A0A5K4FFU0_SCHMA Loading...

ATP-grasp domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FFU0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,492 aa.

						>A0A5K4FFU0_SCHMA|A0A5K4FFU0
MRILFRKKLTPLVTNFQVNVNNSCESYDVKTSDNLENTKSCKVEYTNSTEKDIVSDSQSSSLDDNSPSHLLPIHNNEKNNLIKGKNDENKLNEDLSCLTEPNLYEKENASNHFNNESLINTTKCLNEPKLKRHENYSLETVEKINKIISDKREFIKEVSQTHDSKLFNFPIIKNNENRLLRRIKTERHCNNVQFNIIEKNCQLSTERLKIAKDEVDEAIKSRKIFSILGPYNRIRKALRTRGWIEKFDVNIGPPGQTTQESKKTIRSITNVKTVRNSNSSSNDTTLEDSEDGDSDDDVNAVNEEKQRVQPWEEDNGYYGLLSRMVRSELPRFIWSLRKNQVDFHNLQKDQIINHHSGAPFTTKVGLCKQLRQIRWFADCNADYFFPRCFIISEEEDRQSFINDFRLTACLSIVKMIANLISDVNQLDSFVVRSNPEIVYDMNNVGETNENVNATKNSNVLEIEGSPNIDLSRENSLSFLNNTISYKKVWNINLAPSDLLNSFEIPDEIIEFSIFQCQEFLKTKYHEDLDKSSKHSFSSEYPWDKFLSWYYQIIKMPHLLVTAKHLSSHCQYLCKLLKKYCPQFDMDGVRNVWIVKPGAKSRGRGIVCHDRLDNILKIVQGSVFLTESRYIVQKYIERPLLIYKTKFDIRQWFLITDWAPLTVWWYQDCYLRFCSQEFTLNDFSESIHLCNNCIQHKYKNGPRSSKLPDENMWTWEQFQTWLTEQGQPNLWTEKIQPAMKNAVLNVLLSSQESIEPRKNCFGLYGADFLLTDNDYRIWLIEINSSPCMSPSTSVTAVYTASVLEDTLKVVLDKKYNRNSDVGRFELLYRQPFHNPSTMYTGMELYVIGSKISKPQLENTTVLRCFNKATLDFNGQSLPNPEVKVMSTIGRDKKNMSPIVLRQTKSQTRKEIKPSNTGDEYERTTEIAKGMNGLLPPMKCGKFPTDNQSTMNINIDNPVKHLQSVKETRKSSRSKSCKYENELKICNVSTVLKSVKNIRYLTGLESSVCLSKYNDDISHDDNLLKSSRSESYLKSSLEELDKSRPLINCPGISSVKDSSTSNLNQSKLRLMNKGELNQYTEYETYNNTNLYSSHQSIHGKNKNSQSSSLLLPKIYKNQNSESNIKLVSLNLNRSISSNKIKRLSLKLEQHRNEKLNVDTIHNTTLSNFISTQANSIRYLHEKELSKRQSHFEKIIIDKNKQLINRPNKLPTIGKIKSASSHQSLTHQSTLIVDQLDTNYIRKIPTYKNYIDKIKLNIIQFNEGDSHLKHIHHEKSNHNKLYKHIQKRCIILRRMKKIRKSPAIRRKSLTCQSQSKLSKVLIVNQRLADTTMKDNSLMNLNEVYNCRKLKDSSDKNTNNDKNTDSILNNLNASHYDVAINSSDSITLDSNDPNEISKIITSSPKSSLKQSSTDSGFDDEISTQSKTFLPLDNLSSVTINRNNSYDKAISNGISLCSFINSSKMFVNCRNTDDTKFHRYNINDKFNLKFLSRIAND
					

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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	34	Very low	40.7	Very low	191 Å²	191	148.7 Å²	148.7	94%	0.941	69%	0.693	S	S	*	*				0	-97.3	0	-56.6	-41.7	-113	0	0	112.7	I3 L4 F5	M1-I3 VanDerWaalsContact C-N 3.28Å; M1-I3 PolarHBondContact O-N 2.77Å; M1-L4 WeakPolarHBondContact O-CA 3.38Å; M1-L4 WeakPolarHBondContact O-CB 3.47Å; M1-L4 PolarHBondContact O-N 3.3Å; M1-F5 PolarHBondContact O-N 2.99Å; M1-F5 VanDerWaalsContact O-N 3.07Å
2	R	30.1	Very low	40.5	Very low	230 Å²	230	146.1 Å²	146.1	87%	0.868	69%	0.687	S	S	*	*	H	α-helix	trans	-49.5	-38	-170.5	-77.6	-177.3	173.5	169.8	-2.9	115.9	R6	R2-R6 PolarHBondContact O-N 3.43Å
3	I	41.1	Very low	40.5	Very low	141 Å²	141	143 Å²	143	72%	0.723	68%	0.683	S	S	*	*	H	α-helix	trans	-74.3	-31.7	178.1	-64.2	171.7	0	0	0	113	M1	M1-I3 VanDerWaalsContact C-N 3.28Å; M1-I3 PolarHBondContact O-N 2.77Å
4	L	41.9	Very low	40.5	Very low	128 Å²	128	139.2 Å²	139.2	67%	0.67	67%	0.674	S	S	*	*	H	α-helix	trans	-71.7	-38.7	173.6	-75	163.5	0	0	0	111.2	M1 R6 K7 K8	M1-L4 WeakPolarHBondContact O-CA 3.38Å; M1-L4 WeakPolarHBondContact O-CB 3.47Å; M1-L4 PolarHBondContact O-N 3.3Å; L4-R6 PolarHBondContact O-N 3.15Å; L4-K7 PolarHBondContact O-N 2.87Å; L4-K8 PolarHBondContact O-N 3.1Å
5	F	38.8	Very low	40.3	Very low	155 Å²	155	137.7 Å²	137.7	68%	0.68	67%	0.671	S	S	*	*	H	α-helix	trans	-59.8	-35.6	175.3	-135.8	-95.3	0	0	0	112	M1 K7 L9	M1-F5 PolarHBondContact O-N 2.99Å; M1-F5 VanDerWaalsContact O-N 3.07Å; F5-K7 VanDerWaalsContact C-N 3.3Å; F5-K7 PolarHBondContact O-N 3.22Å; F5-L9 HydrophobicContact CD1-CD1 3.7Å; F5-L9 HydrophobicContact CE1-CD1 3.41Å; F5-L9 VanDerWaalsContact CE1-CD1 3.41Å; F5-L9 HydrophobicContact CZ-CD1 4.04Å
6	R	43	Very low	39.9	Very low	213 Å²	213	139.6 Å²	139.6	80%	0.804	68%	0.675	S	S	*	*	H	α-helix	trans	-75.3	-2.9	174.1	-86.7	-172.1	171.3	-179.6	-3.1	115.5	R2 L4	R2-R6 PolarHBondContact O-N 3.43Å; L4-R6 PolarHBondContact O-N 3.15Å
7	K	43.9	Very low	39.7	Very low	172 Å²	172	140.9 Å²	140.9	75%	0.748	68%	0.68	S	S	*	*	H	α-helix	trans	-118.4	-16.1	-179.6	-77.6	-162.3	171.7	-166.7	0	116.2	L4 F5	L4-K7 PolarHBondContact O-N 2.87Å; F5-K7 VanDerWaalsContact C-N 3.3Å; F5-K7 PolarHBondContact O-N 3.22Å
8	K	45.3	Very low	39.6	Very low	144 Å²	144	138 Å²	138	63%	0.626	67%	0.671	S	S	*	*	H	α-helix	trans	-101.9	-11.2	176.1	-90	-167	174.1	-177	0	115.4	L4 D1357	L4-K8 PolarHBondContact O-N 3.1Å; K8-D1357 IonicContact NZ-OD1 2.67Å; K8-D1357 PolarHBondContact NZ-OD1 3.27Å; K8-D1357 IonicContact NZ-OD2 2.64Å; K8-D1357 PolarHBondContact NZ-OD2 2.98Å
9	L	45.3	Very low	39.3	Very low	78 Å²	78	138.1 Å²	138.1	41%	0.408	68%	0.676	S	S	.	*	S	Bend	trans	-101.4	-16.1	-175.3	-91.1	162.8	0	0	0	115.9	F5 L12	F5-L9 HydrophobicContact CD1-CD1 3.7Å; F5-L9 HydrophobicContact CE1-CD1 3.41Å; F5-L9 VanDerWaalsContact CE1-CD1 3.41Å; F5-L9 HydrophobicContact CZ-CD1 4.04Å; L9-L12 HydrophobicContact CD2-CD1 4.36Å; L9-L12 PolarHBondContact O-N 2.76Å
10	T	43	Very low	39.1	Very low	102 Å²	102	136.8 Å²	136.8	63%	0.626	68%	0.675	S	S	*	*	H	α-helix	trans	-58.2	-36.7	-176.7	-34.2	0	0	0	0	114.5
11	P	41.3	Very low	38.8	Very low	82 Å²	82	136.1 Å²	136.1	53%	0.532	68%	0.675	S	S	.	*	H	α-helix	trans	-79.1	-19.5	178.1	-16.2	32.3	0	0	0	115.2	T14	P11-T14 PolarHBondContact O-OG1 2.88Å
12	L	38.5	Very low	38.6	Very low	117 Å²	117	132.3 Å²	132.3	61%	0.613	66%	0.658	S	S	*	*	H	α-helix	trans	-82.1	-25.6	-173.9	-84.2	162.2	0	0	0	113	L9 T14	L9-L12 HydrophobicContact CD2-CD1 4.36Å; L9-L12 PolarHBondContact O-N 2.76Å; L12-T14 VanDerWaalsContact C-N 3.34Å
13	V	40.9	Very low	38.6	Very low	106 Å²	106	126.6 Å²	126.6	64%	0.642	65%	0.653	S	S	*	*	H	α-helix	trans	-71.3	-31.2	174.8	-178.8	0	0	0	0	111.2
14	T	39.9	Very low	38	Very low	90 Å²	90	125.2 Å²	125.2	55%	0.552	66%	0.655	S	S	*	*	H	α-helix	trans	-72.7	-38	178.4	12.4	0	0	0	0	113.4	P11 L12 Q17	P11-T14 PolarHBondContact O-OG1 2.88Å; L12-T14 VanDerWaalsContact C-N 3.34Å; T14-Q17 PolarHBondContact O-N 3.31Å
15	N	37.5	Very low	37.2	Very low	117 Å²	117	129 Å²	129	63%	0.626	67%	0.669	S	S	*	*	H	α-helix	trans	-75.6	-26.7	-178.6	-79.7	3	0	0	0	113.9	Q17 V18	N15-Q17 PolarHBondContact O-N 3.46Å; N15-Q17 VanDerWaalsContact O-N 3.17Å; N15-V18 PolarHBondContact O-N 2.96Å
16	F	33.1	Very low	36.8	Very low	168 Å²	168	126.3 Å²	126.3	74%	0.737	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-13	177	-149.6	-91.7	0	0	0	113.1
17	Q	37.6	Very low	36.1	Very low	162 Å²	162	126.7 Å²	126.7	76%	0.757	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	5.3	179.1	-155.3	158.5	-11.8	0	0	113.5	T14 N15	T14-Q17 PolarHBondContact O-N 3.31Å; N15-Q17 PolarHBondContact O-N 3.46Å; N15-Q17 VanDerWaalsContact O-N 3.17Å
18	V	37.3	Very low	35.3	Very low	88 Å²	88	125.8 Å²	125.8	53%	0.533	68%	0.676	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107.2	-37.6	178.3	-178.6	0	0	0	0	112.4	N15 V20	N15-V18 PolarHBondContact O-N 2.96Å; V18-V20 PolarHBondContact O-N 2.64Å
19	N	34.3	Very low	34.7	Very low	140 Å²	140	125.1 Å²	125.1	75%	0.749	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	25.5	-169.7	-78.4	1.5	0	0	0	116
20	V	35.1	Very low	33.8	Very low	111 Å²	111	129.3 Å²	129.3	67%	0.673	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.3	21.7	171.6	-161.7	0	0	0	0	111.2	V18	V18-V20 PolarHBondContact O-N 2.64Å
21	N	32	Very low	33.2	Very low	123 Å²	123	130.9 Å²	130.9	66%	0.658	71%	0.708	S	S	*	*	S	Bend	trans	-130.3	22.9	-173.9	-95.9	-22.3	0	0	0	113.6	R187	N21-R187 PolarHBondContact O-NH2 2.95Å
22	N	30	Very low	32.7	Very low	112 Å²	112	131.3 Å²	131.3	60%	0.599	71%	0.714	S	S	*	*	S	Bend	trans	-149.6	58.6	177.9	-78.3	-37.6	0	0	0	112	R187	N22-R187 PolarHBondContact OD1-NH1 3.36Å; N22-R187 PolarHBondContact OD1-NH2 3.41Å
23	S	30.6	Very low	32.2	Very low	109 Å²	109	132.3 Å²	132.3	76%	0.762	72%	0.719	S	S	*	*			trans	173.3	139.7	160.3	37.8	0	0	0	0	110.7
24	C	27.7	Very low	31.6	Very low	113 Å²	113	134.3 Å²	134.3	76%	0.764	73%	0.726	S	S	*	*			cis	-150.6	115.1	-19.3	-91.1	0	0	0	0	107.4
25	E	25.9	Very low	31.2	Very low	207 Å²	207	137 Å²	137	97%	0.967	74%	0.737	S	S	*	*			trans	-136.7	95.7	159.8	-95.5	-175.2	-179.6	0	0	107.8
26	S	30	Very low	30.7	Very low	99 Å²	99	139.6 Å²	139.6	69%	0.692	75%	0.745	S	S	*	*			trans	-140.1	66.8	179.4	62.4	0	0	0	0	109.4
27	Y	29.2	Very low	30.6	Very low	220 Å²	220	137.6 Å²	137.6	86%	0.863	74%	0.742	S	S	*	*			trans	-125.6	68.4	166.7	-88.8	-74.8	0	0	0	110	V29	Y27-V29 PolarHBondContact O-N 2.61Å
28	D	27.7	Very low	30.3	Very low	153 Å²	153	135.2 Å²	135.2	82%	0.818	74%	0.739	S	S	*	*			trans	-67.6	110.5	158.5	-97.9	-35.5	0	0	0	107.9
29	V	31.1	Very low	30	Very low	131 Å²	131	139.6 Å²	139.6	79%	0.794	75%	0.751	S	S	*	*			trans	-110.6	120.3	158.2	-178.7	0	0	0	0	107.3	Y27	Y27-V29 PolarHBondContact O-N 2.61Å
30	K	27.2	Very low	29.9	Very low	165 Å²	165	138.3 Å²	138.3	72%	0.717	75%	0.753	S	S	*	*			trans	-88.3	-176.6	-174.4	-62.6	173.8	-178.7	170.2	0	110.9
31	T	30.7	Very low	29.6	Very low	135 Å²	135	139.1 Å²	139.1	83%	0.828	76%	0.762	S	S	*	*			trans	72.4	145.9	164.4	67.8	0	0	0	0	116.1
32	S	30.4	Very low	29.5	Very low	92 Å²	92	141 Å²	141	64%	0.643	76%	0.764	S	S	*	*			cis	-167.7	146.9	-24.6	45.8	0	0	0	0	109.2
33	D	28.8	Very low	29.7	Very low	137 Å²	137	142.1 Å²	142.1	73%	0.733	78%	0.775	S	S	*	*			trans	30.9	135.3	143.5	-45.5	-32.8	0	0	0	121.9
34	N	28.2	Very low	29.5	Very low	148 Å²	148	142 Å²	142	79%	0.791	76%	0.762	S	S	*	*			trans	88.1	152.5	155	-52.4	-43.2	0	0	0	119.9
35	L	30.7	Very low	29.4	Very low	147 Å²	147	147.8 Å²	147.8	77%	0.77	77%	0.77	S	S	*	*			trans	60.1	112.6	-178.2	-57.1	107.4	0	0	0	114.4
36	E	27.9	Very low	29.6	Very low	171 Å²	171	143.3 Å²	143.3	80%	0.799	76%	0.757	S	S	*	*				67.1	144.1	55.5	-60.6	-161.5	137.9	0	0	115.1
37	N	29.6	Very low	29.5	Very low	127 Å²	127	146.6 Å²	146.6	68%	0.679	77%	0.766	S	S	*	*			trans	77.3	106.9	165.6	-72.2	-55.8	0	0	0	120.3
38	T	31.3	Very low	29.6	Very low	112 Å²	112	141 Å²	141	69%	0.687	76%	0.759	S	S	*	*			trans	78.1	147.5	137.8	68.5	0	0	0	0	119.6
39	K	32.7	Very low	29.8	Very low	179 Å²	179	139.7 Å²	139.7	78%	0.778	76%	0.757	S	S	*	*			cis	-163.2	152.8	-15.2	-114.5	168.1	-176.9	179.4	0	109.6
40	S	31.1	Very low	29.6	Very low	114 Å²	114	141 Å²	141	80%	0.797	75%	0.754	S	S	*	*			trans	59.6	148.4	157.8	47.5	0	0	0	0	119
41	C	29.9	Very low	29.8	Very low	127 Å²	127	140.6 Å²	140.6	86%	0.858	75%	0.753	S	S	*	*			cis	-116.3	153.2	9.8	-65.1	0	0	0	0	113.9
42	K	30	Very low	29.8	Very low	164 Å²	164	139.7 Å²	139.7	71%	0.713	74%	0.743	S	S	*	*			trans	-81.2	178	164.9	-75.7	176.6	157.7	-166.1	0	109.8	E44	K42-E44 WeakPolarHBondContact CD-OE1 3.34Å; K42-E44 WeakPolarHBondContact CE-OE1 3.2Å; K42-E44 IonicContact NZ-OE1 2.64Å; K42-E44 PolarHBondContact NZ-OE1 2.93Å
43	V	32.4	Very low	29.7	Very low	134 Å²	134	142.2 Å²	142.2	81%	0.812	75%	0.747	S	S	*	*				-172.7	147.7	60.4	161.3	0	0	0	0	107.7
44	E	27.2	Very low	29.8	Very low	106 Å²	106	141.7 Å²	141.7	50%	0.495	75%	0.749	S	S	.	*			cis	-163.3	156.9	-33.6	-135.7	161.2	174.6	0	0	109.4	K42	K42-E44 WeakPolarHBondContact CD-OE1 3.34Å; K42-E44 WeakPolarHBondContact CE-OE1 3.2Å; K42-E44 IonicContact NZ-OE1 2.64Å; K42-E44 PolarHBondContact NZ-OE1 2.93Å
45	Y	26.2	Very low	29.9	Very low	236 Å²	236	139 Å²	139	93%	0.925	74%	0.742	S	S	*	*			trans	-146.2	126.2	169.5	-98.1	-83.4	0	0	0	107.1
46	T	30	Very low	29.8	Very low	113 Å²	113	139 Å²	139	69%	0.693	74%	0.743	S	S	*	*			trans	-138.4	121.4	-175.8	48.7	0	0	0	0	112.4
47	N	27.4	Very low	29.8	Very low	168 Å²	168	135.2 Å²	135.2	90%	0.898	74%	0.735	S	S	*	*			trans	-114.5	126	164.4	-80.7	-11.6	0	0	0	108.6
48	S	32	Very low	29.7	Very low	102 Å²	102	137.7 Å²	137.7	71%	0.713	74%	0.742	S	S	*	*			trans	-170	103.8	162	49.7	0	0	0	0	108.1
49	T	30.3	Very low	29.5	Very low	126 Å²	126	136.4 Å²	136.4	77%	0.773	74%	0.738	S	S	*	*				76.1	106.1	69.5	63.4	0	0	0	0	115.3
50	E	27.7	Very low	29.3	Very low	157 Å²	157	132.9 Å²	132.9	73%	0.734	74%	0.736	S	S	*	*			trans	77.3	141.6	136.7	-90.4	-177.1	-143.9	0	0	122.6
51	K	31	Very low	29.1	Very low	157 Å²	157	131.7 Å²	131.7	68%	0.683	73%	0.728	S	S	*	*			trans	74.6	141.4	157.3	-66.7	-175.8	176.7	90	0	117.6
52	D	31	Very low	29.2	Very low	117 Å²	117	132.4 Å²	132.4	63%	0.626	72%	0.722	S	S	*	*			cis	-150.9	144.5	-0.9	-101.5	-29.7	0	0	0	113.1
53	I	28	Very low	29.3	Very low	144 Å²	144	130.6 Å²	130.6	74%	0.738	72%	0.72	S	S	*	*			trans	39.3	146.6	137.2	-35.2	167.4	0	0	0	121.5
54	V	31.6	Very low	29.4	Very low	127 Å²	127	130.4 Å²	130.4	77%	0.77	72%	0.715	S	S	*	*			trans	85.9	130.6	163.4	-167.9	0	0	0	0	115.9
55	S	29.9	Very low	29.7	Very low	91 Å²	91	131.5 Å²	131.5	64%	0.636	72%	0.724	S	S	*	*			cis	-165.7	148.2	-30.9	55.9	0	0	0	0	110.3
56	D	28.3	Very low	30	Very low	147 Å²	147	125 Å²	125	79%	0.786	71%	0.713	S	S	*	*			trans	44.4	101.9	144.7	-62.1	-20.7	0	0	0	122.3
57	S	27.5	Very low	30.4	Very low	91 Å²	91	124.7 Å²	124.7	64%	0.636	71%	0.713	S	S	*	*				92.2	147.4	112.4	83.7	0	0	0	0	120.6
58	Q	28.7	Very low	30.7	Very low	179 Å²	179	121 Å²	121	84%	0.836	70%	0.701	S	S	*	*			trans	65.7	150.1	164.4	-61.3	-178.9	48	0	0	115.6
59	S	27.3	Very low	30.9	Very low	85 Å²	85	123.5 Å²	123.5	59%	0.594	70%	0.701	S	S	*	*			cis	-169	162.6	-21.8	51.1	0	0	0	0	107.3
60	S	27.7	Very low	31.1	Very low	106 Å²	106	124 Å²	124	74%	0.741	70%	0.698	S	S	*	*			trans	62.2	157.6	156	63	0	0	0	0	117.4
61	S	27.9	Very low	31.4	Very low	88 Å²	88	123 Å²	123	62%	0.615	70%	0.697	S	S	*	*			cis	-176.8	170.3	-20.8	47	0	0	0	0	107.7
62	L	32	Very low	31.7	Very low	142 Å²	142	120.7 Å²	120.7	74%	0.743	70%	0.698	S	S	*	*			trans	72.9	148.9	164.9	-40.7	-173.5	0	0	0	115.7
63	D	31.4	Very low	31.7	Very low	127 Å²	127	120.6 Å²	120.6	68%	0.679	70%	0.696	S	S	*	*			cis	-161.7	171.4	-20.7	-106.5	-17.9	0	0	0	112.1
64	D	33.8	Very low	32.1	Very low	129 Å²	129	121.8 Å²	121.8	69%	0.69	70%	0.698	S	S	*	*			trans	89.3	131.2	136.9	-95.3	16.4	0	0	0	125.9
65	N	34.5	Very low	32.1	Very low	130 Å²	130	120.9 Å²	120.9	70%	0.695	69%	0.689	S	S	*	*			trans	81.7	70.6	142.8	-60.3	-34.4	0	0	0	122.3
66	S	32.1	Very low	32.2	Very low	99 Å²	99	122.2 Å²	122.2	69%	0.692	69%	0.689	S	S	*	*				-23	176.7	121.8	77.5	0	0	0	0	117.8
67	P	37.8	Very low	32.4	Very low	106 Å²	106	121.2 Å²	121.2	69%	0.688	68%	0.68	S	S	*	*			cis	-151.8	179.7	24.2	44.3	-23.1	0	0	0	121
68	S	33.6	Very low	32.5	Very low	92 Å²	92	124.2 Å²	124.2	64%	0.643	68%	0.681	S	S	*	*			trans	85.9	153.5	142.1	89.7	0	0	0	0	119.1
69	H	37.1	Very low	32.5	Very low	154 Å²	154	121.8 Å²	121.8	71%	0.713	67%	0.674	S	S	*	*			cis	-151	136.6	11.9	-116.1	-41.7	0	0	0	113.9
70	L	34.8	Very low	32.7	Very low	137 Å²	137	125.1 Å²	125.1	72%	0.717	69%	0.685	S	S	*	*			trans	64.2	144.6	148.1	-45.4	175.7	0	0	0	120.7
71	L	34	Very low	32.7	Very low	135 Å²	135	127.3 Å²	127.3	71%	0.707	69%	0.688	S	S	*	*			cis	-158.3	148.9	-13	-113.5	172.7	0	0	0	111.1	I73	L71-I73 HydrophobicContact CD2-CD1 4.29Å
72	P	36.8	Very low	32.9	Very low	109 Å²	109	131.2 Å²	131.2	71%	0.708	70%	0.7	S	S	*	*			trans	-128.5	-133.9	-179.3	41.2	-23.3	0	0	0	113.8
73	I	31.6	Very low	32.7	Very low	114 Å²	114	134.5 Å²	134.5	59%	0.585	71%	0.708	S	S	*	*			trans	90.1	143	169.3	-51.6	154.2	0	0	0	114	L71	L71-I73 HydrophobicContact CD2-CD1 4.29Å
74	H	36.3	Very low	32.7	Very low	170 Å²	170	132.1 Å²	132.1	79%	0.787	71%	0.714	S	S	*	*			cis	-110.6	160.7	5.3	-83.7	-81.1	0	0	0	112.1
75	N	31.3	Very low	32.4	Very low	108 Å²	108	135.2 Å²	135.2	58%	0.578	72%	0.721	S	S	*	*			cis	73.9	151.5	37.3	-60.5	72	0	0	0	113.4
76	N	30.9	Very low	32.1	Very low	119 Å²	119	135.4 Å²	135.4	64%	0.636	72%	0.722	S	S	*	*			cis	-167.7	173	-12.2	-101.5	7.3	0	0	0	107.2
77	E	32.9	Very low	32.1	Very low	125 Å²	125	138 Å²	138	58%	0.584	73%	0.728	S	S	*	*			cis	-162.5	165.4	0.9	-124	167.7	-73.8	0	0	112.9
78	K	30.1	Very low	31.5	Very low	154 Å²	154	141.8 Å²	141.8	67%	0.67	74%	0.737	S	S	*	*			trans	37.4	133.8	145.8	-73.1	166.6	-171.5	157.4	0	124.6
79	N	28.5	Very low	31.3	Very low	129 Å²	129	145 Å²	145	69%	0.69	75%	0.747	S	S	*	*				48	122.2	128.8	-50.8	-5	0	0	0	121.6
80	N	32.3	Very low	31	Very low	155 Å²	155	146.4 Å²	146.4	83%	0.829	75%	0.751	S	S	*	*				-172.1	167	98.9	-101.7	-42.1	0	0	0	114.6
81	L	26.7	Very low	30.6	Very low	151 Å²	151	147.6 Å²	147.6	79%	0.791	76%	0.757	S	S	*	*			trans	-74.3	150	175.8	-67.6	67.5	0	0	0	111.5
82	I	32.2	Very low	30.3	Very low	170 Å²	170	148 Å²	148	87%	0.872	76%	0.76	S	S	*	*				-174.7	157.2	114.5	-95.4	158.9	0	0	0	111.3
83	K	27.7	Very low	29.8	Very low	212 Å²	212	151.4 Å²	151.4	92%	0.922	77%	0.766	S	S	*	*			trans	-72.6	132.6	-172.1	-58.9	162.5	-177.1	169.1	0	112.5
84	G	31	Very low	29.7	Very low	77 Å²	77	153.5 Å²	153.5	79%	0.794	78%	0.779	S	S	*	*			trans	-148.7	127.4	160.4	0	0	0	0	0	109.3
85	K	28.3	Very low	29.3	Very low	193 Å²	193	153.6 Å²	153.6	84%	0.839	78%	0.784	S	S	*	*			trans	-95.1	138.6	179	-56.9	178.3	178.1	180	0	110.3
86	N	28.6	Very low	29	Very low	134 Å²	134	154 Å²	154	72%	0.717	80%	0.796	S	S	*	*				162.4	167.1	117.4	-84.4	-6.1	0	0	0	111.9
87	D	31.1	Very low	28.8	Very low	154 Å²	154	153.6 Å²	153.6	82%	0.824	80%	0.801	S	S	*	*			trans	67.4	77.2	158.5	-53.4	-23.5	0	0	0	118.2
88	E	26.7	Very low	28.5	Very low	185 Å²	185	155.5 Å²	155.5	86%	0.864	81%	0.814	S	S	*	*			trans	-58.9	139.3	155.1	-53.3	169.5	125.3	0	0	110.9
89	N	28.7	Very low	28.5	Very low	160 Å²	160	153.9 Å²	153.9	86%	0.856	82%	0.817	S	S	*	*			trans	-171.5	155.6	139.2	-112.7	-74.8	0	0	0	113.9
90	K	29.6	Very low	28.6	Very low	184 Å²	184	156.7 Å²	156.7	80%	0.8	83%	0.826	S	S	*	*			trans	61.7	80.5	170.7	-66.7	-160.7	168.3	-155.4	0	118.4
91	L	26.4	Very low	28.7	Very low	161 Å²	161	154.5 Å²	154.5	84%	0.843	82%	0.821	S	S	*	*			trans	-100.9	167.8	139.5	-114.4	152.6	0	0	0	108.9
92	N	28	Very low	28.8	Very low	145 Å²	145	155 Å²	155	78%	0.775	82%	0.824	S	S	*	*			trans	72.5	96.3	171.2	-51.8	-12.8	0	0	0	117.7
93	E	27.9	Very low	28.5	Very low	179 Å²	179	154.7 Å²	154.7	84%	0.836	82%	0.823	S	S	*	*			trans	-112.5	175.3	139.3	-69.6	-177.9	160.2	0	0	107.6
94	D	28	Very low	28.5	Very low	159 Å²	159	155.5 Å²	155.5	85%	0.85	82%	0.822	S	S	*	*			trans	63.7	63.3	-178.6	-65.2	-16	0	0	0	118.3
95	L	28.3	Very low	28.3	Very low	171 Å²	171	161.1 Å²	161.1	90%	0.895	83%	0.828	S	S	*	*			trans	-154.8	105.4	154.4	-110.3	163.3	0	0	0	110.9
96	S	25.8	Very low	28.2	Very low	118 Å²	118	161.9 Å²	161.9	83%	0.825	83%	0.831	S	S	*	*			trans	-144.7	49.4	-171.6	55	0	0	0	0	114.7
97	C	25.4	Very low	28.1	Very low	110 Å²	110	164.4 Å²	164.4	74%	0.743	84%	0.838	S	S	*	*			trans	-145	148.2	163.1	-87.5	0	0	0	0	109.3
98	L	27.4	Very low	27.9	Very low	164 Å²	164	164.9 Å²	164.9	86%	0.859	84%	0.841	S	S	*	*			trans	68.7	144.4	-167.8	-44.7	175.2	0	0	0	112.2
99	T	30.2	Very low	28	Very low	121 Å²	121	161 Å²	161	74%	0.742	84%	0.841	S	S	*	*			cis	-162.1	156.1	-7.8	9	0	0	0	0	109.3
100	E	30.2	Very low	27.9	Very low	188 Å²	188	158.7 Å²	158.7	88%	0.879	84%	0.837	S	S	*	*			trans	-120	150.4	142.3	-84.5	-156.9	154.7	0	0	109.7
101	P	33.8	Very low	27.9	Very low	109 Å²	109	156.8 Å²	156.8	71%	0.708	84%	0.836	S	S	*	*			trans	-102.1	147.5	-144.7	-3.6	25	0	0	0	115.3	L103	P101-L103 PolarHBondContact O-N 2.67Å; P101-L103 VanDerWaalsContact O-N 3.15Å
102	N	30.6	Very low	28.1	Very low	162 Å²	162	158.2 Å²	158.2	87%	0.866	84%	0.838	S	S	*	*			trans	-70.8	102.1	157.9	-75.1	-61	0	0	0	109.8	Y104	N102-Y104 VanDerWaalsContact C-N 3.29Å; N102-Y104 PolarHBondContact O-N 2.91Å
103	L	26	Very low	28.1	Very low	163 Å²	163	159 Å²	159	85%	0.853	83%	0.834	S	S	*	*			trans	-71.1	82.2	161.1	-78.9	168.4	0	0	0	109.9	P101	P101-L103 PolarHBondContact O-N 2.67Å; P101-L103 VanDerWaalsContact O-N 3.15Å
104	Y	26.3	Very low	28.3	Very low	228 Å²	228	157.9 Å²	157.9	89%	0.894	83%	0.834	S	S	*	*			trans	-176.8	72.7	156.7	-105	-63.7	0	0	0	112.7	N102	N102-Y104 VanDerWaalsContact C-N 3.29Å; N102-Y104 PolarHBondContact O-N 2.91Å
105	E	27.4	Very low	28.2	Very low	196 Å²	196	156.3 Å²	156.3	92%	0.916	83%	0.826	S	S	*	*			trans	-162.5	75.8	159.8	-120.4	160.6	-133.1	0	0	112.8
106	K	25.9	Very low	28.2	Very low	208 Å²	208	156.2 Å²	156.2	90%	0.904	82%	0.821	S	S	*	*			trans	-151.6	75	164.6	-90.9	-158.2	176.1	-176.7	0	111.5
107	E	26.6	Very low	28.5	Very low	187 Å²	187	156.4 Å²	156.4	87%	0.874	82%	0.822	S	S	*	*	S	Bend	trans	-165.7	152.1	155.9	-110.5	158.8	-152.2	0	0	108.4
108	N	27.2	Very low	28.5	Very low	164 Å²	164	158.1 Å²	158.1	88%	0.877	82%	0.823	S	S	*	*	S	Bend	trans	78.2	51.3	-173.9	-54.5	-32.7	0	0	0	118.1
109	A	27.5	Very low	28.4	Very low	104 Å²	104	156.6 Å²	156.6	86%	0.86	82%	0.815	S	S	*	*			trans	-143.3	38.7	166.2	0	0	0	0	0	113.9
110	S	26.8	Very low	28.4	Very low	111 Å²	111	157.6 Å²	157.6	78%	0.776	82%	0.815	S	S	*	*			trans	-156.2	93.9	177	58.5	0	0	0	0	112.2
111	N	29.5	Very low	28.4	Very low	144 Å²	144	154.9 Å²	154.9	77%	0.77	81%	0.812	S	S	*	*			trans	-156.7	70.6	164.3	-129.2	-8.3	0	0	0	112.4
112	H	32.2	Very low	28.1	Very low	192 Å²	192	155.8 Å²	155.8	89%	0.889	82%	0.815	S	S	*	*			trans	-150	124.5	150.9	-111	-75.9	0	0	0	108.8
113	F	27.4	Very low	28	Very low	161 Å²	161	157.8 Å²	157.8	71%	0.706	82%	0.816	S	S	*	*			trans	-77	144.7	179	-81.3	-115.9	0	0	0	111.1
114	N	31	Very low	28.3	Very low	156 Å²	156	155.8 Å²	155.8	83%	0.834	82%	0.815	S	S	*	*				-167.9	172.2	106.8	-92.8	-14.8	0	0	0	111.6
115	N	26.8	Very low	28.3	Very low	125 Å²	125	152.4 Å²	152.4	67%	0.668	81%	0.811	S	S	*	*			trans	-88.5	175.8	-160.3	-65.8	-10.2	0	0	0	115.3
116	E	27.8	Very low	28.2	Very low	169 Å²	169	149.4 Å²	149.4	79%	0.79	80%	0.801	S	S	*	*			trans	68.3	96.1	149	-75.8	150	-124.4	0	0	119.3
117	S	31.6	Very low	28.4	Very low	123 Å²	123	147.3 Å²	147.3	86%	0.86	80%	0.795	S	S	*	*				-150.8	151.6	107.4	66.2	0	0	0	0	110.6
118	L	25.3	Very low	28.7	Very low	145 Å²	145	142.7 Å²	142.7	76%	0.759	78%	0.781	S	S	*	*			trans	-112	159.6	-167.9	-114.8	75.3	0	0	0	112.8
119	I	26.4	Very low	29	Very low	133 Å²	133	145.1 Å²	145.1	68%	0.682	78%	0.784	S	S	*	*			trans	76.8	153.3	150.9	-74.2	164.3	0	0	0	117.5
120	N	29.8	Very low	28.9	Very low	142 Å²	142	146.9 Å²	146.9	76%	0.759	78%	0.778	S	S	*	*			trans	74.2	119.8	178.5	-64.4	-27.2	0	0	0	116.4
121	T	30.9	Very low	28.9	Very low	130 Å²	130	150.3 Å²	150.3	80%	0.798	78%	0.779	S	S	*	*			cis	-151.8	138.6	-2.2	-40.2	0	0	0	0	111.5
122	T	26.9	Very low	28.9	Very low	128 Å²	128	154 Å²	154	79%	0.785	78%	0.782	S	S	*	*			trans	-101.6	129.5	174.1	39.6	0	0	0	0	112.8
123	K	28.7	Very low	28.9	Very low	204 Å²	204	151.6 Å²	151.6	89%	0.887	77%	0.771	S	S	*	*			trans	173.3	143.8	155.7	-98.3	150.2	-171.1	175.3	0	108.5
124	C	31.3	Very low	29	Very low	122 Å²	122	151.3 Å²	151.3	82%	0.824	77%	0.772	S	S	*	*			cis	-122.3	164	4.2	-76.2	0	0	0	0	112.7
125	L	26.7	Very low	29	Very low	157 Å²	157	152.1 Å²	152.1	82%	0.822	78%	0.776	S	S	*	*			trans	-107.5	169.8	173	-81.5	159.2	0	0	0	110.4
126	N	26.9	Very low	29.3	Very low	132 Å²	132	155.8 Å²	155.8	71%	0.706	78%	0.782	S	S	*	*			trans	72.5	146.3	158.1	-64.4	2.4	0	0	0	116.6
127	E	29.8	Very low	30	Very low	165 Å²	165	150.8 Å²	150.8	77%	0.771	77%	0.766	S	S	*	*			cis	-154.7	-167.8	-0.6	-125.5	-168.2	-139.9	0	0	112.2
128	P	32	Very low	30.5	Very low	89 Å²	89	151.5 Å²	151.5	58%	0.578	76%	0.759	S	S	*	*			trans	-115.1	169.3	-135.4	43.5	-30.2	0	0	0	116
129	K	33.3	Very low	31.6	Very low	216 Å²	216	149.9 Å²	149.9	94%	0.939	75%	0.748	S	S	*	*			trans	-130.7	137.9	150.3	-74.1	-171.2	177.7	173.7	0	110.7
130	L	26.4	Very low	32.7	Very low	141 Å²	141	146 Å²	146	74%	0.738	73%	0.73	S	S	*	*			trans	-141	142	-157.1	-146.9	168.7	0	0	0	109.2
131	K	26.5	Very low	33.9	Very low	183 Å²	183	142.7 Å²	142.7	80%	0.796	72%	0.715	S	S	*	*			trans	125.5	148.5	147.8	-67.9	178.2	179.1	179.6	0	117.2
132	R	28.9	Very low	35.5	Very low	220 Å²	220	142.2 Å²	142.2	83%	0.83	70%	0.704	S	S	*	*			trans	80.4	124.4	170.9	-52.1	-169.9	167.2	145.5	-2	116.3
133	H	32.3	Very low	37.4	Very low	143 Å²	143	141.6 Å²	141.6	66%	0.662	69%	0.69	S	S	*	*			cis	-150.8	129.4	-26.3	-89.6	-60.1	0	0	0	104.8
134	E	30.3	Very low	39.2	Very low	155 Å²	155	136.3 Å²	136.3	72%	0.724	67%	0.671	S	S	*	*				64.3	103.3	64.4	-68.3	179.8	143.8	0	0	114.8
135	N	29.7	Very low	40.7	Very low	172 Å²	172	135.1 Å²	135.1	92%	0.92	66%	0.656	S	S	*	*			trans	-160.8	46.2	146.2	-110.4	-29.6	0	0	0	112.2
136	Y	33.7	Very low	42.8	Very low	202 Å²	202	133.8 Å²	133.8	79%	0.792	64%	0.644	S	S	*	*			trans	-84.5	129.9	160.3	-83.8	-81.4	0	0	0	108.7
137	S	42.9	Very low	44.7	Very low	64 Å²	64	132.8 Å²	132.8	45%	0.448	64%	0.637	S	S	.	*			trans	-60.6	141.6	-177.6	41	0	0	0	0	112.8	E139 T140	S137-E139 PolarHBondContact O-N 2.63Å; S137-T140 WeakPolarHBondContact O-CB 3.36Å; S137-T140 PolarHBondContact O-N 3.14Å; S137-T140 PolarHBondContact OG-OG1 3.31Å
138	L	41.6	Very low	46.5	Very low	139 Å²	139	128.3 Å²	128.3	73%	0.728	62%	0.618	S	S	*	*	H	α-helix	trans	-47.7	-44.6	174.3	-84.9	157.3	0	0	0	112.3	T140 V141 E142	L138-T140 PolarHBondContact O-N 3.37Å; L138-V141 PolarHBondContact O-N 3.01Å; L138-E142 WeakPolarHBondContact O-CG 3.34Å; L138-E142 PolarHBondContact O-N 2.87Å
139	E	48	Very low	48.1	Very low	110 Å²	110	127 Å²	127	51%	0.514	61%	0.611	S	S	.	*	H	α-helix	trans	-49.5	-35.2	174.4	-80.4	-160.4	91	0	0	114.3	S137 K143	S137-E139 PolarHBondContact O-N 2.63Å; E139-K143 VanDerWaalsContact O-CB 3.26Å; E139-K143 WeakPolarHBondContact O-CB 3.23Å; E139-K143 VanDerWaalsContact O-CD 3.26Å; E139-K143 WeakPolarHBondContact O-CD 3.49Å; E139-K143 WeakPolarHBondContact O-CG 3.34Å; E139-K143 PolarHBondContact O-N 2.73Å; E139-K143 WeakPolarHBondContact OE1-CE 3.44Å; E139-K143 IonicContact OE1-NZ 3.53Å; E139-K143 PolarHBondContact OE1-NZ 3.18Å; E139-K143 IonicContact OE2-NZ 2.79Å
140	T	49.4	Very low	49.7	Very low	52 Å²	52	120.4 Å²	120.4	32%	0.319	59%	0.586	S	S	.	*	H	α-helix	trans	-75.4	-41.2	-177.4	-51.3	0	0	0	0	110.6	S137 L138 K143 I144	S137-T140 WeakPolarHBondContact O-CB 3.36Å; S137-T140 PolarHBondContact O-N 3.14Å; S137-T140 PolarHBondContact OG-OG1 3.31Å; L138-T140 PolarHBondContact O-N 3.37Å; T140-K143 PolarHBondContact O-N 3.25Å; T140-I144 HydrophobicContact CG2-CD1 4.19Å; T140-I144 VanDerWaalsContact O-CG1 3.3Å; T140-I144 WeakPolarHBondContact O-CG1 3.44Å; T140-I144 PolarHBondContact O-N 3.45Å
141	V	56.8	Low	51.6	Low	72 Å²	72	120.6 Å²	120.6	44%	0.436	58%	0.581	S	S	.	*	H	α-helix	trans	-68.4	-41.3	175.5	-179.8	0	0	0	0	110.2	L138 I144 N145	L138-V141 PolarHBondContact O-N 3.01Å; V141-I144 PolarHBondContact O-N 3.48Å; V141-N145 VanDerWaalsContact O-CB 3.27Å; V141-N145 WeakPolarHBondContact O-CB 3.46Å; V141-N145 VanDerWaalsContact O-CG 3.27Å; V141-N145 PolarHBondContact O-N 3.3Å; V141-N145 PolarHBondContact O-ND2 3.48Å
142	E	64.4	Low	53.2	Low	121 Å²	121	120.3 Å²	120.3	57%	0.565	58%	0.575	S	S	*	*	H	α-helix	trans	-62.5	-44.5	173.8	-72.1	176.8	160.1	0	0	112.3	L138 N145 K146	L138-E142 WeakPolarHBondContact O-CG 3.34Å; L138-E142 PolarHBondContact O-N 2.87Å; E142-N145 PolarHBondContact O-N 3.16Å; E142-K146 VanDerWaalsContact O-CB 3.25Å; E142-K146 WeakPolarHBondContact O-CB 3.46Å; E142-K146 PolarHBondContact O-N 2.98Å
143	K	66.6	Low	54.5	Low	114 Å²	114	115.5 Å²	115.5	50%	0.496	56%	0.562	S	S	.	*	H	α-helix	trans	-64	-41.4	176.8	-75.6	162.6	-166.8	164.6	0	112.1	E139 T140 I147	E139-K143 VanDerWaalsContact O-CB 3.26Å; E139-K143 WeakPolarHBondContact O-CB 3.23Å; E139-K143 VanDerWaalsContact O-CD 3.26Å; E139-K143 WeakPolarHBondContact O-CD 3.49Å; E139-K143 WeakPolarHBondContact O-CG 3.34Å; E139-K143 PolarHBondContact O-N 2.73Å; E139-K143 WeakPolarHBondContact OE1-CE 3.44Å; E139-K143 IonicContact OE1-NZ 3.53Å; E139-K143 PolarHBondContact OE1-NZ 3.18Å; E139-K143 IonicContact OE2-NZ 2.79Å; T140-K143 PolarHBondContact O-N 3.25Å; K143-I147 WeakPolarHBondContact O-CD1 3.47Å; K143-I147 VanDerWaalsContact O-CG1 3.25Å; K143-I147 WeakPolarHBondContact O-CG1 3.4Å; K143-I147 PolarHBondContact O-N 2.92Å
144	I	64.7	Low	55.2	Low	93 Å²	93	115 Å²	115	48%	0.477	56%	0.558	S	S	.	*	H	α-helix	trans	-67.2	-46.6	176.3	-69.6	167.7	0	0	0	110.9	T140 V141 K146 I147 I148	T140-I144 HydrophobicContact CG2-CD1 4.19Å; T140-I144 VanDerWaalsContact O-CG1 3.3Å; T140-I144 WeakPolarHBondContact O-CG1 3.44Å; T140-I144 PolarHBondContact O-N 3.45Å; V141-I144 PolarHBondContact O-N 3.48Å; I144-K146 VanDerWaalsContact C-N 3.31Å; I144-K146 PolarHBondContact O-N 3.08Å; I144-I147 PolarHBondContact O-N 3.36Å; I144-I148 HydrophobicContact CG2-CD1 3.8Å; I144-I148 WeakPolarHBondContact O-CG1 3.31Å; I144-I148 PolarHBondContact O-N 3.18Å
145	N	63.2	Low	56.2	Low	97 Å²	97	112.2 Å²	112.2	52%	0.519	55%	0.547	S	S	.	.	H	α-helix	trans	-63.4	-37.1	177.7	-75.9	-19.4	0	0	0	112	V141 E142 I148 S149	V141-N145 VanDerWaalsContact O-CB 3.27Å; V141-N145 WeakPolarHBondContact O-CB 3.46Å; V141-N145 VanDerWaalsContact O-CG 3.27Å; V141-N145 PolarHBondContact O-N 3.3Å; V141-N145 PolarHBondContact O-ND2 3.48Å; E142-N145 PolarHBondContact O-N 3.16Å; N145-I148 PolarHBondContact O-N 3.15Å; N145-S149 WeakPolarHBondContact O-CB 3.28Å; N145-S149 PolarHBondContact O-N 3.21Å
146	K	71.6	Confident	57.2	Low	130 Å²	130	111 Å²	111	57%	0.565	53%	0.533	S	S	*	.	H	α-helix	trans	-63.7	-50	172.9	-177.5	166.7	-178.7	171.7	0	111.5	E142 I144 I148 S149 D150	E142-K146 VanDerWaalsContact O-CB 3.25Å; E142-K146 WeakPolarHBondContact O-CB 3.46Å; E142-K146 PolarHBondContact O-N 2.98Å; I144-K146 VanDerWaalsContact C-N 3.31Å; I144-K146 PolarHBondContact O-N 3.08Å; K146-I148 PolarHBondContact O-N 3.23Å; K146-S149 CarbonylContact O-C 3.54Å; K146-S149 WeakPolarHBondContact O-CA 3.3Å; K146-S149 WeakPolarHBondContact O-CB 3.38Å; K146-S149 PolarHBondContact O-N 2.86Å; K146-D150 WeakPolarHBondContact CE-OD1 3.43Å; K146-D150 VanDerWaalsContact CE-OD2 3.31Å; K146-D150 WeakPolarHBondContact CE-OD2 3.35Å; K146-D150 WeakPolarHBondContact CG-OD1 3.48Å; K146-D150 WeakPolarHBondContact CG-OD2 3.25Å; K146-D150 WeakPolarHBondContact O-CB 3.48Å; K146-D150 PolarHBondContact O-N 3Å
147	I	65.9	Low	57.6	Low	111 Å²	111	107.8 Å²	107.8	57%	0.569	53%	0.526	S	S	*	.	H	α-helix	trans	-57.5	-36.7	176.4	-69.6	163.8	0	0	0	111.6	K143 I144 K151	K143-I147 WeakPolarHBondContact O-CD1 3.47Å; K143-I147 VanDerWaalsContact O-CG1 3.25Å; K143-I147 WeakPolarHBondContact O-CG1 3.4Å; K143-I147 PolarHBondContact O-N 2.92Å; I144-I147 PolarHBondContact O-N 3.36Å; I147-K151 WeakPolarHBondContact O-CB 2.9Å; I147-K151 PolarHBondContact O-N 2.93Å; I147-K151 VanDerWaalsContact O-N 3.11Å
148	I	67.7	Low	57.5	Low	70 Å²	70	109 Å²	109	36%	0.359	53%	0.53	S	S	.	.	H	α-helix	trans	-71.8	-35.3	175.1	-68.1	168.5	0	0	0	111.7	I144 N145 K146 R152	I144-I148 HydrophobicContact CG2-CD1 3.8Å; I144-I148 WeakPolarHBondContact O-CG1 3.31Å; I144-I148 PolarHBondContact O-N 3.18Å; N145-I148 PolarHBondContact O-N 3.15Å; K146-I148 PolarHBondContact O-N 3.23Å; I148-R152 WeakPolarHBondContact O-CB 3.32Å; I148-R152 WeakPolarHBondContact O-CD 3.38Å; I148-R152 WeakPolarHBondContact O-CG 3.49Å; I148-R152 PolarHBondContact O-N 2.98Å; I148-R152 VanDerWaalsContact O-N 3.1Å
149	S	65.5	Low	57.4	Low	62 Å²	62	106.5 Å²	106.5	43%	0.434	52%	0.524	S	S	.	.	H	α-helix	trans	-67.7	-57.8	174.6	-162.9	0	0	0	0	110.9	N145 K146 K151 R152 E153	N145-S149 WeakPolarHBondContact O-CB 3.28Å; N145-S149 PolarHBondContact O-N 3.21Å; K146-S149 CarbonylContact O-C 3.54Å; K146-S149 WeakPolarHBondContact O-CA 3.3Å; K146-S149 WeakPolarHBondContact O-CB 3.38Å; K146-S149 PolarHBondContact O-N 2.86Å; S149-K151 PolarHBondContact O-N 3.26Å; S149-R152 CarbonylContact O-C 3.4Å; S149-R152 WeakPolarHBondContact O-CA 3.45Å; S149-R152 WeakPolarHBondContact O-CB 3.14Å; S149-R152 PolarHBondContact O-N 3.18Å; S149-E153 WeakPolarHBondContact O-CB 3.46Å; S149-E153 PolarHBondContact O-N 3.17Å
150	D	68.4	Low	56.8	Low	77 Å²	77	108.8 Å²	108.8	41%	0.412	54%	0.535	S	S	.	.	H	α-helix	trans	-52.1	-42.2	179	-59.5	-1.8	0	0	0	110.7	K146 E153 F154	K146-D150 WeakPolarHBondContact CE-OD1 3.43Å; K146-D150 VanDerWaalsContact CE-OD2 3.31Å; K146-D150 WeakPolarHBondContact CE-OD2 3.35Å; K146-D150 WeakPolarHBondContact CG-OD1 3.48Å; K146-D150 WeakPolarHBondContact CG-OD2 3.25Å; K146-D150 WeakPolarHBondContact O-CB 3.48Å; K146-D150 PolarHBondContact O-N 3Å; D150-E153 PolarHBondContact O-N 2.7Å; D150-F154 WeakPolarHBondContact O-CB 3.44Å; D150-F154 PolarHBondContact O-N 2.88Å
151	K	64.5	Low	56.1	Low	145 Å²	145	112.4 Å²	112.4	63%	0.63	56%	0.557	S	S	*	*	H	α-helix	trans	-72.5	-29.1	177.2	-165.6	172.2	-174.8	179	0	113.7	I147 S149 I155	I147-K151 WeakPolarHBondContact O-CB 2.9Å; I147-K151 PolarHBondContact O-N 2.93Å; I147-K151 VanDerWaalsContact O-N 3.11Å; S149-K151 PolarHBondContact O-N 3.26Å; K151-I155 HydrophobicContact CG-CD1 4.41Å; K151-I155 WeakPolarHBondContact O-CB 3.5Å; K151-I155 VanDerWaalsContact O-CD1 3.32Å; K151-I155 WeakPolarHBondContact O-CD1 3.5Å; K151-I155 WeakPolarHBondContact O-CG1 3.09Å; K151-I155 PolarHBondContact O-N 3.07Å
152	R	61.5	Low	54.9	Low	178 Å²	178	118 Å²	118	67%	0.672	58%	0.578	S	S	*	*	H	α-helix	trans	-78.6	-31.1	173.4	-79.3	172.6	172	179.3	-2.1	112.5	I148 S149 K156	I148-R152 WeakPolarHBondContact O-CB 3.32Å; I148-R152 WeakPolarHBondContact O-CD 3.38Å; I148-R152 WeakPolarHBondContact O-CG 3.49Å; I148-R152 PolarHBondContact O-N 2.98Å; I148-R152 VanDerWaalsContact O-N 3.1Å; S149-R152 CarbonylContact O-C 3.4Å; S149-R152 WeakPolarHBondContact O-CA 3.45Å; S149-R152 WeakPolarHBondContact O-CB 3.14Å; S149-R152 PolarHBondContact O-N 3.18Å; R152-K156 WeakPolarHBondContact O-CG 3.4Å; R152-K156 PolarHBondContact O-N 2.85Å
153	E	55	Low	53.4	Low	119 Å²	119	119.6 Å²	119.6	56%	0.556	59%	0.59	S	S	*	*	H	α-helix	trans	-74	-46.9	177.9	-163.1	147.9	-131.8	0	0	110.3	S149 D150 I155 K156 E157	S149-E153 WeakPolarHBondContact O-CB 3.46Å; S149-E153 PolarHBondContact O-N 3.17Å; D150-E153 PolarHBondContact O-N 2.7Å; E153-I155 VanDerWaalsContact C-N 3.32Å; E153-I155 PolarHBondContact O-N 2.79Å; E153-K156 WeakPolarHBondContact O-CA 3.44Å; E153-K156 WeakPolarHBondContact O-CB 3.5Å; E153-K156 PolarHBondContact O-N 3.27Å; E153-E157 PolarHBondContact O-N 2.96Å
154	F	48.8	Very low	51.6	Low	131 Å²	131	118 Å²	118	58%	0.575	59%	0.594	S	S	*	*	H	α-helix	trans	-57.4	-40.9	171.4	-174.5	-103.1	0	0	0	112.9	D150 K156 E157 V158	D150-F154 WeakPolarHBondContact O-CB 3.44Å; D150-F154 PolarHBondContact O-N 2.88Å; F154-K156 VanDerWaalsContact C-N 3.27Å; F154-K156 PolarHBondContact O-N 2.84Å; F154-E157 PolarHBondContact O-N 2.99Å; F154-V158 HydrophobicContact CD1-CG2 4.25Å; F154-V158 HydrophobicContact CD2-CG2 4.46Å; F154-V158 HydrophobicContact CE1-CG2 3.9Å; F154-V158 HydrophobicContact CE2-CG2 4.13Å; F154-V158 HydrophobicContact CZ-CG2 3.85Å; F154-V158 WeakPolarHBondContact O-CB 3.31Å; F154-V158 VanDerWaalsContact O-CG2 3.3Å; F154-V158 WeakPolarHBondContact O-CG2 3.17Å; F154-V158 PolarHBondContact O-N 3.32Å
155	I	51.2	Low	50.1	Low	98 Å²	98	123.3 Å²	123.3	50%	0.503	61%	0.614	S	S	.	*	H	α-helix	trans	-66.1	-29.1	175.1	-72.6	170.3	0	0	0	111.8	K151 E153 S159	K151-I155 HydrophobicContact CG-CD1 4.41Å; K151-I155 WeakPolarHBondContact O-CB 3.5Å; K151-I155 VanDerWaalsContact O-CD1 3.32Å; K151-I155 WeakPolarHBondContact O-CD1 3.5Å; K151-I155 WeakPolarHBondContact O-CG1 3.09Å; K151-I155 PolarHBondContact O-N 3.07Å; E153-I155 VanDerWaalsContact C-N 3.32Å; E153-I155 PolarHBondContact O-N 2.79Å; I155-S159 VanDerWaalsContact O-CB 3.31Å; I155-S159 WeakPolarHBondContact O-CB 3.22Å; I155-S159 PolarHBondContact O-N 2.86Å; I155-S159 PolarHBondContact O-OG 3.25Å
156	K	48.9	Very low	48.5	Very low	146 Å²	146	127.1 Å²	127.1	64%	0.635	63%	0.633	S	S	*	*	H	α-helix	trans	-73.3	-46.5	172.4	-78.2	179.5	173.8	-175	0	112.2	R152 E153 F154 V158 S159 Q160	R152-K156 WeakPolarHBondContact O-CG 3.4Å; R152-K156 PolarHBondContact O-N 2.85Å; E153-K156 WeakPolarHBondContact O-CA 3.44Å; E153-K156 WeakPolarHBondContact O-CB 3.5Å; E153-K156 PolarHBondContact O-N 3.27Å; F154-K156 VanDerWaalsContact C-N 3.27Å; F154-K156 PolarHBondContact O-N 2.84Å; K156-V158 PolarHBondContact O-N 3.44Å; K156-S159 PolarHBondContact O-N 3.33Å; K156-Q160 WeakPolarHBondContact O-CG 3.37Å; K156-Q160 PolarHBondContact O-N 3.46Å
157	E	42.6	Very low	46.3	Very low	134 Å²	134	129.6 Å²	129.6	63%	0.626	64%	0.644	S	S	*	*	H	α-helix	trans	-59.5	-45.7	178	-69.8	-171.1	122	0	0	111.8	E153 F154 S159 Q160	E153-E157 PolarHBondContact O-N 2.96Å; F154-E157 PolarHBondContact O-N 2.99Å; E157-S159 PolarHBondContact O-N 2.88Å; E157-Q160 PolarHBondContact O-N 2.94Å
158	V	40.7	Very low	44.8	Very low	91 Å²	91	132 Å²	132	55%	0.552	66%	0.658	S	S	*	*	H	α-helix	trans	-65.7	-19.1	176.8	174.9	0	0	0	0	112.5	F154 K156	F154-V158 HydrophobicContact CD1-CG2 4.25Å; F154-V158 HydrophobicContact CD2-CG2 4.46Å; F154-V158 HydrophobicContact CE1-CG2 3.9Å; F154-V158 HydrophobicContact CE2-CG2 4.13Å; F154-V158 HydrophobicContact CZ-CG2 3.85Å; F154-V158 WeakPolarHBondContact O-CB 3.31Å; F154-V158 VanDerWaalsContact O-CG2 3.3Å; F154-V158 WeakPolarHBondContact O-CG2 3.17Å; F154-V158 PolarHBondContact O-N 3.32Å; K156-V158 PolarHBondContact O-N 3.44Å
159	S	39	Very low	42.8	Very low	85 Å²	85	137.1 Å²	137.1	59%	0.594	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96	5.3	178.5	-56.7	0	0	0	0	114.5	I155 K156 E157	I155-S159 VanDerWaalsContact O-CB 3.31Å; I155-S159 WeakPolarHBondContact O-CB 3.22Å; I155-S159 PolarHBondContact O-N 2.86Å; I155-S159 PolarHBondContact O-OG 3.25Å; K156-S159 PolarHBondContact O-N 3.33Å; E157-S159 PolarHBondContact O-N 2.88Å
160	Q	36.8	Very low	41.1	Very low	159 Å²	159	139 Å²	139	74%	0.743	69%	0.689	S	S	*	*	S	Bend	trans	-121	12.4	-173.4	-74.5	-170.2	-22	0	0	115.6	K156 E157	K156-Q160 WeakPolarHBondContact O-CG 3.37Å; K156-Q160 PolarHBondContact O-N 3.46Å; E157-Q160 PolarHBondContact O-N 2.94Å
161	T	34.2	Very low	39.1	Very low	127 Å²	127	142.7 Å²	142.7	78%	0.779	71%	0.707	S	S	*	*			trans	-108.5	54.7	175.7	41	0	0	0	0	113.4
162	H	32.5	Very low	37.5	Very low	191 Å²	191	143.7 Å²	143.7	88%	0.884	72%	0.717	S	S	*	*			trans	-82.4	116.1	157.8	-92.6	-70.8	0	0	0	110
163	D	32.3	Very low	35.9	Very low	153 Å²	153	143.7 Å²	143.7	82%	0.818	72%	0.722	S	S	*	*			trans	-146.7	174.6	140	-152.2	-10.4	0	0	0	110.2
164	S	29.2	Very low	34.7	Very low	82 Å²	82	145 Å²	145	57%	0.573	73%	0.733	S	S	*	*			trans	-129.2	131.2	-133.7	55.5	0	0	0	0	113.7
165	K	32.4	Very low	34	Very low	204 Å²	204	143.9 Å²	143.9	89%	0.887	73%	0.733	S	S	*	*			trans	-171.2	158.2	150.1	-98.5	132.6	-158.2	159.1	0	110.4
166	L	30.5	Very low	33.2	Very low	176 Å²	176	147.1 Å²	147.1	92%	0.921	75%	0.746	S	S	*	*			trans	69.6	58.1	177.1	-60.4	167.7	0	0	0	116.5
167	F	25.8	Very low	32.7	Very low	183 Å²	183	146.1 Å²	146.1	80%	0.803	75%	0.748	S	S	*	*			trans	-73.9	129.8	142.3	-102.8	-100.1	0	0	0	109.3	F169	F167-F169 HydrophobicContact CE1-CE2 4.5Å
168	N	32.8	Very low	32.3	Very low	161 Å²	161	148.6 Å²	148.6	86%	0.861	75%	0.751	S	S	*	*				-174.7	143.9	127.9	-96.6	-20.9	0	0	0	113.1
169	F	25.7	Very low	32	Very low	177 Å²	177	150.3 Å²	150.3	78%	0.776	76%	0.756	S	S	*	*			trans	-81.3	-174.1	172.5	-76.3	-96.3	0	0	0	110.7	F167	F167-F169 HydrophobicContact CE1-CE2 4.5Å
170	P	31.4	Very low	31.9	Very low	102 Å²	102	152.1 Å²	152.1	66%	0.662	76%	0.759	S	S	*	*			cis	-134	174.4	-1.3	14.8	12.8	0	0	0	116.9
171	I	26	Very low	31.9	Very low	154 Å²	154	153.4 Å²	153.4	79%	0.79	76%	0.757	S	S	*	*			trans	37.2	120.1	139.6	-52.6	159.9	0	0	0	119.3
172	I	30.9	Very low	31.8	Very low	166 Å²	166	157.3 Å²	157.3	85%	0.851	76%	0.758	S	S	*	*				-169.5	150.1	124.6	-101.2	159.7	0	0	0	110.7
173	K	27.9	Very low	32	Very low	179 Å²	179	155 Å²	155	78%	0.778	75%	0.75	S	S	*	*			trans	-83.5	164.6	179.8	-64.1	175.7	179.1	174.6	0	112.3
174	N	29.1	Very low	32.1	Very low	145 Å²	145	156.3 Å²	156.3	78%	0.775	75%	0.749	S	S	*	*			trans	68.6	106.7	164.5	-52.9	-20.8	0	0	0	117.3
175	N	34.1	Very low	32.3	Very low	108 Å²	108	157.3 Å²	157.3	58%	0.578	75%	0.751	S	S	*	*			trans	-179.8	9.8	134.9	-104	-67.9	0	0	0	116.8	N177 R178	N175-N177 PolarHBondContact O-N 3.12Å; N175-R178 WeakPolarHBondContact O-CB 2.89Å; N175-R178 PolarHBondContact O-N 2.72Å; N175-R178 WeakPolarHBondContact OD1-CD 3.27Å
176	E	34.2	Very low	32.3	Very low	166 Å²	166	156.7 Å²	156.7	78%	0.776	75%	0.752	S	S	*	*	H	α-helix	trans	-56.3	-28.2	-172.4	-63.7	-167.2	120.9	0	0	115.5	R178 L179 L180	E176-R178 PolarHBondContact O-N 3.15Å; E176-L179 PolarHBondContact O-N 2.9Å; E176-L180 PolarHBondContact O-N 2.92Å
177	N	39	Very low	32.3	Very low	126 Å²	126	156.7 Å²	156.7	67%	0.674	74%	0.739	S	S	*	*	H	α-helix	trans	-60.7	-7.4	171.5	-84.4	-44.8	0	0	0	115	N175 R181	N175-N177 PolarHBondContact O-N 3.12Å; N177-R181 VanDerWaalsContact O-CD 3.29Å; N177-R181 WeakPolarHBondContact O-CD 3.45Å; N177-R181 VanDerWaalsContact O-CG 3.28Å; N177-R181 WeakPolarHBondContact O-CG 3.47Å
178	R	34.8	Very low	32.5	Very low	186 Å²	186	157.2 Å²	157.2	70%	0.702	74%	0.744	S	S	*	*	H	α-helix	trans	-100.1	-25.4	179.9	-133.6	167.8	-175.9	160.1	-0.6	113.8	N175 E176	N175-R178 WeakPolarHBondContact O-CB 2.89Å; N175-R178 PolarHBondContact O-N 2.72Å; N175-R178 WeakPolarHBondContact OD1-CD 3.27Å; E176-R178 PolarHBondContact O-N 3.15Å
179	L	34.5	Very low	32.4	Very low	126 Å²	126	153.9 Å²	153.9	66%	0.66	73%	0.732	S	S	*	*	H	α-helix	trans	-81.2	-42.9	173.7	-85.5	161.8	0	0	0	111.8	E176 R181 R182 I183	E176-L179 PolarHBondContact O-N 2.9Å; L179-R181 PolarHBondContact O-N 2.91Å; L179-R182 PolarHBondContact O-N 3.29Å; L179-I183 PolarHBondContact O-N 3.18Å
180	L	35.4	Very low	32.5	Very low	123 Å²	123	152.3 Å²	152.3	64%	0.644	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	-12.1	172.8	-85.3	159.3	0	0	0	114.2	E176	E176-L180 PolarHBondContact O-N 2.92Å
181	R	36.5	Very low	32.6	Very low	187 Å²	187	154 Å²	154	71%	0.706	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	-18.2	172.9	-71.4	-177.9	-174.1	-157.9	1.2	114.4	N177 L179	N177-R181 VanDerWaalsContact O-CD 3.29Å; N177-R181 WeakPolarHBondContact O-CD 3.45Å; N177-R181 VanDerWaalsContact O-CG 3.28Å; N177-R181 WeakPolarHBondContact O-CG 3.47Å; L179-R181 PolarHBondContact O-N 2.91Å
182	R	33	Very low	33	Very low	209 Å²	209	151.3 Å²	151.3	79%	0.789	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-26.2	175	-88.3	-176.2	164.7	169	-5	113.8	L179 K184	L179-R182 PolarHBondContact O-N 3.29Å; R182-K184 PolarHBondContact O-N 3.07Å
183	I	37.3	Very low	33.1	Very low	141 Å²	141	151.1 Å²	151.1	72%	0.723	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-7.8	179.1	-66	163.6	0	0	0	112.7	L179	L179-I183 PolarHBondContact O-N 3.18Å
184	K	33.7	Very low	33.4	Very low	182 Å²	182	149.1 Å²	149.1	79%	0.791	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	-5.9	-179.9	-79.8	-167.2	171	-171.2	0	115.6	R182	R182-K184 PolarHBondContact O-N 3.07Å
185	T	32.9	Very low	33.5	Very low	103 Å²	103	146.5 Å²	146.5	63%	0.632	70%	0.699	S	S	*	*	S	Bend	trans	-136.2	50.4	-169.1	57	0	0	0	0	114.2
186	E	33.5	Very low	33.4	Very low	191 Å²	191	147.3 Å²	147.3	89%	0.893	70%	0.702	S	S	*	*			trans	-157.1	118.1	157.8	-117	151.2	-136.6	0	0	112.5	H188	E186-H188 PolarHBondContact O-N 3.12Å
187	R	29.5	Very low	33.5	Very low	175 Å²	175	145.3 Å²	145.3	66%	0.66	70%	0.695	S	S	*	*			trans	-83.5	88.3	174.6	-72.2	174.2	166.4	145.3	-0.6	109.1	N21 N22	N21-R187 PolarHBondContact O-NH2 2.95Å; N22-R187 PolarHBondContact OD1-NH1 3.36Å; N22-R187 PolarHBondContact OD1-NH2 3.41Å
188	H	30.5	Very low	33.4	Very low	195 Å²	195	144.7 Å²	144.7	90%	0.903	69%	0.688	S	S	*	*			trans	-176.7	60.5	157.5	-107.2	79.2	0	0	0	114.4	E186	E186-H188 PolarHBondContact O-N 3.12Å
189	C	30.3	Very low	33.6	Very low	90 Å²	90	144.1 Å²	144.1	61%	0.608	69%	0.691	S	S	*	*			trans	-153	37.9	172.3	-145.5	0	0	0	0	117.6	N191	C189-N191 VanDerWaalsContact C-N 3.26Å; C189-N191 PolarHBondContact O-N 3.34Å
190	N	28.9	Very low	33.8	Very low	144 Å²	144	145.4 Å²	145.4	77%	0.77	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	-6.9	-177.5	-82.9	3.7	0	0	0	116
191	N	33.4	Very low	34.2	Very low	137 Å²	137	143 Å²	143	73%	0.733	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.7	-2.2	-171.2	-75.1	6.4	0	0	0	115.5	C189 N195	C189-N191 VanDerWaalsContact C-N 3.26Å; C189-N191 PolarHBondContact O-N 3.34Å; N191-N195 PolarHBondContact O-ND2 2.9Å
192	V	33.1	Very low	35	Very low	98 Å²	98	142.3 Å²	142.3	59%	0.594	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	-36.4	-174.1	-176.6	0	0	0	0	112.6
193	Q	34.2	Very low	36.4	Very low	162 Å²	162	134.9 Å²	134.9	76%	0.757	67%	0.672	S	S	*	*	S	Bend	trans	-89.8	-11.3	-174.4	-148.1	156.6	3.2	0	0	114.2
194	F	33	Very low	38.2	Very low	138 Å²	138	130.7 Å²	130.7	61%	0.605	65%	0.654	S	S	*	*	H	α-helix	trans	-68.8	-39	169.3	-97.2	-95.1	0	0	0	112.5	I196 I197 E198	F194-I196 PolarHBondContact O-N 3.3Å; F194-I197 PolarHBondContact O-N 2.87Å; F194-E198 PolarHBondContact O-N 3.34Å
195	N	31.4	Very low	40.6	Very low	89 Å²	89	128 Å²	128	48%	0.476	65%	0.654	S	S	.	*	H	α-helix	trans	-62.3	-15.3	-174.3	-68.6	-41	0	0	0	115.1	N191	N191-N195 PolarHBondContact O-ND2 2.9Å
196	I	33.2	Very low	43.1	Very low	125 Å²	125	129.7 Å²	129.7	64%	0.641	65%	0.654	S	S	*	*	H	α-helix	trans	-91.1	-26.7	176.8	-61.9	178.3	0	0	0	111.2	F194	F194-I196 PolarHBondContact O-N 3.3Å
197	I	35.5	Very low	45.6	Very low	124 Å²	124	124.5 Å²	124.5	64%	0.636	63%	0.627	S	S	*	*	H	α-helix	trans	-84.3	-38.7	174.4	-62.7	177.8	0	0	0	110.4	F194 K199 N200 C201	F194-I197 PolarHBondContact O-N 2.87Å; I197-K199 PolarHBondContact O-N 3.06Å; I197-N200 PolarHBondContact O-N 3.03Å; I197-C201 PolarHBondContact O-N 3.47Å
198	E	36.4	Very low	48.4	Very low	114 Å²	114	119.9 Å²	119.9	53%	0.533	62%	0.615	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.7	-20.1	178.8	-70.6	-172.4	150	0	0	114.2	F194	F194-E198 PolarHBondContact O-N 3.34Å
199	K	38.7	Very low	51.3	Low	173 Å²	173	117 Å²	117	75%	0.752	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-21	175.4	-77.7	-171.7	173.1	-175	0	114.9	I197	I197-K199 PolarHBondContact O-N 3.06Å
200	N	38.9	Very low	54.3	Low	153 Å²	153	116.4 Å²	116.4	82%	0.818	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.8	5.7	-178.4	-78.2	-5.5	0	0	0	114.2	I197	I197-N200 PolarHBondContact O-N 3.03Å
201	C	44.2	Very low	57.4	Low	72 Å²	72	109.5 Å²	109.5	49%	0.486	55%	0.553	S	S	.	*			trans	-142.6	53.7	170.7	-155.4	0	0	0	0	112.7	I197 L203	I197-C201 PolarHBondContact O-N 3.47Å; C201-L203 VanDerWaalsContact C-N 3.3Å; C201-L203 PolarHBondContact O-N 2.98Å
202	Q	52.6	Low	60.3	Low	173 Å²	173	108.2 Å²	108.2	81%	0.808	54%	0.541	S	S	*	.			trans	-67.5	95.2	160.7	-73.3	-162.9	0.6	0	0	109	S204	Q202-S204 PolarHBondContact O-N 3.34Å
203	L	63.4	Low	63.2	Low	54 Å²	54	107.8 Å²	107.8	28%	0.283	54%	0.535	S	S	.	.			trans	-62	108.1	178.1	-147.7	156.4	0	0	0	107.9	C201 R207 L208 L320	C201-L203 VanDerWaalsContact C-N 3.3Å; C201-L203 PolarHBondContact O-N 2.98Å; L203-R207 HydrophobicContact CD2-CB 3.61Å; L203-L208 HydrophobicContact CD2-CD2 3.9Å; L203-L208 HydrophobicContact CD2-CG 3.81Å; L203-L208 WeakPolarHBondContact O-CD1 3.33Å; L203-L320 HydrophobicContact CD1-CD2 3.87Å; L203-L320 HydrophobicContact CD2-CD2 3.78Å
204	S	75.9	Confident	66.1	Low	52 Å²	52	104.1 Å²	104.1	36%	0.364	52%	0.518	S	S	.	.			trans	-57.4	149	-164.3	70.2	0	0	0	0	112.2	Q202 E206 R207 L208	Q202-S204 PolarHBondContact O-N 3.34Å; S204-E206 PolarHBondContact O-N 3.35Å; S204-E206 VanDerWaalsContact O-N 3.12Å; S204-R207 PolarHBondContact O-N 3.41Å; S204-R207 WeakPolarHBondContact OG-CB 3.5Å; S204-R207 PolarHBondContact OG-N 3.33Å; S204-L208 PolarHBondContact O-N 2.92Å
205	T	82.1	Confident	69.1	Low	127 Å²	127	97.8 Å²	97.8	78%	0.779	49%	0.49	S	S	*	.	H	α-helix	trans	-55.1	-31.6	176.8	48.3	0	0	0	0	111.9	K209	T205-K209 WeakPolarHBondContact O-CB 3.3Å; T205-K209 PolarHBondContact O-N 2.87Å
206	E	86.1	Confident	72.2	Confident	138 Å²	138	97.4 Å²	97.4	65%	0.645	49%	0.488	S	S	*	.	H	α-helix	trans	-68.1	-50.3	170.8	-174.7	167	-137.8	0	0	113	S204 L208 K209 I210	S204-E206 PolarHBondContact O-N 3.35Å; S204-E206 VanDerWaalsContact O-N 3.12Å; E206-L208 VanDerWaalsContact C-N 3.3Å; E206-L208 PolarHBondContact O-N 3.31Å; E206-K209 WeakPolarHBondContact O-CB 3.37Å; E206-K209 PolarHBondContact O-N 3.05Å; E206-K209 VanDerWaalsContact O-N 3.09Å; E206-I210 HydrophobicContact CG-CD1 3.98Å; E206-I210 WeakPolarHBondContact O-CG1 3.22Å; E206-I210 PolarHBondContact O-N 3.38Å
207	R	86.6	Confident	75.2	Confident	81 Å²	81	95.2 Å²	95.2	31%	0.306	48%	0.475	S	S	.	.	H	α-helix	trans	-60	-38.9	174.5	-89.2	-167.9	158.9	-147.2	-13.4	112.3	L203 S204 K209 I210 A211 D314	L203-R207 HydrophobicContact CD2-CB 3.61Å; S204-R207 PolarHBondContact O-N 3.41Å; S204-R207 WeakPolarHBondContact OG-CB 3.5Å; S204-R207 PolarHBondContact OG-N 3.33Å; R207-K209 VanDerWaalsContact C-N 3.34Å; R207-I210 PolarHBondContact O-N 3.18Å; R207-A211 VanDerWaalsContact O-CB 3.27Å; R207-A211 WeakPolarHBondContact O-CB 3.14Å; R207-A211 PolarHBondContact O-N 3.3Å; R207-D314 IonicContact CZ-OD1 3.37Å; R207-D314 IonicContact CZ-OD2 2.69Å; R207-D314 PolarHBondContact NH1-O 3.48Å; R207-D314 IonicContact NH1-OD1 3.21Å; R207-D314 PolarHBondContact NH1-OD1 3.13Å; R207-D314 VanDerWaalsContact NH1-OD1 3.14Å; R207-D314 IonicContact NH1-OD2 3.78Å; R207-D314 VanDerWaalsContact NH2-CG 3.26Å; R207-D314 IonicContact NH2-OD1 3.09Å; R207-D314 PolarHBondContact NH2-OD1 2.91Å; R207-D314 IonicContact NH2-OD2 2.78Å; R207-D314 PolarHBondContact NH2-OD2 3.16Å
208	L	88.6	Confident	78.1	Confident	78 Å²	78	89.5 Å²	89.5	41%	0.408	45%	0.446	S	S	.	.	H	α-helix	trans	-64	-37.5	174.2	-75.4	170	0	0	0	112.3	L203 S204 E206 K212 L320	L203-L208 HydrophobicContact CD2-CD2 3.9Å; L203-L208 HydrophobicContact CD2-CG 3.81Å; L203-L208 WeakPolarHBondContact O-CD1 3.33Å; S204-L208 PolarHBondContact O-N 2.92Å; E206-L208 VanDerWaalsContact C-N 3.3Å; E206-L208 PolarHBondContact O-N 3.31Å; L208-K212 WeakPolarHBondContact O-CB 3.5Å; L208-K212 PolarHBondContact O-N 3.22Å; L208-K212 VanDerWaalsContact O-N 3.11Å; L208-L320 HydrophobicContact CD2-CD1 4.48Å; L208-L320 HydrophobicContact CD2-CD2 4Å
209	K	91.3	Very high	80.9	Confident	134 Å²	134	87 Å²	87	58%	0.583	44%	0.436	S	S	*	.	H	α-helix	trans	-68.2	-48.8	175.3	-176.1	-172.6	171.3	-166.3	0	111.3	T205 E206 R207 A211 K212 D213	T205-K209 WeakPolarHBondContact O-CB 3.3Å; T205-K209 PolarHBondContact O-N 2.87Å; E206-K209 WeakPolarHBondContact O-CB 3.37Å; E206-K209 PolarHBondContact O-N 3.05Å; E206-K209 VanDerWaalsContact O-N 3.09Å; R207-K209 VanDerWaalsContact C-N 3.34Å; K209-A211 VanDerWaalsContact C-N 3.35Å; K209-A211 PolarHBondContact O-N 3.08Å; K209-K212 WeakPolarHBondContact O-CB 3.32Å; K209-K212 PolarHBondContact O-N 3.45Å; K209-K212 VanDerWaalsContact O-N 3.09Å; K209-D213 PolarHBondContact O-N 3.42Å
210	I	92.8	Very high	83.6	Confident	78 Å²	78	86.1 Å²	86.1	40%	0.4	43%	0.432	S	S	.	.	H	α-helix	trans	-57.9	-48.3	177.2	-64	163.8	0	0	0	110.1	E206 R207 K212 D213 E214	E206-I210 HydrophobicContact CG-CD1 3.98Å; E206-I210 WeakPolarHBondContact O-CG1 3.22Å; E206-I210 PolarHBondContact O-N 3.38Å; R207-I210 PolarHBondContact O-N 3.18Å; I210-K212 PolarHBondContact O-N 2.86Å; I210-D213 PolarHBondContact O-N 2.79Å; I210-E214 HydrophobicContact CG2-CG 4.43Å; I210-E214 WeakPolarHBondContact O-CB 3.24Å; I210-E214 WeakPolarHBondContact O-CG 3.44Å; I210-E214 PolarHBondContact O-N 3.06Å
211	A	93.2	Very high	86.2	Confident	0 Å²	0	81.3 Å²	81.3	0%	0	41%	0.411	C	S	.	.	H	α-helix	trans	-56.6	-38.1	176.1	0	0	0	0	0	112.7	R207 K209 V215 Y317 L320 L321 M324	R207-A211 VanDerWaalsContact O-CB 3.27Å; R207-A211 WeakPolarHBondContact O-CB 3.14Å; R207-A211 PolarHBondContact O-N 3.3Å; K209-A211 VanDerWaalsContact C-N 3.35Å; K209-A211 PolarHBondContact O-N 3.08Å; A211-V215 WeakPolarHBondContact O-CB 3.3Å; A211-V215 WeakPolarHBondContact O-CG2 3.39Å; A211-V215 PolarHBondContact O-N 3.28Å; A211-Y317 WeakPolarHBondContact CA-OH 3.48Å; A211-Y317 HydrophobicContact CB-CE2 3.8Å; A211-Y317 PolarHBondContact N-OH 2.95Å; A211-L320 HydrophobicContact CB-CD2 3.74Å; A211-L320 HydrophobicContact CB-CG 4.4Å; A211-L321 HydrophobicContact CB-CD2 3.77Å; A211-M324 HydrophobicContact CB-SD 4.23Å
212	K	94.2	Very high	88.5	Confident	110 Å²	110	84.7 Å²	84.7	48%	0.478	41%	0.413	S	S	.	.	H	α-helix	trans	-71.3	-46.6	176.7	-168.4	-167.3	170.3	-157.8	0	112.4	L208 K209 I210 E214 V215 D216 M324	L208-K212 WeakPolarHBondContact O-CB 3.5Å; L208-K212 PolarHBondContact O-N 3.22Å; L208-K212 VanDerWaalsContact O-N 3.11Å; K209-K212 WeakPolarHBondContact O-CB 3.32Å; K209-K212 PolarHBondContact O-N 3.45Å; K209-K212 VanDerWaalsContact O-N 3.09Å; I210-K212 PolarHBondContact O-N 2.86Å; K212-E214 VanDerWaalsContact C-N 3.29Å; K212-E214 PolarHBondContact O-N 3.14Å; K212-V215 PolarHBondContact O-N 2.7Å; K212-V215 VanDerWaalsContact O-N 3.14Å; K212-D216 VanDerWaalsContact CE-OD2 3.27Å; K212-D216 WeakPolarHBondContact CE-OD2 3.44Å; K212-D216 IonicContact NZ-OD2 3.96Å; K212-D216 PolarHBondContact O-N 3.23Å; K212-M324 HydrophobicContact CB-CE 3.88Å; K212-M324 HydrophobicContact CG-CE 4.11Å
213	D	95.1	Very high	90.6	Very high	88 Å²	88	79.3 Å²	79.3	47%	0.471	39%	0.387	S	S	.	.	H	α-helix	trans	-64	-36.9	-179.1	-67.4	-20.5	0	0	0	110.6	K209 I210 E217	K209-D213 PolarHBondContact O-N 3.42Å; I210-D213 PolarHBondContact O-N 2.79Å; D213-E217 PolarHBondContact O-N 3.19Å
214	E	95.5	Very high	92.2	Very high	86 Å²	86	77.1 Å²	77.1	40%	0.402	38%	0.376	S	S	.	.	H	α-helix	trans	-64.1	-44.6	169.7	-73.5	-174.8	165.1	0	0	112.7	I210 K212 A218 I244 Y317	I210-E214 HydrophobicContact CG2-CG 4.43Å; I210-E214 WeakPolarHBondContact O-CB 3.24Å; I210-E214 WeakPolarHBondContact O-CG 3.44Å; I210-E214 PolarHBondContact O-N 3.06Å; K212-E214 VanDerWaalsContact C-N 3.29Å; K212-E214 PolarHBondContact O-N 3.14Å; E214-A218 VanDerWaalsContact O-CB 3.23Å; E214-A218 WeakPolarHBondContact O-CB 3.46Å; E214-A218 PolarHBondContact O-N 3.49Å; E214-I244 HydrophobicContact CB-CD1 4.32Å; E214-Y317 VanDerWaalsContact CD-OH 3.29Å; E214-Y317 PolarHBondContact OE2-OH 2.84Å
215	V	96.1	Very high	93.2	Very high	5 Å²	5	74.6 Å²	74.6	3%	0.03	36%	0.358	C	S	.	.	H	α-helix	trans	-65.1	-47.7	178.7	165.3	0	0	0	0	112.1	A211 K212 E217 A218 I219 I244 L321 M324 V325	A211-V215 WeakPolarHBondContact O-CB 3.3Å; A211-V215 WeakPolarHBondContact O-CG2 3.39Å; A211-V215 PolarHBondContact O-N 3.28Å; K212-V215 PolarHBondContact O-N 2.7Å; K212-V215 VanDerWaalsContact O-N 3.14Å; V215-E217 VanDerWaalsContact C-N 3.3Å; V215-E217 PolarHBondContact O-N 3.23Å; V215-A218 PolarHBondContact O-N 2.84Å; V215-I219 HydrophobicContact CG1-CD1 3.62Å; V215-I219 HydrophobicContact CG1-CG1 4.31Å; V215-I219 WeakPolarHBondContact O-CB 3.41Å; V215-I219 VanDerWaalsContact O-CG1 3.24Å; V215-I219 WeakPolarHBondContact O-CG1 3.24Å; V215-I219 PolarHBondContact O-N 3.14Å; V215-I244 HydrophobicContact CB-CD1 4.22Å; V215-I244 HydrophobicContact CG2-CD1 3.56Å; V215-L321 HydrophobicContact CG2-CD2 3.84Å; V215-M324 HydrophobicContact CB-CB 4.49Å; V215-M324 HydrophobicContact CB-CE 4.33Å; V215-M324 HydrophobicContact CG1-CB 4.07Å; V215-M324 HydrophobicContact CG2-CB 3.84Å; V215-M324 HydrophobicContact CG2-CE 4.24Å; V215-M324 HydrophobicContact CG2-SD 4.27Å; V215-V325 HydrophobicContact CG1-CG1 4Å; V215-V325 HydrophobicContact CG2-CG1 4.31Å
216	D	96.2	Very high	93.9	Very high	80 Å²	80	68.6 Å²	68.6	43%	0.428	32%	0.321	S	S	.	.	H	α-helix	trans	-63.2	-37.6	-179.2	-78.2	-21.8	0	0	0	110.6	K212 K220	K212-D216 VanDerWaalsContact CE-OD2 3.27Å; K212-D216 WeakPolarHBondContact CE-OD2 3.44Å; K212-D216 IonicContact NZ-OD2 3.96Å; K212-D216 PolarHBondContact O-N 3.23Å; D216-K220 WeakPolarHBondContact O-CB 3.48Å; D216-K220 PolarHBondContact O-N 3.27Å
217	E	96.1	Very high	94.2	Very high	79 Å²	79	62.7 Å²	62.7	37%	0.369	29%	0.294	S	S	.	.	H	α-helix	trans	-72	-40	172.6	-174.5	54.6	-135.5	0	0	113.1	D213 V215 I219 K220 S221	D213-E217 PolarHBondContact O-N 3.19Å; V215-E217 VanDerWaalsContact C-N 3.3Å; V215-E217 PolarHBondContact O-N 3.23Å; E217-I219 VanDerWaalsContact C-N 3.33Å; E217-I219 PolarHBondContact O-N 3.2Å; E217-K220 VanDerWaalsContact CD-NZ 3.28Å; E217-K220 PolarHBondContact O-N 3.47Å; E217-K220 IonicContact OE1-NZ 2.72Å; E217-K220 PolarHBondContact OE1-NZ 3.22Å; E217-K220 IonicContact OE2-NZ 2.71Å; E217-K220 PolarHBondContact OE2-NZ 2.97Å; E217-S221 WeakPolarHBondContact O-CB 3.28Å; E217-S221 PolarHBondContact O-N 3.47Å; E217-S221 PolarHBondContact OE1-OG 3.43Å
218	A	96.1	Very high	94.4	Very high	4 Å²	4	60.8 Å²	60.8	3%	0.033	29%	0.29	C	S	.	.	H	α-helix	trans	-63.2	-39.2	177.2	0	0	0	0	0	111.8	E214 V215 R222 K223 I244	E214-A218 VanDerWaalsContact O-CB 3.23Å; E214-A218 WeakPolarHBondContact O-CB 3.46Å; E214-A218 PolarHBondContact O-N 3.49Å; V215-A218 PolarHBondContact O-N 2.84Å; A218-R222 CarbonylContact O-C 3.56Å; A218-R222 WeakPolarHBondContact O-CA 3.23Å; A218-R222 PolarHBondContact O-N 2.9Å; A218-K223 PolarHBondContact O-N 3.36Å; A218-I244 HydrophobicContact CB-CB 4.21Å; A218-I244 HydrophobicContact CB-CD1 3.59Å; A218-I244 HydrophobicContact CB-CG1 3.77Å
219	I	95.6	Very high	94.3	Very high	61 Å²	61	58.2 Å²	58.2	31%	0.313	28%	0.282	S	S	.	.	H	α-helix	trans	-62.5	-52	172.2	-67.9	167.9	0	0	0	110	V215 E217 S221 R222 I224 V325 E328	V215-I219 HydrophobicContact CG1-CD1 3.62Å; V215-I219 HydrophobicContact CG1-CG1 4.31Å; V215-I219 WeakPolarHBondContact O-CB 3.41Å; V215-I219 VanDerWaalsContact O-CG1 3.24Å; V215-I219 WeakPolarHBondContact O-CG1 3.24Å; V215-I219 PolarHBondContact O-N 3.14Å; E217-I219 VanDerWaalsContact C-N 3.33Å; E217-I219 PolarHBondContact O-N 3.2Å; I219-S221 PolarHBondContact O-N 2.89Å; I219-R222 WeakPolarHBondContact O-CA 3.45Å; I219-R222 PolarHBondContact O-N 3.12Å; I219-I224 HydrophobicContact CG1-CD1 3.95Å; I219-V325 HydrophobicContact CG1-CG1 4.47Å; I219-E328 HydrophobicContact CD1-CG 4.35Å; I219-E328 HydrophobicContact CG1-CG 4.21Å
220	K	95.1	Very high	94	Very high	155 Å²	155	53.6 Å²	53.6	67%	0.674	27%	0.266	S	S	*	.	H	α-helix	trans	-59.3	-44.5	-178.8	170.6	168.5	157.3	-81.4	0	113.2	D216 E217 R222	D216-K220 WeakPolarHBondContact O-CB 3.48Å; D216-K220 PolarHBondContact O-N 3.27Å; E217-K220 VanDerWaalsContact CD-NZ 3.28Å; E217-K220 PolarHBondContact O-N 3.47Å; E217-K220 IonicContact OE1-NZ 2.72Å; E217-K220 PolarHBondContact OE1-NZ 3.22Å; E217-K220 IonicContact OE2-NZ 2.71Å; E217-K220 PolarHBondContact OE2-NZ 2.97Å; K220-R222 VanDerWaalsContact C-N 3.28Å; K220-R222 PolarHBondContact O-N 2.64Å
221	S	93.3	Very high	93.8	Very high	53 Å²	53	50.8 Å²	50.8	37%	0.371	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	1.5	175.1	-79.3	0	0	0	0	113.9	E217 I219 K223	E217-S221 WeakPolarHBondContact O-CB 3.28Å; E217-S221 PolarHBondContact O-N 3.47Å; E217-S221 PolarHBondContact OE1-OG 3.43Å; I219-S221 PolarHBondContact O-N 2.89Å; S221-K223 PolarHBondContact O-N 2.9Å
222	R	93.5	Very high	93.7	Very high	142 Å²	142	53 Å²	53	54%	0.536	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.5	28.3	-174.3	-54	-171.9	-179	-160.3	-3.5	114.7	A218 I219 K220 I224 R331 D349	A218-R222 CarbonylContact O-C 3.56Å; A218-R222 WeakPolarHBondContact O-CA 3.23Å; A218-R222 PolarHBondContact O-N 2.9Å; I219-R222 WeakPolarHBondContact O-CA 3.45Å; I219-R222 PolarHBondContact O-N 3.12Å; K220-R222 VanDerWaalsContact C-N 3.28Å; K220-R222 PolarHBondContact O-N 2.64Å; R222-I224 PolarHBondContact O-N 3.28Å; R222-I224 VanDerWaalsContact O-N 3.08Å; R222-R331 VanDerWaalsContact O-CB 3.23Å; R222-R331 WeakPolarHBondContact O-CB 3.2Å; R222-R331 WeakPolarHBondContact O-CD 3.1Å; R222-D349 IonicContact CZ-OD2 2.79Å; R222-D349 IonicContact NH1-OD2 3.96Å; R222-D349 PolarHBondContact NH1-OD2 2.86Å
223	K	96.1	Very high	93.6	Very high	61 Å²	61	53.1 Å²	53.1	27%	0.265	26%	0.259	S	S	.	.			trans	-84.9	55.4	179.7	-66.1	-173.3	-179.5	-177.6	0	112.1	A218 S221 R241 G242 W243 I244	A218-K223 PolarHBondContact O-N 3.36Å; S221-K223 PolarHBondContact O-N 2.9Å; K223-R241 PolarHBondContact NZ-O 3.45Å; K223-G242 WeakPolarHBondContact CB-O 3.41Å; K223-G242 WeakPolarHBondContact CD-O 3.38Å; K223-W243 VanDerWaalsContact CA-CE3 3.42Å; K223-W243 HydrophobicContact CB-CB 4.15Å; K223-W243 HydrophobicContact CB-CD2 3.68Å; K223-W243 HydrophobicContact CB-CE3 4.03Å; K223-W243 HydrophobicContact CB-CG 3.72Å; K223-W243 HydrophobicContact CD-CG 4.35Å; K223-W243 HydrophobicContact CG-CD2 4.09Å; K223-W243 HydrophobicContact CG-CG 4.22Å; K223-W243 HydrophobicContact CG-CZ2 4.48Å; K223-W243 CarbonylContact O-C 3.59Å; K223-W243 WeakPolarHBondContact O-CA 3.46Å; K223-W243 WeakPolarHBondContact O-CB 3.31Å; K223-I244 PolarHBondContact O-N 3.12Å
224	I	96.7	Very high	93.6	Very high	7 Å²	7	48.9 Å²	48.9	4%	0.036	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	128.4	175.6	-55.3	175.4	0	0	0	107.9	I219 R222 I244 K246 V325 E328 P330 R331 F332	I219-I224 HydrophobicContact CG1-CD1 3.95Å; R222-I224 PolarHBondContact O-N 3.28Å; R222-I224 VanDerWaalsContact O-N 3.08Å; I224-I244 WeakPolarHBondContact CA-O 3.44Å; I224-K246 HydrophobicContact CG2-CB 4.41Å; I224-V325 HydrophobicContact CD1-CB 4.23Å; I224-V325 HydrophobicContact CD1-CG1 4.07Å; I224-V325 HydrophobicContact CG1-CG1 4.4Å; I224-V325 HydrophobicContact CG2-CB 4.45Å; I224-V325 HydrophobicContact CG2-CG2 4.34Å; I224-E328 HydrophobicContact CD1-CB 3.5Å; I224-E328 VanDerWaalsContact CD1-CB 3.5Å; I224-E328 HydrophobicContact CD1-CG 3.88Å; I224-P330 CarbonylContact O-C 3.57Å; I224-P330 WeakPolarHBondContact O-CA 3.43Å; I224-R331 PolarHBondContact O-N 2.81Å; I224-F332 PolarHBondContact O-N 3.45Å
225	F	97	Very high	93.6	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	168.7	179.9	77.4	-81.7	0	0	0	112.4	I227 L238 R239 W243 I244 E245 K246 F332	F225-I227 HydrophobicContact CD2-CD1 4.13Å; F225-I227 HydrophobicContact CD2-CG1 3.8Å; F225-I227 HydrophobicContact CE2-CD1 3.63Å; F225-I227 HydrophobicContact CE2-CG1 3.74Å; F225-L238 HydrophobicContact CB-CD1 4Å; F225-L238 HydrophobicContact CD1-CB 4.08Å; F225-L238 HydrophobicContact CD1-CD1 4.27Å; F225-L238 HydrophobicContact CD2-CB 4.38Å; F225-L238 HydrophobicContact CD2-CD1 3.39Å; F225-L238 HydrophobicContact CE1-CB 3.88Å; F225-L238 HydrophobicContact CE2-CB 4.23Å; F225-L238 HydrophobicContact CE2-CD1 3.8Å; F225-L238 HydrophobicContact CG-CB 4.3Å; F225-L238 HydrophobicContact CG-CD1 3.64Å; F225-L238 HydrophobicContact CZ-CB 3.94Å; F225-L238 HydrophobicContact CZ-CD1 4.36Å; F225-R239 HydrophobicContact CE1-CG 4.24Å; F225-R239 HydrophobicContact CZ-CG 4.13Å; F225-W243 HydrophobicContact CB-CE3 4Å; F225-W243 HydrophobicContact CD1-CB 3.58Å; F225-W243 HydrophobicContact CE1-CB 3.98Å; F225-I244 WeakPolarHBondContact CD1-O 3.33Å; F225-I244 VanDerWaalsContact CE1-C 3.47Å; F225-I244 PolarHBondContact N-O 2.94Å; F225-E245 HydrophobicContact CD1-CB 4.33Å; F225-E245 HydrophobicContact CD2-CG 4.2Å; F225-E245 HydrophobicContact CE1-CB 3.71Å; F225-E245 HydrophobicContact CE1-CG 4.34Å; F225-E245 HydrophobicContact CE2-CB 3.9Å; F225-E245 HydrophobicContact CE2-CG 3.61Å; F225-E245 HydrophobicContact CZ-CB 3.47Å; F225-E245 VanDerWaalsContact CZ-CB 3.47Å; F225-E245 HydrophobicContact CZ-CG 3.73Å; F225-E245 CarbonylContact O-C 3.54Å; F225-K246 PolarHBondContact O-N 3.23Å; F225-F332 CarbonylContact C-O 3.55Å; F225-F332 WeakPolarHBondContact CA-O 3.45Å; F225-F332 HydrophobicContact CB-CB 4.03Å; F225-F332 HydrophobicContact CB-CD1 4.32Å
226	S	95.9	Very high	93.6	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	149.6	168.5	-170.1	0	0	0	0	110.7	K246 V249 F332 W334	S226-K246 WeakPolarHBondContact CB-O 3.21Å; S226-K246 PolarHBondContact OG-O 3.23Å; S226-V249 WeakPolarHBondContact OG-CG1 3.48Å; S226-V249 WeakPolarHBondContact OG-CG2 3.42Å; S226-F332 PolarHBondContact N-O 3.28Å; S226-W334 PolarHBondContact O-N 3.31Å
227	I	93.9	Very high	93.6	Very high	14 Å²	14	48.4 Å²	48.4	7%	0.072	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	125.6	-179	-59.1	-177.9	0	0	0	109.8	F225 G229 Y231 I234 R235 W334	F225-I227 HydrophobicContact CD2-CD1 4.13Å; F225-I227 HydrophobicContact CD2-CG1 3.8Å; F225-I227 HydrophobicContact CE2-CD1 3.63Å; F225-I227 HydrophobicContact CE2-CG1 3.74Å; I227-G229 VanDerWaalsContact CG2-O 3.31Å; I227-G229 WeakPolarHBondContact CG2-O 3.41Å; I227-Y231 HydrophobicContact CG2-CD2 4.05Å; I227-I234 HydrophobicContact CD1-CB 4.17Å; I227-I234 HydrophobicContact CD1-CG2 3.89Å; I227-R235 HydrophobicContact CD1-CB 3.76Å; I227-W334 CarbonylContact C-O 3.59Å; I227-W334 VanDerWaalsContact CA-O 3.27Å; I227-W334 WeakPolarHBondContact CA-O 3.45Å; I227-W334 HydrophobicContact CG1-CB 4.33Å
228	L	90.3	Very high	93.6	Very high	41 Å²	41	44.6 Å²	44.6	22%	0.215	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	81	171.8	-64.4	179.5	0	0	0	109.5	V249 I251 W334 S335 L336 Q340	L228-V249 HydrophobicContact CD2-CB 4.32Å; L228-V249 HydrophobicContact CD2-CG2 3.51Å; L228-V249 HydrophobicContact CG-CG2 4.27Å; L228-I251 HydrophobicContact CD1-CD1 3.68Å; L228-W334 PolarHBondContact N-O 3.16Å; L228-S335 CarbonylContact O-C 3.5Å; L228-S335 WeakPolarHBondContact O-CA 3.2Å; L228-L336 WeakPolarHBondContact O-CB 3.41Å; L228-L336 PolarHBondContact O-N 2.9Å; L228-Q340 HydrophobicContact CD1-CB 3.89Å; L228-Q340 PolarHBondContact O-OE1 2.63Å
229	G	85.6	Confident	93.6	Very high	24 Å²	24	46 Å²	46	25%	0.247	22%	0.216	C	C	.	.	S	Bend	trans	148.2	173	-179.2	0	0	0	0	0	113.2	I227 Y231	I227-G229 VanDerWaalsContact CG2-O 3.31Å; I227-G229 WeakPolarHBondContact CG2-O 3.41Å; G229-Y231 PolarHBondContact O-N 3.38Å
230	P	86.1	Confident	93.5	Very high	37 Å²	37	48.5 Å²	48.5	24%	0.24	23%	0.234	C	C	.	.	S	Bend	trans	-77.6	31	-174.1	33.6	-37.4	0	0	0	114.2	N232 D297	P230-N232 PolarHBondContact O-N 2.91Å; P230-D297 WeakPolarHBondContact CD-OD2 3.41Å; P230-D297 HydrophobicContact CG-CB 3.96Å; P230-D297 WeakPolarHBondContact CG-OD2 3.44Å
231	Y	89.1	Confident	93.5	Very high	20 Å²	20	43.2 Å²	43.2	8%	0.078	21%	0.21	C	C	.	.			trans	-77.5	60.9	-172.6	-63.1	-77.2	0	0	0	113.9	I227 G229 R233 I234 R235 W334 L336 L802	I227-Y231 HydrophobicContact CG2-CD2 4.05Å; G229-Y231 PolarHBondContact O-N 3.38Å; Y231-R233 PolarHBondContact O-N 3.14Å; Y231-I234 PolarHBondContact O-N 3.42Å; Y231-I234 VanDerWaalsContact O-N 3.07Å; Y231-R235 PolarHBondContact O-N 3.39Å; Y231-W334 AromaticContact CD1-NE1 3.49Å; Y231-W334 AromaticContact CD2-CD1 3.27Å; Y231-W334 HydrophobicContact CD2-CG 4.49Å; Y231-W334 AromaticContact CD2-NE1 3.41Å; Y231-W334 AromaticContact CE1-NE1 3.51Å; Y231-W334 AromaticContact CE2-CD1 3.49Å; Y231-W334 VanDerWaalsContact CE2-CD1 3.49Å; Y231-W334 AromaticContact CE2-NE1 3.39Å; Y231-W334 AromaticContact CG-CD1 3.63Å; Y231-W334 AromaticContact CG-NE1 3.44Å; Y231-W334 AromaticContact CZ-NE1 3.44Å; Y231-L336 HydrophobicContact CE2-CB 4.11Å; Y231-L336 HydrophobicContact CE2-CD1 4.25Å; Y231-L336 WeakPolarHBondContact OH-CD1 3.45Å; Y231-L802 HydrophobicContact CD1-CD1 4.45Å; Y231-L802 HydrophobicContact CD1-CD2 4.36Å
232	N	90.7	Very high	93.6	Very high	46 Å²	46	42.8 Å²	42.8	25%	0.246	21%	0.214	C	C	.	.	H	α-helix	trans	-60.6	-27.8	-178.1	-74.6	-28.7	0	0	0	113.9	P230 R235 K236	P230-N232 PolarHBondContact O-N 2.91Å; N232-R235 PolarHBondContact OD1-NH1 3.42Å; N232-K236 WeakPolarHBondContact O-CG 3.45Å; N232-K236 PolarHBondContact O-N 3.4Å
233	R	92	Very high	93.7	Very high	112 Å²	112	36.4 Å²	36.4	42%	0.423	19%	0.19	S	C	.	.	H	α-helix	trans	-67	-46.2	171.9	-167.7	74.6	-169.1	-167.2	6.8	111.8	Y231 R235 K236 A237 A799 L802 E803	Y231-R233 PolarHBondContact O-N 3.14Å; R233-R235 VanDerWaalsContact C-N 3.34Å; R233-R235 PolarHBondContact O-N 3.29Å; R233-K236 PolarHBondContact O-N 3.27Å; R233-A237 WeakPolarHBondContact O-CB 3.48Å; R233-A237 PolarHBondContact O-N 3.39Å; R233-A799 HydrophobicContact CG-CB 4.4Å; R233-L802 HydrophobicContact CB-CD1 4.23Å; R233-L802 HydrophobicContact CG-CB 4.45Å; R233-E803 IonicContact CZ-OE2 3.89Å; R233-E803 IonicContact NE-OE2 3.31Å; R233-E803 PolarHBondContact NE-OE2 3.48Å; R233-E803 IonicContact NH2-OE2 2.71Å; R233-E803 PolarHBondContact NH2-OE2 2.8Å
234	I	95.1	Very high	93.8	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-62.5	-42.6	176	-61.3	-65	0	0	0	110.5	I227 Y231 A237 L238 F332 W334 L802 L806	I227-I234 HydrophobicContact CD1-CB 4.17Å; I227-I234 HydrophobicContact CD1-CG2 3.89Å; Y231-I234 PolarHBondContact O-N 3.42Å; Y231-I234 VanDerWaalsContact O-N 3.07Å; I234-A237 PolarHBondContact O-N 2.9Å; I234-L238 HydrophobicContact CG2-CD1 3.62Å; I234-L238 HydrophobicContact CG2-CG 4.21Å; I234-L238 WeakPolarHBondContact O-CB 3.33Å; I234-L238 VanDerWaalsContact O-CG 3.28Å; I234-L238 WeakPolarHBondContact O-CG 3.17Å; I234-L238 PolarHBondContact O-N 3.11Å; I234-F332 HydrophobicContact CG2-CE1 4.47Å; I234-W334 HydrophobicContact CD1-CD2 4.28Å; I234-W334 HydrophobicContact CD1-CE3 3.99Å; I234-W334 HydrophobicContact CD1-CH2 3.68Å; I234-W334 HydrophobicContact CD1-CZ2 4Å; I234-W334 HydrophobicContact CD1-CZ3 3.67Å; I234-W334 HydrophobicContact CG1-CD2 4.01Å; I234-W334 HydrophobicContact CG1-CE3 4.21Å; I234-W334 HydrophobicContact CG1-CH2 4.24Å; I234-W334 HydrophobicContact CG1-CZ2 4.06Å; I234-W334 HydrophobicContact CG1-CZ3 4.32Å; I234-W334 HydrophobicContact CG2-CB 4.32Å; I234-W334 HydrophobicContact CG2-CD2 4.09Å; I234-W334 HydrophobicContact CG2-CE3 4.09Å; I234-W334 HydrophobicContact CG2-CG 4.2Å; I234-L802 HydrophobicContact CD1-CB 3.83Å; I234-L802 HydrophobicContact CD1-CD2 4Å; I234-L802 HydrophobicContact CD1-CG 4.46Å; I234-L802 VanDerWaalsContact CD1-O 3.25Å; I234-L802 WeakPolarHBondContact CD1-O 3.38Å; I234-L802 HydrophobicContact CG1-CB 4.34Å; I234-L802 HydrophobicContact CG1-CD2 4.06Å; I234-L806 HydrophobicContact CD1-CD1 3.94Å; I234-L806 HydrophobicContact CD1-CD2 4.16Å; I234-L806 HydrophobicContact CD1-CG 3.93Å; I234-L806 HydrophobicContact CG2-CD1 4.4Å; I234-L806 HydrophobicContact CG2-CD2 4.48Å
235	R	96.2	Very high	93.8	Very high	14 Å²	14	34 Å²	34	5%	0.053	18%	0.179	C	C	.	.	H	α-helix	trans	-53.9	-55.9	174.4	-179.9	167.3	-74	122.4	3.9	112.1	I227 Y231 N232 R233 L238 R239 E245	I227-R235 HydrophobicContact CD1-CB 3.76Å; Y231-R235 PolarHBondContact O-N 3.39Å; N232-R235 PolarHBondContact OD1-NH1 3.42Å; R233-R235 VanDerWaalsContact C-N 3.34Å; R233-R235 PolarHBondContact O-N 3.29Å; R235-L238 PolarHBondContact O-N 3Å; R235-R239 VanDerWaalsContact O-CG 3.3Å; R235-R239 WeakPolarHBondContact O-CG 3.48Å; R235-R239 PolarHBondContact O-N 3.45Å; R235-R239 VanDerWaalsContact O-N 3.07Å; R235-E245 WeakPolarHBondContact CD-OE2 3.27Å; R235-E245 WeakPolarHBondContact CG-OE2 3.45Å; R235-E245 IonicContact CZ-OE1 3.5Å; R235-E245 VanDerWaalsContact NE-CD 3.32Å; R235-E245 IonicContact NE-OE1 3.4Å; R235-E245 PolarHBondContact NE-OE1 3.16Å; R235-E245 IonicContact NE-OE2 3.32Å; R235-E245 PolarHBondContact NE-OE2 3.41Å; R235-E245 IonicContact NH2-OE1 2.72Å; R235-E245 PolarHBondContact NH2-OE1 3.21Å
236	K	94.6	Very high	93.7	Very high	142 Å²	142	35 Å²	35	62%	0.617	18%	0.184	S	C	*	.	H	α-helix	trans	-61.2	-47.4	178.1	-71.2	-178.3	179	-173.7	0	111.3	N232 R233 L238 R239 T240	N232-K236 WeakPolarHBondContact O-CG 3.45Å; N232-K236 PolarHBondContact O-N 3.4Å; R233-K236 PolarHBondContact O-N 3.27Å; K236-L238 VanDerWaalsContact C-N 3.32Å; K236-L238 PolarHBondContact O-N 3.48Å; K236-R239 PolarHBondContact O-N 3.1Å; K236-T240 WeakPolarHBondContact O-CG2 3.41Å; K236-T240 PolarHBondContact O-N 3.48Å; K236-T240 PolarHBondContact O-OG1 3.09Å
237	A	95.8	Very high	93.4	Very high	4 Å²	4	37.3 Å²	37.3	3%	0.033	19%	0.194	C	C	.	.	H	α-helix	trans	-68.7	-22.3	-177.4	0	0	0	0	0	114.8	R233 I234 T240 R241 E803 L806	R233-A237 WeakPolarHBondContact O-CB 3.48Å; R233-A237 PolarHBondContact O-N 3.39Å; I234-A237 PolarHBondContact O-N 2.9Å; A237-T240 PolarHBondContact O-OG1 3.33Å; A237-R241 VanDerWaalsContact O-CD 3.27Å; A237-R241 WeakPolarHBondContact O-CD 3.12Å; A237-R241 VanDerWaalsContact O-CG 3.31Å; A237-R241 WeakPolarHBondContact O-CG 3.47Å; A237-R241 PolarHBondContact O-NH1 2.7Å; A237-E803 HydrophobicContact CB-CG 4.31Å; A237-L806 HydrophobicContact CB-CD1 3.64Å
238	L	96.9	Very high	92.1	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-82.8	-42.2	170.5	-72.3	172	0	0	0	111.8	F225 I234 R235 K236 T240 R241 G242 W243 F332 L806 L810	F225-L238 HydrophobicContact CB-CD1 4Å; F225-L238 HydrophobicContact CD1-CB 4.08Å; F225-L238 HydrophobicContact CD1-CD1 4.27Å; F225-L238 HydrophobicContact CD2-CB 4.38Å; F225-L238 HydrophobicContact CD2-CD1 3.39Å; F225-L238 HydrophobicContact CE1-CB 3.88Å; F225-L238 HydrophobicContact CE2-CB 4.23Å; F225-L238 HydrophobicContact CE2-CD1 3.8Å; F225-L238 HydrophobicContact CG-CB 4.3Å; F225-L238 HydrophobicContact CG-CD1 3.64Å; F225-L238 HydrophobicContact CZ-CB 3.94Å; F225-L238 HydrophobicContact CZ-CD1 4.36Å; I234-L238 HydrophobicContact CG2-CD1 3.62Å; I234-L238 HydrophobicContact CG2-CG 4.21Å; I234-L238 WeakPolarHBondContact O-CB 3.33Å; I234-L238 VanDerWaalsContact O-CG 3.28Å; I234-L238 WeakPolarHBondContact O-CG 3.17Å; I234-L238 PolarHBondContact O-N 3.11Å; R235-L238 PolarHBondContact O-N 3Å; K236-L238 VanDerWaalsContact C-N 3.32Å; K236-L238 PolarHBondContact O-N 3.48Å; L238-T240 PolarHBondContact O-N 2.81Å; L238-R241 CarbonylContact O-C 3.55Å; L238-R241 WeakPolarHBondContact O-CA 3.48Å; L238-R241 WeakPolarHBondContact O-CB 3.37Å; L238-R241 PolarHBondContact O-N 2.82Å; L238-G242 PolarHBondContact O-N 3.27Å; L238-W243 HydrophobicContact CB-CB 4.24Å; L238-W243 HydrophobicContact CD2-CD2 4.35Å; L238-W243 HydrophobicContact CD2-CG 4.37Å; L238-W243 WeakPolarHBondContact O-CB 3.32Å; L238-W243 PolarHBondContact O-N 3.03Å; L238-W243 VanDerWaalsContact O-N 3.08Å; L238-F332 HydrophobicContact CD1-CD1 3.71Å; L238-F332 HydrophobicContact CD1-CE1 3.8Å; L238-F332 HydrophobicContact CD2-CD1 4.31Å; L238-F332 HydrophobicContact CD2-CE1 4.37Å; L238-L806 HydrophobicContact CD2-CD1 4.11Å; L238-L806 HydrophobicContact CD2-CD2 4.15Å; L238-L806 HydrophobicContact CG-CD1 4.01Å; L238-L810 HydrophobicContact CD2-CD1 3.49Å; L238-L810 VanDerWaalsContact CD2-CD1 3.49Å
239	R	95.7	Very high	90.7	Very high	33 Å²	33	39.4 Å²	39.4	13%	0.125	21%	0.207	C	C	.	.	H	α-helix	trans	-60.1	-43.8	175.7	-71.1	172	-178	-172.1	6.8	111.6	F225 R235 K236 R241 G242 E245 P310 E313 Y318	F225-R239 HydrophobicContact CE1-CG 4.24Å; F225-R239 HydrophobicContact CZ-CG 4.13Å; R235-R239 VanDerWaalsContact O-CG 3.3Å; R235-R239 WeakPolarHBondContact O-CG 3.48Å; R235-R239 PolarHBondContact O-N 3.45Å; R235-R239 VanDerWaalsContact O-N 3.07Å; K236-R239 PolarHBondContact O-N 3.1Å; R239-R241 PolarHBondContact O-N 2.73Å; R239-G242 WeakPolarHBondContact O-CA 3.24Å; R239-G242 PolarHBondContact O-N 3.46Å; R239-E245 IonicContact CZ-OE2 2.7Å; R239-E245 IonicContact NE-OE2 3.76Å; R239-E245 PolarHBondContact NE-OE2 3.17Å; R239-E245 IonicContact NH2-OE2 2.73Å; R239-E245 PolarHBondContact NH2-OE2 3.23Å; R239-P310 PolarHBondContact NH2-O 3.38Å; R239-P310 VanDerWaalsContact NH2-O 3.08Å; R239-E313 IonicContact CZ-OE2 3.85Å; R239-E313 IonicContact NH1-OE2 3.03Å; R239-E313 PolarHBondContact NH1-OE2 2.93Å; R239-E313 IonicContact NH2-OE2 3.14Å; R239-Y318 HydrophobicContact CG-CE1 4.28Å; R239-Y318 VanDerWaalsContact CZ-CD1 3.44Å; R239-Y318 VanDerWaalsContact NH1-CD2 3.27Å; R239-Y318 VanDerWaalsContact NH1-CE2 3.31Å; R239-Y318 VanDerWaalsContact NH1-CG 3.32Å
240	T	94.3	Very high	89	Confident	113 Å²	113	44.1 Å²	44.1	69%	0.693	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-22.9	174.3	55.7	0	0	0	0	114	K236 A237 L238 G242	K236-T240 WeakPolarHBondContact O-CG2 3.41Å; K236-T240 PolarHBondContact O-N 3.48Å; K236-T240 PolarHBondContact O-OG1 3.09Å; A237-T240 PolarHBondContact O-OG1 3.33Å; L238-T240 PolarHBondContact O-N 2.81Å; T240-G242 PolarHBondContact O-N 3.28Å
241	R	94.5	Very high	87.4	Confident	45 Å²	45	43.8 Å²	43.8	17%	0.17	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	6.6	171.4	-70.7	171	172	73.9	-0.4	112.8	K223 A237 L238 R239 E803 D811	K223-R241 PolarHBondContact NZ-O 3.45Å; A237-R241 VanDerWaalsContact O-CD 3.27Å; A237-R241 WeakPolarHBondContact O-CD 3.12Å; A237-R241 VanDerWaalsContact O-CG 3.31Å; A237-R241 WeakPolarHBondContact O-CG 3.47Å; A237-R241 PolarHBondContact O-NH1 2.7Å; L238-R241 CarbonylContact O-C 3.55Å; L238-R241 WeakPolarHBondContact O-CA 3.48Å; L238-R241 WeakPolarHBondContact O-CB 3.37Å; L238-R241 PolarHBondContact O-N 2.82Å; R239-R241 PolarHBondContact O-N 2.73Å; R241-E803 IonicContact NH1-OE1 3.98Å; R241-E803 PolarHBondContact NH1-OE1 3.21Å; R241-D811 IonicContact CZ-OD2 2.55Å; R241-D811 VanDerWaalsContact CZ-OD2 3.26Å; R241-D811 IonicContact NE-OD1 2.73Å; R241-D811 PolarHBondContact NE-OD1 2.95Å; R241-D811 VanDerWaalsContact NE-OD1 3.09Å; R241-D811 IonicContact NE-OD2 3.52Å; R241-D811 PolarHBondContact NE-OD2 3.33Å; R241-D811 IonicContact NH2-OD2 3.19Å; R241-D811 PolarHBondContact NH2-OD2 3.11Å
242	G	94.8	Very high	85	Confident	43 Å²	43	44.3 Å²	44.3	44%	0.443	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.2	38.5	-178.4	0	0	0	0	0	113.2	K223 L238 R239 T240	K223-G242 WeakPolarHBondContact CB-O 3.41Å; K223-G242 WeakPolarHBondContact CD-O 3.38Å; L238-G242 PolarHBondContact O-N 3.27Å; R239-G242 WeakPolarHBondContact O-CA 3.24Å; R239-G242 PolarHBondContact O-N 3.46Å; T240-G242 PolarHBondContact O-N 3.28Å
243	W	97.2	Very high	82	Confident	9 Å²	9	44 Å²	44	3%	0.034	23%	0.234	C	C	.	.			trans	-103.2	145.8	172.2	-63.3	63.6	0	0	0	111.7	K223 F225 L238 R331 F332 L810	K223-W243 VanDerWaalsContact CA-CE3 3.42Å; K223-W243 HydrophobicContact CB-CB 4.15Å; K223-W243 HydrophobicContact CB-CD2 3.68Å; K223-W243 HydrophobicContact CB-CE3 4.03Å; K223-W243 HydrophobicContact CB-CG 3.72Å; K223-W243 HydrophobicContact CD-CG 4.35Å; K223-W243 HydrophobicContact CG-CD2 4.09Å; K223-W243 HydrophobicContact CG-CG 4.22Å; K223-W243 HydrophobicContact CG-CZ2 4.48Å; K223-W243 CarbonylContact O-C 3.59Å; K223-W243 WeakPolarHBondContact O-CA 3.46Å; K223-W243 WeakPolarHBondContact O-CB 3.31Å; F225-W243 HydrophobicContact CB-CE3 4Å; F225-W243 HydrophobicContact CD1-CB 3.58Å; F225-W243 HydrophobicContact CE1-CB 3.98Å; L238-W243 HydrophobicContact CB-CB 4.24Å; L238-W243 HydrophobicContact CD2-CD2 4.35Å; L238-W243 HydrophobicContact CD2-CG 4.37Å; L238-W243 WeakPolarHBondContact O-CB 3.32Å; L238-W243 PolarHBondContact O-N 3.03Å; L238-W243 VanDerWaalsContact O-N 3.08Å; W243-R331 HydrophobicContact CH2-CG 4.26Å; W243-R331 HydrophobicContact CZ3-CB 4.13Å; W243-R331 HydrophobicContact CZ3-CG 4.28Å; W243-F332 HydrophobicContact CE3-CB 4.23Å; W243-F332 HydrophobicContact CH2-CB 3.99Å; W243-F332 HydrophobicContact CZ3-CB 3.51Å; W243-L810 HydrophobicContact CH2-CD1 4.46Å; W243-L810 HydrophobicContact CH2-CD2 4.09Å; W243-L810 HydrophobicContact CZ2-CD1 3.84Å; W243-L810 HydrophobicContact CZ2-CD2 3.95Å; W243-L810 HydrophobicContact CZ2-CG 4.45Å
244	I	97.4	Very high	79.1	Confident	10 Å²	10	45.4 Å²	45.4	5%	0.051	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	136.1	177.7	-65.5	-177.3	0	0	0	110.8	E214 V215 A218 K223 I224 F225 L321 V325	E214-I244 HydrophobicContact CB-CD1 4.32Å; V215-I244 HydrophobicContact CB-CD1 4.22Å; V215-I244 HydrophobicContact CG2-CD1 3.56Å; A218-I244 HydrophobicContact CB-CB 4.21Å; A218-I244 HydrophobicContact CB-CD1 3.59Å; A218-I244 HydrophobicContact CB-CG1 3.77Å; K223-I244 PolarHBondContact O-N 3.12Å; I224-I244 WeakPolarHBondContact CA-O 3.44Å; F225-I244 WeakPolarHBondContact CD1-O 3.33Å; F225-I244 VanDerWaalsContact CE1-C 3.47Å; F225-I244 PolarHBondContact N-O 2.94Å; I244-L321 HydrophobicContact CD1-CD1 4.44Å; I244-L321 HydrophobicContact CD1-CD2 4.18Å; I244-L321 HydrophobicContact CG1-CD1 4.42Å; I244-L321 HydrophobicContact CG2-CB 3.84Å; I244-V325 HydrophobicContact CG2-CG1 3.92Å; I244-V325 HydrophobicContact CG2-CG2 3.87Å
245	E	96.7	Very high	76.2	Confident	6 Å²	6	49 Å²	49	3%	0.028	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	139.3	-179	-163.8	162.6	-169.4	0	0	111.8	F225 R235 R239 F247 S322	F225-E245 HydrophobicContact CD1-CB 4.33Å; F225-E245 HydrophobicContact CD2-CG 4.2Å; F225-E245 HydrophobicContact CE1-CB 3.71Å; F225-E245 HydrophobicContact CE1-CG 4.34Å; F225-E245 HydrophobicContact CE2-CB 3.9Å; F225-E245 HydrophobicContact CE2-CG 3.61Å; F225-E245 HydrophobicContact CZ-CB 3.47Å; F225-E245 VanDerWaalsContact CZ-CB 3.47Å; F225-E245 HydrophobicContact CZ-CG 3.73Å; F225-E245 CarbonylContact O-C 3.54Å; R235-E245 WeakPolarHBondContact CD-OE2 3.27Å; R235-E245 WeakPolarHBondContact CG-OE2 3.45Å; R235-E245 IonicContact CZ-OE1 3.5Å; R235-E245 VanDerWaalsContact NE-CD 3.32Å; R235-E245 IonicContact NE-OE1 3.4Å; R235-E245 PolarHBondContact NE-OE1 3.16Å; R235-E245 IonicContact NE-OE2 3.32Å; R235-E245 PolarHBondContact NE-OE2 3.41Å; R235-E245 IonicContact NH2-OE1 2.72Å; R235-E245 PolarHBondContact NH2-OE1 3.21Å; R239-E245 IonicContact CZ-OE2 2.7Å; R239-E245 IonicContact NE-OE2 3.76Å; R239-E245 PolarHBondContact NE-OE2 3.17Å; R239-E245 IonicContact NH2-OE2 2.73Å; R239-E245 PolarHBondContact NH2-OE2 3.23Å; E245-F247 HydrophobicContact CB-CE1 4.33Å; E245-F247 HydrophobicContact CB-CZ 4.26Å; E245-F247 HydrophobicContact CG-CD1 4.05Å; E245-F247 HydrophobicContact CG-CE1 3.68Å; E245-F247 HydrophobicContact CG-CZ 4.11Å; E245-F247 WeakPolarHBondContact OE2-CE1 3.47Å; E245-S322 WeakPolarHBondContact O-CA 3.48Å; E245-S322 VanDerWaalsContact O-CB 3.24Å; E245-S322 WeakPolarHBondContact O-CB 3.35Å; E245-S322 PolarHBondContact O-OG 3.29Å
246	K	94.8	Very high	73.4	Confident	22 Å²	22	55.4 Å²	55.4	10%	0.096	33%	0.325	C	S	.	.			trans	-112.7	108.9	168.3	-172	-177	-172.2	178	0	109.6	I224 F225 S226 D248 V325 R326 E328	I224-K246 HydrophobicContact CG2-CB 4.41Å; F225-K246 PolarHBondContact O-N 3.23Å; S226-K246 WeakPolarHBondContact CB-O 3.21Å; S226-K246 PolarHBondContact OG-O 3.23Å; K246-D248 WeakPolarHBondContact CE-O 3.5Å; K246-V325 HydrophobicContact CB-CG2 4.25Å; K246-R326 VanDerWaalsContact CE-O 3.25Å; K246-R326 WeakPolarHBondContact CE-O 3.36Å; K246-R326 PolarHBondContact NZ-O 2.79Å; K246-E328 PolarHBondContact NZ-O 2.92Å
247	F	89.3	Confident	70.3	Confident	49 Å²	49	51.1 Å²	51.1	22%	0.215	31%	0.311	C	S	.	.			trans	-75	-31.4	177.9	-55.2	-64.6	0	0	0	113	E245 V249 P310 W311 S322	E245-F247 HydrophobicContact CB-CE1 4.33Å; E245-F247 HydrophobicContact CB-CZ 4.26Å; E245-F247 HydrophobicContact CG-CD1 4.05Å; E245-F247 HydrophobicContact CG-CE1 3.68Å; E245-F247 HydrophobicContact CG-CZ 4.11Å; E245-F247 WeakPolarHBondContact OE2-CE1 3.47Å; F247-V249 VanDerWaalsContact O-CG2 3.3Å; F247-V249 WeakPolarHBondContact O-CG2 3.33Å; F247-V249 PolarHBondContact O-N 3.32Å; F247-P310 HydrophobicContact CE1-CB 3.67Å; F247-P310 HydrophobicContact CZ-CB 4.14Å; F247-P310 VanDerWaalsContact CZ-O 3.26Å; F247-P310 WeakPolarHBondContact CZ-O 3.19Å; F247-W311 HydrophobicContact CD1-CE3 4.46Å; F247-W311 HydrophobicContact CD2-CB 3.79Å; F247-W311 HydrophobicContact CE2-CB 3.53Å; F247-W311 HydrophobicContact CG-CE3 4.48Å; F247-W311 HydrophobicContact CZ-CB 4.02Å; F247-S322 VanDerWaalsContact CD2-OG 3.28Å; F247-S322 WeakPolarHBondContact CD2-OG 3.29Å; F247-S322 PolarHBondContact N-OG 2.87Å
248	D	67.6	Low	67.5	Low	72 Å²	72	55 Å²	55	39%	0.385	33%	0.334	S	S	.	.			trans	-79.2	97.1	178.2	-78.2	-30.7	0	0	0	112	K246 R326	K246-D248 WeakPolarHBondContact CE-O 3.5Å; D248-R326 IonicContact OD1-NH2 3.42Å; D248-R326 IonicContact OD2-CZ 2.8Å; D248-R326 IonicContact OD2-NE 3.59Å; D248-R326 PolarHBondContact OD2-NE 2.91Å; D248-R326 IonicContact OD2-NH2 2.91Å; D248-R326 PolarHBondContact OD2-NH2 2.72Å
249	V	60.2	Low	64.5	Low	27 Å²	27	62.1 Å²	62.1	16%	0.164	37%	0.368	C	S	.	.			trans	-123.4	72.5	-177.6	-105.1	0	0	0	0	113.5	S226 L228 F247 I251 P330	S226-V249 WeakPolarHBondContact OG-CG1 3.48Å; S226-V249 WeakPolarHBondContact OG-CG2 3.42Å; L228-V249 HydrophobicContact CD2-CB 4.32Å; L228-V249 HydrophobicContact CD2-CG2 3.51Å; L228-V249 HydrophobicContact CG-CG2 4.27Å; F247-V249 VanDerWaalsContact O-CG2 3.3Å; F247-V249 WeakPolarHBondContact O-CG2 3.33Å; F247-V249 PolarHBondContact O-N 3.32Å; V249-I251 VanDerWaalsContact C-N 3.34Å; V249-I251 HydrophobicContact CB-CD1 4.03Å; V249-I251 HydrophobicContact CB-CG1 3.78Å; V249-I251 HydrophobicContact CG1-CD1 3.85Å; V249-I251 HydrophobicContact CG1-CG1 3.64Å; V249-I251 PolarHBondContact O-N 2.84Å; V249-I251 VanDerWaalsContact O-N 3.14Å; V249-P330 HydrophobicContact CG1-CG 4.27Å
250	N	50.1	Low	61.6	Low	123 Å²	123	66.9 Å²	66.9	66%	0.658	39%	0.391	S	S	*	.			trans	-69.6	95.3	147.9	-70.6	-43.9	0	0	0	107.8
251	I	52.9	Low	58.8	Low	30 Å²	30	63.6 Å²	63.6	15%	0.154	37%	0.373	C	S	.	.			trans	-86.1	-17	179.4	-57.8	177.7	0	0	0	111.7	L228 V249 I333 V341	L228-I251 HydrophobicContact CD1-CD1 3.68Å; V249-I251 VanDerWaalsContact C-N 3.34Å; V249-I251 HydrophobicContact CB-CD1 4.03Å; V249-I251 HydrophobicContact CB-CG1 3.78Å; V249-I251 HydrophobicContact CG1-CD1 3.85Å; V249-I251 HydrophobicContact CG1-CG1 3.64Å; V249-I251 PolarHBondContact O-N 2.84Å; V249-I251 VanDerWaalsContact O-N 3.14Å; I251-I333 HydrophobicContact CD1-CD1 4.31Å; I251-I333 HydrophobicContact CD1-CG2 3.96Å; I251-I333 HydrophobicContact CG2-CD1 4.48Å; I251-V341 HydrophobicContact CD1-CG2 4Å; I251-V341 HydrophobicContact CG2-CG1 3.84Å
252	G	37.4	Very low	55.9	Low	31 Å²	31	66.5 Å²	66.5	32%	0.32	39%	0.387	S	S	.	.	S	Bend	trans	-80.6	179.4	168.3	0	0	0	0	0	114
253	P	29.1	Very low	53.1	Low	40 Å²	40	70.9 Å²	70.9	26%	0.26	39%	0.393	S	S	.	.			trans	-59.7	145.5	-179.8	-26.3	36.7	0	0	0	113.9	G255 Q256 N345	P253-G255 PolarHBondContact O-N 2.64Å; P253-Q256 PolarHBondContact O-N 3.12Å; P253-N345 WeakPolarHBondContact CG-ND2 3.47Å
254	P	31	Very low	50.1	Low	141 Å²	141	73.4 Å²	73.4	92%	0.916	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	105.6	173.6	-21.8	33.1	0	0	0	111.4
255	G	34.8	Very low	47.1	Very low	75 Å²	75	77.7 Å²	77.7	77%	0.773	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	122.4	-24.7	-178.8	0	0	0	0	0	114.4	P253 T257	P253-G255 PolarHBondContact O-N 2.64Å; G255-T257 PolarHBondContact O-N 3.49Å
256	Q	36.2	Very low	43.9	Very low	149 Å²	149	85.2 Å²	85.2	70%	0.696	46%	0.46	S	S	*	.			trans	-96.3	90.6	177.8	-75.7	-179.9	-32.7	0	0	110.8	P253	P253-Q256 PolarHBondContact O-N 3.12Å
257	T	29.6	Very low	40.9	Very low	51 Å²	51	87.7 Å²	87.7	31%	0.313	48%	0.48	S	S	.	.			trans	-104	110	165.6	29.9	0	0	0	0	109.4	G255 K262	G255-T257 PolarHBondContact O-N 3.49Å; T257-K262 HydrophobicContact CG2-CG 4.48Å; T257-K262 VanDerWaalsContact OG1-CE 3.24Å; T257-K262 WeakPolarHBondContact OG1-CE 3.25Å; T257-K262 PolarHBondContact OG1-NZ 2.92Å
258	T	36.9	Very low	38.4	Very low	85 Å²	85	90 Å²	90	52%	0.521	49%	0.494	S	S	.	.			trans	-55.4	148.9	163.4	55.8	0	0	0	0	109.5	E260 S261	T258-E260 PolarHBondContact O-N 3.22Å; T258-S261 PolarHBondContact O-N 2.93Å; T258-S261 PolarHBondContact O-OG 3.05Å; T258-S261 PolarHBondContact OG1-N 3.44Å; T258-S261 PolarHBondContact OG1-OG 3.15Å
259	Q	33.5	Very low	36.8	Very low	151 Å²	151	90.7 Å²	90.7	71%	0.706	50%	0.5	S	S	*	.	H	α-helix	trans	-61.3	-29.5	175.6	-67.2	-165.9	8.4	0	0	111.5	K262 K263	Q259-K262 WeakPolarHBondContact O-CB 3.5Å; Q259-K262 PolarHBondContact O-N 3.45Å; Q259-K263 WeakPolarHBondContact O-CG 3.33Å; Q259-K263 PolarHBondContact O-N 2.6Å
260	E	34.8	Very low	35.2	Very low	133 Å²	133	95.1 Å²	95.1	62%	0.621	52%	0.523	S	S	*	.	H	α-helix	trans	-66	-45.4	178.5	-58.6	-171.8	122.9	0	0	113.6	T258 K262 K263 T264	T258-E260 PolarHBondContact O-N 3.22Å; E260-K262 PolarHBondContact O-N 3.43Å; E260-K263 CarbonylContact O-C 3.44Å; E260-K263 WeakPolarHBondContact O-CA 3.38Å; E260-K263 WeakPolarHBondContact O-CB 3.5Å; E260-K263 PolarHBondContact O-N 3.28Å; E260-T264 PolarHBondContact O-N 2.99Å; E260-T264 PolarHBondContact O-OG1 2.99Å
261	S	36	Very low	34.2	Very low	43 Å²	43	92.9 Å²	92.9	30%	0.301	51%	0.514	S	S	.	.	H	α-helix	trans	-60.2	-35.4	176.3	52.3	0	0	0	0	111.7	T258 I265	T258-S261 PolarHBondContact O-N 2.93Å; T258-S261 PolarHBondContact O-OG 3.05Å; T258-S261 PolarHBondContact OG1-N 3.44Å; T258-S261 PolarHBondContact OG1-OG 3.15Å; S261-I265 WeakPolarHBondContact O-CG1 3.31Å; S261-I265 PolarHBondContact O-N 3.43Å
262	K	34.6	Very low	32.9	Very low	107 Å²	107	100.3 Å²	100.3	47%	0.465	55%	0.545	S	S	.	.	H	α-helix	trans	-69.2	-36.9	169.3	-77.5	165.8	167.4	159.4	0	113.2	T257 Q259 E260 R266	T257-K262 HydrophobicContact CG2-CG 4.48Å; T257-K262 VanDerWaalsContact OG1-CE 3.24Å; T257-K262 WeakPolarHBondContact OG1-CE 3.25Å; T257-K262 PolarHBondContact OG1-NZ 2.92Å; Q259-K262 WeakPolarHBondContact O-CB 3.5Å; Q259-K262 PolarHBondContact O-N 3.45Å; E260-K262 PolarHBondContact O-N 3.43Å; K262-R266 WeakPolarHBondContact O-CB 3.32Å; K262-R266 VanDerWaalsContact O-CG 3.25Å; K262-R266 WeakPolarHBondContact O-CG 3.43Å; K262-R266 PolarHBondContact O-N 3.04Å
263	K	34.3	Very low	32.4	Very low	135 Å²	135	105.4 Å²	105.4	59%	0.587	57%	0.57	S	S	*	*	H	α-helix	trans	-64.8	-44.6	174.8	-77.3	176.1	178.7	178.8	0	111.6	Q259 E260 I265 R266 S267	Q259-K263 WeakPolarHBondContact O-CG 3.33Å; Q259-K263 PolarHBondContact O-N 2.6Å; E260-K263 CarbonylContact O-C 3.44Å; E260-K263 WeakPolarHBondContact O-CA 3.38Å; E260-K263 WeakPolarHBondContact O-CB 3.5Å; E260-K263 PolarHBondContact O-N 3.28Å; K263-I265 PolarHBondContact O-N 2.66Å; K263-R266 CarbonylContact O-C 3.59Å; K263-R266 WeakPolarHBondContact O-CA 3.47Å; K263-R266 WeakPolarHBondContact O-CB 3.39Å; K263-R266 PolarHBondContact O-N 3.21Å; K263-R266 VanDerWaalsContact O-N 3.14Å; K263-S267 PolarHBondContact O-N 3.14Å; K263-S267 PolarHBondContact O-OG 3.45Å
264	T	34.3	Very low	32.5	Very low	61 Å²	61	109.9 Å²	109.9	37%	0.374	60%	0.596	S	S	.	*	H	α-helix	trans	-64.6	-40.7	179.9	-53.3	0	0	0	0	112.4	E260 R266 S267 I268	E260-T264 PolarHBondContact O-N 2.99Å; E260-T264 PolarHBondContact O-OG1 2.99Å; T264-R266 VanDerWaalsContact C-N 3.32Å; T264-S267 WeakPolarHBondContact CA-OG 3.4Å; T264-S267 PolarHBondContact O-N 3.46Å; T264-S267 PolarHBondContact O-OG 2.75Å; T264-I268 HydrophobicContact CG2-CD1 4.46Å; T264-I268 WeakPolarHBondContact O-CG1 3.23Å; T264-I268 PolarHBondContact O-N 3.23Å
265	I	35	Very low	32.2	Very low	100 Å²	100	114.2 Å²	114.2	51%	0.513	59%	0.594	S	S	.	*	H	α-helix	trans	-67.3	-35.5	174.1	-65.8	168.4	0	0	0	110.9	S261 K263 T269	S261-I265 WeakPolarHBondContact O-CG1 3.31Å; S261-I265 PolarHBondContact O-N 3.43Å; K263-I265 PolarHBondContact O-N 2.66Å; I265-T269 PolarHBondContact O-N 2.66Å; I265-T269 PolarHBondContact O-OG1 2.66Å
266	R	28.9	Very low	31.8	Very low	165 Å²	165	118 Å²	118	62%	0.623	60%	0.597	S	S	*	*	H	α-helix	trans	-69.7	-36.1	173	-76.6	173.4	173.2	-176.1	-4.7	113.8	K262 K263 T264 I268 T269 N270	K262-R266 WeakPolarHBondContact O-CB 3.32Å; K262-R266 VanDerWaalsContact O-CG 3.25Å; K262-R266 WeakPolarHBondContact O-CG 3.43Å; K262-R266 PolarHBondContact O-N 3.04Å; K263-R266 CarbonylContact O-C 3.59Å; K263-R266 WeakPolarHBondContact O-CA 3.47Å; K263-R266 WeakPolarHBondContact O-CB 3.39Å; K263-R266 PolarHBondContact O-N 3.21Å; K263-R266 VanDerWaalsContact O-N 3.14Å; T264-R266 VanDerWaalsContact C-N 3.32Å; R266-I268 VanDerWaalsContact C-N 3.33Å; R266-T269 WeakPolarHBondContact CA-OG1 3.2Å; R266-T269 PolarHBondContact O-N 3.2Å; R266-T269 VanDerWaalsContact O-N 3.13Å; R266-T269 PolarHBondContact O-OG1 2.9Å; R266-N270 WeakPolarHBondContact O-CB 3.46Å; R266-N270 PolarHBondContact O-N 2.91Å
267	S	32.9	Very low	31.6	Very low	73 Å²	73	116.1 Å²	116.1	51%	0.51	60%	0.6	S	S	.	*	H	α-helix	trans	-69.8	-31.3	177.2	55.1	0	0	0	0	112.5	K263 T264 T269 V271	K263-S267 PolarHBondContact O-N 3.14Å; K263-S267 PolarHBondContact O-OG 3.45Å; T264-S267 WeakPolarHBondContact CA-OG 3.4Å; T264-S267 PolarHBondContact O-N 3.46Å; T264-S267 PolarHBondContact O-OG 2.75Å; S267-T269 PolarHBondContact O-N 3.02Å; S267-V271 VanDerWaalsContact O-CG2 3.31Å; S267-V271 WeakPolarHBondContact O-CG2 3.45Å
268	I	37.1	Very low	31.5	Very low	99 Å²	99	121.6 Å²	121.6	51%	0.508	63%	0.628	S	S	.	*	H	α-helix	trans	-68.7	-23.4	171.6	-67	165.7	0	0	0	111.5	T264 R266	T264-I268 HydrophobicContact CG2-CD1 4.46Å; T264-I268 WeakPolarHBondContact O-CG1 3.23Å; T264-I268 PolarHBondContact O-N 3.23Å; R266-I268 VanDerWaalsContact C-N 3.33Å
269	T	33	Very low	31.2	Very low	85 Å²	85	123.7 Å²	123.7	52%	0.521	65%	0.646	S	S	.	*	H	α-helix	trans	-107.1	-17.1	-174.8	42.9	0	0	0	0	115.3	I265 R266 S267	I265-T269 PolarHBondContact O-N 2.66Å; I265-T269 PolarHBondContact O-OG1 2.66Å; R266-T269 WeakPolarHBondContact CA-OG1 3.2Å; R266-T269 PolarHBondContact O-N 3.2Å; R266-T269 VanDerWaalsContact O-N 3.13Å; R266-T269 PolarHBondContact O-OG1 2.9Å; S267-T269 PolarHBondContact O-N 3.02Å
270	N	26.7	Very low	30.9	Very low	120 Å²	120	122.1 Å²	122.1	64%	0.642	65%	0.651	S	S	*	*			trans	-114.5	39.4	-175.1	-73.6	-3.5	0	0	0	114	R266 K272	R266-N270 WeakPolarHBondContact O-CB 3.46Å; R266-N270 PolarHBondContact O-N 2.91Å; N270-K272 PolarHBondContact O-N 2.93Å
271	V	29.9	Very low	30.8	Very low	76 Å²	76	121.4 Å²	121.4	46%	0.461	66%	0.661	S	S	.	*			trans	-77.6	57.1	175.2	-166.1	0	0	0	0	111.7	S267 V301	S267-V271 VanDerWaalsContact O-CG2 3.31Å; S267-V271 WeakPolarHBondContact O-CG2 3.45Å; V271-V301 HydrophobicContact CG2-CG1 4.15Å
272	K	25.7	Very low	30.5	Very low	187 Å²	187	127 Å²	127	81%	0.813	69%	0.687	S	S	*	*	S	Bend	trans	-138.2	121.6	166.3	-72.3	-172.4	178.2	178.4	0	110.1	N270	N270-K272 PolarHBondContact O-N 2.93Å
273	T	25.4	Very low	30.2	Very low	137 Å²	137	129.4 Å²	129.4	84%	0.84	71%	0.705	S	S	*	*			trans	50.2	92	163.2	54.6	0	0	0	0	119
274	V	31	Very low	29.9	Very low	134 Å²	134	127.3 Å²	127.3	81%	0.812	70%	0.704	S	S	*	*			trans	-141.8	134.5	130.7	-178.8	0	0	0	0	108.9
275	R	25.9	Very low	29.7	Very low	232 Å²	232	131 Å²	131	88%	0.875	73%	0.727	S	S	*	*			trans	-123.9	151.9	157.1	-89.4	-177.5	171.3	167.5	-4.2	107.1
276	N	26.3	Very low	29.3	Very low	154 Å²	154	134.8 Å²	134.8	82%	0.824	75%	0.747	S	S	*	*			trans	60.1	107.6	170.9	-60.8	7.9	0	0	0	117.7
277	S	31.8	Very low	29.3	Very low	111 Å²	111	136.1 Å²	136.1	78%	0.776	76%	0.761	S	S	*	*			trans	-164.5	135.6	135.1	27.1	0	0	0	0	109.3
278	N	26.5	Very low	29.1	Very low	166 Å²	166	139.3 Å²	139.3	89%	0.888	77%	0.772	S	S	*	*			trans	-96.7	139.1	175.1	-66.7	-26.3	0	0	0	109.4
279	S	30.9	Very low	28.7	Very low	129 Å²	129	139 Å²	139	90%	0.902	78%	0.779	S	S	*	*			trans	-173.5	160.2	150.1	36.1	0	0	0	0	110.3
280	S	27.2	Very low	28.9	Very low	117 Å²	117	139.4 Å²	139.4	82%	0.818	78%	0.775	S	S	*	*			trans	-132.4	136	-167.5	54.9	0	0	0	0	112.3
281	S	32.5	Very low	29.5	Very low	118 Å²	118	135 Å²	135	83%	0.825	75%	0.751	S	S	*	*			trans	-162.2	138	157.5	51.7	0	0	0	0	110
282	N	29.7	Very low	29.7	Very low	160 Å²	160	133.4 Å²	133.4	86%	0.856	75%	0.75	S	S	*	*			trans	-91	153.5	176.3	-56.6	-25.2	0	0	0	110.3
283	D	30.2	Very low	30.4	Very low	158 Å²	158	125.8 Å²	125.8	85%	0.845	72%	0.718	S	S	*	*			trans	-147.8	149.4	151.8	-158.1	-3.8	0	0	0	109.5
284	T	27.5	Very low	31	Very low	92 Å²	92	119.7 Å²	119.7	56%	0.564	68%	0.681	S	S	*	*			trans	-131.3	115.6	-162.6	53.3	0	0	0	0	113.6
285	T	29.4	Very low	31.2	Very low	139 Å²	139	115.9 Å²	115.9	85%	0.853	66%	0.656	S	S	*	*			trans	-135.8	130	167	52.8	0	0	0	0	111
286	L	26.7	Very low	31.6	Very low	178 Å²	178	106.3 Å²	106.3	93%	0.932	62%	0.622	S	S	*	*			trans	-88.2	112.8	-173.2	-67.7	161.1	0	0	0	112
287	E	28.1	Very low	32.4	Very low	194 Å²	194	99.8 Å²	99.8	91%	0.907	59%	0.587	S	S	*	*			trans	-130.4	163.1	157.8	-69.4	-161.4	161	0	0	110.6
288	D	29.9	Very low	32.5	Very low	140 Å²	140	98.8 Å²	98.8	75%	0.749	58%	0.576	S	S	*	*			trans	-62.9	147.5	-157.3	-78.5	-39.6	0	0	0	116
289	S	27.9	Very low	32.9	Very low	93 Å²	93	96.3 Å²	96.3	65%	0.65	56%	0.563	S	S	*	*			trans	-76.6	124.6	-171.7	57.7	0	0	0	0	115.3
290	E	37.4	Very low	33.2	Very low	93 Å²	93	91 Å²	91	44%	0.435	53%	0.527	S	S	.	.			trans	-150.7	131.1	176.3	-96.9	158.8	178.5	0	0	115.5	K338	E290-K338 HydrophobicContact CB-CD 4.29Å; E290-K338 VanDerWaalsContact CD-CD 3.48Å; E290-K338 HydrophobicContact CG-CD 3.88Å; E290-K338 WeakPolarHBondContact OE1-CE 3.36Å; E290-K338 IonicContact OE1-NZ 2.71Å; E290-K338 PolarHBondContact OE1-NZ 3.48Å; E290-K338 WeakPolarHBondContact OE2-CD 3.47Å; E290-K338 VanDerWaalsContact OE2-CE 3.28Å; E290-K338 WeakPolarHBondContact OE2-CE 3.23Å; E290-K338 IonicContact OE2-NZ 3.43Å; E290-K338 PolarHBondContact OE2-NZ 3.32Å
291	D	40.2	Very low	33.7	Very low	27 Å²	27	87.6 Å²	87.6	14%	0.144	50%	0.501	C	S	.	.			trans	46.2	66.3	147.9	-58.1	-24.7	0	0	0	119.2	D293 T361 S783	D291-D293 PolarHBondContact O-N 2.96Å; D291-T361 PolarHBondContact OD1-OG1 3.45Å; D291-S783 WeakPolarHBondContact CB-OG 3.47Å; D291-S783 WeakPolarHBondContact OD1-CB 3.11Å
292	G	32.7	Very low	33.8	Very low	43 Å²	43	86.2 Å²	86.2	44%	0.443	48%	0.484	S	S	.	.			trans	-87	29.2	179.6	0	0	0	0	0	117.2	S600	G292-S600 WeakPolarHBondContact O-CB 3.38Å; G292-S600 PolarHBondContact O-OG 2.86Å
293	D	42	Very low	34.3	Very low	27 Å²	27	84.4 Å²	84.4	14%	0.144	47%	0.471	C	S	.	.			trans	-87.9	-13.5	-168.1	-79.2	-43.2	0	0	0	116.5	D291 S600 R601 S783	D291-D293 PolarHBondContact O-N 2.96Å; D293-S600 WeakPolarHBondContact OD1-CB 3.34Å; D293-R601 PolarHBondContact O-NH2 3.3Å; D293-S783 WeakPolarHBondContact CB-O 3.38Å; D293-S783 WeakPolarHBondContact OD2-CB 3.48Å; D293-S783 PolarHBondContact OD2-N 2.99Å; D293-S783 PolarHBondContact OD2-OG 3.37Å
294	S	38.1	Very low	35.1	Very low	8 Å²	8	79.6 Å²	79.6	6%	0.056	44%	0.443	C	S	.	.			trans	-112.8	36.3	-158.3	60.1	0	0	0	0	117.5	L336 R337	S294-L336 PolarHBondContact OG-O 3.34Å; S294-L336 VanDerWaalsContact OG-O 3.12Å; S294-R337 VanDerWaalsContact C-NH2 3.26Å; S294-R337 PolarHBondContact O-NH2 3.13Å; S294-R337 WeakPolarHBondContact OG-CG 3.24Å; S294-R337 PolarHBondContact OG-NE 3.1Å
295	D	34.6	Very low	35.8	Very low	54 Å²	54	81.4 Å²	81.4	29%	0.289	44%	0.443	S	S	.	.			trans	-80.9	-2.7	171	-53.1	-50.8	0	0	0	114.6	V298 R337 R601 R603	D295-V298 WeakPolarHBondContact O-CB 3.49Å; D295-V298 WeakPolarHBondContact O-CG2 3.45Å; D295-R337 IonicContact OD1-CZ 2.67Å; D295-R337 IonicContact OD1-NH1 3.51Å; D295-R337 PolarHBondContact OD1-NH1 3.38Å; D295-R337 IonicContact OD1-NH2 2.98Å; D295-R337 PolarHBondContact OD1-NH2 3.08Å; D295-R601 VanDerWaalsContact N-NH2 3.15Å; D295-R601 IonicContact OD2-NE 2.73Å; D295-R603 IonicContact OD2-NH1 3.85Å; D295-R603 IonicContact OD2-NH2 3.43Å; D295-R603 PolarHBondContact OD2-NH2 3.08Å
296	D	34.4	Very low	36.7	Very low	31 Å²	31	83.7 Å²	83.7	17%	0.166	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-26.2	-175.8	-77.4	-38.4	0	0	0	114.3	V298 N299 R601	D296-V298 PolarHBondContact O-N 2.83Å; D296-N299 PolarHBondContact O-N 3.05Å; D296-R601 IonicContact OD1-CZ 3.12Å; D296-R601 IonicContact OD1-NH1 2.66Å; D296-R601 PolarHBondContact OD1-NH1 3.33Å; D296-R601 IonicContact OD1-NH2 3.2Å; D296-R601 IonicContact OD2-CZ 3.11Å; D296-R601 IonicContact OD2-NH1 2.66Å; D296-R601 PolarHBondContact OD2-NH1 3.43Å; D296-R601 IonicContact OD2-NH2 3.88Å; D296-R601 PolarHBondContact OD2-NH2 2.83Å
297	D	41.9	Very low	38.4	Very low	17 Å²	17	81 Å²	81	9%	0.091	42%	0.422	C	S	.	.	H	α-helix	trans	-59.1	-19.3	176.7	-80.4	10.8	0	0	0	112.2	P230 N299 A300 V301 L336	P230-D297 WeakPolarHBondContact CD-OD2 3.41Å; P230-D297 HydrophobicContact CG-CB 3.96Å; P230-D297 WeakPolarHBondContact CG-OD2 3.44Å; D297-N299 PolarHBondContact O-N 3.32Å; D297-A300 WeakPolarHBondContact O-CA 3.35Å; D297-A300 WeakPolarHBondContact O-CB 3.47Å; D297-A300 PolarHBondContact O-N 3.03Å; D297-V301 PolarHBondContact O-N 2.94Å; D297-V301 VanDerWaalsContact O-N 3.12Å; D297-L336 HydrophobicContact CB-CD2 4.07Å; D297-L336 WeakPolarHBondContact OD2-CD1 3.29Å
298	V	35.5	Very low	40.7	Very low	90 Å²	90	76.2 Å²	76.2	55%	0.545	41%	0.406	S	S	.	.	H	α-helix	trans	-61.8	-23.1	174	-174.4	0	0	0	0	112.2	D295 D296	D295-V298 WeakPolarHBondContact O-CB 3.49Å; D295-V298 WeakPolarHBondContact O-CG2 3.45Å; D296-V298 PolarHBondContact O-N 2.83Å
299	N	34	Very low	43.3	Very low	115 Å²	115	72.2 Å²	72.2	62%	0.615	38%	0.382	S	S	*	.	H	α-helix	trans	-80	-31.2	170.2	-77.6	-26.6	0	0	0	112.8	D296 D297 V301 N302	D296-N299 PolarHBondContact O-N 3.05Å; D297-N299 PolarHBondContact O-N 3.32Å; N299-V301 VanDerWaalsContact C-N 3.26Å; N299-V301 PolarHBondContact O-N 3.47Å; N299-N302 WeakPolarHBondContact O-CB 3.36Å; N299-N302 PolarHBondContact O-N 2.96Å; N299-N302 VanDerWaalsContact O-N 3.08Å
300	A	36.6	Very low	46.1	Very low	17 Å²	17	68.6 Å²	68.6	14%	0.14	36%	0.357	C	S	.	.	H	α-helix	trans	-63.1	-33.4	169.6	0	0	0	0	0	111.9	D297 N302 E303 E304	D297-A300 WeakPolarHBondContact O-CA 3.35Å; D297-A300 WeakPolarHBondContact O-CB 3.47Å; D297-A300 PolarHBondContact O-N 3.03Å; A300-N302 PolarHBondContact O-N 2.97Å; A300-N302 VanDerWaalsContact O-N 3.11Å; A300-E303 PolarHBondContact O-N 2.91Å; A300-E304 PolarHBondContact O-N 2.97Å
301	V	38.6	Very low	48.5	Very low	45 Å²	45	68.5 Å²	68.5	27%	0.273	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-20.7	172.7	-179.9	0	0	0	0	112.7	V271 D297 N299	V271-V301 HydrophobicContact CG2-CG1 4.15Å; D297-V301 PolarHBondContact O-N 2.94Å; D297-V301 VanDerWaalsContact O-N 3.12Å; N299-V301 VanDerWaalsContact C-N 3.26Å; N299-V301 PolarHBondContact O-N 3.47Å
302	N	33.5	Very low	50.7	Low	89 Å²	89	71.8 Å²	71.8	48%	0.476	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-27	173.8	-77.9	-55.6	0	0	0	113.6	N299 A300 K305	N299-N302 WeakPolarHBondContact O-CB 3.36Å; N299-N302 PolarHBondContact O-N 2.96Å; N299-N302 VanDerWaalsContact O-N 3.08Å; A300-N302 PolarHBondContact O-N 2.97Å; A300-N302 VanDerWaalsContact O-N 3.11Å; N302-K305 PolarHBondContact OD1-NZ 3.48Å
303	E	41	Very low	53.4	Low	123 Å²	123	72 Å²	72	58%	0.575	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-25.9	171.2	-66.9	-173.4	173.6	0	0	113.1	A300 K305 Q306 R307	A300-E303 PolarHBondContact O-N 2.91Å; E303-K305 PolarHBondContact O-N 3.41Å; E303-Q306 PolarHBondContact O-N 2.86Å; E303-R307 IonicContact OE2-CZ 3.71Å; E303-R307 IonicContact OE2-NH1 3.25Å; E303-R307 IonicContact OE2-NH2 3.88Å; E303-R307 PolarHBondContact OE2-NH2 3.42Å
304	E	46.5	Very low	55.6	Low	57 Å²	57	74 Å²	74	27%	0.266	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-61.4	-11.8	-179.8	-72	-171.8	139.4	0	0	114	A300 Q306 R307	A300-E304 PolarHBondContact O-N 2.97Å; E304-Q306 PolarHBondContact O-N 3.25Å; E304-R307 PolarHBondContact O-N 2.84Å
305	K	42.8	Very low	57.8	Low	129 Å²	129	79.9 Å²	79.9	56%	0.561	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-60.6	-11.1	177.2	-64.4	172.7	-167.8	152.7	0	115	N302 E303	N302-K305 PolarHBondContact OD1-NZ 3.48Å; E303-K305 PolarHBondContact O-N 3.41Å
306	Q	48	Very low	60.3	Low	187 Å²	187	78.5 Å²	78.5	87%	0.874	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-119.7	3.8	172.5	-68.4	-175.8	-11.9	0	0	113.9	E303 E304	E303-Q306 PolarHBondContact O-N 2.86Å; E304-Q306 PolarHBondContact O-N 3.25Å
307	R	63.5	Low	63.1	Low	122 Å²	122	77.9 Å²	77.9	46%	0.46	39%	0.392	S	S	.	.	S	Bend	trans	-93.3	131.6	-179.1	-67.2	-174.4	179.7	136.6	11	111.1	E303 E304	E303-R307 IonicContact OE2-CZ 3.71Å; E303-R307 IonicContact OE2-NH1 3.25Å; E303-R307 IonicContact OE2-NH2 3.88Å; E303-R307 PolarHBondContact OE2-NH2 3.42Å; E304-R307 PolarHBondContact O-N 2.84Å
308	V	76.5	Confident	65.5	Low	94 Å²	94	80.2 Å²	80.2	57%	0.57	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-58.8	138.9	169.8	178.2	0	0	0	0	109.1	E312	V308-E312 HydrophobicContact CG1-CB 3.52Å
309	Q	84.4	Confident	68.2	Low	55 Å²	55	76.2 Å²	76.2	26%	0.257	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-69.8	148.3	-177	-65.8	-67.7	-35.4	0	0	111.5	W311 E312 E313	Q309-W311 HydrophobicContact CB-CD2 3.84Å; Q309-W311 VanDerWaalsContact CB-CE2 3.4Å; Q309-W311 HydrophobicContact CB-CE3 4.23Å; Q309-W311 HydrophobicContact CB-CG 4.42Å; Q309-W311 HydrophobicContact CB-CH2 3.9Å; Q309-W311 HydrophobicContact CB-CZ2 3.46Å; Q309-W311 VanDerWaalsContact CB-CZ2 3.46Å; Q309-W311 HydrophobicContact CB-CZ3 4.25Å; Q309-W311 HydrophobicContact CG-CH2 3.92Å; Q309-W311 HydrophobicContact CG-CZ2 3.5Å; Q309-W311 PolarHBondContact O-N 2.75Å; Q309-W311 VanDerWaalsContact OE1-CH2 3.23Å; Q309-E312 HydrophobicContact CB-CB 4.46Å; Q309-E312 WeakPolarHBondContact CB-OE2 3.37Å; Q309-E312 PolarHBondContact N-OE2 3.37Å; Q309-E312 WeakPolarHBondContact O-CA 3.27Å; Q309-E312 PolarHBondContact O-N 2.8Å; Q309-E313 PolarHBondContact O-N 3.07Å; Q309-E313 VanDerWaalsContact O-N 3.16Å
310	P	86.3	Confident	70.9	Confident	18 Å²	18	72.1 Å²	72.1	12%	0.117	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-16.6	-175.5	-31.1	38.3	0	0	0	117	R239 F247	R239-P310 PolarHBondContact NH2-O 3.38Å; R239-P310 VanDerWaalsContact NH2-O 3.08Å; F247-P310 HydrophobicContact CE1-CB 3.67Å; F247-P310 HydrophobicContact CZ-CB 4.14Å; F247-P310 VanDerWaalsContact CZ-O 3.26Å; F247-P310 WeakPolarHBondContact CZ-O 3.19Å
311	W	87.6	Confident	73.7	Confident	90 Å²	90	71.6 Å²	71.6	34%	0.341	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-16.5	175	59.1	75.1	0	0	0	114.2	F247 Q309 G316 G319	F247-W311 HydrophobicContact CD1-CE3 4.46Å; F247-W311 HydrophobicContact CD2-CB 3.79Å; F247-W311 HydrophobicContact CE2-CB 3.53Å; F247-W311 HydrophobicContact CG-CE3 4.48Å; F247-W311 HydrophobicContact CZ-CB 4.02Å; Q309-W311 HydrophobicContact CB-CD2 3.84Å; Q309-W311 VanDerWaalsContact CB-CE2 3.4Å; Q309-W311 HydrophobicContact CB-CE3 4.23Å; Q309-W311 HydrophobicContact CB-CG 4.42Å; Q309-W311 HydrophobicContact CB-CH2 3.9Å; Q309-W311 HydrophobicContact CB-CZ2 3.46Å; Q309-W311 VanDerWaalsContact CB-CZ2 3.46Å; Q309-W311 HydrophobicContact CB-CZ3 4.25Å; Q309-W311 HydrophobicContact CG-CH2 3.92Å; Q309-W311 HydrophobicContact CG-CZ2 3.5Å; Q309-W311 PolarHBondContact O-N 2.75Å; Q309-W311 VanDerWaalsContact OE1-CH2 3.23Å; W311-G316 WeakPolarHBondContact O-CA 3.29Å; W311-G319 WeakPolarHBondContact O-CA 3.21Å; W311-G319 PolarHBondContact O-N 2.82Å; W311-G319 VanDerWaalsContact O-N 3.07Å
312	E	87.1	Confident	76.4	Confident	97 Å²	97	69.7 Å²	69.7	45%	0.453	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-21.3	174.4	-81.1	144.5	-149.2	0	0	112.2	V308 Q309 N315 G316	V308-E312 HydrophobicContact CG1-CB 3.52Å; Q309-E312 HydrophobicContact CB-CB 4.46Å; Q309-E312 WeakPolarHBondContact CB-OE2 3.37Å; Q309-E312 PolarHBondContact N-OE2 3.37Å; Q309-E312 WeakPolarHBondContact O-CA 3.27Å; Q309-E312 PolarHBondContact O-N 2.8Å; E312-N315 PolarHBondContact O-N 3.38Å; E312-G316 PolarHBondContact O-N 3.25Å
313	E	87.5	Confident	79.1	Confident	48 Å²	48	74.3 Å²	74.3	22%	0.224	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.3	141.6	171.5	-71.7	178.5	-164.3	0	0	112.5	R239 Q309 G316 Y317 Y318	R239-E313 IonicContact CZ-OE2 3.85Å; R239-E313 IonicContact NH1-OE2 3.03Å; R239-E313 PolarHBondContact NH1-OE2 2.93Å; R239-E313 IonicContact NH2-OE2 3.14Å; Q309-E313 PolarHBondContact O-N 3.07Å; Q309-E313 VanDerWaalsContact O-N 3.16Å; E313-G316 PolarHBondContact O-N 3.27Å; E313-Y317 PolarHBondContact O-N 2.92Å; E313-Y318 HydrophobicContact CB-CD2 3.69Å; E313-Y318 HydrophobicContact CB-CE2 4.11Å; E313-Y318 WeakPolarHBondContact O-CD2 3.33Å
314	D	88.4	Confident	81.7	Confident	67 Å²	67	71.6 Å²	71.6	36%	0.358	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.5	55	-171.8	-174.7	16.8	0	0	0	113.3	R207 G316 Y317 Y318	R207-D314 IonicContact CZ-OD1 3.37Å; R207-D314 IonicContact CZ-OD2 2.69Å; R207-D314 PolarHBondContact NH1-O 3.48Å; R207-D314 IonicContact NH1-OD1 3.21Å; R207-D314 PolarHBondContact NH1-OD1 3.13Å; R207-D314 VanDerWaalsContact NH1-OD1 3.14Å; R207-D314 IonicContact NH1-OD2 3.78Å; R207-D314 VanDerWaalsContact NH2-CG 3.26Å; R207-D314 IonicContact NH2-OD1 3.09Å; R207-D314 PolarHBondContact NH2-OD1 2.91Å; R207-D314 IonicContact NH2-OD2 2.78Å; R207-D314 PolarHBondContact NH2-OD2 3.16Å; D314-G316 PolarHBondContact O-N 3.16Å; D314-G316 VanDerWaalsContact O-N 3.14Å; D314-Y317 WeakPolarHBondContact O-CB 3.26Å; D314-Y317 PolarHBondContact O-N 3.41Å; D314-Y318 HydrophobicContact CB-CD2 4.32Å; D314-Y318 HydrophobicContact CB-CE2 3.91Å
315	N	86.1	Confident	83.9	Confident	133 Å²	133	68.9 Å²	68.9	71%	0.711	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	40	177.7	-59.9	-17.9	0	0	0	112.8	E312	E312-N315 PolarHBondContact O-N 3.38Å
316	G	86.2	Confident	86.2	Confident	24 Å²	24	70.1 Å²	70.1	25%	0.247	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.3	5.9	-179.7	0	0	0	0	0	115.9	W311 E312 E313 D314 Y318 G319 L320	W311-G316 WeakPolarHBondContact O-CA 3.29Å; E312-G316 PolarHBondContact O-N 3.25Å; E313-G316 PolarHBondContact O-N 3.27Å; D314-G316 PolarHBondContact O-N 3.16Å; D314-G316 VanDerWaalsContact O-N 3.14Å; G316-Y318 PolarHBondContact O-N 3.27Å; G316-G319 CarbonylContact O-C 3.39Å; G316-G319 WeakPolarHBondContact O-CA 3.26Å; G316-G319 PolarHBondContact O-N 3.45Å; G316-G319 VanDerWaalsContact O-N 3.08Å; G316-L320 PolarHBondContact O-N 3.26Å
317	Y	92.3	Very high	88.2	Confident	19 Å²	19	65.6 Å²	65.6	8%	0.075	32%	0.315	C	S	.	.	H	α-helix	trans	-58.1	-45.1	-177.6	-176.5	-104.7	0	0	0	112.4	A211 E214 E313 D314 G319 L320 L321	A211-Y317 WeakPolarHBondContact CA-OH 3.48Å; A211-Y317 HydrophobicContact CB-CE2 3.8Å; A211-Y317 PolarHBondContact N-OH 2.95Å; E214-Y317 VanDerWaalsContact CD-OH 3.29Å; E214-Y317 PolarHBondContact OE2-OH 2.84Å; E313-Y317 PolarHBondContact O-N 2.92Å; D314-Y317 WeakPolarHBondContact O-CB 3.26Å; D314-Y317 PolarHBondContact O-N 3.41Å; Y317-G319 VanDerWaalsContact C-N 3.31Å; Y317-G319 PolarHBondContact O-N 2.95Å; Y317-L320 WeakPolarHBondContact O-CB 3.3Å; Y317-L320 PolarHBondContact O-N 2.69Å; Y317-L320 VanDerWaalsContact O-N 3.13Å; Y317-L321 HydrophobicContact CD1-CD1 3.99Å; Y317-L321 HydrophobicContact CD1-CG 4.33Å; Y317-L321 HydrophobicContact CE1-CD1 3.58Å; Y317-L321 HydrophobicContact CE1-CD2 4.27Å; Y317-L321 HydrophobicContact CE1-CG 4.01Å; Y317-L321 WeakPolarHBondContact O-CG 3.33Å; Y317-L321 PolarHBondContact O-N 3.47Å
318	Y	93.3	Very high	89.6	Confident	66 Å²	66	63 Å²	63	26%	0.259	31%	0.308	S	S	.	.	H	α-helix	trans	-67.6	-32.1	176.4	-61.4	-74.7	0	0	0	112.6	R239 E313 D314 G316 L320 L321 S322	R239-Y318 HydrophobicContact CG-CE1 4.28Å; R239-Y318 VanDerWaalsContact CZ-CD1 3.44Å; R239-Y318 VanDerWaalsContact NH1-CD2 3.27Å; R239-Y318 VanDerWaalsContact NH1-CE2 3.31Å; R239-Y318 VanDerWaalsContact NH1-CG 3.32Å; E313-Y318 HydrophobicContact CB-CD2 3.69Å; E313-Y318 HydrophobicContact CB-CE2 4.11Å; E313-Y318 WeakPolarHBondContact O-CD2 3.33Å; D314-Y318 HydrophobicContact CB-CD2 4.32Å; D314-Y318 HydrophobicContact CB-CE2 3.91Å; G316-Y318 PolarHBondContact O-N 3.27Å; Y318-L320 VanDerWaalsContact C-N 3.35Å; Y318-L321 HydrophobicContact CD1-CD1 4.12Å; Y318-L321 PolarHBondContact O-N 3.12Å; Y318-S322 WeakPolarHBondContact O-CB 3.49Å; Y318-S322 PolarHBondContact O-N 2.91Å
319	G	91.3	Very high	90.2	Very high	6 Å²	6	64.1 Å²	64.1	6%	0.062	31%	0.31	C	S	.	.	H	α-helix	trans	-62.6	-37.9	170	0	0	0	0	0	112.9	W311 G316 Y317 R323	W311-G319 WeakPolarHBondContact O-CA 3.21Å; W311-G319 PolarHBondContact O-N 2.82Å; W311-G319 VanDerWaalsContact O-N 3.07Å; G316-G319 CarbonylContact O-C 3.39Å; G316-G319 WeakPolarHBondContact O-CA 3.26Å; G316-G319 PolarHBondContact O-N 3.45Å; G316-G319 VanDerWaalsContact O-N 3.08Å; Y317-G319 VanDerWaalsContact C-N 3.31Å; Y317-G319 PolarHBondContact O-N 2.95Å; G319-R323 WeakPolarHBondContact O-CD 3.38Å; G319-R323 WeakPolarHBondContact O-CG 3.45Å; G319-R323 PolarHBondContact O-N 3.32Å
320	L	91.5	Very high	90.7	Very high	28 Å²	28	61.8 Å²	61.8	15%	0.147	30%	0.299	C	S	.	.	H	α-helix	trans	-63.6	-53.8	171.1	171.5	66.4	0	0	0	111.2	L203 L208 A211 G316 Y317 Y318 S322 R323 M324	L203-L320 HydrophobicContact CD1-CD2 3.87Å; L203-L320 HydrophobicContact CD2-CD2 3.78Å; L208-L320 HydrophobicContact CD2-CD1 4.48Å; L208-L320 HydrophobicContact CD2-CD2 4Å; A211-L320 HydrophobicContact CB-CD2 3.74Å; A211-L320 HydrophobicContact CB-CG 4.4Å; G316-L320 PolarHBondContact O-N 3.26Å; Y317-L320 WeakPolarHBondContact O-CB 3.3Å; Y317-L320 PolarHBondContact O-N 2.69Å; Y317-L320 VanDerWaalsContact O-N 3.13Å; Y318-L320 VanDerWaalsContact C-N 3.35Å; L320-S322 VanDerWaalsContact C-N 3.3Å; L320-S322 PolarHBondContact O-N 3.31Å; L320-R323 WeakPolarHBondContact O-CB 3.28Å; L320-R323 PolarHBondContact O-N 3.48Å; L320-M324 HydrophobicContact CD1-CG 4.29Å; L320-M324 HydrophobicContact CD1-SD 3.9Å; L320-M324 HydrophobicContact CG-SD 3.92Å; L320-M324 WeakPolarHBondContact O-CG 3.49Å; L320-M324 PolarHBondContact O-N 3.1Å; L320-M324 VanDerWaalsContact O-N 3.1Å
321	L	95.2	Very high	91.1	Very high	6 Å²	6	63.3 Å²	63.3	3%	0.031	30%	0.303	C	S	.	.	H	α-helix	trans	-54.5	-45.9	179.5	-64	178.1	0	0	0	111.6	A211 V215 I244 Y317 Y318 R323 M324 V325	A211-L321 HydrophobicContact CB-CD2 3.77Å; V215-L321 HydrophobicContact CG2-CD2 3.84Å; I244-L321 HydrophobicContact CD1-CD1 4.44Å; I244-L321 HydrophobicContact CD1-CD2 4.18Å; I244-L321 HydrophobicContact CG1-CD1 4.42Å; I244-L321 HydrophobicContact CG2-CB 3.84Å; Y317-L321 HydrophobicContact CD1-CD1 3.99Å; Y317-L321 HydrophobicContact CD1-CG 4.33Å; Y317-L321 HydrophobicContact CE1-CD1 3.58Å; Y317-L321 HydrophobicContact CE1-CD2 4.27Å; Y317-L321 HydrophobicContact CE1-CG 4.01Å; Y317-L321 WeakPolarHBondContact O-CG 3.33Å; Y317-L321 PolarHBondContact O-N 3.47Å; Y318-L321 HydrophobicContact CD1-CD1 4.12Å; Y318-L321 PolarHBondContact O-N 3.12Å; L321-R323 VanDerWaalsContact C-N 3.31Å; L321-R323 PolarHBondContact O-N 3Å; L321-M324 PolarHBondContact O-N 2.92Å; L321-M324 VanDerWaalsContact O-N 3.09Å; L321-V325 PolarHBondContact O-N 2.86Å; L321-V325 VanDerWaalsContact O-N 3.09Å
322	S	94.5	Very high	91.5	Very high	6 Å²	6	59 Å²	59	4%	0.042	29%	0.287	C	S	.	.	H	α-helix	trans	-65.2	-29.3	178.3	-179.1	0	0	0	0	113.6	E245 F247 Y318 L320	E245-S322 WeakPolarHBondContact O-CA 3.48Å; E245-S322 VanDerWaalsContact O-CB 3.24Å; E245-S322 WeakPolarHBondContact O-CB 3.35Å; E245-S322 PolarHBondContact O-OG 3.29Å; F247-S322 VanDerWaalsContact CD2-OG 3.28Å; F247-S322 WeakPolarHBondContact CD2-OG 3.29Å; F247-S322 PolarHBondContact N-OG 2.87Å; Y318-S322 WeakPolarHBondContact O-CB 3.49Å; Y318-S322 PolarHBondContact O-N 2.91Å; L320-S322 VanDerWaalsContact C-N 3.3Å; L320-S322 PolarHBondContact O-N 3.31Å
323	R	91.8	Very high	91.9	Very high	186 Å²	186	54.4 Å²	54.4	70%	0.702	27%	0.265	S	S	*	.	H	α-helix	trans	-71.5	-32.6	173.1	-71.7	163.3	-172	177.8	4.5	111.2	G319 L320 L321 R326	G319-R323 WeakPolarHBondContact O-CD 3.38Å; G319-R323 WeakPolarHBondContact O-CG 3.45Å; G319-R323 PolarHBondContact O-N 3.32Å; L320-R323 WeakPolarHBondContact O-CB 3.28Å; L320-R323 PolarHBondContact O-N 3.48Å; L321-R323 VanDerWaalsContact C-N 3.31Å; L321-R323 PolarHBondContact O-N 3Å; R323-R326 WeakPolarHBondContact O-CB 3.49Å; R323-R326 PolarHBondContact O-N 3Å
324	M	94.3	Very high	92.3	Very high	65 Å²	65	52.5 Å²	52.5	32%	0.32	26%	0.256	S	S	.	.	H	α-helix	trans	-74.5	-37.9	179.6	-64	172.5	70.1	0	0	112.1	A211 K212 V215 L320 L321 R326	A211-M324 HydrophobicContact CB-SD 4.23Å; K212-M324 HydrophobicContact CB-CE 3.88Å; K212-M324 HydrophobicContact CG-CE 4.11Å; V215-M324 HydrophobicContact CB-CB 4.49Å; V215-M324 HydrophobicContact CB-CE 4.33Å; V215-M324 HydrophobicContact CG1-CB 4.07Å; V215-M324 HydrophobicContact CG2-CB 3.84Å; V215-M324 HydrophobicContact CG2-CE 4.24Å; V215-M324 HydrophobicContact CG2-SD 4.27Å; L320-M324 HydrophobicContact CD1-CG 4.29Å; L320-M324 HydrophobicContact CD1-SD 3.9Å; L320-M324 HydrophobicContact CG-SD 3.92Å; L320-M324 WeakPolarHBondContact O-CG 3.49Å; L320-M324 PolarHBondContact O-N 3.1Å; L320-M324 VanDerWaalsContact O-N 3.1Å; L321-M324 PolarHBondContact O-N 2.92Å; L321-M324 VanDerWaalsContact O-N 3.09Å; M324-R326 VanDerWaalsContact C-N 3.26Å; M324-R326 PolarHBondContact O-N 2.88Å
325	V	94.2	Very high	92.5	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	12.9	173.2	-60.1	0	0	0	0	114.5	V215 I219 I224 I244 K246 L321 S327 E328	V215-V325 HydrophobicContact CG1-CG1 4Å; V215-V325 HydrophobicContact CG2-CG1 4.31Å; I219-V325 HydrophobicContact CG1-CG1 4.47Å; I224-V325 HydrophobicContact CD1-CB 4.23Å; I224-V325 HydrophobicContact CD1-CG1 4.07Å; I224-V325 HydrophobicContact CG1-CG1 4.4Å; I224-V325 HydrophobicContact CG2-CB 4.45Å; I224-V325 HydrophobicContact CG2-CG2 4.34Å; I244-V325 HydrophobicContact CG2-CG1 3.92Å; I244-V325 HydrophobicContact CG2-CG2 3.87Å; K246-V325 HydrophobicContact CB-CG2 4.25Å; L321-V325 PolarHBondContact O-N 2.86Å; L321-V325 VanDerWaalsContact O-N 3.09Å; V325-S327 PolarHBondContact O-N 2.78Å; V325-S327 VanDerWaalsContact O-N 3.15Å; V325-E328 PolarHBondContact O-N 3.47Å
326	R	91.1	Very high	92.5	Very high	155 Å²	155	43.8 Å²	43.8	59%	0.585	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-28.9	-171.6	-162.6	179.3	-152.3	-169.6	8.7	114	K246 D248 R323 M324	K246-R326 VanDerWaalsContact CE-O 3.25Å; K246-R326 WeakPolarHBondContact CE-O 3.36Å; K246-R326 PolarHBondContact NZ-O 2.79Å; D248-R326 IonicContact OD1-NH2 3.42Å; D248-R326 IonicContact OD2-CZ 2.8Å; D248-R326 IonicContact OD2-NE 3.59Å; D248-R326 PolarHBondContact OD2-NE 2.91Å; D248-R326 IonicContact OD2-NH2 2.91Å; D248-R326 PolarHBondContact OD2-NH2 2.72Å; R323-R326 WeakPolarHBondContact O-CB 3.49Å; R323-R326 PolarHBondContact O-N 3Å; M324-R326 VanDerWaalsContact C-N 3.26Å; M324-R326 PolarHBondContact O-N 2.88Å
327	S	89.2	Confident	92.4	Very high	92 Å²	92	45.9 Å²	45.9	64%	0.643	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-20.4	175.8	51.6	0	0	0	0	114.6	V325	V325-S327 PolarHBondContact O-N 2.78Å; V325-S327 VanDerWaalsContact O-N 3.15Å
328	E	92.1	Very high	92.1	Very high	67 Å²	67	45.9 Å²	45.9	31%	0.313	21%	0.21	S	C	.	.	S	Bend	trans	-91.6	157.1	-166.7	-56.2	-47.8	113.9	0	0	112.7	I219 I224 K246 V325	I219-E328 HydrophobicContact CD1-CG 4.35Å; I219-E328 HydrophobicContact CG1-CG 4.21Å; I224-E328 HydrophobicContact CD1-CB 3.5Å; I224-E328 VanDerWaalsContact CD1-CB 3.5Å; I224-E328 HydrophobicContact CD1-CG 3.88Å; K246-E328 PolarHBondContact NZ-O 2.92Å; V325-E328 PolarHBondContact O-N 3.47Å
329	L	90.8	Very high	91.7	Very high	118 Å²	118	48.7 Å²	48.7	62%	0.618	23%	0.229	S	C	*	.	P	Polyproline II helix	trans	-92	131.7	175.2	-65	178.5	0	0	0	110.2	R331 Q347	L329-R331 PolarHBondContact O-N 2.95Å; L329-Q347 HydrophobicContact CD1-CG 4.4Å
330	P	94.5	Very high	91.3	Very high	6 Å²	6	50.8 Å²	50.8	4%	0.039	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-65	125.4	175.6	27.1	-33.3	0	0	0	109.8	I224 V249 F332 I333 Q350	I224-P330 CarbonylContact O-C 3.57Å; I224-P330 WeakPolarHBondContact O-CA 3.43Å; V249-P330 HydrophobicContact CG1-CG 4.27Å; P330-F332 VanDerWaalsContact C-N 3.34Å; P330-I333 HydrophobicContact CB-CG1 4.29Å; P330-I333 HydrophobicContact CG-CD1 4.28Å; P330-I333 HydrophobicContact CG-CG1 4Å; P330-Q350 WeakPolarHBondContact O-CG 3.15Å; P330-Q350 PolarHBondContact O-NE2 3.02Å
331	R	94.6	Very high	90.9	Very high	51 Å²	51	49.8 Å²	49.8	19%	0.192	23%	0.233	C	C	.	.	S	Bend	trans	-70.5	-32	172.8	173.9	174.6	-164.9	74.7	-8.3	111.6	R222 I224 W243 L329 D349 Q350 I351	R222-R331 VanDerWaalsContact O-CB 3.23Å; R222-R331 WeakPolarHBondContact O-CB 3.2Å; R222-R331 WeakPolarHBondContact O-CD 3.1Å; I224-R331 PolarHBondContact O-N 2.81Å; W243-R331 HydrophobicContact CH2-CG 4.26Å; W243-R331 HydrophobicContact CZ3-CB 4.13Å; W243-R331 HydrophobicContact CZ3-CG 4.28Å; L329-R331 PolarHBondContact O-N 2.95Å; R331-D349 IonicContact CZ-OD2 3.26Å; R331-D349 PolarHBondContact NH1-O 3Å; R331-D349 IonicContact NH1-OD2 2.76Å; R331-D349 PolarHBondContact NH1-OD2 3Å; R331-Q350 CarbonylContact O-C 3.57Å; R331-Q350 WeakPolarHBondContact O-CA 3.23Å; R331-I351 PolarHBondContact O-N 2.83Å
332	F	96.2	Very high	90.5	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	125.8	179.7	-171.3	-95.2	0	0	0	109.7	I224 F225 S226 I234 L238 W243 P330 W334 I351 F760 L806 V809 L810	I224-F332 PolarHBondContact O-N 3.45Å; F225-F332 CarbonylContact C-O 3.55Å; F225-F332 WeakPolarHBondContact CA-O 3.45Å; F225-F332 HydrophobicContact CB-CB 4.03Å; F225-F332 HydrophobicContact CB-CD1 4.32Å; S226-F332 PolarHBondContact N-O 3.28Å; I234-F332 HydrophobicContact CG2-CE1 4.47Å; L238-F332 HydrophobicContact CD1-CD1 3.71Å; L238-F332 HydrophobicContact CD1-CE1 3.8Å; L238-F332 HydrophobicContact CD2-CD1 4.31Å; L238-F332 HydrophobicContact CD2-CE1 4.37Å; W243-F332 HydrophobicContact CE3-CB 4.23Å; W243-F332 HydrophobicContact CH2-CB 3.99Å; W243-F332 HydrophobicContact CZ3-CB 3.51Å; P330-F332 VanDerWaalsContact C-N 3.34Å; F332-W334 HydrophobicContact CE1-CB 4.19Å; F332-W334 AromaticContact CE1-CE3 3.83Å; F332-W334 HydrophobicContact CE1-CE3 3.83Å; F332-W334 AromaticContact CZ-CE3 3.75Å; F332-W334 HydrophobicContact CZ-CE3 3.75Å; F332-W334 HydrophobicContact CZ-CZ3 4.25Å; F332-I351 HydrophobicContact CD2-CB 3.84Å; F332-I351 HydrophobicContact CD2-CG2 3.59Å; F332-I351 HydrophobicContact CE2-CB 4.48Å; F332-I351 HydrophobicContact CE2-CG2 3.73Å; F332-F760 AromaticContact CE2-CE1 3.87Å; F332-F760 HydrophobicContact CE2-CE1 3.87Å; F332-F760 HydrophobicContact CE2-CZ 4.17Å; F332-F760 HydrophobicContact CZ-CE1 4.18Å; F332-F760 HydrophobicContact CZ-CZ 4.02Å; F332-L806 HydrophobicContact CE1-CD2 3.88Å; F332-L806 HydrophobicContact CE2-CD2 4.29Å; F332-L806 HydrophobicContact CZ-CD2 3.44Å; F332-L806 VanDerWaalsContact CZ-CD2 3.44Å; F332-V809 HydrophobicContact CE2-CG2 3.98Å; F332-V809 HydrophobicContact CZ-CG2 4.46Å; F332-L810 HydrophobicContact CD2-CD1 4.27Å; F332-L810 HydrophobicContact CD2-CD2 3.76Å; F332-L810 HydrophobicContact CD2-CG 4.33Å; F332-L810 HydrophobicContact CE2-CD1 4.2Å; F332-L810 HydrophobicContact CE2-CD2 3.96Å; F332-L810 HydrophobicContact CE2-CG 4.14Å
333	I	95.4	Very high	90	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	119.2	-179.5	-57.9	174.7	0	0	0	107.2	I251 P330 V341 L346 I351 I352 N353	I251-I333 HydrophobicContact CD1-CD1 4.31Å; I251-I333 HydrophobicContact CD1-CG2 3.96Å; I251-I333 HydrophobicContact CG2-CD1 4.48Å; P330-I333 HydrophobicContact CB-CG1 4.29Å; P330-I333 HydrophobicContact CG-CD1 4.28Å; P330-I333 HydrophobicContact CG-CG1 4Å; I333-V341 HydrophobicContact CG2-CG2 3.9Å; I333-L346 HydrophobicContact CD1-CD2 3.65Å; I333-I351 PolarHBondContact N-O 3.31Å; I333-I352 WeakPolarHBondContact O-CA 3.44Å; I333-N353 PolarHBondContact O-N 3.42Å; I333-N353 PolarHBondContact O-OD1 2.88Å
334	W	95.3	Very high	89.7	Confident	7 Å²	7	51.7 Å²	51.7	3%	0.027	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	126.7	169.2	-165.5	-73.3	0	0	0	108.6	S226 I227 L228 Y231 I234 F332 N353 F760 L802 T805 L806	S226-W334 PolarHBondContact O-N 3.31Å; I227-W334 CarbonylContact C-O 3.59Å; I227-W334 VanDerWaalsContact CA-O 3.27Å; I227-W334 WeakPolarHBondContact CA-O 3.45Å; I227-W334 HydrophobicContact CG1-CB 4.33Å; L228-W334 PolarHBondContact N-O 3.16Å; Y231-W334 AromaticContact CD1-NE1 3.49Å; Y231-W334 AromaticContact CD2-CD1 3.27Å; Y231-W334 HydrophobicContact CD2-CG 4.49Å; Y231-W334 AromaticContact CD2-NE1 3.41Å; Y231-W334 AromaticContact CE1-NE1 3.51Å; Y231-W334 AromaticContact CE2-CD1 3.49Å; Y231-W334 VanDerWaalsContact CE2-CD1 3.49Å; Y231-W334 AromaticContact CE2-NE1 3.39Å; Y231-W334 AromaticContact CG-CD1 3.63Å; Y231-W334 AromaticContact CG-NE1 3.44Å; Y231-W334 AromaticContact CZ-NE1 3.44Å; I234-W334 HydrophobicContact CD1-CD2 4.28Å; I234-W334 HydrophobicContact CD1-CE3 3.99Å; I234-W334 HydrophobicContact CD1-CH2 3.68Å; I234-W334 HydrophobicContact CD1-CZ2 4Å; I234-W334 HydrophobicContact CD1-CZ3 3.67Å; I234-W334 HydrophobicContact CG1-CD2 4.01Å; I234-W334 HydrophobicContact CG1-CE3 4.21Å; I234-W334 HydrophobicContact CG1-CH2 4.24Å; I234-W334 HydrophobicContact CG1-CZ2 4.06Å; I234-W334 HydrophobicContact CG1-CZ3 4.32Å; I234-W334 HydrophobicContact CG2-CB 4.32Å; I234-W334 HydrophobicContact CG2-CD2 4.09Å; I234-W334 HydrophobicContact CG2-CE3 4.09Å; I234-W334 HydrophobicContact CG2-CG 4.2Å; F332-W334 HydrophobicContact CE1-CB 4.19Å; F332-W334 AromaticContact CE1-CE3 3.83Å; F332-W334 HydrophobicContact CE1-CE3 3.83Å; F332-W334 AromaticContact CZ-CE3 3.75Å; F332-W334 HydrophobicContact CZ-CE3 3.75Å; F332-W334 HydrophobicContact CZ-CZ3 4.25Å; W334-N353 WeakPolarHBondContact CA-OD1 3.39Å; W334-N353 HydrophobicContact CD2-CB 3.96Å; W334-N353 HydrophobicContact CE3-CB 3.9Å; W334-N353 HydrophobicContact CG-CB 4.45Å; W334-N353 HydrophobicContact CZ3-CB 4.24Å; W334-F760 HydrophobicContact CE3-CZ 4.03Å; W334-F760 HydrophobicContact CH2-CE2 4.36Å; W334-F760 AromaticContact CZ3-CE2 3.91Å; W334-F760 HydrophobicContact CZ3-CE2 3.91Å; W334-F760 AromaticContact CZ3-CZ 3.72Å; W334-F760 HydrophobicContact CZ3-CZ 3.72Å; W334-L802 HydrophobicContact CH2-CD2 3.91Å; W334-L802 HydrophobicContact CZ2-CD2 3.44Å; W334-L802 VanDerWaalsContact CZ2-CD2 3.44Å; W334-T805 HydrophobicContact CH2-CG2 3.95Å; W334-T805 HydrophobicContact CZ3-CG2 4.02Å; W334-L806 HydrophobicContact CE3-CD2 4.47Å; W334-L806 HydrophobicContact CZ3-CD2 4.21Å
335	S	92.5	Very high	89.2	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	150.4	-178.6	51.7	0	0	0	0	111.4	L228 R337 N353 H354	L228-S335 CarbonylContact O-C 3.5Å; L228-S335 WeakPolarHBondContact O-CA 3.2Å; S335-R337 PolarHBondContact OG-O 3.44Å; S335-N353 PolarHBondContact N-OD1 2.8Å; S335-N353 PolarHBondContact O-ND2 2.81Å; S335-N353 PolarHBondContact OG-OD1 2.97Å; S335-H354 PolarHBondContact O-NE2 3.3Å; S335-H354 PolarHBondContact OG-CD2 3.41Å; S335-H354 PolarHBondContact OG-NE2 3.17Å
336	L	87.5	Confident	88.8	Confident	18 Å²	18	53 Å²	53	9%	0.094	26%	0.258	C	S	.	.	S	Bend	trans	-72.5	-30.6	177.4	-179.4	59.6	0	0	0	112.2	L228 Y231 S294 D297	L228-L336 WeakPolarHBondContact O-CB 3.41Å; L228-L336 PolarHBondContact O-N 2.9Å; Y231-L336 HydrophobicContact CE2-CB 4.11Å; Y231-L336 HydrophobicContact CE2-CD1 4.25Å; Y231-L336 WeakPolarHBondContact OH-CD1 3.45Å; S294-L336 PolarHBondContact OG-O 3.34Å; S294-L336 VanDerWaalsContact OG-O 3.12Å; D297-L336 HydrophobicContact CB-CD2 4.07Å; D297-L336 WeakPolarHBondContact OD2-CD1 3.29Å
337	R	84.1	Confident	88.8	Confident	68 Å²	68	50.6 Å²	50.6	26%	0.257	25%	0.253	S	S	.	.			trans	-133.9	145.1	179.9	-66.8	171.6	-158	-144.9	-2.5	111.4	S294 D295 S335 N339 Q340	S294-R337 VanDerWaalsContact C-NH2 3.26Å; S294-R337 PolarHBondContact O-NH2 3.13Å; S294-R337 WeakPolarHBondContact OG-CG 3.24Å; S294-R337 PolarHBondContact OG-NE 3.1Å; D295-R337 IonicContact OD1-CZ 2.67Å; D295-R337 IonicContact OD1-NH1 3.51Å; D295-R337 PolarHBondContact OD1-NH1 3.38Å; D295-R337 IonicContact OD1-NH2 2.98Å; D295-R337 PolarHBondContact OD1-NH2 3.08Å; S335-R337 PolarHBondContact OG-O 3.44Å; R337-N339 VanDerWaalsContact C-N 3.29Å; R337-N339 WeakPolarHBondContact CB-OD1 3.33Å; R337-N339 PolarHBondContact O-N 2.97Å; R337-Q340 HydrophobicContact CB-CG 4.1Å; R337-Q340 WeakPolarHBondContact O-CB 3.38Å; R337-Q340 PolarHBondContact O-N 3.12Å
338	K	85.8	Confident	88.8	Confident	18 Å²	18	55 Å²	55	8%	0.078	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-55.2	-42.9	171.9	-173.2	-177	-177.5	-69.1	0	112.5	E290 Q340 V341 F343 H354 H355 S356	E290-K338 HydrophobicContact CB-CD 4.29Å; E290-K338 VanDerWaalsContact CD-CD 3.48Å; E290-K338 HydrophobicContact CG-CD 3.88Å; E290-K338 WeakPolarHBondContact OE1-CE 3.36Å; E290-K338 IonicContact OE1-NZ 2.71Å; E290-K338 PolarHBondContact OE1-NZ 3.48Å; E290-K338 WeakPolarHBondContact OE2-CD 3.47Å; E290-K338 VanDerWaalsContact OE2-CE 3.28Å; E290-K338 WeakPolarHBondContact OE2-CE 3.23Å; E290-K338 IonicContact OE2-NZ 3.43Å; E290-K338 PolarHBondContact OE2-NZ 3.32Å; K338-Q340 PolarHBondContact O-N 3.49Å; K338-V341 PolarHBondContact O-N 3.37Å; K338-V341 VanDerWaalsContact O-N 3.12Å; K338-F343 HydrophobicContact CD-CE2 4.44Å; K338-F343 HydrophobicContact CG-CE2 3.51Å; K338-F343 HydrophobicContact CG-CZ 3.91Å; K338-H354 HydrophobicContact CB-CB 4.49Å; K338-H354 HydrophobicContact CG-CB 4.4Å; K338-H354 PolarHBondContact N-CE1 3.28Å; K338-H355 WeakPolarHBondContact CE-O 3.26Å; K338-S356 VanDerWaalsContact CE-O 3.25Å; K338-S356 WeakPolarHBondContact CE-O 3.48Å; K338-S356 PolarHBondContact NZ-O 3.2Å
339	N	83.8	Confident	88.7	Confident	125 Å²	125	54.6 Å²	54.6	67%	0.668	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-69.1	-9.6	-178.1	74.9	-15	0	0	0	114.6	R337 V341	R337-N339 VanDerWaalsContact C-N 3.29Å; R337-N339 WeakPolarHBondContact CB-OD1 3.33Å; R337-N339 PolarHBondContact O-N 2.97Å; N339-V341 PolarHBondContact O-N 2.83Å
340	Q	83.6	Confident	88.8	Confident	51 Å²	51	49.9 Å²	49.9	24%	0.238	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-75.2	-8	171.4	-68	170.9	-34.9	0	0	112.7	L228 R337 K338	L228-Q340 HydrophobicContact CD1-CB 3.89Å; L228-Q340 PolarHBondContact O-OE1 2.63Å; R337-Q340 HydrophobicContact CB-CG 4.1Å; R337-Q340 WeakPolarHBondContact O-CB 3.38Å; R337-Q340 PolarHBondContact O-N 3.12Å; K338-Q340 PolarHBondContact O-N 3.49Å
341	V	83.8	Confident	88.9	Confident	6 Å²	6	49.8 Å²	49.8	4%	0.036	24%	0.235	C	C	.	.	S	Bend	trans	-133.1	123.7	-177.1	-178.9	0	0	0	0	112.3	I251 I333 K338 N339 F343 L346 I352	I251-V341 HydrophobicContact CD1-CG2 4Å; I251-V341 HydrophobicContact CG2-CG1 3.84Å; I333-V341 HydrophobicContact CG2-CG2 3.9Å; K338-V341 PolarHBondContact O-N 3.37Å; K338-V341 VanDerWaalsContact O-N 3.12Å; N339-V341 PolarHBondContact O-N 2.83Å; V341-F343 VanDerWaalsContact O-CD2 3.24Å; V341-F343 WeakPolarHBondContact O-CD2 3.42Å; V341-F343 PolarHBondContact O-N 3.25Å; V341-L346 HydrophobicContact CG1-CD1 3.85Å; V341-L346 HydrophobicContact CG1-CD2 3.83Å; V341-L346 HydrophobicContact CG1-CG 3.89Å; V341-I352 HydrophobicContact CB-CD1 3.7Å; V341-I352 HydrophobicContact CG1-CD1 3.53Å; V341-I352 HydrophobicContact CG2-CD1 3.87Å
342	D	84.8	Confident	88.9	Confident	50 Å²	50	47.4 Å²	47.4	27%	0.267	23%	0.226	S	C	.	.			trans	-77.4	105	173	177.1	-1.2	0	0	0	111.9	H344 N345 L346	D342-H344 PolarHBondContact O-N 3.31Å; D342-H344 WeakPolarHBondContact OD1-CA 3.36Å; D342-H344 VanDerWaalsContact OD1-CB 3.28Å; D342-H344 WeakPolarHBondContact OD1-CB 3.45Å; D342-H344 IonicContact OD1-CD2 3.12Å; D342-H344 IonicContact OD1-CG 3.55Å; D342-H344 PolarHBondContact OD1-N 3.11Å; D342-N345 PolarHBondContact O-N 2.81Å; D342-N345 PolarHBondContact OD1-N 3.47Å; D342-N345 PolarHBondContact OD2-ND2 3.31Å; D342-L346 PolarHBondContact O-N 3.48Å
343	F	85.5	Confident	88.8	Confident	21 Å²	21	48.1 Å²	48.1	9%	0.092	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-19.3	178.3	-75.1	-101.8	0	0	0	114.4	K338 V341 L346 I352 H354 H355 R756	K338-F343 HydrophobicContact CD-CE2 4.44Å; K338-F343 HydrophobicContact CG-CE2 3.51Å; K338-F343 HydrophobicContact CG-CZ 3.91Å; V341-F343 VanDerWaalsContact O-CD2 3.24Å; V341-F343 WeakPolarHBondContact O-CD2 3.42Å; V341-F343 PolarHBondContact O-N 3.25Å; F343-L346 HydrophobicContact CD1-CD1 4.35Å; F343-I352 HydrophobicContact CE1-CD1 4.3Å; F343-I352 HydrophobicContact CE1-CG2 4.42Å; F343-I352 HydrophobicContact CE2-CD1 4.34Å; F343-I352 HydrophobicContact CZ-CD1 3.91Å; F343-H354 HydrophobicContact CZ-CB 3.78Å; F343-H355 WeakPolarHBondContact CZ-O 3.36Å; F343-R756 PolarHBondContact O-NH1 3.11Å
344	H	84.5	Confident	88.8	Confident	168 Å²	168	48.5 Å²	48.5	78%	0.778	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-36	176.6	-59.7	-50.2	0	0	0	111.8	D342	D342-H344 PolarHBondContact O-N 3.31Å; D342-H344 WeakPolarHBondContact OD1-CA 3.36Å; D342-H344 VanDerWaalsContact OD1-CB 3.28Å; D342-H344 WeakPolarHBondContact OD1-CB 3.45Å; D342-H344 IonicContact OD1-CD2 3.12Å; D342-H344 IonicContact OD1-CG 3.55Å; D342-H344 PolarHBondContact OD1-N 3.11Å
345	N	84.2	Confident	88.6	Confident	80 Å²	80	48.4 Å²	48.4	43%	0.428	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-16.6	-178.5	-83	-62.4	0	0	0	114.8	P253 D342 Q347	P253-N345 WeakPolarHBondContact CG-ND2 3.47Å; D342-N345 PolarHBondContact O-N 2.81Å; D342-N345 PolarHBondContact OD1-N 3.47Å; D342-N345 PolarHBondContact OD2-ND2 3.31Å; N345-Q347 PolarHBondContact O-N 3.01Å
346	L	86.7	Confident	88.3	Confident	12 Å²	12	49.7 Å²	49.7	6%	0.063	24%	0.24	C	C	.	.			trans	-55.1	132.3	172.8	-74.7	-178.9	0	0	0	113	I333 V341 D342 F343 Q350 I352 R756	I333-L346 HydrophobicContact CD1-CD2 3.65Å; V341-L346 HydrophobicContact CG1-CD1 3.85Å; V341-L346 HydrophobicContact CG1-CD2 3.83Å; V341-L346 HydrophobicContact CG1-CG 3.89Å; D342-L346 PolarHBondContact O-N 3.48Å; F343-L346 HydrophobicContact CD1-CD1 4.35Å; L346-Q350 HydrophobicContact CD2-CB 4.44Å; L346-I352 HydrophobicContact CD1-CB 4.44Å; L346-I352 HydrophobicContact CD1-CD1 4.06Å; L346-I352 HydrophobicContact CD1-CG2 4.01Å; L346-R756 VanDerWaalsContact C-NH2 3.33Å; L346-R756 PolarHBondContact O-NH2 2.99Å
347	Q	89.8	Confident	88.3	Confident	105 Å²	105	49.4 Å²	49.4	49%	0.491	24%	0.242	S	C	.	.			trans	-69.4	160.5	171.2	-60.7	-57.4	-54.5	0	0	112.4	L329 N345 D349 Q350 R756	L329-Q347 HydrophobicContact CD1-CG 4.4Å; N345-Q347 PolarHBondContact O-N 3.01Å; Q347-D349 VanDerWaalsContact C-N 3.31Å; Q347-D349 PolarHBondContact O-N 2.7Å; Q347-Q350 HydrophobicContact CB-CG 4.1Å; Q347-Q350 PolarHBondContact O-N 2.94Å; Q347-R756 PolarHBondContact O-NH2 2.86Å
348	K	88.7	Confident	88.5	Confident	185 Å²	185	46.4 Å²	46.4	80%	0.804	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-25.5	-175.8	-73	-175	177.4	179.2	0	114.6	N758	K348-N758 PolarHBondContact O-ND2 2.86Å
349	D	90.4	Very high	88.7	Confident	58 Å²	58	47.5 Å²	47.5	31%	0.31	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107	3.7	-178.5	74.1	-48.2	0	0	0	114.1	R222 R331 Q347	R222-D349 IonicContact CZ-OD2 2.79Å; R222-D349 IonicContact NH1-OD2 3.96Å; R222-D349 PolarHBondContact NH1-OD2 2.86Å; R331-D349 IonicContact CZ-OD2 3.26Å; R331-D349 PolarHBondContact NH1-O 3Å; R331-D349 IonicContact NH1-OD2 2.76Å; R331-D349 PolarHBondContact NH1-OD2 3Å; Q347-D349 VanDerWaalsContact C-N 3.31Å; Q347-D349 PolarHBondContact O-N 2.7Å
350	Q	93.9	Very high	89.1	Confident	18 Å²	18	41.5 Å²	41.5	8%	0.084	21%	0.209	C	C	.	.			trans	-72.5	140.5	164	-72.3	178.9	-71.1	0	0	110	P330 R331 L346 Q347 N758	P330-Q350 WeakPolarHBondContact O-CG 3.15Å; P330-Q350 PolarHBondContact O-NE2 3.02Å; R331-Q350 CarbonylContact O-C 3.57Å; R331-Q350 WeakPolarHBondContact O-CA 3.23Å; L346-Q350 HydrophobicContact CD2-CB 4.44Å; Q347-Q350 HydrophobicContact CB-CG 4.1Å; Q347-Q350 PolarHBondContact O-N 2.94Å; Q350-N758 WeakPolarHBondContact O-CB 3.32Å
351	I	95.2	Very high	89.5	Confident	5 Å²	5	40 Å²	40	3%	0.026	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	133.6	-177.5	-58.7	165.6	0	0	0	107.9	R331 F332 I333 N758 F760 L810	R331-I351 PolarHBondContact O-N 2.83Å; F332-I351 HydrophobicContact CD2-CB 3.84Å; F332-I351 HydrophobicContact CD2-CG2 3.59Å; F332-I351 HydrophobicContact CE2-CB 4.48Å; F332-I351 HydrophobicContact CE2-CG2 3.73Å; I333-I351 PolarHBondContact N-O 3.31Å; I351-N758 VanDerWaalsContact CA-O 3.31Å; I351-N758 WeakPolarHBondContact CA-O 3.2Å; I351-N758 HydrophobicContact CG1-CB 4.02Å; I351-F760 HydrophobicContact CG2-CD1 4.04Å; I351-F760 HydrophobicContact CG2-CE1 3.83Å; I351-L810 HydrophobicContact CD1-CD2 3.86Å
352	I	95	Very high	89.7	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	142.7	-177.4	-176.4	176.8	0	0	0	111.5	I333 V341 F343 L346 H354 N758 C759 F760	I333-I352 WeakPolarHBondContact O-CA 3.44Å; V341-I352 HydrophobicContact CB-CD1 3.7Å; V341-I352 HydrophobicContact CG1-CD1 3.53Å; V341-I352 HydrophobicContact CG2-CD1 3.87Å; F343-I352 HydrophobicContact CE1-CD1 4.3Å; F343-I352 HydrophobicContact CE1-CG2 4.42Å; F343-I352 HydrophobicContact CE2-CD1 4.34Å; F343-I352 HydrophobicContact CZ-CD1 3.91Å; L346-I352 HydrophobicContact CD1-CB 4.44Å; L346-I352 HydrophobicContact CD1-CD1 4.06Å; L346-I352 HydrophobicContact CD1-CG2 4.01Å; I352-H354 HydrophobicContact CD1-CB 4.33Å; I352-H354 HydrophobicContact CG1-CB 4.37Å; I352-H354 PolarHBondContact O-N 3.29Å; I352-N758 PolarHBondContact N-O 3.46Å; I352-C759 HydrophobicContact CG2-CB 4.26Å; I352-C759 WeakPolarHBondContact CG2-SG 3.37Å; I352-F760 WeakPolarHBondContact O-CD1 3.29Å; I352-F760 WeakPolarHBondContact O-CE1 3.4Å; I352-F760 PolarHBondContact O-N 2.7Å
353	N	95.3	Very high	89.9	Confident	14 Å²	14	40.5 Å²	40.5	8%	0.075	21%	0.205	C	C	.	.	S	Bend	trans	-78.3	13	179.6	72.7	-51.7	0	0	0	115.7	I333 W334 S335 F760	I333-N353 PolarHBondContact O-N 3.42Å; I333-N353 PolarHBondContact O-OD1 2.88Å; W334-N353 WeakPolarHBondContact CA-OD1 3.39Å; W334-N353 HydrophobicContact CD2-CB 3.96Å; W334-N353 HydrophobicContact CE3-CB 3.9Å; W334-N353 HydrophobicContact CG-CB 4.45Å; W334-N353 HydrophobicContact CZ3-CB 4.24Å; S335-N353 PolarHBondContact N-OD1 2.8Å; S335-N353 PolarHBondContact O-ND2 2.81Å; S335-N353 PolarHBondContact OG-OD1 2.97Å; N353-F760 CarbonylContact C-O 3.55Å; N353-F760 VanDerWaalsContact CA-CZ 3.46Å; N353-F760 HydrophobicContact CB-CD2 4.33Å; N353-F760 HydrophobicContact CB-CE1 4.12Å; N353-F760 HydrophobicContact CB-CE2 3.55Å; N353-F760 HydrophobicContact CB-CZ 3.43Å; N353-F760 VanDerWaalsContact CB-CZ 3.43Å
354	H	93.7	Very high	90	Very high	8 Å²	8	40.1 Å²	40.1	4%	0.037	21%	0.205	C	C	.	.	S	Bend	trans	-129.9	145.1	176.3	-65.6	-90.4	0	0	0	111.2	S335 K338 F343 I352 C759 F760 S784	S335-H354 PolarHBondContact O-NE2 3.3Å; S335-H354 PolarHBondContact OG-CD2 3.41Å; S335-H354 PolarHBondContact OG-NE2 3.17Å; K338-H354 HydrophobicContact CB-CB 4.49Å; K338-H354 HydrophobicContact CG-CB 4.4Å; K338-H354 PolarHBondContact N-CE1 3.28Å; F343-H354 HydrophobicContact CZ-CB 3.78Å; I352-H354 HydrophobicContact CD1-CB 4.33Å; I352-H354 HydrophobicContact CG1-CB 4.37Å; I352-H354 PolarHBondContact O-N 3.29Å; H354-C759 VanDerWaalsContact O-CB 3.32Å; H354-C759 WeakPolarHBondContact O-CB 3.06Å; H354-C759 PolarHBondContact O-SG 3.37Å; H354-C759 VanDerWaalsContact O-SG 3.34Å; H354-F760 CarbonylContact C-O 3.6Å; H354-F760 VanDerWaalsContact CA-O 3.23Å; H354-F760 WeakPolarHBondContact CA-O 3.36Å; H354-F760 PolarHBondContact N-O 3.2Å; H354-S784 PolarHBondContact CE1-OG 3.37Å
355	H	91.6	Very high	90.3	Very high	6 Å²	6	32.7 Å²	32.7	3%	0.028	17%	0.174	C	C	.	.			trans	-84.1	161.1	163.7	-71.5	-72.9	0	0	0	110.3	K338 F343 G357 I654 W657 C759 F760 G761 Y763	K338-H355 WeakPolarHBondContact CE-O 3.26Å; F343-H355 WeakPolarHBondContact CZ-O 3.36Å; H355-G357 PolarHBondContact O-N 2.75Å; H355-I654 PolarHBondContact NE2-O 2.7Å; H355-W657 AromaticContact CD2-NE1 3.7Å; H355-W657 AromaticContact CE1-CD1 3.42Å; H355-W657 VanDerWaalsContact CE1-CD1 3.42Å; H355-W657 AromaticContact CE1-NE1 3.41Å; H355-W657 PolarHBondContact CE1-NE1 2.94Å; H355-W657 AromaticContact CG-NE1 3.54Å; H355-W657 AromaticContact ND1-CD1 3.35Å; H355-W657 AromaticContact ND1-NE1 3.36Å; H355-W657 PolarHBondContact ND1-NE1 3.11Å; H355-W657 AromaticContact NE2-NE1 3.6Å; H355-C759 PolarHBondContact CE1-O 2.93Å; H355-F760 VanDerWaalsContact NE2-C 3.28Å; H355-G761 PolarHBondContact CD2-N 3.24Å; H355-G761 PolarHBondContact NE2-N 2.92Å; H355-Y763 PolarHBondContact CD2-OH 3.18Å
356	S	86.6	Confident	90.6	Very high	26 Å²	26	29 Å²	29	18%	0.182	15%	0.154	C	C	.	.	S	Bend	trans	-77.5	6	-176.9	54.4	0	0	0	0	115.1	K338 E754	K338-S356 VanDerWaalsContact CE-O 3.25Å; K338-S356 WeakPolarHBondContact CE-O 3.48Å; K338-S356 PolarHBondContact NZ-O 3.2Å; S356-E754 PolarHBondContact OG-O 2.82Å
357	G	86.9	Confident	90.9	Very high	13 Å²	13	28.6 Å²	28.6	13%	0.134	15%	0.152	C	C	.	.			trans	164.3	140.7	175.1	0	0	0	0	0	109.2	H355	H355-G357 PolarHBondContact O-N 2.75Å
358	A	89.1	Confident	90.9	Very high	5 Å²	5	27 Å²	27	4%	0.041	14%	0.144	C	C	.	.			trans	-146.3	60.8	-173.6	0	0	0	0	0	112.7	F360 T361 Y763	A358-F360 HydrophobicContact CB-CE1 3.99Å; A358-F360 HydrophobicContact CB-CZ 3.96Å; A358-F360 PolarHBondContact O-N 3.02Å; A358-T361 HydrophobicContact CB-CG2 4.01Å; A358-T361 WeakPolarHBondContact O-CB 3.48Å; A358-T361 WeakPolarHBondContact O-CG2 3.26Å; A358-T361 PolarHBondContact O-N 3.07Å; A358-T361 PolarHBondContact O-OG1 2.86Å; A358-Y763 HydrophobicContact CB-CE1 4.13Å; A358-Y763 WeakPolarHBondContact CB-OH 3.13Å
359	P	89.5	Confident	91	Very high	40 Å²	40	18.7 Å²	18.7	26%	0.26	11%	0.107	S	C	.	.	G	3₁₀ helix	trans	-55.2	-18.1	-164.2	14.3	-27.8	0	0	0	117.3	T361 T362 G365 S752	P359-T361 PolarHBondContact O-N 3.23Å; P359-T362 PolarHBondContact O-N 2.9Å; P359-T362 VanDerWaalsContact O-N 3.09Å; P359-T362 PolarHBondContact O-OG1 3.41Å; P359-G365 WeakPolarHBondContact O-CA 3.28Å; P359-S752 WeakPolarHBondContact CG-OG 3.46Å
360	F	92.1	Very high	91.1	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.094	C	C	.	.	G	3₁₀ helix	trans	-63.5	-13	169.9	58	-96.6	0	0	0	114.2	A358 T362 L366 I654 W657 V745 L746 S749 I753 Y763 I781	A358-F360 HydrophobicContact CB-CE1 3.99Å; A358-F360 HydrophobicContact CB-CZ 3.96Å; A358-F360 PolarHBondContact O-N 3.02Å; F360-T362 VanDerWaalsContact C-N 3.28Å; F360-L366 HydrophobicContact CB-CD1 4.41Å; F360-I654 HydrophobicContact CZ-CD1 3.96Å; F360-W657 AromaticContact CE1-CH2 3.68Å; F360-W657 HydrophobicContact CE1-CH2 3.68Å; F360-W657 AromaticContact CE1-CZ2 3.64Å; F360-W657 HydrophobicContact CE1-CZ2 3.64Å; F360-W657 HydrophobicContact CZ-CH2 4.32Å; F360-W657 HydrophobicContact CZ-CZ2 4.03Å; F360-V745 HydrophobicContact CB-CG1 3.76Å; F360-V745 HydrophobicContact CG-CG1 4.35Å; F360-L746 HydrophobicContact CD1-CD2 4.35Å; F360-L746 HydrophobicContact CD2-CD2 4.43Å; F360-L746 HydrophobicContact CE1-CD2 3.98Å; F360-L746 HydrophobicContact CE2-CD2 4.06Å; F360-L746 HydrophobicContact CZ-CD2 3.82Å; F360-S749 WeakPolarHBondContact CD1-OG 3.3Å; F360-I753 HydrophobicContact CD1-CD1 4.15Å; F360-I753 HydrophobicContact CE1-CD1 3.72Å; F360-Y763 AromaticContact CE2-CD1 3.76Å; F360-Y763 HydrophobicContact CE2-CD1 3.76Å; F360-Y763 AromaticContact CE2-CE1 3.54Å; F360-Y763 HydrophobicContact CE2-CE1 3.54Å; F360-Y763 HydrophobicContact CE2-CE2 4.42Å; F360-Y763 HydrophobicContact CE2-CG 4.28Å; F360-Y763 AromaticContact CE2-CZ 3.89Å; F360-Y763 HydrophobicContact CZ-CD1 4.32Å; F360-Y763 AromaticContact CZ-CE1 3.7Å; F360-Y763 HydrophobicContact CZ-CE1 3.7Å; F360-Y763 HydrophobicContact CZ-CE2 4.13Å; F360-Y763 AromaticContact CZ-CZ 3.58Å; F360-I781 HydrophobicContact CD2-CB 4.19Å; F360-I781 HydrophobicContact CD2-CD1 4.11Å; F360-I781 HydrophobicContact CD2-CG2 3.79Å; F360-I781 HydrophobicContact CE2-CG2 3.93Å
361	T	91.6	Very high	90.8	Very high	20 Å²	20	20.3 Å²	20.3	12%	0.123	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-74.3	-20.7	172.3	60.4	0	0	0	0	112.4	D291 A358 P359 Y763 I781	D291-T361 PolarHBondContact OD1-OG1 3.45Å; A358-T361 HydrophobicContact CB-CG2 4.01Å; A358-T361 WeakPolarHBondContact O-CB 3.48Å; A358-T361 WeakPolarHBondContact O-CG2 3.26Å; A358-T361 PolarHBondContact O-N 3.07Å; A358-T361 PolarHBondContact O-OG1 2.86Å; P359-T361 PolarHBondContact O-N 3.23Å; T361-Y763 HydrophobicContact CG2-CD1 4.02Å; T361-Y763 HydrophobicContact CG2-CE1 3.76Å; T361-I781 VanDerWaalsContact CA-O 3.29Å; T361-I781 WeakPolarHBondContact CA-O 3.47Å
362	T	88.4	Confident	90.2	Very high	37 Å²	37	23.9 Å²	23.9	23%	0.227	13%	0.125	C	C	.	.	S	Bend	trans	-93.9	143.9	178.4	71.4	0	0	0	0	111.1	P359 F360 V364 G365 L366	P359-T362 PolarHBondContact O-N 2.9Å; P359-T362 VanDerWaalsContact O-N 3.09Å; P359-T362 PolarHBondContact O-OG1 3.41Å; F360-T362 VanDerWaalsContact C-N 3.28Å; T362-V364 PolarHBondContact O-N 2.98Å; T362-G365 PolarHBondContact O-N 3.18Å; T362-G365 WeakPolarHBondContact OG1-CA 3.49Å; T362-G365 PolarHBondContact OG1-N 2.9Å; T362-L366 VanDerWaalsContact O-CB 3.32Å; T362-L366 WeakPolarHBondContact O-CB 3.4Å; T362-L366 PolarHBondContact O-N 3.29Å
363	K	88.4	Confident	89.7	Confident	28 Å²	28	23.9 Å²	23.9	12%	0.122	13%	0.125	C	C	.	.	H	α-helix	trans	-58	-37.3	177.6	-66.9	-69.6	176.3	167	0	112.9	C367 K595 I630 I779 E780	K363-C367 WeakPolarHBondContact O-CB 3.35Å; K363-C367 PolarHBondContact O-N 2.97Å; K363-K595 HydrophobicContact CD-CD 4.24Å; K363-I630 HydrophobicContact CB-CD1 3.77Å; K363-I630 HydrophobicContact CB-CG1 4.15Å; K363-I630 HydrophobicContact CD-CD1 4.25Å; K363-I630 HydrophobicContact CG-CD1 4.34Å; K363-I779 PolarHBondContact NZ-O 2.76Å; K363-E780 VanDerWaalsContact CE-OE2 3.24Å; K363-E780 WeakPolarHBondContact CE-OE2 3.42Å; K363-E780 IonicContact NZ-OE2 2.77Å; K363-E780 PolarHBondContact NZ-OE2 3.2Å
364	V	88.8	Confident	89.1	Confident	14 Å²	14	29 Å²	29	9%	0.085	14%	0.144	C	C	.	.	H	α-helix	trans	-74.2	-44.9	178.3	177.7	0	0	0	0	111.4	T362 C367 K368 I390 R628 I630	T362-V364 PolarHBondContact O-N 2.98Å; V364-C367 WeakPolarHBondContact O-CB 3.38Å; V364-C367 PolarHBondContact O-N 2.82Å; V364-K368 HydrophobicContact CG1-CD 4.37Å; V364-K368 WeakPolarHBondContact O-CG 3.38Å; V364-K368 PolarHBondContact O-N 3.44Å; V364-I390 HydrophobicContact CG1-CD1 4.02Å; V364-I390 HydrophobicContact CG1-CG1 4.39Å; V364-R628 HydrophobicContact CG2-CB 4.32Å; V364-I630 HydrophobicContact CG2-CG2 3.89Å
365	G	89.7	Confident	88.4	Confident	12 Å²	12	37.8 Å²	37.8	12%	0.124	18%	0.176	C	C	.	.	H	α-helix	trans	-66.7	-45.3	-179.6	0	0	0	0	0	112.7	P359 T362 C367 K368 Q369	P359-G365 WeakPolarHBondContact O-CA 3.28Å; T362-G365 PolarHBondContact O-N 3.18Å; T362-G365 WeakPolarHBondContact OG1-CA 3.49Å; T362-G365 PolarHBondContact OG1-N 2.9Å; G365-C367 VanDerWaalsContact C-N 3.29Å; G365-C367 PolarHBondContact O-N 2.91Å; G365-K368 PolarHBondContact O-N 3.06Å; G365-K368 VanDerWaalsContact O-N 3.16Å; G365-Q369 WeakPolarHBondContact O-CG 3.32Å; G365-Q369 PolarHBondContact O-N 3.42Å; G365-Q369 PolarHBondContact O-OE1 3.01Å
366	L	92.3	Very high	87.9	Confident	3 Å²	3	40.1 Å²	40.1	2%	0.016	19%	0.187	C	C	.	.	H	α-helix	trans	-56.4	-43.3	173.7	-177.5	60.2	0	0	0	111.7	F360 T362 L370 F385 V745 L778	F360-L366 HydrophobicContact CB-CD1 4.41Å; T362-L366 VanDerWaalsContact O-CB 3.32Å; T362-L366 WeakPolarHBondContact O-CB 3.4Å; T362-L366 PolarHBondContact O-N 3.29Å; L366-L370 HydrophobicContact CD1-CD1 3.88Å; L366-L370 HydrophobicContact CD1-CG 4.22Å; L366-L370 HydrophobicContact CG-CD1 4.06Å; L366-L370 VanDerWaalsContact O-CB 3.32Å; L366-L370 WeakPolarHBondContact O-CB 3.25Å; L366-L370 WeakPolarHBondContact O-CG 3.45Å; L366-L370 PolarHBondContact O-N 2.91Å; L366-F385 HydrophobicContact CD2-CE2 3.78Å; L366-F385 HydrophobicContact CD2-CZ 4.36Å; L366-F385 HydrophobicContact CG-CE2 4.08Å; L366-F385 HydrophobicContact CG-CZ 4.33Å; L366-V745 HydrophobicContact CD1-CB 4.43Å; L366-V745 HydrophobicContact CD1-CG1 3.62Å; L366-V745 HydrophobicContact CD1-CG2 3.82Å; L366-L778 HydrophobicContact CD1-CD2 4.48Å
367	C	91.9	Very high	87.3	Confident	3 Å²	3	40 Å²	40	2%	0.02	19%	0.187	C	C	.	.	H	α-helix	trans	-60.6	-49.4	174.9	-179.6	0	0	0	0	112	K363 V364 G365 L370 R371 C388	K363-C367 WeakPolarHBondContact O-CB 3.35Å; K363-C367 PolarHBondContact O-N 2.97Å; V364-C367 WeakPolarHBondContact O-CB 3.38Å; V364-C367 PolarHBondContact O-N 2.82Å; G365-C367 VanDerWaalsContact C-N 3.29Å; G365-C367 PolarHBondContact O-N 2.91Å; C367-L370 PolarHBondContact O-N 2.86Å; C367-R371 WeakPolarHBondContact O-CG 3.47Å; C367-R371 PolarHBondContact O-N 2.86Å; C367-R371 PolarHBondContact SG-NH2 3.4Å; C367-R371 VanDerWaalsContact SG-NH2 3.45Å; C367-C388 PolarHBondContact SG-O 3.11Å; C367-C388 VanDerWaalsContact SG-O 3.36Å
368	K	90.4	Very high	86.9	Confident	72 Å²	72	44.2 Å²	44.2	31%	0.313	21%	0.207	S	C	.	.	H	α-helix	trans	-64.2	-41.8	-180	-71.2	-177.3	-175.4	-70.8	0	112.8	V364 G365 R371 Q372 I390 E393	V364-K368 HydrophobicContact CG1-CD 4.37Å; V364-K368 WeakPolarHBondContact O-CG 3.38Å; V364-K368 PolarHBondContact O-N 3.44Å; G365-K368 PolarHBondContact O-N 3.06Å; G365-K368 VanDerWaalsContact O-N 3.16Å; K368-R371 PolarHBondContact O-N 2.84Å; K368-Q372 PolarHBondContact O-N 3.32Å; K368-I390 HydrophobicContact CD-CD1 4.36Å; K368-I390 HydrophobicContact CG-CD1 3.77Å; K368-E393 WeakPolarHBondContact CE-OE1 3.29Å; K368-E393 IonicContact NZ-OE1 3.88Å; K368-E393 PolarHBondContact NZ-OE1 3.36Å; K368-E393 IonicContact NZ-OE2 3.8Å; K368-E393 PolarHBondContact NZ-OE2 3.01Å
369	Q	90	Very high	86.6	Confident	9 Å²	9	45.9 Å²	45.9	4%	0.042	22%	0.217	C	C	.	.	H	α-helix	trans	-67.2	-41.2	178.4	-70	160.4	-34.5	0	0	112.2	G365 R371 Q372 I373 S749 S752	G365-Q369 WeakPolarHBondContact O-CG 3.32Å; G365-Q369 PolarHBondContact O-N 3.42Å; G365-Q369 PolarHBondContact O-OE1 3.01Å; Q369-R371 PolarHBondContact O-N 2.85Å; Q369-Q372 CarbonylContact O-C 3.59Å; Q369-Q372 PolarHBondContact O-N 2.87Å; Q369-I373 PolarHBondContact O-N 3.17Å; Q369-I373 VanDerWaalsContact O-N 3.16Å; Q369-S749 PolarHBondContact NE2-OG 3.03Å; Q369-S752 PolarHBondContact NE2-OG 3.14Å
370	L	91.7	Very high	86.5	Confident	5 Å²	5	45.8 Å²	45.8	3%	0.026	22%	0.215	C	C	.	.	H	α-helix	trans	-67.6	-21.1	178.5	-78.3	176.4	0	0	0	113.7	L366 C367 I373 A381 F384 F385 V745	L366-L370 HydrophobicContact CD1-CD1 3.88Å; L366-L370 HydrophobicContact CD1-CG 4.22Å; L366-L370 HydrophobicContact CG-CD1 4.06Å; L366-L370 VanDerWaalsContact O-CB 3.32Å; L366-L370 WeakPolarHBondContact O-CB 3.25Å; L366-L370 WeakPolarHBondContact O-CG 3.45Å; L366-L370 PolarHBondContact O-N 2.91Å; C367-L370 PolarHBondContact O-N 2.86Å; L370-I373 HydrophobicContact CD2-CD1 3.69Å; L370-I373 WeakPolarHBondContact O-CB 3.45Å; L370-I373 WeakPolarHBondContact O-CG2 3.39Å; L370-A381 HydrophobicContact CB-CB 3.99Å; L370-A381 HydrophobicContact CD2-CB 4.18Å; L370-F384 HydrophobicContact CD2-CE2 3.98Å; L370-F384 HydrophobicContact CD2-CZ 3.78Å; L370-F385 HydrophobicContact CD1-CB 3.81Å; L370-F385 HydrophobicContact CD1-CD1 3.57Å; L370-F385 HydrophobicContact CD1-CD2 3.53Å; L370-F385 HydrophobicContact CD1-CE1 3.92Å; L370-F385 HydrophobicContact CD1-CE2 3.89Å; L370-F385 HydrophobicContact CD1-CG 3.36Å; L370-F385 HydrophobicContact CD1-CZ 4.07Å; L370-V745 HydrophobicContact CD1-CG2 4.34Å; L370-V745 HydrophobicContact CD2-CG2 3.72Å; L370-V745 HydrophobicContact CG-CG2 4.2Å
371	R	88	Confident	86.6	Confident	106 Å²	106	46.2 Å²	46.2	40%	0.4	22%	0.218	S	C	.	.	H	α-helix	trans	-72.1	-36.2	168.3	-67.5	168.9	-174.3	-167	-0.8	112.4	C367 K368 Q369 I373 C388 D396	C367-R371 WeakPolarHBondContact O-CG 3.47Å; C367-R371 PolarHBondContact O-N 2.86Å; C367-R371 PolarHBondContact SG-NH2 3.4Å; C367-R371 VanDerWaalsContact SG-NH2 3.45Å; K368-R371 PolarHBondContact O-N 2.84Å; Q369-R371 PolarHBondContact O-N 2.85Å; R371-I373 VanDerWaalsContact C-N 3.26Å; R371-I373 PolarHBondContact O-N 2.88Å; R371-C388 PolarHBondContact NH2-O 3.02Å; R371-D396 IonicContact CZ-OD1 3.66Å; R371-D396 IonicContact CZ-OD2 3.21Å; R371-D396 VanDerWaalsContact CZ-OD2 3.31Å; R371-D396 VanDerWaalsContact NH1-CG 3.27Å; R371-D396 IonicContact NH1-OD1 3.12Å; R371-D396 PolarHBondContact NH1-OD1 3.09Å; R371-D396 IonicContact NH1-OD2 2.79Å; R371-D396 PolarHBondContact NH1-OD2 3.26Å; R371-D396 VanDerWaalsContact NH1-OD2 3.08Å; R371-D396 IonicContact NH2-OD1 2.66Å; R371-D396 PolarHBondContact NH2-OD1 3.01Å; R371-D396 IonicContact NH2-OD2 2.71Å; R371-D396 PolarHBondContact NH2-OD2 3.29Å
372	Q	83	Confident	86.6	Confident	79 Å²	79	47.7 Å²	47.7	37%	0.369	23%	0.225	S	C	.	.	H	α-helix	trans	-79.5	-6	178.9	-63.9	176.5	-6.1	0	0	113.2	K368 Q369 R374 W375 F376	K368-Q372 PolarHBondContact O-N 3.32Å; Q369-Q372 CarbonylContact O-C 3.59Å; Q369-Q372 PolarHBondContact O-N 2.87Å; Q372-R374 PolarHBondContact O-N 3.28Å; Q372-W375 HydrophobicContact CB-CE3 4.07Å; Q372-W375 HydrophobicContact CB-CZ3 4.31Å; Q372-W375 HydrophobicContact CG-CE3 4.22Å; Q372-W375 HydrophobicContact CG-CH2 4.36Å; Q372-W375 HydrophobicContact CG-CZ3 3.94Å; Q372-W375 WeakPolarHBondContact O-CB 3.46Å; Q372-W375 PolarHBondContact O-N 3.1Å; Q372-F376 HydrophobicContact CB-CE2 4.19Å; Q372-F376 WeakPolarHBondContact O-CD2 3.3Å
373	I	85.4	Confident	86.8	Confident	2 Å²	2	52 Å²	52	1%	0.01	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-47.8	-35.9	-174	-164.2	162.8	0	0	0	114.5	Q369 L370 R371 W375 F376 A377 A381 F384 N744	Q369-I373 PolarHBondContact O-N 3.17Å; Q369-I373 VanDerWaalsContact O-N 3.16Å; L370-I373 HydrophobicContact CD2-CD1 3.69Å; L370-I373 WeakPolarHBondContact O-CB 3.45Å; L370-I373 WeakPolarHBondContact O-CG2 3.39Å; R371-I373 VanDerWaalsContact C-N 3.26Å; R371-I373 PolarHBondContact O-N 2.88Å; I373-W375 PolarHBondContact O-N 2.95Å; I373-W375 VanDerWaalsContact O-N 3.17Å; I373-F376 PolarHBondContact O-N 2.82Å; I373-A377 PolarHBondContact O-N 3.12Å; I373-A381 HydrophobicContact CG2-CB 4.48Å; I373-F384 HydrophobicContact CD1-CE1 3.99Å; I373-F384 HydrophobicContact CD1-CZ 3.64Å; I373-N744 HydrophobicContact CD1-CB 3.8Å
374	R	81.8	Confident	87.1	Confident	121 Å²	121	51.6 Å²	51.6	46%	0.457	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-64.5	-17.4	-179.3	-64.8	-171.8	-172.1	174.8	7.1	114.5	Q372 F376 A377 S1005	Q372-R374 PolarHBondContact O-N 3.28Å; R374-F376 VanDerWaalsContact C-N 3.3Å; R374-A377 WeakPolarHBondContact CA-O 3.48Å; R374-S1005 PolarHBondContact NH1-OG 3.47Å; R374-S1005 PolarHBondContact NH2-OG 3.1Å
375	W	79.8	Confident	87.5	Confident	192 Å²	192	51.6 Å²	51.6	73%	0.727	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-79.3	-16.8	172.6	-58.7	-16.3	0	0	0	112.4	Q372 I373	Q372-W375 HydrophobicContact CB-CE3 4.07Å; Q372-W375 HydrophobicContact CB-CZ3 4.31Å; Q372-W375 HydrophobicContact CG-CE3 4.22Å; Q372-W375 HydrophobicContact CG-CH2 4.36Å; Q372-W375 HydrophobicContact CG-CZ3 3.94Å; Q372-W375 WeakPolarHBondContact O-CB 3.46Å; Q372-W375 PolarHBondContact O-N 3.1Å; I373-W375 PolarHBondContact O-N 2.95Å; I373-W375 VanDerWaalsContact O-N 3.17Å
376	F	79.8	Confident	87.8	Confident	56 Å²	56	51 Å²	51	25%	0.246	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.3	-25.7	-172.7	-53.7	-82.1	0	0	0	113.4	Q372 I373 R374 E751	Q372-F376 HydrophobicContact CB-CE2 4.19Å; Q372-F376 WeakPolarHBondContact O-CD2 3.3Å; I373-F376 PolarHBondContact O-N 2.82Å; R374-F376 VanDerWaalsContact C-N 3.3Å; F376-E751 HydrophobicContact CE1-CG 4.13Å; F376-E751 HydrophobicContact CZ-CG 4.23Å
377	A	73.8	Confident	88	Confident	23 Å²	23	52.5 Å²	52.5	19%	0.19	24%	0.235	C	C	.	.	S	Bend	trans	-149.1	145.5	176.4	0	0	0	0	0	111.8	I373 R374 C379	I373-A377 PolarHBondContact O-N 3.12Å; R374-A377 WeakPolarHBondContact CA-O 3.48Å; A377-C379 PolarHBondContact O-N 2.94Å
378	D	80	Confident	88.1	Confident	102 Å²	102	52.8 Å²	52.8	55%	0.545	24%	0.237	S	C	.	.	S	Bend	trans	-78.7	62.7	175.2	-163.8	18.8	0	0	0	110.1	P1242 T1243	D378-P1242 WeakPolarHBondContact OD2-CA 3.46Å; D378-T1243 VanDerWaalsContact OD1-CG2 3.27Å; D378-T1243 WeakPolarHBondContact OD1-CG2 3.43Å; D378-T1243 PolarHBondContact OD1-OG1 2.91Å; D378-T1243 PolarHBondContact OD2-N 3.01Å; D378-T1243 PolarHBondContact OD2-OG1 2.76Å
379	C	81.8	Confident	88.3	Confident	39 Å²	39	50.6 Å²	50.6	26%	0.264	23%	0.228	S	C	.	.			trans	-142.5	163	179.4	69.2	0	0	0	0	111.6	A377	A377-C379 PolarHBondContact O-N 2.94Å
380	N	87.9	Confident	88.3	Confident	39 Å²	39	50.2 Å²	50.2	21%	0.209	23%	0.226	C	C	.	.			trans	-113.9	133.5	174.1	-171.6	22.7	0	0	0	110	D382 Y383	N380-D382 PolarHBondContact ND2-OD2 3.19Å; N380-D382 PolarHBondContact O-N 2.84Å; N380-D382 PolarHBondContact OD1-OD2 3.43Å; N380-Y383 HydrophobicContact CB-CD2 3.98Å; N380-Y383 HydrophobicContact CB-CE2 4.17Å; N380-Y383 PolarHBondContact O-N 3.37Å
381	A	93.1	Very high	88.1	Confident	8 Å²	8	50 Å²	50	7%	0.066	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-59.6	-32.5	180	0	0	0	0	0	112.2	L370 I373 Y383 F384 F385	L370-A381 HydrophobicContact CB-CB 3.99Å; L370-A381 HydrophobicContact CD2-CB 4.18Å; I373-A381 HydrophobicContact CG2-CB 4.48Å; A381-Y383 PolarHBondContact O-N 2.72Å; A381-F384 PolarHBondContact O-N 3.45Å; A381-F385 PolarHBondContact O-N 2.81Å
382	D	92.9	Very high	87.7	Confident	52 Å²	52	48 Å²	48	28%	0.278	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-58	-16.5	-177.4	-59.5	-39.5	0	0	0	114.9	N380 P581 Q582 W777	N380-D382 PolarHBondContact ND2-OD2 3.19Å; N380-D382 PolarHBondContact O-N 2.84Å; N380-D382 PolarHBondContact OD1-OD2 3.43Å; D382-P581 HydrophobicContact CB-CB 4.17Å; D382-P581 HydrophobicContact CB-CG 4.02Å; D382-P581 WeakPolarHBondContact O-CB 3.5Å; D382-Q582 PolarHBondContact O-NE2 3.22Å; D382-W777 WeakPolarHBondContact O-CH2 3.36Å; D382-W777 VanDerWaalsContact O-CZ3 3.24Å; D382-W777 WeakPolarHBondContact O-CZ3 3.46Å
383	Y	92.7	Very high	87.8	Confident	127 Å²	127	47.3 Å²	47.3	50%	0.498	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-79.9	-17.4	175.7	-75.3	-76.8	0	0	0	114.5	N380 A381 P581 R775	N380-Y383 HydrophobicContact CB-CD2 3.98Å; N380-Y383 HydrophobicContact CB-CE2 4.17Å; N380-Y383 PolarHBondContact O-N 3.37Å; A381-Y383 PolarHBondContact O-N 2.72Å; Y383-P581 HydrophobicContact CD1-CB 3.79Å; Y383-P581 HydrophobicContact CD1-CG 4.16Å; Y383-P581 HydrophobicContact CD2-CG 4.35Å; Y383-P581 HydrophobicContact CE1-CB 3.85Å; Y383-P581 HydrophobicContact CE1-CG 3.84Å; Y383-P581 HydrophobicContact CE2-CG 4.05Å; Y383-P581 HydrophobicContact CG-CB 4.17Å; Y383-P581 HydrophobicContact CG-CG 4.39Å; Y383-R775 WeakPolarHBondContact O-CD 3.17Å
384	F	94.4	Very high	87.8	Confident	20 Å²	20	52.4 Å²	52.4	9%	0.088	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-143	-2.3	-175.2	70.7	-93.3	0	0	0	114.6	L370 I373 A381 A741 N744 I776 W777 L778	L370-F384 HydrophobicContact CD2-CE2 3.98Å; L370-F384 HydrophobicContact CD2-CZ 3.78Å; I373-F384 HydrophobicContact CD1-CE1 3.99Å; I373-F384 HydrophobicContact CD1-CZ 3.64Å; A381-F384 PolarHBondContact O-N 3.45Å; F384-A741 HydrophobicContact CB-CB 4.35Å; F384-A741 HydrophobicContact CD2-CB 3.46Å; F384-A741 VanDerWaalsContact CD2-CB 3.46Å; F384-A741 HydrophobicContact CE2-CB 3.96Å; F384-A741 HydrophobicContact CG-CB 4.07Å; F384-N744 HydrophobicContact CE1-CB 4.47Å; F384-N744 HydrophobicContact CZ-CB 3.97Å; F384-I776 HydrophobicContact CB-CD1 4.23Å; F384-W777 CarbonylContact O-C 3.58Å; F384-W777 WeakPolarHBondContact O-CA 3.36Å; F384-L778 PolarHBondContact O-N 2.79Å
385	F	96.2	Very high	88.1	Confident	13 Å²	13	54.6 Å²	54.6	6%	0.057	26%	0.263	C	S	.	.	S	Bend	trans	-133.4	123.1	176.7	-178.2	-104.3	0	0	0	109.1	L366 L370 A381 R387 C388 Q582 L778	L366-F385 HydrophobicContact CD2-CE2 3.78Å; L366-F385 HydrophobicContact CD2-CZ 4.36Å; L366-F385 HydrophobicContact CG-CE2 4.08Å; L366-F385 HydrophobicContact CG-CZ 4.33Å; L370-F385 HydrophobicContact CD1-CB 3.81Å; L370-F385 HydrophobicContact CD1-CD1 3.57Å; L370-F385 HydrophobicContact CD1-CD2 3.53Å; L370-F385 HydrophobicContact CD1-CE1 3.92Å; L370-F385 HydrophobicContact CD1-CE2 3.89Å; L370-F385 HydrophobicContact CD1-CG 3.36Å; L370-F385 HydrophobicContact CD1-CZ 4.07Å; A381-F385 PolarHBondContact O-N 2.81Å; F385-R387 PolarHBondContact O-N 3.07Å; F385-C388 HydrophobicContact CE1-CB 3.72Å; F385-C388 HydrophobicContact CZ-CB 4.26Å; F385-Q582 PolarHBondContact O-NE2 3.09Å; F385-Q582 VanDerWaalsContact O-NE2 3.1Å; F385-L778 HydrophobicContact CD2-CB 4.35Å; F385-L778 HydrophobicContact CD2-CG 4.49Å; F385-L778 WeakPolarHBondContact CD2-O 3.26Å
386	P	96.8	Very high	88.5	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.006	23%	0.233	C	C	.	.			trans	-60.6	134.3	176.8	-25.2	36.3	0	0	0	111.3	M585 Q632 I635 W777 L778 I779	P386-M585 HydrophobicContact CB-CE 4.05Å; P386-M585 HydrophobicContact CB-SD 4.48Å; P386-M585 HydrophobicContact CG-CE 4.41Å; P386-M585 HydrophobicContact CG-SD 4.44Å; P386-Q632 HydrophobicContact CB-CG 3.8Å; P386-Q632 WeakPolarHBondContact O-CG 3.37Å; P386-Q632 PolarHBondContact O-NE2 2.98Å; P386-I635 HydrophobicContact CG-CD1 3.97Å; P386-I635 HydrophobicContact CG-CG1 4.15Å; P386-W777 HydrophobicContact CG-CB 4.23Å; P386-W777 HydrophobicContact CG-CE3 4.06Å; P386-L778 WeakPolarHBondContact CD-O 3.21Å; P386-I779 HydrophobicContact CG-CD1 4.17Å
387	R	95.7	Very high	89.1	Confident	33 Å²	33	47.3 Å²	47.3	13%	0.125	24%	0.235	C	C	.	.			trans	-59.5	142.6	-172.5	68.1	-163.6	179.3	-92.2	12.2	112.3	F385 F389 D403 T407 D586 W592 Q632 K633	F385-R387 PolarHBondContact O-N 3.07Å; R387-F389 HydrophobicContact CG-CE2 4.4Å; R387-D403 WeakPolarHBondContact CD-OD2 3.19Å; R387-D403 IonicContact CZ-OD1 3.78Å; R387-D403 IonicContact NE-OD1 3.86Å; R387-D403 PolarHBondContact NE-OD1 2.94Å; R387-D403 IonicContact NE-OD2 2.77Å; R387-D403 PolarHBondContact NE-OD2 2.99Å; R387-D403 IonicContact NH2-OD1 2.93Å; R387-D403 PolarHBondContact NH2-OD1 3.46Å; R387-D403 VanDerWaalsContact NH2-OD1 3.14Å; R387-T407 PolarHBondContact NH2-OG1 3.45Å; R387-D586 IonicContact CZ-OD1 3.99Å; R387-D586 IonicContact CZ-OD2 3.86Å; R387-D586 VanDerWaalsContact NH1-CG 3.3Å; R387-D586 IonicContact NH1-OD1 3.7Å; R387-D586 PolarHBondContact NH1-OD1 3.17Å; R387-D586 IonicContact NH1-OD2 2.98Å; R387-D586 PolarHBondContact NH1-OD2 2.95Å; R387-D586 VanDerWaalsContact NH1-OD2 3.12Å; R387-D586 IonicContact NH2-OD1 2.73Å; R387-D586 IonicContact NH2-OD2 3.73Å; R387-D586 PolarHBondContact NH2-OD2 3.18Å; R387-W592 HydrophobicContact CG-CH2 4.12Å; R387-W592 HydrophobicContact CG-CZ3 4.37Å; R387-Q632 CarbonylContact O-C 3.58Å; R387-Q632 WeakPolarHBondContact O-CA 3.48Å; R387-K633 HydrophobicContact CG-CB 4.06Å; R387-K633 PolarHBondContact O-N 3.42Å
388	C	94.7	Very high	89.9	Confident	10 Å²	10	50.2 Å²	50.2	7%	0.068	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	134.3	-159.9	-174.1	0	0	0	0	112.1	C367 R371 F385 I630 V631 Q632	C367-C388 PolarHBondContact SG-O 3.11Å; C367-C388 VanDerWaalsContact SG-O 3.36Å; R371-C388 PolarHBondContact NH2-O 3.02Å; F385-C388 HydrophobicContact CE1-CB 3.72Å; F385-C388 HydrophobicContact CZ-CB 4.26Å; C388-I630 WeakPolarHBondContact SG-CD1 3.27Å; C388-V631 CarbonylContact C-O 3.57Å; C388-V631 VanDerWaalsContact CA-O 3.29Å; C388-V631 WeakPolarHBondContact CA-O 3.35Å; C388-Q632 HydrophobicContact CB-CB 4.31Å; C388-Q632 HydrophobicContact CB-CG 4.27Å
389	F	93.8	Very high	90.6	Very high	26 Å²	26	47.9 Å²	47.9	11%	0.114	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	145.5	-175.5	-54.1	-86.1	0	0	0	111	R387 D396 F400 D403 W592 I630 V631	R387-F389 HydrophobicContact CG-CE2 4.4Å; F389-D396 WeakPolarHBondContact CA-OD2 3.5Å; F389-F400 HydrophobicContact CB-CB 3.9Å; F389-F400 HydrophobicContact CD1-CB 4.27Å; F389-F400 HydrophobicContact CD2-CB 3.82Å; F389-F400 HydrophobicContact CD2-CD2 4.13Å; F389-F400 HydrophobicContact CD2-CG 4.42Å; F389-F400 HydrophobicContact CE2-CB 4.41Å; F389-F400 HydrophobicContact CG-CB 3.74Å; F389-D403 HydrophobicContact CE2-CB 4.11Å; F389-D403 HydrophobicContact CZ-CB 3.98Å; F389-D403 WeakPolarHBondContact CZ-OD2 3.4Å; F389-W592 HydrophobicContact CD2-CH2 4.45Å; F389-W592 AromaticContact CD2-CZ3 3.99Å; F389-W592 HydrophobicContact CD2-CZ3 3.99Å; F389-W592 AromaticContact CE2-CH2 3.91Å; F389-W592 HydrophobicContact CE2-CH2 3.91Å; F389-W592 AromaticContact CE2-CZ3 3.87Å; F389-W592 HydrophobicContact CE2-CZ3 3.87Å; F389-I630 CarbonylContact O-C 3.59Å; F389-I630 WeakPolarHBondContact O-CA 3.46Å; F389-I630 WeakPolarHBondContact O-CB 3.41Å; F389-V631 HydrophobicContact CB-CG2 4.18Å; F389-V631 PolarHBondContact N-O 3.35Å; F389-V631 PolarHBondContact O-N 3.3Å
390	I	91	Very high	91.2	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	94.1	-177.5	-56.9	158	0	0	0	106.9	V364 K368 S392 E393 D396 I630	V364-I390 HydrophobicContact CG1-CD1 4.02Å; V364-I390 HydrophobicContact CG1-CG1 4.39Å; K368-I390 HydrophobicContact CD-CD1 4.36Å; K368-I390 HydrophobicContact CG-CD1 3.77Å; I390-S392 WeakPolarHBondContact CG2-OG 3.45Å; I390-S392 PolarHBondContact O-N 3.19Å; I390-E393 HydrophobicContact CG2-CG 4.26Å; I390-E393 PolarHBondContact O-N 3.28Å; I390-D396 WeakPolarHBondContact CB-OD2 3.28Å; I390-D396 PolarHBondContact N-OD2 3Å; I390-D396 WeakPolarHBondContact O-CB 3.4Å; I390-I630 HydrophobicContact CG1-CG2 3.96Å
391	I	87.3	Confident	91.5	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-7	-165.4	-31.1	167.2	0	0	0	113.3	E393 R397 I614 V618 Y629 V631	I391-E393 PolarHBondContact O-N 3.33Å; I391-R397 HydrophobicContact CG2-CB 3.66Å; I391-R397 HydrophobicContact CG2-CG 3.5Å; I391-R397 VanDerWaalsContact CG2-CG 3.5Å; I391-I614 HydrophobicContact CD1-CG2 4.06Å; I391-V618 HydrophobicContact CB-CG1 4.39Å; I391-V618 HydrophobicContact CB-CG2 3.78Å; I391-V618 HydrophobicContact CD1-CG2 3.53Å; I391-V618 HydrophobicContact CG1-CG2 4.27Å; I391-V618 HydrophobicContact CG2-CG1 4.21Å; I391-V618 HydrophobicContact CG2-CG2 3.79Å; I391-Y629 PolarHBondContact N-O 3.08Å; I391-V631 HydrophobicContact CD1-CB 4.2Å; I391-V631 HydrophobicContact CD1-CG1 3.7Å; I391-V631 HydrophobicContact CD1-CG2 3.69Å; I391-V631 HydrophobicContact CG1-CG2 3.73Å
392	S	79.8	Confident	91.6	Very high	64 Å²	64	48.7 Å²	48.7	45%	0.448	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-1.9	167.2	61.8	0	0	0	0	113.9	I390	I390-S392 WeakPolarHBondContact CG2-OG 3.45Å; I390-S392 PolarHBondContact O-N 3.19Å
393	E	85.3	Confident	91.7	Very high	64 Å²	64	47.5 Å²	47.5	30%	0.299	23%	0.231	S	C	.	.	S	Bend	trans	-115.3	127.1	175.9	-68.9	169	-164	0	0	108.2	K368 I390 I391 D396 R397	K368-E393 WeakPolarHBondContact CE-OE1 3.29Å; K368-E393 IonicContact NZ-OE1 3.88Å; K368-E393 PolarHBondContact NZ-OE1 3.36Å; K368-E393 IonicContact NZ-OE2 3.8Å; K368-E393 PolarHBondContact NZ-OE2 3.01Å; I390-E393 HydrophobicContact CG2-CG 4.26Å; I390-E393 PolarHBondContact O-N 3.28Å; I391-E393 PolarHBondContact O-N 3.33Å; E393-D396 HydrophobicContact CB-CB 4.06Å; E393-D396 VanDerWaalsContact O-CB 3.29Å; E393-D396 WeakPolarHBondContact O-CB 3.19Å; E393-D396 PolarHBondContact O-N 2.99Å; E393-R397 PolarHBondContact O-N 3.27Å
394	E	85.2	Confident	91.9	Very high	110 Å²	110	41.5 Å²	41.5	51%	0.514	21%	0.207	S	C	.	.	H	α-helix	trans	-65.7	-47.3	-164.2	-169.9	62.4	-127.2	0	0	113.2	D396 R397 Q398	E394-D396 PolarHBondContact O-N 2.75Å; E394-R397 VanDerWaalsContact CD-CZ 3.49Å; E394-R397 WeakPolarHBondContact O-CB 3.44Å; E394-R397 PolarHBondContact O-N 3.3Å; E394-R397 VanDerWaalsContact O-N 3.11Å; E394-R397 IonicContact OE1-CZ 3.64Å; E394-R397 IonicContact OE1-NE 3.99Å; E394-R397 PolarHBondContact OE1-NE 3.23Å; E394-R397 IonicContact OE1-NH2 2.79Å; E394-R397 PolarHBondContact OE1-NH2 3.29Å; E394-R397 IonicContact OE2-CZ 3.97Å; E394-R397 IonicContact OE2-NE 2.85Å; E394-R397 IonicContact OE2-NH1 2.73Å; E394-R397 PolarHBondContact OE2-NH1 2.82Å; E394-R397 IonicContact OE2-NH2 3.25Å; E394-R397 PolarHBondContact OE2-NH2 2.93Å; E394-Q398 PolarHBondContact O-N 2.98Å
395	E	87.3	Confident	92	Very high	167 Å²	167	42.7 Å²	42.7	78%	0.78	21%	0.211	S	C	*	.	H	α-helix	trans	-57.8	-38	176.2	-63.1	165.6	-171.2	0	0	111.4	S399	E395-S399 VanDerWaalsContact O-CB 3.26Å; E395-S399 WeakPolarHBondContact O-CB 3.17Å; E395-S399 PolarHBondContact O-N 2.78Å; E395-S399 PolarHBondContact O-OG 3.16Å
396	D	89.8	Confident	92	Very high	17 Å²	17	44 Å²	44	9%	0.091	22%	0.218	C	C	.	.	H	α-helix	trans	-69.3	-41.1	176.3	-107	38.3	0	0	0	112.1	R371 F389 I390 E393 E394 S399 F400	R371-D396 IonicContact CZ-OD1 3.66Å; R371-D396 IonicContact CZ-OD2 3.21Å; R371-D396 VanDerWaalsContact CZ-OD2 3.31Å; R371-D396 VanDerWaalsContact NH1-CG 3.27Å; R371-D396 IonicContact NH1-OD1 3.12Å; R371-D396 PolarHBondContact NH1-OD1 3.09Å; R371-D396 IonicContact NH1-OD2 2.79Å; R371-D396 PolarHBondContact NH1-OD2 3.26Å; R371-D396 VanDerWaalsContact NH1-OD2 3.08Å; R371-D396 IonicContact NH2-OD1 2.66Å; R371-D396 PolarHBondContact NH2-OD1 3.01Å; R371-D396 IonicContact NH2-OD2 2.71Å; R371-D396 PolarHBondContact NH2-OD2 3.29Å; F389-D396 WeakPolarHBondContact CA-OD2 3.5Å; I390-D396 WeakPolarHBondContact CB-OD2 3.28Å; I390-D396 PolarHBondContact N-OD2 3Å; I390-D396 WeakPolarHBondContact O-CB 3.4Å; E393-D396 HydrophobicContact CB-CB 4.06Å; E393-D396 VanDerWaalsContact O-CB 3.29Å; E393-D396 WeakPolarHBondContact O-CB 3.19Å; E393-D396 PolarHBondContact O-N 2.99Å; E394-D396 PolarHBondContact O-N 2.75Å; D396-S399 PolarHBondContact O-N 2.91Å; D396-F400 WeakPolarHBondContact O-CB 3.43Å; D396-F400 PolarHBondContact O-N 3.2Å
397	R	91.1	Very high	92.1	Very high	78 Å²	78	44.1 Å²	44.1	29%	0.294	22%	0.219	S	C	.	.	H	α-helix	trans	-63.1	-46	175.1	-179.7	169.3	77.2	-151.9	13.1	111.3	I391 E393 E394 F400 I401 L615	I391-R397 HydrophobicContact CG2-CB 3.66Å; I391-R397 HydrophobicContact CG2-CG 3.5Å; I391-R397 VanDerWaalsContact CG2-CG 3.5Å; E393-R397 PolarHBondContact O-N 3.27Å; E394-R397 VanDerWaalsContact CD-CZ 3.49Å; E394-R397 WeakPolarHBondContact O-CB 3.44Å; E394-R397 PolarHBondContact O-N 3.3Å; E394-R397 VanDerWaalsContact O-N 3.11Å; E394-R397 IonicContact OE1-CZ 3.64Å; E394-R397 IonicContact OE1-NE 3.99Å; E394-R397 PolarHBondContact OE1-NE 3.23Å; E394-R397 IonicContact OE1-NH2 2.79Å; E394-R397 PolarHBondContact OE1-NH2 3.29Å; E394-R397 IonicContact OE2-CZ 3.97Å; E394-R397 IonicContact OE2-NE 2.85Å; E394-R397 IonicContact OE2-NH1 2.73Å; E394-R397 PolarHBondContact OE2-NH1 2.82Å; E394-R397 IonicContact OE2-NH2 3.25Å; E394-R397 PolarHBondContact OE2-NH2 2.93Å; R397-F400 PolarHBondContact O-N 2.88Å; R397-I401 HydrophobicContact CG-CD1 4.08Å; R397-I401 WeakPolarHBondContact O-CG1 3.45Å; R397-I401 PolarHBondContact O-N 3.37Å; R397-L615 HydrophobicContact CG-CD2 4.35Å
398	Q	91.6	Very high	92.2	Very high	84 Å²	84	42.6 Å²	42.6	39%	0.393	21%	0.213	S	C	.	.	H	α-helix	trans	-67.9	-37.3	177.2	-171	56.6	55.2	0	0	111.8	E394 I401 N402	E394-Q398 PolarHBondContact O-N 2.98Å; Q398-I401 PolarHBondContact O-N 3.49Å; Q398-N402 PolarHBondContact NE2-OD1 3.16Å; Q398-N402 WeakPolarHBondContact O-CB 3.31Å; Q398-N402 PolarHBondContact O-N 2.98Å; Q398-N402 PolarHBondContact O-ND2 3.01Å; Q398-N402 PolarHBondContact O-OD1 2.98Å
399	S	93.1	Very high	92.3	Very high	53 Å²	53	42.1 Å²	42.1	37%	0.371	21%	0.21	S	C	.	.	H	α-helix	trans	-61.6	-43.7	173.4	-62.6	0	0	0	0	111.8	E395 D396 N402 D403	E395-S399 VanDerWaalsContact O-CB 3.26Å; E395-S399 WeakPolarHBondContact O-CB 3.17Å; E395-S399 PolarHBondContact O-N 2.78Å; E395-S399 PolarHBondContact O-OG 3.16Å; D396-S399 PolarHBondContact O-N 2.91Å; S399-N402 PolarHBondContact O-N 3.01Å; S399-D403 WeakPolarHBondContact O-CB 3.18Å; S399-D403 PolarHBondContact O-N 2.8Å
400	F	95.1	Very high	92.4	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.4	-45	173.3	162.9	-112.5	0	0	0	112.6	F389 D396 R397 N402 D403 F404 W592 L611 I614 L615 V631	F389-F400 HydrophobicContact CB-CB 3.9Å; F389-F400 HydrophobicContact CD1-CB 4.27Å; F389-F400 HydrophobicContact CD2-CB 3.82Å; F389-F400 HydrophobicContact CD2-CD2 4.13Å; F389-F400 HydrophobicContact CD2-CG 4.42Å; F389-F400 HydrophobicContact CE2-CB 4.41Å; F389-F400 HydrophobicContact CG-CB 3.74Å; D396-F400 WeakPolarHBondContact O-CB 3.43Å; D396-F400 PolarHBondContact O-N 3.2Å; R397-F400 PolarHBondContact O-N 2.88Å; F400-N402 VanDerWaalsContact C-N 3.28Å; F400-N402 PolarHBondContact O-N 3.04Å; F400-D403 PolarHBondContact O-N 2.91Å; F400-F404 HydrophobicContact CE2-CB 4.22Å; F400-F404 HydrophobicContact CE2-CD2 4.11Å; F400-F404 HydrophobicContact CZ-CB 4.43Å; F400-F404 HydrophobicContact CZ-CD2 4.03Å; F400-F404 WeakPolarHBondContact O-CB 3.43Å; F400-F404 PolarHBondContact O-N 3.18Å; F400-W592 HydrophobicContact CD2-CD2 4.32Å; F400-W592 HydrophobicContact CD2-CE3 4.07Å; F400-W592 HydrophobicContact CD2-CH2 4.35Å; F400-W592 HydrophobicContact CD2-CZ3 4.1Å; F400-W592 AromaticContact CE2-CD2 3.67Å; F400-W592 HydrophobicContact CE2-CD2 3.67Å; F400-W592 AromaticContact CE2-CE2 3.95Å; F400-W592 AromaticContact CE2-CE3 3.83Å; F400-W592 HydrophobicContact CE2-CE3 3.83Å; F400-W592 HydrophobicContact CE2-CG 4.04Å; F400-W592 HydrophobicContact CE2-CZ2 4.39Å; F400-W592 HydrophobicContact CE2-CZ3 4.27Å; F400-L611 HydrophobicContact CD1-CD1 4.39Å; F400-L611 HydrophobicContact CE1-CD1 3.51Å; F400-L611 HydrophobicContact CZ-CD1 3.75Å; F400-I614 HydrophobicContact CE1-CB 4.42Å; F400-I614 HydrophobicContact CE1-CG2 3.65Å; F400-I614 HydrophobicContact CZ-CB 4.27Å; F400-I614 HydrophobicContact CZ-CD1 3.86Å; F400-I614 HydrophobicContact CZ-CG2 3.67Å; F400-L615 HydrophobicContact CE1-CD2 4.35Å; F400-V631 HydrophobicContact CB-CG2 4.45Å; F400-V631 HydrophobicContact CD1-CG2 4.17Å; F400-V631 HydrophobicContact CD2-CG2 3.58Å; F400-V631 HydrophobicContact CE1-CG2 4.39Å; F400-V631 HydrophobicContact CE2-CB 4.49Å; F400-V631 HydrophobicContact CE2-CG2 3.85Å; F400-V631 HydrophobicContact CG-CG2 3.77Å; F400-V631 HydrophobicContact CZ-CG2 4.26Å
401	I	95	Very high	92.7	Very high	19 Å²	19	41 Å²	41	10%	0.097	21%	0.206	C	C	.	.	H	α-helix	trans	-58.6	-43	176.8	-72.6	162.9	0	0	0	110.6	R397 Q398 R405 L611 L615	R397-I401 HydrophobicContact CG-CD1 4.08Å; R397-I401 WeakPolarHBondContact O-CG1 3.45Å; R397-I401 PolarHBondContact O-N 3.37Å; Q398-I401 PolarHBondContact O-N 3.49Å; I401-R405 WeakPolarHBondContact O-CB 3.45Å; I401-R405 WeakPolarHBondContact O-CD 3.49Å; I401-R405 VanDerWaalsContact O-CG 3.24Å; I401-R405 WeakPolarHBondContact O-CG 3.48Å; I401-R405 PolarHBondContact O-N 3.24Å; I401-R405 VanDerWaalsContact O-N 3.08Å; I401-L611 HydrophobicContact CG1-CD1 4.23Å; I401-L611 HydrophobicContact CG2-CD2 4.34Å; I401-L615 HydrophobicContact CD1-CD1 4.23Å; I401-L615 HydrophobicContact CD1-CD2 4.24Å; I401-L615 HydrophobicContact CG1-CD1 4.3Å; I401-L615 HydrophobicContact CG1-CD2 4.28Å
402	N	94.3	Very high	93.1	Very high	84 Å²	84	41 Å²	41	45%	0.449	21%	0.205	S	C	.	.	H	α-helix	trans	-67.9	-40.2	177.9	-66.1	-10.6	0	0	0	112.2	Q398 S399 F400 R405 L406	Q398-N402 PolarHBondContact NE2-OD1 3.16Å; Q398-N402 WeakPolarHBondContact O-CB 3.31Å; Q398-N402 PolarHBondContact O-N 2.98Å; Q398-N402 PolarHBondContact O-ND2 3.01Å; Q398-N402 PolarHBondContact O-OD1 2.98Å; S399-N402 PolarHBondContact O-N 3.01Å; F400-N402 VanDerWaalsContact C-N 3.28Å; F400-N402 PolarHBondContact O-N 3.04Å; N402-R405 PolarHBondContact O-N 2.7Å; N402-L406 VanDerWaalsContact O-CB 3.31Å; N402-L406 WeakPolarHBondContact O-CB 3.48Å; N402-L406 PolarHBondContact O-N 3.1Å
403	D	95.7	Very high	93.8	Very high	27 Å²	27	38 Å²	38	14%	0.144	18%	0.184	C	C	.	.	H	α-helix	trans	-64.8	-45.9	175.6	-167.6	-42	0	0	0	111.8	R387 F389 S399 F400 R405 L406 T407 W592	R387-D403 WeakPolarHBondContact CD-OD2 3.19Å; R387-D403 IonicContact CZ-OD1 3.78Å; R387-D403 IonicContact NE-OD1 3.86Å; R387-D403 PolarHBondContact NE-OD1 2.94Å; R387-D403 IonicContact NE-OD2 2.77Å; R387-D403 PolarHBondContact NE-OD2 2.99Å; R387-D403 IonicContact NH2-OD1 2.93Å; R387-D403 PolarHBondContact NH2-OD1 3.46Å; R387-D403 VanDerWaalsContact NH2-OD1 3.14Å; F389-D403 HydrophobicContact CE2-CB 4.11Å; F389-D403 HydrophobicContact CZ-CB 3.98Å; F389-D403 WeakPolarHBondContact CZ-OD2 3.4Å; S399-D403 WeakPolarHBondContact O-CB 3.18Å; S399-D403 PolarHBondContact O-N 2.8Å; F400-D403 PolarHBondContact O-N 2.91Å; D403-R405 VanDerWaalsContact C-N 3.33Å; D403-R405 PolarHBondContact O-N 3.11Å; D403-L406 PolarHBondContact O-N 3.04Å; D403-T407 VanDerWaalsContact O-CB 3.23Å; D403-T407 WeakPolarHBondContact O-CB 3.35Å; D403-T407 PolarHBondContact O-N 2.91Å; D403-T407 PolarHBondContact O-OG1 2.91Å; D403-T407 PolarHBondContact OD1-OG1 3.29Å; D403-W592 HydrophobicContact CB-CH2 4.32Å; D403-W592 WeakPolarHBondContact OD1-CH2 3.39Å; D403-W592 WeakPolarHBondContact OD1-CZ2 3.11Å
404	F	97.2	Very high	94.3	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-57.4	-47.8	175.8	-170.8	-72.6	0	0	0	110.9	F400 T407 A408 L546 Y550 N590 W592 D609 L611 I614	F400-F404 HydrophobicContact CE2-CB 4.22Å; F400-F404 HydrophobicContact CE2-CD2 4.11Å; F400-F404 HydrophobicContact CZ-CB 4.43Å; F400-F404 HydrophobicContact CZ-CD2 4.03Å; F400-F404 WeakPolarHBondContact O-CB 3.43Å; F400-F404 PolarHBondContact O-N 3.18Å; F404-T407 PolarHBondContact O-N 3.17Å; F404-A408 PolarHBondContact O-N 2.8Å; F404-L546 HydrophobicContact CD1-CD2 4.19Å; F404-L546 HydrophobicContact CE1-CD2 3.99Å; F404-Y550 HydrophobicContact CE1-CE1 4.4Å; F404-Y550 WeakPolarHBondContact CE1-OH 3.36Å; F404-Y550 HydrophobicContact CZ-CE1 4.32Å; F404-Y550 WeakPolarHBondContact CZ-OH 3.39Å; F404-N590 WeakPolarHBondContact CE1-ND2 3.38Å; F404-N590 PolarHBondContact O-ND2 2.89Å; F404-W592 AromaticContact CD2-CD1 3.49Å; F404-W592 VanDerWaalsContact CD2-CD1 3.49Å; F404-W592 HydrophobicContact CD2-CG 4.42Å; F404-W592 AromaticContact CD2-NE1 3.36Å; F404-W592 AromaticContact CE2-CD1 3.59Å; F404-W592 AromaticContact CE2-NE1 3.81Å; F404-D609 WeakPolarHBondContact CZ-O 3.45Å; F404-L611 HydrophobicContact CB-CD1 4.15Å; F404-L611 HydrophobicContact CD1-CB 3.87Å; F404-L611 HydrophobicContact CD1-CD1 4.42Å; F404-L611 HydrophobicContact CD1-CD2 4.29Å; F404-L611 HydrophobicContact CD1-CG 4.42Å; F404-L611 HydrophobicContact CD2-CB 4.36Å; F404-L611 HydrophobicContact CD2-CD1 4.22Å; F404-L611 HydrophobicContact CE1-CB 3.85Å; F404-L611 HydrophobicContact CE2-CB 4.32Å; F404-L611 HydrophobicContact CG-CB 4.17Å; F404-L611 HydrophobicContact CG-CD1 3.99Å; F404-L611 HydrophobicContact CG-CG 4.48Å; F404-L611 HydrophobicContact CZ-CB 4.09Å; F404-I614 HydrophobicContact CD2-CD1 4.44Å; F404-I614 HydrophobicContact CE2-CD1 4.17Å
405	R	97	Very high	94.8	Very high	45 Å²	45	31.6 Å²	31.6	17%	0.17	15%	0.154	C	C	.	.	H	α-helix	trans	-60.5	-49.8	178.2	-81.1	171.7	173.9	-175.5	-3.6	112.1	I401 N402 D403 T407 A408 C409 W542 D543 L546	I401-R405 WeakPolarHBondContact O-CB 3.45Å; I401-R405 WeakPolarHBondContact O-CD 3.49Å; I401-R405 VanDerWaalsContact O-CG 3.24Å; I401-R405 WeakPolarHBondContact O-CG 3.48Å; I401-R405 PolarHBondContact O-N 3.24Å; I401-R405 VanDerWaalsContact O-N 3.08Å; N402-R405 PolarHBondContact O-N 2.7Å; D403-R405 VanDerWaalsContact C-N 3.33Å; D403-R405 PolarHBondContact O-N 3.11Å; R405-T407 PolarHBondContact O-N 3.1Å; R405-A408 WeakPolarHBondContact O-CB 3.4Å; R405-A408 PolarHBondContact O-N 3.13Å; R405-C409 PolarHBondContact O-N 2.97Å; R405-C409 PolarHBondContact O-SG 3.49Å; R405-W542 HydrophobicContact CB-CD2 4.28Å; R405-W542 HydrophobicContact CB-CE3 3.71Å; R405-W542 HydrophobicContact CB-CH2 3.9Å; R405-W542 HydrophobicContact CB-CZ2 4.44Å; R405-W542 HydrophobicContact CB-CZ3 3.51Å; R405-W542 HydrophobicContact CG-CD2 3.98Å; R405-W542 HydrophobicContact CG-CE3 3.57Å; R405-W542 HydrophobicContact CG-CZ3 3.94Å; R405-D543 IonicContact NH2-OD1 2.72Å; R405-L546 HydrophobicContact CG-CD1 4.31Å
406	L	95.9	Very high	95.1	Very high	41 Å²	41	23.7 Å²	23.7	22%	0.215	12%	0.117	C	C	.	.	H	α-helix	trans	-63.2	-40	176.5	177	61.5	0	0	0	112.2	N402 D403 A408 C409 L410 F519	N402-L406 VanDerWaalsContact O-CB 3.31Å; N402-L406 WeakPolarHBondContact O-CB 3.48Å; N402-L406 PolarHBondContact O-N 3.1Å; D403-L406 PolarHBondContact O-N 3.04Å; L406-A408 VanDerWaalsContact C-N 3.28Å; L406-A408 PolarHBondContact O-N 3.26Å; L406-C409 WeakPolarHBondContact O-CB 3.4Å; L406-C409 PolarHBondContact O-N 3.31Å; L406-C409 VanDerWaalsContact O-N 3.16Å; L406-L410 HydrophobicContact CD1-CD1 3.53Å; L406-L410 HydrophobicContact CG-CD1 3.78Å; L406-L410 WeakPolarHBondContact O-CD1 3.28Å; L406-L410 PolarHBondContact O-N 3.04Å; L406-F519 HydrophobicContact CD1-CB 4.12Å; L406-F519 HydrophobicContact CD1-CG 4.45Å; L406-F519 HydrophobicContact CD2-CB 4.47Å; L406-F519 HydrophobicContact CD2-CD2 3.41Å; L406-F519 VanDerWaalsContact CD2-CD2 3.41Å; L406-F519 HydrophobicContact CD2-CE2 3.82Å; L406-F519 HydrophobicContact CD2-CG 4.11Å
407	T	97.5	Very high	95.3	Very high	4 Å²	4	23 Å²	23	3%	0.025	11%	0.114	C	C	.	.	H	α-helix	trans	-64.7	-32.1	178.1	-58.6	0	0	0	0	111.7	R387 D403 F404 R405 S411 N590	R387-T407 PolarHBondContact NH2-OG1 3.45Å; D403-T407 VanDerWaalsContact O-CB 3.23Å; D403-T407 WeakPolarHBondContact O-CB 3.35Å; D403-T407 PolarHBondContact O-N 2.91Å; D403-T407 PolarHBondContact O-OG1 2.91Å; D403-T407 PolarHBondContact OD1-OG1 3.29Å; F404-T407 PolarHBondContact O-N 3.17Å; R405-T407 PolarHBondContact O-N 3.1Å; T407-S411 WeakPolarHBondContact O-CB 3.43Å; T407-S411 PolarHBondContact O-N 2.67Å; T407-S411 PolarHBondContact O-OG 3.3Å; T407-N590 WeakPolarHBondContact CB-OD1 3.35Å; T407-N590 HydrophobicContact CG2-CB 4.28Å; T407-N590 VanDerWaalsContact CG2-OD1 3.23Å; T407-N590 WeakPolarHBondContact CG2-OD1 3.44Å
408	A	97.7	Very high	95.2	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-66.7	-44.4	170.6	0	0	0	0	0	112.2	F404 R405 L406 L410 S411 I412 F545 L546 Y549 N590	F404-A408 PolarHBondContact O-N 2.8Å; R405-A408 WeakPolarHBondContact O-CB 3.4Å; R405-A408 PolarHBondContact O-N 3.13Å; L406-A408 VanDerWaalsContact C-N 3.28Å; L406-A408 PolarHBondContact O-N 3.26Å; A408-L410 PolarHBondContact O-N 3.06Å; A408-S411 WeakPolarHBondContact O-CB 3.28Å; A408-S411 PolarHBondContact O-N 3.2Å; A408-S411 VanDerWaalsContact O-N 3.1Å; A408-I412 PolarHBondContact O-N 3.12Å; A408-I412 VanDerWaalsContact O-N 3.09Å; A408-F545 HydrophobicContact CB-CE1 3.88Å; A408-F545 HydrophobicContact CB-CZ 4.49Å; A408-L546 HydrophobicContact CB-CD2 4.05Å; A408-Y549 HydrophobicContact CB-CD1 3.67Å; A408-Y549 HydrophobicContact CB-CD2 3.9Å; A408-Y549 HydrophobicContact CB-CE1 3.83Å; A408-Y549 HydrophobicContact CB-CE2 4.06Å; A408-Y549 HydrophobicContact CB-CG 3.72Å; A408-N590 PolarHBondContact N-ND2 2.75Å
409	C	97.1	Very high	94.8	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-58.3	-47.1	172.8	-57.9	0	0	0	0	111.9	R405 L406 S411 I412 V413 Q515 F545	R405-C409 PolarHBondContact O-N 2.97Å; R405-C409 PolarHBondContact O-SG 3.49Å; L406-C409 WeakPolarHBondContact O-CB 3.4Å; L406-C409 PolarHBondContact O-N 3.31Å; L406-C409 VanDerWaalsContact O-N 3.16Å; C409-S411 PolarHBondContact O-N 3.09Å; C409-I412 PolarHBondContact O-N 2.67Å; C409-V413 WeakPolarHBondContact O-CG2 3.36Å; C409-V413 PolarHBondContact O-N 3.08Å; C409-V413 VanDerWaalsContact O-N 3.12Å; C409-Q515 HydrophobicContact CB-CB 4.18Å; C409-F545 HydrophobicContact CB-CZ 4.33Å; C409-F545 VanDerWaalsContact SG-CE1 3.56Å; C409-F545 WeakPolarHBondContact SG-CZ 3.34Å
410	L	96.4	Very high	93.2	Very high	4 Å²	4	21.5 Å²	21.5	2%	0.021	11%	0.109	C	C	.	.	H	α-helix	trans	-59.7	-35.3	174.9	-93.1	78.1	0	0	0	112.1	L406 A408 V413 K414 L576 F583	L406-L410 HydrophobicContact CD1-CD1 3.53Å; L406-L410 HydrophobicContact CG-CD1 3.78Å; L406-L410 WeakPolarHBondContact O-CD1 3.28Å; L406-L410 PolarHBondContact O-N 3.04Å; A408-L410 PolarHBondContact O-N 3.06Å; L410-V413 PolarHBondContact O-N 2.71Å; L410-K414 WeakPolarHBondContact O-CB 3.35Å; L410-K414 VanDerWaalsContact O-CG 3.24Å; L410-K414 WeakPolarHBondContact O-CG 3.24Å; L410-K414 PolarHBondContact O-N 2.92Å; L410-L576 HydrophobicContact CD1-CD2 4.44Å; L410-L576 HydrophobicContact CG-CD1 4.16Å; L410-L576 HydrophobicContact CG-CD2 4.47Å; L410-F583 HydrophobicContact CD2-CD2 3.98Å; L410-F583 HydrophobicContact CD2-CE2 4.11Å
411	S	97	Very high	91.3	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-67.9	-42.9	180	-61.7	0	0	0	0	111.8	T407 A408 C409 K414 M415 V588	T407-S411 WeakPolarHBondContact O-CB 3.43Å; T407-S411 PolarHBondContact O-N 2.67Å; T407-S411 PolarHBondContact O-OG 3.3Å; A408-S411 WeakPolarHBondContact O-CB 3.28Å; A408-S411 PolarHBondContact O-N 3.2Å; A408-S411 VanDerWaalsContact O-N 3.1Å; C409-S411 PolarHBondContact O-N 3.09Å; S411-K414 PolarHBondContact O-N 3.33Å; S411-M415 VanDerWaalsContact O-CG 3.24Å; S411-M415 WeakPolarHBondContact O-CG 3.27Å; S411-M415 PolarHBondContact O-N 3.06Å; S411-V588 VanDerWaalsContact CB-O 3.32Å; S411-V588 WeakPolarHBondContact CB-O 3.42Å; S411-V588 PolarHBondContact OG-O 2.95Å
412	I	96	Very high	89.1	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-61.8	-45.5	173.9	-67.2	174.9	0	0	0	110.5	A408 C409 K414 M415 I416 I508 S512 F545 Y549 I552 L559	A408-I412 PolarHBondContact O-N 3.12Å; A408-I412 VanDerWaalsContact O-N 3.09Å; C409-I412 PolarHBondContact O-N 2.67Å; I412-K414 VanDerWaalsContact C-N 3.35Å; I412-K414 PolarHBondContact O-N 2.73Å; I412-M415 PolarHBondContact O-N 2.67Å; I412-M415 VanDerWaalsContact O-N 3.16Å; I412-I416 HydrophobicContact CG2-CD1 3.76Å; I412-I416 HydrophobicContact CG2-CG1 4.42Å; I412-I416 WeakPolarHBondContact O-CG1 3.09Å; I412-I416 PolarHBondContact O-N 3.4Å; I412-I508 HydrophobicContact CD1-CG2 4.2Å; I412-S512 WeakPolarHBondContact CD1-OG 3.04Å; I412-F545 HydrophobicContact CD1-CE2 3.86Å; I412-F545 HydrophobicContact CD1-CZ 3.84Å; I412-Y549 HydrophobicContact CD1-CD2 4.1Å; I412-Y549 HydrophobicContact CG1-CD2 3.95Å; I412-I552 HydrophobicContact CD1-CD1 3.79Å; I412-I552 HydrophobicContact CG1-CD1 4.34Å; I412-I552 HydrophobicContact CG1-CG2 4.48Å; I412-L559 HydrophobicContact CG2-CD2 4.27Å
413	V	95.8	Very high	86.3	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62.4	-38.8	177.3	175.3	0	0	0	0	111.9	C409 L410 A417 I513 C569 L572	C409-V413 WeakPolarHBondContact O-CG2 3.36Å; C409-V413 PolarHBondContact O-N 3.08Å; C409-V413 VanDerWaalsContact O-N 3.12Å; L410-V413 PolarHBondContact O-N 2.71Å; V413-A417 VanDerWaalsContact O-CB 3.29Å; V413-A417 WeakPolarHBondContact O-CB 3.33Å; V413-A417 PolarHBondContact O-N 2.9Å; V413-I513 HydrophobicContact CG2-CG1 4.13Å; V413-C569 HydrophobicContact CG1-CB 3.99Å; V413-L572 HydrophobicContact CG1-CB 4.31Å; V413-L572 HydrophobicContact CG1-CD2 3.91Å; V413-L572 HydrophobicContact CG1-CG 4.15Å; V413-L572 HydrophobicContact CG2-CD2 4.38Å
414	K	95.2	Very high	83.3	Confident	15 Å²	15	31 Å²	31	7%	0.065	17%	0.168	C	C	.	.	H	α-helix	trans	-63.3	-42.1	172.4	-73.4	172.7	-157.6	-179.5	0	112.5	L410 S411 I412 A417 N418 F583 G587 V588	L410-K414 WeakPolarHBondContact O-CB 3.35Å; L410-K414 VanDerWaalsContact O-CG 3.24Å; L410-K414 WeakPolarHBondContact O-CG 3.24Å; L410-K414 PolarHBondContact O-N 2.92Å; S411-K414 PolarHBondContact O-N 3.33Å; I412-K414 VanDerWaalsContact C-N 3.35Å; I412-K414 PolarHBondContact O-N 2.73Å; K414-A417 PolarHBondContact O-N 2.69Å; K414-N418 PolarHBondContact O-N 2.85Å; K414-N418 PolarHBondContact O-ND2 3.45Å; K414-F583 HydrophobicContact CD-CE1 4.33Å; K414-F583 HydrophobicContact CD-CZ 4.08Å; K414-F583 WeakPolarHBondContact CE-O 3.25Å; K414-F583 HydrophobicContact CG-CE1 4.14Å; K414-F583 HydrophobicContact CG-CE2 4.25Å; K414-F583 HydrophobicContact CG-CZ 3.61Å; K414-F583 PolarHBondContact NZ-O 3.03Å; K414-G587 VanDerWaalsContact CD-O 3.26Å; K414-G587 WeakPolarHBondContact CD-O 3.48Å; K414-G587 PolarHBondContact NZ-O 3.38Å; K414-V588 HydrophobicContact CB-CG1 4.01Å; K414-V588 HydrophobicContact CD-CG1 4.19Å
415	M	94.6	Very high	80.4	Confident	26 Å²	26	37.6 Å²	37.6	13%	0.128	20%	0.199	C	C	.	.	H	α-helix	trans	-64.6	-47.9	179.5	-69.2	167	76	0	0	110.6	S411 I412 A417 N418 L419 I552 I553 P556 L559 V588	S411-M415 VanDerWaalsContact O-CG 3.24Å; S411-M415 WeakPolarHBondContact O-CG 3.27Å; S411-M415 PolarHBondContact O-N 3.06Å; I412-M415 PolarHBondContact O-N 2.67Å; I412-M415 VanDerWaalsContact O-N 3.16Å; M415-A417 VanDerWaalsContact C-N 3.33Å; M415-A417 PolarHBondContact O-N 3.27Å; M415-N418 PolarHBondContact O-N 3.39Å; M415-N418 VanDerWaalsContact O-N 3.12Å; M415-L419 PolarHBondContact O-N 2.89Å; M415-I552 HydrophobicContact CE-CG2 3.8Å; M415-I552 HydrophobicContact SD-CG2 4.19Å; M415-I553 HydrophobicContact CE-CD1 4.18Å; M415-I553 HydrophobicContact SD-CD1 3.67Å; M415-P556 HydrophobicContact CE-CB 3.7Å; M415-L559 HydrophobicContact CB-CD1 3.54Å; M415-L559 HydrophobicContact CE-CD1 3.91Å; M415-L559 HydrophobicContact CG-CD1 4.49Å; M415-L559 HydrophobicContact SD-CD1 4.36Å; M415-V588 HydrophobicContact CG-CB 4.26Å; M415-V588 HydrophobicContact CG-CG1 4Å; M415-V588 HydrophobicContact SD-CB 4.38Å
416	I	95	Very high	77.4	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.3	-41	176.4	-63.1	168.1	0	0	0	111.2	I412 N418 L419 I509 L559 A562 L565 S566 C569	I412-I416 HydrophobicContact CG2-CD1 3.76Å; I412-I416 HydrophobicContact CG2-CG1 4.42Å; I412-I416 WeakPolarHBondContact O-CG1 3.09Å; I412-I416 PolarHBondContact O-N 3.4Å; I416-N418 PolarHBondContact O-N 3.29Å; I416-L419 HydrophobicContact CB-CD1 4.43Å; I416-L419 HydrophobicContact CG2-CD1 4.3Å; I416-L419 PolarHBondContact O-N 3.18Å; I416-I509 HydrophobicContact CD1-CG2 3.55Å; I416-L559 HydrophobicContact CD1-CD2 4.13Å; I416-L559 HydrophobicContact CG1-CD1 4.24Å; I416-L559 HydrophobicContact CG1-CD2 3.93Å; I416-L559 HydrophobicContact CG1-CG 4.48Å; I416-A562 HydrophobicContact CD1-CB 4.02Å; I416-A562 HydrophobicContact CG1-CB 4.14Å; I416-A562 HydrophobicContact CG2-CB 4.3Å; I416-L565 HydrophobicContact CG2-CB 4.09Å; I416-S566 WeakPolarHBondContact O-CB 3.34Å; I416-S566 PolarHBondContact O-OG 2.88Å; I416-C569 HydrophobicContact CB-CB 4.22Å; I416-C569 HydrophobicContact CG2-CB 4Å; I416-C569 VanDerWaalsContact CG2-SG 3.5Å
417	A	93.7	Very high	74.4	Confident	3 Å²	3	41.9 Å²	41.9	3%	0.025	23%	0.225	C	C	.	.	H	α-helix	trans	-58.5	-28.4	176.8	0	0	0	0	0	113.7	V413 K414 M415 C569 Q570	V413-A417 VanDerWaalsContact O-CB 3.29Å; V413-A417 WeakPolarHBondContact O-CB 3.33Å; V413-A417 PolarHBondContact O-N 2.9Å; K414-A417 PolarHBondContact O-N 2.69Å; M415-A417 VanDerWaalsContact C-N 3.33Å; M415-A417 PolarHBondContact O-N 3.27Å; A417-C569 HydrophobicContact CB-CB 3.9Å; A417-Q570 HydrophobicContact CB-CB 4.5Å; A417-Q570 HydrophobicContact CB-CG 3.83Å; A417-Q570 WeakPolarHBondContact O-CG 3.5Å; A417-Q570 PolarHBondContact O-NE2 3.36Å
418	N	88.8	Confident	71.2	Confident	81 Å²	81	44.6 Å²	44.6	43%	0.433	24%	0.244	S	C	.	.	H	α-helix	trans	-90.6	-8.9	-177.5	-66	-13.9	0	0	0	114	K414 M415 I416 I420 S421 D422	K414-N418 PolarHBondContact O-N 2.85Å; K414-N418 PolarHBondContact O-ND2 3.45Å; M415-N418 PolarHBondContact O-N 3.39Å; M415-N418 VanDerWaalsContact O-N 3.12Å; I416-N418 PolarHBondContact O-N 3.29Å; N418-I420 PolarHBondContact O-N 2.99Å; N418-S421 WeakPolarHBondContact O-CA 3.49Å; N418-S421 WeakPolarHBondContact O-CB 3.31Å; N418-S421 PolarHBondContact O-N 3.46Å; N418-D422 PolarHBondContact O-N 3.17Å
419	L	82.8	Confident	68.1	Low	24 Å²	24	51.4 Å²	51.4	13%	0.126	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-17.7	-178.1	-65.5	173.1	0	0	0	114.6	M415 I416 L559 K563	M415-L419 PolarHBondContact O-N 2.89Å; I416-L419 HydrophobicContact CB-CD1 4.43Å; I416-L419 HydrophobicContact CG2-CD1 4.3Å; I416-L419 PolarHBondContact O-N 3.18Å; L419-L559 HydrophobicContact CD1-CB 4.18Å; L419-L559 WeakPolarHBondContact CD1-O 3.39Å; L419-K563 HydrophobicContact CD1-CB 4.44Å
420	I	59.5	Low	65.3	Low	78 Å²	78	55.2 Å²	55.2	40%	0.4	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-28.1	171.2	-73.3	173.8	0	0	0	111.8	N418 V423 S566	N418-I420 PolarHBondContact O-N 2.99Å; I420-V423 WeakPolarHBondContact O-CG2 3.33Å; I420-S566 VanDerWaalsContact CD1-CB 3.45Å
421	S	55.1	Low	62.5	Low	78 Å²	78	59.1 Å²	59.1	55%	0.545	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-33.7	-176.4	-57.5	0	0	0	0	113.1	N418 V423	N418-S421 WeakPolarHBondContact O-CA 3.49Å; N418-S421 WeakPolarHBondContact O-CB 3.31Å; N418-S421 PolarHBondContact O-N 3.46Å; S421-V423 VanDerWaalsContact C-N 3.33Å; S421-V423 PolarHBondContact O-N 3.1Å
422	D	48.4	Very low	59.8	Low	71 Å²	71	68.8 Å²	68.8	38%	0.38	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	1.2	-174.3	-65.6	-34.4	0	0	0	114.4	N418 N424 Q425 L426	N418-D422 PolarHBondContact O-N 3.17Å; D422-N424 VanDerWaalsContact C-N 3.29Å; D422-N424 PolarHBondContact O-N 3.06Å; D422-Q425 PolarHBondContact O-N 3.06Å; D422-L426 HydrophobicContact CB-CD1 4.17Å; D422-L426 PolarHBondContact O-N 3.34Å
423	V	36.4	Very low	56.9	Low	38 Å²	38	72.3 Å²	72.3	23%	0.23	38%	0.382	C	S	.	.	H	α-helix	trans	-53.8	-45.4	179.3	177.8	0	0	0	0	111.3	I420 S421 Q425 L426 D427	I420-V423 WeakPolarHBondContact O-CG2 3.33Å; S421-V423 VanDerWaalsContact C-N 3.33Å; S421-V423 PolarHBondContact O-N 3.1Å; V423-Q425 PolarHBondContact O-N 2.84Å; V423-L426 PolarHBondContact O-N 2.97Å; V423-D427 VanDerWaalsContact CG1-OD2 3.32Å; V423-D427 WeakPolarHBondContact CG1-OD2 3.3Å; V423-D427 WeakPolarHBondContact O-CB 3Å; V423-D427 VanDerWaalsContact O-CG 3.23Å; V423-D427 PolarHBondContact O-N 2.79Å; V423-D427 VanDerWaalsContact O-N 3.08Å
424	N	33.3	Very low	54.1	Low	144 Å²	144	75.4 Å²	75.4	77%	0.77	40%	0.399	S	S	*	.	H	α-helix	trans	-66.3	-7.1	178.1	-67.3	-17.5	0	0	0	114.7	D422	D422-N424 VanDerWaalsContact C-N 3.29Å; D422-N424 PolarHBondContact O-N 3.06Å
425	Q	35.8	Very low	51.3	Low	137 Å²	137	78.9 Å²	78.9	64%	0.64	42%	0.422	S	S	*	.	H	α-helix	trans	-111.9	-42.3	175.4	-62.1	-168.6	28.6	0	0	111.8	D422 V423 S428 F429	D422-Q425 PolarHBondContact O-N 3.06Å; V423-Q425 PolarHBondContact O-N 2.84Å; Q425-S428 PolarHBondContact O-N 3.13Å; Q425-S428 PolarHBondContact O-OG 3.07Å; Q425-F429 PolarHBondContact O-N 2.92Å; Q425-F429 VanDerWaalsContact O-N 3.14Å
426	L	34	Very low	48.7	Very low	84 Å²	84	85.2 Å²	85.2	44%	0.44	45%	0.452	S	S	.	.	H	α-helix	trans	-62.4	-42.8	177.1	-85.9	162.3	0	0	0	112.3	D422 V423 S428 F429 V430	D422-L426 HydrophobicContact CB-CD1 4.17Å; D422-L426 PolarHBondContact O-N 3.34Å; V423-L426 PolarHBondContact O-N 2.97Å; L426-S428 PolarHBondContact O-N 3.35Å; L426-F429 WeakPolarHBondContact O-CA 3.42Å; L426-F429 PolarHBondContact O-N 3.42Å; L426-V430 WeakPolarHBondContact O-CG2 3.32Å; L426-V430 PolarHBondContact O-N 3.07Å
427	D	31.5	Very low	46.1	Very low	92 Å²	92	90.3 Å²	90.3	49%	0.492	48%	0.478	S	S	.	.	H	α-helix	trans	-62	-35.3	178	-63.5	-8.6	0	0	0	110.7	V423 F429 V431	V423-D427 VanDerWaalsContact CG1-OD2 3.32Å; V423-D427 WeakPolarHBondContact CG1-OD2 3.3Å; V423-D427 WeakPolarHBondContact O-CB 3Å; V423-D427 VanDerWaalsContact O-CG 3.23Å; V423-D427 PolarHBondContact O-N 2.79Å; V423-D427 VanDerWaalsContact O-N 3.08Å; D427-F429 VanDerWaalsContact C-N 3.3Å; D427-F429 PolarHBondContact O-N 2.84Å; D427-V431 WeakPolarHBondContact O-CB 3.38Å; D427-V431 VanDerWaalsContact O-CG2 3.25Å; D427-V431 WeakPolarHBondContact O-CG2 3.42Å; D427-V431 PolarHBondContact O-N 2.7Å
428	S	30.5	Very low	43.4	Very low	62 Å²	62	93.7 Å²	93.7	43%	0.434	50%	0.498	S	S	.	.	H	α-helix	trans	-71.2	-21.5	174.5	85.1	0	0	0	0	114.1	Q425 L426 R432	Q425-S428 PolarHBondContact O-N 3.13Å; Q425-S428 PolarHBondContact O-OG 3.07Å; L426-S428 PolarHBondContact O-N 3.35Å; S428-R432 WeakPolarHBondContact O-CB 3.32Å; S428-R432 VanDerWaalsContact O-CD 3.3Å; S428-R432 WeakPolarHBondContact O-CD 3.41Å; S428-R432 VanDerWaalsContact O-CG 3.24Å; S428-R432 WeakPolarHBondContact O-CG 3.34Å
429	F	34.1	Very low	40.8	Very low	142 Å²	142	99 Å²	99	62%	0.623	51%	0.514	S	S	*	.	H	α-helix	trans	-89.1	-43.8	179.1	-167.4	-91.3	0	0	0	111.2	Q425 L426 D427 R432 S433	Q425-F429 PolarHBondContact O-N 2.92Å; Q425-F429 VanDerWaalsContact O-N 3.14Å; L426-F429 WeakPolarHBondContact O-CA 3.42Å; L426-F429 PolarHBondContact O-N 3.42Å; D427-F429 VanDerWaalsContact C-N 3.3Å; D427-F429 PolarHBondContact O-N 2.84Å; F429-R432 PolarHBondContact O-N 2.94Å; F429-S433 WeakPolarHBondContact CE1-OG 3.46Å; F429-S433 WeakPolarHBondContact O-CB 3.08Å; F429-S433 PolarHBondContact O-N 3.37Å; F429-S433 PolarHBondContact O-OG 3.44Å
430	V	38.4	Very low	38.6	Very low	80 Å²	80	104.9 Å²	104.9	49%	0.485	55%	0.545	S	S	.	.	H	α-helix	trans	-64.1	-48.2	177.5	176.7	0	0	0	0	110.6	L426 R432 S433 N434	L426-V430 WeakPolarHBondContact O-CG2 3.32Å; L426-V430 PolarHBondContact O-N 3.07Å; V430-R432 PolarHBondContact O-N 2.86Å; V430-S433 PolarHBondContact O-N 2.63Å; V430-N434 PolarHBondContact O-N 2.64Å
431	V	37.5	Very low	37.3	Very low	86 Å²	86	109.1 Å²	109.1	52%	0.521	57%	0.565	S	S	.	*	H	α-helix	trans	-63.6	-23.2	177.5	174.5	0	0	0	0	112.8	D427	D427-V431 WeakPolarHBondContact O-CB 3.38Å; D427-V431 VanDerWaalsContact O-CG2 3.25Å; D427-V431 WeakPolarHBondContact O-CG2 3.42Å; D427-V431 PolarHBondContact O-N 2.7Å
432	R	38.8	Very low	36.3	Very low	204 Å²	204	111.5 Å²	111.5	77%	0.77	57%	0.572	S	S	*	*	H	α-helix	trans	-87.7	-19.9	172.2	-78.6	-179.7	173.2	168.6	-2.5	114.5	S428 F429 V430	S428-R432 WeakPolarHBondContact O-CB 3.32Å; S428-R432 VanDerWaalsContact O-CD 3.3Å; S428-R432 WeakPolarHBondContact O-CD 3.41Å; S428-R432 VanDerWaalsContact O-CG 3.24Å; S428-R432 WeakPolarHBondContact O-CG 3.34Å; F429-R432 PolarHBondContact O-N 2.94Å; V430-R432 PolarHBondContact O-N 2.86Å
433	S	37	Very low	35.5	Very low	74 Å²	74	114.9 Å²	114.9	52%	0.517	59%	0.59	S	S	.	*	H	α-helix	trans	-93.6	-27	-177.7	-56.2	0	0	0	0	112.3	F429 V430	F429-S433 WeakPolarHBondContact CE1-OG 3.46Å; F429-S433 WeakPolarHBondContact O-CB 3.08Å; F429-S433 PolarHBondContact O-N 3.37Å; F429-S433 PolarHBondContact O-OG 3.44Å; V430-S433 PolarHBondContact O-N 2.63Å
434	N	35.7	Very low	35.4	Very low	65 Å²	65	120.1 Å²	120.1	35%	0.348	62%	0.621	S	S	.	*			trans	-148.7	88.8	178.8	-162.1	-34	0	0	0	111.2	V430 E436 I437	V430-N434 PolarHBondContact O-N 2.64Å; N434-E436 VanDerWaalsContact C-N 3.3Å; N434-E436 PolarHBondContact O-N 2.88Å; N434-I437 HydrophobicContact CB-CD1 3.93Å; N434-I437 HydrophobicContact CB-CG1 4.42Å
435	P	36.9	Very low	35.3	Very low	87 Å²	87	116.5 Å²	116.5	57%	0.565	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-74.4	-15.8	-175	29.9	-35.3	0	0	0	114.1
436	E	39.3	Very low	34.9	Very low	160 Å²	160	118.7 Å²	118.7	75%	0.748	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-73.1	-29.3	-174.9	-58.9	-169.6	151.7	0	0	112.4	N434 V438 Y439	N434-E436 VanDerWaalsContact C-N 3.3Å; N434-E436 PolarHBondContact O-N 2.88Å; E436-V438 PolarHBondContact O-N 3.14Å; E436-Y439 PolarHBondContact O-N 3.07Å
437	I	41.7	Very low	34.8	Very low	106 Å²	106	121.5 Å²	121.5	54%	0.544	65%	0.649	S	S	.	*	G	3₁₀ helix	trans	-60.8	-15.8	-180	-62.4	176.2	0	0	0	112.9	N434	N434-I437 HydrophobicContact CB-CD1 3.93Å; N434-I437 HydrophobicContact CB-CG1 4.42Å
438	V	37.2	Very low	34.6	Very low	75 Å²	75	124.1 Å²	124.1	46%	0.455	66%	0.663	S	S	.	*	G	3₁₀ helix	trans	-80.5	-17.1	-177.6	-175.7	0	0	0	0	113.1	E436 N442	E436-V438 PolarHBondContact O-N 3.14Å; V438-N442 PolarHBondContact O-ND2 3.04Å
439	Y	34.2	Very low	34.7	Very low	193 Å²	193	129.7 Å²	129.7	76%	0.757	68%	0.683	S	S	*	*	S	Bend	trans	-83	-35.3	-173.1	-98.6	-88.9	0	0	0	115.3	E436 M441	E436-Y439 PolarHBondContact O-N 3.07Å; Y439-M441 PolarHBondContact O-N 2.71Å
440	D	35.9	Very low	34.4	Very low	147 Å²	147	129.9 Å²	129.9	79%	0.786	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-77.4	-17.6	-175.4	-89.9	-26.7	0	0	0	115	N442	D440-N442 PolarHBondContact O-N 3.38Å; D440-N442 VanDerWaalsContact O-N 3.1Å
441	M	32.6	Very low	34	Very low	167 Å²	167	133 Å²	133	82%	0.823	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-68.4	-6.7	-179.5	-78.1	-82.3	-172.3	0	0	114.6	Y439	Y439-M441 PolarHBondContact O-N 2.71Å
442	N	34.2	Very low	33.6	Very low	127 Å²	127	136.4 Å²	136.4	68%	0.679	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-108.4	0.8	-170.8	-63.2	-69	0	0	0	114.9	V438 D440	V438-N442 PolarHBondContact O-ND2 3.04Å; D440-N442 PolarHBondContact O-N 3.38Å; D440-N442 VanDerWaalsContact O-N 3.1Å
443	N	31.5	Very low	33	Very low	143 Å²	143	131.2 Å²	131.2	77%	0.765	73%	0.725	S	S	*	*			trans	-128.6	52.6	-169.3	-88.4	-29.8	0	0	0	114.7
444	V	33.8	Very low	32.6	Very low	147 Å²	147	134.2 Å²	134.2	89%	0.891	74%	0.74	S	S	*	*			trans	-131.5	113.4	161.7	-175.6	0	0	0	0	109.4
445	G	30.8	Very low	32.2	Very low	68 Å²	68	140.9 Å²	140.9	70%	0.701	77%	0.766	S	S	*	*			trans	-101.1	150.3	-171	0	0	0	0	0	115.4
446	E	28.1	Very low	31.7	Very low	183 Å²	183	143.3 Å²	143.3	86%	0.855	77%	0.774	S	S	*	*			trans	29.8	98.8	144.2	-55.7	-169.5	139.3	0	0	120.3
447	T	32.1	Very low	31.1	Very low	143 Å²	143	141 Å²	141	88%	0.877	78%	0.776	S	S	*	*			trans	-136.6	119.5	135.5	55.2	0	0	0	0	109.6
448	N	27.5	Very low	30.4	Very low	147 Å²	147	141.2 Å²	141.2	79%	0.786	78%	0.778	S	S	*	*			trans	-93.4	140.5	177.6	-74.3	-67.9	0	0	0	111.2
449	E	31.5	Very low	29.9	Very low	180 Å²	180	144 Å²	144	84%	0.841	80%	0.795	S	S	*	*			trans	-161.1	100.2	134.5	-118.4	173.9	-156.2	0	0	115
450	N	27.3	Very low	29.6	Very low	146 Å²	146	139.8 Å²	139.8	78%	0.781	79%	0.785	S	S	*	*			trans	31.8	91.1	139.2	-59	-40.6	0	0	0	121
451	V	29.8	Very low	29	Very low	144 Å²	144	141.3 Å²	141.3	87%	0.873	79%	0.787	S	S	*	*			trans	-131.7	133.5	137.4	-177.6	0	0	0	0	109.2
452	N	29.8	Very low	29	Very low	159 Å²	159	140.3 Å²	140.3	85%	0.85	78%	0.784	S	S	*	*			trans	-71.7	136.6	-166.2	-78	-62.9	0	0	0	114.5
453	A	25.8	Very low	28.7	Very low	94 Å²	94	142.7 Å²	142.7	78%	0.777	79%	0.791	S	S	*	*			trans	-77.8	139.6	-179.8	0	0	0	0	0	113.4
454	T	28.9	Very low	28.5	Very low	137 Å²	137	139.6 Å²	139.6	84%	0.84	79%	0.793	S	S	*	*			trans	-118.2	119.9	157.5	26.1	0	0	0	0	109.6	N456	T454-N456 PolarHBondContact O-N 2.71Å
455	K	26.4	Very low	28.2	Very low	206 Å²	206	137.5 Å²	137.5	90%	0.896	79%	0.785	S	S	*	*			trans	-75.6	121.5	178.6	-64.3	176.1	179.4	178	0	109.6
456	N	27.8	Very low	28.1	Very low	138 Å²	138	140.3 Å²	140.3	74%	0.738	79%	0.791	S	S	*	*			trans	-136.5	87.8	166.9	-99.4	-26	0	0	0	110.3	T454 N458	T454-N456 PolarHBondContact O-N 2.71Å; N456-N458 PolarHBondContact O-N 2.72Å; N456-N458 VanDerWaalsContact O-N 3.12Å
457	S	26.4	Very low	28.1	Very low	112 Å²	112	139.4 Å²	139.4	78%	0.783	79%	0.791	S	S	*	*			trans	-83	74.5	178.9	53.1	0	0	0	0	111.5	V459	S457-V459 PolarHBondContact O-N 3.33Å; S457-V459 VanDerWaalsContact O-N 3.09Å
458	N	27.3	Very low	28.1	Very low	110 Å²	110	138.9 Å²	138.9	59%	0.588	78%	0.782	S	S	*	*			trans	-84	76.3	179.1	-74.4	-12.8	0	0	0	112	N456 L460	N456-N458 PolarHBondContact O-N 2.72Å; N456-N458 VanDerWaalsContact O-N 3.12Å; N458-L460 PolarHBondContact O-N 2.79Å
459	V	26.1	Very low	28.3	Very low	132 Å²	132	137.3 Å²	137.3	80%	0.8	77%	0.774	S	S	*	*			trans	-74.1	100.2	164.1	179.1	0	0	0	0	108.1	S457 E461	S457-V459 PolarHBondContact O-N 3.33Å; S457-V459 VanDerWaalsContact O-N 3.09Å; V459-E461 PolarHBondContact O-N 2.69Å
460	L	27.3	Very low	28.6	Very low	106 Å²	106	132.7 Å²	132.7	56%	0.555	75%	0.754	S	S	*	*			trans	-84.4	95.6	179.6	-77.3	168.8	0	0	0	111.2	N458 I462	N458-L460 PolarHBondContact O-N 2.79Å; L460-I462 HydrophobicContact CB-CG1 4.29Å; L460-I462 PolarHBondContact O-N 3.27Å
461	E	24.4	Very low	28.9	Very low	178 Å²	178	129.9 Å²	129.9	83%	0.832	75%	0.746	S	S	*	*			trans	-68.1	93.8	162.7	-67.1	-169.4	126.5	0	0	109.9	V459 E463	V459-E461 PolarHBondContact O-N 2.69Å; E461-E463 PolarHBondContact O-N 3.27Å
462	I	31.8	Very low	29	Very low	147 Å²	147	131.8 Å²	131.8	75%	0.754	74%	0.738	S	S	*	*			trans	-82	86.2	177.2	-55.3	-178.2	0	0	0	109.6	L460	L460-I462 HydrophobicContact CB-CG1 4.29Å; L460-I462 PolarHBondContact O-N 3.27Å
463	E	27.4	Very low	29.1	Very low	176 Å²	176	132.1 Å²	132.1	82%	0.822	73%	0.734	S	S	*	*			trans	-61.7	158	163.8	-69.7	-151.4	118	0	0	112	E461 S465	E461-E463 PolarHBondContact O-N 3.27Å; E463-S465 PolarHBondContact O-N 2.84Å
464	G	29.2	Very low	29.4	Very low	78 Å²	78	132.9 Å²	132.9	80%	0.804	73%	0.725	S	S	*	*			trans	-77.4	113.7	-162.4	0	0	0	0	0	115.4
465	S	25.9	Very low	29.7	Very low	104 Å²	104	129.9 Å²	129.9	73%	0.727	71%	0.71	S	S	*	*			trans	-111.4	111.5	160.1	-76.4	0	0	0	0	110.9	E463 N467	E463-S465 PolarHBondContact O-N 2.84Å; S465-N467 VanDerWaalsContact C-N 3.3Å; S465-N467 PolarHBondContact O-N 3.21Å
466	P	29.4	Very low	30	Very low	127 Å²	127	125.3 Å²	125.3	83%	0.825	69%	0.694	S	S	*	*	S	Bend	trans	-88.5	50.3	-169.2	37	-37.9	0	0	0	113.5
467	N	28.6	Very low	30.2	Very low	163 Å²	163	121.2 Å²	121.2	87%	0.872	68%	0.677	S	S	*	*			trans	-154	65.2	175.4	-92.2	-26.8	0	0	0	110.8	S465	S465-N467 VanDerWaalsContact C-N 3.3Å; S465-N467 PolarHBondContact O-N 3.21Å
468	I	31.4	Very low	30.5	Very low	133 Å²	133	123.1 Å²	123.1	68%	0.682	67%	0.671	S	S	*	*			trans	-101.1	121.4	162	-63.3	178.4	0	0	0	106.9
469	D	32.1	Very low	30.7	Very low	114 Å²	114	120.4 Å²	120.4	61%	0.61	66%	0.656	S	S	*	*			trans	-76.6	121.9	-179.3	-178.3	10.5	0	0	0	110.8	S471	D469-S471 VanDerWaalsContact C-N 3.3Å; D469-S471 WeakPolarHBondContact OD1-CB 3.47Å; D469-S471 PolarHBondContact OD1-N 2.96Å; D469-S471 PolarHBondContact OD1-OG 3.21Å; D469-S471 VanDerWaalsContact OD1-OG 3.09Å; D469-S471 PolarHBondContact OD2-OG 3.36Å
470	L	36.8	Very low	31	Very low	82 Å²	82	119.4 Å²	119.4	43%	0.429	65%	0.646	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83	-3.4	178.4	-69.2	171.6	0	0	0	113	R472 Y524	L470-R472 PolarHBondContact O-N 3.48Å; L470-Y524 HydrophobicContact CD1-CE2 4.48Å
471	S	33.7	Very low	31.3	Very low	87 Å²	87	118.9 Å²	118.9	61%	0.608	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	-17	-177.7	76.9	0	0	0	0	114.9	D469	D469-S471 VanDerWaalsContact C-N 3.3Å; D469-S471 WeakPolarHBondContact OD1-CB 3.47Å; D469-S471 PolarHBondContact OD1-N 2.96Å; D469-S471 PolarHBondContact OD1-OG 3.21Å; D469-S471 VanDerWaalsContact OD1-OG 3.09Å; D469-S471 PolarHBondContact OD2-OG 3.36Å
472	R	32.7	Very low	31.8	Very low	185 Å²	185	112.8 Å²	112.8	70%	0.698	62%	0.619	S	S	*	*	S	Bend	trans	-88.1	127	-177.7	-76.4	-175.8	167.7	178.8	-4.4	113	L470 N474	L470-R472 PolarHBondContact O-N 3.48Å; R472-N474 PolarHBondContact O-N 2.72Å
473	E	32.1	Very low	32	Very low	166 Å²	166	109.9 Å²	109.9	78%	0.776	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.6	-14.6	178.6	-59.7	172.8	121.3	0	0	114.3	S475 L476	E473-S475 PolarHBondContact O-N 2.81Å; E473-L476 PolarHBondContact O-N 3.42Å
474	N	32.1	Very low	32.2	Very low	109 Å²	109	105.1 Å²	105.1	58%	0.583	59%	0.591	S	S	*	*	H	α-helix	trans	-53.9	-18.6	177.2	-64.4	2.5	0	0	0	114.7	R472 S477 F478	R472-N474 PolarHBondContact O-N 2.72Å; N474-S477 PolarHBondContact O-N 3.42Å; N474-S477 PolarHBondContact O-OG 3.29Å; N474-F478 PolarHBondContact O-N 3Å
475	S	34.6	Very low	32.2	Very low	75 Å²	75	108.9 Å²	108.9	52%	0.524	58%	0.581	S	S	.	*	H	α-helix	trans	-70.5	-31.9	174.1	50.2	0	0	0	0	113	E473	E473-S475 PolarHBondContact O-N 2.81Å
476	L	33.5	Very low	32.6	Very low	109 Å²	109	110.4 Å²	110.4	57%	0.571	58%	0.575	S	S	*	*	H	α-helix	trans	-75.5	-32.1	171.8	-72.8	167	0	0	0	111.9	E473 F478 L479 N480	E473-L476 PolarHBondContact O-N 3.42Å; L476-F478 PolarHBondContact O-N 2.72Å; L476-L479 PolarHBondContact O-N 3.08Å; L476-N480 PolarHBondContact O-N 3.11Å; L476-N480 VanDerWaalsContact O-N 3.12Å
477	S	32.3	Very low	32.7	Very low	52 Å²	52	113.2 Å²	113.2	36%	0.364	57%	0.574	S	S	.	*	H	α-helix	trans	-64.4	-25.8	175.7	78.1	0	0	0	0	112.6	N474 N481	N474-S477 PolarHBondContact O-N 3.42Å; N474-S477 PolarHBondContact O-OG 3.29Å; S477-N481 VanDerWaalsContact O-CB 3.23Å; S477-N481 WeakPolarHBondContact O-CB 3.38Å; S477-N481 PolarHBondContact O-N 3.26Å; S477-N481 PolarHBondContact O-ND2 3.41Å; S477-N481 VanDerWaalsContact O-ND2 3.16Å
478	F	31	Very low	32.9	Very low	152 Å²	152	110.1 Å²	110.1	67%	0.667	56%	0.561	S	S	*	*	H	α-helix	trans	-68.7	-42.2	175.2	-159.3	-88.8	0	0	0	113	N474 L476 T482	N474-F478 PolarHBondContact O-N 3Å; L476-F478 PolarHBondContact O-N 2.72Å; F478-T482 WeakPolarHBondContact O-CB 3.37Å; F478-T482 PolarHBondContact O-N 3.15Å; F478-T482 PolarHBondContact O-OG1 3.16Å
479	L	31.9	Very low	32.8	Very low	54 Å²	54	113 Å²	113	28%	0.283	56%	0.564	S	S	.	*	H	α-helix	trans	-61.8	-51.9	172.2	-89.4	158.6	0	0	0	110.9	L476 N481 T482 I483	L476-L479 PolarHBondContact O-N 3.08Å; L479-N481 VanDerWaalsContact C-N 3.29Å; L479-N481 PolarHBondContact O-N 2.82Å; L479-T482 PolarHBondContact O-N 3.17Å; L479-T482 VanDerWaalsContact O-N 3.07Å; L479-I483 WeakPolarHBondContact O-CG1 3.41Å; L479-I483 PolarHBondContact O-N 3.33Å
480	N	33.4	Very low	32.6	Very low	110 Å²	110	114.3 Å²	114.3	59%	0.588	57%	0.571	S	S	*	*	H	α-helix	trans	-58.9	-39	178.6	-69.8	-15	0	0	0	112.6	L476 S484	L476-N480 PolarHBondContact O-N 3.11Å; L476-N480 VanDerWaalsContact O-N 3.12Å; N480-S484 PolarHBondContact O-N 2.92Å; N480-S484 VanDerWaalsContact O-N 3.12Å
481	N	33.6	Very low	32.3	Very low	95 Å²	95	115.7 Å²	115.7	51%	0.508	58%	0.577	S	S	.	*	H	α-helix	trans	-69.3	-38	175.4	-74.5	-23.3	0	0	0	112.4	S477 L479 S484 Y485	S477-N481 VanDerWaalsContact O-CB 3.23Å; S477-N481 WeakPolarHBondContact O-CB 3.38Å; S477-N481 PolarHBondContact O-N 3.26Å; S477-N481 PolarHBondContact O-ND2 3.41Å; S477-N481 VanDerWaalsContact O-ND2 3.16Å; L479-N481 VanDerWaalsContact C-N 3.29Å; L479-N481 PolarHBondContact O-N 2.82Å; N481-S484 VanDerWaalsContact O-CB 3.31Å; N481-S484 WeakPolarHBondContact O-CB 3.47Å; N481-S484 PolarHBondContact O-N 3.24Å; N481-Y485 WeakPolarHBondContact O-CD2 3.5Å; N481-Y485 PolarHBondContact O-N 3.38Å
482	T	35	Very low	32.1	Very low	51 Å²	51	119.1 Å²	119.1	31%	0.313	59%	0.589	S	S	.	*	H	α-helix	trans	-67.1	-40.3	177.2	-57.8	0	0	0	0	111.2	F478 L479 S484 Y485	F478-T482 WeakPolarHBondContact O-CB 3.37Å; F478-T482 PolarHBondContact O-N 3.15Å; F478-T482 PolarHBondContact O-OG1 3.16Å; L479-T482 PolarHBondContact O-N 3.17Å; L479-T482 VanDerWaalsContact O-N 3.07Å; T482-S484 PolarHBondContact O-N 2.98Å; T482-Y485 PolarHBondContact O-N 3.22Å
483	I	34.9	Very low	32.1	Very low	86 Å²	86	117.7 Å²	117.7	44%	0.441	59%	0.594	S	S	.	*	H	α-helix	trans	-60.5	-36.2	172.2	-67.5	165.1	0	0	0	110.8	L479 Y485 K486	L479-I483 WeakPolarHBondContact O-CG1 3.41Å; L479-I483 PolarHBondContact O-N 3.33Å; I483-Y485 PolarHBondContact O-N 3.27Å; I483-K486 PolarHBondContact O-N 3.38Å
484	S	32	Very low	32.2	Very low	76 Å²	76	113.9 Å²	113.9	53%	0.531	59%	0.591	S	S	.	*	H	α-helix	trans	-63.5	-22.9	175.1	-164.7	0	0	0	0	114.1	N480 N481 T482 K486 K487	N480-S484 PolarHBondContact O-N 2.92Å; N480-S484 VanDerWaalsContact O-N 3.12Å; N481-S484 VanDerWaalsContact O-CB 3.31Å; N481-S484 WeakPolarHBondContact O-CB 3.47Å; N481-S484 PolarHBondContact O-N 3.24Å; T482-S484 PolarHBondContact O-N 2.98Å; S484-K486 VanDerWaalsContact C-N 3.32Å; S484-K486 PolarHBondContact O-N 3.43Å; S484-K487 PolarHBondContact O-N 3.2Å
485	Y	29.7	Very low	32.4	Very low	156 Å²	156	113.1 Å²	113.1	61%	0.612	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-76.4	-12.2	176.4	-76.9	-78.5	0	0	0	114	N481 T482 I483 K487 V488	N481-Y485 WeakPolarHBondContact O-CD2 3.5Å; N481-Y485 PolarHBondContact O-N 3.38Å; T482-Y485 PolarHBondContact O-N 3.22Å; I483-Y485 PolarHBondContact O-N 3.27Å; Y485-K487 PolarHBondContact O-N 3.14Å; Y485-K487 VanDerWaalsContact O-N 3.08Å; Y485-V488 HydrophobicContact CD1-CB 4.42Å; Y485-V488 HydrophobicContact CD1-CG2 4.05Å; Y485-V488 PolarHBondContact O-N 3.11Å
486	K	33.4	Very low	32.4	Very low	136 Å²	136	114.4 Å²	114.4	59%	0.591	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-58.8	-17.5	168.9	-83.5	-174.5	174.8	179.3	0	112.5	I483 S484 D506	I483-K486 PolarHBondContact O-N 3.38Å; S484-K486 VanDerWaalsContact C-N 3.32Å; S484-K486 PolarHBondContact O-N 3.43Å; K486-D506 IonicContact NZ-OD1 3.7Å; K486-D506 IonicContact NZ-OD2 2.69Å; K486-D506 PolarHBondContact NZ-OD2 2.93Å
487	K	32.3	Very low	32.4	Very low	187 Å²	187	115.8 Å²	115.8	81%	0.813	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-82.3	-9.2	172.8	-92.6	-174	173.8	-178.3	0	115.8	S484 Y485	S484-K487 PolarHBondContact O-N 3.2Å; Y485-K487 PolarHBondContact O-N 3.14Å; Y485-K487 VanDerWaalsContact O-N 3.08Å
488	V	33.2	Very low	32.6	Very low	98 Å²	98	120.3 Å²	120.3	59%	0.594	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	-14.5	-170.9	-175.7	0	0	0	0	112.6	Y485	Y485-V488 HydrophobicContact CD1-CB 4.42Å; Y485-V488 HydrophobicContact CD1-CG2 4.05Å; Y485-V488 PolarHBondContact O-N 3.11Å
489	W	28.8	Very low	33.1	Very low	193 Å²	193	120.8 Å²	120.8	73%	0.731	64%	0.637	S	S	*	*			trans	-112.4	41.5	-177.4	-73.2	89.8	0	0	0	113.5	I491	W489-I491 HydrophobicContact CE3-CD1 3.59Å; W489-I491 HydrophobicContact CE3-CG1 4.17Å; W489-I491 HydrophobicContact CZ3-CD1 3.56Å; W489-I491 PolarHBondContact O-N 2.96Å
490	N	27.8	Very low	33.3	Very low	142 Å²	142	124.1 Å²	124.1	76%	0.759	66%	0.655	S	S	*	*			trans	-71.9	70.1	161.3	-94.2	21.1	0	0	0	109.9
491	I	31.1	Very low	34	Very low	111 Å²	111	123.8 Å²	123.8	57%	0.569	66%	0.661	S	S	*	*			trans	-89.9	119.3	163.3	-63.7	-174.3	0	0	0	106.9	W489 L493	W489-I491 HydrophobicContact CE3-CD1 3.59Å; W489-I491 HydrophobicContact CE3-CG1 4.17Å; W489-I491 HydrophobicContact CZ3-CD1 3.56Å; W489-I491 PolarHBondContact O-N 2.96Å; I491-L493 VanDerWaalsContact C-N 3.3Å; I491-L493 PolarHBondContact O-N 2.8Å
492	N	28.3	Very low	35.3	Very low	158 Å²	158	125.4 Å²	125.4	85%	0.845	66%	0.664	S	S	*	*			trans	-72.6	81.6	-178.4	-68.1	-26.5	0	0	0	111
493	L	32.8	Very low	37.1	Very low	156 Å²	156	130 Å²	130	82%	0.817	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-83.4	121.7	160.2	-76.7	157.8	0	0	0	108	I491	I491-L493 VanDerWaalsContact C-N 3.3Å; I491-L493 PolarHBondContact O-N 2.8Å
494	A	33.9	Very low	39.3	Very low	85 Å²	85	126.1 Å²	126.1	70%	0.702	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-64.7	139.2	-178.6	0	0	0	0	0	110.9	S496	A494-S496 PolarHBondContact O-N 2.98Å
495	P	37	Very low	41.9	Very low	93 Å²	93	124.7 Å²	124.7	60%	0.604	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-68.5	122.5	-179.4	27.9	-33.7	0	0	0	110.8
496	S	35.2	Very low	44.7	Very low	103 Å²	103	120.6 Å²	120.6	72%	0.72	64%	0.64	S	S	*	*			trans	-84.3	112.1	163	-43.6	0	0	0	0	108	A494 L498	A494-S496 PolarHBondContact O-N 2.98Å; S496-L498 PolarHBondContact O-N 2.84Å
497	D	32.4	Very low	47.3	Very low	137 Å²	137	117.7 Å²	117.7	73%	0.733	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	42.2	-160.5	-71.1	-51.5	0	0	0	116.8
498	L	38.1	Very low	50.2	Low	147 Å²	147	108.8 Å²	108.8	77%	0.77	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.5	-8.2	177.4	-94.1	137.4	0	0	0	115.3	S496	S496-L498 PolarHBondContact O-N 2.84Å
499	L	40.9	Very low	53	Low	162 Å²	162	104.2 Å²	104.2	85%	0.848	56%	0.562	S	S	*	*	S	Bend	trans	-97.5	-11.2	-179.4	-135.6	75.7	0	0	0	114.9	S501	L499-S501 PolarHBondContact O-N 2.94Å; L499-S501 VanDerWaalsContact O-N 3.15Å
500	N	35	Very low	56	Low	125 Å²	125	99.3 Å²	99.3	67%	0.668	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	88.3	-170.6	-73.3	-33.2	0	0	0	113.3
501	S	48.7	Very low	59.1	Low	103 Å²	103	93 Å²	93	72%	0.72	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-172.9	-20.4	153.8	42.6	0	0	0	0	116.8	L499	L499-S501 PolarHBondContact O-N 2.94Å; L499-S501 VanDerWaalsContact O-N 3.15Å
502	F	61.6	Low	62.1	Low	129 Å²	129	87.7 Å²	87.7	57%	0.566	49%	0.486	S	S	*	.			trans	-120.7	79.1	-174	-81.6	-90.7	0	0	0	113.2	L558	F502-L558 HydrophobicContact CB-CD2 4.44Å; F502-L558 WeakPolarHBondContact O-CD2 3.43Å
503	E	71.6	Confident	65.3	Low	146 Å²	146	80.6 Å²	80.6	68%	0.682	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-95.2	150	158.5	-64.6	-164.9	132.5	0	0	110.4
504	I	82.5	Confident	68.2	Low	5 Å²	5	75.8 Å²	75.8	3%	0.026	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-74.3	130.1	166.2	-59.8	161.8	0	0	0	107.5	D506 I508 I509 I552 L558 L559	I504-D506 PolarHBondContact O-N 3.32Å; I504-I508 HydrophobicContact CG2-CB 3.89Å; I504-I508 HydrophobicContact CG2-CG1 4.29Å; I504-I508 HydrophobicContact CG2-CG2 4.17Å; I504-I509 HydrophobicContact CB-CD1 4.49Å; I504-I509 HydrophobicContact CG2-CD1 4.19Å; I504-I509 HydrophobicContact CG2-CG1 4.1Å; I504-I552 HydrophobicContact CD1-CD1 3.87Å; I504-I552 HydrophobicContact CD1-CG1 3.63Å; I504-I552 HydrophobicContact CG1-CD1 4.29Å; I504-I552 HydrophobicContact CG1-CG1 4.06Å; I504-I552 HydrophobicContact CG2-CD1 4.13Å; I504-L558 VanDerWaalsContact CD1-C 3.48Å; I504-L558 HydrophobicContact CD1-CB 3.66Å; I504-L558 WeakPolarHBondContact CD1-O 3.24Å; I504-L558 HydrophobicContact CG1-CB 3.81Å; I504-L559 HydrophobicContact CD1-CD2 3.51Å; I504-L559 HydrophobicContact CD1-CG 3.89Å
505	P	86.5	Confident	71.1	Confident	47 Å²	47	72.6 Å²	72.6	31%	0.305	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-59.5	128.8	173.4	-21.9	32.1	0	0	0	110.9	E507 I508 W548	P505-E507 HydrophobicContact CB-CB 4.44Å; P505-E507 PolarHBondContact O-N 3.36Å; P505-I508 HydrophobicContact CB-CG1 4.29Å; P505-I508 HydrophobicContact CG-CG1 4.41Å; P505-I508 WeakPolarHBondContact O-CB 3.4Å; P505-I508 PolarHBondContact O-N 3.38Å; P505-W548 VanDerWaalsContact CD-CZ2 3.48Å; P505-W548 HydrophobicContact CG-CH2 4.25Å; P505-W548 HydrophobicContact CG-CZ2 3.7Å
506	D	86.7	Confident	73.9	Confident	70 Å²	70	68.1 Å²	68.1	37%	0.374	36%	0.362	S	S	.	.	H	α-helix	trans	-47.7	-37.5	178.9	-77.7	-25.8	0	0	0	111.4	K486 I504 I508 I509 E510	K486-D506 IonicContact NZ-OD1 3.7Å; K486-D506 IonicContact NZ-OD2 2.69Å; K486-D506 PolarHBondContact NZ-OD2 2.93Å; I504-D506 PolarHBondContact O-N 3.32Å; D506-I508 VanDerWaalsContact C-N 3.27Å; D506-I508 PolarHBondContact O-N 3.16Å; D506-I508 VanDerWaalsContact O-N 3.15Å; D506-I509 WeakPolarHBondContact O-CA 3.34Å; D506-I509 WeakPolarHBondContact O-CB 3.36Å; D506-I509 PolarHBondContact O-N 3.28Å; D506-E510 WeakPolarHBondContact O-CG 3.18Å; D506-E510 PolarHBondContact O-N 3.03Å
507	E	89.4	Confident	76.6	Confident	74 Å²	74	65.5 Å²	65.5	35%	0.346	34%	0.338	S	S	.	.	H	α-helix	trans	-44.9	-40.9	172.1	-172.5	-152.9	-130.4	0	0	114.4	P505 I509 F511 Y540 K544	P505-E507 HydrophobicContact CB-CB 4.44Å; P505-E507 PolarHBondContact O-N 3.36Å; E507-I509 VanDerWaalsContact C-N 3.3Å; E507-I509 PolarHBondContact O-N 3.46Å; E507-F511 WeakPolarHBondContact O-CB 3.46Å; E507-F511 PolarHBondContact O-N 3.19Å; E507-Y540 VanDerWaalsContact CD-OH 3.27Å; E507-Y540 HydrophobicContact CG-CE2 3.94Å; E507-Y540 PolarHBondContact OE2-OH 2.9Å; E507-K544 IonicContact OE1-NZ 2.91Å; E507-K544 PolarHBondContact OE1-NZ 2.91Å; E507-K544 WeakPolarHBondContact OE2-CE 3.33Å; E507-K544 IonicContact OE2-NZ 2.67Å; E507-K544 PolarHBondContact OE2-NZ 2.95Å
508	I	92.5	Very high	79.4	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-69	-33.1	-179	-59.2	-62.7	0	0	0	111.2	I412 I504 P505 D506 S512 Y540 F545 W548 I552	I412-I508 HydrophobicContact CD1-CG2 4.2Å; I504-I508 HydrophobicContact CG2-CB 3.89Å; I504-I508 HydrophobicContact CG2-CG1 4.29Å; I504-I508 HydrophobicContact CG2-CG2 4.17Å; P505-I508 HydrophobicContact CB-CG1 4.29Å; P505-I508 HydrophobicContact CG-CG1 4.41Å; P505-I508 WeakPolarHBondContact O-CB 3.4Å; P505-I508 PolarHBondContact O-N 3.38Å; D506-I508 VanDerWaalsContact C-N 3.27Å; D506-I508 PolarHBondContact O-N 3.16Å; D506-I508 VanDerWaalsContact O-N 3.15Å; I508-S512 WeakPolarHBondContact O-CB 3.34Å; I508-S512 PolarHBondContact O-N 3.27Å; I508-S512 VanDerWaalsContact O-N 3.12Å; I508-S512 PolarHBondContact O-OG 3.01Å; I508-Y540 WeakPolarHBondContact CD1-OH 3.33Å; I508-F545 HydrophobicContact CD1-CD2 4.37Å; I508-F545 HydrophobicContact CG2-CD2 4.04Å; I508-F545 HydrophobicContact CG2-CE2 3.97Å; I508-W548 HydrophobicContact CD1-CB 3.95Å; I508-W548 HydrophobicContact CD1-CG 3.87Å; I508-W548 HydrophobicContact CG1-CB 4.03Å; I508-W548 HydrophobicContact CG1-CD2 4.46Å; I508-W548 HydrophobicContact CG1-CG 3.87Å; I508-W548 HydrophobicContact CG2-CB 4.06Å; I508-I552 HydrophobicContact CG2-CD1 4.09Å
509	I	92.2	Very high	82	Confident	3 Å²	3	55.8 Å²	55.8	2%	0.015	28%	0.284	C	S	.	.	H	α-helix	trans	-82.7	-46.1	-176.5	-55.5	-179.5	0	0	0	109.3	I416 I504 D506 E507 F511 S512 I513 L559 A562 L565	I416-I509 HydrophobicContact CD1-CG2 3.55Å; I504-I509 HydrophobicContact CB-CD1 4.49Å; I504-I509 HydrophobicContact CG2-CD1 4.19Å; I504-I509 HydrophobicContact CG2-CG1 4.1Å; D506-I509 WeakPolarHBondContact O-CA 3.34Å; D506-I509 WeakPolarHBondContact O-CB 3.36Å; D506-I509 PolarHBondContact O-N 3.28Å; E507-I509 VanDerWaalsContact C-N 3.3Å; E507-I509 PolarHBondContact O-N 3.46Å; I509-F511 PolarHBondContact O-N 3.47Å; I509-S512 WeakPolarHBondContact O-CB 3.32Å; I509-S512 PolarHBondContact O-N 3.33Å; I509-I513 HydrophobicContact CG2-CD1 4.25Å; I509-I513 WeakPolarHBondContact O-CG1 3.37Å; I509-I513 PolarHBondContact O-N 3.27Å; I509-L559 HydrophobicContact CD1-CD2 4.43Å; I509-A562 HydrophobicContact CD1-CB 3.74Å; I509-A562 HydrophobicContact CG2-CB 4.38Å; I509-L565 HydrophobicContact CG2-CD1 3.66Å
510	E	91.5	Very high	84.5	Confident	89 Å²	89	48.4 Å²	48.4	42%	0.416	25%	0.246	S	C	.	.	H	α-helix	trans	-56.4	-47.9	171.1	-69	-177.3	160.4	0	0	111.4	D506 S512 I513 F514	D506-E510 WeakPolarHBondContact O-CG 3.18Å; D506-E510 PolarHBondContact O-N 3.03Å; E510-S512 VanDerWaalsContact C-N 3.34Å; E510-S512 PolarHBondContact O-N 3.39Å; E510-I513 PolarHBondContact O-N 3.39Å; E510-F514 VanDerWaalsContact O-CB 3.28Å; E510-F514 WeakPolarHBondContact O-CB 3.49Å; E510-F514 PolarHBondContact O-N 2.73Å
511	F	93.2	Very high	87.1	Confident	10 Å²	10	45.2 Å²	45.2	4%	0.044	23%	0.226	C	C	.	.	H	α-helix	trans	-62	-39.4	176.5	-175.2	-100.7	0	0	0	112.4	E507 I509 F514 Q515 Y540 W542 F545	E507-F511 WeakPolarHBondContact O-CB 3.46Å; E507-F511 PolarHBondContact O-N 3.19Å; I509-F511 PolarHBondContact O-N 3.47Å; F511-F514 PolarHBondContact O-N 3.06Å; F511-Q515 HydrophobicContact CD1-CG 4.13Å; F511-Q515 HydrophobicContact CD2-CG 4.42Å; F511-Q515 HydrophobicContact CE1-CG 3.89Å; F511-Q515 HydrophobicContact CE2-CG 4.2Å; F511-Q515 HydrophobicContact CG-CG 4.41Å; F511-Q515 HydrophobicContact CZ-CG 3.94Å; F511-Q515 VanDerWaalsContact O-CG 3.25Å; F511-Q515 WeakPolarHBondContact O-CG 3.21Å; F511-Q515 PolarHBondContact O-N 3.35Å; F511-Y540 HydrophobicContact CD2-CD1 4.32Å; F511-Y540 AromaticContact CD2-CD2 3.77Å; F511-Y540 HydrophobicContact CD2-CD2 3.77Å; F511-Y540 HydrophobicContact CD2-CE2 4.28Å; F511-Y540 AromaticContact CD2-CG 3.8Å; F511-Y540 HydrophobicContact CD2-CG 3.8Å; F511-Y540 HydrophobicContact CE1-CD1 4.04Å; F511-Y540 HydrophobicContact CE1-CE1 4.49Å; F511-Y540 HydrophobicContact CE1-CG 4.39Å; F511-Y540 AromaticContact CE2-CD1 3.84Å; F511-Y540 HydrophobicContact CE2-CD1 3.84Å; F511-Y540 AromaticContact CE2-CD2 3.8Å; F511-Y540 HydrophobicContact CE2-CD2 3.8Å; F511-Y540 AromaticContact CE2-CG 3.35Å; F511-Y540 HydrophobicContact CE2-CG 3.35Å; F511-Y540 HydrophobicContact CG-CD2 4.42Å; F511-Y540 HydrophobicContact CG-CG 4.48Å; F511-Y540 AromaticContact CZ-CD1 3.67Å; F511-Y540 HydrophobicContact CZ-CD1 3.67Å; F511-Y540 HydrophobicContact CZ-CD2 4.46Å; F511-Y540 AromaticContact CZ-CG 3.67Å; F511-Y540 HydrophobicContact CZ-CG 3.67Å; F511-W542 HydrophobicContact CE1-CD2 4.31Å; F511-W542 AromaticContact CE1-CE3 3.95Å; F511-W542 HydrophobicContact CE1-CE3 3.95Å; F511-W542 AromaticContact CE1-CH2 3.6Å; F511-W542 HydrophobicContact CE1-CH2 3.6Å; F511-W542 AromaticContact CE1-CZ2 3.96Å; F511-W542 HydrophobicContact CE1-CZ2 3.96Å; F511-W542 AromaticContact CE1-CZ3 3.58Å; F511-W542 HydrophobicContact CE1-CZ3 3.58Å; F511-W542 HydrophobicContact CZ-CD2 4.17Å; F511-W542 AromaticContact CZ-CE2 3.81Å; F511-W542 HydrophobicContact CZ-CE3 4.29Å; F511-W542 AromaticContact CZ-CH2 3.78Å; F511-W542 HydrophobicContact CZ-CH2 3.78Å; F511-W542 AromaticContact CZ-CZ2 3.63Å; F511-W542 HydrophobicContact CZ-CZ2 3.63Å; F511-W542 HydrophobicContact CZ-CZ3 4.09Å; F511-F545 AromaticContact CD1-CD2 3.62Å; F511-F545 HydrophobicContact CD1-CD2 3.62Å; F511-F545 AromaticContact CD1-CE2 3.98Å; F511-F545 HydrophobicContact CD1-CE2 3.98Å; F511-F545 HydrophobicContact CD1-CG 4Å; F511-F545 HydrophobicContact CE1-CB 4.3Å; F511-F545 HydrophobicContact CE1-CD1 4.35Å; F511-F545 HydrophobicContact CE1-CD2 4.07Å; F511-F545 AromaticContact CE1-CG 3.96Å; F511-F545 HydrophobicContact CE1-CG 3.96Å
512	S	95.2	Very high	89	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-61.9	-44.3	175.6	-62.9	0	0	0	0	112.3	I412 I508 I509 E510 C516 F545	I412-S512 WeakPolarHBondContact CD1-OG 3.04Å; I508-S512 WeakPolarHBondContact O-CB 3.34Å; I508-S512 PolarHBondContact O-N 3.27Å; I508-S512 VanDerWaalsContact O-N 3.12Å; I508-S512 PolarHBondContact O-OG 3.01Å; I509-S512 WeakPolarHBondContact O-CB 3.32Å; I509-S512 PolarHBondContact O-N 3.33Å; E510-S512 VanDerWaalsContact C-N 3.34Å; E510-S512 PolarHBondContact O-N 3.39Å; S512-C516 PolarHBondContact O-N 2.95Å; S512-C516 PolarHBondContact O-SG 3.38Å; S512-F545 VanDerWaalsContact OG-CE2 3.31Å; S512-F545 WeakPolarHBondContact OG-CE2 3.45Å
513	I	95	Very high	90.2	Very high	8 Å²	8	38.7 Å²	38.7	4%	0.041	19%	0.186	C	C	.	.	H	α-helix	trans	-67.1	-45.2	177.1	-69.9	169	0	0	0	110.2	V413 I509 E510 C516 Q517 L565 L572	V413-I513 HydrophobicContact CG2-CG1 4.13Å; I509-I513 HydrophobicContact CG2-CD1 4.25Å; I509-I513 WeakPolarHBondContact O-CG1 3.37Å; I509-I513 PolarHBondContact O-N 3.27Å; E510-I513 PolarHBondContact O-N 3.39Å; I513-C516 WeakPolarHBondContact O-CB 3.24Å; I513-C516 PolarHBondContact O-N 2.93Å; I513-Q517 HydrophobicContact CG2-CG 4.41Å; I513-Q517 WeakPolarHBondContact O-CG 3.25Å; I513-Q517 PolarHBondContact O-N 3.26Å; I513-L565 HydrophobicContact CD1-CD1 4Å; I513-L572 HydrophobicContact CG1-CD2 4.49Å; I513-L572 HydrophobicContact CG2-CD2 4.06Å
514	F	93.9	Very high	90.8	Very high	55 Å²	55	34.2 Å²	34.2	24%	0.241	16%	0.164	C	C	.	.	H	α-helix	trans	-58	-51.1	178.4	176.6	-94.2	0	0	0	112.2	E510 F511 C516 Q517 E518 F536	E510-F514 VanDerWaalsContact O-CB 3.28Å; E510-F514 WeakPolarHBondContact O-CB 3.49Å; E510-F514 PolarHBondContact O-N 2.73Å; F511-F514 PolarHBondContact O-N 3.06Å; F514-C516 VanDerWaalsContact C-N 3.28Å; F514-C516 PolarHBondContact O-N 3.22Å; F514-Q517 CarbonylContact O-C 3.59Å; F514-Q517 WeakPolarHBondContact O-CB 3.41Å; F514-Q517 PolarHBondContact O-N 2.86Å; F514-E518 HydrophobicContact CD1-CG 4.04Å; F514-E518 HydrophobicContact CD2-CG 4.42Å; F514-E518 HydrophobicContact CE1-CG 3.46Å; F514-E518 VanDerWaalsContact CE1-CG 3.46Å; F514-E518 HydrophobicContact CE2-CG 3.9Å; F514-E518 HydrophobicContact CG-CG 4.47Å; F514-E518 HydrophobicContact CZ-CG 3.37Å; F514-E518 PolarHBondContact O-N 2.93Å; F514-F536 HydrophobicContact CD1-CB 4.2Å; F514-F536 HydrophobicContact CE1-CB 3.41Å; F514-F536 VanDerWaalsContact CE1-CB 3.41Å; F514-F536 HydrophobicContact CE1-CG 4.44Å; F514-F536 HydrophobicContact CE2-CB 4.49Å; F514-F536 HydrophobicContact CZ-CB 3.59Å; F514-F536 HydrophobicContact CZ-CG 4.48Å
515	Q	94.1	Very high	90.9	Very high	18 Å²	18	38.5 Å²	38.5	8%	0.084	18%	0.183	C	C	.	.	H	α-helix	trans	-62.4	-35.7	179.3	-65.4	-72.8	-11.9	0	0	111.9	C409 F511 F519 S537 W542	C409-Q515 HydrophobicContact CB-CB 4.18Å; F511-Q515 HydrophobicContact CD1-CG 4.13Å; F511-Q515 HydrophobicContact CD2-CG 4.42Å; F511-Q515 HydrophobicContact CE1-CG 3.89Å; F511-Q515 HydrophobicContact CE2-CG 4.2Å; F511-Q515 HydrophobicContact CG-CG 4.41Å; F511-Q515 HydrophobicContact CZ-CG 3.94Å; F511-Q515 VanDerWaalsContact O-CG 3.25Å; F511-Q515 WeakPolarHBondContact O-CG 3.21Å; F511-Q515 PolarHBondContact O-N 3.35Å; Q515-F519 WeakPolarHBondContact O-CB 3.32Å; Q515-F519 PolarHBondContact O-N 2.86Å; Q515-S537 PolarHBondContact NE2-OG 3.42Å; Q515-S537 PolarHBondContact OE1-OG 2.92Å; Q515-W542 HydrophobicContact CG-CH2 3.97Å; Q515-W542 HydrophobicContact CG-CZ2 4.35Å
516	C	94.9	Very high	90.8	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-66.2	-37.5	172.7	-70.2	0	0	0	0	112.8	S512 I513 F514 L520 L572 L576	S512-C516 PolarHBondContact O-N 2.95Å; S512-C516 PolarHBondContact O-SG 3.38Å; I513-C516 WeakPolarHBondContact O-CB 3.24Å; I513-C516 PolarHBondContact O-N 2.93Å; F514-C516 VanDerWaalsContact C-N 3.28Å; F514-C516 PolarHBondContact O-N 3.22Å; C516-L520 WeakPolarHBondContact O-CG 3.44Å; C516-L520 PolarHBondContact O-N 3.14Å; C516-L572 HydrophobicContact CB-CD1 4.37Å; C516-L572 HydrophobicContact CB-CD2 3.91Å; C516-L572 HydrophobicContact CB-CG 4.26Å; C516-L576 HydrophobicContact CB-CD1 4.09Å; C516-L576 HydrophobicContact CB-CD2 4.29Å
517	Q	93.8	Very high	90.4	Very high	48 Å²	48	36.9 Å²	36.9	22%	0.224	17%	0.17	C	C	.	.	H	α-helix	trans	-71.1	-44.8	175.7	-71	177.1	5.6	0	0	111.8	I513 F514 F519 L520 K521 H568 L572	I513-Q517 HydrophobicContact CG2-CG 4.41Å; I513-Q517 WeakPolarHBondContact O-CG 3.25Å; I513-Q517 PolarHBondContact O-N 3.26Å; F514-Q517 CarbonylContact O-C 3.59Å; F514-Q517 WeakPolarHBondContact O-CB 3.41Å; F514-Q517 PolarHBondContact O-N 2.86Å; Q517-F519 VanDerWaalsContact C-N 3.32Å; Q517-F519 PolarHBondContact O-N 2.78Å; Q517-L520 WeakPolarHBondContact O-CB 3.44Å; Q517-L520 PolarHBondContact O-N 3.36Å; Q517-K521 WeakPolarHBondContact O-CG 3.42Å; Q517-K521 PolarHBondContact O-N 3.26Å; Q517-H568 PolarHBondContact NE2-NE2 3.32Å; Q517-L572 HydrophobicContact CG-CD1 4.2Å
518	E	91.2	Very high	89.8	Confident	50 Å²	50	37.8 Å²	37.8	23%	0.234	18%	0.177	C	C	.	.	H	α-helix	trans	-59.8	-41.6	175.3	-71.2	-53.3	117.9	0	0	112.1	F514 L520 K521 T522	F514-E518 HydrophobicContact CD1-CG 4.04Å; F514-E518 HydrophobicContact CD2-CG 4.42Å; F514-E518 HydrophobicContact CE1-CG 3.46Å; F514-E518 VanDerWaalsContact CE1-CG 3.46Å; F514-E518 HydrophobicContact CE2-CG 3.9Å; F514-E518 HydrophobicContact CG-CG 4.47Å; F514-E518 HydrophobicContact CZ-CG 3.37Å; F514-E518 PolarHBondContact O-N 2.93Å; E518-L520 VanDerWaalsContact C-N 3.33Å; E518-L520 PolarHBondContact O-N 2.93Å; E518-K521 PolarHBondContact O-N 3.49Å; E518-K521 WeakPolarHBondContact OE1-CD 3.41Å; E518-K521 WeakPolarHBondContact OE1-CE 3.47Å; E518-K521 IonicContact OE1-NZ 3.46Å; E518-K521 PolarHBondContact OE1-NZ 2.85Å; E518-T522 PolarHBondContact O-N 3.3Å; E518-T522 PolarHBondContact O-OG1 3.12Å
519	F	92.4	Very high	89	Confident	29 Å²	29	45.4 Å²	45.4	13%	0.127	22%	0.217	C	C	.	.	H	α-helix	trans	-57.1	-45	171.2	172	-91.9	0	0	0	111.8	L406 Q515 Q517 T522 K523 L576 C580	L406-F519 HydrophobicContact CD1-CB 4.12Å; L406-F519 HydrophobicContact CD1-CG 4.45Å; L406-F519 HydrophobicContact CD2-CB 4.47Å; L406-F519 HydrophobicContact CD2-CD2 3.41Å; L406-F519 VanDerWaalsContact CD2-CD2 3.41Å; L406-F519 HydrophobicContact CD2-CE2 3.82Å; L406-F519 HydrophobicContact CD2-CG 4.11Å; Q515-F519 WeakPolarHBondContact O-CB 3.32Å; Q515-F519 PolarHBondContact O-N 2.86Å; Q517-F519 VanDerWaalsContact C-N 3.32Å; Q517-F519 PolarHBondContact O-N 2.78Å; F519-T522 WeakPolarHBondContact CA-OG1 3.07Å; F519-T522 PolarHBondContact O-N 2.83Å; F519-T522 PolarHBondContact O-OG1 2.68Å; F519-K523 HydrophobicContact CD1-CG 4.29Å; F519-K523 HydrophobicContact CE1-CG 3.85Å; F519-K523 HydrophobicContact CE2-CD 4.43Å; F519-K523 HydrophobicContact CE2-CG 4.32Å; F519-K523 HydrophobicContact CZ-CD 4.24Å; F519-K523 HydrophobicContact CZ-CG 3.88Å; F519-K523 WeakPolarHBondContact O-CG 3.22Å; F519-K523 PolarHBondContact O-N 2.84Å; F519-L576 HydrophobicContact CD1-CD2 3.82Å; F519-L576 HydrophobicContact CE1-CD2 4.22Å; F519-C580 WeakPolarHBondContact CE1-SG 3.47Å; F519-C580 WeakPolarHBondContact CZ-SG 3.44Å
520	L	92.4	Very high	87.8	Confident	8 Å²	8	51 Å²	51	4%	0.042	24%	0.241	C	C	.	.	H	α-helix	trans	-63.2	-46.4	176.7	-75.9	173.3	0	0	0	111.6	C516 Q517 E518 T522 K523 Y524 L572 L575 L576 Y579	C516-L520 WeakPolarHBondContact O-CG 3.44Å; C516-L520 PolarHBondContact O-N 3.14Å; Q517-L520 WeakPolarHBondContact O-CB 3.44Å; Q517-L520 PolarHBondContact O-N 3.36Å; E518-L520 VanDerWaalsContact C-N 3.33Å; E518-L520 PolarHBondContact O-N 2.93Å; L520-T522 VanDerWaalsContact C-N 3.28Å; L520-T522 PolarHBondContact O-N 3.32Å; L520-K523 CarbonylContact O-C 3.6Å; L520-K523 WeakPolarHBondContact O-CA 3.5Å; L520-K523 PolarHBondContact O-N 3.3Å; L520-Y524 HydrophobicContact CB-CD2 4.32Å; L520-Y524 HydrophobicContact CB-CE2 4.19Å; L520-Y524 HydrophobicContact CD2-CE2 4.35Å; L520-Y524 WeakPolarHBondContact O-CD2 3.4Å; L520-Y524 PolarHBondContact O-N 3.05Å; L520-L572 HydrophobicContact CD1-CD1 3.57Å; L520-L575 HydrophobicContact CD1-CB 3.69Å; L520-L575 HydrophobicContact CD1-CD1 4.08Å; L520-L575 HydrophobicContact CD2-CB 4.23Å; L520-L576 HydrophobicContact CD1-CD2 4.32Å; L520-L576 HydrophobicContact CD1-CG 4.35Å; L520-L576 HydrophobicContact CD2-CD2 4.27Å; L520-L576 HydrophobicContact CG-CD2 4.02Å; L520-Y579 HydrophobicContact CD2-CD2 3.79Å; L520-Y579 HydrophobicContact CD2-CE2 4.46Å
521	K	89.9	Confident	86.1	Confident	57 Å²	57	51.4 Å²	51.4	25%	0.248	26%	0.255	C	S	.	.	H	α-helix	trans	-52.7	-45.8	175.9	-65.9	172.2	-167.2	170.9	0	111.3	Q517 E518 K523 Y524 H525 E526	Q517-K521 WeakPolarHBondContact O-CG 3.42Å; Q517-K521 PolarHBondContact O-N 3.26Å; E518-K521 PolarHBondContact O-N 3.49Å; E518-K521 WeakPolarHBondContact OE1-CD 3.41Å; E518-K521 WeakPolarHBondContact OE1-CE 3.47Å; E518-K521 IonicContact OE1-NZ 3.46Å; E518-K521 PolarHBondContact OE1-NZ 2.85Å; K521-K523 VanDerWaalsContact C-N 3.32Å; K521-K523 PolarHBondContact O-N 2.98Å; K521-Y524 PolarHBondContact O-N 3.18Å; K521-H525 PolarHBondContact O-N 2.81Å; K521-H525 VanDerWaalsContact O-N 3.11Å; K521-E526 HydrophobicContact CB-CB 4.08Å; K521-E526 WeakPolarHBondContact CG-OE2 3.35Å; K521-E526 PolarHBondContact O-N 2.73Å
522	T	88.1	Confident	84.2	Confident	28 Å²	28	53.2 Å²	53.2	17%	0.172	27%	0.269	C	S	.	.	H	α-helix	trans	-65.8	-27.2	174.7	23.9	0	0	0	0	114	E518 F519 L520 D527 C1007	E518-T522 PolarHBondContact O-N 3.3Å; E518-T522 PolarHBondContact O-OG1 3.12Å; F519-T522 WeakPolarHBondContact CA-OG1 3.07Å; F519-T522 PolarHBondContact O-N 2.83Å; F519-T522 PolarHBondContact O-OG1 2.68Å; L520-T522 VanDerWaalsContact C-N 3.28Å; L520-T522 PolarHBondContact O-N 3.32Å; T522-D527 HydrophobicContact CG2-CB 3.58Å; T522-D527 WeakPolarHBondContact CG2-OD2 3.22Å; T522-C1007 HydrophobicContact CG2-CB 3.55Å
523	K	86.5	Confident	81.9	Confident	67 Å²	67	60.4 Å²	60.4	29%	0.291	30%	0.3	S	S	.	.	H	α-helix	trans	-82.7	-19.7	172.3	-61.8	-54.2	-179.9	-165.3	0	114	F519 L520 K521 Y579	F519-K523 HydrophobicContact CD1-CG 4.29Å; F519-K523 HydrophobicContact CE1-CG 3.85Å; F519-K523 HydrophobicContact CE2-CD 4.43Å; F519-K523 HydrophobicContact CE2-CG 4.32Å; F519-K523 HydrophobicContact CZ-CD 4.24Å; F519-K523 HydrophobicContact CZ-CG 3.88Å; F519-K523 WeakPolarHBondContact O-CG 3.22Å; F519-K523 PolarHBondContact O-N 2.84Å; L520-K523 CarbonylContact O-C 3.6Å; L520-K523 WeakPolarHBondContact O-CA 3.5Å; L520-K523 PolarHBondContact O-N 3.3Å; K521-K523 VanDerWaalsContact C-N 3.32Å; K521-K523 PolarHBondContact O-N 2.98Å; K523-Y579 HydrophobicContact CB-CD1 3.71Å; K523-Y579 HydrophobicContact CB-CE1 4.27Å; K523-Y579 HydrophobicContact CB-CG 3.95Å; K523-Y579 HydrophobicContact CG-CD1 4.38Å; K523-Y579 HydrophobicContact CG-CG 4.38Å
524	Y	85.5	Confident	79.5	Confident	52 Å²	52	68.7 Å²	68.7	20%	0.204	34%	0.338	C	S	.	.	H	α-helix	trans	-84.3	-15.5	171.2	-76.4	-71.8	0	0	0	113.6	L470 L520 K521 E526 Y579 K1250	L470-Y524 HydrophobicContact CD1-CE2 4.48Å; L520-Y524 HydrophobicContact CB-CD2 4.32Å; L520-Y524 HydrophobicContact CB-CE2 4.19Å; L520-Y524 HydrophobicContact CD2-CE2 4.35Å; L520-Y524 WeakPolarHBondContact O-CD2 3.4Å; L520-Y524 PolarHBondContact O-N 3.05Å; K521-Y524 PolarHBondContact O-N 3.18Å; Y524-E526 WeakPolarHBondContact CB-OE1 3.36Å; Y524-Y579 HydrophobicContact CE1-CE2 4.14Å; Y524-Y579 AromaticContact CE1-CZ 3.9Å; Y524-Y579 WeakPolarHBondContact CE1-OH 3.19Å; Y524-Y579 HydrophobicContact CE2-CE2 4.14Å; Y524-Y579 AromaticContact CZ-CE2 3.71Å; Y524-Y579 AromaticContact CZ-CZ 3.97Å; Y524-K1250 PolarHBondContact O-NZ 2.89Å
525	H	85.3	Confident	77.3	Confident	96 Å²	96	68.4 Å²	68.4	44%	0.444	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.1	31.8	-170.9	-53.4	-47.9	0	0	0	114.4	K521 D527 L528	K521-H525 PolarHBondContact O-N 2.81Å; K521-H525 VanDerWaalsContact O-N 3.11Å; H525-D527 VanDerWaalsContact CA-OD1 3.31Å; H525-D527 WeakPolarHBondContact CA-OD1 3.38Å; H525-D527 PolarHBondContact O-N 2.72Å; H525-L528 HydrophobicContact CB-CD1 3.83Å; H525-L528 HydrophobicContact CB-CG 3.99Å
526	E	83.1	Confident	75.1	Confident	65 Å²	65	74.7 Å²	74.7	30%	0.304	37%	0.37	S	S	.	.			trans	-86	8.8	174.1	-61.8	165.8	-152.7	0	0	112.2	K521 Y524 K530	K521-E526 HydrophobicContact CB-CB 4.08Å; K521-E526 WeakPolarHBondContact CG-OE2 3.35Å; K521-E526 PolarHBondContact O-N 2.73Å; Y524-E526 WeakPolarHBondContact CB-OE1 3.36Å; E526-K530 WeakPolarHBondContact O-CD 3.36Å; E526-K530 WeakPolarHBondContact O-CE 3.37Å; E526-K530 PolarHBondContact O-NZ 3.23Å
527	D	79	Confident	73.2	Confident	17 Å²	17	76.4 Å²	76.4	9%	0.091	38%	0.382	C	S	.	.	S	Bend	trans	-93.5	-28.5	173.2	59.7	-47.7	0	0	0	113.3	T522 H525 D529 K530 L1008	T522-D527 HydrophobicContact CG2-CB 3.58Å; T522-D527 WeakPolarHBondContact CG2-OD2 3.22Å; H525-D527 VanDerWaalsContact CA-OD1 3.31Å; H525-D527 WeakPolarHBondContact CA-OD1 3.38Å; H525-D527 PolarHBondContact O-N 2.72Å; D527-D529 VanDerWaalsContact C-N 3.34Å; D527-D529 PolarHBondContact O-N 2.82Å; D527-K530 PolarHBondContact O-N 3.05Å; D527-L1008 PolarHBondContact OD2-N 3.11Å; D527-L1008 VanDerWaalsContact OD2-N 3.12Å
528	L	75.6	Confident	71.3	Confident	93 Å²	93	77.8 Å²	77.8	49%	0.487	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-42.1	-166.3	-61.2	-176.6	0	0	0	114.6	H525 L1008	H525-L528 HydrophobicContact CB-CD1 3.83Å; H525-L528 HydrophobicContact CB-CG 3.99Å; L528-L1008 HydrophobicContact CD2-CD1 3.54Å
529	D	76.4	Confident	69.8	Low	160 Å²	160	83.9 Å²	83.9	86%	0.856	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-0.3	-175.2	-56.5	-59.2	0	0	0	113	D527	D527-D529 VanDerWaalsContact C-N 3.34Å; D527-D529 PolarHBondContact O-N 2.82Å
530	K	67.3	Low	68.9	Low	120 Å²	120	83.6 Å²	83.6	52%	0.522	42%	0.424	S	S	.	.	S	Bend	trans	-87.4	119.6	-179.8	-70.1	173.8	179.8	147.4	0	110.6	E526 D527 S532	E526-K530 WeakPolarHBondContact O-CD 3.36Å; E526-K530 WeakPolarHBondContact O-CE 3.37Å; E526-K530 PolarHBondContact O-NZ 3.23Å; D527-K530 PolarHBondContact O-N 3.05Å; K530-S532 PolarHBondContact O-N 2.78Å
531	S	55.2	Low	68.6	Low	99 Å²	99	86.7 Å²	86.7	69%	0.692	44%	0.444	S	S	*	.			trans	-55.6	124.5	167.3	58.1	0	0	0	0	109.9	K533	S531-K533 PolarHBondContact O-N 3.41Å
532	S	52.9	Low	68.8	Low	48 Å²	48	85.1 Å²	85.1	34%	0.336	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	27.2	-167.7	63.6	0	0	0	0	117.1	K530 K1010	K530-S532 PolarHBondContact O-N 2.78Å; S532-K1010 PolarHBondContact OG-N 3.23Å
533	K	48.3	Very low	68.9	Low	151 Å²	151	89.3 Å²	89.3	66%	0.657	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	-1.1	-176.6	-59.8	-159.2	172.9	-163.9	0	114.7	S531 D1013	S531-K533 PolarHBondContact O-N 3.41Å; K533-D1013 IonicContact NZ-OD2 2.68Å; K533-D1013 PolarHBondContact NZ-OD2 3.33Å
534	H	43.6	Very low	69.2	Low	181 Å²	181	90.2 Å²	90.2	84%	0.838	46%	0.462	S	S	*	.			trans	-132.2	99.1	171.4	-66.6	-57.1	0	0	0	112.7
535	S	47.8	Very low	69.6	Low	50 Å²	50	87.7 Å²	87.7	35%	0.35	45%	0.452	S	S	.	.			trans	-136.8	123.8	156.1	62.8	0	0	0	0	109.5	S537 S538	S535-S537 PolarHBondContact O-N 3.13Å; S535-S538 PolarHBondContact O-N 3.13Å; S535-S538 VanDerWaalsContact O-N 3.14Å; S535-S538 PolarHBondContact O-OG 3.41Å
536	F	48.1	Very low	70.1	Confident	149 Å²	149	83.4 Å²	83.4	65%	0.654	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-55.3	-17.1	-179.3	-133.1	-97.5	0	0	0	113.2	F514 S538	F514-F536 HydrophobicContact CD1-CB 4.2Å; F514-F536 HydrophobicContact CE1-CB 3.41Å; F514-F536 VanDerWaalsContact CE1-CB 3.41Å; F514-F536 HydrophobicContact CE1-CG 4.44Å; F514-F536 HydrophobicContact CE2-CB 4.49Å; F514-F536 HydrophobicContact CZ-CB 3.59Å; F514-F536 HydrophobicContact CZ-CG 4.48Å; F536-S538 PolarHBondContact O-N 2.89Å
537	S	54.9	Low	70.6	Confident	36 Å²	36	83 Å²	83	25%	0.252	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-70	-21.2	180	-154.2	0	0	0	0	114.9	Q515 S535 W542	Q515-S537 PolarHBondContact NE2-OG 3.42Å; Q515-S537 PolarHBondContact OE1-OG 2.92Å; S535-S537 PolarHBondContact O-N 3.13Å; S537-W542 PolarHBondContact O-NE1 2.88Å; S537-W542 WeakPolarHBondContact OG-CZ2 3.38Å
538	S	54.2	Low	71.4	Confident	77 Å²	77	84.6 Å²	84.6	54%	0.538	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-86.9	-15	-176.7	57.7	0	0	0	0	115.5	S535 F536	S535-S538 PolarHBondContact O-N 3.13Å; S535-S538 VanDerWaalsContact O-N 3.14Å; S535-S538 PolarHBondContact O-OG 3.41Å; F536-S538 PolarHBondContact O-N 2.89Å
539	E	60.1	Low	72.3	Confident	179 Å²	179	80.2 Å²	80.2	84%	0.836	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.7	-19.6	-179.9	-65.5	-179.1	164.9	0	0	112.9
540	Y	73.7	Confident	73.2	Confident	23 Å²	23	73.4 Å²	73.4	9%	0.09	38%	0.381	C	S	.	.	S	Bend	trans	-70	131.6	-177.3	-165.6	-80.2	0	0	0	112.1	E507 I508 F511 W542 F545	E507-Y540 VanDerWaalsContact CD-OH 3.27Å; E507-Y540 HydrophobicContact CG-CE2 3.94Å; E507-Y540 PolarHBondContact OE2-OH 2.9Å; I508-Y540 WeakPolarHBondContact CD1-OH 3.33Å; F511-Y540 HydrophobicContact CD2-CD1 4.32Å; F511-Y540 AromaticContact CD2-CD2 3.77Å; F511-Y540 HydrophobicContact CD2-CD2 3.77Å; F511-Y540 HydrophobicContact CD2-CE2 4.28Å; F511-Y540 AromaticContact CD2-CG 3.8Å; F511-Y540 HydrophobicContact CD2-CG 3.8Å; F511-Y540 HydrophobicContact CE1-CD1 4.04Å; F511-Y540 HydrophobicContact CE1-CE1 4.49Å; F511-Y540 HydrophobicContact CE1-CG 4.39Å; F511-Y540 AromaticContact CE2-CD1 3.84Å; F511-Y540 HydrophobicContact CE2-CD1 3.84Å; F511-Y540 AromaticContact CE2-CD2 3.8Å; F511-Y540 HydrophobicContact CE2-CD2 3.8Å; F511-Y540 AromaticContact CE2-CG 3.35Å; F511-Y540 HydrophobicContact CE2-CG 3.35Å; F511-Y540 HydrophobicContact CG-CD2 4.42Å; F511-Y540 HydrophobicContact CG-CG 4.48Å; F511-Y540 AromaticContact CZ-CD1 3.67Å; F511-Y540 HydrophobicContact CZ-CD1 3.67Å; F511-Y540 HydrophobicContact CZ-CD2 4.46Å; F511-Y540 AromaticContact CZ-CG 3.67Å; F511-Y540 HydrophobicContact CZ-CG 3.67Å; Y540-W542 VanDerWaalsContact C-N 3.35Å; Y540-W542 PolarHBondContact O-N 2.97Å; Y540-F545 HydrophobicContact CD1-CB 4.35Å; Y540-F545 HydrophobicContact CE1-CB 3.76Å
541	P	85.7	Confident	74.4	Confident	72 Å²	72	70.8 Å²	70.8	47%	0.468	37%	0.371	S	S	.	.			trans	-70.6	87.3	176.9	29.5	-35.5	0	0	0	110.9	D543 K544 F545	P541-D543 PolarHBondContact O-N 2.68Å; P541-K544 HydrophobicContact CB-CB 4.17Å; P541-K544 HydrophobicContact CG-CB 4.01Å; P541-K544 HydrophobicContact CG-CD 3.97Å; P541-K544 WeakPolarHBondContact O-CA 3.39Å; P541-K544 VanDerWaalsContact O-CB 3.23Å; P541-K544 WeakPolarHBondContact O-CB 3.28Å; P541-K544 PolarHBondContact O-N 3.46Å; P541-F545 PolarHBondContact O-N 2.74Å
542	W	92.6	Very high	76.3	Confident	25 Å²	25	66 Å²	66	10%	0.095	34%	0.338	C	S	.	.	H	α-helix	trans	-53	-26.1	-178.1	-84.3	99	0	0	0	114.9	R405 F511 Q515 S537 Y540 F545 L546	R405-W542 HydrophobicContact CB-CD2 4.28Å; R405-W542 HydrophobicContact CB-CE3 3.71Å; R405-W542 HydrophobicContact CB-CH2 3.9Å; R405-W542 HydrophobicContact CB-CZ2 4.44Å; R405-W542 HydrophobicContact CB-CZ3 3.51Å; R405-W542 HydrophobicContact CG-CD2 3.98Å; R405-W542 HydrophobicContact CG-CE3 3.57Å; R405-W542 HydrophobicContact CG-CZ3 3.94Å; F511-W542 HydrophobicContact CE1-CD2 4.31Å; F511-W542 AromaticContact CE1-CE3 3.95Å; F511-W542 HydrophobicContact CE1-CE3 3.95Å; F511-W542 AromaticContact CE1-CH2 3.6Å; F511-W542 HydrophobicContact CE1-CH2 3.6Å; F511-W542 AromaticContact CE1-CZ2 3.96Å; F511-W542 HydrophobicContact CE1-CZ2 3.96Å; F511-W542 AromaticContact CE1-CZ3 3.58Å; F511-W542 HydrophobicContact CE1-CZ3 3.58Å; F511-W542 HydrophobicContact CZ-CD2 4.17Å; F511-W542 AromaticContact CZ-CE2 3.81Å; F511-W542 HydrophobicContact CZ-CE3 4.29Å; F511-W542 AromaticContact CZ-CH2 3.78Å; F511-W542 HydrophobicContact CZ-CH2 3.78Å; F511-W542 AromaticContact CZ-CZ2 3.63Å; F511-W542 HydrophobicContact CZ-CZ2 3.63Å; F511-W542 HydrophobicContact CZ-CZ3 4.09Å; Q515-W542 HydrophobicContact CG-CH2 3.97Å; Q515-W542 HydrophobicContact CG-CZ2 4.35Å; S537-W542 PolarHBondContact O-NE1 2.88Å; S537-W542 WeakPolarHBondContact OG-CZ2 3.38Å; Y540-W542 VanDerWaalsContact C-N 3.35Å; Y540-W542 PolarHBondContact O-N 2.97Å; W542-F545 HydrophobicContact CE3-CB 4.45Å; W542-F545 AromaticContact CE3-CD1 3.73Å; W542-F545 HydrophobicContact CE3-CD1 3.73Å; W542-F545 HydrophobicContact CE3-CE1 4.46Å; W542-F545 HydrophobicContact CE3-CG 4.35Å; W542-F545 AromaticContact CZ3-CD1 3.68Å; W542-F545 HydrophobicContact CZ3-CD1 3.68Å; W542-F545 AromaticContact CZ3-CE1 3.97Å; W542-F545 HydrophobicContact CZ3-CE1 3.97Å; W542-F545 HydrophobicContact CZ3-CG 4.43Å; W542-F545 WeakPolarHBondContact O-CB 3.29Å; W542-F545 PolarHBondContact O-N 2.95Å; W542-L546 WeakPolarHBondContact O-CB 3.36Å; W542-L546 WeakPolarHBondContact O-CG 3.44Å; W542-L546 PolarHBondContact O-N 3.33Å
543	D	91.3	Very high	78.1	Confident	116 Å²	116	64.7 Å²	64.7	62%	0.62	33%	0.327	S	S	*	.	H	α-helix	trans	-77.3	-28.3	179.5	-50.1	-34.2	0	0	0	111.7	R405 P541 S547	R405-D543 IonicContact NH2-OD1 2.72Å; P541-D543 PolarHBondContact O-N 2.68Å; D543-S547 WeakPolarHBondContact O-CB 3.2Å; D543-S547 PolarHBondContact O-N 3.14Å
544	K	92	Very high	80.1	Confident	85 Å²	85	65.7 Å²	65.7	37%	0.37	33%	0.331	S	S	.	.	H	α-helix	trans	-62.6	-47.7	165.5	-178	-167.2	177.1	-166.5	0	109.8	E507 P541 S547 W548	E507-K544 IonicContact OE1-NZ 2.91Å; E507-K544 PolarHBondContact OE1-NZ 2.91Å; E507-K544 WeakPolarHBondContact OE2-CE 3.33Å; E507-K544 IonicContact OE2-NZ 2.67Å; E507-K544 PolarHBondContact OE2-NZ 2.95Å; P541-K544 HydrophobicContact CB-CB 4.17Å; P541-K544 HydrophobicContact CG-CB 4.01Å; P541-K544 HydrophobicContact CG-CD 3.97Å; P541-K544 WeakPolarHBondContact O-CA 3.39Å; P541-K544 VanDerWaalsContact O-CB 3.23Å; P541-K544 WeakPolarHBondContact O-CB 3.28Å; P541-K544 PolarHBondContact O-N 3.46Å; K544-S547 WeakPolarHBondContact O-CB 3.29Å; K544-S547 PolarHBondContact O-N 3.1Å; K544-W548 PolarHBondContact O-N 2.74Å; K544-W548 VanDerWaalsContact O-N 3.14Å
545	F	95.2	Very high	82.2	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-60.3	-49.1	177.4	174.4	-101.4	0	0	0	112	A408 C409 I412 I508 F511 S512 Y540 P541 W542 S547 W548 Y549	A408-F545 HydrophobicContact CB-CE1 3.88Å; A408-F545 HydrophobicContact CB-CZ 4.49Å; C409-F545 HydrophobicContact CB-CZ 4.33Å; C409-F545 VanDerWaalsContact SG-CE1 3.56Å; C409-F545 WeakPolarHBondContact SG-CZ 3.34Å; I412-F545 HydrophobicContact CD1-CE2 3.86Å; I412-F545 HydrophobicContact CD1-CZ 3.84Å; I508-F545 HydrophobicContact CD1-CD2 4.37Å; I508-F545 HydrophobicContact CG2-CD2 4.04Å; I508-F545 HydrophobicContact CG2-CE2 3.97Å; F511-F545 AromaticContact CD1-CD2 3.62Å; F511-F545 HydrophobicContact CD1-CD2 3.62Å; F511-F545 AromaticContact CD1-CE2 3.98Å; F511-F545 HydrophobicContact CD1-CE2 3.98Å; F511-F545 HydrophobicContact CD1-CG 4Å; F511-F545 HydrophobicContact CE1-CB 4.3Å; F511-F545 HydrophobicContact CE1-CD1 4.35Å; F511-F545 HydrophobicContact CE1-CD2 4.07Å; F511-F545 AromaticContact CE1-CG 3.96Å; F511-F545 HydrophobicContact CE1-CG 3.96Å; S512-F545 VanDerWaalsContact OG-CE2 3.31Å; S512-F545 WeakPolarHBondContact OG-CE2 3.45Å; Y540-F545 HydrophobicContact CD1-CB 4.35Å; Y540-F545 HydrophobicContact CE1-CB 3.76Å; P541-F545 PolarHBondContact O-N 2.74Å; W542-F545 HydrophobicContact CE3-CB 4.45Å; W542-F545 AromaticContact CE3-CD1 3.73Å; W542-F545 HydrophobicContact CE3-CD1 3.73Å; W542-F545 HydrophobicContact CE3-CE1 4.46Å; W542-F545 HydrophobicContact CE3-CG 4.35Å; W542-F545 AromaticContact CZ3-CD1 3.68Å; W542-F545 HydrophobicContact CZ3-CD1 3.68Å; W542-F545 AromaticContact CZ3-CE1 3.97Å; W542-F545 HydrophobicContact CZ3-CE1 3.97Å; W542-F545 HydrophobicContact CZ3-CG 4.43Å; W542-F545 WeakPolarHBondContact O-CB 3.29Å; W542-F545 PolarHBondContact O-N 2.95Å; F545-S547 VanDerWaalsContact C-N 3.33Å; F545-S547 PolarHBondContact O-N 3.31Å; F545-W548 PolarHBondContact O-N 2.82Å; F545-Y549 PolarHBondContact O-N 3.41Å
546	L	95.6	Very high	84.2	Confident	5 Å²	5	61.6 Å²	61.6	3%	0.026	31%	0.314	C	S	.	.	H	α-helix	trans	-63.8	-38.1	179.3	-72.7	177.5	0	0	0	111.8	F404 R405 A408 W542 W548 Y549 Y550 L611	F404-L546 HydrophobicContact CD1-CD2 4.19Å; F404-L546 HydrophobicContact CE1-CD2 3.99Å; R405-L546 HydrophobicContact CG-CD1 4.31Å; A408-L546 HydrophobicContact CB-CD2 4.05Å; W542-L546 WeakPolarHBondContact O-CB 3.36Å; W542-L546 WeakPolarHBondContact O-CG 3.44Å; W542-L546 PolarHBondContact O-N 3.33Å; L546-W548 PolarHBondContact O-N 2.63Å; L546-Y549 HydrophobicContact CD2-CD1 4.4Å; L546-Y549 PolarHBondContact O-N 3.24Å; L546-Y550 HydrophobicContact CB-CD2 4.4Å; L546-Y550 HydrophobicContact CB-CE2 3.88Å; L546-Y550 WeakPolarHBondContact O-CD2 3.4Å; L546-Y550 PolarHBondContact O-N 3.12Å; L546-L611 HydrophobicContact CD1-CB 4.45Å; L546-L611 HydrophobicContact CD1-CD2 3.81Å
547	S	94.2	Very high	86	Confident	58 Å²	58	60 Å²	60	41%	0.406	31%	0.308	S	S	.	.	H	α-helix	trans	-56.1	-49.6	172.9	-170.5	0	0	0	0	112	D543 K544 F545 Y550 Q551	D543-S547 WeakPolarHBondContact O-CB 3.2Å; D543-S547 PolarHBondContact O-N 3.14Å; K544-S547 WeakPolarHBondContact O-CB 3.29Å; K544-S547 PolarHBondContact O-N 3.1Å; F545-S547 VanDerWaalsContact C-N 3.33Å; F545-S547 PolarHBondContact O-N 3.31Å; S547-Y550 PolarHBondContact O-N 3.1Å; S547-Q551 WeakPolarHBondContact O-CG 3.26Å; S547-Q551 PolarHBondContact O-N 3.2Å; S547-Q551 VanDerWaalsContact O-N 3.16Å
548	W	94.4	Very high	87.5	Confident	49 Å²	49	59.1 Å²	59.1	19%	0.186	30%	0.3	C	S	.	.	H	α-helix	trans	-64	-43.3	175.7	-81.8	105.7	0	0	0	112.7	P505 I508 K544 F545 L546 Y550 Q551 I552	P505-W548 VanDerWaalsContact CD-CZ2 3.48Å; P505-W548 HydrophobicContact CG-CH2 4.25Å; P505-W548 HydrophobicContact CG-CZ2 3.7Å; I508-W548 HydrophobicContact CD1-CB 3.95Å; I508-W548 HydrophobicContact CD1-CG 3.87Å; I508-W548 HydrophobicContact CG1-CB 4.03Å; I508-W548 HydrophobicContact CG1-CD2 4.46Å; I508-W548 HydrophobicContact CG1-CG 3.87Å; I508-W548 HydrophobicContact CG2-CB 4.06Å; K544-W548 PolarHBondContact O-N 2.74Å; K544-W548 VanDerWaalsContact O-N 3.14Å; F545-W548 PolarHBondContact O-N 2.82Å; L546-W548 PolarHBondContact O-N 2.63Å; W548-Y550 VanDerWaalsContact C-N 3.3Å; W548-Y550 PolarHBondContact O-N 2.96Å; W548-Q551 WeakPolarHBondContact O-CB 3.45Å; W548-Q551 PolarHBondContact O-N 3.44Å; W548-I552 VanDerWaalsContact O-CG1 3.27Å; W548-I552 WeakPolarHBondContact O-CG1 3.23Å; W548-I552 PolarHBondContact O-N 3.03Å
549	Y	95.5	Very high	89.1	Confident	1 Å²	1	55.5 Å²	55.5	0%	0.004	28%	0.275	C	S	.	.	H	α-helix	trans	-55	-44.4	173.4	168.3	-108.6	0	0	0	112.1	A408 I412 F545 L546 Q551 I552 I553 V588 R589 N590	A408-Y549 HydrophobicContact CB-CD1 3.67Å; A408-Y549 HydrophobicContact CB-CD2 3.9Å; A408-Y549 HydrophobicContact CB-CE1 3.83Å; A408-Y549 HydrophobicContact CB-CE2 4.06Å; A408-Y549 HydrophobicContact CB-CG 3.72Å; I412-Y549 HydrophobicContact CD1-CD2 4.1Å; I412-Y549 HydrophobicContact CG1-CD2 3.95Å; F545-Y549 PolarHBondContact O-N 3.41Å; L546-Y549 HydrophobicContact CD2-CD1 4.4Å; L546-Y549 PolarHBondContact O-N 3.24Å; Y549-Q551 VanDerWaalsContact C-N 3.26Å; Y549-Q551 PolarHBondContact O-N 2.94Å; Y549-I552 PolarHBondContact O-N 3.04Å; Y549-I553 HydrophobicContact CD2-CG1 3.95Å; Y549-I553 HydrophobicContact CE1-CG1 4.25Å; Y549-I553 HydrophobicContact CE2-CD1 3.74Å; Y549-I553 HydrophobicContact CE2-CG1 3.39Å; Y549-I553 WeakPolarHBondContact O-CB 3.28Å; Y549-I553 VanDerWaalsContact O-CG1 3.3Å; Y549-I553 WeakPolarHBondContact O-CG1 3.32Å; Y549-I553 PolarHBondContact O-N 2.98Å; Y549-V588 PolarHBondContact OH-O 2.86Å; Y549-R589 VanDerWaalsContact OH-C 3.3Å; Y549-R589 PolarHBondContact OH-O 3.19Å; Y549-N590 HydrophobicContact CE1-CB 4.19Å; Y549-N590 WeakPolarHBondContact OH-CB 3.3Å
550	Y	95.3	Very high	90.3	Very high	18 Å²	18	51.4 Å²	51.4	7%	0.071	26%	0.262	C	S	.	.	H	α-helix	trans	-68.3	-21.5	177.2	-61.8	-44.8	0	0	0	114	F404 L546 S547 W548 K554 D609 R610 L611	F404-Y550 HydrophobicContact CE1-CE1 4.4Å; F404-Y550 WeakPolarHBondContact CE1-OH 3.36Å; F404-Y550 HydrophobicContact CZ-CE1 4.32Å; F404-Y550 WeakPolarHBondContact CZ-OH 3.39Å; L546-Y550 HydrophobicContact CB-CD2 4.4Å; L546-Y550 HydrophobicContact CB-CE2 3.88Å; L546-Y550 WeakPolarHBondContact O-CD2 3.4Å; L546-Y550 PolarHBondContact O-N 3.12Å; S547-Y550 PolarHBondContact O-N 3.1Å; W548-Y550 VanDerWaalsContact C-N 3.3Å; W548-Y550 PolarHBondContact O-N 2.96Å; Y550-K554 WeakPolarHBondContact O-CG 3.34Å; Y550-D609 VanDerWaalsContact CE1-O 3.22Å; Y550-D609 WeakPolarHBondContact CE1-O 3.14Å; Y550-R610 HydrophobicContact CE1-CG 4.23Å; Y550-R610 VanDerWaalsContact CG-NH1 3.34Å; Y550-L611 PolarHBondContact OH-N 2.87Å
551	Q	92.5	Very high	90.8	Very high	64 Å²	64	53 Å²	53	30%	0.299	27%	0.274	S	S	.	.	H	α-helix	trans	-80.4	-46.9	170.7	-66.3	174.6	25.5	0	0	111	S547 W548 Y549 I553 K554 M555	S547-Q551 WeakPolarHBondContact O-CG 3.26Å; S547-Q551 PolarHBondContact O-N 3.2Å; S547-Q551 VanDerWaalsContact O-N 3.16Å; W548-Q551 WeakPolarHBondContact O-CB 3.45Å; W548-Q551 PolarHBondContact O-N 3.44Å; Y549-Q551 VanDerWaalsContact C-N 3.26Å; Y549-Q551 PolarHBondContact O-N 2.94Å; Q551-I553 PolarHBondContact O-N 2.77Å; Q551-K554 CarbonylContact O-C 3.6Å; Q551-K554 WeakPolarHBondContact O-CA 3.36Å; Q551-K554 WeakPolarHBondContact O-CB 3.36Å; Q551-K554 PolarHBondContact O-N 2.85Å; Q551-M555 PolarHBondContact O-N 2.87Å
552	I	93.6	Very high	90.9	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-54.4	-39.2	175.7	-69	165.4	0	0	0	111.5	I412 M415 I504 I508 W548 Y549 K554 M555 P556 L559	I412-I552 HydrophobicContact CD1-CD1 3.79Å; I412-I552 HydrophobicContact CG1-CD1 4.34Å; I412-I552 HydrophobicContact CG1-CG2 4.48Å; M415-I552 HydrophobicContact CE-CG2 3.8Å; M415-I552 HydrophobicContact SD-CG2 4.19Å; I504-I552 HydrophobicContact CD1-CD1 3.87Å; I504-I552 HydrophobicContact CD1-CG1 3.63Å; I504-I552 HydrophobicContact CG1-CD1 4.29Å; I504-I552 HydrophobicContact CG1-CG1 4.06Å; I504-I552 HydrophobicContact CG2-CD1 4.13Å; I508-I552 HydrophobicContact CG2-CD1 4.09Å; W548-I552 VanDerWaalsContact O-CG1 3.27Å; W548-I552 WeakPolarHBondContact O-CG1 3.23Å; W548-I552 PolarHBondContact O-N 3.03Å; Y549-I552 PolarHBondContact O-N 3.04Å; I552-K554 VanDerWaalsContact C-N 3.29Å; I552-K554 PolarHBondContact O-N 2.63Å; I552-M555 CarbonylContact O-C 3.26Å; I552-M555 VanDerWaalsContact O-C 3.26Å; I552-M555 PolarHBondContact O-N 2.97Å; I552-P556 WeakPolarHBondContact O-CA 3.44Å; I552-P556 VanDerWaalsContact O-N 3.15Å; I552-L559 HydrophobicContact CD1-CD2 4.5Å; I552-L559 HydrophobicContact CG2-CD1 3.7Å; I552-L559 HydrophobicContact CG2-CD2 4.21Å; I552-L559 HydrophobicContact CG2-CG 3.93Å
553	I	92.2	Very high	90.7	Very high	20 Å²	20	53.1 Å²	53.1	10%	0.103	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-20.2	177.5	-72.3	-66.8	0	0	0	113.9	M415 Y549 Q551 V588	M415-I553 HydrophobicContact CE-CD1 4.18Å; M415-I553 HydrophobicContact SD-CD1 3.67Å; Y549-I553 HydrophobicContact CD2-CG1 3.95Å; Y549-I553 HydrophobicContact CE1-CG1 4.25Å; Y549-I553 HydrophobicContact CE2-CD1 3.74Å; Y549-I553 HydrophobicContact CE2-CG1 3.39Å; Y549-I553 WeakPolarHBondContact O-CB 3.28Å; Y549-I553 VanDerWaalsContact O-CG1 3.3Å; Y549-I553 WeakPolarHBondContact O-CG1 3.32Å; Y549-I553 PolarHBondContact O-N 2.98Å; Q551-I553 PolarHBondContact O-N 2.77Å; I553-V588 WeakPolarHBondContact CD1-O 3.35Å
554	K	89.5	Confident	90.6	Very high	172 Å²	172	53 Å²	53	75%	0.748	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-33.9	170.3	-67.5	178.3	177.9	-172.6	0	112.4	Y550 Q551 I552 P556	Y550-K554 WeakPolarHBondContact O-CG 3.34Å; Q551-K554 CarbonylContact O-C 3.6Å; Q551-K554 WeakPolarHBondContact O-CA 3.36Å; Q551-K554 WeakPolarHBondContact O-CB 3.36Å; Q551-K554 PolarHBondContact O-N 2.85Å; I552-K554 VanDerWaalsContact C-N 3.29Å; I552-K554 PolarHBondContact O-N 2.63Å; K554-P556 WeakPolarHBondContact O-CD 3.35Å
555	M	88.7	Confident	90.7	Very high	77 Å²	77	50.2 Å²	50.2	38%	0.379	25%	0.253	S	S	.	.			trans	-128.1	68.8	-171.9	-65.9	174.1	68.3	0	0	110.1	Q551 I552 H557 L558	Q551-M555 PolarHBondContact O-N 2.87Å; I552-M555 CarbonylContact O-C 3.26Å; I552-M555 VanDerWaalsContact O-C 3.26Å; I552-M555 PolarHBondContact O-N 2.97Å; M555-H557 WeakPolarHBondContact CE-NE2 3.02Å; M555-H557 PolarHBondContact O-N 3.01Å; M555-L558 HydrophobicContact CB-CD1 3.59Å; M555-L558 HydrophobicContact CB-CG 3.84Å; M555-L558 HydrophobicContact CE-CD1 4.19Å; M555-L558 HydrophobicContact CE-CD2 4.25Å; M555-L558 HydrophobicContact CE-CG 4.38Å; M555-L558 WeakPolarHBondContact O-CB 3.34Å; M555-L558 VanDerWaalsContact O-CG 3.3Å; M555-L558 WeakPolarHBondContact O-CG 3.16Å; M555-L558 PolarHBondContact O-N 3.19Å; M555-L558 VanDerWaalsContact O-N 3.15Å; M555-L558 HydrophobicContact SD-CD1 4.38Å
556	P	88.5	Confident	90.5	Very high	68 Å²	68	50.2 Å²	50.2	44%	0.442	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-65.5	-21.8	-173.9	26.5	-36	0	0	0	113.5	M415 I552 K554 L558 L559	M415-P556 HydrophobicContact CE-CB 3.7Å; I552-P556 WeakPolarHBondContact O-CA 3.44Å; I552-P556 VanDerWaalsContact O-N 3.15Å; K554-P556 WeakPolarHBondContact O-CD 3.35Å; P556-L558 PolarHBondContact O-N 3.26Å; P556-L559 PolarHBondContact O-N 3.19Å
557	H	86	Confident	90.3	Very high	114 Å²	114	53.6 Å²	53.6	53%	0.528	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-59.3	-25.5	175	58.9	-106.6	0	0	0	113	M555 L559 V560	M555-H557 WeakPolarHBondContact CE-NE2 3.02Å; M555-H557 PolarHBondContact O-N 3.01Å; H557-L559 PolarHBondContact O-N 2.92Å; H557-L559 VanDerWaalsContact O-N 3.13Å; H557-V560 VanDerWaalsContact O-CB 3.31Å; H557-V560 WeakPolarHBondContact O-CB 3.45Å; H557-V560 VanDerWaalsContact O-CG1 3.28Å; H557-V560 WeakPolarHBondContact O-CG1 3.05Å; H557-V560 PolarHBondContact O-N 2.99Å
558	L	86.2	Confident	90.3	Very high	19 Å²	19	54.4 Å²	54.4	10%	0.099	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-61.7	-20.9	178.3	-62	175.8	0	0	0	112.9	F502 I504 M555 P556 V560	F502-L558 HydrophobicContact CB-CD2 4.44Å; F502-L558 WeakPolarHBondContact O-CD2 3.43Å; I504-L558 VanDerWaalsContact CD1-C 3.48Å; I504-L558 HydrophobicContact CD1-CB 3.66Å; I504-L558 WeakPolarHBondContact CD1-O 3.24Å; I504-L558 HydrophobicContact CG1-CB 3.81Å; M555-L558 HydrophobicContact CB-CD1 3.59Å; M555-L558 HydrophobicContact CB-CG 3.84Å; M555-L558 HydrophobicContact CE-CD1 4.19Å; M555-L558 HydrophobicContact CE-CD2 4.25Å; M555-L558 HydrophobicContact CE-CG 4.38Å; M555-L558 WeakPolarHBondContact O-CB 3.34Å; M555-L558 VanDerWaalsContact O-CG 3.3Å; M555-L558 WeakPolarHBondContact O-CG 3.16Å; M555-L558 PolarHBondContact O-N 3.19Å; M555-L558 VanDerWaalsContact O-N 3.15Å; M555-L558 HydrophobicContact SD-CD1 4.38Å; P556-L558 PolarHBondContact O-N 3.26Å; L558-V560 PolarHBondContact O-N 3.09Å
559	L	89.3	Confident	90.3	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.005	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-76.1	-1.8	174.6	-67.4	170.3	0	0	0	113.8	I412 M415 I416 L419 I504 I509 I552 P556 H557 T561 A562	I412-L559 HydrophobicContact CG2-CD2 4.27Å; M415-L559 HydrophobicContact CB-CD1 3.54Å; M415-L559 HydrophobicContact CE-CD1 3.91Å; M415-L559 HydrophobicContact CG-CD1 4.49Å; M415-L559 HydrophobicContact SD-CD1 4.36Å; I416-L559 HydrophobicContact CD1-CD2 4.13Å; I416-L559 HydrophobicContact CG1-CD1 4.24Å; I416-L559 HydrophobicContact CG1-CD2 3.93Å; I416-L559 HydrophobicContact CG1-CG 4.48Å; L419-L559 HydrophobicContact CD1-CB 4.18Å; L419-L559 WeakPolarHBondContact CD1-O 3.39Å; I504-L559 HydrophobicContact CD1-CD2 3.51Å; I504-L559 HydrophobicContact CD1-CG 3.89Å; I509-L559 HydrophobicContact CD1-CD2 4.43Å; I552-L559 HydrophobicContact CD1-CD2 4.5Å; I552-L559 HydrophobicContact CG2-CD1 3.7Å; I552-L559 HydrophobicContact CG2-CD2 4.21Å; I552-L559 HydrophobicContact CG2-CG 3.93Å; P556-L559 PolarHBondContact O-N 3.19Å; H557-L559 PolarHBondContact O-N 2.92Å; H557-L559 VanDerWaalsContact O-N 3.13Å; L559-T561 PolarHBondContact O-N 2.72Å; L559-A562 WeakPolarHBondContact O-CA 3.44Å; L559-A562 WeakPolarHBondContact O-CB 3.35Å; L559-A562 PolarHBondContact O-N 2.89Å
560	V	84.9	Confident	90.3	Very high	92 Å²	92	55.7 Å²	55.7	56%	0.558	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-59.8	-31.2	-177.9	71.2	0	0	0	0	112.9	H557 L558 A562 K563	H557-V560 VanDerWaalsContact O-CB 3.31Å; H557-V560 WeakPolarHBondContact O-CB 3.45Å; H557-V560 VanDerWaalsContact O-CG1 3.28Å; H557-V560 WeakPolarHBondContact O-CG1 3.05Å; H557-V560 PolarHBondContact O-N 2.99Å; L558-V560 PolarHBondContact O-N 3.09Å; V560-A562 PolarHBondContact O-N 3.16Å; V560-K563 WeakPolarHBondContact O-CB 3.29Å; V560-K563 PolarHBondContact O-N 3.27Å
561	T	83.3	Confident	90.2	Very high	57 Å²	57	60.7 Å²	60.7	35%	0.35	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-58.9	-34.5	172.6	55.9	0	0	0	0	112	L559 K563 H564	L559-T561 PolarHBondContact O-N 2.72Å; T561-K563 VanDerWaalsContact C-N 3.29Å; T561-K563 PolarHBondContact O-N 2.83Å; T561-H564 PolarHBondContact O-CE1 3.24Å; T561-H564 PolarHBondContact O-ND1 3.31Å
562	A	88.9	Confident	90.4	Very high	2 Å²	2	57.9 Å²	57.9	2%	0.017	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-82.3	5.7	177.5	0	0	0	0	0	114.6	I416 I509 L559 V560 H564 L565	I416-A562 HydrophobicContact CD1-CB 4.02Å; I416-A562 HydrophobicContact CG1-CB 4.14Å; I416-A562 HydrophobicContact CG2-CB 4.3Å; I509-A562 HydrophobicContact CD1-CB 3.74Å; I509-A562 HydrophobicContact CG2-CB 4.38Å; L559-A562 WeakPolarHBondContact O-CA 3.44Å; L559-A562 WeakPolarHBondContact O-CB 3.35Å; L559-A562 PolarHBondContact O-N 2.89Å; V560-A562 PolarHBondContact O-N 3.16Å; A562-H564 PolarHBondContact O-N 2.93Å; A562-L565 HydrophobicContact CB-CD1 4.48Å; A562-L565 WeakPolarHBondContact O-CB 3.37Å; A562-L565 PolarHBondContact O-N 2.75Å
563	K	88.3	Confident	90.4	Very high	97 Å²	97	58.7 Å²	58.7	42%	0.422	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-53.3	-30	176.7	-174.3	175	-176.6	177.8	0	112.5	L419 V560 T561 L565 S566	L419-K563 HydrophobicContact CD1-CB 4.44Å; V560-K563 WeakPolarHBondContact O-CB 3.29Å; V560-K563 PolarHBondContact O-N 3.27Å; T561-K563 VanDerWaalsContact C-N 3.29Å; T561-K563 PolarHBondContact O-N 2.83Å; K563-L565 PolarHBondContact O-N 3.09Å; K563-S566 WeakPolarHBondContact CA-OG 3.49Å; K563-S566 WeakPolarHBondContact O-CB 3.48Å; K563-S566 PolarHBondContact O-N 2.59Å; K563-S566 PolarHBondContact O-OG 3.42Å
564	H	89.4	Confident	90.5	Very high	114 Å²	114	65.4 Å²	65.4	53%	0.528	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-64.2	-23.2	174.7	71.9	-85.1	0	0	0	114.3	T561 A562	T561-H564 PolarHBondContact O-CE1 3.24Å; T561-H564 PolarHBondContact O-ND1 3.31Å; A562-H564 PolarHBondContact O-N 2.93Å
565	L	92.7	Very high	90.7	Very high	26 Å²	26	58.8 Å²	58.8	14%	0.136	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-91.1	-4	177.7	-59.1	174.3	0	0	0	113.5	I416 I509 I513 A562 K563 S567 H568 C569	I416-L565 HydrophobicContact CG2-CB 4.09Å; I509-L565 HydrophobicContact CG2-CD1 3.66Å; I513-L565 HydrophobicContact CD1-CD1 4Å; A562-L565 HydrophobicContact CB-CD1 4.48Å; A562-L565 WeakPolarHBondContact O-CB 3.37Å; A562-L565 PolarHBondContact O-N 2.75Å; K563-L565 PolarHBondContact O-N 3.09Å; L565-S567 PolarHBondContact O-N 3.47Å; L565-H568 WeakPolarHBondContact O-CB 3.49Å; L565-H568 PolarHBondContact O-N 3.28Å; L565-H568 VanDerWaalsContact O-N 3.1Å; L565-C569 PolarHBondContact O-N 3.46Å; L565-C569 PolarHBondContact O-SG 3.04Å
566	S	91.7	Very high	91	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-53.3	-48.1	-173.2	-53.4	0	0	0	0	113	I416 I420 K563 H568 C569 Q570	I416-S566 WeakPolarHBondContact O-CB 3.34Å; I416-S566 PolarHBondContact O-OG 2.88Å; I420-S566 VanDerWaalsContact CD1-CB 3.45Å; K563-S566 WeakPolarHBondContact CA-OG 3.49Å; K563-S566 WeakPolarHBondContact O-CB 3.48Å; K563-S566 PolarHBondContact O-N 2.59Å; K563-S566 PolarHBondContact O-OG 3.42Å; S566-H568 PolarHBondContact O-N 3.4Å; S566-C569 CarbonylContact O-C 3.56Å; S566-C569 PolarHBondContact O-N 3.46Å; S566-Q570 WeakPolarHBondContact O-CG 3.39Å; S566-Q570 PolarHBondContact O-N 3.17Å
567	S	92	Very high	91.2	Very high	76 Å²	76	56.7 Å²	56.7	53%	0.531	28%	0.277	S	S	.	.	H	α-helix	trans	-65.6	-36	-179.4	-49.1	0	0	0	0	112.9	L565 Y571	L565-S567 PolarHBondContact O-N 3.47Å; S567-Y571 PolarHBondContact O-N 2.96Å; S567-Y571 VanDerWaalsContact O-N 3.13Å
568	H	92.7	Very high	91.4	Very high	76 Å²	76	57.5 Å²	57.5	35%	0.352	28%	0.279	S	S	.	.	H	α-helix	trans	-66.4	-43.6	172.7	-179.7	81.7	0	0	0	110.7	Q517 L565 S566 Q570 Y571 L572	Q517-H568 PolarHBondContact NE2-NE2 3.32Å; L565-H568 WeakPolarHBondContact O-CB 3.49Å; L565-H568 PolarHBondContact O-N 3.28Å; L565-H568 VanDerWaalsContact O-N 3.1Å; S566-H568 PolarHBondContact O-N 3.4Å; H568-Q570 PolarHBondContact O-N 3.43Å; H568-Y571 PolarHBondContact O-N 3.2Å; H568-L572 WeakPolarHBondContact O-CB 3.48Å; H568-L572 PolarHBondContact O-N 3.1Å
569	C	95.8	Very high	91.5	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-65.9	-35.8	177.5	-64.8	0	0	0	0	112.2	V413 I416 A417 L565 S566 L572 C573	V413-C569 HydrophobicContact CG1-CB 3.99Å; I416-C569 HydrophobicContact CB-CB 4.22Å; I416-C569 HydrophobicContact CG2-CB 4Å; I416-C569 VanDerWaalsContact CG2-SG 3.5Å; A417-C569 HydrophobicContact CB-CB 3.9Å; L565-C569 PolarHBondContact O-N 3.46Å; L565-C569 PolarHBondContact O-SG 3.04Å; S566-C569 CarbonylContact O-C 3.56Å; S566-C569 PolarHBondContact O-N 3.46Å; C569-L572 PolarHBondContact O-N 3.1Å; C569-C573 VanDerWaalsContact O-CB 3.3Å; C569-C573 WeakPolarHBondContact O-CB 3.16Å; C569-C573 PolarHBondContact O-N 2.98Å; C569-C573 PolarHBondContact O-SG 3.25Å
570	Q	94.8	Very high	91.6	Very high	77 Å²	77	60.5 Å²	60.5	36%	0.36	29%	0.292	S	S	.	.	H	α-helix	trans	-62.4	-45.2	172.2	-73.8	172.8	3	0	0	112	A417 S566 H568 C573 K574	A417-Q570 HydrophobicContact CB-CB 4.5Å; A417-Q570 HydrophobicContact CB-CG 3.83Å; A417-Q570 WeakPolarHBondContact O-CG 3.5Å; A417-Q570 PolarHBondContact O-NE2 3.36Å; S566-Q570 WeakPolarHBondContact O-CG 3.39Å; S566-Q570 PolarHBondContact O-N 3.17Å; H568-Q570 PolarHBondContact O-N 3.43Å; Q570-C573 PolarHBondContact O-N 2.88Å; Q570-K574 WeakPolarHBondContact O-CB 3.45Å; Q570-K574 PolarHBondContact O-N 2.65Å
571	Y	94.1	Very high	91.9	Very high	122 Å²	122	57.1 Å²	57.1	48%	0.478	27%	0.272	S	S	.	.	H	α-helix	trans	-62.6	-44.1	174.3	178.6	-98	0	0	0	111.7	S567 H568 K574 L575	S567-Y571 PolarHBondContact O-N 2.96Å; S567-Y571 VanDerWaalsContact O-N 3.13Å; H568-Y571 PolarHBondContact O-N 3.2Å; Y571-K574 WeakPolarHBondContact O-CB 3.19Å; Y571-K574 PolarHBondContact O-N 2.91Å; Y571-L575 HydrophobicContact CD1-CD1 4.18Å; Y571-L575 HydrophobicContact CE1-CD1 3.53Å; Y571-L575 HydrophobicContact CE1-CG 4.14Å; Y571-L575 PolarHBondContact O-N 3.02Å
572	L	95.2	Very high	92.4	Very high	6 Å²	6	54.7 Å²	54.7	3%	0.031	26%	0.257	C	S	.	.	H	α-helix	trans	-62.4	-43.7	177.2	-172.4	54.6	0	0	0	111.6	V413 I513 C516 Q517 L520 H568 C569 K574 L575 L576	V413-L572 HydrophobicContact CG1-CB 4.31Å; V413-L572 HydrophobicContact CG1-CD2 3.91Å; V413-L572 HydrophobicContact CG1-CG 4.15Å; V413-L572 HydrophobicContact CG2-CD2 4.38Å; I513-L572 HydrophobicContact CG1-CD2 4.49Å; I513-L572 HydrophobicContact CG2-CD2 4.06Å; C516-L572 HydrophobicContact CB-CD1 4.37Å; C516-L572 HydrophobicContact CB-CD2 3.91Å; C516-L572 HydrophobicContact CB-CG 4.26Å; Q517-L572 HydrophobicContact CG-CD1 4.2Å; L520-L572 HydrophobicContact CD1-CD1 3.57Å; H568-L572 WeakPolarHBondContact O-CB 3.48Å; H568-L572 PolarHBondContact O-N 3.1Å; C569-L572 PolarHBondContact O-N 3.1Å; L572-K574 VanDerWaalsContact C-N 3.34Å; L572-K574 PolarHBondContact O-N 2.71Å; L572-L575 PolarHBondContact O-N 2.87Å; L572-L576 HydrophobicContact CD1-CD1 4.48Å; L572-L576 HydrophobicContact CG-CD1 4.01Å; L572-L576 WeakPolarHBondContact O-CB 3.35Å; L572-L576 VanDerWaalsContact O-CG 3.25Å; L572-L576 WeakPolarHBondContact O-CG 3.41Å; L572-L576 PolarHBondContact O-N 3.3Å
573	C	95.3	Very high	92.7	Very high	17 Å²	17	55.4 Å²	55.4	12%	0.115	26%	0.26	C	S	.	.	H	α-helix	trans	-57.7	-42.7	171.5	-75	0	0	0	0	112.4	C569 Q570 L575 L576 K577 F583	C569-C573 VanDerWaalsContact O-CB 3.3Å; C569-C573 WeakPolarHBondContact O-CB 3.16Å; C569-C573 PolarHBondContact O-N 2.98Å; C569-C573 PolarHBondContact O-SG 3.25Å; Q570-C573 PolarHBondContact O-N 2.88Å; C573-L575 VanDerWaalsContact C-N 3.31Å; C573-L575 PolarHBondContact O-N 3.36Å; C573-L576 PolarHBondContact O-N 3.15Å; C573-K577 VanDerWaalsContact O-CB 3.27Å; C573-K577 WeakPolarHBondContact O-CB 3.37Å; C573-K577 PolarHBondContact O-N 3.03Å; C573-F583 HydrophobicContact CB-CE1 4.39Å; C573-F583 HydrophobicContact CB-CZ 3.78Å
574	K	93.4	Very high	92.9	Very high	161 Å²	161	52.1 Å²	52.1	70%	0.7	25%	0.247	S	C	*	.	H	α-helix	trans	-62.3	-35.7	176.8	-173.7	178.7	179.9	178.5	0	112.2	Q570 Y571 L572	Q570-K574 WeakPolarHBondContact O-CB 3.45Å; Q570-K574 PolarHBondContact O-N 2.65Å; Y571-K574 WeakPolarHBondContact O-CB 3.19Å; Y571-K574 PolarHBondContact O-N 2.91Å; L572-K574 VanDerWaalsContact C-N 3.34Å; L572-K574 PolarHBondContact O-N 2.71Å
575	L	94	Very high	93.1	Very high	32 Å²	32	46.7 Å²	46.7	17%	0.168	22%	0.222	C	C	.	.	H	α-helix	trans	-73.1	-49.2	172.2	-65.4	-177.5	0	0	0	112.1	L520 Y571 L572 C573 K577 K578	L520-L575 HydrophobicContact CD1-CB 3.69Å; L520-L575 HydrophobicContact CD1-CD1 4.08Å; L520-L575 HydrophobicContact CD2-CB 4.23Å; Y571-L575 HydrophobicContact CD1-CD1 4.18Å; Y571-L575 HydrophobicContact CE1-CD1 3.53Å; Y571-L575 HydrophobicContact CE1-CG 4.14Å; Y571-L575 PolarHBondContact O-N 3.02Å; L572-L575 PolarHBondContact O-N 2.87Å; C573-L575 VanDerWaalsContact C-N 3.31Å; C573-L575 PolarHBondContact O-N 3.36Å; L575-K577 VanDerWaalsContact C-N 3.32Å; L575-K577 PolarHBondContact O-N 3.41Å; L575-K578 VanDerWaalsContact O-CB 3.28Å; L575-K578 WeakPolarHBondContact O-CB 3.16Å; L575-K578 PolarHBondContact O-N 3.43Å
576	L	94.6	Very high	93.2	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-56.5	-43.9	-179.7	-72.7	163.9	0	0	0	112.1	L410 C516 F519 L520 L572 C573 K578 Y579 C580 F583	L410-L576 HydrophobicContact CD1-CD2 4.44Å; L410-L576 HydrophobicContact CG-CD1 4.16Å; L410-L576 HydrophobicContact CG-CD2 4.47Å; C516-L576 HydrophobicContact CB-CD1 4.09Å; C516-L576 HydrophobicContact CB-CD2 4.29Å; F519-L576 HydrophobicContact CD1-CD2 3.82Å; F519-L576 HydrophobicContact CE1-CD2 4.22Å; L520-L576 HydrophobicContact CD1-CD2 4.32Å; L520-L576 HydrophobicContact CD1-CG 4.35Å; L520-L576 HydrophobicContact CD2-CD2 4.27Å; L520-L576 HydrophobicContact CG-CD2 4.02Å; L572-L576 HydrophobicContact CD1-CD1 4.48Å; L572-L576 HydrophobicContact CG-CD1 4.01Å; L572-L576 WeakPolarHBondContact O-CB 3.35Å; L572-L576 VanDerWaalsContact O-CG 3.25Å; L572-L576 WeakPolarHBondContact O-CG 3.41Å; L572-L576 PolarHBondContact O-N 3.3Å; C573-L576 PolarHBondContact O-N 3.15Å; L576-K578 PolarHBondContact O-N 3.16Å; L576-K578 VanDerWaalsContact O-N 3.13Å; L576-Y579 PolarHBondContact O-N 3.47Å; L576-C580 WeakPolarHBondContact O-CB 3.44Å; L576-C580 PolarHBondContact O-N 3.42Å; L576-F583 HydrophobicContact CB-CD2 3.95Å; L576-F583 HydrophobicContact CB-CE2 3.67Å; L576-F583 HydrophobicContact CD1-CE2 4.19Å
577	K	92.6	Very high	93.3	Very high	102 Å²	102	46.1 Å²	46.1	44%	0.443	22%	0.221	S	C	.	.	H	α-helix	trans	-60	-21.4	178.3	-176.5	164	177.7	157.1	0	114.1	C573 L575 F583 D584	C573-K577 VanDerWaalsContact O-CB 3.27Å; C573-K577 WeakPolarHBondContact O-CB 3.37Å; C573-K577 PolarHBondContact O-N 3.03Å; L575-K577 VanDerWaalsContact C-N 3.32Å; L575-K577 PolarHBondContact O-N 3.41Å; K577-F583 HydrophobicContact CB-CB 4.32Å; K577-F583 HydrophobicContact CB-CD1 3.94Å; K577-F583 HydrophobicContact CB-CE1 4.42Å; K577-F583 HydrophobicContact CB-CG 4.02Å; K577-F583 HydrophobicContact CD-CD1 4.13Å; K577-F583 HydrophobicContact CG-CB 4.38Å; K577-F583 HydrophobicContact CG-CD1 4.18Å; K577-F583 HydrophobicContact CG-CG 4.42Å; K577-D584 WeakPolarHBondContact CE-OD1 3.47Å; K577-D584 WeakPolarHBondContact CE-OD2 3.19Å; K577-D584 IonicContact NZ-OD1 2.86Å; K577-D584 PolarHBondContact NZ-OD1 3.29Å; K577-D584 IonicContact NZ-OD2 3.46Å; K577-D584 PolarHBondContact NZ-OD2 3.29Å
578	K	90	Very high	93.4	Very high	130 Å²	130	44.7 Å²	44.7	57%	0.565	21%	0.209	S	C	*	.	H	α-helix	trans	-75.1	-30	173.6	-173.9	-175.7	170.5	-156.2	0	112.8	L575 L576	L575-K578 VanDerWaalsContact O-CB 3.28Å; L575-K578 WeakPolarHBondContact O-CB 3.16Å; L575-K578 PolarHBondContact O-N 3.43Å; L576-K578 PolarHBondContact O-N 3.16Å; L576-K578 VanDerWaalsContact O-N 3.13Å
579	Y	88.5	Confident	93.6	Very high	63 Å²	63	43.9 Å²	43.9	25%	0.247	20%	0.203	C	C	.	.	H	α-helix	trans	-111.7	-11.8	-174	-65	-81.8	0	0	0	114.3	L520 K523 Y524 L576 P581	L520-Y579 HydrophobicContact CD2-CD2 3.79Å; L520-Y579 HydrophobicContact CD2-CE2 4.46Å; K523-Y579 HydrophobicContact CB-CD1 3.71Å; K523-Y579 HydrophobicContact CB-CE1 4.27Å; K523-Y579 HydrophobicContact CB-CG 3.95Å; K523-Y579 HydrophobicContact CG-CD1 4.38Å; K523-Y579 HydrophobicContact CG-CG 4.38Å; Y524-Y579 HydrophobicContact CE1-CE2 4.14Å; Y524-Y579 AromaticContact CE1-CZ 3.9Å; Y524-Y579 WeakPolarHBondContact CE1-OH 3.19Å; Y524-Y579 HydrophobicContact CE2-CE2 4.14Å; Y524-Y579 AromaticContact CZ-CE2 3.71Å; Y524-Y579 AromaticContact CZ-CZ 3.97Å; L576-Y579 PolarHBondContact O-N 3.47Å; Y579-P581 WeakPolarHBondContact O-CD 3.14Å
580	C	91.6	Very high	93.6	Very high	21 Å²	21	43.9 Å²	43.9	14%	0.142	20%	0.203	C	C	.	.			trans	-110.2	94.2	172	-63.4	0	0	0	0	109.8	F519 L576 Q582 F583	F519-C580 WeakPolarHBondContact CE1-SG 3.47Å; F519-C580 WeakPolarHBondContact CZ-SG 3.44Å; L576-C580 WeakPolarHBondContact O-CB 3.44Å; L576-C580 PolarHBondContact O-N 3.42Å; C580-Q582 PolarHBondContact O-N 2.75Å; C580-F583 HydrophobicContact CB-CB 4.01Å; C580-F583 HydrophobicContact CB-CD2 4.41Å; C580-F583 VanDerWaalsContact O-CB 3.28Å; C580-F583 WeakPolarHBondContact O-CB 3.42Å; C580-F583 PolarHBondContact O-N 2.66Å
581	P	90.8	Very high	93.8	Very high	21 Å²	21	40.2 Å²	40.2	14%	0.136	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-28	178.5	-29.3	37.8	0	0	0	114	D382 Y383 Y579 R775	D382-P581 HydrophobicContact CB-CB 4.17Å; D382-P581 HydrophobicContact CB-CG 4.02Å; D382-P581 WeakPolarHBondContact O-CB 3.5Å; Y383-P581 HydrophobicContact CD1-CB 3.79Å; Y383-P581 HydrophobicContact CD1-CG 4.16Å; Y383-P581 HydrophobicContact CD2-CG 4.35Å; Y383-P581 HydrophobicContact CE1-CB 3.85Å; Y383-P581 HydrophobicContact CE1-CG 3.84Å; Y383-P581 HydrophobicContact CE2-CG 4.05Å; Y383-P581 HydrophobicContact CG-CB 4.17Å; Y383-P581 HydrophobicContact CG-CG 4.39Å; Y579-P581 WeakPolarHBondContact O-CD 3.14Å; P581-R775 PolarHBondContact O-NH1 3.18Å
582	Q	94.9	Very high	93.9	Very high	6 Å²	6	34.4 Å²	34.4	3%	0.028	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	5	-177.1	-67.3	168.6	26.8	0	0	113.6	D382 F385 C580 D584 M585 D586 W777	D382-Q582 PolarHBondContact O-NE2 3.22Å; F385-Q582 PolarHBondContact O-NE2 3.09Å; F385-Q582 VanDerWaalsContact O-NE2 3.1Å; C580-Q582 PolarHBondContact O-N 2.75Å; Q582-D584 VanDerWaalsContact C-N 3.27Å; Q582-D584 PolarHBondContact O-N 2.82Å; Q582-M585 HydrophobicContact CB-CG 3.72Å; Q582-M585 HydrophobicContact CB-SD 3.92Å; Q582-M585 HydrophobicContact CG-CG 4.15Å; Q582-M585 HydrophobicContact CG-SD 3.72Å; Q582-M585 WeakPolarHBondContact O-CG 3.34Å; Q582-M585 PolarHBondContact O-N 3.25Å; Q582-M585 VanDerWaalsContact O-N 3.14Å; Q582-D586 WeakPolarHBondContact O-CB 3.45Å; Q582-D586 PolarHBondContact O-N 3.46Å; Q582-W777 HydrophobicContact CB-CH2 4.49Å; Q582-W777 HydrophobicContact CG-CH2 3.57Å; Q582-W777 HydrophobicContact CG-CZ3 3.74Å
583	F	94.5	Very high	93.9	Very high	16 Å²	16	34.6 Å²	34.6	7%	0.07	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.4	-41.4	-172.6	-174.6	-89.2	0	0	0	114.9	L410 K414 C573 L576 K577 C580	L410-F583 HydrophobicContact CD2-CD2 3.98Å; L410-F583 HydrophobicContact CD2-CE2 4.11Å; K414-F583 HydrophobicContact CD-CE1 4.33Å; K414-F583 HydrophobicContact CD-CZ 4.08Å; K414-F583 WeakPolarHBondContact CE-O 3.25Å; K414-F583 HydrophobicContact CG-CE1 4.14Å; K414-F583 HydrophobicContact CG-CE2 4.25Å; K414-F583 HydrophobicContact CG-CZ 3.61Å; K414-F583 PolarHBondContact NZ-O 3.03Å; C573-F583 HydrophobicContact CB-CE1 4.39Å; C573-F583 HydrophobicContact CB-CZ 3.78Å; L576-F583 HydrophobicContact CB-CD2 3.95Å; L576-F583 HydrophobicContact CB-CE2 3.67Å; L576-F583 HydrophobicContact CD1-CE2 4.19Å; K577-F583 HydrophobicContact CB-CB 4.32Å; K577-F583 HydrophobicContact CB-CD1 3.94Å; K577-F583 HydrophobicContact CB-CE1 4.42Å; K577-F583 HydrophobicContact CB-CG 4.02Å; K577-F583 HydrophobicContact CD-CD1 4.13Å; K577-F583 HydrophobicContact CG-CB 4.38Å; K577-F583 HydrophobicContact CG-CD1 4.18Å; K577-F583 HydrophobicContact CG-CG 4.42Å; C580-F583 HydrophobicContact CB-CB 4.01Å; C580-F583 HydrophobicContact CB-CD2 4.41Å; C580-F583 VanDerWaalsContact O-CB 3.28Å; C580-F583 WeakPolarHBondContact O-CB 3.42Å; C580-F583 PolarHBondContact O-N 2.66Å
584	D	91.5	Very high	93.7	Very high	28 Å²	28	33.9 Å²	33.9	15%	0.15	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-45.1	-178.9	-58.4	-46.5	0	0	0	112.4	K577 Q582 D586 G587 R637	K577-D584 WeakPolarHBondContact CE-OD1 3.47Å; K577-D584 WeakPolarHBondContact CE-OD2 3.19Å; K577-D584 IonicContact NZ-OD1 2.86Å; K577-D584 PolarHBondContact NZ-OD1 3.29Å; K577-D584 IonicContact NZ-OD2 3.46Å; K577-D584 PolarHBondContact NZ-OD2 3.29Å; Q582-D584 VanDerWaalsContact C-N 3.27Å; Q582-D584 PolarHBondContact O-N 2.82Å; D584-D586 PolarHBondContact O-N 2.8Å; D584-G587 PolarHBondContact O-N 3.19Å; D584-R637 WeakPolarHBondContact O-CD 3.37Å
585	M	94.4	Very high	93.4	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.005	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-22.5	-179.6	61.4	153.7	-85.2	0	0	113.7	P386 Q582 G587 K633 I635 E636 T770 W777	P386-M585 HydrophobicContact CB-CE 4.05Å; P386-M585 HydrophobicContact CB-SD 4.48Å; P386-M585 HydrophobicContact CG-CE 4.41Å; P386-M585 HydrophobicContact CG-SD 4.44Å; Q582-M585 HydrophobicContact CB-CG 3.72Å; Q582-M585 HydrophobicContact CB-SD 3.92Å; Q582-M585 HydrophobicContact CG-CG 4.15Å; Q582-M585 HydrophobicContact CG-SD 3.72Å; Q582-M585 WeakPolarHBondContact O-CG 3.34Å; Q582-M585 PolarHBondContact O-N 3.25Å; Q582-M585 VanDerWaalsContact O-N 3.14Å; M585-G587 PolarHBondContact O-N 3.4Å; M585-K633 HydrophobicContact CE-CB 4.32Å; M585-K633 HydrophobicContact CE-CG 3.9Å; M585-I635 HydrophobicContact CB-CG2 4.18Å; M585-I635 HydrophobicContact CE-CG1 3.83Å; M585-I635 HydrophobicContact SD-CG1 4.27Å; M585-E636 PolarHBondContact O-N 3.17Å; M585-T770 HydrophobicContact CB-CG2 3.7Å; M585-W777 HydrophobicContact CB-CZ2 4.49Å; M585-W777 HydrophobicContact CG-CH2 4.3Å; M585-W777 HydrophobicContact CG-CZ2 3.96Å; M585-W777 HydrophobicContact SD-CD2 3.89Å; M585-W777 HydrophobicContact SD-CE3 3.92Å; M585-W777 HydrophobicContact SD-CH2 3.75Å; M585-W777 HydrophobicContact SD-CZ2 3.7Å; M585-W777 HydrophobicContact SD-CZ3 3.85Å
586	D	94.4	Very high	92.7	Very high	4 Å²	4	25.3 Å²	25.3	2%	0.021	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-19.9	178.9	-82.5	2.5	0	0	0	113.7	R387 Q582 D584 V588 K633	R387-D586 IonicContact CZ-OD1 3.99Å; R387-D586 IonicContact CZ-OD2 3.86Å; R387-D586 VanDerWaalsContact NH1-CG 3.3Å; R387-D586 IonicContact NH1-OD1 3.7Å; R387-D586 PolarHBondContact NH1-OD1 3.17Å; R387-D586 IonicContact NH1-OD2 2.98Å; R387-D586 PolarHBondContact NH1-OD2 2.95Å; R387-D586 VanDerWaalsContact NH1-OD2 3.12Å; R387-D586 IonicContact NH2-OD1 2.73Å; R387-D586 IonicContact NH2-OD2 3.73Å; R387-D586 PolarHBondContact NH2-OD2 3.18Å; Q582-D586 WeakPolarHBondContact O-CB 3.45Å; Q582-D586 PolarHBondContact O-N 3.46Å; D584-D586 PolarHBondContact O-N 2.8Å; D586-V588 PolarHBondContact O-N 3.43Å; D586-K633 PolarHBondContact O-NZ 3.49Å; D586-K633 WeakPolarHBondContact OD1-CG 3.11Å
587	G	93.9	Very high	91.4	Very high	10 Å²	10	26 Å²	26	10%	0.103	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	-133.6	-176.3	0	0	0	0	0	112.4	K414 D584 M585 E636	K414-G587 VanDerWaalsContact CD-O 3.26Å; K414-G587 WeakPolarHBondContact CD-O 3.48Å; K414-G587 PolarHBondContact NZ-O 3.38Å; D584-G587 PolarHBondContact O-N 3.19Å; M585-G587 PolarHBondContact O-N 3.4Å; G587-E636 WeakPolarHBondContact CA-OE2 3.37Å
588	V	95.1	Very high	89.9	Confident	45 Å²	45	25.6 Å²	25.6	27%	0.273	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-142.2	-15.2	179.1	-64.4	0	0	0	0	113.5	S411 K414 M415 Y549 I553 D586 N590 E636	S411-V588 VanDerWaalsContact CB-O 3.32Å; S411-V588 WeakPolarHBondContact CB-O 3.42Å; S411-V588 PolarHBondContact OG-O 2.95Å; K414-V588 HydrophobicContact CB-CG1 4.01Å; K414-V588 HydrophobicContact CD-CG1 4.19Å; M415-V588 HydrophobicContact CG-CB 4.26Å; M415-V588 HydrophobicContact CG-CG1 4Å; M415-V588 HydrophobicContact SD-CB 4.38Å; Y549-V588 PolarHBondContact OH-O 2.86Å; I553-V588 WeakPolarHBondContact CD1-O 3.35Å; D586-V588 PolarHBondContact O-N 3.43Å; V588-N590 VanDerWaalsContact C-N 3.28Å; V588-N590 PolarHBondContact O-N 3.44Å; V588-E636 PolarHBondContact N-OE2 2.74Å
589	R	95.6	Very high	88.5	Confident	59 Å²	59	25.5 Å²	25.5	22%	0.223	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-11.4	-178.7	-70.4	-63.4	-57	-137.1	-5.3	113.1	Y549 V591 D609 E636 L679	Y549-R589 VanDerWaalsContact OH-C 3.3Å; Y549-R589 PolarHBondContact OH-O 3.19Å; R589-V591 VanDerWaalsContact C-N 3.28Å; R589-V591 HydrophobicContact CB-CG2 3.64Å; R589-V591 PolarHBondContact O-N 3.14Å; R589-D609 IonicContact CZ-OD2 2.95Å; R589-D609 IonicContact NE-OD2 3.31Å; R589-D609 IonicContact NH2-OD2 2.74Å; R589-D609 PolarHBondContact NH2-OD2 3.38Å; R589-D609 WeakPolarHBondContact O-CB 3.31Å; R589-E636 WeakPolarHBondContact CB-OE2 3.41Å; R589-E636 PolarHBondContact N-OE2 3.46Å; R589-L679 HydrophobicContact CG-CB 4.48Å; R589-L679 HydrophobicContact CG-CD1 4.06Å
590	N	97.2	Very high	87	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	14%	0.137	C	C	.	.			trans	53	44.7	-179.6	-163.5	8.7	0	0	0	112.4	F404 T407 A408 Y549 V588 W592 E636	F404-N590 WeakPolarHBondContact CE1-ND2 3.38Å; F404-N590 PolarHBondContact O-ND2 2.89Å; T407-N590 WeakPolarHBondContact CB-OD1 3.35Å; T407-N590 HydrophobicContact CG2-CB 4.28Å; T407-N590 VanDerWaalsContact CG2-OD1 3.23Å; T407-N590 WeakPolarHBondContact CG2-OD1 3.44Å; A408-N590 PolarHBondContact N-ND2 2.75Å; Y549-N590 HydrophobicContact CE1-CB 4.19Å; Y549-N590 WeakPolarHBondContact OH-CB 3.3Å; V588-N590 VanDerWaalsContact C-N 3.28Å; V588-N590 PolarHBondContact O-N 3.44Å; N590-W592 PolarHBondContact OD1-NE1 2.82Å; N590-E636 WeakPolarHBondContact CA-OE1 3.23Å; N590-E636 PolarHBondContact N-OE1 3.26Å
591	V	97.4	Very high	85.3	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.137	C	C	.	.			trans	-76.4	136	178.6	-170.9	0	0	0	0	109.9	R589 C607 D609 K633 Y634 E636 F682	R589-V591 VanDerWaalsContact C-N 3.28Å; R589-V591 HydrophobicContact CB-CG2 3.64Å; R589-V591 PolarHBondContact O-N 3.14Å; V591-C607 HydrophobicContact CG1-CB 4.03Å; V591-D609 HydrophobicContact CG2-CB 4.29Å; V591-K633 PolarHBondContact O-NZ 3.32Å; V591-Y634 HydrophobicContact CB-CD1 4.14Å; V591-Y634 HydrophobicContact CB-CG 4.35Å; V591-Y634 HydrophobicContact CG1-CD1 4.01Å; V591-Y634 HydrophobicContact CG1-CG 3.96Å; V591-Y634 VanDerWaalsContact O-CB 3.27Å; V591-Y634 WeakPolarHBondContact O-CB 3.37Å; V591-Y634 PolarHBondContact O-N 2.87Å; V591-E636 HydrophobicContact CB-CG 4.16Å; V591-E636 HydrophobicContact CG2-CG 4.03Å; V591-E636 PolarHBondContact N-OE1 3.48Å; V591-F682 HydrophobicContact CG1-CE1 3.8Å; V591-F682 HydrophobicContact CG1-CZ 3.89Å; V591-F682 HydrophobicContact CG2-CE1 4.07Å; V591-F682 HydrophobicContact CG2-CZ 3.86Å
592	W	97.3	Very high	83.8	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	148.1	172.7	-65.3	77	0	0	0	110	R387 F389 F400 D403 F404 N590 C607 H608 I614 V631 Q632 K633	R387-W592 HydrophobicContact CG-CH2 4.12Å; R387-W592 HydrophobicContact CG-CZ3 4.37Å; F389-W592 HydrophobicContact CD2-CH2 4.45Å; F389-W592 AromaticContact CD2-CZ3 3.99Å; F389-W592 HydrophobicContact CD2-CZ3 3.99Å; F389-W592 AromaticContact CE2-CH2 3.91Å; F389-W592 HydrophobicContact CE2-CH2 3.91Å; F389-W592 AromaticContact CE2-CZ3 3.87Å; F389-W592 HydrophobicContact CE2-CZ3 3.87Å; F400-W592 HydrophobicContact CD2-CD2 4.32Å; F400-W592 HydrophobicContact CD2-CE3 4.07Å; F400-W592 HydrophobicContact CD2-CH2 4.35Å; F400-W592 HydrophobicContact CD2-CZ3 4.1Å; F400-W592 AromaticContact CE2-CD2 3.67Å; F400-W592 HydrophobicContact CE2-CD2 3.67Å; F400-W592 AromaticContact CE2-CE2 3.95Å; F400-W592 AromaticContact CE2-CE3 3.83Å; F400-W592 HydrophobicContact CE2-CE3 3.83Å; F400-W592 HydrophobicContact CE2-CG 4.04Å; F400-W592 HydrophobicContact CE2-CZ2 4.39Å; F400-W592 HydrophobicContact CE2-CZ3 4.27Å; D403-W592 HydrophobicContact CB-CH2 4.32Å; D403-W592 WeakPolarHBondContact OD1-CH2 3.39Å; D403-W592 WeakPolarHBondContact OD1-CZ2 3.11Å; F404-W592 AromaticContact CD2-CD1 3.49Å; F404-W592 VanDerWaalsContact CD2-CD1 3.49Å; F404-W592 HydrophobicContact CD2-CG 4.42Å; F404-W592 AromaticContact CD2-NE1 3.36Å; F404-W592 AromaticContact CE2-CD1 3.59Å; F404-W592 AromaticContact CE2-NE1 3.81Å; N590-W592 PolarHBondContact OD1-NE1 2.82Å; W592-C607 WeakPolarHBondContact O-CA 3.23Å; W592-H608 PolarHBondContact N-O 3.17Å; W592-H608 PolarHBondContact O-N 3.45Å; W592-I614 HydrophobicContact CB-CD1 3.85Å; W592-I614 HydrophobicContact CG-CD1 4.28Å; W592-V631 HydrophobicContact CE3-CB 4.31Å; W592-Q632 VanDerWaalsContact CE3-C 3.46Å; W592-K633 HydrophobicContact CD2-CB 4.49Å; W592-K633 HydrophobicContact CD2-CD 4.11Å; W592-K633 HydrophobicContact CE3-CB 4.11Å; W592-K633 VanDerWaalsContact CE3-N 3.33Å; W592-K633 HydrophobicContact CH2-CB 4Å; W592-K633 HydrophobicContact CH2-CD 4.2Å; W592-K633 HydrophobicContact CZ2-CB 4.4Å; W592-K633 HydrophobicContact CZ2-CD 3.72Å; W592-K633 HydrophobicContact CZ3-CB 3.84Å
593	I	94.3	Very high	82.2	Confident	11 Å²	11	29 Å²	29	6%	0.056	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	109.5	179.9	-174	167	0	0	0	109.4	K595 I605 V606 Q632 Y634 L688	I593-K595 HydrophobicContact CG1-CG 4.27Å; I593-I605 HydrophobicContact CD1-CG2 3.54Å; I593-I605 HydrophobicContact CG1-CG2 3.46Å; I593-I605 VanDerWaalsContact CG1-CG2 3.46Å; I593-V606 CarbonylContact C-O 3.55Å; I593-V606 WeakPolarHBondContact CA-O 3.33Å; I593-Q632 HydrophobicContact CG2-CB 4.12Å; I593-Q632 VanDerWaalsContact CG2-O 3.28Å; I593-Q632 WeakPolarHBondContact CG2-O 3.36Å; I593-Q632 PolarHBondContact N-O 2.91Å; I593-Q632 PolarHBondContact O-N 3.4Å; I593-Q632 VanDerWaalsContact O-N 3.1Å; I593-Y634 HydrophobicContact CB-CD2 4.09Å; I593-Y634 HydrophobicContact CD1-CD2 4.12Å; I593-Y634 HydrophobicContact CD1-CE2 4.44Å; I593-Y634 HydrophobicContact CG2-CD2 4.24Å; I593-L688 HydrophobicContact CD1-CD2 4.3Å
594	V	91.8	Very high	81.3	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.006	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	129	177.7	-171.7	0	0	0	0	107.9	I605 V606 I614 I617 Y629 I630 V631	V594-I605 WeakPolarHBondContact O-CA 3.03Å; V594-V606 HydrophobicContact CB-CG2 3.83Å; V594-V606 HydrophobicContact CG2-CG2 4.11Å; V594-V606 PolarHBondContact N-O 3.24Å; V594-V606 PolarHBondContact O-N 2.84Å; V594-V606 VanDerWaalsContact O-N 3.17Å; V594-I614 HydrophobicContact CG2-CG1 4.28Å; V594-I614 HydrophobicContact CG2-CG2 4.35Å; V594-I617 HydrophobicContact CG1-CG2 4.39Å; V594-I617 HydrophobicContact CG2-CD1 4.26Å; V594-Y629 HydrophobicContact CG1-CD1 3.67Å; V594-Y629 HydrophobicContact CG1-CE1 4.18Å; V594-Y629 HydrophobicContact CG1-CG 4.49Å; V594-I630 WeakPolarHBondContact CA-O 3.44Å; V594-V631 HydrophobicContact CB-CG1 4.17Å; V594-V631 HydrophobicContact CG1-CG1 4.37Å; V594-V631 HydrophobicContact CG2-CG1 3.7Å
595	K	87	Confident	80.8	Confident	8 Å²	8	30.5 Å²	30.5	4%	0.035	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	123.6	-180	-48.9	178.1	-179.4	165.3	0	110.2	K363 I593 G597 I605 I630	K363-K595 HydrophobicContact CD-CD 4.24Å; I593-K595 HydrophobicContact CG1-CG 4.27Å; K595-G597 PolarHBondContact O-N 2.89Å; K595-I605 HydrophobicContact CB-CD1 4.33Å; K595-I605 HydrophobicContact CB-CG1 4.19Å; K595-I605 HydrophobicContact CD-CD1 4.05Å; K595-I605 HydrophobicContact CG-CD1 3.92Å; K595-I605 HydrophobicContact CG-CG1 4.01Å; K595-I605 HydrophobicContact CG-CG2 4.13Å; K595-I630 HydrophobicContact CB-CD1 4.14Å; K595-I630 HydrophobicContact CB-CG1 3.79Å; K595-I630 HydrophobicContact CD-CD1 4.24Å; K595-I630 HydrophobicContact CG-CD1 4.49Å; K595-I630 PolarHBondContact N-O 3.07Å; K595-I630 WeakPolarHBondContact O-CG1 3.39Å; K595-I630 PolarHBondContact O-N 3.03Å
596	P	80.4	Confident	80.4	Confident	6 Å²	6	33.2 Å²	33.2	4%	0.039	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	126.6	171.5	26.4	-34.7	0	0	0	110	A598 K599 R603 G604 Y629	P596-A598 PolarHBondContact O-N 3.22Å; P596-K599 HydrophobicContact CB-CB 4.38Å; P596-K599 HydrophobicContact CB-CD 4.21Å; P596-K599 HydrophobicContact CB-CG 4.15Å; P596-K599 HydrophobicContact CG-CB 3.86Å; P596-K599 HydrophobicContact CG-CD 3.99Å; P596-K599 HydrophobicContact CG-CG 4.05Å; P596-K599 PolarHBondContact O-N 3.4Å; P596-R603 WeakPolarHBondContact CG-O 3.49Å; P596-G604 VanDerWaalsContact CD-O 3.26Å; P596-G604 WeakPolarHBondContact CD-O 3.45Å; P596-Y629 HydrophobicContact CB-CD1 4.17Å; P596-Y629 HydrophobicContact CB-CE1 3.81Å; P596-Y629 HydrophobicContact CG-CE1 4.4Å
597	G	65.9	Low	80.3	Confident	13 Å²	13	33.5 Å²	33.5	13%	0.134	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-12.5	-167.1	0	0	0	0	0	116.6	K595 R628	K595-G597 PolarHBondContact O-N 2.89Å; G597-R628 VanDerWaalsContact CA-O 3.23Å; G597-R628 WeakPolarHBondContact CA-O 3.25Å; G597-R628 PolarHBondContact N-O 3.24Å
598	A	60.6	Low	80.2	Confident	94 Å²	94	35.2 Å²	35.2	78%	0.777	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-124.3	6.6	-176.7	0	0	0	0	0	114.6	P596	P596-A598 PolarHBondContact O-N 3.22Å
599	K	61.1	Low	80.2	Confident	128 Å²	128	34.7 Å²	34.7	56%	0.557	19%	0.194	S	C	*	.			trans	-108.5	135.5	176.3	-53.1	-177.3	-179.2	176.8	0	111.5	P596	P596-K599 HydrophobicContact CB-CB 4.38Å; P596-K599 HydrophobicContact CB-CD 4.21Å; P596-K599 HydrophobicContact CB-CG 4.15Å; P596-K599 HydrophobicContact CG-CB 3.86Å; P596-K599 HydrophobicContact CG-CD 3.99Å; P596-K599 HydrophobicContact CG-CG 4.05Å; P596-K599 PolarHBondContact O-N 3.4Å
600	S	57	Low	80.1	Confident	17 Å²	17	35.8 Å²	35.8	12%	0.119	20%	0.198	C	C	.	.			trans	-97.8	174.4	177.9	55.6	0	0	0	0	112.4	G292 D293 G602 R603	G292-S600 WeakPolarHBondContact O-CB 3.38Å; G292-S600 PolarHBondContact O-OG 2.86Å; D293-S600 WeakPolarHBondContact OD1-CB 3.34Å; S600-G602 PolarHBondContact O-N 3.12Å; S600-R603 WeakPolarHBondContact O-CB 3.49Å; S600-R603 WeakPolarHBondContact O-CG 3.31Å; S600-R603 PolarHBondContact O-N 3.46Å; S600-R603 PolarHBondContact O-NE 3.31Å; S600-R603 VanDerWaalsContact O-NE 3.11Å; S600-R603 PolarHBondContact OG-NH2 3.34Å
601	R	55.9	Low	80	Confident	38 Å²	38	36.2 Å²	36.2	14%	0.143	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.3	30.7	172.4	-51.2	126.5	174.6	-60.5	-46.5	115.3	D293 D295 D296 R603	D293-R601 PolarHBondContact O-NH2 3.3Å; D295-R601 VanDerWaalsContact N-NH2 3.15Å; D295-R601 IonicContact OD2-NE 2.73Å; D296-R601 IonicContact OD1-CZ 3.12Å; D296-R601 IonicContact OD1-NH1 2.66Å; D296-R601 PolarHBondContact OD1-NH1 3.33Å; D296-R601 IonicContact OD1-NH2 3.2Å; D296-R601 IonicContact OD2-CZ 3.11Å; D296-R601 IonicContact OD2-NH1 2.66Å; D296-R601 PolarHBondContact OD2-NH1 3.43Å; D296-R601 IonicContact OD2-NH2 3.88Å; D296-R601 PolarHBondContact OD2-NH2 2.83Å; R601-R603 HydrophobicContact CB-CG 4.38Å; R601-R603 PolarHBondContact O-N 3.15Å; R601-R603 VanDerWaalsContact O-N 3.08Å
602	G	58.9	Low	79.8	Confident	7 Å²	7	38.7 Å²	38.7	7%	0.072	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.6	0.5	-176.2	0	0	0	0	0	115.6	S600 G604 I605	S600-G602 PolarHBondContact O-N 3.12Å; G602-G604 PolarHBondContact O-N 3.34Å; G602-G604 VanDerWaalsContact O-N 3.1Å; G602-I605 WeakPolarHBondContact O-CB 3.26Å; G602-I605 PolarHBondContact O-N 3.26Å
603	R	62.8	Low	79.5	Confident	122 Å²	122	41.4 Å²	41.4	46%	0.46	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	112.6	-175.2	-67.6	-177.7	-72.2	-175.5	-8.5	111.8	D295 P596 S600 R601 I605	D295-R603 IonicContact OD2-NH1 3.85Å; D295-R603 IonicContact OD2-NH2 3.43Å; D295-R603 PolarHBondContact OD2-NH2 3.08Å; P596-R603 WeakPolarHBondContact CG-O 3.49Å; S600-R603 WeakPolarHBondContact O-CB 3.49Å; S600-R603 WeakPolarHBondContact O-CG 3.31Å; S600-R603 PolarHBondContact O-N 3.46Å; S600-R603 PolarHBondContact O-NE 3.31Å; S600-R603 VanDerWaalsContact O-NE 3.11Å; S600-R603 PolarHBondContact OG-NH2 3.34Å; R601-R603 HydrophobicContact CB-CG 4.38Å; R601-R603 PolarHBondContact O-N 3.15Å; R601-R603 VanDerWaalsContact O-N 3.08Å; R603-I605 VanDerWaalsContact C-N 3.32Å
604	G	74	Confident	79.3	Confident	49 Å²	49	40.9 Å²	40.9	51%	0.505	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.9	17.8	-178.9	0	0	0	0	0	114.2	P596 G602	P596-G604 VanDerWaalsContact CD-O 3.26Å; P596-G604 WeakPolarHBondContact CD-O 3.45Å; G602-G604 PolarHBondContact O-N 3.34Å; G602-G604 VanDerWaalsContact O-N 3.1Å
605	I	81	Confident	79.2	Confident	27 Å²	27	42.4 Å²	42.4	14%	0.138	23%	0.233	C	C	.	.			trans	-79.6	129.6	166	-63.7	-169.7	0	0	0	108.6	I593 V594 K595 G602 R603 L688	I593-I605 HydrophobicContact CD1-CG2 3.54Å; I593-I605 HydrophobicContact CG1-CG2 3.46Å; I593-I605 VanDerWaalsContact CG1-CG2 3.46Å; V594-I605 WeakPolarHBondContact O-CA 3.03Å; K595-I605 HydrophobicContact CB-CD1 4.33Å; K595-I605 HydrophobicContact CB-CG1 4.19Å; K595-I605 HydrophobicContact CD-CD1 4.05Å; K595-I605 HydrophobicContact CG-CD1 3.92Å; K595-I605 HydrophobicContact CG-CG1 4.01Å; K595-I605 HydrophobicContact CG-CG2 4.13Å; G602-I605 WeakPolarHBondContact O-CB 3.26Å; G602-I605 PolarHBondContact O-N 3.26Å; R603-I605 VanDerWaalsContact C-N 3.32Å; I605-L688 HydrophobicContact CB-CD1 4.34Å; I605-L688 HydrophobicContact CG2-CD1 4.43Å; I605-L688 HydrophobicContact CG2-CD2 4.11Å
606	V	86.2	Confident	79.1	Confident	58 Å²	58	47.8 Å²	47.8	35%	0.352	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	146.8	178.1	-64.9	0	0	0	0	111.3	I593 V594 I617	I593-V606 CarbonylContact C-O 3.55Å; I593-V606 WeakPolarHBondContact CA-O 3.33Å; V594-V606 HydrophobicContact CB-CG2 3.83Å; V594-V606 HydrophobicContact CG2-CG2 4.11Å; V594-V606 PolarHBondContact N-O 3.24Å; V594-V606 PolarHBondContact O-N 2.84Å; V594-V606 VanDerWaalsContact O-N 3.17Å; V606-I617 HydrophobicContact CG2-CD1 3.96Å
607	C	92.4	Very high	78.9	Confident	10 Å²	10	49.8 Å²	49.8	7%	0.068	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	136	173.4	-68.3	0	0	0	0	110.5	V591 W592 F682	V591-C607 HydrophobicContact CG1-CB 4.03Å; W592-C607 WeakPolarHBondContact O-CA 3.23Å; C607-F682 HydrophobicContact CB-CB 4.04Å; C607-F682 HydrophobicContact CB-CD1 3.76Å; C607-F682 HydrophobicContact CB-CD2 4.32Å; C607-F682 HydrophobicContact CB-CE1 4.31Å; C607-F682 HydrophobicContact CB-CG 3.79Å; C607-F682 WeakPolarHBondContact O-CD2 3.31Å
608	H	93.1	Very high	79	Confident	47 Å²	47	49.7 Å²	49.7	22%	0.218	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	144.2	176.4	-68.4	-45.6	0	0	0	111.4	W592 I614 I617	W592-H608 PolarHBondContact N-O 3.17Å; W592-H608 PolarHBondContact O-N 3.45Å; H608-I614 HydrophobicContact CB-CD1 4.16Å; H608-I614 HydrophobicContact CB-CG1 3.72Å; H608-I617 WeakPolarHBondContact NE2-CD1 3.4Å
609	D	93.7	Very high	79.4	Confident	33 Å²	33	51.5 Å²	51.5	18%	0.176	26%	0.256	C	S	.	.	S	Bend	trans	-109.1	7.6	175.5	60.4	-8.1	0	0	0	112.9	F404 Y550 R589 V591	F404-D609 WeakPolarHBondContact CZ-O 3.45Å; Y550-D609 VanDerWaalsContact CE1-O 3.22Å; Y550-D609 WeakPolarHBondContact CE1-O 3.14Å; R589-D609 IonicContact CZ-OD2 2.95Å; R589-D609 IonicContact NE-OD2 3.31Å; R589-D609 IonicContact NH2-OD2 2.74Å; R589-D609 PolarHBondContact NH2-OD2 3.38Å; R589-D609 WeakPolarHBondContact O-CB 3.31Å; V591-D609 HydrophobicContact CG2-CB 4.29Å
610	R	94.6	Very high	79.2	Confident	83 Å²	83	48.5 Å²	48.5	31%	0.313	26%	0.261	S	S	.	.			trans	-118.7	131.1	176.3	-66.7	-168.8	65.5	82.4	9.4	112.5	Y550 D612 N613 I614	Y550-R610 HydrophobicContact CE1-CG 4.23Å; Y550-R610 VanDerWaalsContact CG-NH1 3.34Å; R610-D612 IonicContact CZ-OD1 2.82Å; R610-D612 IonicContact CZ-OD2 3.89Å; R610-D612 VanDerWaalsContact CZ-OD2 3.25Å; R610-D612 IonicContact NE-OD1 3.27Å; R610-D612 IonicContact NE-OD2 2.73Å; R610-D612 PolarHBondContact NE-OD2 2.97Å; R610-D612 IonicContact NH2-OD1 3.48Å; R610-D612 PolarHBondContact NH2-OD1 3.32Å; R610-D612 IonicContact NH2-OD2 3.19Å; R610-D612 PolarHBondContact NH2-OD2 3.39Å; R610-N613 HydrophobicContact CB-CB 4.15Å; R610-N613 PolarHBondContact O-N 2.86Å; R610-I614 WeakPolarHBondContact O-CG1 3.5Å; R610-I614 PolarHBondContact O-N 3.17Å
611	L	94.8	Very high	79	Confident	8 Å²	8	48.6 Å²	48.6	4%	0.042	26%	0.262	C	S	.	.	H	α-helix	trans	-63.3	-47.4	179.7	-179	58.9	0	0	0	111.3	F400 I401 F404 L546 Y550 N613 I614 L615	F400-L611 HydrophobicContact CD1-CD1 4.39Å; F400-L611 HydrophobicContact CE1-CD1 3.51Å; F400-L611 HydrophobicContact CZ-CD1 3.75Å; I401-L611 HydrophobicContact CG1-CD1 4.23Å; I401-L611 HydrophobicContact CG2-CD2 4.34Å; F404-L611 HydrophobicContact CB-CD1 4.15Å; F404-L611 HydrophobicContact CD1-CB 3.87Å; F404-L611 HydrophobicContact CD1-CD1 4.42Å; F404-L611 HydrophobicContact CD1-CD2 4.29Å; F404-L611 HydrophobicContact CD1-CG 4.42Å; F404-L611 HydrophobicContact CD2-CB 4.36Å; F404-L611 HydrophobicContact CD2-CD1 4.22Å; F404-L611 HydrophobicContact CE1-CB 3.85Å; F404-L611 HydrophobicContact CE2-CB 4.32Å; F404-L611 HydrophobicContact CG-CB 4.17Å; F404-L611 HydrophobicContact CG-CD1 3.99Å; F404-L611 HydrophobicContact CG-CG 4.48Å; F404-L611 HydrophobicContact CZ-CB 4.09Å; L546-L611 HydrophobicContact CD1-CB 4.45Å; L546-L611 HydrophobicContact CD1-CD2 3.81Å; Y550-L611 PolarHBondContact OH-N 2.87Å; L611-N613 VanDerWaalsContact C-N 3.28Å; L611-N613 PolarHBondContact O-N 2.62Å; L611-I614 PolarHBondContact O-N 3.29Å; L611-I614 VanDerWaalsContact O-N 3.11Å; L611-L615 HydrophobicContact CD1-CD1 4.05Å; L611-L615 HydrophobicContact CD1-CG 4.09Å; L611-L615 HydrophobicContact CG-CD1 3.9Å; L611-L615 HydrophobicContact CG-CG 4.33Å; L611-L615 WeakPolarHBondContact O-CG 3.2Å; L611-L615 PolarHBondContact O-N 2.85Å
612	D	92.3	Very high	78.6	Confident	53 Å²	53	51.9 Å²	51.9	28%	0.283	29%	0.286	S	S	.	.	H	α-helix	trans	-58.9	-33.2	178.1	27.9	-67.8	0	0	0	113.3	R610 K616	R610-D612 IonicContact CZ-OD1 2.82Å; R610-D612 IonicContact CZ-OD2 3.89Å; R610-D612 VanDerWaalsContact CZ-OD2 3.25Å; R610-D612 IonicContact NE-OD1 3.27Å; R610-D612 IonicContact NE-OD2 2.73Å; R610-D612 PolarHBondContact NE-OD2 2.97Å; R610-D612 IonicContact NH2-OD1 3.48Å; R610-D612 PolarHBondContact NH2-OD1 3.32Å; R610-D612 IonicContact NH2-OD2 3.19Å; R610-D612 PolarHBondContact NH2-OD2 3.39Å; D612-K616 WeakPolarHBondContact O-CB 3.3Å; D612-K616 WeakPolarHBondContact O-CD 3.45Å; D612-K616 WeakPolarHBondContact O-CG 3.33Å; D612-K616 PolarHBondContact O-N 3.49Å; D612-K616 VanDerWaalsContact O-N 3.07Å
613	N	90.9	Very high	77.8	Confident	56 Å²	56	61 Å²	61	30%	0.299	32%	0.324	S	S	.	.	H	α-helix	trans	-72.5	-39.7	174.7	-71.7	-6.9	0	0	0	112	R610 L611 K616 I617	R610-N613 HydrophobicContact CB-CB 4.15Å; R610-N613 PolarHBondContact O-N 2.86Å; L611-N613 VanDerWaalsContact C-N 3.28Å; L611-N613 PolarHBondContact O-N 2.62Å; N613-K616 PolarHBondContact O-N 3.2Å; N613-I617 PolarHBondContact O-N 3.24Å
614	I	91.1	Very high	76.8	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-65.2	-44.4	176.8	-64.9	163.4	0	0	0	110.6	I391 F400 F404 W592 V594 H608 R610 L611 I617 V631	I391-I614 HydrophobicContact CD1-CG2 4.06Å; F400-I614 HydrophobicContact CE1-CB 4.42Å; F400-I614 HydrophobicContact CE1-CG2 3.65Å; F400-I614 HydrophobicContact CZ-CB 4.27Å; F400-I614 HydrophobicContact CZ-CD1 3.86Å; F400-I614 HydrophobicContact CZ-CG2 3.67Å; F404-I614 HydrophobicContact CD2-CD1 4.44Å; F404-I614 HydrophobicContact CE2-CD1 4.17Å; W592-I614 HydrophobicContact CB-CD1 3.85Å; W592-I614 HydrophobicContact CG-CD1 4.28Å; V594-I614 HydrophobicContact CG2-CG1 4.28Å; V594-I614 HydrophobicContact CG2-CG2 4.35Å; H608-I614 HydrophobicContact CB-CD1 4.16Å; H608-I614 HydrophobicContact CB-CG1 3.72Å; R610-I614 WeakPolarHBondContact O-CG1 3.5Å; R610-I614 PolarHBondContact O-N 3.17Å; L611-I614 PolarHBondContact O-N 3.29Å; L611-I614 VanDerWaalsContact O-N 3.11Å; I614-I617 PolarHBondContact O-N 3.04Å; I614-V631 HydrophobicContact CG2-CG1 3.76Å
615	L	89.1	Confident	75.3	Confident	33 Å²	33	65.4 Å²	65.4	17%	0.173	35%	0.351	C	S	.	.	H	α-helix	trans	-68.2	-34.7	179.1	-65.2	177.8	0	0	0	112.5	R397 F400 I401 L611 I617 V618 Q619	R397-L615 HydrophobicContact CG-CD2 4.35Å; F400-L615 HydrophobicContact CE1-CD2 4.35Å; I401-L615 HydrophobicContact CD1-CD1 4.23Å; I401-L615 HydrophobicContact CD1-CD2 4.24Å; I401-L615 HydrophobicContact CG1-CD1 4.3Å; I401-L615 HydrophobicContact CG1-CD2 4.28Å; L611-L615 HydrophobicContact CD1-CD1 4.05Å; L611-L615 HydrophobicContact CD1-CG 4.09Å; L611-L615 HydrophobicContact CG-CD1 3.9Å; L611-L615 HydrophobicContact CG-CG 4.33Å; L611-L615 WeakPolarHBondContact O-CG 3.2Å; L611-L615 PolarHBondContact O-N 2.85Å; L615-I617 VanDerWaalsContact C-N 3.34Å; L615-I617 PolarHBondContact O-N 2.96Å; L615-V618 PolarHBondContact O-N 2.81Å; L615-V618 VanDerWaalsContact O-N 3.14Å; L615-Q619 WeakPolarHBondContact O-CG 3.45Å; L615-Q619 PolarHBondContact O-N 2.82Å
616	K	84.9	Confident	73.7	Confident	122 Å²	122	70.7 Å²	70.7	53%	0.53	37%	0.374	S	S	.	.	H	α-helix	trans	-59.7	-38.9	173.9	-80.1	165.9	-172.3	171	0	113.3	D612 N613 V618 Q619 G620	D612-K616 WeakPolarHBondContact O-CB 3.3Å; D612-K616 WeakPolarHBondContact O-CD 3.45Å; D612-K616 WeakPolarHBondContact O-CG 3.33Å; D612-K616 PolarHBondContact O-N 3.49Å; D612-K616 VanDerWaalsContact O-N 3.07Å; N613-K616 PolarHBondContact O-N 3.2Å; K616-V618 VanDerWaalsContact C-N 3.26Å; K616-V618 PolarHBondContact O-N 3.37Å; K616-Q619 PolarHBondContact O-N 2.97Å; K616-G620 PolarHBondContact O-N 3.27Å
617	I	77.4	Confident	72.2	Confident	47 Å²	47	69.7 Å²	69.7	24%	0.241	37%	0.37	C	S	.	.	H	α-helix	trans	-60.1	-39.8	175.8	-67.7	166.1	0	0	0	110.7	V594 V606 H608 N613 I614 L615 S621 Y629	V594-I617 HydrophobicContact CG1-CG2 4.39Å; V594-I617 HydrophobicContact CG2-CD1 4.26Å; V606-I617 HydrophobicContact CG2-CD1 3.96Å; H608-I617 WeakPolarHBondContact NE2-CD1 3.4Å; N613-I617 PolarHBondContact O-N 3.24Å; I614-I617 PolarHBondContact O-N 3.04Å; L615-I617 VanDerWaalsContact C-N 3.34Å; L615-I617 PolarHBondContact O-N 2.96Å; I617-S621 PolarHBondContact O-N 3.44Å; I617-Y629 HydrophobicContact CG2-CE1 4.22Å; I617-Y629 HydrophobicContact CG2-CE2 4.37Å
618	V	68.3	Low	71.3	Confident	12 Å²	12	76.8 Å²	76.8	7%	0.073	40%	0.396	C	S	.	.	H	α-helix	trans	-72	-46.8	178	-175.5	0	0	0	0	110.9	I391 L615 K616 G620 S621 V622	I391-V618 HydrophobicContact CB-CG1 4.39Å; I391-V618 HydrophobicContact CB-CG2 3.78Å; I391-V618 HydrophobicContact CD1-CG2 3.53Å; I391-V618 HydrophobicContact CG1-CG2 4.27Å; I391-V618 HydrophobicContact CG2-CG1 4.21Å; I391-V618 HydrophobicContact CG2-CG2 3.79Å; L615-V618 PolarHBondContact O-N 2.81Å; L615-V618 VanDerWaalsContact O-N 3.14Å; K616-V618 VanDerWaalsContact C-N 3.26Å; K616-V618 PolarHBondContact O-N 3.37Å; V618-G620 PolarHBondContact O-N 2.92Å; V618-S621 WeakPolarHBondContact O-CA 3.39Å; V618-S621 WeakPolarHBondContact O-CB 3.36Å; V618-S621 PolarHBondContact O-N 3.32Å; V618-S621 PolarHBondContact O-OG 3.35Å; V618-V622 PolarHBondContact O-N 3.17Å
619	Q	67.4	Low	70.8	Confident	131 Å²	131	76.7 Å²	76.7	61%	0.612	39%	0.394	S	S	*	.	H	α-helix	trans	-61.2	-40.9	179.7	-72.7	172.8	-15.5	0	0	112.4	L615 K616 S621 V622	L615-Q619 WeakPolarHBondContact O-CG 3.45Å; L615-Q619 PolarHBondContact O-N 2.82Å; K616-Q619 PolarHBondContact O-N 2.97Å; Q619-S621 PolarHBondContact O-N 3.03Å; Q619-V622 WeakPolarHBondContact O-CG2 3.24Å; Q619-V622 PolarHBondContact O-N 3.29Å
620	G	57.4	Low	70.7	Confident	65 Å²	65	75.2 Å²	75.2	67%	0.67	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-18.2	173	0	0	0	0	0	114.1	K616 V618	K616-G620 PolarHBondContact O-N 3.27Å; V618-G620 PolarHBondContact O-N 2.92Å
621	S	53.4	Low	70.6	Confident	20 Å²	20	71.2 Å²	71.2	14%	0.14	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-6.7	178.5	74.8	0	0	0	0	114.6	I617 V618 Q619 F623 L624	I617-S621 PolarHBondContact O-N 3.44Å; V618-S621 WeakPolarHBondContact O-CA 3.39Å; V618-S621 WeakPolarHBondContact O-CB 3.36Å; V618-S621 PolarHBondContact O-N 3.32Å; V618-S621 PolarHBondContact O-OG 3.35Å; Q619-S621 PolarHBondContact O-N 3.03Å; S621-F623 PolarHBondContact O-N 3.35Å; S621-F623 VanDerWaalsContact O-N 3.12Å; S621-L624 PolarHBondContact O-N 3.07Å; S621-L624 VanDerWaalsContact O-O 3.13Å
622	V	46.4	Very low	70.7	Confident	106 Å²	106	71 Å²	71	64%	0.642	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-26.2	-173	174.1	0	0	0	0	113.6	V618 Q619	V618-V622 PolarHBondContact O-N 3.17Å; Q619-V622 WeakPolarHBondContact O-CG2 3.24Å; Q619-V622 PolarHBondContact O-N 3.29Å
623	F	41.7	Very low	71	Confident	199 Å²	199	68.6 Å²	68.6	87%	0.873	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-0.4	176.1	-68.3	-78.9	0	0	0	114.6	S621	S621-F623 PolarHBondContact O-N 3.35Å; S621-F623 VanDerWaalsContact O-N 3.12Å
624	L	43.4	Very low	71.3	Confident	114 Å²	114	66.2 Å²	66.2	60%	0.597	34%	0.343	S	S	*	.			trans	-120.9	111.5	177.9	-66.2	176.3	0	0	0	110.6	S621 E626	S621-L624 PolarHBondContact O-N 3.07Å; S621-L624 VanDerWaalsContact O-O 3.13Å; L624-E626 PolarHBondContact O-N 2.98Å
625	T	42.8	Very low	71.6	Confident	150 Å²	150	66.4 Å²	66.4	92%	0.92	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	2.3	-177.4	44.1	0	0	0	0	115.3
626	E	47	Very low	72	Confident	137 Å²	137	65.2 Å²	65.2	64%	0.64	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.4	-7.7	-158.2	-55.3	-168.5	136.1	0	0	115.2	L624	L624-E626 PolarHBondContact O-N 2.98Å
627	S	53.8	Low	72.5	Confident	38 Å²	38	64.8 Å²	64.8	27%	0.266	33%	0.333	S	S	.	.			trans	-124.7	81.7	-169.4	63.2	0	0	0	0	115.1	Y629	S627-Y629 WeakPolarHBondContact O-CD2 3.4Å; S627-Y629 PolarHBondContact O-N 3.42Å; S627-Y629 WeakPolarHBondContact OG-CE2 3.06Å
628	R	74.3	Confident	73.4	Confident	158 Å²	158	62.8 Å²	62.8	60%	0.596	32%	0.323	S	S	*	.			trans	-66.7	95.3	163.8	-65.9	-176.3	-173.1	149.6	5.1	109.9	V364 G597	V364-R628 HydrophobicContact CG2-CB 4.32Å; G597-R628 VanDerWaalsContact CA-O 3.23Å; G597-R628 WeakPolarHBondContact CA-O 3.25Å; G597-R628 PolarHBondContact N-O 3.24Å
629	Y	82.7	Confident	74.8	Confident	45 Å²	45	62.8 Å²	62.8	18%	0.176	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	143.8	172.8	-80.1	-85.6	0	0	0	111.9	I391 V594 P596 I617 S627	I391-Y629 PolarHBondContact N-O 3.08Å; V594-Y629 HydrophobicContact CG1-CD1 3.67Å; V594-Y629 HydrophobicContact CG1-CE1 4.18Å; V594-Y629 HydrophobicContact CG1-CG 4.49Å; P596-Y629 HydrophobicContact CB-CD1 4.17Å; P596-Y629 HydrophobicContact CB-CE1 3.81Å; P596-Y629 HydrophobicContact CG-CE1 4.4Å; I617-Y629 HydrophobicContact CG2-CE1 4.22Å; I617-Y629 HydrophobicContact CG2-CE2 4.37Å; S627-Y629 WeakPolarHBondContact O-CD2 3.4Å; S627-Y629 PolarHBondContact O-N 3.42Å; S627-Y629 WeakPolarHBondContact OG-CE2 3.06Å
630	I	90.4	Very high	76.3	Confident	2 Å²	2	59.2 Å²	59.2	1%	0.01	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	155.4	160.3	64.5	149.5	0	0	0	110.8	K363 V364 C388 F389 I390 V594 K595	K363-I630 HydrophobicContact CB-CD1 3.77Å; K363-I630 HydrophobicContact CB-CG1 4.15Å; K363-I630 HydrophobicContact CD-CD1 4.25Å; K363-I630 HydrophobicContact CG-CD1 4.34Å; V364-I630 HydrophobicContact CG2-CG2 3.89Å; C388-I630 WeakPolarHBondContact SG-CD1 3.27Å; F389-I630 CarbonylContact O-C 3.59Å; F389-I630 WeakPolarHBondContact O-CA 3.46Å; F389-I630 WeakPolarHBondContact O-CB 3.41Å; I390-I630 HydrophobicContact CG1-CG2 3.96Å; V594-I630 WeakPolarHBondContact CA-O 3.44Å; K595-I630 HydrophobicContact CB-CD1 4.14Å; K595-I630 HydrophobicContact CB-CG1 3.79Å; K595-I630 HydrophobicContact CD-CD1 4.24Å; K595-I630 HydrophobicContact CG-CD1 4.49Å; K595-I630 PolarHBondContact N-O 3.07Å; K595-I630 WeakPolarHBondContact O-CG1 3.39Å; K595-I630 PolarHBondContact O-N 3.03Å
631	V	94	Very high	78.1	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	139.4	155.4	-84.6	0	0	0	0	110	C388 F389 I391 F400 W592 V594 I614	C388-V631 CarbonylContact C-O 3.57Å; C388-V631 VanDerWaalsContact CA-O 3.29Å; C388-V631 WeakPolarHBondContact CA-O 3.35Å; F389-V631 HydrophobicContact CB-CG2 4.18Å; F389-V631 PolarHBondContact N-O 3.35Å; F389-V631 PolarHBondContact O-N 3.3Å; I391-V631 HydrophobicContact CD1-CB 4.2Å; I391-V631 HydrophobicContact CD1-CG1 3.7Å; I391-V631 HydrophobicContact CD1-CG2 3.69Å; I391-V631 HydrophobicContact CG1-CG2 3.73Å; F400-V631 HydrophobicContact CB-CG2 4.45Å; F400-V631 HydrophobicContact CD1-CG2 4.17Å; F400-V631 HydrophobicContact CD2-CG2 3.58Å; F400-V631 HydrophobicContact CE1-CG2 4.39Å; F400-V631 HydrophobicContact CE2-CB 4.49Å; F400-V631 HydrophobicContact CE2-CG2 3.85Å; F400-V631 HydrophobicContact CG-CG2 3.77Å; F400-V631 HydrophobicContact CZ-CG2 4.26Å; W592-V631 HydrophobicContact CE3-CB 4.31Å; V594-V631 HydrophobicContact CB-CG1 4.17Å; V594-V631 HydrophobicContact CG1-CG1 4.37Å; V594-V631 HydrophobicContact CG2-CG1 3.7Å; I614-V631 HydrophobicContact CG2-CG1 3.76Å
632	Q	96.1	Very high	80.2	Confident	3 Å²	3	58 Å²	58	1%	0.014	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	143.2	174.7	-177.8	170.7	43.1	0	0	108.5	P386 R387 C388 W592 I593 Y634	P386-Q632 HydrophobicContact CB-CG 3.8Å; P386-Q632 WeakPolarHBondContact O-CG 3.37Å; P386-Q632 PolarHBondContact O-NE2 2.98Å; R387-Q632 CarbonylContact O-C 3.58Å; R387-Q632 WeakPolarHBondContact O-CA 3.48Å; C388-Q632 HydrophobicContact CB-CB 4.31Å; C388-Q632 HydrophobicContact CB-CG 4.27Å; W592-Q632 VanDerWaalsContact CE3-C 3.46Å; I593-Q632 HydrophobicContact CG2-CB 4.12Å; I593-Q632 VanDerWaalsContact CG2-O 3.28Å; I593-Q632 WeakPolarHBondContact CG2-O 3.36Å; I593-Q632 PolarHBondContact N-O 2.91Å; I593-Q632 PolarHBondContact O-N 3.4Å; I593-Q632 VanDerWaalsContact O-N 3.1Å; Q632-Y634 PolarHBondContact O-N 3.23Å
633	K	97.6	Very high	82.6	Confident	2 Å²	2	58.7 Å²	58.7	1%	0.009	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	128.9	175.5	-178.7	69.9	-174.2	76	0	109	R387 M585 D586 V591 W592 E636	R387-K633 HydrophobicContact CG-CB 4.06Å; R387-K633 PolarHBondContact O-N 3.42Å; M585-K633 HydrophobicContact CE-CB 4.32Å; M585-K633 HydrophobicContact CE-CG 3.9Å; D586-K633 PolarHBondContact O-NZ 3.49Å; D586-K633 WeakPolarHBondContact OD1-CG 3.11Å; V591-K633 PolarHBondContact O-NZ 3.32Å; W592-K633 HydrophobicContact CD2-CB 4.49Å; W592-K633 HydrophobicContact CD2-CD 4.11Å; W592-K633 HydrophobicContact CE3-CB 4.11Å; W592-K633 VanDerWaalsContact CE3-N 3.33Å; W592-K633 HydrophobicContact CH2-CB 4Å; W592-K633 HydrophobicContact CH2-CD 4.2Å; W592-K633 HydrophobicContact CZ2-CB 4.4Å; W592-K633 HydrophobicContact CZ2-CD 3.72Å; W592-K633 HydrophobicContact CZ3-CB 3.84Å; K633-E636 IonicContact NZ-OE1 3.1Å; K633-E636 PolarHBondContact NZ-OE1 2.87Å
634	Y	97.7	Very high	85.3	Confident	7 Å²	7	49.2 Å²	49.2	3%	0.027	23%	0.233	C	C	.	.			trans	-77.1	139.5	176.3	-175.8	-94.9	0	0	0	110.2	V591 I593 Q632 E636 K645 F677 L679 H687	V591-Y634 HydrophobicContact CB-CD1 4.14Å; V591-Y634 HydrophobicContact CB-CG 4.35Å; V591-Y634 HydrophobicContact CG1-CD1 4.01Å; V591-Y634 HydrophobicContact CG1-CG 3.96Å; V591-Y634 VanDerWaalsContact O-CB 3.27Å; V591-Y634 WeakPolarHBondContact O-CB 3.37Å; V591-Y634 PolarHBondContact O-N 2.87Å; I593-Y634 HydrophobicContact CB-CD2 4.09Å; I593-Y634 HydrophobicContact CD1-CD2 4.12Å; I593-Y634 HydrophobicContact CD1-CE2 4.44Å; I593-Y634 HydrophobicContact CG2-CD2 4.24Å; Q632-Y634 PolarHBondContact O-N 3.23Å; Y634-E636 HydrophobicContact CD1-CG 4.19Å; Y634-E636 PolarHBondContact O-N 2.93Å; Y634-K645 PolarHBondContact OH-NZ 3.47Å; Y634-F677 HydrophobicContact CE1-CE2 4.44Å; Y634-F677 HydrophobicContact CE1-CZ 4.2Å; Y634-F677 WeakPolarHBondContact OH-CE2 3.3Å; Y634-L679 HydrophobicContact CD1-CD2 4.43Å; Y634-L679 HydrophobicContact CE1-CD2 4.01Å; Y634-H687 AromaticContact CE1-ND1 4Å; Y634-H687 AromaticContact CE2-ND1 3.91Å; Y634-H687 AromaticContact CZ-ND1 3.36Å; Y634-H687 PolarHBondContact OH-ND1 3.5Å
635	I	97.3	Very high	87.9	Confident	4 Å²	4	44.2 Å²	44.2	2%	0.021	21%	0.206	C	C	.	.			trans	-78.6	97.7	176.3	-54.8	-169.4	0	0	0	107.9	P386 M585 R637 P638 L768 T770 W777 I779	P386-I635 HydrophobicContact CG-CD1 3.97Å; P386-I635 HydrophobicContact CG-CG1 4.15Å; M585-I635 HydrophobicContact CB-CG2 4.18Å; M585-I635 HydrophobicContact CE-CG1 3.83Å; M585-I635 HydrophobicContact SD-CG1 4.27Å; I635-R637 VanDerWaalsContact C-N 3.33Å; I635-P638 HydrophobicContact CG2-CB 4.36Å; I635-L768 HydrophobicContact CB-CD1 4.5Å; I635-L768 HydrophobicContact CD1-CB 3.9Å; I635-L768 HydrophobicContact CD1-CD1 3.81Å; I635-L768 HydrophobicContact CD1-CG 4.49Å; I635-L768 HydrophobicContact CG1-CD1 4.38Å; I635-T770 HydrophobicContact CG2-CG2 4.19Å; I635-W777 HydrophobicContact CD1-CB 3.56Å; I635-W777 HydrophobicContact CD1-CD2 4.48Å; I635-W777 HydrophobicContact CD1-CG 3.69Å; I635-I779 HydrophobicContact CD1-CD1 4.04Å
636	E	97.2	Very high	90.5	Very high	8 Å²	8	37.2 Å²	37.2	4%	0.037	16%	0.163	C	C	.	.	S	Bend	trans	-75.5	-23.8	-177.5	-75.8	173.9	-141.4	0	0	112.9	M585 G587 V588 R589 N590 V591 K633 Y634 P638 L679	M585-E636 PolarHBondContact O-N 3.17Å; G587-E636 WeakPolarHBondContact CA-OE2 3.37Å; V588-E636 PolarHBondContact N-OE2 2.74Å; R589-E636 WeakPolarHBondContact CB-OE2 3.41Å; R589-E636 PolarHBondContact N-OE2 3.46Å; N590-E636 WeakPolarHBondContact CA-OE1 3.23Å; N590-E636 PolarHBondContact N-OE1 3.26Å; V591-E636 HydrophobicContact CB-CG 4.16Å; V591-E636 HydrophobicContact CG2-CG 4.03Å; V591-E636 PolarHBondContact N-OE1 3.48Å; K633-E636 IonicContact NZ-OE1 3.1Å; K633-E636 PolarHBondContact NZ-OE1 2.87Å; Y634-E636 HydrophobicContact CD1-CG 4.19Å; Y634-E636 PolarHBondContact O-N 2.93Å; E636-P638 VanDerWaalsContact O-CD 3.26Å; E636-P638 WeakPolarHBondContact O-CD 3.5Å; E636-L679 HydrophobicContact CB-CD1 4Å; E636-L679 HydrophobicContact CG-CD1 4.08Å; E636-L679 HydrophobicContact CG-CD2 4.34Å
637	R	96	Very high	92.9	Very high	112 Å²	112	31.3 Å²	31.3	42%	0.423	14%	0.136	S	C	.	.	S	Bend	trans	-117.9	62	179.5	-57.2	-167.6	66.2	146.6	4.6	112.4	D584 I635 T770 D771 N772	D584-R637 WeakPolarHBondContact O-CD 3.37Å; I635-R637 VanDerWaalsContact C-N 3.33Å; R637-T770 WeakPolarHBondContact O-CA 3.29Å; R637-D771 WeakPolarHBondContact CB-OD1 3.33Å; R637-D771 IonicContact CZ-OD2 2.66Å; R637-D771 VanDerWaalsContact CZ-OD2 3.28Å; R637-D771 IonicContact NE-OD1 2.99Å; R637-D771 IonicContact NE-OD2 3.79Å; R637-D771 PolarHBondContact NE-OD2 3.08Å; R637-D771 IonicContact NH2-OD2 2.75Å; R637-D771 PolarHBondContact NH2-OD2 2.65Å; R637-D771 PolarHBondContact O-N 2.96Å; R637-N772 VanDerWaalsContact CZ-ND2 3.29Å; R637-N772 PolarHBondContact NE-ND2 3.33Å; R637-N772 PolarHBondContact NH2-ND2 3.31Å; R637-N772 VanDerWaalsContact NH2-ND2 3.18Å
638	P	97.2	Very high	95	Very high	5 Å²	5	29.5 Å²	29.5	3%	0.032	12%	0.123	C	C	.	.	B	Isolated β-bridge	trans	-66.9	154.2	173.7	32.6	-34.7	0	0	0	110	I635 E636 L640 K645 F677 L769	I635-P638 HydrophobicContact CG2-CB 4.36Å; E636-P638 VanDerWaalsContact O-CD 3.26Å; E636-P638 WeakPolarHBondContact O-CD 3.5Å; P638-L640 HydrophobicContact CG-CD2 3.92Å; P638-L640 PolarHBondContact O-N 3.02Å; P638-K645 HydrophobicContact CG-CG 4.49Å; P638-F677 HydrophobicContact CG-CD1 4.17Å; P638-F677 HydrophobicContact CG-CE1 3.79Å; P638-F677 HydrophobicContact CG-CE2 4.22Å; P638-F677 HydrophobicContact CG-CZ 3.82Å; P638-L769 CarbonylContact C-O 3.48Å; P638-L769 VanDerWaalsContact CA-O 3.3Å; P638-L769 WeakPolarHBondContact CA-O 3.48Å
639	L	97.4	Very high	96.1	Very high	12 Å²	12	22.7 Å²	22.7	6%	0.063	10%	0.097	C	C	.	.			trans	-63.3	129.2	164.2	-177.2	62.7	0	0	0	108.6	F646 F717 W720 L769 Y774	L639-F646 HydrophobicContact CB-CE1 4.28Å; L639-F646 HydrophobicContact CD2-CE1 4.35Å; L639-F646 HydrophobicContact CD2-CZ 4.12Å; L639-F646 HydrophobicContact CG-CE1 4.16Å; L639-F646 HydrophobicContact CG-CZ 4.42Å; L639-F646 WeakPolarHBondContact O-CE1 3.49Å; L639-F717 HydrophobicContact CD2-CE2 4.49Å; L639-F717 HydrophobicContact CD2-CZ 4.36Å; L639-W720 HydrophobicContact CD1-CH2 4.3Å; L639-W720 HydrophobicContact CD2-CZ3 4.35Å; L639-L769 HydrophobicContact CB-CB 3.82Å; L639-L769 HydrophobicContact CD2-CB 3.98Å; L639-L769 HydrophobicContact CD2-CD2 4.17Å; L639-L769 PolarHBondContact N-O 3.44Å; L639-Y774 HydrophobicContact CD1-CD1 4.33Å; L639-Y774 HydrophobicContact CD1-CE1 3.92Å; L639-Y774 HydrophobicContact CD2-CD1 3.72Å; L639-Y774 HydrophobicContact CD2-CE1 3.84Å
640	L	97.5	Very high	96.9	Very high	56 Å²	56	20.5 Å²	20.5	29%	0.293	9%	0.089	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	130.2	-179.2	-60.1	178	0	0	0	110.2	P638 K645 F677	P638-L640 HydrophobicContact CG-CD2 3.92Å; P638-L640 PolarHBondContact O-N 3.02Å; L640-K645 HydrophobicContact CD2-CB 4.16Å; L640-F677 HydrophobicContact CD1-CB 4.02Å; L640-F677 HydrophobicContact CD1-CD1 3.93Å; L640-F677 HydrophobicContact CD1-CG 4.37Å; L640-F677 HydrophobicContact CD2-CB 3.53Å; L640-F677 HydrophobicContact CD2-CD1 3.91Å; L640-F677 HydrophobicContact CD2-CG 3.76Å; L640-F677 HydrophobicContact CG-CB 4.44Å; L640-F677 HydrophobicContact CG-CD1 4.46Å
641	I	97.3	Very high	97.3	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	116.8	171.6	-66.4	167.6	0	0	0	106.2	K643 T644 F646 L670 F672 L706 W712 F717 W720	I641-K643 VanDerWaalsContact C-N 3.3Å; I641-K643 PolarHBondContact O-N 2.98Å; I641-T644 PolarHBondContact N-O 3.43Å; I641-T644 WeakPolarHBondContact O-CB 3.27Å; I641-T644 PolarHBondContact O-N 2.98Å; I641-F646 HydrophobicContact CB-CD1 4.41Å; I641-F646 HydrophobicContact CD1-CD1 3.67Å; I641-F646 HydrophobicContact CD1-CD2 4.45Å; I641-F646 HydrophobicContact CD1-CE1 3.42Å; I641-F646 VanDerWaalsContact CD1-CE1 3.42Å; I641-F646 HydrophobicContact CD1-CE2 4.23Å; I641-F646 HydrophobicContact CD1-CG 4.18Å; I641-F646 HydrophobicContact CD1-CZ 3.71Å; I641-F646 HydrophobicContact CG1-CD1 3.93Å; I641-F646 HydrophobicContact CG1-CE1 3.63Å; I641-F646 HydrophobicContact CG1-CZ 4.32Å; I641-L670 HydrophobicContact CD1-CD2 3.89Å; I641-F672 HydrophobicContact CB-CE1 4Å; I641-F672 HydrophobicContact CD1-CE1 4.03Å; I641-F672 HydrophobicContact CD1-CZ 4.22Å; I641-F672 HydrophobicContact CG2-CE1 4.16Å; I641-F672 HydrophobicContact CG2-CZ 4.49Å; I641-L706 HydrophobicContact CG2-CD2 4.05Å; I641-W712 HydrophobicContact CD1-CE3 4.28Å; I641-W712 HydrophobicContact CD1-CZ3 3.95Å; I641-W712 HydrophobicContact CG2-CH2 3.66Å; I641-W712 HydrophobicContact CG2-CZ3 3.7Å; I641-F717 HydrophobicContact CD1-CD2 3.83Å; I641-F717 HydrophobicContact CD1-CE2 3.93Å; I641-W720 HydrophobicContact CD1-CD2 4.47Å; I641-W720 HydrophobicContact CD1-CE3 4.32Å; I641-W720 HydrophobicContact CG1-CD2 4.11Å; I641-W720 HydrophobicContact CG1-CE3 4.13Å; I641-W720 HydrophobicContact CG1-CH2 3.96Å; I641-W720 HydrophobicContact CG1-CZ2 3.94Å; I641-W720 HydrophobicContact CG1-CZ3 4.06Å
642	Y	96.9	Very high	97.5	Very high	59 Å²	59	20.4 Å²	20.4	23%	0.231	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	46.5	53	-172.3	-45.5	-58.1	0	0	0	112.2	T644 K705 L706 W712 W720	Y642-T644 PolarHBondContact O-N 2.98Å; Y642-T644 PolarHBondContact O-OG1 2.89Å; Y642-K705 HydrophobicContact CD2-CB 3.86Å; Y642-K705 HydrophobicContact CE1-CB 4.43Å; Y642-K705 HydrophobicContact CE1-CD 3.88Å; Y642-K705 HydrophobicContact CE2-CB 3.42Å; Y642-K705 VanDerWaalsContact CE2-CB 3.42Å; Y642-K705 HydrophobicContact CE2-CD 4.23Å; Y642-K705 HydrophobicContact CE2-CG 4.47Å; Y642-L706 HydrophobicContact CD2-CD2 3.82Å; Y642-L706 HydrophobicContact CD2-CG 3.9Å; Y642-L706 HydrophobicContact CE2-CD2 4.48Å; Y642-W712 AromaticContact CE2-CH2 3.82Å; Y642-W712 HydrophobicContact CE2-CH2 3.82Å; Y642-W712 HydrophobicContact CE2-CZ2 4.04Å; Y642-W720 AromaticContact CZ-CD1 3.9Å; Y642-W720 AromaticContact CZ-NE1 3.91Å
643	K	96.9	Very high	97.6	Very high	122 Å²	122	20.3 Å²	20.3	53%	0.53	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	0.1	-173	-54.9	162.3	171.8	177.5	0	116.6	I641 E676 F677	I641-K643 VanDerWaalsContact C-N 3.3Å; I641-K643 PolarHBondContact O-N 2.98Å; K643-E676 HydrophobicContact CB-CB 4.47Å; K643-E676 HydrophobicContact CB-CG 4.38Å; K643-E676 HydrophobicContact CD-CG 4.35Å; K643-E676 WeakPolarHBondContact CD-OE1 3.41Å; K643-E676 WeakPolarHBondContact CD-OE2 3.45Å; K643-E676 IonicContact NZ-OE1 2.94Å; K643-E676 PolarHBondContact NZ-OE1 3.33Å; K643-E676 IonicContact NZ-OE2 3.21Å; K643-E676 PolarHBondContact NZ-OE2 3.19Å; K643-F677 VanDerWaalsContact O-CB 3.29Å; K643-F677 WeakPolarHBondContact O-CB 3.36Å; K643-F677 PolarHBondContact O-N 3.09Å
644	T	97.9	Very high	97.6	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	134.6	-175.8	-58	0	0	0	0	109.7	I641 Y642 F672 C673 L706	I641-T644 PolarHBondContact N-O 3.43Å; I641-T644 WeakPolarHBondContact O-CB 3.27Å; I641-T644 PolarHBondContact O-N 2.98Å; Y642-T644 PolarHBondContact O-N 2.98Å; Y642-T644 PolarHBondContact O-OG1 2.89Å; T644-F672 HydrophobicContact CG2-CB 4.23Å; T644-F672 HydrophobicContact CG2-CD1 4.26Å; T644-C673 HydrophobicContact CG2-CB 4.25Å; T644-C673 WeakPolarHBondContact CG2-O 3.5Å; T644-L706 HydrophobicContact CG2-CD1 3.94Å; T644-L706 WeakPolarHBondContact OG1-CD1 3.19Å
645	K	97.9	Very high	97.5	Very high	9 Å²	9	21.5 Å²	21.5	4%	0.039	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	141.3	175.4	-178	-175.1	174.1	-175.1	0	109.7	Y634 P638 L640 C673 F677 H687	Y634-K645 PolarHBondContact OH-NZ 3.47Å; P638-K645 HydrophobicContact CG-CG 4.49Å; L640-K645 HydrophobicContact CD2-CB 4.16Å; K645-C673 PolarHBondContact O-N 3.25Å; K645-F677 HydrophobicContact CB-CB 4.34Å; K645-F677 HydrophobicContact CB-CD2 3.95Å; K645-F677 HydrophobicContact CB-CG 4.39Å; K645-F677 HydrophobicContact CD-CD2 4.12Å; K645-F677 HydrophobicContact CD-CE2 4.16Å; K645-F677 HydrophobicContact CG-CD2 4.49Å; K645-H687 PolarHBondContact NZ-O 3.31Å
646	F	97.9	Very high	97.3	Very high	2 Å²	2	22.7 Å²	22.7	1%	0.009	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	163.8	173.9	74.2	-81.2	0	0	0	111.4	L639 I641 I648 L670 R671 F672 F717 L768 L769	L639-F646 HydrophobicContact CB-CE1 4.28Å; L639-F646 HydrophobicContact CD2-CE1 4.35Å; L639-F646 HydrophobicContact CD2-CZ 4.12Å; L639-F646 HydrophobicContact CG-CE1 4.16Å; L639-F646 HydrophobicContact CG-CZ 4.42Å; L639-F646 WeakPolarHBondContact O-CE1 3.49Å; I641-F646 HydrophobicContact CB-CD1 4.41Å; I641-F646 HydrophobicContact CD1-CD1 3.67Å; I641-F646 HydrophobicContact CD1-CD2 4.45Å; I641-F646 HydrophobicContact CD1-CE1 3.42Å; I641-F646 VanDerWaalsContact CD1-CE1 3.42Å; I641-F646 HydrophobicContact CD1-CE2 4.23Å; I641-F646 HydrophobicContact CD1-CG 4.18Å; I641-F646 HydrophobicContact CD1-CZ 3.71Å; I641-F646 HydrophobicContact CG1-CD1 3.93Å; I641-F646 HydrophobicContact CG1-CE1 3.63Å; I641-F646 HydrophobicContact CG1-CZ 4.32Å; F646-I648 HydrophobicContact CD2-CG1 4.46Å; F646-I648 HydrophobicContact CE2-CD1 4.46Å; F646-I648 HydrophobicContact CE2-CG1 4.09Å; F646-L670 HydrophobicContact CD2-CB 4.21Å; F646-L670 HydrophobicContact CD2-CD2 3.51Å; F646-L670 HydrophobicContact CD2-CG 3.66Å; F646-L670 HydrophobicContact CE2-CD2 3.56Å; F646-L670 HydrophobicContact CE2-CG 3.89Å; F646-L670 HydrophobicContact CG-CD2 4.26Å; F646-L670 HydrophobicContact CZ-CD2 4.36Å; F646-R671 CarbonylContact C-O 3.57Å; F646-R671 WeakPolarHBondContact CA-O 3.48Å; F646-R671 WeakPolarHBondContact CB-O 3.48Å; F646-F672 HydrophobicContact CB-CD1 3.56Å; F646-F672 HydrophobicContact CB-CE1 3.67Å; F646-F672 HydrophobicContact CB-CG 4.3Å; F646-F672 HydrophobicContact CB-CZ 4.5Å; F646-F672 HydrophobicContact CD1-CE1 4.41Å; F646-F672 HydrophobicContact CG-CD1 4.48Å; F646-F672 HydrophobicContact CG-CE1 4.13Å; F646-F717 HydrophobicContact CE2-CE2 4.43Å; F646-F717 AromaticContact CZ-CE2 3.97Å; F646-F717 HydrophobicContact CZ-CE2 3.97Å; F646-F717 HydrophobicContact CZ-CZ 4.18Å; F646-L768 WeakPolarHBondContact O-CD2 3.25Å; F646-L769 HydrophobicContact CE2-CD1 4.24Å; F646-L769 HydrophobicContact CZ-CD1 4.26Å
647	D	97.8	Very high	97.1	Very high	13 Å²	13	23.1 Å²	23.1	7%	0.07	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	169.6	162.5	69.9	17.8	0	0	0	111.7	L670 R671 C689 F767 L768	D647-L670 CarbonylContact O-C 3.51Å; D647-L670 WeakPolarHBondContact O-CA 3.31Å; D647-R671 PolarHBondContact N-O 2.83Å; D647-R671 PolarHBondContact O-N 3.5Å; D647-R671 IonicContact OD1-CZ 3.41Å; D647-R671 IonicContact OD1-NE 2.85Å; D647-R671 PolarHBondContact OD1-NE 2.67Å; D647-R671 IonicContact OD1-NH2 3.14Å; D647-R671 PolarHBondContact OD1-NH2 2.75Å; D647-R671 IonicContact OD2-CZ 3.75Å; D647-R671 IonicContact OD2-NE 3.62Å; D647-R671 IonicContact OD2-NH2 2.61Å; D647-R671 PolarHBondContact OD2-NH2 3.28Å; D647-C689 HydrophobicContact CB-CB 4.23Å; D647-C689 VanDerWaalsContact CG-CB 3.49Å; D647-C689 WeakPolarHBondContact OD2-CB 3.43Å; D647-F767 CarbonylContact C-O 3.48Å; D647-F767 WeakPolarHBondContact CA-O 3.47Å; D647-F767 WeakPolarHBondContact CB-O 3.41Å; D647-L768 HydrophobicContact CB-CD2 3.67Å; D647-L768 HydrophobicContact CB-CG 4.37Å
648	I	97.9	Very high	96.7	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	124.5	178.9	-56.1	178.7	0	0	0	109.8	F646 C668 L670 F717 W730 M738 D766 F767 L769	F646-I648 HydrophobicContact CD2-CG1 4.46Å; F646-I648 HydrophobicContact CE2-CD1 4.46Å; F646-I648 HydrophobicContact CE2-CG1 4.09Å; I648-C668 HydrophobicContact CG2-CB 4.02Å; I648-L670 HydrophobicContact CD1-CD1 4.42Å; I648-L670 HydrophobicContact CG1-CD1 4.02Å; I648-L670 HydrophobicContact CG1-CG 4.05Å; I648-F717 HydrophobicContact CD1-CE1 4.24Å; I648-W730 HydrophobicContact CD1-CZ3 4.03Å; I648-M738 HydrophobicContact CG2-CE 3.88Å; I648-D766 WeakPolarHBondContact O-CA 3.42Å; I648-F767 HydrophobicContact CB-CB 4.44Å; I648-F767 PolarHBondContact N-O 2.95Å; I648-F767 PolarHBondContact O-N 3.41Å; I648-L769 HydrophobicContact CD1-CD1 3.67Å; I648-L769 HydrophobicContact CG1-CD1 4.36Å
649	R	97.5	Very high	96.4	Very high	15 Å²	15	19.8 Å²	19.8	6%	0.057	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	111.5	169.8	168.4	54.3	61.7	76.5	-7.5	110	C668 Y669 R671 D766 N782	R649-C668 WeakPolarHBondContact O-CA 3.36Å; R649-C668 WeakPolarHBondContact O-CB 3.37Å; R649-Y669 HydrophobicContact CB-CD1 4.28Å; R649-Y669 HydrophobicContact CB-CD2 4.29Å; R649-Y669 HydrophobicContact CB-CE1 3.96Å; R649-Y669 HydrophobicContact CB-CE2 3.96Å; R649-Y669 HydrophobicContact CB-CG 4.45Å; R649-Y669 HydrophobicContact CG-CD1 4.19Å; R649-Y669 HydrophobicContact CG-CE1 3.5Å; R649-Y669 VanDerWaalsContact CG-CE1 3.5Å; R649-Y669 HydrophobicContact CG-CE2 4.21Å; R649-Y669 PolarHBondContact N-O 3.1Å; R649-Y669 PolarHBondContact O-N 2.96Å; R649-R671 VanDerWaalsContact CZ-NH1 3.31Å; R649-D766 IonicContact CZ-OD1 2.7Å; R649-D766 VanDerWaalsContact CZ-OD1 3.27Å; R649-D766 IonicContact CZ-OD2 2.63Å; R649-D766 IonicContact NE-OD1 2.96Å; R649-D766 PolarHBondContact NE-OD1 2.89Å; R649-D766 IonicContact NE-OD2 3.27Å; R649-D766 PolarHBondContact NE-OD2 2.61Å; R649-D766 VanDerWaalsContact NH2-CG 3.29Å; R649-D766 IonicContact NH2-OD1 2.84Å; R649-D766 PolarHBondContact NH2-OD1 3.11Å; R649-D766 IonicContact NH2-OD2 2.88Å; R649-D766 PolarHBondContact NH2-OD2 3.03Å; R649-N782 PolarHBondContact NH2-ND2 3.39Å; R649-N782 VanDerWaalsContact NH2-ND2 3.13Å
650	Q	98.1	Very high	96.2	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	125.5	-178.6	174	62.1	71	0	0	111.5	W664 Y665 C668 M738 G764 A765 F767	Q650-W664 VanDerWaalsContact CD-CE2 3.44Å; Q650-W664 HydrophobicContact CG-CE3 4.42Å; Q650-W664 HydrophobicContact CG-CH2 3.4Å; Q650-W664 VanDerWaalsContact CG-CH2 3.4Å; Q650-W664 HydrophobicContact CG-CZ2 3.49Å; Q650-W664 VanDerWaalsContact CG-CZ2 3.49Å; Q650-W664 HydrophobicContact CG-CZ3 3.89Å; Q650-Y665 PolarHBondContact NE2-O 3.31Å; Q650-C668 HydrophobicContact CB-CB 4.29Å; Q650-M738 HydrophobicContact CB-CE 3.79Å; Q650-M738 HydrophobicContact CG-CE 4.02Å; Q650-G764 CarbonylContact O-C 3.14Å; Q650-G764 WeakPolarHBondContact O-CA 3.41Å; Q650-A765 PolarHBondContact N-O 3.44Å; Q650-A765 PolarHBondContact O-N 2.81Å; Q650-F767 HydrophobicContact CB-CD2 4.36Å; Q650-F767 HydrophobicContact CB-CE2 4.31Å
651	W	98.4	Very high	96.2	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	144.9	175.3	-67.6	-74.2	0	0	0	113.3	Y665 Y669 L762 Y763 M787 Y797 T798 V801	W651-Y665 HydrophobicContact CE3-CD1 4.02Å; W651-Y665 PolarHBondContact O-N 3.43Å; W651-Y669 AromaticContact CH2-CD1 3.74Å; W651-Y669 HydrophobicContact CH2-CD1 3.74Å; W651-Y669 AromaticContact CH2-CE1 3.48Å; W651-Y669 HydrophobicContact CH2-CE1 3.48Å; W651-Y669 VanDerWaalsContact CH2-CE1 3.48Å; W651-Y669 HydrophobicContact CZ2-CD1 4.39Å; W651-Y669 AromaticContact CZ2-CE1 3.69Å; W651-Y669 HydrophobicContact CZ2-CE1 3.69Å; W651-Y669 AromaticContact CZ3-CD1 3.99Å; W651-Y669 HydrophobicContact CZ3-CD1 3.99Å; W651-Y669 HydrophobicContact CZ3-CE1 4.11Å; W651-L762 HydrophobicContact CB-CD1 4.33Å; W651-Y763 WeakPolarHBondContact CA-O 3.45Å; W651-M787 HydrophobicContact CZ2-SD 4.28Å; W651-Y797 HydrophobicContact CZ3-CD2 4.43Å; W651-Y797 HydrophobicContact CZ3-CG 4.45Å; W651-T798 HydrophobicContact CH2-CG2 4.39Å; W651-T798 HydrophobicContact CZ2-CG2 4.07Å; W651-V801 HydrophobicContact CB-CG2 4.24Å; W651-V801 HydrophobicContact CD2-CG1 4.28Å; W651-V801 HydrophobicContact CD2-CG2 4.31Å; W651-V801 HydrophobicContact CG-CG2 4.2Å; W651-V801 HydrophobicContact CH2-CG1 4.49Å; W651-V801 HydrophobicContact CZ2-CG1 4.17Å
652	F	98.5	Very high	96.2	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	152.3	167.1	69.7	-86.2	0	0	0	111.2	I654 V662 W663 V742 L746 Y763 A765 I781	F652-I654 HydrophobicContact CD2-CG1 4.18Å; F652-I654 HydrophobicContact CE2-CD1 4.07Å; F652-I654 HydrophobicContact CE2-CG1 4.03Å; F652-V662 HydrophobicContact CD2-CG1 4.25Å; F652-W663 CarbonylContact C-O 3.55Å; F652-W663 VanDerWaalsContact CA-O 3.31Å; F652-W663 WeakPolarHBondContact CA-O 3.31Å; F652-W663 WeakPolarHBondContact CB-O 3.42Å; F652-V742 HydrophobicContact CD1-CG1 3.91Å; F652-V742 HydrophobicContact CD1-CG2 4.34Å; F652-V742 HydrophobicContact CD2-CG1 3.91Å; F652-V742 HydrophobicContact CE1-CG1 3.84Å; F652-V742 HydrophobicContact CE1-CG2 4.34Å; F652-V742 HydrophobicContact CE2-CG1 3.83Å; F652-V742 HydrophobicContact CG-CG1 3.94Å; F652-V742 HydrophobicContact CZ-CG1 3.78Å; F652-L746 HydrophobicContact CD2-CD1 4.17Å; F652-L746 HydrophobicContact CE2-CD1 3.78Å; F652-L746 HydrophobicContact CE2-CD2 4.14Å; F652-L746 HydrophobicContact CE2-CG 4.43Å; F652-Y763 HydrophobicContact CD2-CD2 4.31Å; F652-Y763 AromaticContact CE2-CD2 3.75Å; F652-Y763 HydrophobicContact CE2-CD2 3.75Å; F652-Y763 AromaticContact CE2-CG 3.99Å; F652-Y763 HydrophobicContact CE2-CG 3.99Å; F652-Y763 VanDerWaalsContact CZ-CB 3.41Å; F652-Y763 HydrophobicContact CZ-CD2 4.16Å; F652-Y763 AromaticContact CZ-CG 3.91Å; F652-Y763 HydrophobicContact CZ-CG 3.91Å; F652-Y763 PolarHBondContact N-O 3.33Å; F652-Y763 PolarHBondContact O-N 3.35Å; F652-A765 HydrophobicContact CD1-CB 4.33Å; F652-A765 HydrophobicContact CE1-CB 3.98Å; F652-I781 HydrophobicContact CE1-CD1 4.47Å; F652-I781 HydrophobicContact CE1-CG2 3.9Å; F652-I781 HydrophobicContact CZ-CD1 4.17Å; F652-I781 HydrophobicContact CZ-CG2 3.7Å
653	L	98.2	Very high	96.3	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	122.6	-171.3	166.2	65	0	0	0	110.1	T655 W663 F760 G761 L762 T805 V808 V809 F823	L653-T655 HydrophobicContact CD1-CG2 4.31Å; L653-T655 HydrophobicContact CD2-CG2 4.17Å; L653-T655 HydrophobicContact CG-CG2 3.94Å; L653-W663 HydrophobicContact CB-CB 4.21Å; L653-W663 PolarHBondContact N-O 2.9Å; L653-W663 PolarHBondContact O-N 3.46Å; L653-F760 HydrophobicContact CD1-CB 4.23Å; L653-F760 HydrophobicContact CD1-CD2 3.64Å; L653-F760 HydrophobicContact CD1-CE2 4.47Å; L653-F760 HydrophobicContact CD1-CG 4.35Å; L653-G761 WeakPolarHBondContact CA-O 3.39Å; L653-L762 HydrophobicContact CB-CD1 4.22Å; L653-T805 HydrophobicContact CD1-CG2 4.23Å; L653-T805 HydrophobicContact CD2-CG2 4.15Å; L653-V808 HydrophobicContact CD2-CB 3.91Å; L653-V808 HydrophobicContact CD2-CG1 3.76Å; L653-V808 HydrophobicContact CD2-CG2 4.35Å; L653-V809 HydrophobicContact CD2-CG1 4.31Å; L653-F823 HydrophobicContact CB-CD1 4.3Å; L653-F823 HydrophobicContact CB-CE1 3.53Å; L653-F823 HydrophobicContact CB-CZ 3.79Å; L653-F823 HydrophobicContact CD2-CD2 4.44Å; L653-F823 HydrophobicContact CD2-CE1 4.15Å; L653-F823 HydrophobicContact CD2-CE2 4.06Å; L653-F823 HydrophobicContact CD2-CZ 3.9Å; L653-F823 HydrophobicContact CG-CZ 4.49Å
654	I	97.7	Very high	96.4	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.054	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	114	174.2	-50.8	178.4	0	0	0	108.8	H355 F360 F652 D656 W657 L660 L746 F760 G761 Y763	H355-I654 PolarHBondContact NE2-O 2.7Å; F360-I654 HydrophobicContact CZ-CD1 3.96Å; F652-I654 HydrophobicContact CD2-CG1 4.18Å; F652-I654 HydrophobicContact CE2-CD1 4.07Å; F652-I654 HydrophobicContact CE2-CG1 4.03Å; I654-D656 WeakPolarHBondContact CG2-O 3.32Å; I654-W657 HydrophobicContact CD1-CH2 3.86Å; I654-W657 HydrophobicContact CD1-CZ2 3.36Å; I654-W657 HydrophobicContact CG2-CD2 4.39Å; I654-W657 HydrophobicContact CG2-CZ2 4.17Å; I654-L660 HydrophobicContact CG2-CD1 4.25Å; I654-L746 HydrophobicContact CD1-CD1 3.84Å; I654-L746 HydrophobicContact CD1-CD2 3.56Å; I654-L746 HydrophobicContact CD1-CG 4.31Å; I654-L746 HydrophobicContact CG1-CD1 4.13Å; I654-F760 CarbonylContact O-C 3.6Å; I654-F760 WeakPolarHBondContact O-CA 3.42Å; I654-F760 WeakPolarHBondContact O-CB 3.31Å; I654-G761 PolarHBondContact N-O 2.98Å; I654-G761 PolarHBondContact O-N 2.68Å; I654-Y763 HydrophobicContact CB-CE2 4.18Å; I654-Y763 HydrophobicContact CD1-CD2 4.07Å; I654-Y763 HydrophobicContact CD1-CE2 3.58Å; I654-Y763 HydrophobicContact CG1-CD2 4.05Å; I654-Y763 HydrophobicContact CG1-CE2 3.8Å
655	T	96.2	Very high	96.4	Very high	35 Å²	35	9.5 Å²	9.5	22%	0.215	5%	0.054	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	-13.9	-178.8	56.4	0	0	0	0	114.4	L653 T661 W663 V808 V809	L653-T655 HydrophobicContact CD1-CG2 4.31Å; L653-T655 HydrophobicContact CD2-CG2 4.17Å; L653-T655 HydrophobicContact CG-CG2 3.94Å; T655-T661 PolarHBondContact N-O 3.01Å; T655-T661 VanDerWaalsContact N-O 3.08Å; T655-T661 WeakPolarHBondContact OG1-CG2 3.16Å; T655-W663 PolarHBondContact OG1-NE1 3.06Å; T655-V808 HydrophobicContact CG2-CG1 3.88Å; T655-V809 HydrophobicContact CG2-CG1 4.04Å
656	D	93.6	Very high	96.4	Very high	29 Å²	29	12.6 Å²	12.6	16%	0.155	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	149.7	-179.4	-156.8	-25	0	0	0	110	I654 A658 P659 L660 T661 K757	I654-D656 WeakPolarHBondContact CG2-O 3.32Å; D656-A658 PolarHBondContact OD1-N 3.17Å; D656-P659 CarbonylContact C-O 3.47Å; D656-P659 WeakPolarHBondContact CB-O 3.44Å; D656-L660 WeakPolarHBondContact O-CA 3.17Å; D656-T661 PolarHBondContact O-N 2.92Å; D656-K757 IonicContact OD1-NZ 3.37Å; D656-K757 PolarHBondContact OD1-NZ 3.19Å; D656-K757 IonicContact OD2-NZ 2.64Å; D656-K757 PolarHBondContact OD2-NZ 2.98Å
657	W	92.3	Very high	96.3	Very high	16 Å²	16	12.6 Å²	12.6	6%	0.061	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	-10.2	175.3	-78	101.8	0	0	0	113.3	H355 F360 I654 P659 L660 L746 Q750 I753 P755	H355-W657 AromaticContact CD2-NE1 3.7Å; H355-W657 AromaticContact CE1-CD1 3.42Å; H355-W657 VanDerWaalsContact CE1-CD1 3.42Å; H355-W657 AromaticContact CE1-NE1 3.41Å; H355-W657 PolarHBondContact CE1-NE1 2.94Å; H355-W657 AromaticContact CG-NE1 3.54Å; H355-W657 AromaticContact ND1-CD1 3.35Å; H355-W657 AromaticContact ND1-NE1 3.36Å; H355-W657 PolarHBondContact ND1-NE1 3.11Å; H355-W657 AromaticContact NE2-NE1 3.6Å; F360-W657 AromaticContact CE1-CH2 3.68Å; F360-W657 HydrophobicContact CE1-CH2 3.68Å; F360-W657 AromaticContact CE1-CZ2 3.64Å; F360-W657 HydrophobicContact CE1-CZ2 3.64Å; F360-W657 HydrophobicContact CZ-CH2 4.32Å; F360-W657 HydrophobicContact CZ-CZ2 4.03Å; I654-W657 HydrophobicContact CD1-CH2 3.86Å; I654-W657 HydrophobicContact CD1-CZ2 3.36Å; I654-W657 HydrophobicContact CG2-CD2 4.39Å; I654-W657 HydrophobicContact CG2-CZ2 4.17Å; W657-P659 CarbonylContact C-O 3.51Å; W657-P659 CarbonylContact O-C 3.5Å; W657-L660 HydrophobicContact CD2-CD1 4.36Å; W657-L660 HydrophobicContact CE3-CD1 3.78Å; W657-L660 HydrophobicContact CH2-CD1 4.3Å; W657-L660 HydrophobicContact CZ3-CD1 3.75Å; W657-L660 PolarHBondContact O-N 2.94Å; W657-L746 HydrophobicContact CH2-CB 4.49Å; W657-L746 HydrophobicContact CH2-CD2 3.95Å; W657-Q750 HydrophobicContact CE3-CG 4.32Å; W657-Q750 HydrophobicContact CZ3-CG 4.28Å; W657-I753 HydrophobicContact CD2-CD1 4.21Å; W657-I753 HydrophobicContact CD2-CG2 4.08Å; W657-I753 HydrophobicContact CE3-CD1 4.19Å; W657-I753 HydrophobicContact CG-CG2 4.1Å; W657-I753 HydrophobicContact CH2-CD1 3.37Å; W657-I753 HydrophobicContact CZ2-CD1 3.36Å; W657-I753 HydrophobicContact CZ3-CD1 3.8Å; W657-P755 HydrophobicContact CB-CB 3.93Å
658	A	87.3	Confident	96.3	Very high	44 Å²	44	12 Å²	12	36%	0.364	7%	0.065	S	C	.	.	T	Hydrogen-bonded Turn	trans	-142.8	72.3	-176.6	0	0	0	0	0	111.9	D656 P755 K757	D656-A658 PolarHBondContact OD1-N 3.17Å; A658-P755 HydrophobicContact CB-CB 3.98Å; A658-K757 PolarHBondContact O-NZ 2.77Å
659	P	91.2	Very high	96.3	Very high	3 Å²	3	12.4 Å²	12.4	2%	0.019	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	cis	-79.6	152.1	12	29.9	-36.5	0	0	0	114.1	D656 W657 T661 R828 Q829 F831	D656-P659 CarbonylContact C-O 3.47Å; D656-P659 WeakPolarHBondContact CB-O 3.44Å; W657-P659 CarbonylContact C-O 3.51Å; W657-P659 CarbonylContact O-C 3.5Å; P659-T661 PolarHBondContact O-N 3.42Å; P659-T661 VanDerWaalsContact O-N 3.11Å; P659-T661 PolarHBondContact O-OG1 2.92Å; P659-R828 HydrophobicContact CG-CG 4.47Å; P659-Q829 HydrophobicContact CB-CB 3.76Å; P659-Q829 WeakPolarHBondContact CB-O 3.45Å; P659-F831 VanDerWaalsContact CD-CE1 3.44Å; P659-F831 HydrophobicContact CG-CD2 4.01Å; P659-F831 HydrophobicContact CG-CE1 4.41Å; P659-F831 HydrophobicContact CG-CE2 3.72Å; P659-F831 HydrophobicContact CG-CG 4.48Å; P659-F831 HydrophobicContact CG-CZ 3.95Å
660	L	94.1	Very high	96.3	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.5	117.4	166.1	175.1	58.6	0	0	0	109.6	I654 D656 W657 V662 L746 L747 Q750 Y827 R828 Q829	I654-L660 HydrophobicContact CG2-CD1 4.25Å; D656-L660 WeakPolarHBondContact O-CA 3.17Å; W657-L660 HydrophobicContact CD2-CD1 4.36Å; W657-L660 HydrophobicContact CE3-CD1 3.78Å; W657-L660 HydrophobicContact CH2-CD1 4.3Å; W657-L660 HydrophobicContact CZ3-CD1 3.75Å; W657-L660 PolarHBondContact O-N 2.94Å; L660-V662 HydrophobicContact CD1-CG2 3.58Å; L660-V662 HydrophobicContact CD2-CG2 4.46Å; L660-V662 HydrophobicContact CG-CG2 3.84Å; L660-L746 HydrophobicContact CD1-CB 4.38Å; L660-L746 HydrophobicContact CD2-CB 4.03Å; L660-L747 HydrophobicContact CD2-CD2 4.09Å; L660-L747 HydrophobicContact CD2-CG 4.41Å; L660-Q750 HydrophobicContact CD2-CG 4.4Å; L660-Y827 HydrophobicContact CD2-CD1 4.31Å; L660-Y827 HydrophobicContact CD2-CE1 4.28Å; L660-Y827 HydrophobicContact CG-CD1 4.24Å; L660-Y827 HydrophobicContact CG-CE1 4.44Å; L660-R828 WeakPolarHBondContact O-CA 3.48Å; L660-Q829 HydrophobicContact CB-CB 4.27Å; L660-Q829 PolarHBondContact O-N 2.98Å
661	T	96.1	Very high	96.2	Very high	8 Å²	8	12.2 Å²	12.2	5%	0.049	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	109.3	-176.2	-53.2	0	0	0	0	109.3	T655 D656 P659 L825 Y827 R828	T655-T661 PolarHBondContact N-O 3.01Å; T655-T661 VanDerWaalsContact N-O 3.08Å; T655-T661 WeakPolarHBondContact OG1-CG2 3.16Å; D656-T661 PolarHBondContact O-N 2.92Å; P659-T661 PolarHBondContact O-N 3.42Å; P659-T661 VanDerWaalsContact O-N 3.11Å; P659-T661 PolarHBondContact O-OG1 2.92Å; T661-L825 HydrophobicContact CG2-CD1 3.98Å; T661-Y827 WeakPolarHBondContact CA-O 3.42Å; T661-R828 HydrophobicContact CG2-CG 4.17Å
662	V	98.1	Very high	96.2	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	128.3	-168.5	-170.7	0	0	0	0	109.8	F652 L660 L746 L826 Y827	F652-V662 HydrophobicContact CD2-CG1 4.25Å; L660-V662 HydrophobicContact CD1-CG2 3.58Å; L660-V662 HydrophobicContact CD2-CG2 4.46Å; L660-V662 HydrophobicContact CG-CG2 3.84Å; V662-L746 HydrophobicContact CB-CD1 4.39Å; V662-L746 HydrophobicContact CG1-CD1 3.77Å; V662-L746 HydrophobicContact CG2-CD1 3.64Å; V662-L826 HydrophobicContact CG1-CD2 4.38Å; V662-L826 PolarHBondContact O-N 3.4Å; V662-L826 VanDerWaalsContact O-N 3.08Å; V662-Y827 PolarHBondContact N-O 2.9Å; V662-Y827 PolarHBondContact O-N 3.35Å; V662-Y827 VanDerWaalsContact O-N 3.08Å
663	W	98.4	Very high	96.1	Very high	26 Å²	26	12.2 Å²	12.2	10%	0.098	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	138.8	174.9	-53.4	77.9	0	0	0	109.6	F652 L653 T655 V808 K812 V820 F823 E824 L825	F652-W663 CarbonylContact C-O 3.55Å; F652-W663 VanDerWaalsContact CA-O 3.31Å; F652-W663 WeakPolarHBondContact CA-O 3.31Å; F652-W663 WeakPolarHBondContact CB-O 3.42Å; L653-W663 HydrophobicContact CB-CB 4.21Å; L653-W663 PolarHBondContact N-O 2.9Å; L653-W663 PolarHBondContact O-N 3.46Å; T655-W663 PolarHBondContact OG1-NE1 3.06Å; W663-V808 HydrophobicContact CD2-CG1 3.79Å; W663-V808 HydrophobicContact CE3-CG1 4.32Å; W663-V808 HydrophobicContact CE3-CG2 4.4Å; W663-V808 HydrophobicContact CG-CG1 4.11Å; W663-V808 HydrophobicContact CZ2-CG1 3.97Å; W663-K812 HydrophobicContact CH2-CD 3.71Å; W663-K812 HydrophobicContact CZ2-CD 4.4Å; W663-K812 HydrophobicContact CZ3-CD 4.44Å; W663-V820 HydrophobicContact CZ3-CG1 4.25Å; W663-F823 HydrophobicContact CB-CB 4.48Å; W663-F823 HydrophobicContact CB-CD1 3.7Å; W663-F823 HydrophobicContact CB-CE1 4.36Å; W663-F823 HydrophobicContact CB-CG 4.35Å; W663-F823 HydrophobicContact CE3-CB 4.43Å; W663-E824 CarbonylContact C-O 3.54Å; W663-E824 WeakPolarHBondContact CA-O 3.3Å; W663-L825 HydrophobicContact CD2-CD1 3.95Å; W663-L825 HydrophobicContact CE3-CB 3.94Å; W663-L825 HydrophobicContact CE3-CD1 4.22Å; W663-L825 HydrophobicContact CG-CD1 4.48Å; W663-L825 HydrophobicContact CH2-CB 4.27Å; W663-L825 HydrophobicContact CH2-CD1 4.19Å; W663-L825 HydrophobicContact CZ2-CD1 3.94Å; W663-L825 HydrophobicContact CZ3-CB 3.81Å; W663-L825 HydrophobicContact CZ3-CD1 4.34Å
664	W	98.4	Very high	96	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	134.4	177.5	-178.4	-89.4	0	0	0	109.1	Q650 Q735 M738 K739 V742 F823 E824 L826	Q650-W664 VanDerWaalsContact CD-CE2 3.44Å; Q650-W664 HydrophobicContact CG-CE3 4.42Å; Q650-W664 HydrophobicContact CG-CH2 3.4Å; Q650-W664 VanDerWaalsContact CG-CH2 3.4Å; Q650-W664 HydrophobicContact CG-CZ2 3.49Å; Q650-W664 VanDerWaalsContact CG-CZ2 3.49Å; Q650-W664 HydrophobicContact CG-CZ3 3.89Å; W664-Q735 HydrophobicContact CZ2-CG 4.07Å; W664-M738 HydrophobicContact CH2-CB 3.68Å; W664-M738 HydrophobicContact CZ2-CB 4.27Å; W664-M738 HydrophobicContact CZ2-CE 4.49Å; W664-K739 HydrophobicContact CD2-CD 4.34Å; W664-K739 HydrophobicContact CD2-CG 3.61Å; W664-K739 HydrophobicContact CE3-CG 3.68Å; W664-K739 HydrophobicContact CG-CG 4.29Å; W664-K739 HydrophobicContact CH2-CB 4.33Å; W664-K739 HydrophobicContact CH2-CG 3.65Å; W664-K739 HydrophobicContact CZ2-CD 4.49Å; W664-K739 HydrophobicContact CZ2-CG 3.62Å; W664-K739 HydrophobicContact CZ3-CB 4.26Å; W664-K739 HydrophobicContact CZ3-CG 3.7Å; W664-V742 HydrophobicContact CZ3-CB 4.42Å; W664-V742 HydrophobicContact CZ3-CG2 4.03Å; W664-F823 CarbonylContact O-C 3.58Å; W664-F823 WeakPolarHBondContact O-CA 3.33Å; W664-E824 HydrophobicContact CB-CG 3.86Å; W664-E824 HydrophobicContact CG-CG 4.46Å; W664-E824 PolarHBondContact N-O 3.21Å; W664-E824 PolarHBondContact O-N 3.07Å; W664-L826 HydrophobicContact CB-CB 3.93Å; W664-L826 HydrophobicContact CB-CD2 4.35Å; W664-L826 HydrophobicContact CE3-CD2 3.84Å
665	Y	98.4	Very high	96	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	129.6	170.9	-152.4	-116.9	0	0	0	109.2	Q650 W651 D667 S800 V801 D804 R822 F823	Q650-Y665 PolarHBondContact NE2-O 3.31Å; W651-Y665 HydrophobicContact CE3-CD1 4.02Å; W651-Y665 PolarHBondContact O-N 3.43Å; Y665-D667 VanDerWaalsContact C-N 3.29Å; Y665-D667 HydrophobicContact CD1-CB 3.96Å; Y665-D667 HydrophobicContact CE1-CB 3.95Å; Y665-D667 PolarHBondContact O-N 2.93Å; Y665-S800 VanDerWaalsContact OH-C 3.28Å; Y665-S800 VanDerWaalsContact OH-CB 3.29Å; Y665-S800 WeakPolarHBondContact OH-CB 3.46Å; Y665-V801 HydrophobicContact CD1-CB 4.07Å; Y665-V801 HydrophobicContact CD1-CG2 3.85Å; Y665-V801 HydrophobicContact CD2-CB 4.49Å; Y665-V801 HydrophobicContact CD2-CG2 3.83Å; Y665-V801 HydrophobicContact CE1-CB 3.7Å; Y665-V801 HydrophobicContact CE1-CG2 3.97Å; Y665-V801 HydrophobicContact CE2-CB 4.18Å; Y665-V801 HydrophobicContact CE2-CG2 3.96Å; Y665-V801 HydrophobicContact CG-CB 4.44Å; Y665-V801 HydrophobicContact CG-CG2 3.78Å; Y665-V801 PolarHBondContact OH-N 2.97Å; Y665-D804 HydrophobicContact CE2-CB 3.79Å; Y665-D804 VanDerWaalsContact CE2-OD2 3.3Å; Y665-D804 WeakPolarHBondContact CE2-OD2 3.5Å; Y665-D804 PolarHBondContact OH-OD2 3.26Å; Y665-R822 HydrophobicContact CD2-CB 4.36Å; Y665-R822 WeakPolarHBondContact CD2-O 3.35Å; Y665-R822 HydrophobicContact CE1-CB 4.31Å; Y665-R822 HydrophobicContact CE2-CB 3.75Å; Y665-F823 AromaticContact CD2-CD1 3.76Å; Y665-F823 HydrophobicContact CD2-CD1 3.76Å; Y665-F823 AromaticContact CD2-CD2 3.68Å; Y665-F823 HydrophobicContact CD2-CD2 3.68Å; Y665-F823 AromaticContact CD2-CE1 3.72Å; Y665-F823 HydrophobicContact CD2-CE1 3.72Å; Y665-F823 AromaticContact CD2-CE2 3.63Å; Y665-F823 HydrophobicContact CD2-CE2 3.63Å; Y665-F823 AromaticContact CD2-CG 3.72Å; Y665-F823 HydrophobicContact CD2-CG 3.72Å; Y665-F823 AromaticContact CD2-CZ 3.66Å; Y665-F823 HydrophobicContact CD2-CZ 3.66Å; Y665-F823 AromaticContact CE2-CD2 3.89Å; Y665-F823 HydrophobicContact CE2-CD2 3.89Å; Y665-F823 AromaticContact CE2-CE2 3.9Å; Y665-F823 HydrophobicContact CE2-CE2 3.9Å; Y665-F823 HydrophobicContact CE2-CG 4.29Å; Y665-F823 HydrophobicContact CE2-CZ 4.34Å; Y665-F823 HydrophobicContact CG-CE1 4.26Å; Y665-F823 HydrophobicContact CG-CZ 4.34Å
666	Q	97.5	Very high	96	Very high	73 Å²	73	15.6 Å²	15.6	34%	0.341	8%	0.08	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	-30.6	-174.5	-70.2	178.6	-25	0	0	112.1	R822 E824	Q666-R822 HydrophobicContact CB-CB 4.41Å; Q666-R822 WeakPolarHBondContact CG-O 3.45Å; Q666-R822 PolarHBondContact N-O 2.84Å; Q666-E824 HydrophobicContact CG-CG 4.31Å; Q666-E824 PolarHBondContact NE2-OE2 3.1Å
667	D	97.3	Very high	96.2	Very high	3 Å²	3	15.9 Å²	15.9	2%	0.016	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	144.1	173.2	-57.9	-31.6	0	0	0	112.4	Y665 W714 Y797 R822	Y665-D667 VanDerWaalsContact C-N 3.29Å; Y665-D667 HydrophobicContact CD1-CB 3.96Å; Y665-D667 HydrophobicContact CE1-CB 3.95Å; Y665-D667 PolarHBondContact O-N 2.93Å; D667-W714 PolarHBondContact OD1-NE1 2.96Å; D667-W714 VanDerWaalsContact OD1-NE1 3.1Å; D667-Y797 HydrophobicContact CB-CD1 4.11Å; D667-Y797 HydrophobicContact CB-CD2 4.43Å; D667-Y797 HydrophobicContact CB-CE1 3.82Å; D667-Y797 HydrophobicContact CB-CE2 4.15Å; D667-Y797 HydrophobicContact CB-CG 4.39Å; D667-R822 IonicContact OD1-CZ 3.67Å; D667-R822 VanDerWaalsContact OD1-CZ 3.25Å; D667-R822 IonicContact OD1-NE 3.08Å; D667-R822 PolarHBondContact OD1-NE 3.48Å; D667-R822 IonicContact OD1-NH2 2.67Å; D667-R822 PolarHBondContact OD1-NH2 3.41Å; D667-R822 WeakPolarHBondContact OD2-CD 3.47Å; D667-R822 IonicContact OD2-CZ 2.72Å; D667-R822 IonicContact OD2-NE 2.67Å; D667-R822 PolarHBondContact OD2-NE 3.33Å; D667-R822 IonicContact OD2-NH2 2.61Å
668	C	97.5	Very high	96.3	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	168	167.2	58.3	0	0	0	0	108.4	I648 R649 Q650 W714 W730 Y797	I648-C668 HydrophobicContact CG2-CB 4.02Å; R649-C668 WeakPolarHBondContact O-CA 3.36Å; R649-C668 WeakPolarHBondContact O-CB 3.37Å; Q650-C668 HydrophobicContact CB-CB 4.29Å; C668-W714 PolarHBondContact O-N 2.78Å; C668-W730 WeakPolarHBondContact SG-CH2 3.44Å; C668-Y797 WeakPolarHBondContact O-CE2 3.48Å
669	Y	97.3	Very high	96.7	Very high	9 Å²	9	16.8 Å²	16.8	4%	0.035	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	150.4	177.1	63.2	-88.6	0	0	0	111.8	R649 W651 R671 M711 W712 V793 T794 Y797	R649-Y669 HydrophobicContact CB-CD1 4.28Å; R649-Y669 HydrophobicContact CB-CD2 4.29Å; R649-Y669 HydrophobicContact CB-CE1 3.96Å; R649-Y669 HydrophobicContact CB-CE2 3.96Å; R649-Y669 HydrophobicContact CB-CG 4.45Å; R649-Y669 HydrophobicContact CG-CD1 4.19Å; R649-Y669 HydrophobicContact CG-CE1 3.5Å; R649-Y669 VanDerWaalsContact CG-CE1 3.5Å; R649-Y669 HydrophobicContact CG-CE2 4.21Å; R649-Y669 PolarHBondContact N-O 3.1Å; R649-Y669 PolarHBondContact O-N 2.96Å; W651-Y669 AromaticContact CH2-CD1 3.74Å; W651-Y669 HydrophobicContact CH2-CD1 3.74Å; W651-Y669 AromaticContact CH2-CE1 3.48Å; W651-Y669 HydrophobicContact CH2-CE1 3.48Å; W651-Y669 VanDerWaalsContact CH2-CE1 3.48Å; W651-Y669 HydrophobicContact CZ2-CD1 4.39Å; W651-Y669 AromaticContact CZ2-CE1 3.69Å; W651-Y669 HydrophobicContact CZ2-CE1 3.69Å; W651-Y669 AromaticContact CZ3-CD1 3.99Å; W651-Y669 HydrophobicContact CZ3-CD1 3.99Å; W651-Y669 HydrophobicContact CZ3-CE1 4.11Å; Y669-R671 HydrophobicContact CD2-CG 3.87Å; Y669-R671 HydrophobicContact CE2-CG 3.67Å; Y669-M711 HydrophobicContact CD2-CG 4.37Å; Y669-M711 HydrophobicContact CD2-SD 3.62Å; Y669-M711 HydrophobicContact CE2-CE 4.09Å; Y669-M711 HydrophobicContact CE2-SD 3.61Å; Y669-W712 CarbonylContact C-O 2.96Å; Y669-W712 WeakPolarHBondContact CA-O 3.21Å; Y669-W712 WeakPolarHBondContact CB-O 3.42Å; Y669-V793 HydrophobicContact CG-CG1 4.31Å; Y669-T794 HydrophobicContact CE1-CG2 4.12Å; Y669-T794 HydrophobicContact CE2-CG2 4.05Å; Y669-Y797 HydrophobicContact CD1-CD2 4.5Å
670	L	97.7	Very high	96.8	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	148.2	172.9	-78.7	64.4	0	0	0	109.4	I641 F646 D647 I648 F672 M711 W712 F717	I641-L670 HydrophobicContact CD1-CD2 3.89Å; F646-L670 HydrophobicContact CD2-CB 4.21Å; F646-L670 HydrophobicContact CD2-CD2 3.51Å; F646-L670 HydrophobicContact CD2-CG 3.66Å; F646-L670 HydrophobicContact CE2-CD2 3.56Å; F646-L670 HydrophobicContact CE2-CG 3.89Å; F646-L670 HydrophobicContact CG-CD2 4.26Å; F646-L670 HydrophobicContact CZ-CD2 4.36Å; D647-L670 CarbonylContact O-C 3.51Å; D647-L670 WeakPolarHBondContact O-CA 3.31Å; I648-L670 HydrophobicContact CD1-CD1 4.42Å; I648-L670 HydrophobicContact CG1-CD1 4.02Å; I648-L670 HydrophobicContact CG1-CG 4.05Å; L670-F672 HydrophobicContact CB-CE2 4.35Å; L670-F672 HydrophobicContact CB-CZ 4.43Å; L670-F672 HydrophobicContact CD2-CZ 4.17Å; L670-M711 VanDerWaalsContact O-CA 3.23Å; L670-M711 WeakPolarHBondContact O-CA 3.31Å; L670-M711 WeakPolarHBondContact O-CB 3.4Å; L670-W712 HydrophobicContact CB-CB 4.12Å; L670-W712 HydrophobicContact CD2-CB 4.47Å; L670-W712 HydrophobicContact CD2-CE3 4.25Å; L670-W712 PolarHBondContact N-O 3.04Å; L670-W712 PolarHBondContact O-N 3.19Å; L670-F717 HydrophobicContact CD1-CB 3.81Å; L670-F717 HydrophobicContact CD1-CD1 4.26Å; L670-F717 HydrophobicContact CD1-CG 4.11Å; L670-F717 HydrophobicContact CD2-CB 3.8Å; L670-F717 HydrophobicContact CD2-CD1 4.49Å; L670-F717 HydrophobicContact CD2-CD2 3.79Å; L670-F717 HydrophobicContact CD2-CG 3.78Å; L670-F717 HydrophobicContact CG-CB 4.5Å
671	R	97.1	Very high	96.7	Very high	10 Å²	10	27 Å²	27	4%	0.038	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	126.3	170.5	-53.7	178.5	-60.9	-154.2	5.8	109.8	F646 D647 R649 Y669 C689 N710 D766	F646-R671 CarbonylContact C-O 3.57Å; F646-R671 WeakPolarHBondContact CA-O 3.48Å; F646-R671 WeakPolarHBondContact CB-O 3.48Å; D647-R671 PolarHBondContact N-O 2.83Å; D647-R671 PolarHBondContact O-N 3.5Å; D647-R671 IonicContact OD1-CZ 3.41Å; D647-R671 IonicContact OD1-NE 2.85Å; D647-R671 PolarHBondContact OD1-NE 2.67Å; D647-R671 IonicContact OD1-NH2 3.14Å; D647-R671 PolarHBondContact OD1-NH2 2.75Å; D647-R671 IonicContact OD2-CZ 3.75Å; D647-R671 IonicContact OD2-NE 3.62Å; D647-R671 IonicContact OD2-NH2 2.61Å; D647-R671 PolarHBondContact OD2-NH2 3.28Å; R649-R671 VanDerWaalsContact CZ-NH1 3.31Å; Y669-R671 HydrophobicContact CD2-CG 3.87Å; Y669-R671 HydrophobicContact CE2-CG 3.67Å; R671-C689 HydrophobicContact CB-CB 4.35Å; R671-C689 WeakPolarHBondContact CB-O 3.28Å; R671-C689 PolarHBondContact NE-O 3.14Å; R671-N710 CarbonylContact C-O 3.56Å; R671-N710 WeakPolarHBondContact CA-O 3.13Å; R671-D766 IonicContact CZ-OD2 3.81Å; R671-D766 VanDerWaalsContact CZ-OD2 3.31Å; R671-D766 IonicContact NH1-OD2 2.74Å; R671-D766 PolarHBondContact NH1-OD2 3.08Å; R671-D766 VanDerWaalsContact NH1-OD2 3.1Å; R671-D766 IonicContact NH2-OD2 2.65Å; R671-D766 PolarHBondContact NH2-OD2 3.07Å
672	F	97.6	Very high	96.5	Very high	1 Å²	1	29.2 Å²	29.2	0%	0.004	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	150.1	-178.5	-66.1	-78.3	0	0	0	112.3	I641 T644 F646 L670 L706 N710 W712	I641-F672 HydrophobicContact CB-CE1 4Å; I641-F672 HydrophobicContact CD1-CE1 4.03Å; I641-F672 HydrophobicContact CD1-CZ 4.22Å; I641-F672 HydrophobicContact CG2-CE1 4.16Å; I641-F672 HydrophobicContact CG2-CZ 4.49Å; T644-F672 HydrophobicContact CG2-CB 4.23Å; T644-F672 HydrophobicContact CG2-CD1 4.26Å; F646-F672 HydrophobicContact CB-CD1 3.56Å; F646-F672 HydrophobicContact CB-CE1 3.67Å; F646-F672 HydrophobicContact CB-CG 4.3Å; F646-F672 HydrophobicContact CB-CZ 4.5Å; F646-F672 HydrophobicContact CD1-CE1 4.41Å; F646-F672 HydrophobicContact CG-CD1 4.48Å; F646-F672 HydrophobicContact CG-CE1 4.13Å; L670-F672 HydrophobicContact CB-CE2 4.35Å; L670-F672 HydrophobicContact CB-CZ 4.43Å; L670-F672 HydrophobicContact CD2-CZ 4.17Å; F672-L706 HydrophobicContact CD1-CD2 3.81Å; F672-L706 HydrophobicContact CD2-CD2 4.41Å; F672-L706 HydrophobicContact CE1-CD2 3.64Å; F672-L706 HydrophobicContact CE2-CD2 4.24Å; F672-L706 HydrophobicContact CG-CD2 4.22Å; F672-L706 HydrophobicContact CZ-CD2 3.86Å; F672-N710 HydrophobicContact CB-CB 4.4Å; F672-N710 PolarHBondContact N-O 3.16Å; F672-W712 HydrophobicContact CE2-CB 3.81Å; F672-W712 AromaticContact CE2-CD2 3.88Å; F672-W712 HydrophobicContact CE2-CD2 3.88Å; F672-W712 HydrophobicContact CE2-CE3 4.34Å; F672-W712 AromaticContact CE2-CG 3.65Å; F672-W712 HydrophobicContact CE2-CG 3.65Å; F672-W712 HydrophobicContact CZ-CB 4.26Å; F672-W712 AromaticContact CZ-CD2 3.72Å; F672-W712 HydrophobicContact CZ-CD2 3.72Å; F672-W712 AromaticContact CZ-CE3 3.73Å; F672-W712 HydrophobicContact CZ-CE3 3.73Å; F672-W712 AromaticContact CZ-CG 3.99Å; F672-W712 HydrophobicContact CZ-CG 3.99Å; F672-W712 HydrophobicContact CZ-CZ3 4.34Å
673	C	97.2	Very high	96.3	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	152.8	162.3	-67.8	0	0	0	0	111.2	T644 K645 Q675 S685 I686 R702	T644-C673 HydrophobicContact CG2-CB 4.25Å; T644-C673 WeakPolarHBondContact CG2-O 3.5Å; K645-C673 PolarHBondContact O-N 3.25Å; C673-Q675 VanDerWaalsContact C-N 3.27Å; C673-Q675 PolarHBondContact O-N 2.88Å; C673-S685 WeakPolarHBondContact CB-O 3.28Å; C673-I686 PolarHBondContact SG-O 3.44Å; C673-R702 PolarHBondContact O-NH1 3.43Å
674	S	96	Very high	95.9	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	-19.5	176.3	50.8	0	0	0	0	112.9	Q694 Y697 N699 G700	S674-Q694 PolarHBondContact OG-OE1 2.96Å; S674-Y697 WeakPolarHBondContact OG-CB 3.43Å; S674-N699 CarbonylContact O-C 3.49Å; S674-N699 WeakPolarHBondContact O-CA 3.48Å; S674-G700 PolarHBondContact O-N 2.75Å
675	Q	96.1	Very high	95.7	Very high	48 Å²	48	32.6 Å²	32.6	22%	0.224	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	157.8	-173.6	-56	-56.9	-42.9	0	0	112.2	C673 I686 K698	C673-Q675 VanDerWaalsContact C-N 3.27Å; C673-Q675 PolarHBondContact O-N 2.88Å; Q675-I686 HydrophobicContact CB-CG1 3.67Å; Q675-I686 HydrophobicContact CG-CG1 4.15Å; Q675-K698 PolarHBondContact NE2-O 3.4Å
676	E	97.2	Very high	95.5	Very high	58 Å²	58	33.2 Å²	33.2	27%	0.271	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	149.3	169.9	-65.2	-162.8	155.4	0	0	111	K643 R702	K643-E676 HydrophobicContact CB-CB 4.47Å; K643-E676 HydrophobicContact CB-CG 4.38Å; K643-E676 HydrophobicContact CD-CG 4.35Å; K643-E676 WeakPolarHBondContact CD-OE1 3.41Å; K643-E676 WeakPolarHBondContact CD-OE2 3.45Å; K643-E676 IonicContact NZ-OE1 2.94Å; K643-E676 PolarHBondContact NZ-OE1 3.33Å; K643-E676 IonicContact NZ-OE2 3.21Å; K643-E676 PolarHBondContact NZ-OE2 3.19Å; E676-R702 HydrophobicContact CG-CB 4.18Å
677	F	97.2	Very high	95.4	Very high	35 Å²	35	29.8 Å²	29.8	15%	0.154	15%	0.153	C	C	.	.			trans	-78.1	136.7	-175.8	-177	-108.8	0	0	0	113.3	Y634 P638 L640 K643 K645 L679 I686 H687	Y634-F677 HydrophobicContact CE1-CE2 4.44Å; Y634-F677 HydrophobicContact CE1-CZ 4.2Å; Y634-F677 WeakPolarHBondContact OH-CE2 3.3Å; P638-F677 HydrophobicContact CG-CD1 4.17Å; P638-F677 HydrophobicContact CG-CE1 3.79Å; P638-F677 HydrophobicContact CG-CE2 4.22Å; P638-F677 HydrophobicContact CG-CZ 3.82Å; L640-F677 HydrophobicContact CD1-CB 4.02Å; L640-F677 HydrophobicContact CD1-CD1 3.93Å; L640-F677 HydrophobicContact CD1-CG 4.37Å; L640-F677 HydrophobicContact CD2-CB 3.53Å; L640-F677 HydrophobicContact CD2-CD1 3.91Å; L640-F677 HydrophobicContact CD2-CG 3.76Å; L640-F677 HydrophobicContact CG-CB 4.44Å; L640-F677 HydrophobicContact CG-CD1 4.46Å; K643-F677 VanDerWaalsContact O-CB 3.29Å; K643-F677 WeakPolarHBondContact O-CB 3.36Å; K643-F677 PolarHBondContact O-N 3.09Å; K645-F677 HydrophobicContact CB-CB 4.34Å; K645-F677 HydrophobicContact CB-CD2 3.95Å; K645-F677 HydrophobicContact CB-CG 4.39Å; K645-F677 HydrophobicContact CD-CD2 4.12Å; K645-F677 HydrophobicContact CD-CE2 4.16Å; K645-F677 HydrophobicContact CG-CD2 4.49Å; F677-L679 HydrophobicContact CE1-CD2 4.32Å; F677-L679 HydrophobicContact CE1-CG 4.36Å; F677-L679 HydrophobicContact CZ-CD2 3.72Å; F677-L679 HydrophobicContact CZ-CG 4.24Å; F677-I686 HydrophobicContact CD2-CG2 4.32Å; F677-H687 AromaticContact CE2-CE1 3.62Å; F677-H687 AromaticContact CE2-ND1 3.85Å
678	T	95.7	Very high	95.2	Very high	46 Å²	46	30.4 Å²	30.4	28%	0.282	16%	0.157	S	C	.	.			trans	-145.9	173	172.8	-178.8	0	0	0	0	110.4	N680 I686 H687	T678-N680 PolarHBondContact OG1-N 2.89Å; T678-N680 VanDerWaalsContact OG1-N 3.15Å; T678-I686 HydrophobicContact CG2-CD1 3.83Å; T678-I686 HydrophobicContact CG2-CG2 4.13Å; T678-H687 PolarHBondContact O-CE1 2.95Å; T678-H687 PolarHBondContact O-NE2 3.22Å
679	L	94.8	Very high	95	Very high	32 Å²	32	30.6 Å²	30.6	17%	0.168	16%	0.158	C	C	.	.	S	Bend	trans	-119.3	8.8	169.8	-64.8	174.6	0	0	0	112.1	R589 Y634 E636 F677	R589-L679 HydrophobicContact CG-CB 4.48Å; R589-L679 HydrophobicContact CG-CD1 4.06Å; Y634-L679 HydrophobicContact CD1-CD2 4.43Å; Y634-L679 HydrophobicContact CE1-CD2 4.01Å; E636-L679 HydrophobicContact CB-CD1 4Å; E636-L679 HydrophobicContact CG-CD1 4.08Å; E636-L679 HydrophobicContact CG-CD2 4.34Å; F677-L679 HydrophobicContact CE1-CD2 4.32Å; F677-L679 HydrophobicContact CE1-CG 4.36Å; F677-L679 HydrophobicContact CZ-CD2 3.72Å; F677-L679 HydrophobicContact CZ-CG 4.24Å
680	N	92.5	Very high	94.5	Very high	140 Å²	140	31.1 Å²	31.1	75%	0.749	16%	0.161	S	C	*	.	S	Bend	trans	-95.6	-21.7	-178.4	-64.8	-14.7	0	0	0	113.3	T678	T678-N680 PolarHBondContact OG1-N 2.89Å; T678-N680 VanDerWaalsContact OG1-N 3.15Å
681	D	92.7	Very high	93.9	Very high	79 Å²	79	32.2 Å²	32.2	42%	0.422	17%	0.167	S	C	.	.			trans	-126.8	132.5	169.7	169.7	27.2	0	0	0	107.8	S683 I686 H687	D681-S683 WeakPolarHBondContact OD1-CB 3.5Å; D681-S683 PolarHBondContact OD1-N 3.14Å; D681-S683 WeakPolarHBondContact OD2-CB 3.48Å; D681-S683 PolarHBondContact OD2-OG 3.34Å; D681-I686 HydrophobicContact CB-CD1 3.98Å; D681-I686 WeakPolarHBondContact OD2-CD1 3.18Å; D681-H687 PolarHBondContact O-CD2 2.89Å; D681-H687 PolarHBondContact O-NE2 3.03Å
682	F	92.5	Very high	93.1	Very high	54 Å²	54	34 Å²	34	24%	0.237	18%	0.18	C	C	.	.			trans	-100.3	18.5	-178.8	-68.1	-46.3	0	0	0	113.8	V591 C607 H687	V591-F682 HydrophobicContact CG1-CE1 3.8Å; V591-F682 HydrophobicContact CG1-CZ 3.89Å; V591-F682 HydrophobicContact CG2-CE1 4.07Å; V591-F682 HydrophobicContact CG2-CZ 3.86Å; C607-F682 HydrophobicContact CB-CB 4.04Å; C607-F682 HydrophobicContact CB-CD1 3.76Å; C607-F682 HydrophobicContact CB-CD2 4.32Å; C607-F682 HydrophobicContact CB-CE1 4.31Å; C607-F682 HydrophobicContact CB-CG 3.79Å; C607-F682 WeakPolarHBondContact O-CD2 3.31Å; F682-H687 AromaticContact CD1-NE2 3.76Å
683	S	92.6	Very high	92.4	Very high	32 Å²	32	34 Å²	34	22%	0.224	18%	0.18	C	C	.	.			trans	-56.1	147.3	179.8	62.3	0	0	0	0	114.4	D681 S685 I686 H687	D681-S683 WeakPolarHBondContact OD1-CB 3.5Å; D681-S683 PolarHBondContact OD1-N 3.14Å; D681-S683 WeakPolarHBondContact OD2-CB 3.48Å; D681-S683 PolarHBondContact OD2-OG 3.34Å; S683-S685 PolarHBondContact O-N 3.33Å; S683-S685 PolarHBondContact OG-OG 3.02Å; S683-I686 PolarHBondContact O-N 3.19Å; S683-I686 VanDerWaalsContact O-N 3.11Å; S683-I686 VanDerWaalsContact OG-CD1 3.27Å; S683-I686 WeakPolarHBondContact OG-CD1 3.34Å; S683-I686 WeakPolarHBondContact OG-CG1 3.45Å; S683-H687 PolarHBondContact O-N 3.12Å; S683-H687 VanDerWaalsContact O-N 3.11Å
684	E	91.7	Very high	92.1	Very high	54 Å²	54	34 Å²	34	25%	0.252	18%	0.181	S	C	.	.	H	α-helix	trans	-65.3	-26.4	-175.1	61.4	168.5	-135.9	0	0	113.3	I686 L688 I693 Q694 K696 Y697	E684-I686 VanDerWaalsContact C-N 3.34Å; E684-I686 PolarHBondContact O-N 3.25Å; E684-L688 HydrophobicContact CB-CB 4.46Å; E684-L688 HydrophobicContact CB-CD1 3.9Å; E684-L688 HydrophobicContact CB-CG 4.28Å; E684-L688 PolarHBondContact O-N 3.18Å; E684-I693 HydrophobicContact CB-CG2 3.95Å; E684-I693 HydrophobicContact CG-CG2 3.86Å; E684-I693 WeakPolarHBondContact OE1-CG2 3.48Å; E684-Q694 PolarHBondContact O-NE2 3.26Å; E684-K696 IonicContact OE1-NZ 3.27Å; E684-K696 PolarHBondContact OE1-NZ 2.96Å; E684-K696 IonicContact OE2-NZ 2.74Å; E684-Y697 HydrophobicContact CG-CE2 3.83Å; E684-Y697 VanDerWaalsContact CG-OH 3.3Å; E684-Y697 WeakPolarHBondContact CG-OH 3.49Å; E684-Y697 WeakPolarHBondContact OE1-CE2 3.32Å; E684-Y697 PolarHBondContact OE1-OH 2.98Å
685	S	93.1	Very high	91.6	Very high	10 Å²	10	39.6 Å²	39.6	7%	0.07	21%	0.206	C	C	.	.	H	α-helix	trans	-64	-32	173.5	50.1	0	0	0	0	113.6	C673 S683 Q694	C673-S685 WeakPolarHBondContact CB-O 3.28Å; S683-S685 PolarHBondContact O-N 3.33Å; S683-S685 PolarHBondContact OG-OG 3.02Å; S685-Q694 PolarHBondContact O-NE2 3.34Å; S685-Q694 PolarHBondContact O-OE1 3.43Å
686	I	95.4	Very high	91.3	Very high	13 Å²	13	43.4 Å²	43.4	7%	0.067	22%	0.222	C	C	.	.	H	α-helix	trans	-87.6	-37.2	177.2	-62	169.9	0	0	0	111.4	C673 Q675 F677 T678 D681 S683 E684	C673-I686 PolarHBondContact SG-O 3.44Å; Q675-I686 HydrophobicContact CB-CG1 3.67Å; Q675-I686 HydrophobicContact CG-CG1 4.15Å; F677-I686 HydrophobicContact CD2-CG2 4.32Å; T678-I686 HydrophobicContact CG2-CD1 3.83Å; T678-I686 HydrophobicContact CG2-CG2 4.13Å; D681-I686 HydrophobicContact CB-CD1 3.98Å; D681-I686 WeakPolarHBondContact OD2-CD1 3.18Å; S683-I686 PolarHBondContact O-N 3.19Å; S683-I686 VanDerWaalsContact O-N 3.11Å; S683-I686 VanDerWaalsContact OG-CD1 3.27Å; S683-I686 WeakPolarHBondContact OG-CD1 3.34Å; S683-I686 WeakPolarHBondContact OG-CG1 3.45Å; E684-I686 VanDerWaalsContact C-N 3.34Å; E684-I686 PolarHBondContact O-N 3.25Å
687	H	94.7	Very high	91	Very high	2 Å²	2	45 Å²	45	1%	0.009	23%	0.227	C	C	.	.	H	α-helix	trans	-105.7	-21.8	-165.3	-74.4	-81.5	0	0	0	116.8	Y634 K645 F677 T678 D681 F682 S683	Y634-H687 AromaticContact CE1-ND1 4Å; Y634-H687 AromaticContact CE2-ND1 3.91Å; Y634-H687 AromaticContact CZ-ND1 3.36Å; Y634-H687 PolarHBondContact OH-ND1 3.5Å; K645-H687 PolarHBondContact NZ-O 3.31Å; F677-H687 AromaticContact CE2-CE1 3.62Å; F677-H687 AromaticContact CE2-ND1 3.85Å; T678-H687 PolarHBondContact O-CE1 2.95Å; T678-H687 PolarHBondContact O-NE2 3.22Å; D681-H687 PolarHBondContact O-CD2 2.89Å; D681-H687 PolarHBondContact O-NE2 3.03Å; F682-H687 AromaticContact CD1-NE2 3.76Å; S683-H687 PolarHBondContact O-N 3.12Å; S683-H687 VanDerWaalsContact O-N 3.11Å
688	L	93.1	Very high	90.8	Very high	16 Å²	16	52.4 Å²	52.4	8%	0.084	26%	0.259	C	S	.	.			trans	-116.7	100.1	-172.2	-58.3	-176.3	0	0	0	111.4	I593 I605 E684 N690 I693 Q694	I593-L688 HydrophobicContact CD1-CD2 4.3Å; I605-L688 HydrophobicContact CB-CD1 4.34Å; I605-L688 HydrophobicContact CG2-CD1 4.43Å; I605-L688 HydrophobicContact CG2-CD2 4.11Å; E684-L688 HydrophobicContact CB-CB 4.46Å; E684-L688 HydrophobicContact CB-CD1 3.9Å; E684-L688 HydrophobicContact CB-CG 4.28Å; E684-L688 PolarHBondContact O-N 3.18Å; L688-N690 PolarHBondContact O-N 3.25Å; L688-I693 HydrophobicContact CB-CD1 3.9Å; L688-I693 HydrophobicContact CB-CG2 4.41Å; L688-I693 HydrophobicContact CD1-CD1 3.65Å; L688-I693 HydrophobicContact CG-CD1 4.43Å; L688-Q694 PolarHBondContact O-NE2 3.04Å
689	C	92.5	Very high	90.7	Very high	3 Å²	3	52.5 Å²	52.5	2%	0.02	26%	0.257	C	S	.	.			trans	-67.5	1.5	-177	-43	0	0	0	0	114.6	D647 R671 N691	D647-C689 HydrophobicContact CB-CB 4.23Å; D647-C689 VanDerWaalsContact CG-CB 3.49Å; D647-C689 WeakPolarHBondContact OD2-CB 3.43Å; R671-C689 HydrophobicContact CB-CB 4.35Å; R671-C689 WeakPolarHBondContact CB-O 3.28Å; R671-C689 PolarHBondContact NE-O 3.14Å; C689-N691 PolarHBondContact O-N 3.43Å
690	N	87.1	Confident	90.5	Very high	20 Å²	20	52.1 Å²	52.1	11%	0.107	26%	0.261	C	S	.	.			trans	-64.3	126.6	-177.1	-61.7	86.9	0	0	0	110.8	L688 C692 I693 Q694	L688-N690 PolarHBondContact O-N 3.25Å; N690-C692 VanDerWaalsContact C-N 3.29Å; N690-C692 PolarHBondContact O-N 3.47Å; N690-I693 HydrophobicContact CB-CB 4.48Å; N690-I693 HydrophobicContact CB-CD1 4.46Å; N690-I693 WeakPolarHBondContact O-CA 3.39Å; N690-I693 WeakPolarHBondContact O-CB 3.43Å; N690-I693 PolarHBondContact O-N 2.86Å; N690-Q694 PolarHBondContact O-N 3.09Å
691	N	85.5	Confident	90.4	Very high	24 Å²	24	51 Å²	51	13%	0.128	26%	0.261	C	S	.	.	H	α-helix	trans	-57.9	-38.6	-174	-162.3	41.7	0	0	0	113.7	C689 I693 Q694 H695 M711 S790	C689-N691 PolarHBondContact O-N 3.43Å; N691-I693 PolarHBondContact O-N 2.88Å; N691-Q694 PolarHBondContact O-N 2.94Å; N691-H695 VanDerWaalsContact CG-CD2 3.47Å; N691-H695 PolarHBondContact ND2-CD2 2.88Å; N691-H695 VanDerWaalsContact ND2-CD2 3.26Å; N691-H695 PolarHBondContact O-CD2 2.82Å; N691-H695 VanDerWaalsContact O-CD2 3.29Å; N691-H695 PolarHBondContact O-N 3.45Å; N691-H695 PolarHBondContact OD1-CD2 3.05Å; N691-M711 HydrophobicContact CB-CE 3.83Å; N691-M711 VanDerWaalsContact ND2-CE 3.32Å; N691-M711 WeakPolarHBondContact ND2-CE 3.16Å; N691-M711 WeakPolarHBondContact OD1-CE 3.5Å; N691-S790 PolarHBondContact ND2-OG 2.82Å; N691-S790 VanDerWaalsContact ND2-OG 3.16Å
692	C	79.4	Confident	90.5	Very high	46 Å²	46	48.6 Å²	48.6	31%	0.311	25%	0.246	S	C	.	.	H	α-helix	trans	-70	-7.5	175.8	52.7	0	0	0	0	114.8	N690	N690-C692 VanDerWaalsContact C-N 3.29Å; N690-C692 PolarHBondContact O-N 3.47Å
693	I	82.9	Confident	90.6	Very high	2 Å²	2	48 Å²	48	1%	0.01	25%	0.249	C	C	.	.	H	α-helix	trans	-95.1	-51.8	165	-76.5	175.3	0	0	0	109.6	E684 L688 N690 N691 H695 K696 Y697	E684-I693 HydrophobicContact CB-CG2 3.95Å; E684-I693 HydrophobicContact CG-CG2 3.86Å; E684-I693 WeakPolarHBondContact OE1-CG2 3.48Å; L688-I693 HydrophobicContact CB-CD1 3.9Å; L688-I693 HydrophobicContact CB-CG2 4.41Å; L688-I693 HydrophobicContact CD1-CD1 3.65Å; L688-I693 HydrophobicContact CG-CD1 4.43Å; N690-I693 HydrophobicContact CB-CB 4.48Å; N690-I693 HydrophobicContact CB-CD1 4.46Å; N690-I693 WeakPolarHBondContact O-CA 3.39Å; N690-I693 WeakPolarHBondContact O-CB 3.43Å; N690-I693 PolarHBondContact O-N 2.86Å; N691-I693 PolarHBondContact O-N 2.88Å; I693-H695 VanDerWaalsContact C-N 3.33Å; I693-H695 PolarHBondContact O-N 3.04Å; I693-K696 VanDerWaalsContact O-CB 3.28Å; I693-K696 WeakPolarHBondContact O-CB 3.38Å; I693-K696 VanDerWaalsContact O-CG 3.26Å; I693-K696 WeakPolarHBondContact O-CG 3.48Å; I693-K696 PolarHBondContact O-N 3.42Å; I693-Y697 HydrophobicContact CG2-CE2 4.22Å; I693-Y697 WeakPolarHBondContact O-CD2 3.42Å
694	Q	91.4	Very high	90.6	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-65.7	-31.1	-170.9	-65.2	-63.5	-20	0	0	113.5	S674 E684 S685 L688 N690 N691 K696 Y697	S674-Q694 PolarHBondContact OG-OE1 2.96Å; E684-Q694 PolarHBondContact O-NE2 3.26Å; S685-Q694 PolarHBondContact O-NE2 3.34Å; S685-Q694 PolarHBondContact O-OE1 3.43Å; L688-Q694 PolarHBondContact O-NE2 3.04Å; N690-Q694 PolarHBondContact O-N 3.09Å; N691-Q694 PolarHBondContact O-N 2.94Å; Q694-K696 PolarHBondContact O-N 3.18Å; Q694-K696 VanDerWaalsContact O-N 3.1Å; Q694-Y697 PolarHBondContact O-N 3.36Å
695	H	86.3	Confident	90.7	Very high	116 Å²	116	56 Å²	56	54%	0.537	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-12.9	171.9	-79.4	-56	0	0	0	115.1	N691 I693 Y697 S790	N691-H695 VanDerWaalsContact CG-CD2 3.47Å; N691-H695 PolarHBondContact ND2-CD2 2.88Å; N691-H695 VanDerWaalsContact ND2-CD2 3.26Å; N691-H695 PolarHBondContact O-CD2 2.82Å; N691-H695 VanDerWaalsContact O-CD2 3.29Å; N691-H695 PolarHBondContact O-N 3.45Å; N691-H695 PolarHBondContact OD1-CD2 3.05Å; I693-H695 VanDerWaalsContact C-N 3.33Å; I693-H695 PolarHBondContact O-N 3.04Å; H695-Y697 VanDerWaalsContact C-N 3.3Å; H695-S790 PolarHBondContact NE2-O 2.89Å
696	K	88.8	Confident	90.9	Very high	128 Å²	128	55.8 Å²	55.8	56%	0.557	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-18.7	172.4	-54	171.5	-166.4	167	0	112.7	E684 I693 Q694	E684-K696 IonicContact OE1-NZ 3.27Å; E684-K696 PolarHBondContact OE1-NZ 2.96Å; E684-K696 IonicContact OE2-NZ 2.74Å; I693-K696 VanDerWaalsContact O-CB 3.28Å; I693-K696 WeakPolarHBondContact O-CB 3.38Å; I693-K696 VanDerWaalsContact O-CG 3.26Å; I693-K696 WeakPolarHBondContact O-CG 3.48Å; I693-K696 PolarHBondContact O-N 3.42Å; Q694-K696 PolarHBondContact O-N 3.18Å; Q694-K696 VanDerWaalsContact O-N 3.1Å
697	Y	91.8	Very high	90.8	Very high	93 Å²	93	56.8 Å²	56.8	37%	0.365	30%	0.299	S	S	.	.	S	Bend	trans	-115.2	141.1	-167.8	-64.4	-80.7	0	0	0	111.1	S674 E684 I693 Q694 H695	S674-Y697 WeakPolarHBondContact OG-CB 3.43Å; E684-Y697 HydrophobicContact CG-CE2 3.83Å; E684-Y697 VanDerWaalsContact CG-OH 3.3Å; E684-Y697 WeakPolarHBondContact CG-OH 3.49Å; E684-Y697 WeakPolarHBondContact OE1-CE2 3.32Å; E684-Y697 PolarHBondContact OE1-OH 2.98Å; I693-Y697 HydrophobicContact CG2-CE2 4.22Å; I693-Y697 WeakPolarHBondContact O-CD2 3.42Å; Q694-Y697 PolarHBondContact O-N 3.36Å; H695-Y697 VanDerWaalsContact C-N 3.3Å
698	K	92.3	Very high	90.7	Very high	190 Å²	190	62.9 Å²	62.9	83%	0.826	33%	0.332	S	S	*	.			trans	-73.7	146.5	166	-66.7	-174.5	178.2	-177.3	0	109.4	Q675	Q675-K698 PolarHBondContact NE2-O 3.4Å
699	N	94.3	Very high	90.7	Very high	47 Å²	47	64.8 Å²	64.8	25%	0.251	34%	0.341	S	S	.	.			trans	-63	134.6	172.8	-61	-31.9	0	0	0	109.8	S674 R702 D708 N710	S674-N699 CarbonylContact O-C 3.49Å; S674-N699 WeakPolarHBondContact O-CA 3.48Å; N699-R702 VanDerWaalsContact CG-NH2 3.34Å; N699-R702 PolarHBondContact ND2-NH2 3.07Å; N699-R702 VanDerWaalsContact ND2-NH2 3.17Å; N699-D708 WeakPolarHBondContact ND2-CA 3.29Å; N699-D708 PolarHBondContact ND2-O 3.17Å; N699-D708 PolarHBondContact ND2-OD1 3.08Å; N699-D708 VanDerWaalsContact ND2-OD1 3.13Å; N699-N710 PolarHBondContact OD1-ND2 3.43Å; N699-N710 PolarHBondContact OD1-OD1 2.71Å; N699-N710 VanDerWaalsContact OD1-OD1 3.11Å
700	G	90.8	Very high	90.9	Very high	24 Å²	24	65 Å²	65	25%	0.247	34%	0.341	C	S	.	.			trans	-87.3	-162.1	-179.2	0	0	0	0	0	113.7	S674 R702	S674-G700 PolarHBondContact O-N 2.75Å; G700-R702 PolarHBondContact O-N 2.96Å
701	P	90.1	Very high	91.4	Very high	117 Å²	117	64 Å²	64	76%	0.76	34%	0.337	S	S	*	.	S	Bend	trans	-76.8	47.8	-176.7	34.8	-38	0	0	0	113
702	R	93.7	Very high	91.9	Very high	28 Å²	28	63.9 Å²	63.9	11%	0.106	33%	0.334	C	S	.	.			trans	-88.5	173.8	177.3	72	-174.1	-165.4	177.1	1.2	111.1	C673 E676 N699 G700 L706 P707 N710	C673-R702 PolarHBondContact O-NH1 3.43Å; E676-R702 HydrophobicContact CG-CB 4.18Å; N699-R702 VanDerWaalsContact CG-NH2 3.34Å; N699-R702 PolarHBondContact ND2-NH2 3.07Å; N699-R702 VanDerWaalsContact ND2-NH2 3.17Å; G700-R702 PolarHBondContact O-N 2.96Å; R702-L706 HydrophobicContact CB-CD1 4.38Å; R702-L706 HydrophobicContact CG-CD1 4.21Å; R702-P707 PolarHBondContact NH2-O 2.93Å; R702-N710 PolarHBondContact NH1-OD1 3.21Å; R702-N710 PolarHBondContact NH2-OD1 2.79Å
703	S	94.8	Very high	92.8	Very high	41 Å²	41	62.9 Å²	62.9	29%	0.287	33%	0.327	S	S	.	.			trans	-65.5	134.8	177.6	-172.6	0	0	0	0	113.3	K705 L706	S703-K705 PolarHBondContact O-N 2.79Å; S703-K705 VanDerWaalsContact O-N 3.1Å; S703-K705 PolarHBondContact OG-N 3.33Å; S703-L706 WeakPolarHBondContact O-CB 3.22Å; S703-L706 PolarHBondContact O-N 2.88Å
704	S	93.4	Very high	93.5	Very high	122 Å²	122	65.2 Å²	65.2	85%	0.853	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-3.6	170	52.8	0	0	0	0	114.7
705	K	94.1	Very high	93.7	Very high	132 Å²	132	68.5 Å²	68.5	57%	0.574	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-9.8	167.4	-65.4	-168.3	173.7	-164.1	0	113.2	Y642 S703	Y642-K705 HydrophobicContact CD2-CB 3.86Å; Y642-K705 HydrophobicContact CE1-CB 4.43Å; Y642-K705 HydrophobicContact CE1-CD 3.88Å; Y642-K705 HydrophobicContact CE2-CB 3.42Å; Y642-K705 VanDerWaalsContact CE2-CB 3.42Å; Y642-K705 HydrophobicContact CE2-CD 4.23Å; Y642-K705 HydrophobicContact CE2-CG 4.47Å; S703-K705 PolarHBondContact O-N 2.79Å; S703-K705 VanDerWaalsContact O-N 3.1Å; S703-K705 PolarHBondContact OG-N 3.33Å
706	L	95.7	Very high	94.2	Very high	7 Å²	7	66.9 Å²	66.9	4%	0.037	34%	0.343	C	S	.	.	S	Bend	trans	-89.9	139.2	171.9	-66.2	172.1	0	0	0	110.6	I641 Y642 T644 F672 R702 S703	I641-L706 HydrophobicContact CG2-CD2 4.05Å; Y642-L706 HydrophobicContact CD2-CD2 3.82Å; Y642-L706 HydrophobicContact CD2-CG 3.9Å; Y642-L706 HydrophobicContact CE2-CD2 4.48Å; T644-L706 HydrophobicContact CG2-CD1 3.94Å; T644-L706 WeakPolarHBondContact OG1-CD1 3.19Å; F672-L706 HydrophobicContact CD1-CD2 3.81Å; F672-L706 HydrophobicContact CD2-CD2 4.41Å; F672-L706 HydrophobicContact CE1-CD2 3.64Å; F672-L706 HydrophobicContact CE2-CD2 4.24Å; F672-L706 HydrophobicContact CG-CD2 4.22Å; F672-L706 HydrophobicContact CZ-CD2 3.86Å; R702-L706 HydrophobicContact CB-CD1 4.38Å; R702-L706 HydrophobicContact CG-CD1 4.21Å; S703-L706 WeakPolarHBondContact O-CB 3.22Å; S703-L706 PolarHBondContact O-N 2.88Å
707	P	94.6	Very high	94.7	Very high	33 Å²	33	60.8 Å²	60.8	21%	0.214	32%	0.317	C	S	.	.			trans	-74	139.3	-178.5	30.8	-33.4	0	0	0	110.7	R702 E709 N710 M711	R702-P707 PolarHBondContact NH2-O 2.93Å; P707-E709 HydrophobicContact CB-CG 4.45Å; P707-E709 PolarHBondContact O-N 2.9Å; P707-N710 PolarHBondContact O-N 2.9Å; P707-N710 PolarHBondContact O-OD1 2.97Å; P707-M711 WeakPolarHBondContact CG-O 3.47Å
708	D	92.7	Very high	94.9	Very high	131 Å²	131	57.9 Å²	57.9	70%	0.701	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-28.7	-178	-78.6	-51.2	0	0	0	114	N699 N710	N699-D708 WeakPolarHBondContact ND2-CA 3.29Å; N699-D708 PolarHBondContact ND2-O 3.17Å; N699-D708 PolarHBondContact ND2-OD1 3.08Å; N699-D708 VanDerWaalsContact ND2-OD1 3.13Å; D708-N710 PolarHBondContact O-N 3.03Å; D708-N710 PolarHBondContact O-OD1 3.07Å
709	E	93.1	Very high	95.1	Very high	56 Å²	56	52.7 Å²	52.7	26%	0.262	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	7	173.2	66.8	170.4	-159.3	0	0	114.5	P707 M711 T791 S792	P707-E709 HydrophobicContact CB-CG 4.45Å; P707-E709 PolarHBondContact O-N 2.9Å; E709-M711 VanDerWaalsContact C-N 3.26Å; E709-M711 PolarHBondContact O-N 2.98Å; E709-M711 VanDerWaalsContact O-N 3.15Å; E709-T791 HydrophobicContact CB-CG2 3.99Å; E709-T791 HydrophobicContact CG-CG2 4.41Å; E709-T791 WeakPolarHBondContact O-CG2 3.41Å; E709-T791 WeakPolarHBondContact OE2-CA 3.47Å; E709-T791 WeakPolarHBondContact OE2-CB 3.35Å; E709-S792 WeakPolarHBondContact OE1-CB 3.47Å; E709-S792 PolarHBondContact OE1-N 3.33Å; E709-S792 PolarHBondContact OE1-OG 2.83Å; E709-S792 PolarHBondContact OE2-N 3.33Å
710	N	96	Very high	95.3	Very high	6 Å²	6	51.1 Å²	51.1	3%	0.032	28%	0.282	C	S	.	.	S	Bend	trans	60.9	24.6	169	-62.8	-21.6	0	0	0	115.7	R671 F672 N699 R702 P707 D708	R671-N710 CarbonylContact C-O 3.56Å; R671-N710 WeakPolarHBondContact CA-O 3.13Å; F672-N710 HydrophobicContact CB-CB 4.4Å; F672-N710 PolarHBondContact N-O 3.16Å; N699-N710 PolarHBondContact OD1-ND2 3.43Å; N699-N710 PolarHBondContact OD1-OD1 2.71Å; N699-N710 VanDerWaalsContact OD1-OD1 3.11Å; R702-N710 PolarHBondContact NH1-OD1 3.21Å; R702-N710 PolarHBondContact NH2-OD1 2.79Å; P707-N710 PolarHBondContact O-N 2.9Å; P707-N710 PolarHBondContact O-OD1 2.97Å; D708-N710 PolarHBondContact O-N 3.03Å; D708-N710 PolarHBondContact O-OD1 3.07Å
711	M	96.9	Very high	95.6	Very high	1 Å²	1	50 Å²	50	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	140.3	175.7	-61.7	-168.5	-168.1	0	0	113.8	Y669 L670 N691 P707 E709 T791 V793 T794	Y669-M711 HydrophobicContact CD2-CG 4.37Å; Y669-M711 HydrophobicContact CD2-SD 3.62Å; Y669-M711 HydrophobicContact CE2-CE 4.09Å; Y669-M711 HydrophobicContact CE2-SD 3.61Å; L670-M711 VanDerWaalsContact O-CA 3.23Å; L670-M711 WeakPolarHBondContact O-CA 3.31Å; L670-M711 WeakPolarHBondContact O-CB 3.4Å; N691-M711 HydrophobicContact CB-CE 3.83Å; N691-M711 VanDerWaalsContact ND2-CE 3.32Å; N691-M711 WeakPolarHBondContact ND2-CE 3.16Å; N691-M711 WeakPolarHBondContact OD1-CE 3.5Å; P707-M711 WeakPolarHBondContact CG-O 3.47Å; E709-M711 VanDerWaalsContact C-N 3.26Å; E709-M711 PolarHBondContact O-N 2.98Å; E709-M711 VanDerWaalsContact O-N 3.15Å; M711-T791 HydrophobicContact CE-CG2 3.68Å; M711-T791 HydrophobicContact CG-CG2 4.16Å; M711-T791 HydrophobicContact SD-CG2 3.81Å; M711-T791 PolarHBondContact SD-OG1 3.38Å; M711-V793 HydrophobicContact CB-CB 4.24Å; M711-V793 HydrophobicContact CB-CG2 4.22Å; M711-T794 HydrophobicContact CE-CG2 4.11Å; M711-T794 HydrophobicContact SD-CG2 3.62Å
712	W	97.2	Very high	95.9	Very high	20 Å²	20	47.9 Å²	47.9	8%	0.076	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	151.6	165.7	-90.2	-6.6	0	0	0	110.6	I641 Y642 Y669 L670 F672 Q716 W720	I641-W712 HydrophobicContact CD1-CE3 4.28Å; I641-W712 HydrophobicContact CD1-CZ3 3.95Å; I641-W712 HydrophobicContact CG2-CH2 3.66Å; I641-W712 HydrophobicContact CG2-CZ3 3.7Å; Y642-W712 AromaticContact CE2-CH2 3.82Å; Y642-W712 HydrophobicContact CE2-CH2 3.82Å; Y642-W712 HydrophobicContact CE2-CZ2 4.04Å; Y669-W712 CarbonylContact C-O 2.96Å; Y669-W712 WeakPolarHBondContact CA-O 3.21Å; Y669-W712 WeakPolarHBondContact CB-O 3.42Å; L670-W712 HydrophobicContact CB-CB 4.12Å; L670-W712 HydrophobicContact CD2-CB 4.47Å; L670-W712 HydrophobicContact CD2-CE3 4.25Å; L670-W712 PolarHBondContact N-O 3.04Å; L670-W712 PolarHBondContact O-N 3.19Å; F672-W712 HydrophobicContact CE2-CB 3.81Å; F672-W712 AromaticContact CE2-CD2 3.88Å; F672-W712 HydrophobicContact CE2-CD2 3.88Å; F672-W712 HydrophobicContact CE2-CE3 4.34Å; F672-W712 AromaticContact CE2-CG 3.65Å; F672-W712 HydrophobicContact CE2-CG 3.65Å; F672-W712 HydrophobicContact CZ-CB 4.26Å; F672-W712 AromaticContact CZ-CD2 3.72Å; F672-W712 HydrophobicContact CZ-CD2 3.72Å; F672-W712 AromaticContact CZ-CE3 3.73Å; F672-W712 HydrophobicContact CZ-CE3 3.73Å; F672-W712 AromaticContact CZ-CG 3.99Å; F672-W712 HydrophobicContact CZ-CG 3.99Å; F672-W712 HydrophobicContact CZ-CZ3 4.34Å; W712-Q716 VanDerWaalsContact CA-OE1 3.23Å; W712-Q716 HydrophobicContact CB-CB 4.02Å; W712-Q716 VanDerWaalsContact CD1-OE1 3.25Å; W712-Q716 HydrophobicContact CD2-CB 3.98Å; W712-Q716 HydrophobicContact CE3-CB 4.39Å; W712-Q716 HydrophobicContact CG-CB 3.8Å; W712-W720 HydrophobicContact CH2-CB 4.01Å; W712-W720 AromaticContact CH2-CD1 3.93Å; W712-W720 HydrophobicContact CH2-CG 4.04Å; W712-W720 HydrophobicContact CZ3-CB 3.69Å; W712-W720 AromaticContact CZ3-CG 3.86Å; W712-W720 HydrophobicContact CZ3-CG 3.86Å
713	T	97.7	Very high	96	Very high	26 Å²	26	52.1 Å²	52.1	16%	0.16	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	165.8	163	81.8	0	0	0	0	111.1	E715 Q716 F717 V793 Y797	T713-E715 VanDerWaalsContact C-N 3.29Å; T713-E715 WeakPolarHBondContact CB-OE2 3.21Å; T713-E715 PolarHBondContact O-N 3.1Å; T713-E715 PolarHBondContact OG1-N 3.08Å; T713-E715 PolarHBondContact OG1-OE2 3.18Å; T713-Q716 PolarHBondContact O-N 2.96Å; T713-Q716 PolarHBondContact OG1-N 3.22Å; T713-F717 PolarHBondContact O-N 2.9Å; T713-V793 HydrophobicContact CG2-CG1 4.19Å; T713-V793 HydrophobicContact CG2-CG2 4.03Å; T713-Y797 WeakPolarHBondContact CB-OH 3.44Å; T713-Y797 HydrophobicContact CG2-CE2 4.29Å
714	W	96.9	Very high	95.9	Very high	51 Å²	51	54.4 Å²	54.4	19%	0.193	28%	0.282	C	S	.	.	H	α-helix	trans	-69.3	-28.5	174.2	76.3	-86.5	0	0	0	112.1	D667 C668 F717 Q718 W730 Y797	D667-W714 PolarHBondContact OD1-NE1 2.96Å; D667-W714 VanDerWaalsContact OD1-NE1 3.1Å; C668-W714 PolarHBondContact O-N 2.78Å; W714-F717 PolarHBondContact O-N 3.31Å; W714-Q718 HydrophobicContact CE3-CB 4.36Å; W714-Q718 HydrophobicContact CZ3-CB 4.36Å; W714-Q718 HydrophobicContact CZ3-CG 4.48Å; W714-Q718 WeakPolarHBondContact O-CB 3.28Å; W714-Q718 PolarHBondContact O-N 3.18Å; W714-W730 HydrophobicContact CB-CH2 4.48Å; W714-W730 HydrophobicContact CB-CZ2 4.04Å; W714-W730 AromaticContact CE3-CD1 3.73Å; W714-W730 AromaticContact CE3-CE2 3.81Å; W714-W730 HydrophobicContact CE3-CZ2 4.32Å; W714-W730 AromaticContact CE3-NE1 3.16Å; W714-W730 HydrophobicContact CG-CZ2 4.46Å; W714-W730 AromaticContact CZ3-CD1 3.71Å; W714-W730 AromaticContact CZ3-NE1 3.48Å; W714-Y797 VanDerWaalsContact CD1-OH 3.31Å
715	E	96.5	Very high	96	Very high	69 Å²	69	51 Å²	51	32%	0.322	27%	0.266	S	S	.	.	H	α-helix	trans	-65.4	-40.5	173.8	-54	86	171.3	0	0	111	T713 F717 Q718 T719 Y797	T713-E715 VanDerWaalsContact C-N 3.29Å; T713-E715 WeakPolarHBondContact CB-OE2 3.21Å; T713-E715 PolarHBondContact O-N 3.1Å; T713-E715 PolarHBondContact OG1-N 3.08Å; T713-E715 PolarHBondContact OG1-OE2 3.18Å; E715-F717 VanDerWaalsContact C-N 3.33Å; E715-F717 PolarHBondContact O-N 2.76Å; E715-Q718 WeakPolarHBondContact O-CB 3.32Å; E715-Q718 PolarHBondContact O-N 2.65Å; E715-Q718 VanDerWaalsContact O-N 3.17Å; E715-T719 PolarHBondContact O-N 3.12Å; E715-T719 PolarHBondContact O-OG1 3Å; E715-Y797 PolarHBondContact OE1-OH 3.07Å; E715-Y797 PolarHBondContact OE2-OH 3.43Å
716	Q	97.7	Very high	96	Very high	82 Å²	82	48.4 Å²	48.4	38%	0.383	26%	0.256	S	S	.	.	H	α-helix	trans	-62.1	-40.3	174.7	-71.2	173.6	-45.9	0	0	111.7	W712 T713 T719 W720	W712-Q716 VanDerWaalsContact CA-OE1 3.23Å; W712-Q716 HydrophobicContact CB-CB 4.02Å; W712-Q716 VanDerWaalsContact CD1-OE1 3.25Å; W712-Q716 HydrophobicContact CD2-CB 3.98Å; W712-Q716 HydrophobicContact CE3-CB 4.39Å; W712-Q716 HydrophobicContact CG-CB 3.8Å; T713-Q716 PolarHBondContact O-N 2.96Å; T713-Q716 PolarHBondContact OG1-N 3.22Å; Q716-T719 PolarHBondContact O-N 3.09Å; Q716-W720 PolarHBondContact O-N 3.21Å
717	F	97.6	Very high	95.9	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-66.3	-37.8	172.9	-178.2	-129.2	0	0	0	112.7	L639 I641 F646 I648 L670 T713 W714 E715 W720 L721 W730 I734 L769	L639-F717 HydrophobicContact CD2-CE2 4.49Å; L639-F717 HydrophobicContact CD2-CZ 4.36Å; I641-F717 HydrophobicContact CD1-CD2 3.83Å; I641-F717 HydrophobicContact CD1-CE2 3.93Å; F646-F717 HydrophobicContact CE2-CE2 4.43Å; F646-F717 AromaticContact CZ-CE2 3.97Å; F646-F717 HydrophobicContact CZ-CE2 3.97Å; F646-F717 HydrophobicContact CZ-CZ 4.18Å; I648-F717 HydrophobicContact CD1-CE1 4.24Å; L670-F717 HydrophobicContact CD1-CB 3.81Å; L670-F717 HydrophobicContact CD1-CD1 4.26Å; L670-F717 HydrophobicContact CD1-CG 4.11Å; L670-F717 HydrophobicContact CD2-CB 3.8Å; L670-F717 HydrophobicContact CD2-CD1 4.49Å; L670-F717 HydrophobicContact CD2-CD2 3.79Å; L670-F717 HydrophobicContact CD2-CG 3.78Å; L670-F717 HydrophobicContact CG-CB 4.5Å; T713-F717 PolarHBondContact O-N 2.9Å; W714-F717 PolarHBondContact O-N 3.31Å; E715-F717 VanDerWaalsContact C-N 3.33Å; E715-F717 PolarHBondContact O-N 2.76Å; F717-W720 AromaticContact CD2-CE3 3.93Å; F717-W720 HydrophobicContact CD2-CE3 3.93Å; F717-W720 AromaticContact CE2-CE3 3.71Å; F717-W720 HydrophobicContact CE2-CE3 3.71Å; F717-W720 AromaticContact CE2-CZ3 3.88Å; F717-W720 HydrophobicContact CE2-CZ3 3.88Å; F717-W720 PolarHBondContact O-N 3.38Å; F717-L721 HydrophobicContact CD1-CD1 4.16Å; F717-L721 HydrophobicContact CD2-CG 4.34Å; F717-L721 HydrophobicContact CE1-CD1 3.8Å; F717-L721 HydrophobicContact CE1-CG 4.4Å; F717-L721 HydrophobicContact CE2-CD1 4.32Å; F717-L721 HydrophobicContact CE2-CD2 4.16Å; F717-L721 HydrophobicContact CE2-CG 4.04Å; F717-L721 HydrophobicContact CZ-CD1 3.89Å; F717-L721 HydrophobicContact CZ-CD2 4.14Å; F717-L721 HydrophobicContact CZ-CG 4.07Å; F717-L721 WeakPolarHBondContact O-CB 3.21Å; F717-L721 WeakPolarHBondContact O-CG 3.43Å; F717-L721 PolarHBondContact O-N 3.46Å; F717-W730 HydrophobicContact CD1-CE3 4.03Å; F717-W730 HydrophobicContact CD1-CZ3 4.1Å; F717-W730 AromaticContact CE1-CE3 4Å; F717-W730 HydrophobicContact CE1-CE3 4Å; F717-W730 HydrophobicContact CE1-CZ3 4.1Å; F717-I734 HydrophobicContact CE1-CD1 4.11Å; F717-I734 HydrophobicContact CZ-CD1 4.33Å; F717-L769 HydrophobicContact CZ-CD2 4.44Å
718	Q	97	Very high	95.9	Very high	33 Å²	33	53.9 Å²	53.9	15%	0.154	29%	0.287	C	S	.	.	H	α-helix	trans	-64.9	-37.6	174.3	173.3	64	97.6	0	0	112.2	W714 E715 T722 P727	W714-Q718 HydrophobicContact CE3-CB 4.36Å; W714-Q718 HydrophobicContact CZ3-CB 4.36Å; W714-Q718 HydrophobicContact CZ3-CG 4.48Å; W714-Q718 WeakPolarHBondContact O-CB 3.28Å; W714-Q718 PolarHBondContact O-N 3.18Å; E715-Q718 WeakPolarHBondContact O-CB 3.32Å; E715-Q718 PolarHBondContact O-N 2.65Å; E715-Q718 VanDerWaalsContact O-N 3.17Å; Q718-T722 PolarHBondContact O-N 3.38Å; Q718-T722 PolarHBondContact O-OG1 2.9Å; Q718-P727 PolarHBondContact NE2-O 2.66Å
719	T	97.5	Very high	96.1	Very high	81 Å²	81	48.5 Å²	48.5	50%	0.497	26%	0.258	S	S	.	.	H	α-helix	trans	-64.1	-48.6	171	-61.4	0	0	0	0	110.5	E715 Q716 L721 T722 E723	E715-T719 PolarHBondContact O-N 3.12Å; E715-T719 PolarHBondContact O-OG1 3Å; Q716-T719 PolarHBondContact O-N 3.09Å; T719-L721 VanDerWaalsContact C-N 3.33Å; T719-L721 PolarHBondContact O-N 2.99Å; T719-T722 CarbonylContact O-C 3.5Å; T719-T722 WeakPolarHBondContact O-CA 3.33Å; T719-T722 VanDerWaalsContact O-CB 3.26Å; T719-T722 WeakPolarHBondContact O-CB 3.45Å; T719-T722 PolarHBondContact O-N 3.45Å; T719-E723 PolarHBondContact O-N 3.15Å
720	W	97.3	Very high	96.2	Very high	14 Å²	14	45.9 Å²	45.9	5%	0.053	25%	0.246	C	C	.	.	H	α-helix	trans	-59.2	-40.6	176.7	-179.1	80.6	0	0	0	113	L639 I641 Y642 W712 Q716 F717 T722 E723 Q724	L639-W720 HydrophobicContact CD1-CH2 4.3Å; L639-W720 HydrophobicContact CD2-CZ3 4.35Å; I641-W720 HydrophobicContact CD1-CD2 4.47Å; I641-W720 HydrophobicContact CD1-CE3 4.32Å; I641-W720 HydrophobicContact CG1-CD2 4.11Å; I641-W720 HydrophobicContact CG1-CE3 4.13Å; I641-W720 HydrophobicContact CG1-CH2 3.96Å; I641-W720 HydrophobicContact CG1-CZ2 3.94Å; I641-W720 HydrophobicContact CG1-CZ3 4.06Å; Y642-W720 AromaticContact CZ-CD1 3.9Å; Y642-W720 AromaticContact CZ-NE1 3.91Å; W712-W720 HydrophobicContact CH2-CB 4.01Å; W712-W720 AromaticContact CH2-CD1 3.93Å; W712-W720 HydrophobicContact CH2-CG 4.04Å; W712-W720 HydrophobicContact CZ3-CB 3.69Å; W712-W720 AromaticContact CZ3-CG 3.86Å; W712-W720 HydrophobicContact CZ3-CG 3.86Å; Q716-W720 PolarHBondContact O-N 3.21Å; F717-W720 AromaticContact CD2-CE3 3.93Å; F717-W720 HydrophobicContact CD2-CE3 3.93Å; F717-W720 AromaticContact CE2-CE3 3.71Å; F717-W720 HydrophobicContact CE2-CE3 3.71Å; F717-W720 AromaticContact CE2-CZ3 3.88Å; F717-W720 HydrophobicContact CE2-CZ3 3.88Å; F717-W720 PolarHBondContact O-N 3.38Å; W720-T722 VanDerWaalsContact C-N 3.29Å; W720-T722 PolarHBondContact O-N 3.14Å; W720-E723 WeakPolarHBondContact O-CB 3.36Å; W720-E723 PolarHBondContact O-N 3.03Å; W720-Q724 HydrophobicContact CD2-CG 4.02Å; W720-Q724 HydrophobicContact CE3-CG 4.1Å; W720-Q724 HydrophobicContact CH2-CG 3.73Å; W720-Q724 HydrophobicContact CZ2-CG 3.63Å; W720-Q724 HydrophobicContact CZ3-CG 3.96Å; W720-Q724 WeakPolarHBondContact O-CG 3.24Å; W720-Q724 PolarHBondContact O-N 2.91Å; W720-Q724 PolarHBondContact O-NE2 3.4Å
721	L	96.5	Very high	96.2	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-62.8	-35.2	172.6	-74.6	176.8	0	0	0	112.2	F717 T719 Q724 G725 Q726 L729 W730 I734 Y774	F717-L721 HydrophobicContact CD1-CD1 4.16Å; F717-L721 HydrophobicContact CD2-CG 4.34Å; F717-L721 HydrophobicContact CE1-CD1 3.8Å; F717-L721 HydrophobicContact CE1-CG 4.4Å; F717-L721 HydrophobicContact CE2-CD1 4.32Å; F717-L721 HydrophobicContact CE2-CD2 4.16Å; F717-L721 HydrophobicContact CE2-CG 4.04Å; F717-L721 HydrophobicContact CZ-CD1 3.89Å; F717-L721 HydrophobicContact CZ-CD2 4.14Å; F717-L721 HydrophobicContact CZ-CG 4.07Å; F717-L721 WeakPolarHBondContact O-CB 3.21Å; F717-L721 WeakPolarHBondContact O-CG 3.43Å; F717-L721 PolarHBondContact O-N 3.46Å; T719-L721 VanDerWaalsContact C-N 3.33Å; T719-L721 PolarHBondContact O-N 2.99Å; L721-Q724 PolarHBondContact O-N 3.24Å; L721-G725 PolarHBondContact O-N 3.48Å; L721-Q726 CarbonylContact O-C 3.5Å; L721-Q726 WeakPolarHBondContact O-CA 3.19Å; L721-Q726 WeakPolarHBondContact O-CB 3.26Å; L721-Q726 PolarHBondContact O-N 2.96Å; L721-L729 HydrophobicContact CD2-CD2 4Å; L721-W730 HydrophobicContact CD1-CB 4.24Å; L721-I734 HydrophobicContact CD1-CD1 3.82Å; L721-Y774 HydrophobicContact CD2-CD1 4.48Å; L721-Y774 HydrophobicContact CD2-CE1 4.03Å
722	T	96.9	Very high	96.1	Very high	72 Å²	72	56.3 Å²	56.3	44%	0.442	30%	0.3	S	S	.	.	H	α-helix	trans	-66.1	-41.7	173.3	-54.4	0	0	0	0	111.1	Q718 T719 W720 Q724 G725 P727	Q718-T722 PolarHBondContact O-N 3.38Å; Q718-T722 PolarHBondContact O-OG1 2.9Å; T719-T722 CarbonylContact O-C 3.5Å; T719-T722 WeakPolarHBondContact O-CA 3.33Å; T719-T722 VanDerWaalsContact O-CB 3.26Å; T719-T722 WeakPolarHBondContact O-CB 3.45Å; T719-T722 PolarHBondContact O-N 3.45Å; W720-T722 VanDerWaalsContact C-N 3.29Å; W720-T722 PolarHBondContact O-N 3.14Å; T722-Q724 VanDerWaalsContact C-N 3.29Å; T722-Q724 PolarHBondContact O-N 3.02Å; T722-G725 PolarHBondContact O-N 3.23Å; T722-P727 HydrophobicContact CG2-CB 4.27Å
723	E	95.7	Very high	96	Very high	117 Å²	117	59.8 Å²	59.8	55%	0.547	32%	0.316	S	S	.	.	H	α-helix	trans	-60.7	-34.7	171.8	-64.8	175.8	-168.5	0	0	112.6	T719 W720 G725	T719-E723 PolarHBondContact O-N 3.15Å; W720-E723 WeakPolarHBondContact O-CB 3.36Å; W720-E723 PolarHBondContact O-N 3.03Å; E723-G725 PolarHBondContact O-N 2.79Å
724	Q	93.7	Very high	96	Very high	90 Å²	90	58.6 Å²	58.6	42%	0.421	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	5.8	173.5	-56.2	-35.3	-76.2	0	0	113.3	W720 L721 T722	W720-Q724 HydrophobicContact CD2-CG 4.02Å; W720-Q724 HydrophobicContact CE3-CG 4.1Å; W720-Q724 HydrophobicContact CH2-CG 3.73Å; W720-Q724 HydrophobicContact CZ2-CG 3.63Å; W720-Q724 HydrophobicContact CZ3-CG 3.96Å; W720-Q724 WeakPolarHBondContact O-CG 3.24Å; W720-Q724 PolarHBondContact O-N 2.91Å; W720-Q724 PolarHBondContact O-NE2 3.4Å; L721-Q724 PolarHBondContact O-N 3.24Å; T722-Q724 VanDerWaalsContact C-N 3.29Å; T722-Q724 PolarHBondContact O-N 3.02Å
725	G	95.2	Very high	96	Very high	50 Å²	50	57.6 Å²	57.6	52%	0.515	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.8	27.1	-178.2	0	0	0	0	0	114	L721 T722 E723	L721-G725 PolarHBondContact O-N 3.48Å; T722-G725 PolarHBondContact O-N 3.23Å; E723-G725 PolarHBondContact O-N 2.79Å
726	Q	93.7	Very high	96	Very high	78 Å²	78	56.3 Å²	56.3	36%	0.364	30%	0.304	S	S	.	.			trans	-124.4	49.6	-177	-63.9	-62.1	-61.5	0	0	112.8	L721 N728 L729	L721-Q726 CarbonylContact O-C 3.5Å; L721-Q726 WeakPolarHBondContact O-CA 3.19Å; L721-Q726 WeakPolarHBondContact O-CB 3.26Å; L721-Q726 PolarHBondContact O-N 2.96Å; Q726-N728 PolarHBondContact O-N 3.47Å; Q726-L729 HydrophobicContact CB-CB 3.98Å; Q726-L729 HydrophobicContact CB-CD2 4Å; Q726-L729 HydrophobicContact CG-CD2 4.33Å; Q726-L729 VanDerWaalsContact O-CB 3.3Å; Q726-L729 WeakPolarHBondContact O-CB 3.44Å; Q726-L729 PolarHBondContact O-N 2.69Å
727	P	93.9	Very high	96	Very high	63 Å²	63	54 Å²	54	41%	0.409	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-40.4	-168.1	23	-34.5	0	0	0	114.4	Q718 T722	Q718-P727 PolarHBondContact NE2-O 2.66Å; T722-P727 HydrophobicContact CG2-CB 4.27Å
728	N	95.1	Very high	96	Very high	92 Å²	92	54 Å²	54	49%	0.492	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-7	-175.5	-62.3	8.3	0	0	0	113.9	Q726 W730 T731 E732	Q726-N728 PolarHBondContact O-N 3.47Å; N728-W730 VanDerWaalsContact C-N 3.28Å; N728-W730 PolarHBondContact O-N 3.2Å; N728-T731 PolarHBondContact O-N 3.26Å; N728-T731 VanDerWaalsContact O-N 3.08Å; N728-E732 VanDerWaalsContact CB-CD 3.45Å; N728-E732 HydrophobicContact CB-CG 3.96Å; N728-E732 WeakPolarHBondContact CB-OE1 3.38Å; N728-E732 PolarHBondContact ND2-OE1 2.96Å; N728-E732 PolarHBondContact O-N 3.25Å
729	L	95.5	Very high	96.1	Very high	17 Å²	17	53.6 Å²	53.6	9%	0.089	30%	0.296	C	S	.	.	H	α-helix	trans	-61.3	-34	-164.3	-173.8	72.2	0	0	0	113.6	L721 Q726 K733 I734 Y774	L721-L729 HydrophobicContact CD2-CD2 4Å; Q726-L729 HydrophobicContact CB-CB 3.98Å; Q726-L729 HydrophobicContact CB-CD2 4Å; Q726-L729 HydrophobicContact CG-CD2 4.33Å; Q726-L729 VanDerWaalsContact O-CB 3.3Å; Q726-L729 WeakPolarHBondContact O-CB 3.44Å; Q726-L729 PolarHBondContact O-N 2.69Å; L729-K733 HydrophobicContact CD1-CB 3.98Å; L729-K733 HydrophobicContact CD1-CD 3.63Å; L729-K733 HydrophobicContact CD1-CG 4.46Å; L729-K733 WeakPolarHBondContact O-CB 3.28Å; L729-K733 PolarHBondContact O-N 3.08Å; L729-K733 VanDerWaalsContact O-N 3.07Å; L729-I734 HydrophobicContact CD2-CD1 4.04Å; L729-I734 HydrophobicContact CG-CD1 3.96Å; L729-I734 HydrophobicContact CG-CG1 4.28Å; L729-I734 PolarHBondContact O-N 2.97Å; L729-Y774 HydrophobicContact CD2-CD1 3.5Å; L729-Y774 HydrophobicContact CD2-CD2 3.96Å; L729-Y774 HydrophobicContact CD2-CE1 3.86Å; L729-Y774 HydrophobicContact CD2-CE2 4.29Å; L729-Y774 HydrophobicContact CD2-CG 3.55Å
730	W	96.3	Very high	96	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.008	29%	0.289	C	S	.	.	I	π-helix	trans	-58.8	-54.8	174.1	178.2	-115.3	0	0	0	111.8	I648 C668 W714 F717 L721 N728 I734 Q735 M738	I648-W730 HydrophobicContact CD1-CZ3 4.03Å; C668-W730 WeakPolarHBondContact SG-CH2 3.44Å; W714-W730 HydrophobicContact CB-CH2 4.48Å; W714-W730 HydrophobicContact CB-CZ2 4.04Å; W714-W730 AromaticContact CE3-CD1 3.73Å; W714-W730 AromaticContact CE3-CE2 3.81Å; W714-W730 HydrophobicContact CE3-CZ2 4.32Å; W714-W730 AromaticContact CE3-NE1 3.16Å; W714-W730 HydrophobicContact CG-CZ2 4.46Å; W714-W730 AromaticContact CZ3-CD1 3.71Å; W714-W730 AromaticContact CZ3-NE1 3.48Å; F717-W730 HydrophobicContact CD1-CE3 4.03Å; F717-W730 HydrophobicContact CD1-CZ3 4.1Å; F717-W730 AromaticContact CE1-CE3 4Å; F717-W730 HydrophobicContact CE1-CE3 4Å; F717-W730 HydrophobicContact CE1-CZ3 4.1Å; L721-W730 HydrophobicContact CD1-CB 4.24Å; N728-W730 VanDerWaalsContact C-N 3.28Å; N728-W730 PolarHBondContact O-N 3.2Å; W730-I734 HydrophobicContact CE3-CB 3.88Å; W730-I734 HydrophobicContact CE3-CD1 4.36Å; W730-I734 HydrophobicContact CE3-CG2 3.61Å; W730-I734 HydrophobicContact CZ3-CB 4.3Å; W730-I734 HydrophobicContact CZ3-CG2 3.52Å; W730-I734 PolarHBondContact O-N 3.15Å; W730-Q735 HydrophobicContact CD2-CB 4.42Å; W730-Q735 HydrophobicContact CZ2-CB 4.33Å; W730-Q735 HydrophobicContact CZ2-CG 4.35Å; W730-Q735 WeakPolarHBondContact O-CB 3.25Å; W730-Q735 PolarHBondContact O-N 3.13Å; W730-M738 HydrophobicContact CH2-CE 4.49Å; W730-M738 HydrophobicContact CH2-SD 4.21Å; W730-M738 HydrophobicContact CZ3-SD 4.21Å
731	T	95.4	Very high	96	Very high	89 Å²	89	52.2 Å²	52.2	55%	0.546	29%	0.287	S	S	.	.	I	π-helix	trans	-74.4	-38.3	-174.1	-55.6	0	0	0	0	112.9	N728 P736	N728-T731 PolarHBondContact O-N 3.26Å; N728-T731 VanDerWaalsContact O-N 3.08Å; T731-P736 WeakPolarHBondContact O-CD 3.3Å; T731-P736 WeakPolarHBondContact O-CG 3.3Å
732	E	95.1	Very high	96	Very high	136 Å²	136	52.2 Å²	52.2	64%	0.636	29%	0.287	S	S	*	.	I	π-helix	trans	-84.4	-29.1	-177	-71.4	178.5	-168.4	0	0	113.6	N728	N728-E732 VanDerWaalsContact CB-CD 3.45Å; N728-E732 HydrophobicContact CB-CG 3.96Å; N728-E732 WeakPolarHBondContact CB-OE1 3.38Å; N728-E732 PolarHBondContact ND2-OE1 2.96Å; N728-E732 PolarHBondContact O-N 3.25Å
733	K	95	Very high	95.9	Very high	94 Å²	94	49.6 Å²	49.6	41%	0.409	27%	0.27	S	S	.	.	I	π-helix	trans	-128.1	-57.5	-169.1	-165.5	-176	-168.4	176.6	0	114.1	L729 A737 D773	L729-K733 HydrophobicContact CD1-CB 3.98Å; L729-K733 HydrophobicContact CD1-CD 3.63Å; L729-K733 HydrophobicContact CD1-CG 4.46Å; L729-K733 WeakPolarHBondContact O-CB 3.28Å; L729-K733 PolarHBondContact O-N 3.08Å; L729-K733 VanDerWaalsContact O-N 3.07Å; K733-A737 WeakPolarHBondContact O-CB 3.45Å; K733-A737 PolarHBondContact O-N 3.15Å; K733-A737 VanDerWaalsContact O-N 3.08Å; K733-D773 WeakPolarHBondContact CE-O 3.37Å; K733-D773 PolarHBondContact NZ-O 3.03Å
734	I	97.3	Very high	95.9	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.252	C	S	.	.	I	π-helix	trans	-69.9	-58.5	-167.3	-60.6	166.9	0	0	0	110.7	F717 L721 L729 W730 A737 M738 L769 I776	F717-I734 HydrophobicContact CE1-CD1 4.11Å; F717-I734 HydrophobicContact CZ-CD1 4.33Å; L721-I734 HydrophobicContact CD1-CD1 3.82Å; L729-I734 HydrophobicContact CD2-CD1 4.04Å; L729-I734 HydrophobicContact CG-CD1 3.96Å; L729-I734 HydrophobicContact CG-CG1 4.28Å; L729-I734 PolarHBondContact O-N 2.97Å; W730-I734 HydrophobicContact CE3-CB 3.88Å; W730-I734 HydrophobicContact CE3-CD1 4.36Å; W730-I734 HydrophobicContact CE3-CG2 3.61Å; W730-I734 HydrophobicContact CZ3-CB 4.3Å; W730-I734 HydrophobicContact CZ3-CG2 3.52Å; W730-I734 PolarHBondContact O-N 3.15Å; I734-A737 PolarHBondContact O-N 2.96Å; I734-M738 HydrophobicContact CG2-SD 3.8Å; I734-M738 WeakPolarHBondContact O-CG 3.45Å; I734-M738 PolarHBondContact O-N 3.13Å; I734-L769 HydrophobicContact CD1-CD2 3.72Å; I734-L769 HydrophobicContact CG1-CD2 3.9Å; I734-L769 HydrophobicContact CG2-CD2 4.09Å; I734-I776 HydrophobicContact CB-CG2 4.43Å; I734-I776 HydrophobicContact CG2-CG2 3.82Å
735	Q	96.9	Very high	95.9	Very high	31 Å²	31	41 Å²	41	15%	0.145	23%	0.231	C	C	.	.	H	α-helix	trans	-63.6	-42.7	-178.2	-164.2	-159	79.8	0	0	112.4	W664 W730 A737 M738 K739	W664-Q735 HydrophobicContact CZ2-CG 4.07Å; W730-Q735 HydrophobicContact CD2-CB 4.42Å; W730-Q735 HydrophobicContact CZ2-CB 4.33Å; W730-Q735 HydrophobicContact CZ2-CG 4.35Å; W730-Q735 WeakPolarHBondContact O-CB 3.25Å; W730-Q735 PolarHBondContact O-N 3.13Å; Q735-A737 VanDerWaalsContact C-N 3.33Å; Q735-A737 PolarHBondContact O-N 3.12Å; Q735-M738 PolarHBondContact O-N 3.5Å; Q735-K739 HydrophobicContact CG-CD 4.35Å; Q735-K739 WeakPolarHBondContact O-CB 3.5Å; Q735-K739 VanDerWaalsContact O-CG 3.32Å; Q735-K739 WeakPolarHBondContact O-CG 3.32Å; Q735-K739 PolarHBondContact O-N 3.14Å
736	P	97.3	Very high	95.9	Very high	42 Å²	42	38.7 Å²	38.7	27%	0.273	21%	0.207	S	C	.	.	H	α-helix	trans	-60.1	-37.4	172.4	-26	36.1	0	0	0	113.7	T731 N740	T731-P736 WeakPolarHBondContact O-CD 3.3Å; T731-P736 WeakPolarHBondContact O-CG 3.3Å; P736-N740 WeakPolarHBondContact O-CB 3.41Å; P736-N740 PolarHBondContact O-N 3.29Å; P736-N740 PolarHBondContact O-ND2 2.76Å
737	A	97	Very high	95.8	Very high	34 Å²	34	36.1 Å²	36.1	28%	0.281	20%	0.196	S	C	.	.	H	α-helix	trans	-70.4	-40.8	178	0	0	0	0	0	111.9	K733 I734 Q735 N740 A741 I776	K733-A737 WeakPolarHBondContact O-CB 3.45Å; K733-A737 PolarHBondContact O-N 3.15Å; K733-A737 VanDerWaalsContact O-N 3.08Å; I734-A737 PolarHBondContact O-N 2.96Å; Q735-A737 VanDerWaalsContact C-N 3.33Å; Q735-A737 PolarHBondContact O-N 3.12Å; A737-N740 PolarHBondContact O-N 3.31Å; A737-A741 WeakPolarHBondContact O-CB 3.41Å; A737-A741 PolarHBondContact O-N 3.34Å; A737-I776 HydrophobicContact CB-CD1 4.31Å; A737-I776 HydrophobicContact CB-CG1 3.47Å; A737-I776 VanDerWaalsContact CB-CG1 3.47Å; A737-I776 HydrophobicContact CB-CG2 4.41Å
738	M	98.4	Very high	95.5	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-61.5	-44.2	173.2	-63.2	161.9	61.2	0	0	111.5	I648 Q650 W664 W730 I734 Q735 N740 A741 V742 F767 I776	I648-M738 HydrophobicContact CG2-CE 3.88Å; Q650-M738 HydrophobicContact CB-CE 3.79Å; Q650-M738 HydrophobicContact CG-CE 4.02Å; W664-M738 HydrophobicContact CH2-CB 3.68Å; W664-M738 HydrophobicContact CZ2-CB 4.27Å; W664-M738 HydrophobicContact CZ2-CE 4.49Å; W730-M738 HydrophobicContact CH2-CE 4.49Å; W730-M738 HydrophobicContact CH2-SD 4.21Å; W730-M738 HydrophobicContact CZ3-SD 4.21Å; I734-M738 HydrophobicContact CG2-SD 3.8Å; I734-M738 WeakPolarHBondContact O-CG 3.45Å; I734-M738 PolarHBondContact O-N 3.13Å; Q735-M738 PolarHBondContact O-N 3.5Å; M738-N740 PolarHBondContact O-N 3.28Å; M738-A741 PolarHBondContact O-N 3Å; M738-V742 PolarHBondContact O-N 2.82Å; M738-V742 VanDerWaalsContact O-N 3.09Å; M738-F767 HydrophobicContact CB-CD2 4.39Å; M738-F767 HydrophobicContact CB-CE1 4.16Å; M738-F767 HydrophobicContact CB-CE2 3.94Å; M738-F767 HydrophobicContact CB-CZ 3.81Å; M738-F767 HydrophobicContact CE-CD2 3.69Å; M738-F767 HydrophobicContact CE-CE2 4.03Å; M738-F767 HydrophobicContact CE-CG 4.31Å; M738-F767 HydrophobicContact CG-CD1 4.07Å; M738-F767 HydrophobicContact CG-CD2 4.1Å; M738-F767 HydrophobicContact CG-CE1 4.15Å; M738-F767 HydrophobicContact CG-CE2 4.14Å; M738-F767 HydrophobicContact CG-CG 4.05Å; M738-F767 HydrophobicContact CG-CZ 4.17Å; M738-I776 HydrophobicContact CG-CB 4.18Å; M738-I776 HydrophobicContact CG-CD1 4.44Å; M738-I776 HydrophobicContact CG-CG1 4.26Å; M738-I776 HydrophobicContact CG-CG2 3.99Å
739	K	98.1	Very high	95.3	Very high	23 Å²	23	28.9 Å²	28.9	10%	0.1	15%	0.154	C	C	.	.	H	α-helix	trans	-56.1	-47.3	174.7	-78.8	171	171.8	177.7	0	112.2	W664 Q735 L743 E824 L826	W664-K739 HydrophobicContact CD2-CD 4.34Å; W664-K739 HydrophobicContact CD2-CG 3.61Å; W664-K739 HydrophobicContact CE3-CG 3.68Å; W664-K739 HydrophobicContact CG-CG 4.29Å; W664-K739 HydrophobicContact CH2-CB 4.33Å; W664-K739 HydrophobicContact CH2-CG 3.65Å; W664-K739 HydrophobicContact CZ2-CD 4.49Å; W664-K739 HydrophobicContact CZ2-CG 3.62Å; W664-K739 HydrophobicContact CZ3-CB 4.26Å; W664-K739 HydrophobicContact CZ3-CG 3.7Å; Q735-K739 HydrophobicContact CG-CD 4.35Å; Q735-K739 WeakPolarHBondContact O-CB 3.5Å; Q735-K739 VanDerWaalsContact O-CG 3.32Å; Q735-K739 WeakPolarHBondContact O-CG 3.32Å; Q735-K739 PolarHBondContact O-N 3.14Å; K739-L743 WeakPolarHBondContact O-CB 3.35Å; K739-L743 PolarHBondContact O-N 3.18Å; K739-E824 WeakPolarHBondContact CE-OE1 3.11Å; K739-E824 IonicContact NZ-OE1 2.73Å; K739-E824 PolarHBondContact NZ-OE1 3.22Å; K739-E824 IonicContact NZ-OE2 2.67Å; K739-L826 HydrophobicContact CB-CD1 3.9Å; K739-L826 HydrophobicContact CB-CD2 4.31Å; K739-L826 HydrophobicContact CD-CD1 4.07Å; K739-L826 HydrophobicContact CG-CD1 3.96Å; K739-L826 HydrophobicContact CG-CD2 4.32Å
740	N	95.9	Very high	94.9	Very high	65 Å²	65	30.4 Å²	30.4	35%	0.348	16%	0.16	S	C	.	.	H	α-helix	trans	-67	-38	178	-74.8	-48.4	0	0	0	112.8	P736 A737 M738 L743 N744	P736-N740 WeakPolarHBondContact O-CB 3.41Å; P736-N740 PolarHBondContact O-N 3.29Å; P736-N740 PolarHBondContact O-ND2 2.76Å; A737-N740 PolarHBondContact O-N 3.31Å; M738-N740 PolarHBondContact O-N 3.28Å; N740-L743 PolarHBondContact O-N 3.39Å; N740-N744 WeakPolarHBondContact O-CB 3.41Å; N740-N744 VanDerWaalsContact O-CG 3.23Å; N740-N744 PolarHBondContact O-N 3.02Å; N740-N744 PolarHBondContact O-ND2 3Å
741	A	96.7	Very high	94.3	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.008	20%	0.196	C	C	.	.	H	α-helix	trans	-61.5	-48.3	176.5	0	0	0	0	0	112.2	F384 A737 M738 N744 V745 F767 I776	F384-A741 HydrophobicContact CB-CB 4.35Å; F384-A741 HydrophobicContact CD2-CB 3.46Å; F384-A741 VanDerWaalsContact CD2-CB 3.46Å; F384-A741 HydrophobicContact CE2-CB 3.96Å; F384-A741 HydrophobicContact CG-CB 4.07Å; A737-A741 WeakPolarHBondContact O-CB 3.41Å; A737-A741 PolarHBondContact O-N 3.34Å; M738-A741 PolarHBondContact O-N 3Å; A741-N744 PolarHBondContact O-N 2.97Å; A741-V745 WeakPolarHBondContact O-CG2 3.3Å; A741-V745 PolarHBondContact O-N 3.36Å; A741-F767 HydrophobicContact CB-CE1 3.88Å; A741-F767 HydrophobicContact CB-CZ 4.24Å; A741-I776 HydrophobicContact CB-CD1 3.85Å
742	V	97.1	Very high	93.7	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.1	-49.3	174.7	177.3	0	0	0	0	110.6	F652 W664 M738 N744 V745 L746 A765 F767	F652-V742 HydrophobicContact CD1-CG1 3.91Å; F652-V742 HydrophobicContact CD1-CG2 4.34Å; F652-V742 HydrophobicContact CD2-CG1 3.91Å; F652-V742 HydrophobicContact CE1-CG1 3.84Å; F652-V742 HydrophobicContact CE1-CG2 4.34Å; F652-V742 HydrophobicContact CE2-CG1 3.83Å; F652-V742 HydrophobicContact CG-CG1 3.94Å; F652-V742 HydrophobicContact CZ-CG1 3.78Å; W664-V742 HydrophobicContact CZ3-CB 4.42Å; W664-V742 HydrophobicContact CZ3-CG2 4.03Å; M738-V742 PolarHBondContact O-N 2.82Å; M738-V742 VanDerWaalsContact O-N 3.09Å; V742-N744 VanDerWaalsContact C-N 3.31Å; V742-N744 PolarHBondContact O-N 3.34Å; V742-V745 PolarHBondContact O-N 3.41Å; V742-L746 HydrophobicContact CG1-CD1 3.82Å; V742-L746 HydrophobicContact CG1-CG 4.16Å; V742-L746 WeakPolarHBondContact O-CG 3.21Å; V742-L746 PolarHBondContact O-N 3.5Å; V742-A765 HydrophobicContact CG2-CB 3.99Å; V742-F767 HydrophobicContact CG2-CE2 4.31Å; V742-F767 HydrophobicContact CG2-CZ 3.94Å
743	L	95.4	Very high	93.2	Very high	17 Å²	17	30.7 Å²	30.7	9%	0.089	16%	0.163	C	C	.	.	H	α-helix	trans	-57.8	-42.5	-178	178.6	56.5	0	0	0	112.4	K739 N740 L746 L747 Y827	K739-L743 WeakPolarHBondContact O-CB 3.35Å; K739-L743 PolarHBondContact O-N 3.18Å; N740-L743 PolarHBondContact O-N 3.39Å; L743-L746 PolarHBondContact O-N 2.89Å; L743-L747 HydrophobicContact CD1-CD1 4.07Å; L743-L747 HydrophobicContact CD1-CG 4.04Å; L743-L747 HydrophobicContact CG-CD1 3.94Å; L743-L747 HydrophobicContact CG-CG 4.39Å; L743-L747 WeakPolarHBondContact O-CB 3.29Å; L743-L747 VanDerWaalsContact O-CG 3.29Å; L743-L747 WeakPolarHBondContact O-CG 3.19Å; L743-L747 PolarHBondContact O-N 3.47Å; L743-Y827 HydrophobicContact CD1-CD1 3.63Å; L743-Y827 HydrophobicContact CD1-CD2 3.84Å; L743-Y827 HydrophobicContact CD1-CE1 4.17Å; L743-Y827 HydrophobicContact CD1-CE2 4.37Å; L743-Y827 HydrophobicContact CD1-CG 3.43Å; L743-Y827 VanDerWaalsContact CD1-CG 3.43Å; L743-Y827 HydrophobicContact CD2-CD2 3.89Å; L743-Y827 HydrophobicContact CD2-CE2 4.44Å; L743-Y827 HydrophobicContact CD2-CG 4.24Å
744	N	94.3	Very high	92.7	Very high	28 Å²	28	31.1 Å²	31.1	15%	0.15	17%	0.166	C	C	.	.	H	α-helix	trans	-63.1	-42.6	177.9	-76.4	-25.9	0	0	0	112.8	I373 F384 N740 A741 V742 L747 S748	I373-N744 HydrophobicContact CD1-CB 3.8Å; F384-N744 HydrophobicContact CE1-CB 4.47Å; F384-N744 HydrophobicContact CZ-CB 3.97Å; N740-N744 WeakPolarHBondContact O-CB 3.41Å; N740-N744 VanDerWaalsContact O-CG 3.23Å; N740-N744 PolarHBondContact O-N 3.02Å; N740-N744 PolarHBondContact O-ND2 3Å; A741-N744 PolarHBondContact O-N 2.97Å; V742-N744 VanDerWaalsContact C-N 3.31Å; V742-N744 PolarHBondContact O-N 3.34Å; N744-L747 PolarHBondContact O-N 3.22Å; N744-S748 PolarHBondContact O-N 2.86Å; N744-S748 VanDerWaalsContact O-N 3.09Å; N744-S748 PolarHBondContact O-OG 2.97Å
745	V	94.9	Very high	92.1	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-59.5	-49.2	173.9	173.1	0	0	0	0	110.4	F360 L366 L370 A741 V742 L747 S748 S749 L778 I781	F360-V745 HydrophobicContact CB-CG1 3.76Å; F360-V745 HydrophobicContact CG-CG1 4.35Å; L366-V745 HydrophobicContact CD1-CB 4.43Å; L366-V745 HydrophobicContact CD1-CG1 3.62Å; L366-V745 HydrophobicContact CD1-CG2 3.82Å; L370-V745 HydrophobicContact CD1-CG2 4.34Å; L370-V745 HydrophobicContact CD2-CG2 3.72Å; L370-V745 HydrophobicContact CG-CG2 4.2Å; A741-V745 WeakPolarHBondContact O-CG2 3.3Å; A741-V745 PolarHBondContact O-N 3.36Å; V742-V745 PolarHBondContact O-N 3.41Å; V745-L747 VanDerWaalsContact C-N 3.35Å; V745-L747 PolarHBondContact O-N 3.36Å; V745-S748 PolarHBondContact O-N 3.25Å; V745-S748 PolarHBondContact O-OG 2.95Å; V745-S749 WeakPolarHBondContact O-CB 3.19Å; V745-S749 PolarHBondContact O-N 2.95Å; V745-S749 PolarHBondContact O-OG 2.87Å; V745-L778 HydrophobicContact CG2-CD2 3.74Å; V745-I781 HydrophobicContact CB-CD1 4.27Å; V745-I781 HydrophobicContact CG1-CD1 3.84Å; V745-I781 HydrophobicContact CG2-CD1 4.49Å
746	L	94.3	Very high	91.7	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-66.2	-35.8	-177.5	-60.6	-178.3	0	0	0	112.4	F360 F652 I654 W657 L660 V662 V742 L743 S749	F360-L746 HydrophobicContact CD1-CD2 4.35Å; F360-L746 HydrophobicContact CD2-CD2 4.43Å; F360-L746 HydrophobicContact CE1-CD2 3.98Å; F360-L746 HydrophobicContact CE2-CD2 4.06Å; F360-L746 HydrophobicContact CZ-CD2 3.82Å; F652-L746 HydrophobicContact CD2-CD1 4.17Å; F652-L746 HydrophobicContact CE2-CD1 3.78Å; F652-L746 HydrophobicContact CE2-CD2 4.14Å; F652-L746 HydrophobicContact CE2-CG 4.43Å; I654-L746 HydrophobicContact CD1-CD1 3.84Å; I654-L746 HydrophobicContact CD1-CD2 3.56Å; I654-L746 HydrophobicContact CD1-CG 4.31Å; I654-L746 HydrophobicContact CG1-CD1 4.13Å; W657-L746 HydrophobicContact CH2-CB 4.49Å; W657-L746 HydrophobicContact CH2-CD2 3.95Å; L660-L746 HydrophobicContact CD1-CB 4.38Å; L660-L746 HydrophobicContact CD2-CB 4.03Å; V662-L746 HydrophobicContact CB-CD1 4.39Å; V662-L746 HydrophobicContact CG1-CD1 3.77Å; V662-L746 HydrophobicContact CG2-CD1 3.64Å; V742-L746 HydrophobicContact CG1-CD1 3.82Å; V742-L746 HydrophobicContact CG1-CG 4.16Å; V742-L746 WeakPolarHBondContact O-CG 3.21Å; V742-L746 PolarHBondContact O-N 3.5Å; L743-L746 PolarHBondContact O-N 2.89Å; L746-S749 PolarHBondContact O-N 2.87Å
747	L	91.4	Very high	91.4	Very high	25 Å²	25	38.3 Å²	38.3	13%	0.131	20%	0.199	C	C	.	.	H	α-helix	trans	-62	-43.7	172.5	-75.6	169.4	0	0	0	111.8	L660 L743 N744 V745 S749 Q750 Y827	L660-L747 HydrophobicContact CD2-CD2 4.09Å; L660-L747 HydrophobicContact CD2-CG 4.41Å; L743-L747 HydrophobicContact CD1-CD1 4.07Å; L743-L747 HydrophobicContact CD1-CG 4.04Å; L743-L747 HydrophobicContact CG-CD1 3.94Å; L743-L747 HydrophobicContact CG-CG 4.39Å; L743-L747 WeakPolarHBondContact O-CB 3.29Å; L743-L747 VanDerWaalsContact O-CG 3.29Å; L743-L747 WeakPolarHBondContact O-CG 3.19Å; L743-L747 PolarHBondContact O-N 3.47Å; N744-L747 PolarHBondContact O-N 3.22Å; V745-L747 VanDerWaalsContact C-N 3.35Å; V745-L747 PolarHBondContact O-N 3.36Å; L747-S749 VanDerWaalsContact C-N 3.28Å; L747-S749 PolarHBondContact O-N 2.83Å; L747-Q750 PolarHBondContact O-NE2 2.73Å; L747-Y827 HydrophobicContact CD2-CE1 4.08Å
748	S	89.4	Confident	91.2	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.021	20%	0.197	C	C	.	.	H	α-helix	trans	-73.6	-15.1	175.8	67.5	0	0	0	0	114.9	N744 V745	N744-S748 PolarHBondContact O-N 2.86Å; N744-S748 VanDerWaalsContact O-N 3.09Å; N744-S748 PolarHBondContact O-OG 2.97Å; V745-S748 PolarHBondContact O-N 3.25Å; V745-S748 PolarHBondContact O-OG 2.95Å
749	S	90.3	Very high	91	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-83.1	-16	-178.7	-62.2	0	0	0	0	114.3	F360 Q369 V745 L746 L747 E751 S752	F360-S749 WeakPolarHBondContact CD1-OG 3.3Å; Q369-S749 PolarHBondContact NE2-OG 3.03Å; V745-S749 WeakPolarHBondContact O-CB 3.19Å; V745-S749 PolarHBondContact O-N 2.95Å; V745-S749 PolarHBondContact O-OG 2.87Å; L746-S749 PolarHBondContact O-N 2.87Å; L747-S749 VanDerWaalsContact C-N 3.28Å; L747-S749 PolarHBondContact O-N 2.83Å; S749-E751 VanDerWaalsContact C-N 3.35Å; S749-E751 PolarHBondContact O-N 2.67Å; S749-S752 PolarHBondContact O-N 3.03Å; S749-S752 PolarHBondContact O-OG 2.67Å
750	Q	87.4	Confident	90.9	Very high	48 Å²	48	38 Å²	38	22%	0.224	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-57.6	-37.5	-165.1	-70.9	173.4	91.4	0	0	115.1	W657 L660 L747 S752	W657-Q750 HydrophobicContact CE3-CG 4.32Å; W657-Q750 HydrophobicContact CZ3-CG 4.28Å; L660-Q750 HydrophobicContact CD2-CG 4.4Å; L747-Q750 PolarHBondContact O-NE2 2.73Å; Q750-S752 VanDerWaalsContact C-N 3.28Å; Q750-S752 PolarHBondContact O-N 3.45Å
751	E	82.5	Confident	90.9	Very high	160 Å²	160	35 Å²	35	75%	0.748	18%	0.178	S	C	*	.	G	3₁₀ helix	trans	-75.3	-19	-179.2	-59.8	-163.5	149.6	0	0	113	F376 S749	F376-E751 HydrophobicContact CE1-CG 4.13Å; F376-E751 HydrophobicContact CZ-CG 4.23Å; S749-E751 VanDerWaalsContact C-N 3.35Å; S749-E751 PolarHBondContact O-N 2.67Å
752	S	82.8	Confident	90.9	Very high	59 Å²	59	35.7 Å²	35.7	41%	0.413	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-88.8	5.2	-176.1	65.4	0	0	0	0	114.7	P359 Q369 S749 Q750	P359-S752 WeakPolarHBondContact CG-OG 3.46Å; Q369-S752 PolarHBondContact NE2-OG 3.14Å; S749-S752 PolarHBondContact O-N 3.03Å; S749-S752 PolarHBondContact O-OG 2.67Å; Q750-S752 VanDerWaalsContact C-N 3.28Å; Q750-S752 PolarHBondContact O-N 3.45Å
753	I	85.7	Confident	91	Very high	15 Å²	15	36.1 Å²	36.1	8%	0.077	18%	0.183	C	C	.	.	S	Bend	trans	-131.8	131.5	-167.5	-64.5	173.2	0	0	0	110.7	F360 W657 P755	F360-I753 HydrophobicContact CD1-CD1 4.15Å; F360-I753 HydrophobicContact CE1-CD1 3.72Å; W657-I753 HydrophobicContact CD2-CD1 4.21Å; W657-I753 HydrophobicContact CD2-CG2 4.08Å; W657-I753 HydrophobicContact CE3-CD1 4.19Å; W657-I753 HydrophobicContact CG-CG2 4.1Å; W657-I753 HydrophobicContact CH2-CD1 3.37Å; W657-I753 HydrophobicContact CZ2-CD1 3.36Å; W657-I753 HydrophobicContact CZ3-CD1 3.8Å; I753-P755 VanDerWaalsContact O-CD 3.28Å; I753-P755 WeakPolarHBondContact O-CD 3.43Å
754	E	84.2	Confident	91	Very high	103 Å²	103	35.3 Å²	35.3	48%	0.481	18%	0.179	S	C	.	.			trans	-78.1	113.8	172.7	-173.5	171.2	-179.9	0	0	109.7	S356 R756 K1316	S356-E754 PolarHBondContact OG-O 2.82Å; E754-R756 PolarHBondContact O-N 2.93Å; E754-K1316 IonicContact OE1-NZ 3.99Å; E754-K1316 PolarHBondContact OE1-NZ 2.88Å; E754-K1316 IonicContact OE2-NZ 3.28Å
755	P	85.3	Confident	91.2	Very high	75 Å²	75	34 Å²	34	49%	0.487	17%	0.172	S	C	.	.			trans	-78	95.3	-171.7	30.6	-35.3	0	0	0	111.8	W657 A658 I753	W657-P755 HydrophobicContact CB-CB 3.93Å; A658-P755 HydrophobicContact CB-CB 3.98Å; I753-P755 VanDerWaalsContact O-CD 3.28Å; I753-P755 WeakPolarHBondContact O-CD 3.43Å
756	R	88.2	Confident	91.3	Very high	56 Å²	56	34 Å²	34	21%	0.211	17%	0.172	C	C	.	.			trans	-95.3	123.7	176.3	-176.4	167.8	176.4	125.1	11.6	112.3	F343 L346 Q347 E754 C759	F343-R756 PolarHBondContact O-NH1 3.11Å; L346-R756 VanDerWaalsContact C-NH2 3.33Å; L346-R756 PolarHBondContact O-NH2 2.99Å; Q347-R756 PolarHBondContact O-NH2 2.86Å; E754-R756 PolarHBondContact O-N 2.93Å; R756-C759 HydrophobicContact CB-CB 4.37Å; R756-C759 VanDerWaalsContact CD-SG 3.55Å; R756-C759 VanDerWaalsContact CG-SG 3.6Å; R756-C759 WeakPolarHBondContact O-CB 3.46Å; R756-C759 PolarHBondContact O-N 2.89Å
757	K	90.2	Very high	91.5	Very high	92 Å²	92	34 Å²	34	40%	0.4	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	147	171.9	-62.3	-57.3	-175.9	-172	0	111.4	D656 A658 C759	D656-K757 IonicContact OD1-NZ 3.37Å; D656-K757 PolarHBondContact OD1-NZ 3.19Å; D656-K757 IonicContact OD2-NZ 2.64Å; D656-K757 PolarHBondContact OD2-NZ 2.98Å; A658-K757 PolarHBondContact O-NZ 2.77Å; K757-C759 PolarHBondContact O-N 2.86Å
758	N	92.8	Very high	91.8	Very high	46 Å²	46	33.4 Å²	33.4	25%	0.246	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.5	0.3	-174.5	-55.6	-61.7	0	0	0	115.3	K348 Q350 I351 I352 K813	K348-N758 PolarHBondContact O-ND2 2.86Å; Q350-N758 WeakPolarHBondContact O-CB 3.32Å; I351-N758 VanDerWaalsContact CA-O 3.31Å; I351-N758 WeakPolarHBondContact CA-O 3.2Å; I351-N758 HydrophobicContact CG1-CB 4.02Å; I352-N758 PolarHBondContact N-O 3.46Å; N758-K813 PolarHBondContact OD1-NZ 3.49Å
759	C	94.2	Very high	92.1	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.007	17%	0.168	C	C	.	.	B	Isolated β-bridge	trans	-77.9	136.5	155.8	-69.9	0	0	0	0	109.6	I352 H354 H355 R756 K757	I352-C759 HydrophobicContact CG2-CB 4.26Å; I352-C759 WeakPolarHBondContact CG2-SG 3.37Å; H354-C759 VanDerWaalsContact O-CB 3.32Å; H354-C759 WeakPolarHBondContact O-CB 3.06Å; H354-C759 PolarHBondContact O-SG 3.37Å; H354-C759 VanDerWaalsContact O-SG 3.34Å; H355-C759 PolarHBondContact CE1-O 2.93Å; R756-C759 HydrophobicContact CB-CB 4.37Å; R756-C759 VanDerWaalsContact CD-SG 3.55Å; R756-C759 VanDerWaalsContact CG-SG 3.6Å; R756-C759 WeakPolarHBondContact O-CB 3.46Å; R756-C759 PolarHBondContact O-N 2.89Å; K757-C759 PolarHBondContact O-N 2.86Å
760	F	96.3	Very high	92.3	Very high	4 Å²	4	33.5 Å²	33.5	2%	0.018	17%	0.169	C	C	.	.			trans	-128.4	171.9	162.6	67.3	-89	0	0	0	109.1	F332 W334 I351 I352 N353 H354 H355 L653 I654 T805 V809	F332-F760 AromaticContact CE2-CE1 3.87Å; F332-F760 HydrophobicContact CE2-CE1 3.87Å; F332-F760 HydrophobicContact CE2-CZ 4.17Å; F332-F760 HydrophobicContact CZ-CE1 4.18Å; F332-F760 HydrophobicContact CZ-CZ 4.02Å; W334-F760 HydrophobicContact CE3-CZ 4.03Å; W334-F760 HydrophobicContact CH2-CE2 4.36Å; W334-F760 AromaticContact CZ3-CE2 3.91Å; W334-F760 HydrophobicContact CZ3-CE2 3.91Å; W334-F760 AromaticContact CZ3-CZ 3.72Å; W334-F760 HydrophobicContact CZ3-CZ 3.72Å; I351-F760 HydrophobicContact CG2-CD1 4.04Å; I351-F760 HydrophobicContact CG2-CE1 3.83Å; I352-F760 WeakPolarHBondContact O-CD1 3.29Å; I352-F760 WeakPolarHBondContact O-CE1 3.4Å; I352-F760 PolarHBondContact O-N 2.7Å; N353-F760 CarbonylContact C-O 3.55Å; N353-F760 VanDerWaalsContact CA-CZ 3.46Å; N353-F760 HydrophobicContact CB-CD2 4.33Å; N353-F760 HydrophobicContact CB-CE1 4.12Å; N353-F760 HydrophobicContact CB-CE2 3.55Å; N353-F760 HydrophobicContact CB-CZ 3.43Å; N353-F760 VanDerWaalsContact CB-CZ 3.43Å; H354-F760 CarbonylContact C-O 3.6Å; H354-F760 VanDerWaalsContact CA-O 3.23Å; H354-F760 WeakPolarHBondContact CA-O 3.36Å; H354-F760 PolarHBondContact N-O 3.2Å; H355-F760 VanDerWaalsContact NE2-C 3.28Å; L653-F760 HydrophobicContact CD1-CB 4.23Å; L653-F760 HydrophobicContact CD1-CD2 3.64Å; L653-F760 HydrophobicContact CD1-CE2 4.47Å; L653-F760 HydrophobicContact CD1-CG 4.35Å; I654-F760 CarbonylContact O-C 3.6Å; I654-F760 WeakPolarHBondContact O-CA 3.42Å; I654-F760 WeakPolarHBondContact O-CB 3.31Å; F760-T805 HydrophobicContact CD2-CG2 4.24Å; F760-T805 HydrophobicContact CE2-CG2 3.61Å; F760-T805 HydrophobicContact CZ-CG2 4.33Å; F760-V809 HydrophobicContact CB-CG1 4.19Å; F760-V809 HydrophobicContact CD1-CB 4.15Å; F760-V809 HydrophobicContact CD1-CG1 3.93Å; F760-V809 HydrophobicContact CD1-CG2 4.23Å; F760-V809 HydrophobicContact CD2-CG1 3.98Å; F760-V809 HydrophobicContact CE1-CB 4.23Å; F760-V809 HydrophobicContact CE1-CG1 4.25Å; F760-V809 HydrophobicContact CE1-CG2 3.79Å; F760-V809 HydrophobicContact CE2-CG1 4.28Å; F760-V809 HydrophobicContact CG-CG1 3.78Å; F760-V809 HydrophobicContact CZ-CG1 4.4Å; F760-V809 HydrophobicContact CZ-CG2 3.95Å
761	G	95.4	Very high	92.3	Very high	3 Å²	3	33.6 Å²	33.6	3%	0.031	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	129.3	175.5	0	0	0	0	0	110.4	H355 L653 I654 Y763	H355-G761 PolarHBondContact CD2-N 3.24Å; H355-G761 PolarHBondContact NE2-N 2.92Å; L653-G761 WeakPolarHBondContact CA-O 3.39Å; I654-G761 PolarHBondContact N-O 2.98Å; I654-G761 PolarHBondContact O-N 2.68Å; G761-Y763 VanDerWaalsContact O-CD2 3.29Å; G761-Y763 WeakPolarHBondContact O-CD2 3.35Å; G761-Y763 WeakPolarHBondContact O-CE2 3.31Å
762	L	97.6	Very high	92.3	Very high	14 Å²	14	30.5 Å²	30.5	7%	0.073	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	126.3	173.4	179.9	58.1	0	0	0	107.9	W651 L653 P785 M787 V801 F823	W651-L762 HydrophobicContact CB-CD1 4.33Å; L653-L762 HydrophobicContact CB-CD1 4.22Å; L762-P785 WeakPolarHBondContact O-CD 3.37Å; L762-M787 HydrophobicContact CD2-CE 3.33Å; L762-M787 HydrophobicContact CG-CE 4.04Å; L762-V801 HydrophobicContact CD1-CG2 4.27Å; L762-V801 HydrophobicContact CD2-CG2 4.34Å; L762-F823 HydrophobicContact CD1-CZ 4.09Å
763	Y	97.5	Very high	92.5	Very high	10 Å²	10	29.4 Å²	29.4	4%	0.039	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	154.8	-172.1	-61.6	-86.3	0	0	0	110.5	H355 A358 F360 T361 W651 F652 I654 G761 I781	H355-Y763 PolarHBondContact CD2-OH 3.18Å; A358-Y763 HydrophobicContact CB-CE1 4.13Å; A358-Y763 WeakPolarHBondContact CB-OH 3.13Å; F360-Y763 AromaticContact CE2-CD1 3.76Å; F360-Y763 HydrophobicContact CE2-CD1 3.76Å; F360-Y763 AromaticContact CE2-CE1 3.54Å; F360-Y763 HydrophobicContact CE2-CE1 3.54Å; F360-Y763 HydrophobicContact CE2-CE2 4.42Å; F360-Y763 HydrophobicContact CE2-CG 4.28Å; F360-Y763 AromaticContact CE2-CZ 3.89Å; F360-Y763 HydrophobicContact CZ-CD1 4.32Å; F360-Y763 AromaticContact CZ-CE1 3.7Å; F360-Y763 HydrophobicContact CZ-CE1 3.7Å; F360-Y763 HydrophobicContact CZ-CE2 4.13Å; F360-Y763 AromaticContact CZ-CZ 3.58Å; T361-Y763 HydrophobicContact CG2-CD1 4.02Å; T361-Y763 HydrophobicContact CG2-CE1 3.76Å; W651-Y763 WeakPolarHBondContact CA-O 3.45Å; F652-Y763 HydrophobicContact CD2-CD2 4.31Å; F652-Y763 AromaticContact CE2-CD2 3.75Å; F652-Y763 HydrophobicContact CE2-CD2 3.75Å; F652-Y763 AromaticContact CE2-CG 3.99Å; F652-Y763 HydrophobicContact CE2-CG 3.99Å; F652-Y763 VanDerWaalsContact CZ-CB 3.41Å; F652-Y763 HydrophobicContact CZ-CD2 4.16Å; F652-Y763 AromaticContact CZ-CG 3.91Å; F652-Y763 HydrophobicContact CZ-CG 3.91Å; F652-Y763 PolarHBondContact N-O 3.33Å; F652-Y763 PolarHBondContact O-N 3.35Å; I654-Y763 HydrophobicContact CB-CE2 4.18Å; I654-Y763 HydrophobicContact CD1-CD2 4.07Å; I654-Y763 HydrophobicContact CD1-CE2 3.58Å; I654-Y763 HydrophobicContact CG1-CD2 4.05Å; I654-Y763 HydrophobicContact CG1-CE2 3.8Å; G761-Y763 VanDerWaalsContact O-CD2 3.29Å; G761-Y763 WeakPolarHBondContact O-CD2 3.35Å; G761-Y763 WeakPolarHBondContact O-CE2 3.31Å; Y763-I781 HydrophobicContact CD1-CG2 4.25Å; Y763-I781 HydrophobicContact CG-CG2 4.46Å
764	G	96.8	Very high	92.8	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	116	171.4	0	0	0	0	0	110.4	Q650 I781 N782	Q650-G764 CarbonylContact O-C 3.14Å; Q650-G764 WeakPolarHBondContact O-CA 3.41Å; G764-I781 CarbonylContact O-C 3.52Å; G764-I781 WeakPolarHBondContact O-CA 3.39Å; G764-N782 PolarHBondContact N-O 2.94Å; G764-N782 VanDerWaalsContact N-O 3.14Å; G764-N782 PolarHBondContact O-N 3.14Å
765	A	97.4	Very high	93.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	138.2	169	0	0	0	0	0	110.1	Q650 F652 V742 F767 L778 I781	Q650-A765 PolarHBondContact N-O 3.44Å; Q650-A765 PolarHBondContact O-N 2.81Å; F652-A765 HydrophobicContact CD1-CB 4.33Å; F652-A765 HydrophobicContact CE1-CB 3.98Å; V742-A765 HydrophobicContact CG2-CB 3.99Å; A765-F767 HydrophobicContact CB-CD2 4.19Å; A765-F767 HydrophobicContact CB-CE2 3.51Å; A765-F767 HydrophobicContact CB-CZ 4.14Å; A765-L778 HydrophobicContact CB-CD1 4.07Å; A765-I781 HydrophobicContact CB-CG1 4.27Å
766	D	97.3	Very high	93.8	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.005	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	122.5	-176	-63.9	39.1	0	0	0	109.1	I648 R649 R671 I779 E780 N782	I648-D766 WeakPolarHBondContact O-CA 3.42Å; R649-D766 IonicContact CZ-OD1 2.7Å; R649-D766 VanDerWaalsContact CZ-OD1 3.27Å; R649-D766 IonicContact CZ-OD2 2.63Å; R649-D766 IonicContact NE-OD1 2.96Å; R649-D766 PolarHBondContact NE-OD1 2.89Å; R649-D766 IonicContact NE-OD2 3.27Å; R649-D766 PolarHBondContact NE-OD2 2.61Å; R649-D766 VanDerWaalsContact NH2-CG 3.29Å; R649-D766 IonicContact NH2-OD1 2.84Å; R649-D766 PolarHBondContact NH2-OD1 3.11Å; R649-D766 IonicContact NH2-OD2 2.88Å; R649-D766 PolarHBondContact NH2-OD2 3.03Å; R671-D766 IonicContact CZ-OD2 3.81Å; R671-D766 VanDerWaalsContact CZ-OD2 3.31Å; R671-D766 IonicContact NH1-OD2 2.74Å; R671-D766 PolarHBondContact NH1-OD2 3.08Å; R671-D766 VanDerWaalsContact NH1-OD2 3.1Å; R671-D766 IonicContact NH2-OD2 2.65Å; R671-D766 PolarHBondContact NH2-OD2 3.07Å; D766-I779 PolarHBondContact O-N 3.2Å; D766-E780 HydrophobicContact CB-CG 3.67Å; D766-E780 PolarHBondContact N-O 3.34Å; D766-N782 VanDerWaalsContact CG-ND2 3.34Å; D766-N782 PolarHBondContact OD1-ND2 3.32Å; D766-N782 PolarHBondContact OD2-ND2 3.45Å
767	F	98.2	Very high	94.3	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	141.2	-170.3	-70.7	-85	0	0	0	113.7	D647 I648 Q650 M738 A741 V742 A765 I776 W777 L778	D647-F767 CarbonylContact C-O 3.48Å; D647-F767 WeakPolarHBondContact CA-O 3.47Å; D647-F767 WeakPolarHBondContact CB-O 3.41Å; I648-F767 HydrophobicContact CB-CB 4.44Å; I648-F767 PolarHBondContact N-O 2.95Å; I648-F767 PolarHBondContact O-N 3.41Å; Q650-F767 HydrophobicContact CB-CD2 4.36Å; Q650-F767 HydrophobicContact CB-CE2 4.31Å; M738-F767 HydrophobicContact CB-CD2 4.39Å; M738-F767 HydrophobicContact CB-CE1 4.16Å; M738-F767 HydrophobicContact CB-CE2 3.94Å; M738-F767 HydrophobicContact CB-CZ 3.81Å; M738-F767 HydrophobicContact CE-CD2 3.69Å; M738-F767 HydrophobicContact CE-CE2 4.03Å; M738-F767 HydrophobicContact CE-CG 4.31Å; M738-F767 HydrophobicContact CG-CD1 4.07Å; M738-F767 HydrophobicContact CG-CD2 4.1Å; M738-F767 HydrophobicContact CG-CE1 4.15Å; M738-F767 HydrophobicContact CG-CE2 4.14Å; M738-F767 HydrophobicContact CG-CG 4.05Å; M738-F767 HydrophobicContact CG-CZ 4.17Å; A741-F767 HydrophobicContact CB-CE1 3.88Å; A741-F767 HydrophobicContact CB-CZ 4.24Å; V742-F767 HydrophobicContact CG2-CE2 4.31Å; V742-F767 HydrophobicContact CG2-CZ 3.94Å; A765-F767 HydrophobicContact CB-CD2 4.19Å; A765-F767 HydrophobicContact CB-CE2 3.51Å; A765-F767 HydrophobicContact CB-CZ 4.14Å; F767-I776 HydrophobicContact CD1-CB 4.47Å; F767-I776 HydrophobicContact CD1-CD1 3.88Å; F767-I776 HydrophobicContact CE1-CD1 3.7Å; F767-W777 CarbonylContact C-O 3.59Å; F767-W777 WeakPolarHBondContact CA-O 3.47Å; F767-L778 HydrophobicContact CD1-CB 4.15Å; F767-L778 HydrophobicContact CD1-CD1 4.29Å; F767-L778 HydrophobicContact CE1-CB 3.81Å; F767-L778 HydrophobicContact CE1-CD1 3.79Å; F767-L778 HydrophobicContact CE1-CG 4.39Å; F767-L778 HydrophobicContact CE2-CD1 4.3Å; F767-L778 HydrophobicContact CZ-CD1 3.81Å
768	L	97.2	Very high	94.7	Very high	12 Å²	12	18.6 Å²	18.6	6%	0.063	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	161.4	165.9	-71.5	174.5	0	0	0	111.1	I635 F646 D647 I776 W777 I779	I635-L768 HydrophobicContact CB-CD1 4.5Å; I635-L768 HydrophobicContact CD1-CB 3.9Å; I635-L768 HydrophobicContact CD1-CD1 3.81Å; I635-L768 HydrophobicContact CD1-CG 4.49Å; I635-L768 HydrophobicContact CG1-CD1 4.38Å; F646-L768 WeakPolarHBondContact O-CD2 3.25Å; D647-L768 HydrophobicContact CB-CD2 3.67Å; D647-L768 HydrophobicContact CB-CG 4.37Å; L768-I776 CarbonylContact O-C 3.6Å; L768-I776 WeakPolarHBondContact O-CA 3.49Å; L768-W777 HydrophobicContact CB-CB 4.48Å; L768-W777 PolarHBondContact N-O 2.74Å; L768-W777 PolarHBondContact O-N 2.66Å; L768-I779 HydrophobicContact CB-CD1 4.23Å; L768-I779 HydrophobicContact CB-CG1 4.32Å; L768-I779 HydrophobicContact CD1-CD1 3.78Å; L768-I779 HydrophobicContact CD1-CG1 3.97Å; L768-I779 HydrophobicContact CG-CD1 4.06Å; L768-I779 HydrophobicContact CG-CG1 3.87Å
769	L	96.8	Very high	94.8	Very high	2 Å²	2	17.5 Å²	17.5	1%	0.01	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	158	168.8	-71.2	92.2	0	0	0	111.1	P638 L639 F646 I648 F717 I734 R775 I776	P638-L769 CarbonylContact C-O 3.48Å; P638-L769 VanDerWaalsContact CA-O 3.3Å; P638-L769 WeakPolarHBondContact CA-O 3.48Å; L639-L769 HydrophobicContact CB-CB 3.82Å; L639-L769 HydrophobicContact CD2-CB 3.98Å; L639-L769 HydrophobicContact CD2-CD2 4.17Å; L639-L769 PolarHBondContact N-O 3.44Å; F646-L769 HydrophobicContact CE2-CD1 4.24Å; F646-L769 HydrophobicContact CZ-CD1 4.26Å; I648-L769 HydrophobicContact CD1-CD1 3.67Å; I648-L769 HydrophobicContact CG1-CD1 4.36Å; F717-L769 HydrophobicContact CZ-CD2 4.44Å; I734-L769 HydrophobicContact CD1-CD2 3.72Å; I734-L769 HydrophobicContact CG1-CD2 3.9Å; I734-L769 HydrophobicContact CG2-CD2 4.09Å; L769-R775 VanDerWaalsContact CA-O 3.29Å; L769-R775 WeakPolarHBondContact CA-O 3.16Å; L769-I776 HydrophobicContact CD2-CG2 4.47Å; L769-I776 HydrophobicContact CG-CG2 4.31Å
770	T	95	Very high	94.7	Very high	2 Å²	2	18.7 Å²	18.7	1%	0.012	9%	0.091	C	C	.	.	B	Isolated β-bridge	trans	-100.9	147.2	171	30.5	0	0	0	0	113.3	M585 I635 R637 D773 Y774 R775 W777	M585-T770 HydrophobicContact CB-CG2 3.7Å; I635-T770 HydrophobicContact CG2-CG2 4.19Å; R637-T770 WeakPolarHBondContact O-CA 3.29Å; T770-D773 PolarHBondContact OG1-OD1 3.4Å; T770-Y774 VanDerWaalsContact O-CA 3.29Å; T770-Y774 WeakPolarHBondContact O-CA 3.48Å; T770-Y774 PolarHBondContact O-N 2.94Å; T770-R775 PolarHBondContact N-O 2.91Å; T770-R775 VanDerWaalsContact N-O 3.14Å; T770-R775 PolarHBondContact OG1-N 3.42Å; T770-R775 PolarHBondContact OG1-O 3.19Å; T770-W777 VanDerWaalsContact CG2-NE1 3.32Å; T770-W777 PolarHBondContact OG1-NE1 2.96Å
771	D	86.2	Confident	94.7	Very high	50 Å²	50	18.5 Å²	18.5	27%	0.267	9%	0.09	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-49.1	-176.7	62.6	-17.7	0	0	0	114.4	R637	R637-D771 WeakPolarHBondContact CB-OD1 3.33Å; R637-D771 IonicContact CZ-OD2 2.66Å; R637-D771 VanDerWaalsContact CZ-OD2 3.28Å; R637-D771 IonicContact NE-OD1 2.99Å; R637-D771 IonicContact NE-OD2 3.79Å; R637-D771 PolarHBondContact NE-OD2 3.08Å; R637-D771 IonicContact NH2-OD2 2.75Å; R637-D771 PolarHBondContact NH2-OD2 2.65Å; R637-D771 PolarHBondContact O-N 2.96Å
772	N	82.8	Confident	94.5	Very high	96 Å²	96	19 Å²	19	51%	0.513	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-25.9	-168.3	-78.6	-87.6	0	0	0	114.3	R637	R637-N772 VanDerWaalsContact CZ-ND2 3.29Å; R637-N772 PolarHBondContact NE-ND2 3.33Å; R637-N772 PolarHBondContact NH2-ND2 3.31Å; R637-N772 VanDerWaalsContact NH2-ND2 3.18Å
773	D	86.8	Confident	94	Very high	35 Å²	35	18.5 Å²	18.5	19%	0.187	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-136.4	3.5	-172.1	78.4	-21.7	0	0	0	114.7	K733 T770 R775	K733-D773 WeakPolarHBondContact CE-O 3.37Å; K733-D773 PolarHBondContact NZ-O 3.03Å; T770-D773 PolarHBondContact OG1-OD1 3.4Å; D773-R775 PolarHBondContact O-N 3.07Å; D773-R775 VanDerWaalsContact O-N 3.1Å; D773-R775 VanDerWaalsContact OD1-CB 3.28Å; D773-R775 WeakPolarHBondContact OD1-CB 3.22Å; D773-R775 PolarHBondContact OD1-N 3.27Å; D773-R775 WeakPolarHBondContact OD2-CB 3.43Å; D773-R775 IonicContact OD2-CZ 2.66Å; D773-R775 IonicContact OD2-NE 3.71Å; D773-R775 PolarHBondContact OD2-NE 3.29Å; D773-R775 IonicContact OD2-NH2 2.72Å; D773-R775 PolarHBondContact OD2-NH2 3.32Å
774	Y	93.3	Very high	93.4	Very high	48 Å²	48	19.1 Å²	19.1	19%	0.188	10%	0.095	C	C	.	.			trans	50.5	31.7	-178.3	-60.8	-94.9	0	0	0	113.5	L639 L721 L729 T770	L639-Y774 HydrophobicContact CD1-CD1 4.33Å; L639-Y774 HydrophobicContact CD1-CE1 3.92Å; L639-Y774 HydrophobicContact CD2-CD1 3.72Å; L639-Y774 HydrophobicContact CD2-CE1 3.84Å; L721-Y774 HydrophobicContact CD2-CD1 4.48Å; L721-Y774 HydrophobicContact CD2-CE1 4.03Å; L729-Y774 HydrophobicContact CD2-CD1 3.5Å; L729-Y774 HydrophobicContact CD2-CD2 3.96Å; L729-Y774 HydrophobicContact CD2-CE1 3.86Å; L729-Y774 HydrophobicContact CD2-CE2 4.29Å; L729-Y774 HydrophobicContact CD2-CG 3.55Å; T770-Y774 VanDerWaalsContact O-CA 3.29Å; T770-Y774 WeakPolarHBondContact O-CA 3.48Å; T770-Y774 PolarHBondContact O-N 2.94Å
775	R	94.2	Very high	92.9	Very high	59 Å²	59	19.4 Å²	19.4	22%	0.223	10%	0.097	C	C	.	.			trans	-78.7	138.1	178.5	-164	-174.6	-42.8	173.3	10.3	110.3	Y383 P581 L769 T770 D773 W777	Y383-R775 WeakPolarHBondContact O-CD 3.17Å; P581-R775 PolarHBondContact O-NH1 3.18Å; L769-R775 VanDerWaalsContact CA-O 3.29Å; L769-R775 WeakPolarHBondContact CA-O 3.16Å; T770-R775 PolarHBondContact N-O 2.91Å; T770-R775 VanDerWaalsContact N-O 3.14Å; T770-R775 PolarHBondContact OG1-N 3.42Å; T770-R775 PolarHBondContact OG1-O 3.19Å; D773-R775 PolarHBondContact O-N 3.07Å; D773-R775 VanDerWaalsContact O-N 3.1Å; D773-R775 VanDerWaalsContact OD1-CB 3.28Å; D773-R775 WeakPolarHBondContact OD1-CB 3.22Å; D773-R775 PolarHBondContact OD1-N 3.27Å; D773-R775 WeakPolarHBondContact OD2-CB 3.43Å; D773-R775 IonicContact OD2-CZ 2.66Å; D773-R775 IonicContact OD2-NE 3.71Å; D773-R775 PolarHBondContact OD2-NE 3.29Å; D773-R775 IonicContact OD2-NH2 2.72Å; D773-R775 PolarHBondContact OD2-NH2 3.32Å; R775-W777 HydrophobicContact CG-CZ2 4.46Å; R775-W777 PolarHBondContact O-NE1 2.69Å
776	I	96.6	Very high	92.2	Very high	4 Å²	4	21.4 Å²	21.4	2%	0.021	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	145.5	178.8	69.3	89.5	0	0	0	110.8	F384 I734 A737 M738 A741 F767 L768 L769	F384-I776 HydrophobicContact CB-CD1 4.23Å; I734-I776 HydrophobicContact CB-CG2 4.43Å; I734-I776 HydrophobicContact CG2-CG2 3.82Å; A737-I776 HydrophobicContact CB-CD1 4.31Å; A737-I776 HydrophobicContact CB-CG1 3.47Å; A737-I776 VanDerWaalsContact CB-CG1 3.47Å; A737-I776 HydrophobicContact CB-CG2 4.41Å; M738-I776 HydrophobicContact CG-CB 4.18Å; M738-I776 HydrophobicContact CG-CD1 4.44Å; M738-I776 HydrophobicContact CG-CG1 4.26Å; M738-I776 HydrophobicContact CG-CG2 3.99Å; A741-I776 HydrophobicContact CB-CD1 3.85Å; F767-I776 HydrophobicContact CD1-CB 4.47Å; F767-I776 HydrophobicContact CD1-CD1 3.88Å; F767-I776 HydrophobicContact CE1-CD1 3.7Å; L768-I776 CarbonylContact O-C 3.6Å; L768-I776 WeakPolarHBondContact O-CA 3.49Å; L769-I776 HydrophobicContact CD2-CG2 4.47Å; L769-I776 HydrophobicContact CG-CG2 4.31Å
777	W	97.6	Very high	91.8	Very high	3 Å²	3	22.2 Å²	22.2	1%	0.011	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	114.9	179.9	-62.5	97.3	0	0	0	109.8	D382 F384 P386 Q582 M585 I635 F767 L768 T770 R775 I779	D382-W777 WeakPolarHBondContact O-CH2 3.36Å; D382-W777 VanDerWaalsContact O-CZ3 3.24Å; D382-W777 WeakPolarHBondContact O-CZ3 3.46Å; F384-W777 CarbonylContact O-C 3.58Å; F384-W777 WeakPolarHBondContact O-CA 3.36Å; P386-W777 HydrophobicContact CG-CB 4.23Å; P386-W777 HydrophobicContact CG-CE3 4.06Å; Q582-W777 HydrophobicContact CB-CH2 4.49Å; Q582-W777 HydrophobicContact CG-CH2 3.57Å; Q582-W777 HydrophobicContact CG-CZ3 3.74Å; M585-W777 HydrophobicContact CB-CZ2 4.49Å; M585-W777 HydrophobicContact CG-CH2 4.3Å; M585-W777 HydrophobicContact CG-CZ2 3.96Å; M585-W777 HydrophobicContact SD-CD2 3.89Å; M585-W777 HydrophobicContact SD-CE3 3.92Å; M585-W777 HydrophobicContact SD-CH2 3.75Å; M585-W777 HydrophobicContact SD-CZ2 3.7Å; M585-W777 HydrophobicContact SD-CZ3 3.85Å; I635-W777 HydrophobicContact CD1-CB 3.56Å; I635-W777 HydrophobicContact CD1-CD2 4.48Å; I635-W777 HydrophobicContact CD1-CG 3.69Å; F767-W777 CarbonylContact C-O 3.59Å; F767-W777 WeakPolarHBondContact CA-O 3.47Å; L768-W777 HydrophobicContact CB-CB 4.48Å; L768-W777 PolarHBondContact N-O 2.74Å; L768-W777 PolarHBondContact O-N 2.66Å; T770-W777 VanDerWaalsContact CG2-NE1 3.32Å; T770-W777 PolarHBondContact OG1-NE1 2.96Å; R775-W777 HydrophobicContact CG-CZ2 4.46Å; R775-W777 PolarHBondContact O-NE1 2.69Å; W777-I779 HydrophobicContact CB-CD1 4.27Å
778	L	97.9	Very high	91	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	128.7	174.8	179.7	66.9	0	0	0	109.9	L366 F384 F385 P386 V745 A765 F767 E780 I781	L366-L778 HydrophobicContact CD1-CD2 4.48Å; F384-L778 PolarHBondContact O-N 2.79Å; F385-L778 HydrophobicContact CD2-CB 4.35Å; F385-L778 HydrophobicContact CD2-CG 4.49Å; F385-L778 WeakPolarHBondContact CD2-O 3.26Å; P386-L778 WeakPolarHBondContact CD-O 3.21Å; V745-L778 HydrophobicContact CG2-CD2 3.74Å; A765-L778 HydrophobicContact CB-CD1 4.07Å; F767-L778 HydrophobicContact CD1-CB 4.15Å; F767-L778 HydrophobicContact CD1-CD1 4.29Å; F767-L778 HydrophobicContact CE1-CB 3.81Å; F767-L778 HydrophobicContact CE1-CD1 3.79Å; F767-L778 HydrophobicContact CE1-CG 4.39Å; F767-L778 HydrophobicContact CE2-CD1 4.3Å; F767-L778 HydrophobicContact CZ-CD1 3.81Å; L778-E780 WeakPolarHBondContact CD1-O 3.37Å; L778-I781 HydrophobicContact CD1-CG1 4.14Å; L778-I781 HydrophobicContact CD2-CD1 4.48Å; L778-I781 HydrophobicContact CD2-CG1 4.44Å
779	I	94.9	Very high	90.6	Very high	24 Å²	24	27 Å²	27	12%	0.123	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	-32.8	-175.5	-49.5	-55.5	0	0	0	112.2	K363 P386 I635 D766 L768 W777	K363-I779 PolarHBondContact NZ-O 2.76Å; P386-I779 HydrophobicContact CG-CD1 4.17Å; I635-I779 HydrophobicContact CD1-CD1 4.04Å; D766-I779 PolarHBondContact O-N 3.2Å; L768-I779 HydrophobicContact CB-CD1 4.23Å; L768-I779 HydrophobicContact CB-CG1 4.32Å; L768-I779 HydrophobicContact CD1-CD1 3.78Å; L768-I779 HydrophobicContact CD1-CG1 3.97Å; L768-I779 HydrophobicContact CG-CD1 4.06Å; L768-I779 HydrophobicContact CG-CG1 3.87Å; W777-I779 HydrophobicContact CB-CD1 4.27Å
780	E	93.4	Very high	90.1	Very high	25 Å²	25	29 Å²	29	12%	0.117	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.4	161	174.8	42.6	-163.3	-131.2	0	0	111.1	K363 D766 L778 N782	K363-E780 VanDerWaalsContact CE-OE2 3.24Å; K363-E780 WeakPolarHBondContact CE-OE2 3.42Å; K363-E780 IonicContact NZ-OE2 2.77Å; K363-E780 PolarHBondContact NZ-OE2 3.2Å; D766-E780 HydrophobicContact CB-CG 3.67Å; D766-E780 PolarHBondContact N-O 3.34Å; L778-E780 WeakPolarHBondContact CD1-O 3.37Å; E780-N782 PolarHBondContact OE1-ND2 2.99Å; E780-N782 PolarHBondContact OE1-OD1 3.15Å
781	I	95.1	Very high	89.9	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	125.9	157.5	-61.1	179.5	0	0	0	105.5	F360 T361 F652 V745 Y763 G764 A765 L778	F360-I781 HydrophobicContact CD2-CB 4.19Å; F360-I781 HydrophobicContact CD2-CD1 4.11Å; F360-I781 HydrophobicContact CD2-CG2 3.79Å; F360-I781 HydrophobicContact CE2-CG2 3.93Å; T361-I781 VanDerWaalsContact CA-O 3.29Å; T361-I781 WeakPolarHBondContact CA-O 3.47Å; F652-I781 HydrophobicContact CE1-CD1 4.47Å; F652-I781 HydrophobicContact CE1-CG2 3.9Å; F652-I781 HydrophobicContact CZ-CD1 4.17Å; F652-I781 HydrophobicContact CZ-CG2 3.7Å; V745-I781 HydrophobicContact CB-CD1 4.27Å; V745-I781 HydrophobicContact CG1-CD1 3.84Å; V745-I781 HydrophobicContact CG2-CD1 4.49Å; Y763-I781 HydrophobicContact CD1-CG2 4.25Å; Y763-I781 HydrophobicContact CG-CG2 4.46Å; G764-I781 CarbonylContact O-C 3.52Å; G764-I781 WeakPolarHBondContact O-CA 3.39Å; A765-I781 HydrophobicContact CB-CG1 4.27Å; L778-I781 HydrophobicContact CD1-CG1 4.14Å; L778-I781 HydrophobicContact CD2-CD1 4.48Å; L778-I781 HydrophobicContact CD2-CG1 4.44Å
782	N	91.2	Very high	90.3	Very high	15 Å²	15	30.5 Å²	30.5	8%	0.08	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	134.6	-177.9	-69	-58.3	0	0	0	110	R649 G764 D766 E780	R649-N782 PolarHBondContact NH2-ND2 3.39Å; R649-N782 VanDerWaalsContact NH2-ND2 3.13Å; G764-N782 PolarHBondContact N-O 2.94Å; G764-N782 VanDerWaalsContact N-O 3.14Å; G764-N782 PolarHBondContact O-N 3.14Å; D766-N782 VanDerWaalsContact CG-ND2 3.34Å; D766-N782 PolarHBondContact OD1-ND2 3.32Å; D766-N782 PolarHBondContact OD2-ND2 3.45Å; E780-N782 PolarHBondContact OE1-ND2 2.99Å; E780-N782 PolarHBondContact OE1-OD1 3.15Å
783	S	88.1	Confident	90.9	Very high	2 Å²	2	26.4 Å²	26.4	1%	0.014	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	148.8	169.1	69.1	0	0	0	0	109.3	D291 D293 P785	D291-S783 WeakPolarHBondContact CB-OG 3.47Å; D291-S783 WeakPolarHBondContact OD1-CB 3.11Å; D293-S783 WeakPolarHBondContact CB-O 3.38Å; D293-S783 WeakPolarHBondContact OD2-CB 3.48Å; D293-S783 PolarHBondContact OD2-N 2.99Å; D293-S783 PolarHBondContact OD2-OG 3.37Å; S783-P785 VanDerWaalsContact C-N 3.34Å; S783-P785 VanDerWaalsContact O-N 3.07Å
784	S	84	Confident	91.2	Very high	24 Å²	24	24.8 Å²	24.8	17%	0.168	15%	0.145	C	C	.	.	S	Bend	trans	42.5	52.7	169.3	-48.6	0	0	0	0	114.2	H354 C786	H354-S784 PolarHBondContact CE1-OG 3.37Å; S784-C786 PolarHBondContact O-N 3.1Å
785	P	87	Confident	91.2	Very high	6 Å²	6	24.6 Å²	24.6	4%	0.039	15%	0.153	C	C	.	.			trans	-59	140.5	-165.5	26.2	-36.5	0	0	0	111	L762 S783 M787	L762-P785 WeakPolarHBondContact O-CD 3.37Å; S783-P785 VanDerWaalsContact C-N 3.34Å; S783-P785 VanDerWaalsContact O-N 3.07Å; P785-M787 HydrophobicContact CG-CE 4.12Å; P785-M787 WeakPolarHBondContact O-CG 3.43Å; P785-M787 PolarHBondContact O-N 3.24Å
786	C	83.1	Confident	91.3	Very high	41 Å²	41	26.1 Å²	26.1	28%	0.277	17%	0.169	S	C	.	.			trans	-50.8	129.4	-177	-176.9	0	0	0	0	112.2	S784	S784-C786 PolarHBondContact O-N 3.1Å
787	M	87.6	Confident	91.2	Very high	19 Å²	19	26.8 Å²	26.8	9%	0.094	17%	0.171	C	C	.	.			trans	-114.3	12.9	-178.1	-62.6	-58.2	-170	0	0	113.2	W651 L762 P785 T798 V801 L802	W651-M787 HydrophobicContact CZ2-SD 4.28Å; L762-M787 HydrophobicContact CD2-CE 3.33Å; L762-M787 HydrophobicContact CG-CE 4.04Å; P785-M787 HydrophobicContact CG-CE 4.12Å; P785-M787 WeakPolarHBondContact O-CG 3.43Å; P785-M787 PolarHBondContact O-N 3.24Å; M787-T798 HydrophobicContact CB-CG2 4.4Å; M787-T798 WeakPolarHBondContact O-CB 3.47Å; M787-T798 PolarHBondContact O-OG1 3.43Å; M787-T798 VanDerWaalsContact O-OG1 3.12Å; M787-T798 HydrophobicContact SD-CG2 4.05Å; M787-V801 HydrophobicContact CE-CG1 3.93Å; M787-V801 HydrophobicContact SD-CG1 4.06Å; M787-L802 HydrophobicContact CB-CD1 4.16Å; M787-L802 HydrophobicContact CE-CD2 4.37Å; M787-L802 HydrophobicContact CG-CD1 4.36Å; M787-L802 HydrophobicContact CG-CD2 4.13Å; M787-L802 HydrophobicContact CG-CG 4.33Å
788	S	83.1	Confident	91.1	Very high	30 Å²	30	27 Å²	27	21%	0.21	17%	0.173	C	C	.	.			trans	-62	135.9	176.4	-170	0	0	0	0	110.7	S790	S788-S790 PolarHBondContact O-N 3.18Å
789	P	87.8	Confident	90.9	Very high	82 Å²	82	27.9 Å²	27.9	53%	0.532	18%	0.181	S	C	.	.			trans	-78	57.2	175.8	35.3	-37.6	0	0	0	111	T791 A795	P789-T791 VanDerWaalsContact C-N 3.27Å; P789-T791 PolarHBondContact O-N 3.39Å; P789-A795 HydrophobicContact CB-CB 3.75Å
790	S	86.4	Confident	91	Very high	44 Å²	44	28.8 Å²	28.8	31%	0.308	19%	0.189	S	C	.	.			trans	-71.8	-12.6	-171.8	45.6	0	0	0	0	115.8	N691 H695 S788 T794	N691-S790 PolarHBondContact ND2-OG 2.82Å; N691-S790 VanDerWaalsContact ND2-OG 3.16Å; H695-S790 PolarHBondContact NE2-O 2.89Å; S788-S790 PolarHBondContact O-N 3.18Å; S790-T794 PolarHBondContact N-OG1 3.23Å; S790-T794 VanDerWaalsContact N-OG1 3.09Å; S790-T794 PolarHBondContact OG-OG1 3.38Å
791	T	91.6	Very high	91.2	Very high	8 Å²	8	27.6 Å²	27.6	5%	0.049	18%	0.183	C	C	.	.	S	Bend	trans	-150.3	161.8	-174.9	60.1	0	0	0	0	108.7	E709 M711 P789 V793 T794 A795	E709-T791 HydrophobicContact CB-CG2 3.99Å; E709-T791 HydrophobicContact CG-CG2 4.41Å; E709-T791 WeakPolarHBondContact O-CG2 3.41Å; E709-T791 WeakPolarHBondContact OE2-CA 3.47Å; E709-T791 WeakPolarHBondContact OE2-CB 3.35Å; M711-T791 HydrophobicContact CE-CG2 3.68Å; M711-T791 HydrophobicContact CG-CG2 4.16Å; M711-T791 HydrophobicContact SD-CG2 3.81Å; M711-T791 PolarHBondContact SD-OG1 3.38Å; P789-T791 VanDerWaalsContact C-N 3.27Å; P789-T791 PolarHBondContact O-N 3.39Å; T791-V793 VanDerWaalsContact C-N 3.26Å; T791-V793 PolarHBondContact O-N 3.39Å; T791-T794 PolarHBondContact N-OG1 3.21Å; T791-T794 PolarHBondContact O-N 3.4Å; T791-T794 VanDerWaalsContact O-N 3.15Å; T791-T794 PolarHBondContact O-OG1 3.05Å; T791-T794 WeakPolarHBondContact OG1-CB 3.49Å; T791-T794 PolarHBondContact OG1-N 3.38Å; T791-T794 VanDerWaalsContact OG1-N 3.09Å; T791-T794 PolarHBondContact OG1-OG1 3.35Å; T791-A795 WeakPolarHBondContact O-CB 3.35Å; T791-A795 PolarHBondContact O-N 3.46Å
792	S	94.1	Very high	91.2	Very high	75 Å²	75	28 Å²	28	52%	0.524	19%	0.186	S	C	.	.	H	α-helix	trans	-55.8	-42.9	176.5	79.2	0	0	0	0	111.7	E709 A795 V796	E709-S792 WeakPolarHBondContact OE1-CB 3.47Å; E709-S792 PolarHBondContact OE1-N 3.33Å; E709-S792 PolarHBondContact OE1-OG 2.83Å; E709-S792 PolarHBondContact OE2-N 3.33Å; S792-A795 PolarHBondContact O-N 2.93Å; S792-V796 PolarHBondContact O-N 3.4Å
793	V	94.8	Very high	91.5	Very high	10 Å²	10	29.3 Å²	29.3	6%	0.061	19%	0.191	C	C	.	.	H	α-helix	trans	-60.9	-48.5	175.7	177.9	0	0	0	0	111.6	Y669 M711 T713 T791 Y797	Y669-V793 HydrophobicContact CG-CG1 4.31Å; M711-V793 HydrophobicContact CB-CB 4.24Å; M711-V793 HydrophobicContact CB-CG2 4.22Å; T713-V793 HydrophobicContact CG2-CG1 4.19Å; T713-V793 HydrophobicContact CG2-CG2 4.03Å; T791-V793 VanDerWaalsContact C-N 3.26Å; T791-V793 PolarHBondContact O-N 3.39Å; V793-Y797 HydrophobicContact CG1-CD2 3.8Å; V793-Y797 HydrophobicContact CG1-CE2 4Å; V793-Y797 WeakPolarHBondContact O-CB 3.11Å; V793-Y797 PolarHBondContact O-N 3.01Å; V793-Y797 VanDerWaalsContact O-N 3.08Å
794	T	94	Very high	91.9	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.012	19%	0.193	C	C	.	.	H	α-helix	trans	-71.5	-35	-179.4	49.3	0	0	0	0	112.5	Y669 M711 S790 T791 V796 Y797 T798	Y669-T794 HydrophobicContact CE1-CG2 4.12Å; Y669-T794 HydrophobicContact CE2-CG2 4.05Å; M711-T794 HydrophobicContact CE-CG2 4.11Å; M711-T794 HydrophobicContact SD-CG2 3.62Å; S790-T794 PolarHBondContact N-OG1 3.23Å; S790-T794 VanDerWaalsContact N-OG1 3.09Å; S790-T794 PolarHBondContact OG-OG1 3.38Å; T791-T794 PolarHBondContact N-OG1 3.21Å; T791-T794 PolarHBondContact O-N 3.4Å; T791-T794 VanDerWaalsContact O-N 3.15Å; T791-T794 PolarHBondContact O-OG1 3.05Å; T791-T794 WeakPolarHBondContact OG1-CB 3.49Å; T791-T794 PolarHBondContact OG1-N 3.38Å; T791-T794 VanDerWaalsContact OG1-N 3.09Å; T791-T794 PolarHBondContact OG1-OG1 3.35Å; T794-V796 VanDerWaalsContact C-N 3.3Å; T794-V796 PolarHBondContact O-N 3.4Å; T794-Y797 PolarHBondContact O-N 3.21Å; T794-T798 WeakPolarHBondContact O-CB 3.36Å; T794-T798 VanDerWaalsContact O-CG2 3.25Å; T794-T798 WeakPolarHBondContact O-CG2 3.35Å; T794-T798 PolarHBondContact O-N 3.18Å; T794-T798 PolarHBondContact O-OG1 3.37Å
795	A	93.6	Very high	92.6	Very high	43 Å²	43	28.5 Å²	28.5	36%	0.355	19%	0.185	S	C	.	.	H	α-helix	trans	-58.2	-40.3	177.2	0	0	0	0	0	112.9	P789 T791 S792 A799	P789-A795 HydrophobicContact CB-CB 3.75Å; T791-A795 WeakPolarHBondContact O-CB 3.35Å; T791-A795 PolarHBondContact O-N 3.46Å; S792-A795 PolarHBondContact O-N 2.93Å; A795-A799 WeakPolarHBondContact O-CB 3.5Å
796	V	94.9	Very high	93.1	Very high	92 Å²	92	28.2 Å²	28.2	56%	0.558	18%	0.183	S	C	*	.	H	α-helix	trans	-74.6	-55.5	175.1	178.5	0	0	0	0	111	S792 T794 A799 S800	S792-V796 PolarHBondContact O-N 3.4Å; T794-V796 VanDerWaalsContact C-N 3.3Å; T794-V796 PolarHBondContact O-N 3.4Å; V796-A799 PolarHBondContact O-N 3.16Å; V796-S800 PolarHBondContact O-N 2.99Å; V796-S800 PolarHBondContact O-OG 2.95Å
797	Y	95.9	Very high	93.8	Very high	17 Å²	17	28 Å²	28	7%	0.067	18%	0.178	C	C	.	.	H	α-helix	trans	-71.4	-35.9	-170.4	-72.9	-20.5	0	0	0	114.1	W651 D667 C668 Y669 T713 W714 E715 V793 T794 A799 S800 V801	W651-Y797 HydrophobicContact CZ3-CD2 4.43Å; W651-Y797 HydrophobicContact CZ3-CG 4.45Å; D667-Y797 HydrophobicContact CB-CD1 4.11Å; D667-Y797 HydrophobicContact CB-CD2 4.43Å; D667-Y797 HydrophobicContact CB-CE1 3.82Å; D667-Y797 HydrophobicContact CB-CE2 4.15Å; D667-Y797 HydrophobicContact CB-CG 4.39Å; C668-Y797 WeakPolarHBondContact O-CE2 3.48Å; Y669-Y797 HydrophobicContact CD1-CD2 4.5Å; T713-Y797 WeakPolarHBondContact CB-OH 3.44Å; T713-Y797 HydrophobicContact CG2-CE2 4.29Å; W714-Y797 VanDerWaalsContact CD1-OH 3.31Å; E715-Y797 PolarHBondContact OE1-OH 3.07Å; E715-Y797 PolarHBondContact OE2-OH 3.43Å; V793-Y797 HydrophobicContact CG1-CD2 3.8Å; V793-Y797 HydrophobicContact CG1-CE2 4Å; V793-Y797 WeakPolarHBondContact O-CB 3.11Å; V793-Y797 PolarHBondContact O-N 3.01Å; V793-Y797 VanDerWaalsContact O-N 3.08Å; T794-Y797 PolarHBondContact O-N 3.21Å; Y797-A799 VanDerWaalsContact C-N 3.34Å; Y797-S800 PolarHBondContact O-N 3.18Å; Y797-V801 WeakPolarHBondContact O-CG1 3.31Å; Y797-V801 PolarHBondContact O-N 3.21Å
798	T	94.3	Very high	94.2	Very high	7 Å²	7	27.6 Å²	27.6	4%	0.043	18%	0.176	C	C	.	.	H	α-helix	trans	-68.6	-35.5	177.5	69.1	0	0	0	0	111.3	W651 M787 T794 L802	W651-T798 HydrophobicContact CH2-CG2 4.39Å; W651-T798 HydrophobicContact CZ2-CG2 4.07Å; M787-T798 HydrophobicContact CB-CG2 4.4Å; M787-T798 WeakPolarHBondContact O-CB 3.47Å; M787-T798 PolarHBondContact O-OG1 3.43Å; M787-T798 VanDerWaalsContact O-OG1 3.12Å; M787-T798 HydrophobicContact SD-CG2 4.05Å; T794-T798 WeakPolarHBondContact O-CB 3.36Å; T794-T798 VanDerWaalsContact O-CG2 3.25Å; T794-T798 WeakPolarHBondContact O-CG2 3.35Å; T794-T798 PolarHBondContact O-N 3.18Å; T794-T798 PolarHBondContact O-OG1 3.37Å; T798-L802 VanDerWaalsContact O-CB 3.3Å; T798-L802 WeakPolarHBondContact O-CB 3.25Å; T798-L802 WeakPolarHBondContact O-CD1 3.24Å; T798-L802 WeakPolarHBondContact O-CG 3.13Å; T798-L802 PolarHBondContact O-N 3.45Å
799	A	94.2	Very high	94.8	Very high	20 Å²	20	27 Å²	27	17%	0.165	17%	0.171	C	C	.	.	H	α-helix	trans	-63.1	-44.6	174.3	0	0	0	0	0	111.9	R233 A795 V796 Y797 E803	R233-A799 HydrophobicContact CG-CB 4.4Å; A795-A799 WeakPolarHBondContact O-CB 3.5Å; V796-A799 PolarHBondContact O-N 3.16Å; Y797-A799 VanDerWaalsContact C-N 3.34Å; A799-E803 PolarHBondContact O-N 3.07Å
800	S	96.1	Very high	95.2	Very high	42 Å²	42	23.1 Å²	23.1	29%	0.294	15%	0.145	S	C	.	.	H	α-helix	trans	-66.7	-50.3	178.6	-61	0	0	0	0	112.6	Y665 V796 Y797 L802 E803 D804	Y665-S800 VanDerWaalsContact OH-C 3.28Å; Y665-S800 VanDerWaalsContact OH-CB 3.29Å; Y665-S800 WeakPolarHBondContact OH-CB 3.46Å; V796-S800 PolarHBondContact O-N 2.99Å; V796-S800 PolarHBondContact O-OG 2.95Å; Y797-S800 PolarHBondContact O-N 3.18Å; S800-L802 VanDerWaalsContact C-N 3.31Å; S800-L802 PolarHBondContact O-N 3.3Å; S800-E803 PolarHBondContact O-N 3.12Å; S800-D804 WeakPolarHBondContact O-CB 3.41Å; S800-D804 VanDerWaalsContact O-CG 3.31Å; S800-D804 PolarHBondContact O-N 3.43Å
801	V	97.3	Very high	95.5	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-65.7	-33	-177.1	74.4	0	0	0	0	112.6	W651 Y665 L762 M787 Y797 T805 F823	W651-V801 HydrophobicContact CB-CG2 4.24Å; W651-V801 HydrophobicContact CD2-CG1 4.28Å; W651-V801 HydrophobicContact CD2-CG2 4.31Å; W651-V801 HydrophobicContact CG-CG2 4.2Å; W651-V801 HydrophobicContact CH2-CG1 4.49Å; W651-V801 HydrophobicContact CZ2-CG1 4.17Å; Y665-V801 HydrophobicContact CD1-CB 4.07Å; Y665-V801 HydrophobicContact CD1-CG2 3.85Å; Y665-V801 HydrophobicContact CD2-CB 4.49Å; Y665-V801 HydrophobicContact CD2-CG2 3.83Å; Y665-V801 HydrophobicContact CE1-CB 3.7Å; Y665-V801 HydrophobicContact CE1-CG2 3.97Å; Y665-V801 HydrophobicContact CE2-CB 4.18Å; Y665-V801 HydrophobicContact CE2-CG2 3.96Å; Y665-V801 HydrophobicContact CG-CB 4.44Å; Y665-V801 HydrophobicContact CG-CG2 3.78Å; Y665-V801 PolarHBondContact OH-N 2.97Å; L762-V801 HydrophobicContact CD1-CG2 4.27Å; L762-V801 HydrophobicContact CD2-CG2 4.34Å; M787-V801 HydrophobicContact CE-CG1 3.93Å; M787-V801 HydrophobicContact SD-CG1 4.06Å; Y797-V801 WeakPolarHBondContact O-CG1 3.31Å; Y797-V801 PolarHBondContact O-N 3.21Å; V801-T805 VanDerWaalsContact O-CB 3.32Å; V801-T805 WeakPolarHBondContact O-CB 3.42Å; V801-T805 PolarHBondContact O-N 2.71Å; V801-T805 PolarHBondContact O-OG1 3.41Å; V801-F823 HydrophobicContact CG2-CE2 4.17Å; V801-F823 HydrophobicContact CG2-CZ 3.84Å
802	L	96.6	Very high	95.6	Very high	9 Å²	9	25 Å²	25	5%	0.047	15%	0.15	C	C	.	.	H	α-helix	trans	-65	-44.6	174.1	-77.4	175.1	0	0	0	111.8	Y231 R233 I234 W334 M787 T798 S800	Y231-L802 HydrophobicContact CD1-CD1 4.45Å; Y231-L802 HydrophobicContact CD1-CD2 4.36Å; R233-L802 HydrophobicContact CB-CD1 4.23Å; R233-L802 HydrophobicContact CG-CB 4.45Å; I234-L802 HydrophobicContact CD1-CB 3.83Å; I234-L802 HydrophobicContact CD1-CD2 4Å; I234-L802 HydrophobicContact CD1-CG 4.46Å; I234-L802 VanDerWaalsContact CD1-O 3.25Å; I234-L802 WeakPolarHBondContact CD1-O 3.38Å; I234-L802 HydrophobicContact CG1-CB 4.34Å; I234-L802 HydrophobicContact CG1-CD2 4.06Å; W334-L802 HydrophobicContact CH2-CD2 3.91Å; W334-L802 HydrophobicContact CZ2-CD2 3.44Å; W334-L802 VanDerWaalsContact CZ2-CD2 3.44Å; M787-L802 HydrophobicContact CB-CD1 4.16Å; M787-L802 HydrophobicContact CE-CD2 4.37Å; M787-L802 HydrophobicContact CG-CD1 4.36Å; M787-L802 HydrophobicContact CG-CD2 4.13Å; M787-L802 HydrophobicContact CG-CG 4.33Å; T798-L802 VanDerWaalsContact O-CB 3.3Å; T798-L802 WeakPolarHBondContact O-CB 3.25Å; T798-L802 WeakPolarHBondContact O-CD1 3.24Å; T798-L802 WeakPolarHBondContact O-CG 3.13Å; T798-L802 PolarHBondContact O-N 3.45Å; S800-L802 VanDerWaalsContact C-N 3.31Å; S800-L802 PolarHBondContact O-N 3.3Å
803	E	96.2	Very high	95.2	Very high	42 Å²	42	26.6 Å²	26.6	20%	0.196	15%	0.147	C	C	.	.	H	α-helix	trans	-72.9	-41.4	178.8	178.5	148.8	-156.5	0	0	112.5	R233 A237 R241 A799 S800 T805 L806 K807	R233-E803 IonicContact CZ-OE2 3.89Å; R233-E803 IonicContact NE-OE2 3.31Å; R233-E803 PolarHBondContact NE-OE2 3.48Å; R233-E803 IonicContact NH2-OE2 2.71Å; R233-E803 PolarHBondContact NH2-OE2 2.8Å; A237-E803 HydrophobicContact CB-CG 4.31Å; R241-E803 IonicContact NH1-OE1 3.98Å; R241-E803 PolarHBondContact NH1-OE1 3.21Å; A799-E803 PolarHBondContact O-N 3.07Å; S800-E803 PolarHBondContact O-N 3.12Å; E803-T805 PolarHBondContact O-N 3.3Å; E803-L806 WeakPolarHBondContact O-CA 3.49Å; E803-L806 WeakPolarHBondContact O-CB 3.35Å; E803-L806 PolarHBondContact O-N 2.91Å; E803-K807 PolarHBondContact O-N 3.34Å; E803-K807 VanDerWaalsContact O-N 3.16Å
804	D	97.9	Very high	94.8	Very high	9 Å²	9	32.5 Å²	32.5	5%	0.048	17%	0.169	C	C	.	.	H	α-helix	trans	-64.1	-31.2	176.3	-72	-13.7	0	0	0	112.1	Y665 S800 L806 K807 V808 G821 R822 F823	Y665-D804 HydrophobicContact CE2-CB 3.79Å; Y665-D804 VanDerWaalsContact CE2-OD2 3.3Å; Y665-D804 WeakPolarHBondContact CE2-OD2 3.5Å; Y665-D804 PolarHBondContact OH-OD2 3.26Å; S800-D804 WeakPolarHBondContact O-CB 3.41Å; S800-D804 VanDerWaalsContact O-CG 3.31Å; S800-D804 PolarHBondContact O-N 3.43Å; D804-L806 VanDerWaalsContact C-N 3.28Å; D804-L806 PolarHBondContact O-N 2.77Å; D804-K807 WeakPolarHBondContact O-CB 3.48Å; D804-K807 PolarHBondContact O-N 2.95Å; D804-K807 VanDerWaalsContact O-N 3.13Å; D804-K807 WeakPolarHBondContact OD1-CD 3.48Å; D804-K807 WeakPolarHBondContact OD1-CE 3.33Å; D804-K807 IonicContact OD1-NZ 3.4Å; D804-K807 PolarHBondContact OD1-NZ 3.32Å; D804-V808 PolarHBondContact O-N 2.91Å; D804-G821 WeakPolarHBondContact OD1-CA 3.41Å; D804-G821 WeakPolarHBondContact OD2-CA 3.41Å; D804-R822 PolarHBondContact OD2-N 3.45Å; D804-F823 HydrophobicContact CB-CD2 3.81Å; D804-F823 HydrophobicContact CB-CE2 4.02Å
805	T	97.9	Very high	94.6	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-59.8	-40.7	171.2	-64.5	0	0	0	0	110.9	W334 L653 F760 V801 E803 V808 V809 F823	W334-T805 HydrophobicContact CH2-CG2 3.95Å; W334-T805 HydrophobicContact CZ3-CG2 4.02Å; L653-T805 HydrophobicContact CD1-CG2 4.23Å; L653-T805 HydrophobicContact CD2-CG2 4.15Å; F760-T805 HydrophobicContact CD2-CG2 4.24Å; F760-T805 HydrophobicContact CE2-CG2 3.61Å; F760-T805 HydrophobicContact CZ-CG2 4.33Å; V801-T805 VanDerWaalsContact O-CB 3.32Å; V801-T805 WeakPolarHBondContact O-CB 3.42Å; V801-T805 PolarHBondContact O-N 2.71Å; V801-T805 PolarHBondContact O-OG1 3.41Å; E803-T805 PolarHBondContact O-N 3.3Å; T805-V808 PolarHBondContact O-N 3.39Å; T805-V809 HydrophobicContact CG2-CG1 4.43Å; T805-V809 WeakPolarHBondContact O-CG1 3.43Å; T805-V809 WeakPolarHBondContact O-CG2 3.48Å; T805-V809 PolarHBondContact O-N 2.89Å; T805-F823 WeakPolarHBondContact OG1-CE2 3.48Å
806	L	97.3	Very high	94.4	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-65.7	-37.9	174.6	-60.1	178.7	0	0	0	111.9	I234 A237 L238 F332 W334 E803 D804 V808 V809 L810 D811	I234-L806 HydrophobicContact CD1-CD1 3.94Å; I234-L806 HydrophobicContact CD1-CD2 4.16Å; I234-L806 HydrophobicContact CD1-CG 3.93Å; I234-L806 HydrophobicContact CG2-CD1 4.4Å; I234-L806 HydrophobicContact CG2-CD2 4.48Å; A237-L806 HydrophobicContact CB-CD1 3.64Å; L238-L806 HydrophobicContact CD2-CD1 4.11Å; L238-L806 HydrophobicContact CD2-CD2 4.15Å; L238-L806 HydrophobicContact CG-CD1 4.01Å; F332-L806 HydrophobicContact CE1-CD2 3.88Å; F332-L806 HydrophobicContact CE2-CD2 4.29Å; F332-L806 HydrophobicContact CZ-CD2 3.44Å; F332-L806 VanDerWaalsContact CZ-CD2 3.44Å; W334-L806 HydrophobicContact CE3-CD2 4.47Å; W334-L806 HydrophobicContact CZ3-CD2 4.21Å; E803-L806 WeakPolarHBondContact O-CA 3.49Å; E803-L806 WeakPolarHBondContact O-CB 3.35Å; E803-L806 PolarHBondContact O-N 2.91Å; D804-L806 VanDerWaalsContact C-N 3.28Å; D804-L806 PolarHBondContact O-N 2.77Å; L806-V808 VanDerWaalsContact C-N 3.32Å; L806-V808 PolarHBondContact O-N 3.01Å; L806-V809 PolarHBondContact O-N 2.84Å; L806-L810 HydrophobicContact CD2-CD1 4.18Å; L806-L810 WeakPolarHBondContact O-CA 3.47Å; L806-L810 VanDerWaalsContact O-CB 3.3Å; L806-L810 WeakPolarHBondContact O-CB 3.21Å; L806-L810 PolarHBondContact O-N 3.05Å; L806-D811 PolarHBondContact O-N 3.45Å
807	K	97.3	Very high	94.1	Very high	38 Å²	38	46.9 Å²	46.9	17%	0.165	22%	0.221	C	C	.	.	I	π-helix	trans	-57.9	-45.1	174	-59.1	177.8	-174.2	169.6	0	111.6	E803 D804 D811 K812 D819	E803-K807 PolarHBondContact O-N 3.34Å; E803-K807 VanDerWaalsContact O-N 3.16Å; D804-K807 WeakPolarHBondContact O-CB 3.48Å; D804-K807 PolarHBondContact O-N 2.95Å; D804-K807 VanDerWaalsContact O-N 3.13Å; D804-K807 WeakPolarHBondContact OD1-CD 3.48Å; D804-K807 WeakPolarHBondContact OD1-CE 3.33Å; D804-K807 IonicContact OD1-NZ 3.4Å; D804-K807 PolarHBondContact OD1-NZ 3.32Å; K807-D811 WeakPolarHBondContact CA-OD2 3.2Å; K807-D811 PolarHBondContact O-N 2.89Å; K807-K812 PolarHBondContact O-N 2.94Å; K807-D819 VanDerWaalsContact CD-OD2 3.24Å; K807-D819 WeakPolarHBondContact CD-OD2 3.18Å; K807-D819 VanDerWaalsContact CE-OD2 3.25Å; K807-D819 WeakPolarHBondContact CE-OD2 3.3Å; K807-D819 IonicContact NZ-OD2 3.33Å; K807-D819 PolarHBondContact NZ-OD2 3.28Å
808	V	96.9	Very high	93.9	Very high	10 Å²	10	47 Å²	47	6%	0.061	22%	0.224	C	C	.	.	I	π-helix	trans	-68.4	-47.3	179.2	176.1	0	0	0	0	112.4	L653 T655 W663 D804 T805 L806 V820 F823	L653-V808 HydrophobicContact CD2-CB 3.91Å; L653-V808 HydrophobicContact CD2-CG1 3.76Å; L653-V808 HydrophobicContact CD2-CG2 4.35Å; T655-V808 HydrophobicContact CG2-CG1 3.88Å; W663-V808 HydrophobicContact CD2-CG1 3.79Å; W663-V808 HydrophobicContact CE3-CG1 4.32Å; W663-V808 HydrophobicContact CE3-CG2 4.4Å; W663-V808 HydrophobicContact CG-CG1 4.11Å; W663-V808 HydrophobicContact CZ2-CG1 3.97Å; D804-V808 PolarHBondContact O-N 2.91Å; T805-V808 PolarHBondContact O-N 3.39Å; L806-V808 VanDerWaalsContact C-N 3.32Å; L806-V808 PolarHBondContact O-N 3.01Å; V808-V820 HydrophobicContact CG2-CB 3.93Å; V808-V820 HydrophobicContact CG2-CG1 3.96Å; V808-F823 HydrophobicContact CG2-CB 3.76Å; V808-F823 HydrophobicContact CG2-CD2 3.7Å; V808-F823 HydrophobicContact CG2-CG 3.9Å
809	V	96.1	Very high	94	Very high	16 Å²	16	51.1 Å²	51.1	10%	0.097	25%	0.246	C	C	.	.	I	π-helix	trans	-89.7	-22.1	-170.5	-50.4	0	0	0	0	114.7	F332 L653 T655 F760 T805 L806	F332-V809 HydrophobicContact CE2-CG2 3.98Å; F332-V809 HydrophobicContact CZ-CG2 4.46Å; L653-V809 HydrophobicContact CD2-CG1 4.31Å; T655-V809 HydrophobicContact CG2-CG1 4.04Å; F760-V809 HydrophobicContact CB-CG1 4.19Å; F760-V809 HydrophobicContact CD1-CB 4.15Å; F760-V809 HydrophobicContact CD1-CG1 3.93Å; F760-V809 HydrophobicContact CD1-CG2 4.23Å; F760-V809 HydrophobicContact CD2-CG1 3.98Å; F760-V809 HydrophobicContact CE1-CB 4.23Å; F760-V809 HydrophobicContact CE1-CG1 4.25Å; F760-V809 HydrophobicContact CE1-CG2 3.79Å; F760-V809 HydrophobicContact CE2-CG1 4.28Å; F760-V809 HydrophobicContact CG-CG1 3.78Å; F760-V809 HydrophobicContact CZ-CG1 4.4Å; F760-V809 HydrophobicContact CZ-CG2 3.95Å; T805-V809 HydrophobicContact CG2-CG1 4.43Å; T805-V809 WeakPolarHBondContact O-CG1 3.43Å; T805-V809 WeakPolarHBondContact O-CG2 3.48Å; T805-V809 PolarHBondContact O-N 2.89Å; L806-V809 PolarHBondContact O-N 2.84Å
810	L	94.9	Very high	94	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.005	25%	0.245	C	C	.	.	I	π-helix	trans	-110.6	-64.4	176.5	-59.7	-179.1	0	0	0	111.6	L238 W243 F332 I351 L806 K812 K813 Y814	L238-L810 HydrophobicContact CD2-CD1 3.49Å; L238-L810 VanDerWaalsContact CD2-CD1 3.49Å; W243-L810 HydrophobicContact CH2-CD1 4.46Å; W243-L810 HydrophobicContact CH2-CD2 4.09Å; W243-L810 HydrophobicContact CZ2-CD1 3.84Å; W243-L810 HydrophobicContact CZ2-CD2 3.95Å; W243-L810 HydrophobicContact CZ2-CG 4.45Å; F332-L810 HydrophobicContact CD2-CD1 4.27Å; F332-L810 HydrophobicContact CD2-CD2 3.76Å; F332-L810 HydrophobicContact CD2-CG 4.33Å; F332-L810 HydrophobicContact CE2-CD1 4.2Å; F332-L810 HydrophobicContact CE2-CD2 3.96Å; F332-L810 HydrophobicContact CE2-CG 4.14Å; I351-L810 HydrophobicContact CD1-CD2 3.86Å; L806-L810 HydrophobicContact CD2-CD1 4.18Å; L806-L810 WeakPolarHBondContact O-CA 3.47Å; L806-L810 VanDerWaalsContact O-CB 3.3Å; L806-L810 WeakPolarHBondContact O-CB 3.21Å; L806-L810 PolarHBondContact O-N 3.05Å; L810-K812 VanDerWaalsContact C-N 3.34Å; L810-K812 PolarHBondContact O-N 3.15Å; L810-K813 WeakPolarHBondContact O-CA 3.49Å; L810-K813 WeakPolarHBondContact O-CB 3.34Å; L810-K813 PolarHBondContact O-N 3.29Å; L810-Y814 WeakPolarHBondContact O-CD2 3.43Å; L810-Y814 PolarHBondContact O-N 3.49Å
811	D	94.6	Very high	94.1	Very high	40 Å²	40	50.5 Å²	50.5	21%	0.214	24%	0.243	C	C	.	.	I	π-helix	trans	-65	-40.8	-165.3	-55.8	-26.1	0	0	0	111.2	R241 L806 K807 K813 Y814 N815	R241-D811 IonicContact CZ-OD2 2.55Å; R241-D811 VanDerWaalsContact CZ-OD2 3.26Å; R241-D811 IonicContact NE-OD1 2.73Å; R241-D811 PolarHBondContact NE-OD1 2.95Å; R241-D811 VanDerWaalsContact NE-OD1 3.09Å; R241-D811 IonicContact NE-OD2 3.52Å; R241-D811 PolarHBondContact NE-OD2 3.33Å; R241-D811 IonicContact NH2-OD2 3.19Å; R241-D811 PolarHBondContact NH2-OD2 3.11Å; L806-D811 PolarHBondContact O-N 3.45Å; K807-D811 WeakPolarHBondContact CA-OD2 3.2Å; K807-D811 PolarHBondContact O-N 2.89Å; D811-K813 PolarHBondContact O-N 2.99Å; D811-Y814 PolarHBondContact O-N 3.29Å; D811-N815 PolarHBondContact O-N 2.78Å
812	K	91.9	Very high	94.1	Very high	53 Å²	53	54.9 Å²	54.9	23%	0.23	26%	0.259	C	S	.	.	H	α-helix	trans	-65	-20	176.2	-152	171.2	-154.5	59.6	0	114.5	W663 K807 L810 N815 R816 S818 V820	W663-K812 HydrophobicContact CH2-CD 3.71Å; W663-K812 HydrophobicContact CZ2-CD 4.4Å; W663-K812 HydrophobicContact CZ3-CD 4.44Å; K807-K812 PolarHBondContact O-N 2.94Å; L810-K812 VanDerWaalsContact C-N 3.34Å; L810-K812 PolarHBondContact O-N 3.15Å; K812-N815 VanDerWaalsContact CA-O 3.3Å; K812-N815 WeakPolarHBondContact CA-O 3.36Å; K812-N815 CarbonylContact O-C 3.5Å; K812-R816 WeakPolarHBondContact CE-O 3.49Å; K812-R816 PolarHBondContact NZ-O 2.78Å; K812-S818 VanDerWaalsContact CA-OG 3.26Å; K812-S818 WeakPolarHBondContact CA-OG 3.34Å; K812-S818 WeakPolarHBondContact CB-OG 3.42Å; K812-S818 PolarHBondContact N-OG 2.79Å; K812-S818 PolarHBondContact NZ-O 2.73Å; K812-S818 VanDerWaalsContact NZ-O 3.09Å; K812-V820 HydrophobicContact CD-CG1 3.64Å
813	K	86.9	Confident	94.1	Very high	107 Å²	107	54.7 Å²	54.7	47%	0.465	26%	0.258	S	S	.	.	H	α-helix	trans	-78.4	-28.7	176.2	-161.6	177	-171.2	165.8	0	112	N758 L810 D811	N758-K813 PolarHBondContact OD1-NZ 3.49Å; L810-K813 WeakPolarHBondContact O-CA 3.49Å; L810-K813 WeakPolarHBondContact O-CB 3.34Å; L810-K813 PolarHBondContact O-N 3.29Å; D811-K813 PolarHBondContact O-N 2.99Å
814	Y	85.7	Confident	94.1	Very high	134 Å²	134	55.3 Å²	55.3	53%	0.525	26%	0.261	S	S	.	.	H	α-helix	trans	-88.9	-41.5	173.9	-62.6	-73.4	0	0	0	111.9	L810 D811	L810-Y814 WeakPolarHBondContact O-CD2 3.43Å; L810-Y814 PolarHBondContact O-N 3.49Å; D811-Y814 PolarHBondContact O-N 3.29Å
815	N	89.8	Confident	94.1	Very high	87 Å²	87	59 Å²	59	47%	0.465	28%	0.28	S	S	.	.			trans	-131.3	110.4	176.3	174.4	15.3	0	0	0	110.2	D811 K812 N817 S818	D811-N815 PolarHBondContact O-N 2.78Å; K812-N815 VanDerWaalsContact CA-O 3.3Å; K812-N815 WeakPolarHBondContact CA-O 3.36Å; K812-N815 CarbonylContact O-C 3.5Å; N815-N817 PolarHBondContact O-N 3.28Å; N815-N817 VanDerWaalsContact O-N 3.07Å; N815-N817 PolarHBondContact OD1-N 3.03Å; N815-S818 VanDerWaalsContact O-CB 3.31Å; N815-S818 WeakPolarHBondContact O-CB 3.48Å; N815-S818 PolarHBondContact O-N 3.08Å; N815-S818 PolarHBondContact O-OG 2.85Å
816	R	88.7	Confident	94.1	Very high	215 Å²	215	60 Å²	60	81%	0.811	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-29.4	179.5	-65.6	-177.5	-179.2	176.8	1.8	113.4	K812 S818	K812-R816 WeakPolarHBondContact CE-O 3.49Å; K812-R816 PolarHBondContact NZ-O 2.78Å; R816-S818 VanDerWaalsContact C-N 3.3Å
817	N	90	Very high	94	Very high	137 Å²	137	62.8 Å²	62.8	73%	0.733	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	18.6	-179.7	-57.3	10.7	0	0	0	111.7	N815	N815-N817 PolarHBondContact O-N 3.28Å; N815-N817 VanDerWaalsContact O-N 3.07Å; N815-N817 PolarHBondContact OD1-N 3.03Å
818	S	91.9	Very high	93.9	Very high	20 Å²	20	67.8 Å²	67.8	14%	0.14	31%	0.314	C	S	.	.	S	Bend	trans	-63	153.4	167.9	75.9	0	0	0	0	110.5	K812 N815 R816	K812-S818 VanDerWaalsContact CA-OG 3.26Å; K812-S818 WeakPolarHBondContact CA-OG 3.34Å; K812-S818 WeakPolarHBondContact CB-OG 3.42Å; K812-S818 PolarHBondContact N-OG 2.79Å; K812-S818 PolarHBondContact NZ-O 2.73Å; K812-S818 VanDerWaalsContact NZ-O 3.09Å; N815-S818 VanDerWaalsContact O-CB 3.31Å; N815-S818 WeakPolarHBondContact O-CB 3.48Å; N815-S818 PolarHBondContact O-N 3.08Å; N815-S818 PolarHBondContact O-OG 2.85Å; R816-S818 VanDerWaalsContact C-N 3.3Å
819	D	95	Very high	93.5	Very high	94 Å²	94	69.4 Å²	69.4	50%	0.503	32%	0.321	S	S	.	.			trans	-49.6	153.6	155.1	-178	34.8	0	0	0	110.9	K807 G821	K807-D819 VanDerWaalsContact CD-OD2 3.24Å; K807-D819 WeakPolarHBondContact CD-OD2 3.18Å; K807-D819 VanDerWaalsContact CE-OD2 3.25Å; K807-D819 WeakPolarHBondContact CE-OD2 3.3Å; K807-D819 IonicContact NZ-OD2 3.33Å; K807-D819 PolarHBondContact NZ-OD2 3.28Å; D819-G821 WeakPolarHBondContact OD1-CA 3.23Å; D819-G821 PolarHBondContact OD1-N 3.08Å; D819-G821 PolarHBondContact OD2-N 2.87Å
820	V	95.6	Very high	92.9	Very high	25 Å²	25	72.7 Å²	72.7	15%	0.152	34%	0.342	C	S	.	.			trans	-127.3	2.9	173.5	-72.2	0	0	0	0	111.4	W663 V808 K812 F823	W663-V820 HydrophobicContact CZ3-CG1 4.25Å; V808-V820 HydrophobicContact CG2-CB 3.93Å; V808-V820 HydrophobicContact CG2-CG1 3.96Å; K812-V820 HydrophobicContact CD-CG1 3.64Å; V820-F823 HydrophobicContact CB-CB 4.42Å; V820-F823 WeakPolarHBondContact CG2-O 3.5Å; V820-F823 PolarHBondContact O-N 3.08Å
821	G	96.5	Very high	91.6	Very high	23 Å²	23	79.7 Å²	79.7	24%	0.237	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.3	-133.5	-169.5	0	0	0	0	0	110.8	D804 D819 F823	D804-G821 WeakPolarHBondContact OD1-CA 3.41Å; D804-G821 WeakPolarHBondContact OD2-CA 3.41Å; D819-G821 WeakPolarHBondContact OD1-CA 3.23Å; D819-G821 PolarHBondContact OD1-N 3.08Å; D819-G821 PolarHBondContact OD2-N 2.87Å; G821-F823 PolarHBondContact O-N 3.09Å
822	R	97.4	Very high	89.8	Confident	93 Å²	93	84.7 Å²	84.7	35%	0.351	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	18.2	-175	-57.6	176.9	70.6	87.5	-10.5	112.9	Y665 Q666 D667 D804	Y665-R822 HydrophobicContact CD2-CB 4.36Å; Y665-R822 WeakPolarHBondContact CD2-O 3.35Å; Y665-R822 HydrophobicContact CE1-CB 4.31Å; Y665-R822 HydrophobicContact CE2-CB 3.75Å; Q666-R822 HydrophobicContact CB-CB 4.41Å; Q666-R822 WeakPolarHBondContact CG-O 3.45Å; Q666-R822 PolarHBondContact N-O 2.84Å; D667-R822 IonicContact OD1-CZ 3.67Å; D667-R822 VanDerWaalsContact OD1-CZ 3.25Å; D667-R822 IonicContact OD1-NE 3.08Å; D667-R822 PolarHBondContact OD1-NE 3.48Å; D667-R822 IonicContact OD1-NH2 2.67Å; D667-R822 PolarHBondContact OD1-NH2 3.41Å; D667-R822 WeakPolarHBondContact OD2-CD 3.47Å; D667-R822 IonicContact OD2-CZ 2.72Å; D667-R822 IonicContact OD2-NE 2.67Å; D667-R822 PolarHBondContact OD2-NE 3.33Å; D667-R822 IonicContact OD2-NH2 2.61Å; D804-R822 PolarHBondContact OD2-N 3.45Å
823	F	98.1	Very high	87.5	Confident	5 Å²	5	87.1 Å²	87.1	2%	0.022	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	127.4	165.8	-82.9	-68.8	0	0	0	112.5	L653 W663 W664 Y665 L762 V801 D804 T805 V808 V820 G821	L653-F823 HydrophobicContact CB-CD1 4.3Å; L653-F823 HydrophobicContact CB-CE1 3.53Å; L653-F823 HydrophobicContact CB-CZ 3.79Å; L653-F823 HydrophobicContact CD2-CD2 4.44Å; L653-F823 HydrophobicContact CD2-CE1 4.15Å; L653-F823 HydrophobicContact CD2-CE2 4.06Å; L653-F823 HydrophobicContact CD2-CZ 3.9Å; L653-F823 HydrophobicContact CG-CZ 4.49Å; W663-F823 HydrophobicContact CB-CB 4.48Å; W663-F823 HydrophobicContact CB-CD1 3.7Å; W663-F823 HydrophobicContact CB-CE1 4.36Å; W663-F823 HydrophobicContact CB-CG 4.35Å; W663-F823 HydrophobicContact CE3-CB 4.43Å; W664-F823 CarbonylContact O-C 3.58Å; W664-F823 WeakPolarHBondContact O-CA 3.33Å; Y665-F823 AromaticContact CD2-CD1 3.76Å; Y665-F823 HydrophobicContact CD2-CD1 3.76Å; Y665-F823 AromaticContact CD2-CD2 3.68Å; Y665-F823 HydrophobicContact CD2-CD2 3.68Å; Y665-F823 AromaticContact CD2-CE1 3.72Å; Y665-F823 HydrophobicContact CD2-CE1 3.72Å; Y665-F823 AromaticContact CD2-CE2 3.63Å; Y665-F823 HydrophobicContact CD2-CE2 3.63Å; Y665-F823 AromaticContact CD2-CG 3.72Å; Y665-F823 HydrophobicContact CD2-CG 3.72Å; Y665-F823 AromaticContact CD2-CZ 3.66Å; Y665-F823 HydrophobicContact CD2-CZ 3.66Å; Y665-F823 AromaticContact CE2-CD2 3.89Å; Y665-F823 HydrophobicContact CE2-CD2 3.89Å; Y665-F823 AromaticContact CE2-CE2 3.9Å; Y665-F823 HydrophobicContact CE2-CE2 3.9Å; Y665-F823 HydrophobicContact CE2-CG 4.29Å; Y665-F823 HydrophobicContact CE2-CZ 4.34Å; Y665-F823 HydrophobicContact CG-CE1 4.26Å; Y665-F823 HydrophobicContact CG-CZ 4.34Å; L762-F823 HydrophobicContact CD1-CZ 4.09Å; V801-F823 HydrophobicContact CG2-CE2 4.17Å; V801-F823 HydrophobicContact CG2-CZ 3.84Å; D804-F823 HydrophobicContact CB-CD2 3.81Å; D804-F823 HydrophobicContact CB-CE2 4.02Å; T805-F823 WeakPolarHBondContact OG1-CE2 3.48Å; V808-F823 HydrophobicContact CG2-CB 3.76Å; V808-F823 HydrophobicContact CG2-CD2 3.7Å; V808-F823 HydrophobicContact CG2-CG 3.9Å; V820-F823 HydrophobicContact CB-CB 4.42Å; V820-F823 WeakPolarHBondContact CG2-O 3.5Å; V820-F823 PolarHBondContact O-N 3.08Å; G821-F823 PolarHBondContact O-N 3.09Å
824	E	96.6	Very high	85.5	Confident	55 Å²	55	86.4 Å²	86.4	26%	0.257	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	152	165.3	63.1	178.7	-129.5	0	0	111.4	W663 W664 Q666 K739 L826	W663-E824 CarbonylContact C-O 3.54Å; W663-E824 WeakPolarHBondContact CA-O 3.3Å; W664-E824 HydrophobicContact CB-CG 3.86Å; W664-E824 HydrophobicContact CG-CG 4.46Å; W664-E824 PolarHBondContact N-O 3.21Å; W664-E824 PolarHBondContact O-N 3.07Å; Q666-E824 HydrophobicContact CG-CG 4.31Å; Q666-E824 PolarHBondContact NE2-OE2 3.1Å; K739-E824 WeakPolarHBondContact CE-OE1 3.11Å; K739-E824 IonicContact NZ-OE1 2.73Å; K739-E824 PolarHBondContact NZ-OE1 3.22Å; K739-E824 IonicContact NZ-OE2 2.67Å; E824-L826 PolarHBondContact O-N 3.09Å
825	L	97.1	Very high	83.4	Confident	85 Å²	85	84.7 Å²	84.7	45%	0.445	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	93.9	175.8	-178.8	65.7	0	0	0	110	T661 W663 R828	T661-L825 HydrophobicContact CG2-CD1 3.98Å; W663-L825 HydrophobicContact CD2-CD1 3.95Å; W663-L825 HydrophobicContact CE3-CB 3.94Å; W663-L825 HydrophobicContact CE3-CD1 4.22Å; W663-L825 HydrophobicContact CG-CD1 4.48Å; W663-L825 HydrophobicContact CH2-CB 4.27Å; W663-L825 HydrophobicContact CH2-CD1 4.19Å; W663-L825 HydrophobicContact CZ2-CD1 3.94Å; W663-L825 HydrophobicContact CZ3-CB 3.81Å; W663-L825 HydrophobicContact CZ3-CD1 4.34Å; L825-R828 HydrophobicContact CD1-CB 4.5Å; L825-R828 HydrophobicContact CD2-CB 4.39Å
826	L	97	Very high	80.9	Confident	21 Å²	21	86 Å²	86	11%	0.11	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	-46.3	179.9	171.9	61.1	0	0	0	112.7	V662 W664 K739 E824 M929	V662-L826 HydrophobicContact CG1-CD2 4.38Å; V662-L826 PolarHBondContact O-N 3.4Å; V662-L826 VanDerWaalsContact O-N 3.08Å; W664-L826 HydrophobicContact CB-CB 3.93Å; W664-L826 HydrophobicContact CB-CD2 4.35Å; W664-L826 HydrophobicContact CE3-CD2 3.84Å; K739-L826 HydrophobicContact CB-CD1 3.9Å; K739-L826 HydrophobicContact CB-CD2 4.31Å; K739-L826 HydrophobicContact CD-CD1 4.07Å; K739-L826 HydrophobicContact CG-CD1 3.96Å; K739-L826 HydrophobicContact CG-CD2 4.32Å; E824-L826 PolarHBondContact O-N 3.09Å; L826-M929 HydrophobicContact CD1-CE 4.36Å
827	Y	96.2	Very high	78.4	Confident	59 Å²	59	82.1 Å²	82.1	23%	0.231	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	140.9	-176.4	-172.7	-103.9	0	0	0	112.6	L660 T661 V662 L743 L747 Q829	L660-Y827 HydrophobicContact CD2-CD1 4.31Å; L660-Y827 HydrophobicContact CD2-CE1 4.28Å; L660-Y827 HydrophobicContact CG-CD1 4.24Å; L660-Y827 HydrophobicContact CG-CE1 4.44Å; T661-Y827 WeakPolarHBondContact CA-O 3.42Å; V662-Y827 PolarHBondContact N-O 2.9Å; V662-Y827 PolarHBondContact O-N 3.35Å; V662-Y827 VanDerWaalsContact O-N 3.08Å; L743-Y827 HydrophobicContact CD1-CD1 3.63Å; L743-Y827 HydrophobicContact CD1-CD2 3.84Å; L743-Y827 HydrophobicContact CD1-CE1 4.17Å; L743-Y827 HydrophobicContact CD1-CE2 4.37Å; L743-Y827 HydrophobicContact CD1-CG 3.43Å; L743-Y827 VanDerWaalsContact CD1-CG 3.43Å; L743-Y827 HydrophobicContact CD2-CD2 3.89Å; L743-Y827 HydrophobicContact CD2-CE2 4.44Å; L743-Y827 HydrophobicContact CD2-CG 4.24Å; L747-Y827 HydrophobicContact CD2-CE1 4.08Å; Y827-Q829 HydrophobicContact CE1-CB 3.73Å; Y827-Q829 HydrophobicContact CE1-CG 4.33Å
828	R	94.7	Very high	76.1	Confident	144 Å²	144	86.7 Å²	86.7	54%	0.543	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	112	167.1	-169.4	174.9	-170.4	-162.5	1.1	109.9	P659 L660 T661 L825	P659-R828 HydrophobicContact CG-CG 4.47Å; L660-R828 WeakPolarHBondContact O-CA 3.48Å; T661-R828 HydrophobicContact CG2-CG 4.17Å; L825-R828 HydrophobicContact CD1-CB 4.5Å; L825-R828 HydrophobicContact CD2-CB 4.39Å
829	Q	89.3	Confident	73.6	Confident	44 Å²	44	90.3 Å²	90.3	21%	0.206	46%	0.459	C	S	.	.			trans	-62	141.6	-179.7	-163.3	-176.7	29.2	0	0	111.2	P659 L660 Y827	P659-Q829 HydrophobicContact CB-CB 3.76Å; P659-Q829 WeakPolarHBondContact CB-O 3.45Å; L660-Q829 HydrophobicContact CB-CB 4.27Å; L660-Q829 PolarHBondContact O-N 2.98Å; Y827-Q829 HydrophobicContact CE1-CB 3.73Å; Y827-Q829 HydrophobicContact CE1-CG 4.33Å
830	P	83.1	Confident	71.3	Confident	84 Å²	84	89 Å²	89	55%	0.545	47%	0.467	S	S	.	.			trans	-60.1	140.6	169.1	-24.5	35.3	0	0	0	112	H832	P830-H832 PolarHBondContact O-CD2 3.47Å; P830-H832 PolarHBondContact O-N 2.99Å
831	F	66.6	Low	69	Low	149 Å²	149	91.2 Å²	91.2	65%	0.654	48%	0.476	S	S	*	.			trans	-69.2	96.1	173	-87.5	-89.9	0	0	0	110.7	P659	P659-F831 VanDerWaalsContact CD-CE1 3.44Å; P659-F831 HydrophobicContact CG-CD2 4.01Å; P659-F831 HydrophobicContact CG-CE1 4.41Å; P659-F831 HydrophobicContact CG-CE2 3.72Å; P659-F831 HydrophobicContact CG-CG 4.48Å; P659-F831 HydrophobicContact CG-CZ 3.95Å
832	H	57.6	Low	66.6	Low	145 Å²	145	95.7 Å²	95.7	67%	0.671	49%	0.491	S	S	*	.			trans	-76.1	121.1	160.5	-67.6	-84.7	0	0	0	108.8	P830 P834	P830-H832 PolarHBondContact O-CD2 3.47Å; P830-H832 PolarHBondContact O-N 2.99Å; H832-P834 VanDerWaalsContact O-CD 3.3Å; H832-P834 WeakPolarHBondContact O-CD 3.09Å
833	N	44	Very low	64.1	Low	103 Å²	103	99.2 Å²	99.2	55%	0.551	52%	0.516	S	S	*	.			trans	-68.1	116.2	-176.3	179.7	-12.5	0	0	0	110.2	S835 T836	N833-S835 PolarHBondContact ND2-OG 3.21Å; N833-S835 PolarHBondContact O-N 3.34Å; N833-S835 VanDerWaalsContact OD1-CB 3.29Å; N833-S835 WeakPolarHBondContact OD1-CB 3.02Å; N833-S835 PolarHBondContact OD1-N 3.18Å; N833-S835 PolarHBondContact OD1-OG 3.12Å; N833-T836 PolarHBondContact O-N 3.34Å; N833-T836 VanDerWaalsContact O-N 3.15Å; N833-T836 PolarHBondContact O-OG1 3.28Å
834	P	44.9	Very low	62	Low	93 Å²	93	107.1 Å²	107.1	60%	0.604	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-68.1	5.8	-176.9	29.5	-36.1	0	0	0	114.1	H832 T836 M837	H832-P834 VanDerWaalsContact O-CD 3.3Å; H832-P834 WeakPolarHBondContact O-CD 3.09Å; P834-T836 PolarHBondContact O-N 3.07Å; P834-M837 HydrophobicContact CB-CG 4.42Å; P834-M837 VanDerWaalsContact O-CB 3.23Å; P834-M837 WeakPolarHBondContact O-CB 3.23Å; P834-M837 WeakPolarHBondContact O-CG 3.24Å; P834-M837 PolarHBondContact O-N 3.36Å
835	S	40.7	Very low	59.7	Low	98 Å²	98	111.1 Å²	111.1	69%	0.685	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-56.7	-21.6	161	-57.8	0	0	0	0	113.1	N833 M837	N833-S835 PolarHBondContact ND2-OG 3.21Å; N833-S835 PolarHBondContact O-N 3.34Å; N833-S835 VanDerWaalsContact OD1-CB 3.29Å; N833-S835 WeakPolarHBondContact OD1-CB 3.02Å; N833-S835 PolarHBondContact OD1-N 3.18Å; N833-S835 PolarHBondContact OD1-OG 3.12Å; S835-M837 VanDerWaalsContact C-N 3.32Å
836	T	37.9	Very low	57.9	Low	115 Å²	115	112.1 Å²	112.1	71%	0.706	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-93.8	28.4	167.8	60.4	0	0	0	0	113.1	N833 P834	N833-T836 PolarHBondContact O-N 3.34Å; N833-T836 VanDerWaalsContact O-N 3.15Å; N833-T836 PolarHBondContact O-OG1 3.28Å; P834-T836 PolarHBondContact O-N 3.07Å
837	M	36	Very low	56.2	Low	133 Å²	133	114.3 Å²	114.3	66%	0.655	61%	0.607	S	S	*	*			trans	-49.8	141.4	172.7	-112.2	-174.1	155	0	0	111.5	P834 S835 T839	P834-M837 HydrophobicContact CB-CG 4.42Å; P834-M837 VanDerWaalsContact O-CB 3.23Å; P834-M837 WeakPolarHBondContact O-CB 3.23Å; P834-M837 WeakPolarHBondContact O-CG 3.24Å; P834-M837 PolarHBondContact O-N 3.36Å; S835-M837 VanDerWaalsContact C-N 3.32Å; M837-T839 PolarHBondContact O-N 3.02Å
838	Y	42.4	Very low	54.7	Low	233 Å²	233	116.7 Å²	116.7	91%	0.914	63%	0.632	S	S	*	*			trans	-56	93.6	-175.2	-97	-106.2	0	0	0	112.5
839	T	39.1	Very low	53.4	Low	96 Å²	96	119.4 Å²	119.4	59%	0.589	65%	0.648	S	S	*	*			trans	-103.4	8.2	165.9	50.1	0	0	0	0	111.7	M837 M841	M837-T839 PolarHBondContact O-N 3.02Å; T839-M841 PolarHBondContact O-N 3.3Å
840	G	47.3	Very low	52.2	Low	65 Å²	65	122.2 Å²	122.2	67%	0.67	66%	0.663	S	S	*	*	S	Bend	trans	64.4	5.7	-178.7	0	0	0	0	0	115.6
841	M	45.9	Very low	51.3	Low	73 Å²	73	122.3 Å²	122.3	36%	0.36	67%	0.666	S	S	.	*			trans	-103.8	-14.6	-166.3	-81.7	-168.8	-75.7	0	0	116.2	T839	T839-M841 PolarHBondContact O-N 3.3Å
842	E	46.8	Very low	50.7	Low	116 Å²	116	124.2 Å²	124.2	54%	0.542	67%	0.674	S	S	.	*			trans	-129.3	62.6	179.8	-62.7	-155	126	0	0	112.3	Y844 K1293	E842-Y844 PolarHBondContact O-N 3Å; E842-K1293 WeakPolarHBondContact OE1-CE 3.22Å; E842-K1293 IonicContact OE1-NZ 2.63Å; E842-K1293 PolarHBondContact OE1-NZ 2.96Å
843	L	45.8	Very low	50.5	Low	168 Å²	168	121.8 Å²	121.8	88%	0.88	67%	0.672	S	S	*	*			trans	-63.3	122.5	158.8	-72.7	168.5	0	0	0	109.3
844	Y	52.9	Low	50.5	Low	170 Å²	170	125.5 Å²	125.5	67%	0.667	69%	0.686	S	S	*	*			trans	-112.4	136.2	165.9	56	-97.7	0	0	0	109.5	E842 I846 M936	E842-Y844 PolarHBondContact O-N 3Å; Y844-I846 HydrophobicContact CD2-CD1 3.88Å; Y844-I846 HydrophobicContact CD2-CG1 4.03Å; Y844-I846 HydrophobicContact CE2-CD1 3.84Å; Y844-I846 HydrophobicContact CE2-CG1 4.47Å; Y844-M936 HydrophobicContact CE2-CE 4.37Å
845	V	48	Very low	50.3	Low	140 Å²	140	126.7 Å²	126.7	85%	0.848	69%	0.686	S	S	*	*			trans	-105.3	121.3	174	178.6	0	0	0	0	107.9
846	I	60.5	Low	50.2	Low	106 Å²	106	129.7 Å²	129.7	54%	0.544	69%	0.689	S	S	.	*			trans	-100.8	93.3	173.8	-66.4	168.2	0	0	0	107.4	Y844 M936	Y844-I846 HydrophobicContact CD2-CD1 3.88Å; Y844-I846 HydrophobicContact CD2-CG1 4.03Å; Y844-I846 HydrophobicContact CE2-CD1 3.84Å; Y844-I846 HydrophobicContact CE2-CG1 4.47Å; I846-M936 HydrophobicContact CD1-CE 3.47Å; I846-M936 VanDerWaalsContact CD1-CE 3.47Å; I846-M936 HydrophobicContact CD1-CG 4.06Å; I846-M936 HydrophobicContact CD1-SD 3.78Å
847	G	60.1	Low	50.1	Low	66 Å²	66	130.1 Å²	130.1	68%	0.68	69%	0.687	S	S	*	*			trans	-92.4	123.2	174.8	0	0	0	0	0	111.4
848	S	64.3	Low	50.1	Low	110 Å²	110	128 Å²	128	77%	0.769	68%	0.682	S	S	*	*			trans	-75.2	132.3	162.6	-64.4	0	0	0	0	109.4	I850	S848-I850 PolarHBondContact O-N 3.43Å
849	K	69.3	Low	49.8	Very low	200 Å²	200	121.6 Å²	121.6	87%	0.87	67%	0.667	S	S	*	*			trans	-66.2	105	167.1	179.9	-177.6	176	-178.1	0	108.3	S851	K849-S851 PolarHBondContact O-N 3.44Å
850	I	63.8	Low	49.8	Very low	103 Å²	103	122 Å²	122	53%	0.528	67%	0.669	S	S	.	*			trans	-67.5	112.8	162.7	-57.4	176.8	0	0	0	106.2	S848	S848-I850 PolarHBondContact O-N 3.43Å
851	S	64.4	Low	49.3	Very low	87 Å²	87	122 Å²	122	61%	0.608	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-60.2	136.6	163.7	30	0	0	0	0	108.4	K849	K849-S851 PolarHBondContact O-N 3.44Å
852	K	52.8	Low	48.8	Very low	188 Å²	188	127 Å²	127	82%	0.817	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-52.2	127.5	158.5	-171.8	178	-175.3	-179	0	105.4	Q854	K852-Q854 PolarHBondContact O-N 3.07Å
853	P	54	Low	48.2	Very low	95 Å²	95	125.3 Å²	125.3	62%	0.617	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-54.5	119.5	178.2	22.5	-32.3	0	0	0	106.8	L855	P853-L855 PolarHBondContact O-N 3.48Å
854	Q	43.3	Very low	47.8	Very low	181 Å²	181	124 Å²	124	85%	0.846	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-67.4	125.1	168.6	-74.1	-172.3	-30.1	0	0	105.3	K852 E856	K852-Q854 PolarHBondContact O-N 3.07Å; Q854-E856 VanDerWaalsContact C-N 3.33Å; Q854-E856 PolarHBondContact O-N 3.08Å
855	L	41.3	Very low	47	Very low	117 Å²	117	121 Å²	121	61%	0.613	65%	0.651	S	S	*	*			trans	-58.4	107.4	158.9	-87.3	50.2	0	0	0	104.8	P853 N857 L861	P853-L855 PolarHBondContact O-N 3.48Å; L855-N857 PolarHBondContact O-N 3.46Å; L855-L861 HydrophobicContact CB-CD1 3.89Å; L855-L861 HydrophobicContact CD2-CD1 3.65Å; L855-L861 HydrophobicContact CG-CD1 3.78Å
856	E	38.5	Very low	46.4	Very low	161 Å²	161	120.6 Å²	120.6	75%	0.752	64%	0.638	S	S	*	*			trans	-62.2	107.5	164.7	-69.6	-168.3	161	0	0	105.6	Q854 T858	Q854-E856 VanDerWaalsContact C-N 3.33Å; Q854-E856 PolarHBondContact O-N 3.08Å; E856-T858 PolarHBondContact O-N 3.34Å
857	N	36.7	Very low	45.1	Very low	125 Å²	125	118.9 Å²	118.9	67%	0.668	64%	0.64	S	S	*	*			trans	-76.1	43.3	-173.8	-78.6	-28.8	0	0	0	111.6	L855	L855-N857 PolarHBondContact O-N 3.46Å
858	T	34.3	Very low	43.9	Very low	87 Å²	87	120.6 Å²	120.6	53%	0.534	64%	0.637	S	S	.	*	S	Bend	trans	-131	123.7	-170.7	14.4	0	0	0	0	108.8	E856 V860	E856-T858 PolarHBondContact O-N 3.34Å; T858-V860 PolarHBondContact O-N 3.13Å
859	T	37.9	Very low	42.5	Very low	100 Å²	100	121.8 Å²	121.8	61%	0.613	63%	0.634	S	S	*	*	S	Bend	trans	65.9	-75.6	177.1	-41.6	0	0	0	0	115.5	L861 R862 C863	T859-L861 PolarHBondContact O-N 3.02Å; T859-R862 CarbonylContact O-C 3.56Å; T859-R862 WeakPolarHBondContact O-CA 3.45Å; T859-R862 WeakPolarHBondContact O-CB 3.49Å; T859-R862 PolarHBondContact O-N 3.42Å; T859-C863 PolarHBondContact O-N 3.03Å
860	V	38.5	Very low	40.6	Very low	104 Å²	104	117.9 Å²	117.9	63%	0.63	62%	0.623	S	S	*	*	H	α-helix	trans	-58.9	-46.9	-162.6	-175.4	0	0	0	0	113.5	T858 R862 C863 F864	T858-V860 PolarHBondContact O-N 3.13Å; V860-R862 VanDerWaalsContact C-N 3.28Å; V860-R862 PolarHBondContact O-N 3.16Å; V860-C863 WeakPolarHBondContact O-CB 3.3Å; V860-C863 PolarHBondContact O-N 3.3Å; V860-F864 PolarHBondContact O-N 3.4Å
861	L	36.9	Very low	39	Very low	64 Å²	64	121.9 Å²	121.9	34%	0.335	64%	0.637	S	S	.	*	H	α-helix	trans	-70.9	-21.4	176.9	-79	153.3	0	0	0	113.6	L855 T859 N865	L855-L861 HydrophobicContact CB-CD1 3.89Å; L855-L861 HydrophobicContact CD2-CD1 3.65Å; L855-L861 HydrophobicContact CG-CD1 3.78Å; T859-L861 PolarHBondContact O-N 3.02Å; L861-N865 VanDerWaalsContact O-CB 3.31Å; L861-N865 WeakPolarHBondContact O-CB 3.45Å; L861-N865 PolarHBondContact O-N 3.13Å
862	R	34.7	Very low	37.4	Very low	180 Å²	180	125.1 Å²	125.1	68%	0.679	65%	0.647	S	S	*	*	H	α-helix	trans	-81.2	-20.6	173.5	-160.8	177.8	-67.8	163.7	-0.3	111.8	T859 V860 K866	T859-R862 CarbonylContact O-C 3.56Å; T859-R862 WeakPolarHBondContact O-CA 3.45Å; T859-R862 WeakPolarHBondContact O-CB 3.49Å; T859-R862 PolarHBondContact O-N 3.42Å; V860-R862 VanDerWaalsContact C-N 3.28Å; V860-R862 PolarHBondContact O-N 3.16Å; R862-K866 WeakPolarHBondContact O-CB 3.13Å; R862-K866 PolarHBondContact O-N 3.25Å
863	C	35.3	Very low	36.2	Very low	79 Å²	79	119.7 Å²	119.7	53%	0.534	65%	0.645	S	S	.	*	H	α-helix	trans	-76.6	-49.7	166.2	-61.8	0	0	0	0	110.9	T859 V860 K866 A867	T859-C863 PolarHBondContact O-N 3.03Å; V860-C863 WeakPolarHBondContact O-CB 3.3Å; V860-C863 PolarHBondContact O-N 3.3Å; C863-K866 PolarHBondContact O-N 3.23Å; C863-K866 VanDerWaalsContact O-N 3.14Å; C863-A867 PolarHBondContact O-N 2.84Å
864	F	36.2	Very low	35.1	Very low	141 Å²	141	124.6 Å²	124.6	62%	0.618	66%	0.66	S	S	*	*	H	α-helix	trans	-58.8	-50.3	177.3	-108.6	-93.2	0	0	0	112.2	V860 K866 A867 T868	V860-F864 PolarHBondContact O-N 3.4Å; F864-K866 PolarHBondContact O-N 3.43Å; F864-K866 VanDerWaalsContact O-N 3.15Å; F864-A867 PolarHBondContact O-N 3.29Å; F864-A867 VanDerWaalsContact O-N 3.15Å; F864-T868 PolarHBondContact O-N 2.86Å; F864-T868 VanDerWaalsContact O-N 3.13Å; F864-T868 PolarHBondContact O-OG1 2.73Å; F864-T868 VanDerWaalsContact O-OG1 3.08Å
865	N	36.3	Very low	34.3	Very low	107 Å²	107	121.1 Å²	121.1	57%	0.572	66%	0.655	S	S	*	*	H	α-helix	trans	-73.9	-2.2	179.1	-67.3	-1.4	0	0	0	114.2	L861	L861-N865 VanDerWaalsContact O-CB 3.31Å; L861-N865 WeakPolarHBondContact O-CB 3.45Å; L861-N865 PolarHBondContact O-N 3.13Å
866	K	35.1	Very low	33.7	Very low	132 Å²	132	123.8 Å²	123.8	57%	0.574	67%	0.669	S	S	*	*	H	α-helix	trans	-88.6	-47.6	162.5	-96.6	-164	159.5	-136.1	0	111.3	R862 C863 F864 T868 L869 D870	R862-K866 WeakPolarHBondContact O-CB 3.13Å; R862-K866 PolarHBondContact O-N 3.25Å; C863-K866 PolarHBondContact O-N 3.23Å; C863-K866 VanDerWaalsContact O-N 3.14Å; F864-K866 PolarHBondContact O-N 3.43Å; F864-K866 VanDerWaalsContact O-N 3.15Å; K866-T868 PolarHBondContact O-N 3.27Å; K866-T868 VanDerWaalsContact O-N 3.12Å; K866-L869 PolarHBondContact O-N 3.32Å; K866-D870 PolarHBondContact O-N 2.97Å; K866-D870 VanDerWaalsContact O-N 3.13Å
867	A	33.1	Very low	33.4	Very low	69 Å²	69	121.7 Å²	121.7	57%	0.57	67%	0.669	S	S	*	*	H	α-helix	trans	-56.8	-28.4	179	0	0	0	0	0	113.2	C863 F864	C863-A867 PolarHBondContact O-N 2.84Å; F864-A867 PolarHBondContact O-N 3.29Å; F864-A867 VanDerWaalsContact O-N 3.15Å
868	T	35.9	Very low	33	Very low	103 Å²	103	122.3 Å²	122.3	63%	0.632	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	6.6	177.1	-31.6	0	0	0	0	114.5	F864 K866	F864-T868 PolarHBondContact O-N 2.86Å; F864-T868 VanDerWaalsContact O-N 3.13Å; F864-T868 PolarHBondContact O-OG1 2.73Å; F864-T868 VanDerWaalsContact O-OG1 3.08Å; K866-T868 PolarHBondContact O-N 3.27Å; K866-T868 VanDerWaalsContact O-N 3.12Å
869	L	33.5	Very low	32.9	Very low	135 Å²	135	123.8 Å²	123.8	71%	0.707	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.6	-23.6	178.1	-85	173.4	0	0	0	114.8	K866 F871	K866-L869 PolarHBondContact O-N 3.32Å; L869-F871 PolarHBondContact O-N 2.87Å
870	D	31	Very low	32.4	Very low	117 Å²	117	126.9 Å²	126.9	63%	0.626	69%	0.691	S	S	*	*			trans	-83.7	21.7	175.8	-67.8	-38.3	0	0	0	113.1	K866 N872	K866-D870 PolarHBondContact O-N 2.97Å; K866-D870 VanDerWaalsContact O-N 3.13Å; D870-N872 PolarHBondContact O-N 2.9Å
871	F	29.4	Very low	32	Very low	188 Å²	188	127.4 Å²	127.4	83%	0.825	70%	0.695	S	S	*	*			trans	-81.1	36.5	175.8	-117.5	-79.8	0	0	0	113.5	L869	L869-F871 PolarHBondContact O-N 2.87Å
872	N	30.8	Very low	31.5	Very low	154 Å²	154	133.5 Å²	133.5	82%	0.824	72%	0.718	S	S	*	*	S	Bend	trans	-124.9	113.2	167.6	-88.5	-57.9	0	0	0	108.4	D870	D870-N872 PolarHBondContact O-N 2.9Å
873	G	27.7	Very low	31.2	Very low	75 Å²	75	130.9 Å²	130.9	77%	0.773	72%	0.722	S	S	*	*			trans	-79.5	136.1	-156.2	0	0	0	0	0	115.8
874	Q	30	Very low	30.8	Very low	198 Å²	198	134.9 Å²	134.9	93%	0.925	74%	0.735	S	S	*	*			trans	-151.6	139.6	142.4	-109.9	162.3	55.3	0	0	110.1
875	S	28	Very low	30.3	Very low	108 Å²	108	132.7 Å²	132.7	76%	0.755	74%	0.737	S	S	*	*			trans	-99.2	136.1	-173.4	55.5	0	0	0	0	112.3
876	L	28.9	Very low	29.9	Very low	173 Å²	173	133.5 Å²	133.5	91%	0.906	75%	0.746	S	S	*	*			trans	-143.6	154.8	159	-92.9	129.7	0	0	0	110.4
877	P	31.4	Very low	29.6	Very low	116 Å²	116	135 Å²	135	75%	0.753	76%	0.759	S	S	*	*			trans	-98.2	166.7	-155.5	38	-36.6	0	0	0	115.8
878	N	29.1	Very low	29.3	Very low	139 Å²	139	134.6 Å²	134.6	74%	0.743	76%	0.761	S	S	*	*			trans	-81.3	137.1	-179.4	-170.4	34.6	0	0	0	113.3
879	P	32.2	Very low	28.8	Very low	117 Å²	117	141 Å²	141	76%	0.76	77%	0.774	S	S	*	*			trans	-116.6	127	164.8	35.3	-23.2	0	0	0	113.1
880	E	26.6	Very low	28.7	Very low	165 Å²	165	141.7 Å²	141.7	77%	0.771	78%	0.778	S	S	*	*			trans	-104.4	145.6	177.6	-98.8	-170.7	162.7	0	0	113.9
881	V	30	Very low	28.5	Very low	116 Å²	116	145 Å²	145	70%	0.703	79%	0.786	S	S	*	*			trans	75.2	148	147.3	168.4	0	0	0	0	119.9
882	K	26.6	Very low	28.3	Very low	191 Å²	191	145.2 Å²	145.2	83%	0.83	79%	0.787	S	S	*	*			trans	73.1	151	173.7	-78.9	160.6	-176.9	171.5	0	115.9
883	V	28.3	Very low	28.1	Very low	126 Å²	126	145.2 Å²	145.2	76%	0.764	79%	0.787	S	S	*	*			cis	-133.7	123.6	9.4	-175.1	0	0	0	0	108.3
884	M	25.7	Very low	28.2	Very low	163 Å²	163	151.1 Å²	151.1	80%	0.803	80%	0.797	S	S	*	*				52.7	127.2	94.3	-145.4	-171.2	-70.8	0	0	118.6
885	S	27.7	Very low	28.2	Very low	95 Å²	95	146.9 Å²	146.9	66%	0.664	79%	0.789	S	S	*	*			trans	51	124.9	152.6	59.1	0	0	0	0	122.1
886	T	26	Very low	28.8	Very low	124 Å²	124	146.7 Å²	146.7	76%	0.761	79%	0.785	S	S	*	*				164.7	161.8	108	-60.8	0	0	0	0	110
887	I	29.4	Very low	28.8	Very low	164 Å²	164	144.9 Å²	144.9	84%	0.841	78%	0.775	S	S	*	*			trans	71.5	128.9	176.2	-42	179	0	0	0	114.2
888	G	26.2	Very low	28.8	Very low	59 Å²	59	145.6 Å²	145.6	61%	0.608	78%	0.777	S	S	*	*			cis	122.9	108.2	-12.4	0	0	0	0	0	115
889	R	26.6	Very low	28.9	Very low	239 Å²	239	145 Å²	145	90%	0.902	77%	0.774	S	S	*	*			trans	71.1	107.5	170.2	-50.7	170.3	-177	144.7	0.5	116.5
890	D	31	Very low	28.8	Very low	148 Å²	148	147.9 Å²	147.9	79%	0.791	77%	0.769	S	S	*	*				173.6	134.5	110.4	-84.8	-21.2	0	0	0	109.1
891	K	26.5	Very low	29	Very low	187 Å²	187	144.9 Å²	144.9	81%	0.813	76%	0.755	S	S	*	*			cis	73.7	82.7	47	-78.4	-170.1	173.9	176	0	115.6
892	K	26.3	Very low	29	Very low	192 Å²	192	144.4 Å²	144.4	84%	0.835	75%	0.752	S	S	*	*			trans	75.5	162.8	153.6	-55.7	-178.6	175	-177.7	0	116.5
893	N	26.5	Very low	29.1	Very low	154 Å²	154	144.6 Å²	144.6	82%	0.824	75%	0.753	S	S	*	*			trans	67.7	94.7	169.1	-54.8	-11.8	0	0	0	117.3
894	M	28.3	Very low	29.2	Very low	200 Å²	200	143.1 Å²	143.1	99%	0.985	75%	0.748	S	S	*	*				-161	127.7	110	-106.9	-171.7	-174.3	0	0	113.4
895	S	31.8	Very low	29.5	Very low	109 Å²	109	143 Å²	143	76%	0.762	75%	0.746	S	S	*	*			trans	-175.9	175.7	171.2	72.1	0	0	0	0	106.4
896	P	39.1	Very low	29.5	Very low	104 Å²	104	144 Å²	144	68%	0.675	75%	0.748	S	S	*	*			cis	-130.4	-142.4	-18.7	24.4	1.3	0	0	0	109.8
897	I	28.6	Very low	29.6	Very low	135 Å²	135	149.5 Å²	149.5	69%	0.692	76%	0.755	S	S	*	*			trans	89.4	120.6	153.5	-61.5	164.1	0	0	0	118.7	L899	I897-L899 HydrophobicContact CG2-CD2 3.99Å
898	V	31.7	Very low	29.5	Very low	131 Å²	131	149.5 Å²	149.5	79%	0.794	75%	0.749	S	S	*	*				-174.8	125.4	119.8	145	0	0	0	0	105.3
899	L	31.7	Very low	29.5	Very low	127 Å²	127	152.9 Å²	152.9	67%	0.665	75%	0.749	S	S	*	*			cis	-155.9	179.8	-11.8	-85.3	179.4	0	0	0	105.3	I897	I897-L899 HydrophobicContact CG2-CD2 3.99Å
900	R	29.3	Very low	29.5	Very low	176 Å²	176	148.4 Å²	148.4	66%	0.664	74%	0.741	S	S	*	*			cis	-166	173.4	2.4	-121.3	171.9	-168.9	-136	15	105.8
901	Q	31.3	Very low	29.3	Very low	102 Å²	102	150.5 Å²	150.5	48%	0.477	74%	0.743	S	S	.	*			cis	-146	136.9	-20.4	-153.4	163.4	-31.8	0	0	112	E1119	Q901-E1119 PolarHBondContact N-OE1 2.9Å; Q901-E1119 VanDerWaalsContact N-OE1 3.11Å
902	T	29.5	Very low	29.6	Very low	106 Å²	106	147.4 Å²	147.4	65%	0.65	74%	0.742	S	S	*	*			trans	52.8	119	155.1	44.7	0	0	0	0	121.8
903	K	29.5	Very low	29.7	Very low	196 Å²	196	143.5 Å²	143.5	85%	0.852	74%	0.739	S	S	*	*				63.1	134.2	88.4	-66.4	-177.6	-175.6	-179.8	0	114.5
904	S	30.5	Very low	29.8	Very low	94 Å²	94	142.5 Å²	142.5	66%	0.657	73%	0.734	S	S	*	*			cis	-162.7	-159.3	-0	44.9	0	0	0	0	108.6
905	Q	32	Very low	29.9	Very low	162 Å²	162	140.1 Å²	140.1	76%	0.757	73%	0.731	S	S	*	*			cis	-163.1	161.5	11.6	-149.1	144.2	-89.6	0	0	114.1
906	T	28.3	Very low	29.8	Very low	115 Å²	115	138.4 Å²	138.4	71%	0.706	73%	0.73	S	S	*	*			trans	20.3	122.1	158.1	51.6	0	0	0	0	125.2
907	R	26.6	Very low	29.3	Very low	239 Å²	239	141.3 Å²	141.3	90%	0.902	74%	0.74	S	S	*	*			trans	39.3	125.9	130.6	-71.3	-176.6	170.4	-174.3	-3.2	121
908	K	29.3	Very low	29.3	Very low	165 Å²	165	143.7 Å²	143.7	72%	0.717	75%	0.748	S	S	*	*				-165.9	137.4	98.1	-107.8	-175.7	170	-115.5	0	115
909	E	25.8	Very low	29.1	Very low	129 Å²	129	148 Å²	148	60%	0.603	75%	0.752	S	S	*	*			trans	47.4	127.1	139.2	-73.1	147.8	-149.7	0	0	123.8
910	I	26.8	Very low	28.9	Very low	145 Å²	145	150.6 Å²	150.6	74%	0.744	76%	0.76	S	S	*	*				69	128.6	130	-64.2	172.8	0	0	0	117.2
911	K	25.5	Very low	28.8	Very low	192 Å²	192	154 Å²	154	84%	0.835	77%	0.773	S	S	*	*			cis	-153.8	170.5	11	-124.3	165.5	-173	179.4	0	109.6
912	P	33.5	Very low	28.7	Very low	122 Å²	122	155.6 Å²	155.6	79%	0.792	79%	0.79	S	S	*	*			trans	-103.4	152.5	-172.5	37.9	-31.4	0	0	0	116
913	S	28.8	Very low	28.6	Very low	110 Å²	110	154.8 Å²	154.8	77%	0.769	79%	0.785	S	S	*	*			trans	-156.7	115.7	158.8	57.3	0	0	0	0	109
914	N	27.4	Very low	28.5	Very low	134 Å²	134	152 Å²	152	72%	0.717	78%	0.775	S	S	*	*				69.2	140.9	74.8	-88.9	-33.7	0	0	0	115.5
915	T	30.5	Very low	28.5	Very low	150 Å²	150	154.7 Å²	154.7	92%	0.92	78%	0.781	S	S	*	*			trans	74.4	123.9	-167.7	72.4	0	0	0	0	114.2
916	G	30.3	Very low	28.4	Very low	72 Å²	72	150 Å²	150	74%	0.742	77%	0.77	S	S	*	*			cis	-163.9	148.5	-10.1	0	0	0	0	0	111.2
917	D	29.7	Very low	28.4	Very low	165 Å²	165	151.3 Å²	151.3	88%	0.882	77%	0.766	S	S	*	*			trans	-79.6	-169.9	-171.1	-64.1	-79.9	0	0	0	114.4
918	E	26.7	Very low	28.5	Very low	185 Å²	185	143.1 Å²	143.1	86%	0.864	76%	0.756	S	S	*	*			trans	76	60.1	177.3	-53.6	-160.2	133.4	0	0	118.2
919	Y	27.7	Very low	28.8	Very low	223 Å²	223	140.2 Å²	140.2	88%	0.875	75%	0.746	S	S	*	*	S	Bend	trans	-147.1	19.5	159.5	-123.5	-78.3	0	0	0	118.4
920	E	27.8	Very low	29.1	Very low	180 Å²	180	140.2 Å²	140.2	84%	0.841	75%	0.75	S	S	*	*			trans	-143	55.3	-173.6	-152.8	158.9	-132.2	0	0	115.7
921	R	27.1	Very low	29.3	Very low	247 Å²	247	134.2 Å²	134.2	93%	0.932	72%	0.724	S	S	*	*	S	Bend	trans	-133.8	13.9	177.4	-123.6	178.4	-171.3	-177.8	2.5	117.6
922	T	29.5	Very low	29.6	Very low	137 Å²	137	132.1 Å²	132.1	84%	0.84	72%	0.721	S	S	*	*	S	Bend	trans	-113	13.9	-175.2	48.9	0	0	0	0	115.1
923	T	28.2	Very low	29.7	Very low	89 Å²	89	133.5 Å²	133.5	55%	0.546	72%	0.721	S	S	.	*	S	Bend	trans	-118.2	-2.3	-166.3	26	0	0	0	0	116.7
924	E	27.3	Very low	29.8	Very low	137 Å²	137	132.2 Å²	132.2	64%	0.64	71%	0.71	S	S	*	*	S	Bend	trans	-102.3	-39.2	-175.2	-64.8	-109.4	91.1	0	0	113.8	A926 K927	E924-A926 PolarHBondContact O-N 2.7Å; E924-K927 WeakPolarHBondContact O-CB 3.47Å; E924-K927 PolarHBondContact O-N 2.73Å; E924-K927 IonicContact OE1-NZ 3.38Å; E924-K927 PolarHBondContact OE1-NZ 2.93Å
925	I	30.1	Very low	29.8	Very low	150 Å²	150	131.5 Å²	131.5	77%	0.769	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-61.3	-30.4	-179.8	-63.6	175.9	0	0	0	111.8	K927 G928	I925-K927 PolarHBondContact O-N 3.22Å; I925-K927 VanDerWaalsContact O-N 3.12Å; I925-G928 PolarHBondContact O-N 2.81Å
926	A	30.4	Very low	29.7	Very low	64 Å²	64	129.6 Å²	129.6	53%	0.529	70%	0.695	S	S	.	*	G	3₁₀ helix	trans	-63.4	-14.9	176	0	0	0	0	0	114.7	E924 N930	E924-A926 PolarHBondContact O-N 2.7Å; A926-N930 PolarHBondContact O-ND2 3.14Å
927	K	27.7	Very low	29.5	Very low	143 Å²	143	135.8 Å²	135.8	62%	0.622	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-81.1	-24.7	177.6	-63.7	174.3	-170.4	162.9	0	112.8	E924 I925	E924-K927 WeakPolarHBondContact O-CB 3.47Å; E924-K927 PolarHBondContact O-N 2.73Å; E924-K927 IonicContact OE1-NZ 3.38Å; E924-K927 PolarHBondContact OE1-NZ 2.93Å; I925-K927 PolarHBondContact O-N 3.22Å; I925-K927 VanDerWaalsContact O-N 3.12Å
928	G	29.1	Very low	29.6	Very low	67 Å²	67	133.7 Å²	133.7	69%	0.691	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	-34	179.9	0	0	0	0	0	114.4	I925 N930	I925-G928 PolarHBondContact O-N 2.81Å; G928-N930 PolarHBondContact O-N 3.03Å
929	M	35.8	Very low	29.6	Very low	104 Å²	104	127.7 Å²	127.7	51%	0.512	69%	0.685	S	S	.	*	S	Bend	trans	-82.5	-10.2	-170.7	-62.1	179.8	75.2	0	0	114.6	L826 G931	L826-M929 HydrophobicContact CD1-CE 4.36Å; M929-G931 PolarHBondContact O-N 3.03Å
930	N	31.2	Very low	29.4	Very low	129 Å²	129	127.3 Å²	127.3	69%	0.69	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	53.5	178.4	-77.4	-75.5	0	0	0	112.1	A926 G928 K1240	A926-N930 PolarHBondContact O-ND2 3.14Å; G928-N930 PolarHBondContact O-N 3.03Å; N930-K1240 PolarHBondContact O-NZ 2.79Å
931	G	30.2	Very low	29.4	Very low	18 Å²	18	127.7 Å²	127.7	19%	0.186	69%	0.687	C	S	.	*	T	Hydrogen-bonded Turn	trans	-110.9	-37	-175.8	0	0	0	0	0	115.8	M929 K1240	M929-G931 PolarHBondContact O-N 3.03Å; G931-K1240 WeakPolarHBondContact O-CG 3.15Å
932	L	33.8	Very low	29.4	Very low	148 Å²	148	121 Å²	121	78%	0.775	68%	0.676	S	S	*	*	S	Bend	trans	-111.2	52.9	-161.7	-67.2	169.8	0	0	0	113.5
933	L	34.8	Very low	29.2	Very low	152 Å²	152	121 Å²	121	80%	0.796	68%	0.676	S	S	*	*	S	Bend	trans	-169.5	139.5	159.6	-99.6	142.8	0	0	0	108.7
934	P	31	Very low	29.2	Very low	82 Å²	82	123.3 Å²	123.3	53%	0.532	69%	0.685	S	S	.	*			trans	-69.2	137.5	178.7	27.3	-34.4	0	0	0	111.8	M936	P934-M936 PolarHBondContact O-N 2.72Å
935	P	27.2	Very low	29.4	Very low	119 Å²	119	123.5 Å²	123.5	77%	0.773	69%	0.691	S	S	*	*			trans	-73.2	97.2	-178.6	29	-34.6	0	0	0	111.4	K937	P935-K937 PolarHBondContact O-N 2.97Å
936	M	29.1	Very low	29.2	Very low	111 Å²	111	125.7 Å²	125.7	55%	0.547	70%	0.698	S	S	.	*			trans	-64.3	95.5	170.4	-85.9	176.7	38.6	0	0	110.8	Y844 I846 P934 C938	Y844-M936 HydrophobicContact CE2-CE 4.37Å; I846-M936 HydrophobicContact CD1-CE 3.47Å; I846-M936 VanDerWaalsContact CD1-CE 3.47Å; I846-M936 HydrophobicContact CD1-CG 4.06Å; I846-M936 HydrophobicContact CD1-SD 3.78Å; P934-M936 PolarHBondContact O-N 2.72Å; M936-C938 PolarHBondContact O-N 3.11Å
937	K	25.6	Very low	29.2	Very low	202 Å²	202	128.1 Å²	128.1	88%	0.878	71%	0.711	S	S	*	*			trans	-61	97	172.4	-69.6	-178.5	178.2	178.2	0	110.4	P935 G939	P935-K937 PolarHBondContact O-N 2.97Å; K937-G939 PolarHBondContact O-N 3.48Å
938	C	30.3	Very low	29	Very low	120 Å²	120	127.4 Å²	127.4	81%	0.811	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-61.9	129.1	162.7	-71	0	0	0	0	108.8	M936	M936-C938 PolarHBondContact O-N 3.11Å
939	G	27.4	Very low	28.9	Very low	59 Å²	59	132.8 Å²	132.8	61%	0.608	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-64.6	147.1	-179.8	0	0	0	0	0	111.9	K937 F941	K937-G939 PolarHBondContact O-N 3.48Å; G939-F941 PolarHBondContact O-N 3.18Å
940	K	24.6	Very low	28.4	Very low	215 Å²	215	135.3 Å²	135.3	94%	0.935	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-57.3	119.5	171	-64.9	-177.7	178.2	-175.5	0	109.2
941	F	27.1	Very low	28.3	Very low	188 Å²	188	136.9 Å²	136.9	83%	0.825	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-99.7	147.6	157.7	-85.4	-86.1	0	0	0	109	G939	G939-F941 PolarHBondContact O-N 3.18Å
942	P	27.9	Very low	28.1	Very low	108 Å²	108	142.1 Å²	142.1	70%	0.701	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-65.4	137.8	-175.1	-20.6	33.3	0	0	0	112.4
943	T	25.1	Very low	28	Very low	137 Å²	137	142.7 Å²	142.7	84%	0.84	78%	0.776	S	S	*	*			trans	-76.8	115	155.7	46.3	0	0	0	0	108.2
944	D	28.2	Very low	27.8	Very low	136 Å²	136	141.9 Å²	141.9	73%	0.727	77%	0.772	S	S	*	*			trans	-147.9	153.7	169.8	-96.6	-46.3	0	0	0	111.7
945	N	30.5	Very low	27.7	Very low	142 Å²	142	145.2 Å²	145.2	76%	0.759	79%	0.786	S	S	*	*			trans	60.3	80	170.7	-62	-21.8	0	0	0	116.8	S947	N945-S947 PolarHBondContact O-N 2.81Å
946	Q	26.1	Very low	28.1	Very low	195 Å²	195	144.1 Å²	144.1	91%	0.911	78%	0.779	S	S	*	*			trans	-40.7	131.8	132.5	-63.8	171.4	-17.1	0	0	110
947	S	29.6	Very low	27.9	Very low	115 Å²	115	144.4 Å²	144.4	80%	0.804	79%	0.787	S	S	*	*			trans	-144.2	116.2	159.4	41.5	0	0	0	0	109.1	N945	N945-S947 PolarHBondContact O-N 2.81Å
948	T	25.1	Very low	27.9	Very low	129 Å²	129	142.8 Å²	142.8	79%	0.791	78%	0.779	S	S	*	*			trans	-80.2	127	-175.4	44.9	0	0	0	0	111.5
949	M	27	Very low	27.8	Very low	180 Å²	180	145.9 Å²	145.9	89%	0.887	78%	0.782	S	S	*	*			trans	-133.2	96.1	144.9	-81.4	-161.9	168.7	0	0	109.4	I951	M949-I951 PolarHBondContact O-N 2.89Å
950	N	25	Very low	27.8	Very low	156 Å²	156	148.2 Å²	148.2	83%	0.834	78%	0.78	S	S	*	*			trans	-71.3	114.6	161.4	-75.9	-23.5	0	0	0	108
951	I	28.7	Very low	27.8	Very low	163 Å²	163	146.1 Å²	146.1	84%	0.836	77%	0.773	S	S	*	*			trans	-120.4	94.7	150.8	-59.8	-177	0	0	0	106.3	M949	M949-I951 PolarHBondContact O-N 2.89Å
952	N	26.5	Very low	27.7	Very low	127 Å²	127	142.5 Å²	142.5	68%	0.679	77%	0.771	S	S	*	*			trans	-82	154.5	162.5	-173.1	28.9	0	0	0	108.8
953	I	31.5	Very low	27.9	Very low	161 Å²	161	143.3 Å²	143.3	83%	0.826	77%	0.774	S	S	*	*			trans	158.4	132.2	151.4	-85.9	155	0	0	0	108.8
954	D	30.2	Very low	28	Very low	134 Å²	134	144.1 Å²	144.1	72%	0.717	77%	0.766	S	S	*	*			trans	-89.9	162.2	-178.3	-58.3	-85.9	0	0	0	113.9
955	N	29.7	Very low	27.9	Very low	153 Å²	153	143.9 Å²	143.9	82%	0.818	76%	0.76	S	S	*	*			trans	75.4	172.4	145.5	-115.1	-3.1	0	0	0	117.7
956	P	34.4	Very low	27.7	Very low	95 Å²	95	143.1 Å²	143.1	62%	0.617	76%	0.761	S	S	*	*				-140.4	-173.7	-110.3	47.4	-29.5	0	0	0	116.6
957	V	25	Very low	27.8	Very low	118 Å²	118	144.4 Å²	144.4	72%	0.715	76%	0.757	S	S	*	*			trans	73.3	127.8	157.2	175.3	0	0	0	0	118.4
958	K	26	Very low	27.6	Very low	167 Å²	167	148.1 Å²	148.1	73%	0.726	76%	0.759	S	S	*	*			trans	55.8	109.3	160.6	-70.5	167.6	-174.1	176.8	0	120
959	H	29.2	Very low	27.6	Very low	185 Å²	185	147.2 Å²	147.2	86%	0.856	76%	0.758	S	S	*	*				-148	112.3	118	-110.9	-85.9	0	0	0	106.6
960	L	25.7	Very low	27.6	Very low	109 Å²	109	144 Å²	144	57%	0.571	75%	0.754	S	S	*	*				67	103.2	60.6	-70.7	171.8	0	0	0	114.7
961	Q	25.3	Very low	27.7	Very low	171 Å²	171	147.7 Å²	147.7	80%	0.799	76%	0.756	S	S	*	*			trans	45.6	120.7	137.3	-64.2	169.6	-41.2	0	0	119.3
962	S	24.7	Very low	27.6	Very low	111 Å²	111	144 Å²	144	78%	0.776	74%	0.744	S	S	*	*				-178.1	-174.6	93.5	52.1	0	0	0	0	111.1
963	V	31.9	Very low	27.6	Very low	126 Å²	126	147.5 Å²	147.5	76%	0.764	75%	0.754	S	S	*	*			trans	71.8	90.4	-164.4	-169.4	0	0	0	0	111.8
964	K	27.2	Very low	27.3	Very low	153 Å²	153	144.8 Å²	144.8	67%	0.665	75%	0.749	S	S	*	*				66.3	143.7	58.8	-58.3	178.6	148.1	-104.5	0	112.9
965	E	26.3	Very low	27.1	Very low	131 Å²	131	144.3 Å²	144.3	61%	0.612	76%	0.755	S	S	*	*			cis	-171.9	148	-14.7	-109.2	150.7	-173.3	0	0	106.1
966	T	26	Very low	26.8	Very low	127 Å²	127	144.4 Å²	144.4	78%	0.779	75%	0.748	S	S	*	*			trans	61	168	172.5	75.5	0	0	0	0	116.7
967	R	28.5	Very low	26.5	Very low	221 Å²	221	150.7 Å²	150.7	83%	0.834	76%	0.761	S	S	*	*			cis	-113.8	140.6	-19.1	-85.7	97.9	-177.2	-126.8	-1.8	107.4
968	K	25.9	Very low	26.4	Very low	194 Å²	194	151.4 Å²	151.4	84%	0.843	76%	0.756	S	S	*	*				45.9	113.7	85.7	-77.6	-172.3	175.8	-178.2	0	115.6
969	S	25	Very low	26.6	Very low	109 Å²	109	150.3 Å²	150.3	76%	0.762	76%	0.758	S	S	*	*			trans	47.4	121.8	146.8	58.7	0	0	0	0	121.3
970	S	27.6	Very low	26.4	Very low	114 Å²	114	147.5 Å²	147.5	80%	0.797	75%	0.746	S	S	*	*				175.1	152.7	100.5	50.4	0	0	0	0	116.2
971	R	27.3	Very low	26.5	Very low	232 Å²	232	150.4 Å²	150.4	88%	0.875	76%	0.761	S	S	*	*			trans	20	110.2	147.6	-69.3	173.9	171.2	155.7	-4.6	121.4
972	S	24.7	Very low	26.5	Very low	86 Å²	86	148.6 Å²	148.6	60%	0.601	75%	0.75	S	S	*	*				27	117.5	121.1	60.2	0	0	0	0	121.6
973	K	28	Very low	26.5	Very low	201 Å²	201	150.2 Å²	150.2	87%	0.874	75%	0.749	S	S	*	*			trans	173.9	122	138.9	-94.1	166.3	179.6	-173.7	0	106.5
974	S	24.1	Very low	26.3	Very low	103 Å²	103	150 Å²	150	72%	0.72	75%	0.751	S	S	*	*				78.2	79.1	61.1	78.3	0	0	0	0	115.6
975	C	26.1	Very low	26.3	Very low	124 Å²	124	149.2 Å²	149.2	84%	0.838	75%	0.754	S	S	*	*			trans	-162.2	125.8	143.5	-105.9	0	0	0	0	106.3
976	K	24.4	Very low	26.5	Very low	156 Å²	156	148 Å²	148	68%	0.678	76%	0.756	S	S	*	*				51.6	99.5	66.7	-82.9	-148	171.5	-148.5	0	113.7	E978	K976-E978 WeakPolarHBondContact CE-OE2 3.4Å; K976-E978 IonicContact NZ-OE2 2.9Å; K976-E978 PolarHBondContact NZ-OE2 3.1Å
977	Y	27.4	Very low	26.5	Very low	226 Å²	226	147.3 Å²	147.3	89%	0.886	76%	0.756	S	S	*	*			trans	-136.9	109.7	136.9	-112.8	-79	0	0	0	108.1
978	E	24.1	Very low	26.6	Very low	134 Å²	134	141 Å²	141	63%	0.626	74%	0.742	S	S	*	*			trans	-89.1	144	168.3	-71.3	160.8	97.6	0	0	108.4	K976	K976-E978 WeakPolarHBondContact CE-OE2 3.4Å; K976-E978 IonicContact NZ-OE2 2.9Å; K976-E978 PolarHBondContact NZ-OE2 3.1Å
979	N	29.9	Very low	26.8	Very low	143 Å²	143	136.8 Å²	136.8	77%	0.765	73%	0.732	S	S	*	*			trans	-165.4	94.7	158.6	-95	-35.8	0	0	0	106.5
980	E	24.3	Very low	27	Very low	127 Å²	127	138.9 Å²	138.9	59%	0.593	74%	0.735	S	S	*	*				58.7	92.8	81.2	-75.4	-113.6	112.3	0	0	113.8	K982	E980-K982 WeakPolarHBondContact OE1-CE 3.5Å; E980-K982 IonicContact OE1-NZ 2.86Å; E980-K982 WeakPolarHBondContact OE2-CE 3.44Å; E980-K982 IonicContact OE2-NZ 2.7Å; E980-K982 PolarHBondContact OE2-NZ 3.49Å
981	L	28.1	Very low	27.1	Very low	169 Å²	169	140.9 Å²	140.9	89%	0.885	73%	0.729	S	S	*	*			trans	-167.1	74.2	151.5	-107	163.6	0	0	0	107.2
982	K	25.9	Very low	27.2	Very low	134 Å²	134	133.2 Å²	133.2	58%	0.583	71%	0.711	S	S	*	*				67.1	102.5	82.7	-72.7	173.5	160.8	156.7	0	114.7	E980	E980-K982 WeakPolarHBondContact OE1-CE 3.5Å; E980-K982 IonicContact OE1-NZ 2.86Å; E980-K982 WeakPolarHBondContact OE2-CE 3.44Å; E980-K982 IonicContact OE2-NZ 2.7Å; E980-K982 PolarHBondContact OE2-NZ 3.49Å
983	I	24.6	Very low	27.5	Very low	145 Å²	145	133.8 Å²	133.8	74%	0.744	71%	0.71	S	S	*	*			trans	55.5	108.8	134.7	-54.5	166.1	0	0	0	118.6	N985	I983-N985 HydrophobicContact CG2-CB 4.3Å
984	C	27.6	Very low	27.6	Very low	121 Å²	121	133 Å²	133	82%	0.818	71%	0.707	S	S	*	*			trans	-174.8	78.2	146.7	-111.1	0	0	0	0	107.1
985	N	26.6	Very low	27.8	Very low	136 Å²	136	133.8 Å²	133.8	73%	0.727	70%	0.703	S	S	*	*				52.9	73.4	66.8	-163.3	15.2	0	0	0	114.6	I983	I983-N985 HydrophobicContact CG2-CB 4.3Å
986	V	31.1	Very low	28	Very low	105 Å²	105	132.7 Å²	132.7	64%	0.636	69%	0.688	S	S	*	*			trans	-139.7	99.5	161.4	-178.9	0	0	0	0	109.9	T988	V986-T988 WeakPolarHBondContact CG1-OG1 3.12Å; V986-T988 PolarHBondContact O-N 3.49Å
987	S	26.2	Very low	28.3	Very low	113 Å²	113	132.4 Å²	132.4	79%	0.79	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	52.6	-178.7	-166.9	0	0	0	0	113.2
988	T	29.5	Very low	28.3	Very low	89 Å²	89	131.9 Å²	131.9	55%	0.546	68%	0.68	S	S	.	*	T	Hydrogen-bonded Turn	trans	-139.9	-19.1	-168.2	-33.8	0	0	0	0	115	V986 S992	V986-T988 WeakPolarHBondContact CG1-OG1 3.12Å; V986-T988 PolarHBondContact O-N 3.49Å; T988-S992 PolarHBondContact O-OG 3.14Å; T988-S992 VanDerWaalsContact O-OG 3.12Å
989	V	29.8	Very low	28.4	Very low	105 Å²	105	132.5 Å²	132.5	64%	0.636	69%	0.687	S	S	*	*	S	Bend	trans	-84.2	-38.8	-179.5	-176	0	0	0	0	112.1	K991 S992	V989-K991 PolarHBondContact O-N 2.61Å; V989-S992 WeakPolarHBondContact O-CB 3.34Å; V989-S992 PolarHBondContact O-N 2.67Å; V989-S992 VanDerWaalsContact O-N 3.07Å
990	L	30.5	Very low	28.3	Very low	154 Å²	154	131.8 Å²	131.8	81%	0.806	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-75.3	-18	-178.4	-89.3	160.8	0	0	0	114.8	S992	L990-S992 VanDerWaalsContact C-N 3.3Å
991	K	28.5	Very low	28.4	Very low	155 Å²	155	129 Å²	129	67%	0.674	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-81.2	-4.1	166.4	-84.2	-171.6	173.4	-177.4	0	113.9	V989	V989-K991 PolarHBondContact O-N 2.61Å
992	S	29.3	Very low	28.4	Very low	72 Å²	72	128.6 Å²	128.6	50%	0.503	69%	0.692	S	S	.	*	G	3₁₀ helix	trans	-102	-0.9	179.7	-58.4	0	0	0	0	114.2	T988 V989 L990	T988-S992 PolarHBondContact O-OG 3.14Å; T988-S992 VanDerWaalsContact O-OG 3.12Å; V989-S992 WeakPolarHBondContact O-CB 3.34Å; V989-S992 PolarHBondContact O-N 2.67Å; V989-S992 VanDerWaalsContact O-N 3.07Å; L990-S992 VanDerWaalsContact C-N 3.3Å
993	V	31.6	Very low	28.3	Very low	97 Å²	97	131.3 Å²	131.3	59%	0.588	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.5	-28.2	-178.1	-179.1	0	0	0	0	112.4	N995 I996	V993-N995 VanDerWaalsContact C-N 3.26Å; V993-N995 PolarHBondContact O-N 3.39Å; V993-I996 PolarHBondContact O-N 3.18Å
994	K	29.7	Very low	28.4	Very low	186 Å²	186	129 Å²	129	81%	0.809	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-17.2	173.3	-77.5	-161.3	169.1	-164.5	0	114.3
995	N	29.5	Very low	28.4	Very low	118 Å²	118	126.1 Å²	126.1	63%	0.631	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	16.7	176	-68.1	28.3	0	0	0	113.5	V993	V993-N995 VanDerWaalsContact C-N 3.26Å; V993-N995 PolarHBondContact O-N 3.39Å
996	I	29.7	Very low	28.4	Very low	101 Å²	101	126 Å²	126	52%	0.518	69%	0.688	S	S	.	*	S	Bend	trans	-120.8	43.5	173	-39.6	-177.1	0	0	0	110.7	V993	V993-I996 PolarHBondContact O-N 3.18Å
997	R	29.6	Very low	28.2	Very low	151 Å²	151	123.6 Å²	123.6	57%	0.57	68%	0.676	S	S	*	*	S	Bend	trans	-126.5	16.8	158.8	-149.3	172.3	-176.2	165.8	-0.2	111.3	D1326 M1329	R997-D1326 IonicContact CZ-OD1 3.4Å; R997-D1326 IonicContact NH1-OD1 2.82Å; R997-D1326 IonicContact NH2-OD1 2.69Å; R997-D1326 PolarHBondContact NH2-OD1 3.06Å; R997-M1329 VanDerWaalsContact CZ-SD 3.6Å; R997-M1329 PolarHBondContact NH1-SD 3.2Å
998	Y	27.7	Very low	28	Very low	214 Å²	214	123.9 Å²	123.9	84%	0.839	67%	0.668	S	S	*	*	S	Bend	trans	-143.6	9.7	-173.7	-115.1	-84.7	0	0	0	114.9
999	L	26.1	Very low	27.9	Very low	147 Å²	147	123.4 Å²	123.4	77%	0.77	67%	0.668	S	S	*	*	S	Bend	trans	-134.8	27.1	-177.3	-79.3	176.4	0	0	0	113.9
1000	T	29.1	Very low	27.8	Very low	128 Å²	128	124.6 Å²	124.6	79%	0.785	67%	0.665	S	S	*	*			trans	-135	38.5	161.1	55.9	0	0	0	0	110.3	L1002	T1000-L1002 PolarHBondContact O-N 3.49Å
1001	G	24.8	Very low	27.6	Very low	70 Å²	70	128.1 Å²	128.1	72%	0.722	67%	0.669	S	S	*	*			trans	-73.6	102.3	164.9	0	0	0	0	0	109.1
1002	L	28.2	Very low	27.4	Very low	159 Å²	159	127.5 Å²	127.5	83%	0.832	67%	0.673	S	S	*	*			trans	-138	70.4	162.2	-101.2	173.5	0	0	0	107.2	T1000 S1004	T1000-L1002 PolarHBondContact O-N 3.49Å; L1002-S1004 PolarHBondContact O-N 3.23Å
1003	E	24.8	Very low	27.3	Very low	191 Å²	191	129.2 Å²	129.2	89%	0.893	68%	0.676	S	S	*	*			trans	-73.4	111	168.2	-63.9	-179.4	145.2	0	0	107.5
1004	S	27.6	Very low	27.1	Very low	96 Å²	96	131.7 Å²	131.7	67%	0.671	69%	0.687	S	S	*	*			trans	-142.1	71.7	-174.3	70.9	0	0	0	0	112.8	L1002	L1002-S1004 PolarHBondContact O-N 3.23Å
1005	S	25.7	Very low	26.9	Very low	61 Å²	61	131.1 Å²	131.1	43%	0.427	69%	0.691	S	S	.	*	S	Bend		-163	37.2	126.5	81.2	0	0	0	0	113.5	R374	R374-S1005 PolarHBondContact NH1-OG 3.47Å; R374-S1005 PolarHBondContact NH2-OG 3.1Å
1006	V	27.1	Very low	26.8	Very low	133 Å²	133	129.8 Å²	129.8	81%	0.806	69%	0.69	S	S	*	*	S	Bend	trans	-114.7	134.8	159.4	-178.3	0	0	0	0	107
1007	C	26.5	Very low	26.9	Very low	55 Å²	55	132.5 Å²	132.5	37%	0.372	70%	0.701	S	S	.	*			trans	-47.2	139.5	-169.6	-52.4	0	0	0	0	114.7	T522 S1009	T522-C1007 HydrophobicContact CG2-CB 3.55Å; C1007-S1009 PolarHBondContact O-N 3.31Å
1008	L	23.8	Very low	27	Very low	119 Å²	119	131.3 Å²	131.3	62%	0.623	71%	0.706	S	S	*	*			trans	-84.4	111.5	179.4	-100.3	158	0	0	0	111.1	D527 L528	D527-L1008 PolarHBondContact OD2-N 3.11Å; D527-L1008 VanDerWaalsContact OD2-N 3.12Å; L528-L1008 HydrophobicContact CD2-CD1 3.54Å
1009	S	26.1	Very low	27	Very low	79 Å²	79	127.3 Å²	127.3	55%	0.552	70%	0.698	S	S	*	*			trans	-160.8	147.3	153.8	60.4	0	0	0	0	111	C1007	C1007-S1009 PolarHBondContact O-N 3.31Å
1010	K	27.2	Very low	27.2	Very low	130 Å²	130	126.7 Å²	126.7	57%	0.565	70%	0.696	S	S	*	*			trans	64.1	83.4	176.3	-55.9	-170.5	178.3	-171	0	116.7	S532	S532-K1010 PolarHBondContact OG-N 3.23Å
1011	Y	26.3	Very low	27.1	Very low	228 Å²	228	127.1 Å²	127.1	89%	0.894	69%	0.693	S	S	*	*			trans	-148.3	99.2	134.3	-114.3	-71.8	0	0	0	110.1
1012	N	25.2	Very low	27.2	Very low	142 Å²	142	130 Å²	130	76%	0.759	69%	0.691	S	S	*	*			trans	-166	146.6	162.6	-105.7	-9.7	0	0	0	104.7
1013	D	26.9	Very low	27.2	Very low	108 Å²	108	131.3 Å²	131.3	58%	0.578	69%	0.69	S	S	*	*			trans	69.4	117.7	-166.6	-36.6	-32	0	0	0	108.3	K533	K533-D1013 IonicContact NZ-OD2 2.68Å; K533-D1013 PolarHBondContact NZ-OD2 3.33Å
1014	D	28.3	Very low	27.4	Very low	150 Å²	150	127 Å²	127	80%	0.802	68%	0.681	S	S	*	*			cis	-133	149.9	24.5	-58.6	-55.3	0	0	0	115.2
1015	I	25.3	Very low	27.4	Very low	174 Å²	174	127.1 Å²	127.1	89%	0.892	68%	0.682	S	S	*	*			trans	-145	90.2	158	-56.4	-178.3	0	0	0	110.3
1016	S	27	Very low	27.5	Very low	90 Å²	90	135.4 Å²	135.4	63%	0.629	70%	0.704	S	S	*	*			trans	-179.7	116.3	161.4	52.8	0	0	0	0	106.1
1017	H	32.2	Very low	27.6	Very low	158 Å²	158	133.4 Å²	133.4	73%	0.731	70%	0.696	S	S	*	*				-165.5	175.5	62.2	-89.7	-86.8	0	0	0	108.2
1018	D	30.4	Very low	27.5	Very low	126 Å²	126	138.9 Å²	138.9	67%	0.674	72%	0.716	S	S	*	*			cis	-147.7	167.4	2.5	-129.8	-17.2	0	0	0	114.6
1019	D	29.6	Very low	27.7	Very low	129 Å²	129	137.4 Å²	137.4	69%	0.69	72%	0.715	S	S	*	*			trans	7.6	132.2	155.6	-83.5	-16.9	0	0	0	121.8
1020	N	28.9	Very low	27.7	Very low	134 Å²	134	143.5 Å²	143.5	72%	0.717	73%	0.728	S	S	*	*				-171	164.2	87.6	-120	-72.6	0	0	0	117.5
1021	L	28.3	Very low	27.5	Very low	137 Å²	137	143.8 Å²	143.8	72%	0.717	74%	0.735	S	S	*	*			trans	75	85.5	157.9	-66	162.4	0	0	0	121.1
1022	L	26.7	Very low	27.4	Very low	132 Å²	132	142 Å²	142	69%	0.691	73%	0.732	S	S	*	*				79.4	126.6	122.2	-69.9	176	0	0	0	122.9
1023	K	27.2	Very low	27.6	Very low	185 Å²	185	140.6 Å²	140.6	80%	0.804	73%	0.733	S	S	*	*			trans	76	130.6	147.1	-65.2	165.1	-174.5	179.3	0	116.6
1024	S	29.1	Very low	27.7	Very low	102 Å²	102	141.2 Å²	141.2	71%	0.713	75%	0.746	S	S	*	*			cis	-158.9	148.9	4.6	53.6	0	0	0	0	115.9
1025	S	28.2	Very low	27.5	Very low	97 Å²	97	139.7 Å²	139.7	68%	0.678	74%	0.737	S	S	*	*			trans	68.5	122.8	139.6	64.5	0	0	0	0	122.6
1026	R	27.9	Very low	27.5	Very low	235 Å²	235	140 Å²	140	89%	0.887	74%	0.735	S	S	*	*			trans	70.7	140.9	148.4	-70.3	174.5	171	157.4	-3.4	117.3
1027	S	28.5	Very low	27.8	Very low	91 Å²	91	145.2 Å²	145.2	64%	0.636	75%	0.749	S	S	*	*			cis	-159.6	138.7	-3.3	38.5	0	0	0	0	107.9
1028	E	25.5	Very low	27.6	Very low	171 Å²	171	145.3 Å²	145.3	80%	0.799	75%	0.754	S	S	*	*				52.4	138.1	99.4	-52.3	162.2	115.8	0	0	113.7
1029	S	27.1	Very low	27.4	Very low	87 Å²	87	145.6 Å²	145.6	61%	0.608	76%	0.756	S	S	*	*			cis	-178.3	143.1	0.6	41.1	0	0	0	0	106.1
1030	Y	25.8	Very low	27.3	Very low	207 Å²	207	147.7 Å²	147.7	81%	0.812	76%	0.758	S	S	*	*				-178.7	153.8	75.5	-90	-93.7	0	0	0	106
1031	L	24.2	Very low	27.5	Very low	137 Å²	137	147.4 Å²	147.4	72%	0.717	77%	0.767	S	S	*	*			cis	96.6	105.4	26.9	-86.9	175.6	0	0	0	117.8
1032	K	24.1	Very low	27.6	Very low	191 Å²	191	151.4 Å²	151.4	83%	0.83	77%	0.773	S	S	*	*			trans	77	149.6	135.8	-96.3	-174	176.6	-174.1	0	123.5
1033	S	27.9	Very low	28	Very low	111 Å²	111	150.9 Å²	150.9	78%	0.776	78%	0.777	S	S	*	*			trans	96	134.3	162.2	-38.7	0	0	0	0	115.1
1034	S	29	Very low	27.9	Very low	122 Å²	122	148 Å²	148	85%	0.853	77%	0.77	S	S	*	*			cis	-156.4	176.4	-13.1	-91.8	0	0	0	0	109.8
1035	L	24.7	Very low	28	Very low	117 Å²	117	151 Å²	151	61%	0.613	78%	0.776	S	S	*	*			trans	-108	170.4	-173.8	-121.8	170	0	0	0	112.8
1036	E	26.4	Very low	28.1	Very low	182 Å²	182	152.3 Å²	152.3	85%	0.85	78%	0.776	S	S	*	*			trans	80.1	111.4	167.9	-60.9	-179.6	176.2	0	0	120
1037	E	32.4	Very low	28.1	Very low	199 Å²	199	146.6 Å²	146.6	93%	0.93	77%	0.77	S	S	*	*				-154.4	-175	125.1	-134.9	-175.2	-155.1	0	0	111.7
1038	L	27.4	Very low	28.4	Very low	160 Å²	160	148.1 Å²	148.1	84%	0.838	78%	0.778	S	S	*	*			trans	-133.3	137.4	-147.3	-87.7	163.4	0	0	0	118.3
1039	D	26.6	Very low	28.7	Very low	132 Å²	132	143 Å²	143	71%	0.706	77%	0.771	S	S	*	*			trans	74.3	159.6	136.6	-164	30.6	0	0	0	121.4
1040	K	28.1	Very low	28.8	Very low	172 Å²	172	146.7 Å²	146.7	75%	0.748	78%	0.782	S	S	*	*			trans	78.4	106.6	163.9	-51.7	174.9	-172.2	149	0	120.2
1041	S	32	Very low	28.9	Very low	129 Å²	129	141.9 Å²	141.9	90%	0.902	78%	0.779	S	S	*	*				-177.1	154.8	115	41.6	0	0	0	0	114.3
1042	R	30.4	Very low	28.9	Very low	220 Å²	220	140 Å²	140	83%	0.83	78%	0.777	S	S	*	*			trans	-140.7	153.6	173.6	-107.5	-168.8	179.8	-161.8	2.4	108.6
1043	P	34.6	Very low	29.3	Very low	122 Å²	122	137.5 Å²	137.5	79%	0.792	78%	0.778	S	S	*	*				-138.4	155.1	113	20.9	-0.6	0	0	0	112.6
1044	L	26.4	Very low	29.2	Very low	124 Å²	124	140.1 Å²	140.1	65%	0.649	78%	0.775	S	S	*	*			cis	95.9	95.2	29.4	-89.1	176.7	0	0	0	116.6
1045	I	31.5	Very low	29.3	Very low	165 Å²	165	140.4 Å²	140.4	85%	0.846	77%	0.767	S	S	*	*			trans	-151.1	104.8	148.3	-51.7	-177.6	0	0	0	104.6
1046	N	29.1	Very low	29.4	Very low	124 Å²	124	140 Å²	140	66%	0.663	77%	0.774	S	S	*	*				64.2	137.2	67.1	-73.9	2.8	0	0	0	114.1
1047	C	29.4	Very low	29.6	Very low	115 Å²	115	135.9 Å²	135.9	78%	0.777	77%	0.765	S	S	*	*			cis	-148.2	179.1	11.3	-109.9	0	0	0	0	112.6
1048	P	34	Very low	29.4	Very low	124 Å²	124	132.3 Å²	132.3	81%	0.805	76%	0.757	S	S	*	*			trans	-125.7	-178.9	-156.4	45.2	-34.9	0	0	0	118.5
1049	G	31.1	Very low	29.6	Very low	62 Å²	62	128.9 Å²	128.9	64%	0.639	75%	0.746	S	S	*	*			trans	-169.5	124.9	159.3	0	0	0	0	0	110.3
1050	I	29	Very low	29.7	Very low	166 Å²	166	129.7 Å²	129.7	85%	0.851	75%	0.751	S	S	*	*				73.6	122.8	68.1	-65.8	169.2	0	0	0	111.6
1051	S	28.6	Very low	29.9	Very low	105 Å²	105	127.9 Å²	127.9	73%	0.734	75%	0.748	S	S	*	*			cis	-162.7	161.1	-7.1	49.4	0	0	0	0	114.3
1052	S	25.2	Very low	29.8	Very low	98 Å²	98	127.8 Å²	127.8	69%	0.685	74%	0.738	S	S	*	*			trans	-34.8	138.6	173.9	55.3	0	0	0	0	121.7
1053	V	31.8	Very low	29.6	Very low	139 Å²	139	126 Å²	126	84%	0.842	74%	0.739	S	S	*	*			trans	-146.6	106.4	144.2	176.4	0	0	0	0	104.3
1054	K	25.3	Very low	29.5	Very low	166 Å²	166	126 Å²	126	72%	0.722	74%	0.741	S	S	*	*				55.4	127.9	64.6	-79.6	-164.9	174.4	-169.2	0	112.4
1055	D	31.6	Very low	29.6	Very low	128 Å²	128	129.9 Å²	129.9	68%	0.684	75%	0.753	S	S	*	*			cis	-149.4	173.5	25.6	-86.7	-53.6	0	0	0	112.8
1056	S	27.5	Very low	29.4	Very low	108 Å²	108	129.3 Å²	129.3	76%	0.755	75%	0.751	S	S	*	*			trans	38.5	140.1	143.2	80.2	0	0	0	0	121.1
1057	S	30.3	Very low	29.2	Very low	95 Å²	95	133.8 Å²	133.8	66%	0.664	76%	0.759	S	S	*	*			cis	-165.6	155.5	34.5	60.4	0	0	0	0	113.6
1058	T	28.6	Very low	29.2	Very low	125 Å²	125	136 Å²	136	77%	0.767	76%	0.762	S	S	*	*			trans	25.5	140.6	142.5	51.9	0	0	0	0	121.6
1059	S	30.9	Very low	28.8	Very low	87 Å²	87	138.1 Å²	138.1	61%	0.608	76%	0.763	S	S	*	*			cis	-176.1	150.8	7.7	43.7	0	0	0	0	113.8
1060	N	29.3	Very low	28.6	Very low	149 Å²	149	141.7 Å²	141.7	80%	0.797	77%	0.767	S	S	*	*			trans	62	152.5	142.7	-58.4	-12.9	0	0	0	119.1
1061	L	31.4	Very low	28.6	Very low	134 Å²	134	141.8 Å²	141.8	70%	0.702	76%	0.762	S	S	*	*			cis	-150.1	143	13.2	-165.4	62.1	0	0	0	112.7
1062	N	30.7	Very low	28.6	Very low	128 Å²	128	139.8 Å²	139.8	68%	0.684	76%	0.757	S	S	*	*			trans	34.5	118.7	158.7	-56.2	-10	0	0	0	120.4
1063	Q	25.8	Very low	28.8	Very low	183 Å²	183	142.1 Å²	142.1	86%	0.855	76%	0.757	S	S	*	*				66	98.8	57.7	-63.9	-163.4	1.1	0	0	117.4
1064	S	31.8	Very low	28.6	Very low	120 Å²	120	143 Å²	143	84%	0.839	76%	0.757	S	S	*	*			trans	177.1	149.2	135.7	43.2	0	0	0	0	108.4
1065	K	29.9	Very low	28.6	Very low	207 Å²	207	139.5 Å²	139.5	90%	0.9	75%	0.746	S	S	*	*			cis	-138.8	162.1	9.1	-125.4	166.2	-174.2	174.6	0	110
1066	L	25.5	Very low	28.4	Very low	152 Å²	152	138.7 Å²	138.7	80%	0.796	74%	0.738	S	S	*	*			trans	-122.1	161.8	-177.7	-151	98.1	0	0	0	111
1067	R	26.1	Very low	28.2	Very low	219 Å²	219	142.5 Å²	142.5	83%	0.826	74%	0.737	S	S	*	*			trans	90.3	149.1	162.4	-54.9	-179.1	175.9	163.5	-1	120
1068	L	29.7	Very low	28.1	Very low	160 Å²	160	143.3 Å²	143.3	84%	0.838	74%	0.738	S	S	*	*			trans	94.4	91.5	179.5	-61	167.9	0	0	0	113.4
1069	M	24.9	Very low	27.9	Very low	169 Å²	169	146.5 Å²	146.5	83%	0.833	75%	0.745	S	S	*	*			cis	72.6	129.4	19	-121.8	-179.1	-170	0	0	115.9
1070	N	27.1	Very low	27.6	Very low	137 Å²	137	152.7 Å²	152.7	73%	0.733	76%	0.756	S	S	*	*			trans	99.2	138.4	-176.8	-61.9	-31.3	0	0	0	115.4
1071	K	28.4	Very low	27.3	Very low	169 Å²	169	153.2 Å²	153.2	74%	0.735	75%	0.754	S	S	*	*			cis	-163.4	171.1	-13	-124	174.5	173.7	-103.2	0	110.2	E1073	K1071-E1073 IonicContact NZ-OE1 2.76Å; K1071-E1073 PolarHBondContact NZ-OE1 3.41Å
1072	G	29.6	Very low	27	Very low	62 Å²	62	152.3 Å²	152.3	64%	0.639	75%	0.754	S	S	*	*			trans	110.8	79	176.9	0	0	0	0	0	112.6
1073	E	28.4	Very low	26.8	Very low	147 Å²	147	156.7 Å²	156.7	69%	0.687	76%	0.763	S	S	*	*				65.8	95.6	69	-56.2	168.7	-163.8	0	0	109.8	K1071	K1071-E1073 IonicContact NZ-OE1 2.76Å; K1071-E1073 PolarHBondContact NZ-OE1 3.41Å
1074	L	27.3	Very low	26.7	Very low	158 Å²	158	154.2 Å²	154.2	83%	0.827	76%	0.755	S	S	*	*			cis	82.1	151.9	39.9	-152.9	83	0	0	0	113.1
1075	N	26.5	Very low	26.4	Very low	93 Å²	93	154.8 Å²	154.8	50%	0.497	75%	0.749	S	S	.	*			trans	83.1	144	166.2	-68.5	-3.7	0	0	0	119.6
1076	Q	26.4	Very low	26.1	Very low	111 Å²	111	150.1 Å²	150.1	52%	0.519	74%	0.737	S	S	.	*			cis	-170.6	162.7	-24.6	-120.5	172.7	-19.8	0	0	110.7
1077	Y	24.7	Very low	26.1	Very low	188 Å²	188	149 Å²	149	74%	0.737	73%	0.732	S	S	*	*			trans	49.7	129.7	143.3	-72.6	-162.2	0	0	0	120.3
1078	T	27.4	Very low	26	Very low	112 Å²	112	145.8 Å²	145.8	69%	0.687	73%	0.731	S	S	*	*				75.2	109.5	57	67.7	0	0	0	0	116.7
1079	E	25.2	Very low	25.7	Very low	192 Å²	192	147.9 Å²	147.9	90%	0.897	73%	0.729	S	S	*	*			trans	-158.5	143	144.2	-103.2	154.3	-152.9	0	0	106.6
1080	Y	23	Very low	25.7	Very low	216 Å²	216	144 Å²	144	85%	0.847	72%	0.719	S	S	*	*			cis	105	149.4	28.4	-105.2	-87.2	0	0	0	114.9
1081	E	24.2	Very low	25.6	Very low	161 Å²	161	141.1 Å²	141.1	75%	0.752	71%	0.709	S	S	*	*			trans	63.5	94.8	167.7	-53.1	-150.3	151.3	0	0	122.1
1082	T	25.4	Very low	25.5	Very low	115 Å²	115	140.3 Å²	140.3	71%	0.706	71%	0.708	S	S	*	*				14.7	117.2	121.1	48.7	0	0	0	0	120.7
1083	Y	25.7	Very low	25.3	Very low	220 Å²	220	144.8 Å²	144.8	86%	0.863	71%	0.712	S	S	*	*				-134.6	114.1	127.1	-105	-94.8	0	0	0	107
1084	N	23.6	Very low	25.2	Very low	130 Å²	130	142.7 Å²	142.7	70%	0.695	71%	0.714	S	S	*	*				61.1	135.5	70.3	-100.1	-15.4	0	0	0	115.5
1085	N	24.6	Very low	25.1	Very low	133 Å²	133	143 Å²	143	71%	0.711	71%	0.714	S	S	*	*			trans	70.2	139.5	169.5	-59.3	-23.1	0	0	0	116.1
1086	T	25	Very low	25	Very low	108 Å²	108	145.2 Å²	145.2	66%	0.663	72%	0.721	S	S	*	*			cis	-157.8	172.3	-4.2	5.2	0	0	0	0	110.8
1087	N	24.6	Very low	25	Very low	128 Å²	128	143.5 Å²	143.5	68%	0.684	73%	0.734	S	S	*	*			trans	12.5	139.4	138.5	-46.6	-19.2	0	0	0	117.3
1088	L	24.9	Very low	25	Very low	152 Å²	152	141.9 Å²	141.9	80%	0.796	73%	0.731	S	S	*	*			cis	-140.9	153.9	42.9	-95.9	93.5	0	0	0	110.7
1089	Y	23.2	Very low	25	Very low	204 Å²	204	142.9 Å²	142.9	80%	0.8	73%	0.732	S	S	*	*				46.1	133.7	81.3	-82.3	-112.6	0	0	0	113.8
1090	S	24.2	Very low	24.9	Very low	89 Å²	89	141.8 Å²	141.8	62%	0.622	72%	0.724	S	S	*	*			cis	-168.5	-161.5	-5.5	47	0	0	0	0	109.3
1091	S	24.5	Very low	25	Very low	75 Å²	75	138.4 Å²	138.4	52%	0.524	72%	0.721	S	S	.	*			trans	27.4	121.9	143.2	57.3	0	0	0	0	118.3
1092	H	27.9	Very low	25	Very low	153 Å²	153	134.8 Å²	134.8	71%	0.708	71%	0.713	S	S	*	*			cis	-142	140.7	49.2	-82.8	-83.7	0	0	0	111.1
1093	Q	25.1	Very low	24.9	Very low	156 Å²	156	137.6 Å²	137.6	73%	0.729	72%	0.718	S	S	*	*				50.7	111.8	80.7	-66	175.9	-16	0	0	111.1
1094	S	24.9	Very low	24.8	Very low	103 Å²	103	132 Å²	132	72%	0.72	71%	0.711	S	S	*	*				59	117.2	81.3	-175.3	0	0	0	0	112.7
1095	I	25.2	Very low	24.9	Very low	163 Å²	163	131.2 Å²	131.2	84%	0.836	72%	0.716	S	S	*	*				-161.7	159.1	127.5	-101.9	153.3	0	0	0	110.2
1096	H	24.7	Very low	25	Very low	140 Å²	140	129.4 Å²	129.4	65%	0.648	71%	0.713	S	S	*	*			trans	-64.2	158.3	-169.2	-58.9	-63.4	0	0	0	116.9	K1098	H1096-K1098 HydrophobicContact CB-CB 4.41Å; H1096-K1098 HydrophobicContact CB-CD 3.83Å; H1096-K1098 HydrophobicContact CB-CG 4Å
1097	G	27.3	Very low	25.1	Very low	76 Å²	76	131.3 Å²	131.3	78%	0.784	72%	0.719	S	S	*	*			trans	-178.5	51.8	163.7	0	0	0	0	0	111.3
1098	K	25	Very low	25.3	Very low	154 Å²	154	132.5 Å²	132.5	67%	0.67	72%	0.724	S	S	*	*				43.5	77.9	78.3	-82	-172.4	-176.8	170.5	0	112.9	H1096	H1096-K1098 HydrophobicContact CB-CB 4.41Å; H1096-K1098 HydrophobicContact CB-CD 3.83Å; H1096-K1098 HydrophobicContact CB-CG 4Å
1099	N	26	Very low	25.4	Very low	132 Å²	132	132.3 Å²	132.3	71%	0.706	72%	0.723	S	S	*	*				-175.7	125	113.9	-87.6	-25.4	0	0	0	108.9
1100	K	24.7	Very low	25.9	Very low	169 Å²	169	126.5 Å²	126.5	74%	0.735	71%	0.711	S	S	*	*				70.4	131.4	68.6	-76.1	-167.8	-177	-178.6	0	112.4
1101	N	24.7	Very low	26.1	Very low	146 Å²	146	131.1 Å²	131.1	78%	0.781	72%	0.72	S	S	*	*			trans	69.8	149.2	154.2	-61.9	9.4	0	0	0	115.5
1102	S	24.3	Very low	26.1	Very low	84 Å²	84	133.8 Å²	133.8	59%	0.587	73%	0.727	S	S	*	*			cis	-166.2	151.7	-11.3	37.6	0	0	0	0	111.1
1103	Q	23.4	Very low	26	Very low	175 Å²	175	136.2 Å²	136.2	82%	0.818	73%	0.731	S	S	*	*			trans	55.6	135.4	140	-66.5	167.3	-49.7	0	0	121.8
1104	S	23.6	Very low	26	Very low	103 Å²	103	136.7 Å²	136.7	72%	0.72	73%	0.731	S	S	*	*			trans	41.2	115.5	140.1	65.3	0	0	0	0	121.5
1105	S	25.8	Very low	26.1	Very low	113 Å²	113	138.1 Å²	138.1	79%	0.79	73%	0.73	S	S	*	*				-161	119.8	100.3	13.2	0	0	0	0	107.8
1106	S	26.5	Very low	26	Very low	94 Å²	94	137.6 Å²	137.6	66%	0.657	72%	0.724	S	S	*	*			cis	95.7	147.3	44.9	73.4	0	0	0	0	112.9
1107	L	27.2	Very low	26.1	Very low	149 Å²	149	137.3 Å²	137.3	78%	0.78	73%	0.727	S	S	*	*			trans	77	127.7	168.3	-53	171.6	0	0	0	116.2
1108	L	28.8	Very low	25.9	Very low	152 Å²	152	138.6 Å²	138.6	80%	0.796	72%	0.724	S	S	*	*			cis	-141.3	128.4	1	-105.4	156.5	0	0	0	114.3
1109	L	26.8	Very low	25.9	Very low	149 Å²	149	136.7 Å²	136.7	78%	0.78	72%	0.718	S	S	*	*			trans	-77	-164.1	152.4	-85.1	162.5	0	0	0	109.5
1110	P	33.5	Very low	25.8	Very low	82 Å²	82	135.3 Å²	135.3	53%	0.532	72%	0.719	S	S	.	*			cis	-131.1	178.6	-26.2	20.2	3.1	0	0	0	113.5
1111	K	28.6	Very low	25.8	Very low	186 Å²	186	133.8 Å²	133.8	81%	0.809	72%	0.718	S	S	*	*				148.8	115.6	126.5	-80	165.3	-175	179.5	0	108.6
1112	I	23.7	Very low	25.8	Very low	131 Å²	131	133.7 Å²	133.7	67%	0.672	72%	0.716	S	S	*	*			cis	65.9	110.5	37.9	-47.9	174.8	0	0	0	112.5
1113	Y	26.8	Very low	25.9	Very low	204 Å²	204	139.4 Å²	139.4	80%	0.8	73%	0.731	S	S	*	*			trans	162.4	104.1	140.2	-97.5	-83.7	0	0	0	104.9
1114	K	24.8	Very low	25.8	Very low	166 Å²	166	138 Å²	138	72%	0.722	73%	0.728	S	S	*	*				78.9	144.1	75.5	-92.5	-167.3	172.8	-173.8	0	113.9
1115	N	26.6	Very low	26	Very low	133 Å²	133	139.9 Å²	139.9	71%	0.711	74%	0.735	S	S	*	*			trans	70.2	158.8	168.1	-61.9	10.7	0	0	0	116.1
1116	Q	24.4	Very low	25.9	Very low	152 Å²	152	138.8 Å²	138.8	71%	0.71	73%	0.727	S	S	*	*			cis	-177.9	155.4	-43.8	-120.1	175.5	-10.2	0	0	108.2
1117	N	25	Very low	25.9	Very low	134 Å²	134	141.9 Å²	141.9	72%	0.717	74%	0.736	S	S	*	*			trans	73.1	152.1	156.7	-54.5	-16.6	0	0	0	121.3
1118	S	24.7	Very low	25.8	Very low	103 Å²	103	140.9 Å²	140.9	72%	0.72	73%	0.731	S	S	*	*			trans	53.6	117.6	157.2	46.3	0	0	0	0	118.8
1119	E	23.8	Very low	25.7	Very low	114 Å²	114	139.6 Å²	139.6	53%	0.533	72%	0.724	S	S	.	*				68.7	133.4	63.9	-76	-167.3	120.3	0	0	115.8	Q901	Q901-E1119 PolarHBondContact N-OE1 2.9Å; Q901-E1119 VanDerWaalsContact N-OE1 3.11Å
1120	S	23.6	Very low	25.5	Very low	103 Å²	103	139 Å²	139	72%	0.72	72%	0.722	S	S	*	*			trans	89.3	144.3	155.7	83.1	0	0	0	0	121.1
1121	N	24.9	Very low	25.4	Very low	136 Å²	136	146.3 Å²	146.3	73%	0.727	74%	0.739	S	S	*	*			trans	72.1	89.3	149.7	-58.6	-29.4	0	0	0	121
1122	I	24.5	Very low	25.4	Very low	145 Å²	145	141.9 Å²	141.9	74%	0.744	73%	0.731	S	S	*	*				29.1	119	110.6	-53.9	169.8	0	0	0	116.2
1123	K	26.1	Very low	25.6	Very low	203 Å²	203	143.1 Å²	143.1	88%	0.883	74%	0.737	S	S	*	*			trans	-150	126.1	137.9	-118.9	167.8	-173.4	175.5	0	111.7
1124	L	21.9	Very low	25.8	Very low	146 Å²	146	139.5 Å²	139.5	76%	0.764	74%	0.742	S	S	*	*			trans	-69.4	140.3	161.9	-73.7	87.8	0	0	0	108.7
1125	V	28	Very low	25.9	Very low	142 Å²	142	135.6 Å²	135.6	86%	0.861	74%	0.736	S	S	*	*			trans	-130.3	97.7	143	-178.8	0	0	0	0	106.9
1126	S	23.3	Very low	26.1	Very low	90 Å²	90	136.4 Å²	136.4	63%	0.629	74%	0.74	S	S	*	*			trans	-72.6	150	159.3	46.7	0	0	0	0	109.4
1127	L	27.5	Very low	26.6	Very low	160 Å²	160	138.1 Å²	138.1	84%	0.838	75%	0.745	S	S	*	*			trans	145.9	143.4	155.5	-80.7	167	0	0	0	109.4
1128	N	24.7	Very low	27	Very low	127 Å²	127	138.1 Å²	138.1	68%	0.679	74%	0.744	S	S	*	*			cis	-163	174.1	-36.1	-148.1	-15.6	0	0	0	110.2
1129	L	25.7	Very low	27.5	Very low	126 Å²	126	141.6 Å²	141.6	66%	0.66	75%	0.746	S	S	*	*			trans	66.5	103.7	154.1	-61.9	164.8	0	0	0	120.2
1130	N	24.7	Very low	28	Very low	136 Å²	136	146.7 Å²	146.7	73%	0.727	76%	0.76	S	S	*	*				57.3	118.5	121.4	-57.5	-12.7	0	0	0	121.5
1131	R	29.5	Very low	28.4	Very low	235 Å²	235	147.3 Å²	147.3	89%	0.887	76%	0.755	S	S	*	*				-166.1	123.1	97.7	-106.5	170.6	-178.7	171	1	116.4
1132	S	28.5	Very low	28.8	Very low	93 Å²	93	143.6 Å²	143.6	65%	0.65	74%	0.739	S	S	*	*			trans	44.1	95.8	138.7	59.2	0	0	0	0	122
1133	I	28.4	Very low	29.3	Very low	157 Å²	157	142.7 Å²	142.7	81%	0.805	74%	0.736	S	S	*	*				53.5	126.5	103.5	-59.9	157.9	0	0	0	119.2
1134	S	31.9	Very low	29.8	Very low	128 Å²	128	141 Å²	141	90%	0.895	73%	0.728	S	S	*	*			trans	-130.1	130.6	134.7	-178.5	0	0	0	0	109.3
1135	S	25.9	Very low	30.2	Very low	84 Å²	84	140.3 Å²	140.3	59%	0.587	72%	0.724	S	S	*	*			trans	-107.6	110.6	-164.2	-175.4	0	0	0	0	112.5
1136	N	32.1	Very low	30.5	Very low	150 Å²	150	140.1 Å²	140.1	80%	0.802	71%	0.714	S	S	*	*	S	Bend	trans	-160.2	-7.6	162.7	-104.9	-38.8	0	0	0	116
1137	K	34.4	Very low	31	Very low	189 Å²	189	144.1 Å²	144.1	82%	0.822	72%	0.723	S	S	*	*	S	Bend	trans	-92.4	-14.5	-179.7	-114.2	175.3	-179.2	175.5	0	115.4
1138	I	33.8	Very low	31.4	Very low	134 Å²	134	145.4 Å²	145.4	69%	0.687	72%	0.724	S	S	*	*	S	Bend	trans	-88.5	-33.2	-173.2	-65.3	172.5	0	0	0	112	R1140 L1141	I1138-R1140 PolarHBondContact O-N 3.23Å; I1138-L1141 PolarHBondContact O-N 3.15Å
1139	K	33.4	Very low	31.6	Very low	176 Å²	176	149.4 Å²	149.4	77%	0.765	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	3	179.5	-113.3	-175.6	179.8	-175.8	0	115.7
1140	R	35.4	Very low	32	Very low	221 Å²	221	150.7 Å²	150.7	83%	0.834	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.6	1.7	174.2	-108.4	179.9	177.8	165.8	0.2	114.2	I1138	I1138-R1140 PolarHBondContact O-N 3.23Å
1141	L	32.7	Very low	32.3	Very low	115 Å²	115	153.7 Å²	153.7	60%	0.602	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.9	-29.9	174.7	-76.4	164.7	0	0	0	112.6	I1138 L1143 K1144	I1138-L1141 PolarHBondContact O-N 3.15Å; L1141-L1143 PolarHBondContact O-N 3.29Å; L1141-K1144 PolarHBondContact O-N 2.99Å
1142	S	33.3	Very low	32.3	Very low	58 Å²	58	151.1 Å²	151.1	41%	0.406	74%	0.742	S	S	.	*	H	α-helix	trans	-57.7	-47.8	172.5	52.8	0	0	0	0	112	K1144 L1145	S1142-K1144 PolarHBondContact O-N 3.22Å; S1142-L1145 PolarHBondContact O-N 2.99Å
1143	L	34.5	Very low	32.4	Very low	127 Å²	127	153.9 Å²	153.9	67%	0.665	75%	0.749	S	S	*	*	H	α-helix	trans	-68.5	7.5	179.4	-93	163.9	0	0	0	115.7	L1141	L1141-L1143 PolarHBondContact O-N 3.29Å
1144	K	35.5	Very low	32.6	Very low	166 Å²	166	154.3 Å²	154.3	72%	0.722	75%	0.753	S	S	*	*	H	α-helix	trans	-119.8	-4.4	167	-79.7	-158.4	168.2	-157.5	0	114.3	L1141 S1142	L1141-K1144 PolarHBondContact O-N 2.99Å; S1142-K1144 PolarHBondContact O-N 3.22Å
1145	L	32	Very low	32.3	Very low	132 Å²	132	152.4 Å²	152.4	69%	0.691	74%	0.736	S	S	*	*	H	α-helix	trans	-100.9	-2.7	176.7	-76.6	163.8	0	0	0	113	S1142	S1142-L1145 PolarHBondContact O-N 2.99Å
1146	E	32.8	Very low	32.3	Very low	138 Å²	138	155.4 Å²	155.4	65%	0.645	75%	0.745	S	S	*	*	S	Bend	trans	-103.4	-11.1	-172.4	-140.1	134.9	-129	0	0	113.6
1147	Q	34.4	Very low	32.1	Very low	175 Å²	175	154.5 Å²	154.5	82%	0.818	75%	0.745	S	S	*	*	S	Bend	trans	-94.6	-14.1	177	-71.3	-175.2	-59.5	0	0	114.5	R1149	Q1147-R1149 PolarHBondContact O-N 3.07Å
1148	H	35.7	Very low	31.9	Very low	186 Å²	186	151.9 Å²	151.9	86%	0.861	74%	0.739	S	S	*	*	S	Bend	trans	-93	18.1	178.9	-94.6	-63.7	0	0	0	114.3
1149	R	30	Very low	31.6	Very low	212 Å²	212	153.4 Å²	153.4	80%	0.8	74%	0.743	S	S	*	*	S	Bend	trans	-113.1	-8.7	-170.8	-120.4	174.8	-179.7	170.6	-0.5	116.3	Q1147	Q1147-R1149 PolarHBondContact O-N 3.07Å
1150	N	32.6	Very low	31.3	Very low	152 Å²	152	152.4 Å²	152.4	81%	0.813	75%	0.746	S	S	*	*	S	Bend	trans	-120	42.8	-169.5	-75	-1.9	0	0	0	114.5
1151	E	32.3	Very low	31	Very low	199 Å²	199	147 Å²	147	93%	0.93	74%	0.737	S	S	*	*	S	Bend	trans	-150.9	28.8	176.8	-137.1	162.4	-119.9	0	0	114.5
1152	K	27.8	Very low	31	Very low	181 Å²	181	146.8 Å²	146.8	79%	0.787	74%	0.741	S	S	*	*			trans	-137.8	55.8	-173	-159.1	168.5	-172.4	167.2	0	114.1
1153	L	30.7	Very low	30.7	Very low	151 Å²	151	150.2 Å²	150.2	79%	0.791	75%	0.754	S	S	*	*			trans	-159.3	78.9	177.4	-129.1	153.5	0	0	0	114.8	V1155	L1153-V1155 HydrophobicContact CD2-CG2 3.76Å; L1153-V1155 HydrophobicContact CG-CG2 4.19Å
1154	N	32.5	Very low	30.4	Very low	167 Å²	167	148.6 Å²	148.6	89%	0.893	75%	0.753	S	S	*	*			trans	-167.1	71.4	152.5	-138.7	29.4	0	0	0	108.7
1155	V	26.5	Very low	30.3	Very low	88 Å²	88	146.3 Å²	146.3	53%	0.533	75%	0.749	S	S	.	*				70.8	104.3	60.3	-177.2	0	0	0	0	113.1	L1153	L1153-V1155 HydrophobicContact CD2-CG2 3.76Å; L1153-V1155 HydrophobicContact CG-CG2 4.19Å
1156	D	25.3	Very low	30.2	Very low	147 Å²	147	146.9 Å²	146.9	79%	0.786	75%	0.746	S	S	*	*			trans	57.5	76.1	147.2	-52.7	-8.8	0	0	0	120.1
1157	T	28.1	Very low	30.1	Very low	130 Å²	130	145.8 Å²	145.8	80%	0.798	74%	0.743	S	S	*	*	S	Bend	trans	-146.6	152.9	144.1	-42.1	0	0	0	0	110.5	H1159	T1157-H1159 PolarHBondContact O-N 3.02Å
1158	I	31.6	Very low	29.9	Very low	134 Å²	134	140.1 Å²	140.1	69%	0.687	72%	0.723	S	S	*	*			trans	64	30.5	178.1	-29.4	-176.7	0	0	0	115.9	N1160	I1158-N1160 PolarHBondContact O-N 3.33Å; I1158-N1160 VanDerWaalsContact O-N 3.14Å
1159	H	27.2	Very low	29.8	Very low	167 Å²	167	135.4 Å²	135.4	77%	0.773	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	50.6	164.8	-164.9	-61.7	0	0	0	111.7	T1157	T1157-H1159 PolarHBondContact O-N 3.02Å
1160	N	26.8	Very low	29.9	Very low	155 Å²	155	131.1 Å²	131.1	83%	0.829	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-156.9	11	-175.1	-115	-13.3	0	0	0	118.9	I1158	I1158-N1160 PolarHBondContact O-N 3.33Å; I1158-N1160 VanDerWaalsContact O-N 3.14Å
1161	T	29.7	Very low	29.8	Very low	107 Å²	107	126.6 Å²	126.6	66%	0.656	68%	0.681	S	S	*	*	S	Bend	trans	-135.5	-10.3	-173.9	-35	0	0	0	0	116.2
1162	T	31	Very low	29.7	Very low	110 Å²	110	122.4 Å²	122.4	68%	0.675	67%	0.665	S	S	*	*	S	Bend	trans	-112.6	-7.7	-179	23.8	0	0	0	0	115.2	S1164 N1165	T1162-S1164 PolarHBondContact O-N 3.31Å; T1162-N1165 PolarHBondContact O-N 2.88Å
1163	L	28.1	Very low	29.9	Very low	131 Å²	131	117.1 Å²	117.1	69%	0.686	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-12.3	177.4	-150.5	70.4	0	0	0	113.3	I1167	L1163-I1167 HydrophobicContact CG-CD1 4.37Å
1164	S	28.5	Very low	30	Very low	92 Å²	92	116 Å²	116	64%	0.643	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	-19.7	179.8	-168.2	0	0	0	0	114.9	T1162	T1162-S1164 PolarHBondContact O-N 3.31Å
1165	N	32.1	Very low	29.8	Very low	119 Å²	119	117.3 Å²	117.3	64%	0.636	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.9	-3.7	-172.7	-75.7	-2.2	0	0	0	114.1	T1162 S1168 T1169	T1162-N1165 PolarHBondContact O-N 2.88Å; N1165-S1168 PolarHBondContact O-OG 3.02Å; N1165-T1169 PolarHBondContact O-OG1 2.97Å
1166	F	30.8	Very low	30	Very low	143 Å²	143	121.2 Å²	121.2	63%	0.627	64%	0.643	S	S	*	*	S	Bend	trans	-95.9	-30.3	176.2	-150.8	-104.7	0	0	0	112.5
1167	I	31	Very low	30.3	Very low	115 Å²	115	120.4 Å²	120.4	59%	0.59	64%	0.638	S	S	*	*	H	α-helix	trans	-80.3	-21.3	-178.3	-63.9	177.4	0	0	0	111.9	L1163 A1171	L1163-I1167 HydrophobicContact CG-CD1 4.37Å; I1167-A1171 VanDerWaalsContact O-CB 3.3Å; I1167-A1171 WeakPolarHBondContact O-CB 3.05Å
1168	S	30.3	Very low	30.3	Very low	56 Å²	56	122.1 Å²	122.1	39%	0.392	64%	0.637	S	S	.	*	H	α-helix	trans	-78.7	-27	177	43.5	0	0	0	0	114.3	N1165 N1172	N1165-S1168 PolarHBondContact O-OG 3.02Å; S1168-N1172 PolarHBondContact O-ND2 3.43Å
1169	T	33	Very low	30.2	Very low	88 Å²	88	124.1 Å²	124.1	54%	0.54	64%	0.643	S	S	.	*	H	α-helix	trans	-87.1	-40.1	-175.1	-34.8	0	0	0	0	112.7	N1165 S1173	N1165-T1169 PolarHBondContact O-OG1 2.97Å; T1169-S1173 PolarHBondContact O-N 3Å; T1169-S1173 PolarHBondContact O-OG 2.64Å; T1169-S1173 VanDerWaalsContact O-OG 3.1Å
1170	Q	32.4	Very low	30.3	Very low	121 Å²	121	122.6 Å²	122.6	57%	0.565	63%	0.634	S	S	*	*	H	α-helix	trans	-72.5	-29.2	175.1	-68.9	-168.7	-14.7	0	0	112.6	N1172 I1174	Q1170-N1172 VanDerWaalsContact C-N 3.31Å; Q1170-N1172 PolarHBondContact O-N 2.99Å; Q1170-I1174 WeakPolarHBondContact O-CG1 3.23Å; Q1170-I1174 PolarHBondContact O-N 2.67Å
1171	A	29.5	Very low	30.5	Very low	58 Å²	58	124.4 Å²	124.4	48%	0.479	64%	0.637	S	S	.	*	H	α-helix	trans	-67.1	-25.8	177.4	0	0	0	0	0	114.3	I1167	I1167-A1171 VanDerWaalsContact O-CB 3.3Å; I1167-A1171 WeakPolarHBondContact O-CB 3.05Å
1172	N	31.8	Very low	30.4	Very low	111 Å²	111	127.5 Å²	127.5	59%	0.594	65%	0.649	S	S	*	*	H	α-helix	trans	-91.5	-32.6	177.6	-75.2	-46.1	0	0	0	112.9	S1168 Q1170 I1174 R1175 Y1176	S1168-N1172 PolarHBondContact O-ND2 3.43Å; Q1170-N1172 VanDerWaalsContact C-N 3.31Å; Q1170-N1172 PolarHBondContact O-N 2.99Å; N1172-I1174 VanDerWaalsContact C-N 3.3Å; N1172-I1174 PolarHBondContact O-N 2.97Å; N1172-R1175 PolarHBondContact O-N 2.78Å; N1172-Y1176 PolarHBondContact O-N 2.71Å
1173	S	31.8	Very low	30.2	Very low	70 Å²	70	126.4 Å²	126.4	49%	0.49	65%	0.646	S	S	.	*	H	α-helix	trans	-64.8	-34.1	177.4	-57.6	0	0	0	0	112.5	T1169 R1175 Y1176	T1169-S1173 PolarHBondContact O-N 3Å; T1169-S1173 PolarHBondContact O-OG 2.64Å; T1169-S1173 VanDerWaalsContact O-OG 3.1Å; S1173-R1175 VanDerWaalsContact C-N 3.26Å; S1173-R1175 PolarHBondContact O-N 3.3Å; S1173-Y1176 PolarHBondContact O-N 2.69Å
1174	I	31.8	Very low	30.3	Very low	128 Å²	128	129.9 Å²	129.9	66%	0.656	66%	0.655	S	S	*	*	H	α-helix	trans	-73.7	-14.4	178.6	-67.3	172.8	0	0	0	112.6	Q1170 N1172	Q1170-I1174 WeakPolarHBondContact O-CG1 3.23Å; Q1170-I1174 PolarHBondContact O-N 2.67Å; N1172-I1174 VanDerWaalsContact C-N 3.3Å; N1172-I1174 PolarHBondContact O-N 2.97Å
1175	R	29.6	Very low	30.3	Very low	193 Å²	193	137 Å²	137	73%	0.728	67%	0.668	S	S	*	*	H	α-helix	trans	-87.7	-21.9	169.4	-79.8	-177.9	171.8	154.1	-1.5	114.1	N1172 S1173	N1172-R1175 PolarHBondContact O-N 2.78Å; S1173-R1175 VanDerWaalsContact C-N 3.26Å; S1173-R1175 PolarHBondContact O-N 3.3Å
1176	Y	30.6	Very low	30	Very low	170 Å²	170	139.5 Å²	139.5	67%	0.667	68%	0.676	S	S	*	*	H	α-helix	trans	-83	-14.7	-177.6	-167	-107	0	0	0	114.3	N1172 S1173	N1172-Y1176 PolarHBondContact O-N 2.71Å; S1173-Y1176 PolarHBondContact O-N 2.69Å
1177	L	30.1	Very low	29.9	Very low	131 Å²	131	137 Å²	137	69%	0.686	68%	0.677	S	S	*	*	S	Bend	trans	-108.8	-5	-178.9	-70.9	171.2	0	0	0	114.5
1178	H	29.5	Very low	29.8	Very low	166 Å²	166	140.4 Å²	140.4	77%	0.769	69%	0.689	S	S	*	*	S	Bend	trans	-92.8	3	-179.4	-152.2	-64.4	0	0	0	114
1179	E	28.9	Very low	29.8	Very low	176 Å²	176	146.8 Å²	146.8	82%	0.822	71%	0.711	S	S	*	*	S	Bend	trans	-120.9	10.9	179.2	-65.2	-171.4	138.4	0	0	113.4
1180	K	30.2	Very low	29.5	Very low	134 Å²	134	150.8 Å²	150.8	58%	0.583	72%	0.723	S	S	*	*	S	Bend	trans	-107.3	-0.8	-170.6	-136.3	166.7	-170.3	166.6	0	116.3
1181	E	29.5	Very low	29.3	Very low	193 Å²	193	154.7 Å²	154.7	90%	0.902	74%	0.738	S	S	*	*	S	Bend	trans	-91.5	-8.4	175.6	-72.1	-152.8	118.8	0	0	114.8
1182	L	27.3	Very low	29.3	Very low	173 Å²	173	158.7 Å²	158.7	91%	0.906	75%	0.75	S	S	*	*	S	Bend	trans	-114.2	22	-173.3	-84	167.8	0	0	0	115.4
1183	S	26.9	Very low	29.2	Very low	86 Å²	86	160.8 Å²	160.8	60%	0.601	76%	0.76	S	S	*	*			trans	-155.4	77.9	166.9	-162.3	0	0	0	0	114.8
1184	K	30.4	Very low	29	Very low	204 Å²	204	165.5 Å²	165.5	89%	0.887	78%	0.778	S	S	*	*	S	Bend	trans	-138.9	25.6	160.5	-88.5	-163	174.1	-175.5	0	113.4
1185	R	28.5	Very low	28.8	Very low	241 Å²	241	166.5 Å²	166.5	91%	0.909	78%	0.784	S	S	*	*	S	Bend	trans	-138.1	40.5	174.9	-85.5	-167.8	171.7	-167.8	-1.6	112.7
1186	Q	26.4	Very low	28.9	Very low	172 Å²	172	166.4 Å²	166.4	80%	0.804	79%	0.789	S	S	*	*	S	Bend	trans	-164.2	167.2	165.1	-108.7	147.1	-1.9	0	0	110.5
1187	S	28.5	Very low	29	Very low	92 Å²	92	165.3 Å²	165.3	64%	0.643	80%	0.795	S	S	*	*			trans	62.3	60.9	174.9	68.8	0	0	0	0	119.8
1188	H	29.8	Very low	28.9	Very low	185 Å²	185	168.7 Å²	168.7	86%	0.856	80%	0.804	S	S	*	*	S	Bend	trans	-135.3	41.6	140.5	-154.6	80.1	0	0	0	113.8
1189	F	28.6	Very low	29.1	Very low	190 Å²	190	169.3 Å²	169.3	83%	0.833	81%	0.807	S	S	*	*	S	Bend	trans	-148.3	11	158.8	-118.1	-74.9	0	0	0	114.7
1190	E	27.4	Very low	29.2	Very low	172 Å²	172	167.7 Å²	167.7	80%	0.804	80%	0.804	S	S	*	*			trans	-106.2	59.8	169.8	-70.1	-171.8	131.7	0	0	110.4
1191	K	28.2	Very low	29	Very low	203 Å²	203	168.2 Å²	168.2	88%	0.883	81%	0.811	S	S	*	*	S	Bend	trans	-143	23.1	172.4	-139.2	177.4	-176.1	-177.5	0	114.6
1192	I	29.3	Very low	29.2	Very low	143 Å²	143	165 Å²	165	73%	0.733	80%	0.8	S	S	*	*	S	Bend	trans	-130.7	139.9	164.7	-54.5	179.5	0	0	0	105.4
1193	I	30.1	Very low	29.3	Very low	155 Å²	155	167.6 Å²	167.6	80%	0.795	80%	0.798	S	S	*	*			trans	66.8	54.6	-173.2	-31.8	-177	0	0	0	115.3
1194	I	27.3	Very low	29.6	Very low	168 Å²	168	168.5 Å²	168.5	86%	0.862	80%	0.802	S	S	*	*			trans	-120.2	73.8	135.5	-56.2	-177.8	0	0	0	107.3
1195	D	28.5	Very low	29.5	Very low	149 Å²	149	165.7 Å²	165.7	80%	0.797	80%	0.797	S	S	*	*			trans	-162.8	83.2	156.7	-125.4	-16.8	0	0	0	112.6
1196	K	31.9	Very low	29.7	Very low	192 Å²	192	164.2 Å²	164.2	84%	0.835	80%	0.797	S	S	*	*	S	Bend	trans	175.5	110.3	146.9	-98.6	157.7	-174.9	175.2	0	111.4
1197	N	31.9	Very low	29.7	Very low	146 Å²	146	163.9 Å²	163.9	78%	0.781	80%	0.799	S	S	*	*			trans	43.2	100.7	144.6	-52.4	-17.9	0	0	0	116.8
1198	K	27.6	Very low	30	Very low	202 Å²	202	164.3 Å²	164.3	88%	0.878	80%	0.8	S	S	*	*				34.9	98	66.1	-79.8	-174.1	177.1	175.8	0	114
1199	Q	34	Very low	30	Very low	179 Å²	179	161.1 Å²	161.1	84%	0.836	79%	0.794	S	S	*	*			trans	-165.1	137.3	133.8	-106.3	171	50.8	0	0	111.6
1200	L	30.2	Very low	30	Very low	143 Å²	143	159.6 Å²	159.6	75%	0.749	79%	0.793	S	S	*	*			trans	36	111.4	148.4	-53.2	168.4	0	0	0	118
1201	I	27.1	Very low	30.1	Very low	144 Å²	144	155 Å²	155	74%	0.738	79%	0.791	S	S	*	*			cis	59	95	49.7	-46.6	177.8	0	0	0	114.2
1202	N	32.9	Very low	30.2	Very low	127 Å²	127	154 Å²	154	68%	0.679	79%	0.787	S	S	*	*				-178.8	125.2	119.7	-101.6	-59	0	0	0	116.5
1203	R	29.3	Very low	30.1	Very low	227 Å²	227	153.5 Å²	153.5	86%	0.857	78%	0.784	S	S	*	*			trans	72	158.1	140.9	-71.2	177.5	-178.7	-148.8	-3.9	122.1
1204	P	33.2	Very low	30	Very low	104 Å²	104	155.2 Å²	155.2	68%	0.675	79%	0.786	S	S	*	*			trans	-140.1	-166.3	-149.2	43.4	-22.6	0	0	0	116.8
1205	N	28	Very low	29.9	Very low	146 Å²	146	152.1 Å²	152.1	78%	0.781	78%	0.779	S	S	*	*			trans	79.3	111.8	158.5	-62	-10.1	0	0	0	120.2
1206	K	32.9	Very low	29.9	Very low	210 Å²	210	149.5 Å²	149.5	91%	0.913	78%	0.778	S	S	*	*				-166.5	146.8	123.7	-106.5	167.5	-176.3	179.8	0	113.3
1207	L	26.5	Very low	29.6	Very low	164 Å²	164	145.3 Å²	145.3	86%	0.859	77%	0.774	S	S	*	*			trans	-146.7	177	176.4	-101.2	145.5	0	0	0	105.4
1208	P	34.2	Very low	29.3	Very low	102 Å²	102	143.3 Å²	143.3	66%	0.662	77%	0.771	S	S	*	*			cis	-131.6	-169.8	-12.6	31.6	-9.6	0	0	0	113.4
1209	T	31	Very low	29.3	Very low	118 Å²	118	141.7 Å²	141.7	72%	0.724	77%	0.766	S	S	*	*				153.7	103.6	116.1	-57.4	0	0	0	0	115.8
1210	I	27.9	Very low	28.9	Very low	158 Å²	158	140.7 Å²	140.7	81%	0.81	76%	0.761	S	S	*	*			trans	23.1	128.4	138.1	-53.9	173	0	0	0	120.5
1211	G	30.9	Very low	28.6	Very low	75 Å²	75	138.8 Å²	138.8	77%	0.773	76%	0.76	S	S	*	*			trans	-152.2	30.8	-179.6	0	0	0	0	0	120.7
1212	K	29.1	Very low	28.6	Very low	182 Å²	182	139 Å²	139	79%	0.791	76%	0.762	S	S	*	*			trans	52.3	128.1	157.7	-82.9	-179.6	174.4	176.7	0	123.2
1213	I	27	Very low	28.2	Very low	132 Å²	132	136.9 Å²	136.9	68%	0.677	75%	0.754	S	S	*	*			trans	92.9	119	130.4	-71.9	172	0	0	0	121.5
1214	K	28.4	Very low	28.2	Very low	191 Å²	191	133.4 Å²	133.4	83%	0.83	75%	0.747	S	S	*	*			trans	61.8	154.1	153.3	-73	172.7	-176.6	-178.2	0	120.3
1215	S	26.5	Very low	27.9	Very low	103 Å²	103	136.1 Å²	136.1	72%	0.72	75%	0.751	S	S	*	*			cis	173.2	110.5	-44.6	49.3	0	0	0	0	110.2
1216	A	27.1	Very low	28	Very low	94 Å²	94	135.2 Å²	135.2	78%	0.777	76%	0.756	S	S	*	*			trans	-169	141	156.8	0	0	0	0	0	112.2
1217	S	25.9	Very low	27.6	Very low	105 Å²	105	131.3 Å²	131.3	73%	0.734	75%	0.749	S	S	*	*			trans	42.2	129.4	152.9	53.4	0	0	0	0	122.2
1218	S	25.2	Very low	27.6	Very low	103 Å²	103	131 Å²	131	72%	0.72	75%	0.748	S	S	*	*			trans	53.1	108.1	151.5	57.1	0	0	0	0	119
1219	H	27	Very low	27.1	Very low	169 Å²	169	133.2 Å²	133.2	78%	0.782	75%	0.752	S	S	*	*				-165.8	163.1	125.6	-112.1	-91.1	0	0	0	111.9
1220	Q	26.9	Very low	26.9	Very low	157 Å²	157	134 Å²	134	73%	0.734	76%	0.757	S	S	*	*			trans	-21.7	145.1	176.4	-69.7	146.4	-41.2	0	0	122
1221	S	24	Very low	26.8	Very low	103 Å²	103	133.5 Å²	133.5	72%	0.72	76%	0.756	S	S	*	*			trans	22.7	134.1	142.7	64.2	0	0	0	0	122.3
1222	L	25.5	Very low	26.5	Very low	149 Å²	149	138 Å²	138	78%	0.78	76%	0.757	S	S	*	*				-168.2	-178.9	116.7	-103.9	161.7	0	0	0	112.5
1223	T	26.2	Very low	26.4	Very low	83 Å²	83	137.7 Å²	137.7	51%	0.509	76%	0.763	S	S	.	*			trans	-123.8	167.6	-155.1	47.2	0	0	0	0	115.2
1224	H	28.5	Very low	26.4	Very low	153 Å²	153	136.5 Å²	136.5	71%	0.708	76%	0.758	S	S	*	*			trans	69.6	159.8	168.7	-65.7	-71.4	0	0	0	115.6
1225	Q	26.1	Very low	26.3	Very low	162 Å²	162	134.3 Å²	134.3	76%	0.757	76%	0.761	S	S	*	*			cis	-152.3	143.9	3.6	-139.9	164.4	12.2	0	0	110.3
1226	S	30.7	Very low	26.3	Very low	127 Å²	127	136.1 Å²	136.1	89%	0.888	76%	0.762	S	S	*	*			trans	-169.9	93.7	163.7	-83.3	0	0	0	0	111.2
1227	T	25.3	Very low	26.3	Very low	127 Å²	127	141 Å²	141	78%	0.779	76%	0.762	S	S	*	*			trans	-132.4	132.1	179.6	-38.3	0	0	0	0	109
1228	L	25.7	Very low	26.4	Very low	159 Å²	159	143.9 Å²	143.9	83%	0.832	77%	0.767	S	S	*	*			trans	176.1	150.6	149.1	-101.9	160.6	0	0	0	113.7
1229	I	24.8	Very low	26.5	Very low	147 Å²	147	150.1 Å²	150.1	75%	0.754	78%	0.775	S	S	*	*			trans	62.1	99.2	163	-54.2	153.5	0	0	0	115.7
1230	V	26.8	Very low	26.4	Very low	134 Å²	134	148.4 Å²	148.4	81%	0.812	77%	0.765	S	S	*	*				-145.4	129.2	75.1	166.8	0	0	0	0	108.4
1231	D	25.3	Very low	26.5	Very low	148 Å²	148	146.5 Å²	146.5	79%	0.791	76%	0.759	S	S	*	*			trans	-118.6	164.2	164.6	-161.4	-6.8	0	0	0	107.9
1232	Q	25.5	Very low	27	Very low	169 Å²	169	144.7 Å²	144.7	79%	0.79	75%	0.745	S	S	*	*			trans	64.2	97.9	-175.6	-50.3	179.6	0.2	0	0	115.8
1233	L	25.7	Very low	27.6	Very low	176 Å²	176	142.2 Å²	142.2	92%	0.921	74%	0.736	S	S	*	*			trans	-173.3	115.7	133.5	-103.7	165	0	0	0	113.1
1234	D	26.7	Very low	27.9	Very low	107 Å²	107	146.7 Å²	146.7	57%	0.572	75%	0.745	S	S	*	*			trans	46.8	97.6	158.8	-158.8	-1.4	0	0	0	120.2	N1236	D1234-N1236 VanDerWaalsContact C-N 3.29Å; D1234-N1236 PolarHBondContact O-N 2.78Å; D1234-N1236 WeakPolarHBondContact OD1-CB 3.27Å; D1234-N1236 PolarHBondContact OD1-N 3.24Å; D1234-N1236 VanDerWaalsContact OD1-N 3.07Å; D1234-N1236 PolarHBondContact OD1-ND2 2.71Å
1235	T	27.2	Very low	28.1	Very low	146 Å²	146	144.1 Å²	144.1	90%	0.896	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	2.4	175.7	30.5	0	0	0	0	115.8
1236	N	26.1	Very low	28.6	Very low	140 Å²	140	142.7 Å²	142.7	75%	0.749	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	-3.2	-169.3	-75	-68.6	0	0	0	117.8	D1234	D1234-N1236 VanDerWaalsContact C-N 3.29Å; D1234-N1236 PolarHBondContact O-N 2.78Å; D1234-N1236 WeakPolarHBondContact OD1-CB 3.27Å; D1234-N1236 PolarHBondContact OD1-N 3.24Å; D1234-N1236 VanDerWaalsContact OD1-N 3.07Å; D1234-N1236 PolarHBondContact OD1-ND2 2.71Å
1237	Y	26.3	Very low	28.8	Very low	197 Å²	197	144 Å²	144	77%	0.773	72%	0.716	S	S	*	*	S	Bend	trans	-110.9	-5.7	-166.1	-128.6	-93.5	0	0	0	118.6
1238	I	28.2	Very low	29.5	Very low	165 Å²	165	140.8 Å²	140.8	85%	0.846	69%	0.693	S	S	*	*			trans	-109.8	66.5	-171.3	-45.4	-175.8	0	0	0	113.2
1239	R	27.6	Very low	30.2	Very low	234 Å²	234	135.4 Å²	135.4	88%	0.883	67%	0.665	S	S	*	*	S	Bend	trans	-139.4	24.2	168	-86.5	-169.7	175.7	169	0.8	114.5
1240	K	25.6	Very low	30.9	Very low	133 Å²	133	133.8 Å²	133.8	58%	0.578	65%	0.653	S	S	*	*			trans	-136.5	57.2	-173	-53.9	-165.9	-169.2	-167.8	0	115.9	N930 G931	N930-K1240 PolarHBondContact O-NZ 2.79Å; G931-K1240 WeakPolarHBondContact O-CG 3.15Å
1241	I	29.8	Very low	31.5	Very low	118 Å²	118	131.1 Å²	131.1	61%	0.605	63%	0.633	S	S	*	*			trans	-137.1	124.6	168.1	-57	-177.6	0	0	0	110.2	K1245	I1241-K1245 HydrophobicContact CD1-CD 4.45Å; I1241-K1245 HydrophobicContact CG2-CB 3.79Å; I1241-K1245 HydrophobicContact CG2-CD 4.03Å
1242	P	34	Very low	31.9	Very low	65 Å²	65	127.6 Å²	127.6	42%	0.422	61%	0.611	S	S	.	*			trans	-66.3	156.8	178.4	-23.8	35	0	0	0	115.1	D378 Y1244 K1245	D378-P1242 WeakPolarHBondContact OD2-CA 3.46Å; P1242-Y1244 PolarHBondContact O-N 3.25Å; P1242-K1245 PolarHBondContact O-N 2.91Å
1243	T	38	Very low	32.5	Very low	96 Å²	96	124.6 Å²	124.6	59%	0.589	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.6	-23.3	-175	40.6	0	0	0	0	116.5	D378 K1245	D378-T1243 VanDerWaalsContact OD1-CG2 3.27Å; D378-T1243 WeakPolarHBondContact OD1-CG2 3.43Å; D378-T1243 PolarHBondContact OD1-OG1 2.91Å; D378-T1243 PolarHBondContact OD2-N 3.01Å; D378-T1243 PolarHBondContact OD2-OG1 2.76Å; T1243-K1245 PolarHBondContact O-N 3.08Å
1244	Y	31.4	Very low	32.9	Very low	178 Å²	178	121.1 Å²	121.1	70%	0.698	58%	0.582	S	S	*	*	H	α-helix	trans	-63	-29.8	178	-107.4	-94.1	0	0	0	115.4	P1242 Y1247 I1248	P1242-Y1244 PolarHBondContact O-N 3.25Å; Y1244-Y1247 PolarHBondContact O-N 3.31Å; Y1244-I1248 HydrophobicContact CD1-CD1 4.26Å; Y1244-I1248 WeakPolarHBondContact O-CG1 3.39Å; Y1244-I1248 PolarHBondContact O-N 3.4Å; Y1244-I1248 VanDerWaalsContact O-N 3.1Å
1245	K	33.1	Very low	33.2	Very low	98 Å²	98	121.5 Å²	121.5	43%	0.426	58%	0.583	S	S	.	*	H	α-helix	trans	-70.9	-42.6	-173.9	-166.2	-175.1	174.8	-160.8	0	112	I1241 P1242 T1243 Y1247 I1248 D1249	I1241-K1245 HydrophobicContact CD1-CD 4.45Å; I1241-K1245 HydrophobicContact CG2-CB 3.79Å; I1241-K1245 HydrophobicContact CG2-CD 4.03Å; P1242-K1245 PolarHBondContact O-N 2.91Å; T1243-K1245 PolarHBondContact O-N 3.08Å; K1245-Y1247 VanDerWaalsContact C-N 3.29Å; K1245-Y1247 PolarHBondContact O-N 3.23Å; K1245-I1248 PolarHBondContact O-N 2.98Å; K1245-D1249 WeakPolarHBondContact CE-OD2 3.25Å; K1245-D1249 WeakPolarHBondContact CG-OD2 3.44Å; K1245-D1249 WeakPolarHBondContact O-CB 3.47Å; K1245-D1249 PolarHBondContact O-N 2.87Å
1246	N	37.7	Very low	33.5	Very low	132 Å²	132	120.4 Å²	120.4	71%	0.706	57%	0.57	S	S	*	*	H	α-helix	trans	-65.3	-33.1	177.2	-77.1	-2.1	0	0	0	112.3	D1249 K1250	N1246-D1249 PolarHBondContact O-N 3.02Å; N1246-K1250 WeakPolarHBondContact O-CB 3.31Å; N1246-K1250 PolarHBondContact O-N 2.78Å
1247	Y	34.5	Very low	33.8	Very low	155 Å²	155	121.4 Å²	121.4	61%	0.608	57%	0.57	S	S	*	*	H	α-helix	trans	-65.6	-47.2	174.1	-163.7	-104.6	0	0	0	111.2	Y1244 K1245 D1249 I1251	Y1244-Y1247 PolarHBondContact O-N 3.31Å; K1245-Y1247 VanDerWaalsContact C-N 3.29Å; K1245-Y1247 PolarHBondContact O-N 3.23Å; Y1247-D1249 PolarHBondContact O-N 3.18Å; Y1247-I1251 HydrophobicContact CD1-CD1 3.66Å; Y1247-I1251 HydrophobicContact CE1-CD1 3.53Å; Y1247-I1251 HydrophobicContact CG-CD1 4.48Å; Y1247-I1251 WeakPolarHBondContact O-CB 3.47Å; Y1247-I1251 VanDerWaalsContact O-CG1 3.31Å; Y1247-I1251 WeakPolarHBondContact O-CG1 3.46Å; Y1247-I1251 PolarHBondContact O-N 3.09Å
1248	I	39.6	Very low	34	Very low	59 Å²	59	120.6 Å²	120.6	30%	0.303	57%	0.571	S	S	.	*	H	α-helix	trans	-64.9	-36.4	175.9	-73.2	173.7	0	0	0	112.2	Y1244 K1245 I1251 K1252	Y1244-I1248 HydrophobicContact CD1-CD1 4.26Å; Y1244-I1248 WeakPolarHBondContact O-CG1 3.39Å; Y1244-I1248 PolarHBondContact O-N 3.4Å; Y1244-I1248 VanDerWaalsContact O-N 3.1Å; K1245-I1248 PolarHBondContact O-N 2.98Å; I1248-I1251 PolarHBondContact O-N 2.9Å; I1248-K1252 HydrophobicContact CG2-CD 4.41Å; I1248-K1252 VanDerWaalsContact CG2-CE 3.5Å; I1248-K1252 WeakPolarHBondContact O-CG 3.27Å; I1248-K1252 PolarHBondContact O-N 2.76Å
1249	D	39.7	Very low	34	Very low	46 Å²	46	119.3 Å²	119.3	25%	0.246	57%	0.566	C	S	.	*	H	α-helix	trans	-81.5	-28.8	-178.2	-68.4	-13.5	0	0	0	112.4	K1245 N1246 Y1247 K1252 L1253	K1245-D1249 WeakPolarHBondContact CE-OD2 3.25Å; K1245-D1249 WeakPolarHBondContact CG-OD2 3.44Å; K1245-D1249 WeakPolarHBondContact O-CB 3.47Å; K1245-D1249 PolarHBondContact O-N 2.87Å; N1246-D1249 PolarHBondContact O-N 3.02Å; Y1247-D1249 PolarHBondContact O-N 3.18Å; D1249-K1252 PolarHBondContact O-N 3.22Å; D1249-K1252 WeakPolarHBondContact OD1-CD 3.42Å; D1249-K1252 WeakPolarHBondContact OD1-CE 3.5Å; D1249-K1252 IonicContact OD1-NZ 2.73Å; D1249-K1252 PolarHBondContact OD1-NZ 3.05Å; D1249-L1253 WeakPolarHBondContact O-CG 3.45Å; D1249-L1253 PolarHBondContact O-N 3.09Å
1250	K	39.8	Very low	34.2	Very low	114 Å²	114	117.5 Å²	117.5	50%	0.496	57%	0.567	S	S	.	*	H	α-helix	trans	-60.9	-48.4	161	-107.7	-162.5	170.3	-162.6	0	110.7	Y524 N1246 K1252 L1253 N1254	Y524-K1250 PolarHBondContact O-NZ 2.89Å; N1246-K1250 WeakPolarHBondContact O-CB 3.31Å; N1246-K1250 PolarHBondContact O-N 2.78Å; K1250-K1252 VanDerWaalsContact C-N 3.28Å; K1250-K1252 PolarHBondContact O-N 3.42Å; K1250-L1253 PolarHBondContact O-N 2.92Å; K1250-L1253 VanDerWaalsContact O-N 3.11Å; K1250-N1254 PolarHBondContact O-N 3.45Å; K1250-N1254 PolarHBondContact O-OD1 3.45Å
1251	I	39.9	Very low	34.4	Very low	77 Å²	77	115.1 Å²	115.1	40%	0.395	58%	0.581	S	S	.	*	H	α-helix	trans	-58.6	-38.7	177.1	-74.9	168.9	0	0	0	111.5	Y1247 I1248 I1255	Y1247-I1251 HydrophobicContact CD1-CD1 3.66Å; Y1247-I1251 HydrophobicContact CE1-CD1 3.53Å; Y1247-I1251 HydrophobicContact CG-CD1 4.48Å; Y1247-I1251 WeakPolarHBondContact O-CB 3.47Å; Y1247-I1251 VanDerWaalsContact O-CG1 3.31Å; Y1247-I1251 WeakPolarHBondContact O-CG1 3.46Å; Y1247-I1251 PolarHBondContact O-N 3.09Å; I1248-I1251 PolarHBondContact O-N 2.9Å; I1251-I1255 HydrophobicContact CG2-CD1 3.64Å; I1251-I1255 HydrophobicContact CG2-CG1 4.48Å; I1251-I1255 VanDerWaalsContact O-CB 3.3Å; I1251-I1255 WeakPolarHBondContact O-CB 3.42Å; I1251-I1255 WeakPolarHBondContact O-CD1 3.3Å; I1251-I1255 WeakPolarHBondContact O-CG1 3.44Å; I1251-I1255 PolarHBondContact O-N 3.49Å
1252	K	34.6	Very low	34.4	Very low	75 Å²	75	117.3 Å²	117.3	33%	0.326	59%	0.594	S	S	.	*	H	α-helix	trans	-66.7	-40.3	174.1	-74.1	170.3	-164.2	155.4	0	113.2	I1248 D1249 K1250 I1255 I1256	I1248-K1252 HydrophobicContact CG2-CD 4.41Å; I1248-K1252 VanDerWaalsContact CG2-CE 3.5Å; I1248-K1252 WeakPolarHBondContact O-CG 3.27Å; I1248-K1252 PolarHBondContact O-N 2.76Å; D1249-K1252 PolarHBondContact O-N 3.22Å; D1249-K1252 WeakPolarHBondContact OD1-CD 3.42Å; D1249-K1252 WeakPolarHBondContact OD1-CE 3.5Å; D1249-K1252 IonicContact OD1-NZ 2.73Å; D1249-K1252 PolarHBondContact OD1-NZ 3.05Å; K1250-K1252 VanDerWaalsContact C-N 3.28Å; K1250-K1252 PolarHBondContact O-N 3.42Å; K1252-I1255 PolarHBondContact O-N 2.62Å; K1252-I1256 WeakPolarHBondContact O-CB 3.41Å; K1252-I1256 WeakPolarHBondContact O-CD1 3.37Å; K1252-I1256 WeakPolarHBondContact O-CG1 3.27Å; K1252-I1256 PolarHBondContact O-N 2.88Å
1253	L	37.9	Very low	34.2	Very low	105 Å²	105	118.9 Å²	118.9	55%	0.55	61%	0.606	S	S	.	*	H	α-helix	trans	-63.6	-47.4	177	-76.5	163.8	0	0	0	110.6	D1249 K1250 I1255 I1256 Q1257	D1249-L1253 WeakPolarHBondContact O-CG 3.45Å; D1249-L1253 PolarHBondContact O-N 3.09Å; K1250-L1253 PolarHBondContact O-N 2.92Å; K1250-L1253 VanDerWaalsContact O-N 3.11Å; L1253-I1255 VanDerWaalsContact C-N 3.27Å; L1253-I1255 PolarHBondContact O-N 3.43Å; L1253-I1256 PolarHBondContact O-N 3.23Å; L1253-Q1257 PolarHBondContact O-N 2.85Å
1254	N	33.9	Very low	33.8	Very low	103 Å²	103	123.5 Å²	123.5	55%	0.551	62%	0.621	S	S	*	*	H	α-helix	trans	-63.1	-31	175.8	-67.3	33.9	0	0	0	112.6	K1250	K1250-N1254 PolarHBondContact O-N 3.45Å; K1250-N1254 PolarHBondContact O-OD1 3.45Å
1255	I	33.4	Very low	33.6	Very low	115 Å²	115	121.8 Å²	121.8	59%	0.59	62%	0.623	S	S	*	*	H	α-helix	trans	-77.8	-17.5	173.5	-73.4	171.2	0	0	0	112.8	I1251 K1252 L1253	I1251-I1255 HydrophobicContact CG2-CD1 3.64Å; I1251-I1255 HydrophobicContact CG2-CG1 4.48Å; I1251-I1255 VanDerWaalsContact O-CB 3.3Å; I1251-I1255 WeakPolarHBondContact O-CB 3.42Å; I1251-I1255 WeakPolarHBondContact O-CD1 3.3Å; I1251-I1255 WeakPolarHBondContact O-CG1 3.44Å; I1251-I1255 PolarHBondContact O-N 3.49Å; K1252-I1255 PolarHBondContact O-N 2.62Å; L1253-I1255 VanDerWaalsContact C-N 3.27Å; L1253-I1255 PolarHBondContact O-N 3.43Å
1256	I	32.9	Very low	33.6	Very low	124 Å²	124	126.8 Å²	126.8	64%	0.636	65%	0.645	S	S	*	*	H	α-helix	trans	-95.6	-23.1	-179.5	-73.7	168	0	0	0	112.1	K1252 L1253 F1258	K1252-I1256 WeakPolarHBondContact O-CB 3.41Å; K1252-I1256 WeakPolarHBondContact O-CD1 3.37Å; K1252-I1256 WeakPolarHBondContact O-CG1 3.27Å; K1252-I1256 PolarHBondContact O-N 2.88Å; L1253-I1256 PolarHBondContact O-N 3.23Å; I1256-F1258 VanDerWaalsContact C-N 3.33Å
1257	Q	33	Very low	33.4	Very low	161 Å²	161	128.9 Å²	128.9	75%	0.752	65%	0.65	S	S	*	*	S	Bend	trans	-87.9	10.9	175.1	-66.6	-175.1	-84.9	0	0	114.7	L1253	L1253-Q1257 PolarHBondContact O-N 2.85Å
1258	F	29.7	Very low	33.3	Very low	179 Å²	179	125.3 Å²	125.3	79%	0.785	64%	0.641	S	S	*	*			trans	-112.5	30.8	-174.9	-111.7	-77.5	0	0	0	114.4	I1256	I1256-F1258 VanDerWaalsContact C-N 3.33Å
1259	N	28.7	Very low	32.9	Very low	139 Å²	139	130 Å²	130	74%	0.743	66%	0.661	S	S	*	*	S	Bend	trans	-124.4	46.6	-179.2	-80.2	-38.8	0	0	0	113
1260	E	31.5	Very low	32.6	Very low	195 Å²	195	135 Å²	135	91%	0.911	68%	0.682	S	S	*	*	S	Bend	trans	-163.3	135.5	166.4	-112.4	160.2	-135.9	0	0	109.4
1261	G	30.6	Very low	32.3	Very low	84 Å²	84	135.6 Å²	135.6	87%	0.866	69%	0.687	S	S	*	*			trans	90.9	131.9	175.1	0	0	0	0	0	115.8
1262	D	29.2	Very low	32	Very low	163 Å²	163	138 Å²	138	87%	0.872	70%	0.695	S	S	*	*			trans	-88.5	178	-164.8	-126.9	-54.7	0	0	0	115.9
1263	S	28.5	Very low	32.1	Very low	98 Å²	98	137.1 Å²	137.1	69%	0.685	70%	0.698	S	S	*	*			trans	80	61.4	151.6	73.2	0	0	0	0	122.4
1264	H	30.4	Very low	32.2	Very low	194 Å²	194	136.3 Å²	136.3	90%	0.898	69%	0.694	S	S	*	*			trans	-154.3	42.1	147.3	-113.7	-68.5	0	0	0	116	K1266	H1264-K1266 PolarHBondContact O-N 3.37Å
1265	L	27.9	Very low	32.6	Very low	141 Å²	141	138.1 Å²	138.1	74%	0.738	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	46.7	-163.2	-134.7	169.5	0	0	0	116	I1268	L1265-I1268 HydrophobicContact CD2-CB 4.28Å; L1265-I1268 HydrophobicContact CD2-CD1 3.88Å; L1265-I1268 HydrophobicContact CG-CD1 4.27Å
1266	K	31.5	Very low	33	Very low	204 Å²	204	137.3 Å²	137.3	89%	0.887	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.4	-14.3	-178.8	-87.9	-174.3	175.5	178.8	0	118.1	H1264	H1264-K1266 PolarHBondContact O-N 3.37Å
1267	H	33.6	Very low	33.7	Very low	175 Å²	175	137.8 Å²	137.8	81%	0.81	69%	0.693	S	S	*	*	S	Bend	trans	-95.9	-15.4	-180	-87.5	-74.6	0	0	0	116.2	H1269 H1270	H1267-H1269 PolarHBondContact O-N 3.07Å; H1267-H1270 PolarHBondContact O-N 2.98Å
1268	I	32.9	Very low	34.1	Very low	81 Å²	81	135 Å²	135	42%	0.415	68%	0.683	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.7	-10.5	-167.3	-70.2	170.6	0	0	0	114.4	L1265 H1270	L1265-I1268 HydrophobicContact CD2-CB 4.28Å; L1265-I1268 HydrophobicContact CD2-CD1 3.88Å; L1265-I1268 HydrophobicContact CG-CD1 4.27Å; I1268-H1270 PolarHBondContact O-N 3.12Å
1269	H	32.7	Very low	34.7	Very low	158 Å²	158	133.2 Å²	133.2	73%	0.731	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-22.2	-179.7	-113.7	-98	0	0	0	114.7	H1267	H1267-H1269 PolarHBondContact O-N 3.07Å
1270	H	33	Very low	35.7	Very low	149 Å²	149	133.3 Å²	133.3	69%	0.69	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-33.7	-178.2	-143.1	-105.5	0	0	0	112.7	H1267 I1268 S1273	H1267-H1270 PolarHBondContact O-N 2.98Å; I1268-H1270 PolarHBondContact O-N 3.12Å; H1270-S1273 VanDerWaalsContact O-CB 3.31Å; H1270-S1273 WeakPolarHBondContact O-CB 3.33Å; H1270-S1273 PolarHBondContact O-N 2.97Å
1271	E	32.3	Very low	36.5	Very low	127 Å²	127	129.9 Å²	129.9	59%	0.593	65%	0.65	S	S	*	*	H	α-helix	trans	-70.7	-36.8	-177.2	-61.2	-165.3	106.7	0	0	113.7	S1273 N1274 H1275	E1271-S1273 PolarHBondContact O-N 3.22Å; E1271-N1274 PolarHBondContact O-N 3.28Å; E1271-N1274 VanDerWaalsContact O-N 3.07Å; E1271-H1275 PolarHBondContact O-N 3.44Å
1272	K	33.7	Very low	37.3	Very low	128 Å²	128	130.2 Å²	130.2	56%	0.557	63%	0.631	S	S	*	*	H	α-helix	trans	-59.2	-26.1	175.1	-73	179.2	179	172.2	0	112.5	N1276	K1272-N1276 PolarHBondContact O-N 2.78Å; K1272-N1276 PolarHBondContact O-ND2 2.84Å
1273	S	37.6	Very low	38.4	Very low	56 Å²	56	127 Å²	127	39%	0.392	61%	0.611	S	S	.	*	H	α-helix	trans	-70.4	-45.9	173.8	-169.6	0	0	0	0	111.8	H1270 E1271 N1276 K1277	H1270-S1273 VanDerWaalsContact O-CB 3.31Å; H1270-S1273 WeakPolarHBondContact O-CB 3.33Å; H1270-S1273 PolarHBondContact O-N 2.97Å; E1271-S1273 PolarHBondContact O-N 3.22Å; S1273-N1276 PolarHBondContact O-N 2.94Å; S1273-K1277 WeakPolarHBondContact O-CG 3.29Å; S1273-K1277 PolarHBondContact O-N 3.38Å
1274	N	39.3	Very low	39.5	Very low	88 Å²	88	129.6 Å²	129.6	47%	0.471	61%	0.609	S	S	.	*	H	α-helix	trans	-68.6	-39.6	179.6	-76.6	-16.7	0	0	0	112.5	E1271 N1276 K1277 L1278	E1271-N1274 PolarHBondContact O-N 3.28Å; E1271-N1274 VanDerWaalsContact O-N 3.07Å; N1274-N1276 VanDerWaalsContact C-N 3.34Å; N1274-N1276 PolarHBondContact O-N 2.99Å; N1274-K1277 PolarHBondContact O-N 3.42Å; N1274-L1278 PolarHBondContact O-N 2.81Å
1275	H	42.3	Very low	40.2	Very low	141 Å²	141	127.4 Å²	127.4	65%	0.653	59%	0.593	S	S	*	*	H	α-helix	trans	-59.2	-41.7	172.2	-97.4	79	0	0	0	112.5	E1271 L1278 Y1279	E1271-H1275 PolarHBondContact O-N 3.44Å; H1275-L1278 PolarHBondContact O-N 3.45Å; H1275-Y1279 PolarHBondContact O-N 3.08Å
1276	N	41.9	Very low	41.1	Very low	98 Å²	98	123.6 Å²	123.6	52%	0.524	58%	0.577	S	S	.	*	H	α-helix	trans	-67.5	-36.6	175.8	-95.2	-60.5	0	0	0	113.5	K1272 S1273 N1274 K1280	K1272-N1276 PolarHBondContact O-N 2.78Å; K1272-N1276 PolarHBondContact O-ND2 2.84Å; S1273-N1276 PolarHBondContact O-N 2.94Å; N1274-N1276 VanDerWaalsContact C-N 3.34Å; N1274-N1276 PolarHBondContact O-N 2.99Å; N1276-K1280 PolarHBondContact O-N 2.85Å; N1276-K1280 VanDerWaalsContact O-N 3.09Å
1277	K	46.7	Very low	42.1	Very low	134 Å²	134	118.3 Å²	118.3	58%	0.583	56%	0.558	S	S	*	*	H	α-helix	trans	-61.8	-46.4	172.4	-73.7	174	-177.3	170.8	0	111.1	S1273 N1274 K1280 H1281	S1273-K1277 WeakPolarHBondContact O-CG 3.29Å; S1273-K1277 PolarHBondContact O-N 3.38Å; N1274-K1277 PolarHBondContact O-N 3.42Å; K1277-K1280 PolarHBondContact O-N 3.23Å; K1277-H1281 WeakPolarHBondContact O-CB 3.47Å; K1277-H1281 PolarHBondContact O-N 3.41Å
1278	L	42	Very low	42.7	Very low	104 Å²	104	114.8 Å²	114.8	55%	0.545	54%	0.544	S	S	.	.	H	α-helix	trans	-60.8	-47	178.1	-176.6	61.3	0	0	0	111.7	N1274 H1275 K1280 H1281 I1282	N1274-L1278 PolarHBondContact O-N 2.81Å; H1275-L1278 PolarHBondContact O-N 3.45Å; L1278-K1280 PolarHBondContact O-N 2.96Å; L1278-H1281 WeakPolarHBondContact O-CB 3.18Å; L1278-H1281 PolarHBondContact O-N 3.08Å; L1278-H1281 VanDerWaalsContact O-N 3.14Å; L1278-I1282 HydrophobicContact CD1-CD1 4.3Å; L1278-I1282 HydrophobicContact CG-CD1 4.07Å; L1278-I1282 WeakPolarHBondContact O-CG1 3.49Å; L1278-I1282 PolarHBondContact O-N 3.33Å
1279	Y	42.5	Very low	43.1	Very low	140 Å²	140	114.7 Å²	114.7	55%	0.549	54%	0.544	S	S	.	.	H	α-helix	trans	-60.8	-45.7	178.7	-171.2	-96.4	0	0	0	112.7	H1275 H1281 I1282 Q1283	H1275-Y1279 PolarHBondContact O-N 3.08Å; Y1279-H1281 VanDerWaalsContact C-N 3.29Å; Y1279-H1281 PolarHBondContact O-N 3.08Å; Y1279-I1282 PolarHBondContact O-N 3.38Å; Y1279-Q1283 HydrophobicContact CD1-CG 4.34Å; Y1279-Q1283 HydrophobicContact CE1-CG 4.01Å; Y1279-Q1283 PolarHBondContact O-N 3.02Å
1280	K	50.1	Low	43.8	Very low	142 Å²	142	116.3 Å²	116.3	62%	0.617	54%	0.544	S	S	*	.	H	α-helix	trans	-62.3	-34.2	174.6	-76.3	-179	177.1	177.5	0	112.5	N1276 K1277 L1278 K1284	N1276-K1280 PolarHBondContact O-N 2.85Å; N1276-K1280 VanDerWaalsContact O-N 3.09Å; K1277-K1280 PolarHBondContact O-N 3.23Å; L1278-K1280 PolarHBondContact O-N 2.96Å; K1280-K1284 PolarHBondContact O-N 3.18Å; K1280-K1284 VanDerWaalsContact O-N 3.16Å
1281	H	48.1	Very low	44.5	Very low	122 Å²	122	118.4 Å²	118.4	57%	0.565	55%	0.545	S	S	*	.	H	α-helix	trans	-69.4	-43	176.6	-158.4	103.5	0	0	0	111.9	K1277 L1278 Y1279 K1284 R1285	K1277-H1281 WeakPolarHBondContact O-CB 3.47Å; K1277-H1281 PolarHBondContact O-N 3.41Å; L1278-H1281 WeakPolarHBondContact O-CB 3.18Å; L1278-H1281 PolarHBondContact O-N 3.08Å; L1278-H1281 VanDerWaalsContact O-N 3.14Å; Y1279-H1281 VanDerWaalsContact C-N 3.29Å; Y1279-H1281 PolarHBondContact O-N 3.08Å; H1281-K1284 PolarHBondContact O-N 2.79Å; H1281-R1285 PolarHBondContact O-N 2.86Å
1282	I	47.5	Very low	45	Very low	92 Å²	92	117 Å²	117	47%	0.472	54%	0.54	S	S	.	.	H	α-helix	trans	-60.9	-46	174.7	-67.8	167.1	0	0	0	110.8	L1278 Y1279 K1284 R1285 C1286	L1278-I1282 HydrophobicContact CD1-CD1 4.3Å; L1278-I1282 HydrophobicContact CG-CD1 4.07Å; L1278-I1282 WeakPolarHBondContact O-CG1 3.49Å; L1278-I1282 PolarHBondContact O-N 3.33Å; Y1279-I1282 PolarHBondContact O-N 3.38Å; I1282-K1284 PolarHBondContact O-N 2.72Å; I1282-R1285 PolarHBondContact O-N 2.92Å; I1282-C1286 PolarHBondContact O-N 3.33Å; I1282-C1286 PolarHBondContact O-SG 3.34Å
1283	Q	51.5	Low	45.5	Very low	96 Å²	96	117 Å²	117	45%	0.449	54%	0.54	S	S	.	.	H	α-helix	trans	-57.6	-46.8	176.4	-77.2	-167.4	-21.4	0	0	112.6	Y1279 R1285 C1286 I1287	Y1279-Q1283 HydrophobicContact CD1-CG 4.34Å; Y1279-Q1283 HydrophobicContact CE1-CG 4.01Å; Y1279-Q1283 PolarHBondContact O-N 3.02Å; Q1283-R1285 VanDerWaalsContact C-N 3.35Å; Q1283-R1285 PolarHBondContact O-N 3.39Å; Q1283-C1286 PolarHBondContact O-N 3.01Å; Q1283-I1287 WeakPolarHBondContact O-CG1 3.3Å; Q1283-I1287 PolarHBondContact O-N 3.06Å; Q1283-I1287 VanDerWaalsContact O-N 3.1Å
1284	K	52.5	Low	45.8	Very low	152 Å²	152	122.7 Å²	122.7	66%	0.661	56%	0.558	S	S	*	*	H	α-helix	trans	-58.9	-43.9	176	-79.2	-174.5	174.2	-176.9	0	111.9	K1280 H1281 I1282 C1286 I1287 I1288	K1280-K1284 PolarHBondContact O-N 3.18Å; K1280-K1284 VanDerWaalsContact O-N 3.16Å; H1281-K1284 PolarHBondContact O-N 2.79Å; I1282-K1284 PolarHBondContact O-N 2.72Å; K1284-C1286 PolarHBondContact O-N 3.49Å; K1284-I1287 PolarHBondContact O-N 3.01Å; K1284-I1288 WeakPolarHBondContact O-CG1 3.26Å; K1284-I1288 PolarHBondContact O-N 3.27Å
1285	R	44.7	Very low	46	Very low	148 Å²	148	124.1 Å²	124.1	56%	0.558	56%	0.564	S	S	*	*	H	α-helix	trans	-63	-40.8	179.3	-154.1	164.5	-179	161.5	-3.7	111.7	H1281 I1282 Q1283 I1287 I1288 L1289	H1281-R1285 PolarHBondContact O-N 2.86Å; I1282-R1285 PolarHBondContact O-N 2.92Å; Q1283-R1285 VanDerWaalsContact C-N 3.35Å; Q1283-R1285 PolarHBondContact O-N 3.39Å; R1285-I1287 PolarHBondContact O-N 2.92Å; R1285-I1288 PolarHBondContact O-N 2.88Å; R1285-L1289 WeakPolarHBondContact O-CG 3.33Å; R1285-L1289 PolarHBondContact O-N 3.45Å; R1285-L1289 VanDerWaalsContact O-N 3.14Å
1286	C	46.1	Very low	45.9	Very low	60 Å²	60	125.2 Å²	125.2	41%	0.405	56%	0.563	S	S	.	*	H	α-helix	trans	-63.6	-36.9	174	-73.4	0	0	0	0	114	I1282 Q1283 K1284 R1290	I1282-C1286 PolarHBondContact O-N 3.33Å; I1282-C1286 PolarHBondContact O-SG 3.34Å; Q1283-C1286 PolarHBondContact O-N 3.01Å; K1284-C1286 PolarHBondContact O-N 3.49Å; C1286-R1290 WeakPolarHBondContact O-CG 3.37Å; C1286-R1290 PolarHBondContact O-N 3.45Å; C1286-R1290 VanDerWaalsContact O-N 3.11Å
1287	I	53.8	Low	45.8	Very low	93 Å²	93	129.2 Å²	129.2	48%	0.477	58%	0.575	S	S	.	*	H	α-helix	trans	-67.5	-40.8	177.2	-68.4	166.2	0	0	0	111.2	Q1283 K1284 R1285 R1290 R1291	Q1283-I1287 WeakPolarHBondContact O-CG1 3.3Å; Q1283-I1287 PolarHBondContact O-N 3.06Å; Q1283-I1287 VanDerWaalsContact O-N 3.1Å; K1284-I1287 PolarHBondContact O-N 3.01Å; R1285-I1287 PolarHBondContact O-N 2.92Å; I1287-R1290 PolarHBondContact O-N 3.21Å; I1287-R1291 PolarHBondContact O-N 3.48Å; I1287-R1291 VanDerWaalsContact O-N 3.08Å
1288	I	45.5	Very low	45.5	Very low	101 Å²	101	125.6 Å²	125.6	52%	0.518	57%	0.567	S	S	.	*	H	α-helix	trans	-62.6	-47.9	176.9	-66.2	167.2	0	0	0	110.5	K1284 R1285 R1290 R1291 M1292	K1284-I1288 WeakPolarHBondContact O-CG1 3.26Å; K1284-I1288 PolarHBondContact O-N 3.27Å; R1285-I1288 PolarHBondContact O-N 2.88Å; I1288-R1290 VanDerWaalsContact C-N 3.3Å; I1288-R1290 PolarHBondContact O-N 3.39Å; I1288-R1291 PolarHBondContact O-N 2.66Å; I1288-R1291 VanDerWaalsContact O-N 3.08Å; I1288-M1292 HydrophobicContact CG2-CG 4.5Å; I1288-M1292 HydrophobicContact CG2-SD 4.13Å; I1288-M1292 WeakPolarHBondContact O-CG 3.27Å; I1288-M1292 PolarHBondContact O-N 3.18Å
1289	L	40.6	Very low	45.3	Very low	79 Å²	79	125.4 Å²	125.4	41%	0.414	57%	0.572	S	S	.	*	H	α-helix	trans	-58.8	-39	177	-70	168.4	0	0	0	112.4	R1285 M1292 K1293	R1285-L1289 WeakPolarHBondContact O-CG 3.33Å; R1285-L1289 PolarHBondContact O-N 3.45Å; R1285-L1289 VanDerWaalsContact O-N 3.14Å; L1289-M1292 PolarHBondContact O-N 2.94Å; L1289-K1293 PolarHBondContact O-N 2.83Å
1290	R	49.1	Very low	45.2	Very low	193 Å²	193	122.1 Å²	122.1	73%	0.728	57%	0.574	S	S	*	*	H	α-helix	trans	-64	-40.1	173.8	-75.9	176.4	176.6	175.5	-0.5	112.7	C1286 I1287 I1288 K1294	C1286-R1290 WeakPolarHBondContact O-CG 3.37Å; C1286-R1290 PolarHBondContact O-N 3.45Å; C1286-R1290 VanDerWaalsContact O-N 3.11Å; I1287-R1290 PolarHBondContact O-N 3.21Å; I1288-R1290 VanDerWaalsContact C-N 3.3Å; I1288-R1290 PolarHBondContact O-N 3.39Å; R1290-K1294 PolarHBondContact O-N 3Å
1291	R	47.8	Very low	44.8	Very low	192 Å²	192	120.3 Å²	120.3	73%	0.725	57%	0.57	S	S	*	*	H	α-helix	trans	-66.5	-43.4	175.1	-76.6	-175.5	170.7	179.8	-3.2	111.8	I1287 I1288 K1293 K1294 I1295	I1287-R1291 PolarHBondContact O-N 3.48Å; I1287-R1291 VanDerWaalsContact O-N 3.08Å; I1288-R1291 PolarHBondContact O-N 2.66Å; I1288-R1291 VanDerWaalsContact O-N 3.08Å; R1291-K1293 VanDerWaalsContact C-N 3.34Å; R1291-K1293 PolarHBondContact O-N 2.8Å; R1291-K1294 PolarHBondContact O-N 2.88Å; R1291-K1294 VanDerWaalsContact O-N 3.08Å; R1291-I1295 PolarHBondContact O-N 3.07Å
1292	M	41.5	Very low	44.3	Very low	98 Å²	98	124.2 Å²	124.2	48%	0.483	58%	0.579	S	S	.	*	H	α-helix	trans	-64.2	-35.6	177.3	-64.7	-178.5	105.9	0	0	112.7	I1288 L1289 K1294 I1295 R1296	I1288-M1292 HydrophobicContact CG2-CG 4.5Å; I1288-M1292 HydrophobicContact CG2-SD 4.13Å; I1288-M1292 WeakPolarHBondContact O-CG 3.27Å; I1288-M1292 PolarHBondContact O-N 3.18Å; L1289-M1292 PolarHBondContact O-N 2.94Å; M1292-K1294 VanDerWaalsContact C-N 3.29Å; M1292-K1294 PolarHBondContact O-N 3.14Å; M1292-I1295 PolarHBondContact O-N 2.91Å; M1292-R1296 PolarHBondContact O-N 3.42Å
1293	K	43.5	Very low	43.8	Very low	127 Å²	127	130.1 Å²	130.1	55%	0.552	60%	0.596	S	S	*	*	H	α-helix	trans	-68	-18.5	172.7	-79.4	-167.4	172.3	-172.7	0	114.4	E842 L1289 R1291	E842-K1293 WeakPolarHBondContact OE1-CE 3.22Å; E842-K1293 IonicContact OE1-NZ 2.63Å; E842-K1293 PolarHBondContact OE1-NZ 2.96Å; L1289-K1293 PolarHBondContact O-N 2.83Å; R1291-K1293 VanDerWaalsContact C-N 3.34Å; R1291-K1293 PolarHBondContact O-N 2.8Å
1294	K	45.1	Very low	43	Very low	177 Å²	177	134.3 Å²	134.3	77%	0.77	61%	0.613	S	S	*	*	H	α-helix	trans	-75.1	-45.5	166.5	-84	-165.8	172.8	-171.2	0	111.9	R1290 R1291 M1292 R1296 K1297	R1290-K1294 PolarHBondContact O-N 3Å; R1291-K1294 PolarHBondContact O-N 2.88Å; R1291-K1294 VanDerWaalsContact O-N 3.08Å; M1292-K1294 VanDerWaalsContact C-N 3.29Å; M1292-K1294 PolarHBondContact O-N 3.14Å; K1294-R1296 VanDerWaalsContact C-N 3.34Å; K1294-R1296 PolarHBondContact O-N 2.85Å; K1294-K1297 PolarHBondContact O-N 3.2Å; K1294-K1297 VanDerWaalsContact O-N 3.12Å
1295	I	44	Very low	42.3	Very low	118 Å²	118	131.5 Å²	131.5	61%	0.605	61%	0.612	S	S	*	*	H	α-helix	trans	-61.6	-40.7	-177.4	-61.7	171.7	0	0	0	111.5	R1291 M1292 K1297 S1298	R1291-I1295 PolarHBondContact O-N 3.07Å; M1292-I1295 PolarHBondContact O-N 2.91Å; I1295-K1297 PolarHBondContact O-N 3.07Å; I1295-S1298 PolarHBondContact O-N 3Å
1296	R	38.5	Very low	41.9	Very low	164 Å²	164	131.6 Å²	131.6	62%	0.619	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	-7.2	176.8	-86.9	-175.8	170.7	176.5	-3.1	115.4	M1292 K1294	M1292-R1296 PolarHBondContact O-N 3.42Å; K1294-R1296 VanDerWaalsContact C-N 3.34Å; K1294-R1296 PolarHBondContact O-N 2.85Å
1297	K	40.4	Very low	41.4	Very low	182 Å²	182	134.7 Å²	134.7	79%	0.791	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	-1.3	175.3	-71.3	-166.5	173.9	-168.2	0	114.7	K1294 I1295 P1299	K1294-K1297 PolarHBondContact O-N 3.2Å; K1294-K1297 VanDerWaalsContact O-N 3.12Å; I1295-K1297 PolarHBondContact O-N 3.07Å; K1297-P1299 WeakPolarHBondContact O-CD 3.44Å
1298	S	41.5	Very low	40.2	Very low	57 Å²	57	135.3 Å²	135.3	40%	0.399	65%	0.651	S	S	.	*			trans	-67.3	125.3	179.6	-179.2	0	0	0	0	112.9	I1295 A1300 I1301	I1295-S1298 PolarHBondContact O-N 3Å; S1298-A1300 PolarHBondContact O-N 2.73Å; S1298-I1301 PolarHBondContact O-N 3.03Å
1299	P	37.3	Very low	39.5	Very low	101 Å²	101	140.2 Å²	140.2	66%	0.656	67%	0.672	S	S	*	*	H	α-helix	trans	-58.6	-29.5	179.1	-26.5	35.4	0	0	0	114.7	K1297 I1301 R1302	K1297-P1299 WeakPolarHBondContact O-CD 3.44Å; P1299-I1301 VanDerWaalsContact C-N 3.27Å; P1299-I1301 PolarHBondContact O-N 3.09Å; P1299-R1302 WeakPolarHBondContact O-CB 3.47Å; P1299-R1302 PolarHBondContact O-N 2.87Å
1300	A	41.1	Very low	39.1	Very low	71 Å²	71	139.5 Å²	139.5	59%	0.587	67%	0.674	S	S	*	*	H	α-helix	trans	-62.5	-32.1	-176.1	0	0	0	0	0	113.2	S1298	S1298-A1300 PolarHBondContact O-N 2.73Å
1301	I	40.4	Very low	38.5	Very low	103 Å²	103	139 Å²	139	53%	0.528	68%	0.679	S	S	.	*	H	α-helix	trans	-73.5	-36.1	179.2	-61.1	174.8	0	0	0	110.4	S1298 P1299 R1303 K1304	S1298-I1301 PolarHBondContact O-N 3.03Å; P1299-I1301 VanDerWaalsContact C-N 3.27Å; P1299-I1301 PolarHBondContact O-N 3.09Å; I1301-R1303 PolarHBondContact O-N 3.11Å; I1301-K1304 PolarHBondContact O-N 3.2Å; I1301-K1304 VanDerWaalsContact O-N 3.08Å
1302	R	37.7	Very low	38.2	Very low	205 Å²	205	133.8 Å²	133.8	77%	0.774	67%	0.673	S	S	*	*	H	α-helix	trans	-64.6	-24.8	-176.1	-136.3	176.6	-172.8	-177.1	0.1	113.4	P1299	P1299-R1302 WeakPolarHBondContact O-CB 3.47Å; P1299-R1302 PolarHBondContact O-N 2.87Å
1303	R	36.8	Very low	37.9	Very low	216 Å²	216	136.8 Å²	136.8	82%	0.815	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	-17.5	175.5	-69.8	-175.6	178.3	165.3	-0.2	114.1	I1301	I1301-R1303 PolarHBondContact O-N 3.11Å
1304	K	35.6	Very low	37.3	Very low	184 Å²	184	136.6 Å²	136.6	80%	0.8	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	-6.5	-179.7	-75.3	-168.6	174.3	-174.9	0	114.8	I1301	I1301-K1304 PolarHBondContact O-N 3.2Å; I1301-K1304 VanDerWaalsContact O-N 3.08Å
1305	S	37.7	Very low	36.8	Very low	92 Å²	92	130.1 Å²	130.1	64%	0.643	66%	0.664	S	S	*	*	S	Bend	trans	-95.9	1.4	-179.6	64.9	0	0	0	0	115.1
1306	L	35	Very low	36.3	Very low	150 Å²	150	129.3 Å²	129.3	79%	0.785	66%	0.657	S	S	*	*	S	Bend	trans	-95.8	-1.1	-173.5	-94.1	154.4	0	0	0	114.5
1307	T	35.7	Very low	36	Very low	125 Å²	125	125.5 Å²	125.5	77%	0.767	65%	0.651	S	S	*	*	S	Bend	trans	-127.2	15	-164.2	48.4	0	0	0	0	115.5
1308	C	29.9	Very low	35.6	Very low	106 Å²	106	122 Å²	122	72%	0.716	64%	0.641	S	S	*	*			trans	-136.4	110.3	-178.2	-162	0	0	0	0	114.1
1309	Q	29.9	Very low	35.5	Very low	205 Å²	205	123.1 Å²	123.1	96%	0.958	64%	0.641	S	S	*	*			trans	-97.1	81.9	177.4	-68.4	-177.5	-11.3	0	0	112.2
1310	S	32	Very low	35.4	Very low	64 Å²	64	122.2 Å²	122.2	45%	0.448	63%	0.634	S	S	.	*			trans	-160	53.9	172.7	66.6	0	0	0	0	116.6	S1312	S1310-S1312 VanDerWaalsContact C-N 3.28Å; S1310-S1312 PolarHBondContact O-N 3.24Å
1311	Q	37.5	Very low	34.9	Very low	181 Å²	181	123.1 Å²	123.1	85%	0.846	63%	0.629	S	S	*	*	H	α-helix	trans	-62.9	-29.4	175.3	-78.2	-178.3	-30.5	0	0	113.8	K1313 L1314	Q1311-K1313 PolarHBondContact O-N 3.09Å; Q1311-K1313 VanDerWaalsContact O-N 3.12Å; Q1311-L1314 PolarHBondContact O-N 2.9Å
1312	S	41.6	Very low	34.8	Very low	84 Å²	84	124 Å²	124	59%	0.587	63%	0.631	S	S	*	*	H	α-helix	trans	-72.9	-1.4	-174.4	68.9	0	0	0	0	116.1	S1310	S1310-S1312 VanDerWaalsContact C-N 3.28Å; S1310-S1312 PolarHBondContact O-N 3.24Å
1313	K	34.1	Very low	34.7	Very low	160 Å²	160	122.4 Å²	122.4	70%	0.696	63%	0.625	S	S	*	*	H	α-helix	trans	-91.5	-30.2	170.5	-75.8	-169.6	172.8	-173.3	0	112.5	Q1311 V1317	Q1311-K1313 PolarHBondContact O-N 3.09Å; Q1311-K1313 VanDerWaalsContact O-N 3.12Å; K1313-V1317 WeakPolarHBondContact O-CG2 3.37Å; K1313-V1317 PolarHBondContact O-N 2.93Å
1314	L	31.3	Very low	34.5	Very low	123 Å²	123	116.5 Å²	116.5	64%	0.644	61%	0.609	S	S	*	*	H	α-helix	trans	-74.3	-36.1	179.3	-96.4	157.6	0	0	0	112.5	Q1311 V1317 L1318	Q1311-L1314 PolarHBondContact O-N 2.9Å; L1314-V1317 PolarHBondContact O-N 3.44Å; L1314-L1318 PolarHBondContact O-N 3.03Å
1315	S	34.6	Very low	34.3	Very low	41 Å²	41	109.4 Å²	109.4	29%	0.287	58%	0.584	S	S	.	*	H	α-helix	trans	-62.7	-42.5	173.2	54.2	0	0	0	0	112.3	L1318 I1319	S1315-L1318 PolarHBondContact O-N 3.5Å; S1315-I1319 WeakPolarHBondContact O-CG1 3.31Å; S1315-I1319 PolarHBondContact O-N 2.93Å
1316	K	33.9	Very low	34.2	Very low	102 Å²	102	109.1 Å²	109.1	44%	0.443	58%	0.575	S	S	.	*	H	α-helix	trans	-66.6	-36.3	177.2	-68.7	-165.1	178.6	-91.5	0	112.6	E754 V1320	E754-K1316 IonicContact OE1-NZ 3.99Å; E754-K1316 PolarHBondContact OE1-NZ 2.88Å; E754-K1316 IonicContact OE2-NZ 3.28Å; K1316-V1320 VanDerWaalsContact O-CB 3.31Å; K1316-V1320 WeakPolarHBondContact O-CB 3.45Å; K1316-V1320 VanDerWaalsContact O-CG2 3.23Å; K1316-V1320 WeakPolarHBondContact O-CG2 3.43Å; K1316-V1320 PolarHBondContact O-N 3.06Å
1317	V	31.7	Very low	34.2	Very low	84 Å²	84	106.6 Å²	106.6	51%	0.509	57%	0.566	S	S	.	*	H	α-helix	trans	-65.6	-37.7	172.2	172.2	0	0	0	0	111.9	K1313 L1314 N1321	K1313-V1317 WeakPolarHBondContact O-CG2 3.37Å; K1313-V1317 PolarHBondContact O-N 2.93Å; L1314-V1317 PolarHBondContact O-N 3.44Å; V1317-N1321 WeakPolarHBondContact O-CB 3.34Å; V1317-N1321 VanDerWaalsContact O-CG 3.22Å; V1317-N1321 PolarHBondContact O-N 3.14Å; V1317-N1321 PolarHBondContact O-ND2 3.06Å; V1317-N1321 VanDerWaalsContact O-ND2 3.15Å
1318	L	32.9	Very low	34.1	Very low	109 Å²	109	105.1 Å²	105.1	57%	0.571	56%	0.557	S	S	*	*	H	α-helix	trans	-67.4	-46.3	175.1	-80	162.4	0	0	0	112.3	L1314 S1315 V1320 N1321 Q1322	L1314-L1318 PolarHBondContact O-N 3.03Å; S1315-L1318 PolarHBondContact O-N 3.5Å; L1318-V1320 PolarHBondContact O-N 3.43Å; L1318-N1321 CarbonylContact O-C 3.56Å; L1318-N1321 PolarHBondContact O-N 3.23Å; L1318-Q1322 PolarHBondContact O-N 3.25Å
1319	I	38.1	Very low	34.2	Very low	80 Å²	80	105.7 Å²	105.7	41%	0.41	55%	0.551	S	S	.	*	H	α-helix	trans	-64.7	-39.8	178.4	-67	165.2	0	0	0	111.4	S1315 Q1322 R1323	S1315-I1319 WeakPolarHBondContact O-CG1 3.31Å; S1315-I1319 PolarHBondContact O-N 2.93Å; I1319-Q1322 PolarHBondContact O-N 2.85Å; I1319-R1323 PolarHBondContact O-N 3.12Å
1320	V	35.3	Very low	34.4	Very low	81 Å²	81	105.1 Å²	105.1	49%	0.491	55%	0.545	S	S	.	.	H	α-helix	trans	-64.5	-42.1	173.7	166.9	0	0	0	0	111.2	K1316 L1318 Q1322 R1323 L1324	K1316-V1320 VanDerWaalsContact O-CB 3.31Å; K1316-V1320 WeakPolarHBondContact O-CB 3.45Å; K1316-V1320 VanDerWaalsContact O-CG2 3.23Å; K1316-V1320 WeakPolarHBondContact O-CG2 3.43Å; K1316-V1320 PolarHBondContact O-N 3.06Å; L1318-V1320 PolarHBondContact O-N 3.43Å; V1320-Q1322 VanDerWaalsContact C-N 3.29Å; V1320-Q1322 PolarHBondContact O-N 3.48Å; V1320-R1323 PolarHBondContact O-N 3.38Å; V1320-L1324 HydrophobicContact CG1-CD1 3.94Å; V1320-L1324 WeakPolarHBondContact O-CB 3.12Å; V1320-L1324 PolarHBondContact O-N 3.37Å
1321	N	31.9	Very low	34.4	Very low	90 Å²	90	108.6 Å²	108.6	48%	0.481	56%	0.559	S	S	.	*	H	α-helix	trans	-67.3	-27.7	174.4	-74.9	-27.7	0	0	0	113.1	V1317 L1318 A1325	V1317-N1321 WeakPolarHBondContact O-CB 3.34Å; V1317-N1321 VanDerWaalsContact O-CG 3.22Å; V1317-N1321 PolarHBondContact O-N 3.14Å; V1317-N1321 PolarHBondContact O-ND2 3.06Å; V1317-N1321 VanDerWaalsContact O-ND2 3.15Å; L1318-N1321 CarbonylContact O-C 3.56Å; L1318-N1321 PolarHBondContact O-N 3.23Å; N1321-A1325 VanDerWaalsContact O-CB 3.26Å; N1321-A1325 WeakPolarHBondContact O-CB 3.25Å; N1321-A1325 PolarHBondContact O-N 2.55Å
1322	Q	38.3	Very low	34	Very low	123 Å²	123	107.9 Å²	107.9	58%	0.575	56%	0.561	S	S	*	*	H	α-helix	trans	-71.8	-49.3	172.6	-125.9	167	-43.4	0	0	110.8	L1318 I1319 V1320 L1324 A1325 D1326	L1318-Q1322 PolarHBondContact O-N 3.25Å; I1319-Q1322 PolarHBondContact O-N 2.85Å; V1320-Q1322 VanDerWaalsContact C-N 3.29Å; V1320-Q1322 PolarHBondContact O-N 3.48Å; Q1322-L1324 VanDerWaalsContact C-N 3.27Å; Q1322-L1324 PolarHBondContact O-N 3.08Å; Q1322-A1325 PolarHBondContact O-N 3.19Å; Q1322-D1326 PolarHBondContact O-N 2.63Å
1323	R	35.6	Very low	33.7	Very low	171 Å²	171	107.5 Å²	107.5	65%	0.645	56%	0.558	S	S	*	*	H	α-helix	trans	-60.6	-33.6	174.4	-69.5	-175.5	179.1	-156.8	-1.7	112.8	I1319 V1320 T1327	I1319-R1323 PolarHBondContact O-N 3.12Å; V1320-R1323 PolarHBondContact O-N 3.38Å; R1323-T1327 PolarHBondContact O-N 2.87Å; R1323-T1327 VanDerWaalsContact O-N 3.14Å; R1323-T1327 PolarHBondContact O-OG1 3.19Å
1324	L	32.7	Very low	33.5	Very low	91 Å²	91	107.1 Å²	107.1	48%	0.476	56%	0.563	S	S	.	*	H	α-helix	trans	-71	-38.4	170.2	-88.7	159.3	0	0	0	113	V1320 Q1322 T1327 T1328	V1320-L1324 HydrophobicContact CG1-CD1 3.94Å; V1320-L1324 WeakPolarHBondContact O-CB 3.12Å; V1320-L1324 PolarHBondContact O-N 3.37Å; Q1322-L1324 VanDerWaalsContact C-N 3.27Å; Q1322-L1324 PolarHBondContact O-N 3.08Å; L1324-T1327 WeakPolarHBondContact CA-OG1 3.26Å; L1324-T1327 PolarHBondContact O-OG1 3.22Å; L1324-T1328 WeakPolarHBondContact O-CB 3.26Å; L1324-T1328 WeakPolarHBondContact O-CG2 3.35Å; L1324-T1328 PolarHBondContact O-N 3.17Å; L1324-T1328 PolarHBondContact O-OG1 3.18Å
1325	A	31.3	Very low	33.3	Very low	35 Å²	35	109.5 Å²	109.5	29%	0.289	57%	0.573	S	S	.	*	H	α-helix	trans	-67.1	-37.6	176.3	0	0	0	0	0	112.3	N1321 Q1322 T1328 M1329	N1321-A1325 VanDerWaalsContact O-CB 3.26Å; N1321-A1325 WeakPolarHBondContact O-CB 3.25Å; N1321-A1325 PolarHBondContact O-N 2.55Å; Q1322-A1325 PolarHBondContact O-N 3.19Å; A1325-T1328 PolarHBondContact O-N 3.29Å; A1325-M1329 WeakPolarHBondContact O-CB 3.49Å; A1325-M1329 WeakPolarHBondContact O-CG 3.42Å; A1325-M1329 PolarHBondContact O-N 3.37Å
1326	D	35.1	Very low	33.1	Very low	86 Å²	86	113.3 Å²	113.3	46%	0.46	59%	0.59	S	S	.	*	H	α-helix	trans	-85.4	-12.7	-178.2	-58.1	-36.4	0	0	0	112.7	R997 Q1322	R997-D1326 IonicContact CZ-OD1 3.4Å; R997-D1326 IonicContact NH1-OD1 2.82Å; R997-D1326 IonicContact NH2-OD1 2.69Å; R997-D1326 PolarHBondContact NH2-OD1 3.06Å; Q1322-D1326 PolarHBondContact O-N 2.63Å
1327	T	35	Very low	32.8	Very low	97 Å²	97	114.7 Å²	114.7	60%	0.595	60%	0.602	S	S	*	*	H	α-helix	trans	-86.2	-27.8	162.2	41	0	0	0	0	113.2	R1323 L1324	R1323-T1327 PolarHBondContact O-N 2.87Å; R1323-T1327 VanDerWaalsContact O-N 3.14Å; R1323-T1327 PolarHBondContact O-OG1 3.19Å; L1324-T1327 WeakPolarHBondContact CA-OG1 3.26Å; L1324-T1327 PolarHBondContact O-OG1 3.22Å
1328	T	32.6	Very low	32.7	Very low	94 Å²	94	116.7 Å²	116.7	58%	0.577	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	10.5	178.1	55.2	0	0	0	0	114.8	L1324 A1325	L1324-T1328 WeakPolarHBondContact O-CB 3.26Å; L1324-T1328 WeakPolarHBondContact O-CG2 3.35Å; L1324-T1328 PolarHBondContact O-N 3.17Å; L1324-T1328 PolarHBondContact O-OG1 3.18Å; A1325-T1328 PolarHBondContact O-N 3.29Å
1329	M	32.5	Very low	32.7	Very low	119 Å²	119	119.3 Å²	119.3	59%	0.586	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.8	18.8	171.9	-81.1	-162.5	156.1	0	0	114.3	R997 A1325	R997-M1329 VanDerWaalsContact CZ-SD 3.6Å; R997-M1329 PolarHBondContact NH1-SD 3.2Å; A1325-M1329 WeakPolarHBondContact O-CB 3.49Å; A1325-M1329 WeakPolarHBondContact O-CG 3.42Å; A1325-M1329 PolarHBondContact O-N 3.37Å
1330	K	34.8	Very low	32.5	Very low	192 Å²	192	122.3 Å²	122.3	84%	0.835	64%	0.64	S	S	*	*	S	Bend	trans	-96.5	-15.6	166.2	-78.2	-162.7	167.5	-164.4	0	114.8
1331	D	31.2	Very low	32.2	Very low	138 Å²	138	128.3 Å²	128.3	74%	0.738	66%	0.656	S	S	*	*			trans	-112.5	126	173.1	-66.1	-57.6	0	0	0	109.8
1332	N	30.4	Very low	32	Very low	166 Å²	166	130 Å²	130	89%	0.888	67%	0.665	S	S	*	*			trans	-146.5	69.6	-173.8	-149.8	14	0	0	0	111.6
1333	S	34	Very low	31.6	Very low	76 Å²	76	130.5 Å²	130.5	53%	0.531	68%	0.68	S	S	.	*			trans	-125.2	131	175	50.9	0	0	0	0	113.4	F1485	S1333-F1485 VanDerWaalsContact CB-CZ 3.44Å; S1333-F1485 WeakPolarHBondContact OG-CZ 3.5Å
1334	L	29.4	Very low	31.1	Very low	152 Å²	152	134.2 Å²	134.2	80%	0.796	70%	0.695	S	S	*	*			trans	-35.7	136.5	-175.8	-76.5	151.9	0	0	0	120.4
1335	M	27.8	Very low	30.8	Very low	173 Å²	173	139.3 Å²	139.3	85%	0.852	71%	0.713	S	S	*	*			trans	66.7	161.2	156	-52.5	-159.2	-160.9	0	0	117
1336	N	30.2	Very low	30.8	Very low	121 Å²	121	145.6 Å²	145.6	65%	0.647	74%	0.741	S	S	*	*			cis	-130.1	158	3.1	-165.8	-5.6	0	0	0	111.1
1337	L	27	Very low	30.5	Very low	131 Å²	131	150.2 Å²	150.2	69%	0.686	76%	0.757	S	S	*	*	S	Bend	trans	-95.9	9.4	-162.4	-125.6	169.4	0	0	0	115.8
1338	N	30.1	Very low	30.1	Very low	125 Å²	125	153.7 Å²	153.7	67%	0.668	77%	0.771	S	S	*	*	S	Bend	trans	-102	-26.9	-173.7	-80.4	-9.9	0	0	0	115.4
1339	E	34	Very low	30	Very low	165 Å²	165	153.6 Å²	153.6	77%	0.771	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-83	-24.7	-168	-64.7	-177.6	135	0	0	113.8	Y1341	E1339-Y1341 PolarHBondContact O-N 2.95Å; E1339-Y1341 VanDerWaalsContact O-N 3.1Å
1340	V	32.8	Very low	30	Very low	142 Å²	142	153.2 Å²	153.2	86%	0.861	78%	0.784	S	S	*	*	G	3₁₀ helix	trans	-72.9	1.5	175.9	-170.1	0	0	0	0	112.5
1341	Y	28.5	Very low	29.8	Very low	207 Å²	207	149.7 Å²	149.7	81%	0.812	77%	0.774	S	S	*	*	G	3₁₀ helix	trans	-88.7	-13.1	179.4	-147.8	-94.8	0	0	0	114	E1339	E1339-Y1341 PolarHBondContact O-N 2.95Å; E1339-Y1341 VanDerWaalsContact O-N 3.1Å
1342	N	29.3	Very low	29.8	Very low	125 Å²	125	149.3 Å²	149.3	67%	0.668	77%	0.766	S	S	*	*	S	Bend	trans	-102.7	166.1	178.5	-72.5	-39	0	0	0	112.1
1343	C	29.3	Very low	29.9	Very low	134 Å²	134	148 Å²	148	91%	0.905	76%	0.759	S	S	*	*			trans	64.6	48.6	178.3	-64.4	0	0	0	0	117.2
1344	R	24.9	Very low	29.7	Very low	250 Å²	250	149.3 Å²	149.3	94%	0.943	76%	0.764	S	S	*	*			trans	-115.3	83	148.8	-91.8	-169.2	173.9	-174.9	0.2	111.6
1345	K	27.2	Very low	29.7	Very low	198 Å²	198	148.8 Å²	148.8	86%	0.861	76%	0.762	S	S	*	*			trans	-171.5	162.5	161.8	-109.9	169	-177.4	-177.9	0	108.9
1346	L	30	Very low	29.9	Very low	167 Å²	167	147.7 Å²	147.7	87%	0.874	76%	0.76	S	S	*	*			trans	71.3	134.9	-166	-48.4	172.9	0	0	0	111.7
1347	K	30.1	Very low	29.8	Very low	183 Å²	183	147.6 Å²	147.6	80%	0.796	76%	0.759	S	S	*	*			cis	-150	102.3	-2	-153	176.6	-175.5	-179.2	0	111.1
1348	D	26.5	Very low	30	Very low	169 Å²	169	149.8 Å²	149.8	90%	0.904	76%	0.763	S	S	*	*			trans	-77.7	121.4	159.7	-79	-57.9	0	0	0	109
1349	S	29.6	Very low	30.1	Very low	92 Å²	92	150.2 Å²	150.2	64%	0.643	77%	0.765	S	S	*	*			trans	176.3	153.3	144.8	48.8	0	0	0	0	114
1350	S	31.9	Very low	29.9	Very low	111 Å²	111	148 Å²	148	78%	0.776	76%	0.763	S	S	*	*			trans	69.7	152.5	167	74	0	0	0	0	119.5
1351	D	32	Very low	29.6	Very low	119 Å²	119	148.4 Å²	148.4	64%	0.636	76%	0.761	S	S	*	*				-162	142.6	-64.8	-125.2	-6.6	0	0	0	110.8
1352	K	31.6	Very low	29.6	Very low	129 Å²	129	143.7 Å²	143.7	56%	0.561	76%	0.758	S	S	*	*			trans	42.8	140	141.6	-64.6	171.8	-173.6	74.5	0	122
1353	N	31.4	Very low	29.6	Very low	139 Å²	139	144.6 Å²	144.6	74%	0.743	76%	0.761	S	S	*	*			trans	72.4	142.6	146.2	-63.5	-3.8	0	0	0	118.1
1354	T	29.3	Very low	29.6	Very low	104 Å²	104	144.6 Å²	144.6	64%	0.638	75%	0.752	S	S	*	*			cis	162.3	144.2	-27.2	35.2	0	0	0	0	106.7
1355	N	30.2	Very low	29.6	Very low	141 Å²	141	138.8 Å²	138.8	75%	0.754	74%	0.739	S	S	*	*			trans	84.1	152.1	157.1	-58.3	-17.5	0	0	0	119.9
1356	N	31.5	Very low	29.5	Very low	150 Å²	150	136.2 Å²	136.2	80%	0.802	74%	0.735	S	S	*	*			trans	69.4	107.2	172.4	-55	-12.7	0	0	0	115
1357	D	28.7	Very low	29.3	Very low	119 Å²	119	134.8 Å²	134.8	64%	0.636	73%	0.727	S	S	*	*				77.7	142.2	67.7	-108.4	-17.2	0	0	0	113.9	K8	K8-D1357 IonicContact NZ-OD1 2.67Å; K8-D1357 PolarHBondContact NZ-OD1 3.27Å; K8-D1357 IonicContact NZ-OD2 2.64Å; K8-D1357 PolarHBondContact NZ-OD2 2.98Å
1358	K	31.7	Very low	29.2	Very low	177 Å²	177	133 Å²	133	77%	0.77	73%	0.726	S	S	*	*			trans	87.5	122.2	168.6	-64.3	177.5	-179.5	-179.7	0	119.5
1359	N	31.2	Very low	29.2	Very low	133 Å²	133	128.1 Å²	128.1	71%	0.711	71%	0.71	S	S	*	*			trans	78.1	148.3	132.1	-62.6	12.1	0	0	0	121.1
1360	T	30.3	Very low	29.1	Very low	119 Å²	119	128.5 Å²	128.5	73%	0.73	71%	0.712	S	S	*	*			trans	61.5	116	152.1	41.1	0	0	0	0	116.2
1361	D	25.6	Very low	28.9	Very low	151 Å²	151	129.2 Å²	129.2	81%	0.807	70%	0.703	S	S	*	*				52.6	127.2	56.2	-66.2	-41.7	0	0	0	113.1
1362	S	28.4	Very low	28.8	Very low	108 Å²	108	131.8 Å²	131.8	76%	0.755	71%	0.705	S	S	*	*			trans	63	159.4	-166.5	85.4	0	0	0	0	113.4
1363	I	29.5	Very low	28.6	Very low	144 Å²	144	132.2 Å²	132.2	74%	0.738	71%	0.714	S	S	*	*			cis	-136.2	126.3	-10.3	-127.6	147.9	0	0	0	104.4
1364	L	29.6	Very low	28.5	Very low	134 Å²	134	131.9 Å²	131.9	70%	0.702	72%	0.716	S	S	*	*				69.3	137.8	82.1	-149.7	85	0	0	0	113.3
1365	N	25.7	Very low	28.5	Very low	127 Å²	127	130.8 Å²	130.8	68%	0.679	72%	0.718	S	S	*	*	S	Bend	trans	20.3	115.9	156.5	-63.4	-3.3	0	0	0	118.9
1366	N	25.2	Very low	28.5	Very low	144 Å²	144	131.1 Å²	131.1	77%	0.77	72%	0.718	S	S	*	*			trans	67.8	157.6	162.1	-48.3	-33.2	0	0	0	111
1367	L	25	Very low	28.5	Very low	138 Å²	138	131.1 Å²	131.1	72%	0.723	72%	0.718	S	S	*	*			cis	-155	156.9	48.1	-86.7	163.2	0	0	0	109.9
1368	N	28.3	Very low	28.7	Very low	144 Å²	144	130.3 Å²	130.3	77%	0.77	72%	0.722	S	S	*	*			trans	67.8	157.1	144.1	-67.2	-6	0	0	0	118.4
1369	A	27.7	Very low	28.8	Very low	68 Å²	68	126.3 Å²	126.3	56%	0.562	72%	0.716	S	S	*	*			cis	-163.6	150.5	-31	0	0	0	0	0	107.6
1370	S	27.2	Very low	28.8	Very low	99 Å²	99	126.5 Å²	126.5	69%	0.692	72%	0.717	S	S	*	*			trans	67.6	173.7	147	87.3	0	0	0	0	115.5
1371	H	27.5	Very low	28.7	Very low	126 Å²	126	124.9 Å²	124.9	58%	0.583	71%	0.711	S	S	*	*			cis	-148.3	154.8	-1.6	-129.1	-40.3	0	0	0	108.5
1372	Y	28.7	Very low	29	Very low	173 Å²	173	124.4 Å²	124.4	68%	0.678	71%	0.707	S	S	*	*			trans	61.3	112.9	152.7	-55.9	-46.2	0	0	0	117.2
1373	D	27.7	Very low	29	Very low	139 Å²	139	124.4 Å²	124.4	74%	0.743	70%	0.702	S	S	*	*				106.2	160.5	74.9	-76	-9.1	0	0	0	108.5
1374	V	30.6	Very low	28.9	Very low	132 Å²	132	124.2 Å²	124.2	80%	0.8	70%	0.702	S	S	*	*			cis	-127.8	156.2	8.1	178.6	0	0	0	0	109.1
1375	A	29.1	Very low	28.9	Very low	81 Å²	81	123.8 Å²	123.8	67%	0.669	70%	0.7	S	S	*	*			trans	-9.4	160.3	162.5	0	0	0	0	0	120.3
1376	I	30.3	Very low	29.1	Very low	147 Å²	147	121.4 Å²	121.4	75%	0.754	69%	0.693	S	S	*	*			cis	-149.1	141.1	40	-67.6	171.2	0	0	0	111.3
1377	N	30.5	Very low	29.5	Very low	151 Å²	151	121.4 Å²	121.4	81%	0.807	69%	0.694	S	S	*	*			trans	19.7	146.9	150.7	-50.5	-5.9	0	0	0	120.9
1378	S	33	Very low	29.8	Very low	102 Å²	102	122.5 Å²	122.5	71%	0.713	70%	0.7	S	S	*	*			cis	-154.2	150.2	14.4	49.2	0	0	0	0	113.3
1379	S	33.1	Very low	30.2	Very low	92 Å²	92	120.4 Å²	120.4	64%	0.643	69%	0.694	S	S	*	*			trans	52.5	139.9	143.8	63.7	0	0	0	0	121.9
1380	D	31.3	Very low	30.3	Very low	137 Å²	137	125 Å²	125	73%	0.733	71%	0.709	S	S	*	*			cis	-165.3	146.4	-19	-98	-50.1	0	0	0	105.2
1381	S	29.3	Very low	30.5	Very low	86 Å²	86	128.3 Å²	128.3	60%	0.601	71%	0.714	S	S	*	*				65.2	132.7	53.7	113	0	0	0	0	111.2
1382	I	30.9	Very low	30.7	Very low	141 Å²	141	128.6 Å²	128.6	72%	0.723	72%	0.719	S	S	*	*			cis	-158.3	130.5	40.9	-128.5	155.5	0	0	0	111.6
1383	T	27.9	Very low	30.6	Very low	107 Å²	107	124.3 Å²	124.3	66%	0.656	71%	0.714	S	S	*	*			trans	48.8	137.5	139.2	65	0	0	0	0	123.8
1384	L	27.8	Very low	30.7	Very low	140 Å²	140	125.7 Å²	125.7	73%	0.733	71%	0.713	S	S	*	*				66.4	151	90.4	-49.6	169.6	0	0	0	114.3
1385	D	30.2	Very low	30.7	Very low	126 Å²	126	127 Å²	127	67%	0.674	71%	0.714	S	S	*	*			cis	-153.1	169.1	8.3	-138.2	-44.7	0	0	0	114.1
1386	S	30.5	Very low	30.8	Very low	76 Å²	76	129.5 Å²	129.5	53%	0.531	72%	0.715	S	S	.	*			trans	-6.4	154.9	160	47.9	0	0	0	0	124.6
1387	N	33.5	Very low	30.8	Very low	145 Å²	145	128.2 Å²	128.2	78%	0.775	71%	0.714	S	S	*	*				141.7	116	128.5	-71.4	-52.4	0	0	0	115.5
1388	D	31.7	Very low	30.8	Very low	161 Å²	161	126.4 Å²	126.4	86%	0.861	71%	0.713	S	S	*	*			trans	59.3	157.5	148.4	-86.1	14.5	0	0	0	124.1
1389	P	35.2	Very low	30.8	Very low	100 Å²	100	124.5 Å²	124.5	65%	0.649	70%	0.7	S	S	*	*			trans	-123.4	179.2	-156.3	40.4	-24.3	0	0	0	115.9
1390	N	30.1	Very low	30.8	Very low	163 Å²	163	126 Å²	126	87%	0.872	71%	0.708	S	S	*	*			trans	73.9	48.3	171.1	-60.6	-24.6	0	0	0	117.3
1391	E	31.7	Very low	30.7	Very low	170 Å²	170	127.9 Å²	127.9	79%	0.794	71%	0.709	S	S	*	*			trans	-112.7	127.5	157.5	-82.2	-135	131.1	0	0	114.3
1392	I	31.6	Very low	30.8	Very low	132 Å²	132	128.9 Å²	128.9	68%	0.677	72%	0.716	S	S	*	*				57.1	112.4	129	-53.6	-176.2	0	0	0	120.2
1393	S	27.1	Very low	30.7	Very low	83 Å²	83	126.7 Å²	126.7	58%	0.58	71%	0.714	S	S	*	*			trans	-50.4	169.3	162.5	62.1	0	0	0	0	119
1394	K	29.8	Very low	30.7	Very low	167 Å²	167	128.8 Å²	128.8	73%	0.726	72%	0.72	S	S	*	*			trans	92.4	130.8	169	-52.7	148.2	-170.4	171.8	0	111.2	I1396	K1394-I1396 HydrophobicContact CG-CD1 4.4Å
1395	I	30.6	Very low	30.7	Very low	159 Å²	159	129.6 Å²	129.6	82%	0.815	72%	0.717	S	S	*	*				-151.9	128.6	55.1	-75.3	154.4	0	0	0	106.7
1396	I	30.3	Very low	30.6	Very low	134 Å²	134	131 Å²	131	69%	0.687	72%	0.72	S	S	*	*				70.4	119.3	50.8	-58.7	175.4	0	0	0	111.6	K1394	K1394-I1396 HydrophobicContact CG-CD1 4.4Å
1397	T	31	Very low	30.6	Very low	120 Å²	120	132.2 Å²	132.2	74%	0.736	73%	0.729	S	S	*	*			cis	-129.1	159.6	33.3	50.1	0	0	0	0	112
1398	S	29.9	Very low	30.3	Very low	113 Å²	113	130.1 Å²	130.1	79%	0.79	73%	0.725	S	S	*	*			cis	-125	148	38.1	55.3	0	0	0	0	113.3
1399	S	33.3	Very low	30.1	Very low	63 Å²	63	127.5 Å²	127.5	44%	0.441	72%	0.715	S	S	.	*			cis	74.1	142	29.4	-57.4	0	0	0	0	115.2
1400	P	33.1	Very low	29.9	Very low	124 Å²	124	129.1 Å²	129.1	81%	0.805	72%	0.718	S	S	*	*			cis	-70	145.2	-1.3	-12.8	30.1	0	0	0	112
1401	K	29	Very low	29.8	Very low	175 Å²	175	127 Å²	127	76%	0.761	72%	0.716	S	S	*	*			cis	77	144.1	47.9	-67	-177.5	176.4	-178.5	0	113.9
1402	S	31.8	Very low	29.7	Very low	108 Å²	108	121.4 Å²	121.4	76%	0.755	70%	0.704	S	S	*	*			trans	59.5	118.9	173.5	36.1	0	0	0	0	116.4
1403	S	27.9	Very low	29.8	Very low	95 Å²	95	124 Å²	124	66%	0.664	71%	0.711	S	S	*	*			cis	91.8	128.5	33.5	76.8	0	0	0	0	114.3
1404	L	27.7	Very low	30	Very low	150 Å²	150	126 Å²	126	79%	0.785	72%	0.715	S	S	*	*			trans	71.1	145.5	171.6	-47.9	156.6	0	0	0	113.2
1405	K	29.4	Very low	30.1	Very low	157 Å²	157	124.3 Å²	124.3	68%	0.683	71%	0.714	S	S	*	*			cis	-163.2	134.7	-11.3	-124	-177.5	176.8	-173.5	0	110.5
1406	Q	27.2	Very low	29.9	Very low	156 Å²	156	124.3 Å²	124.3	73%	0.729	71%	0.711	S	S	*	*			trans	54.8	177.9	143.5	-66.6	173.2	-76.1	0	0	119.2
1407	S	30.3	Very low	30	Very low	102 Å²	102	124.3 Å²	124.3	71%	0.713	71%	0.711	S	S	*	*			trans	56	106	-175.8	30.6	0	0	0	0	115.4
1408	S	28.6	Very low	29.9	Very low	100 Å²	100	122.8 Å²	122.8	70%	0.699	71%	0.705	S	S	*	*				56.9	120.1	63.3	82.4	0	0	0	0	110
1409	T	27.1	Very low	29.7	Very low	107 Å²	107	122.5 Å²	122.5	66%	0.656	70%	0.699	S	S	*	*			cis	157.4	-169.7	34.7	20.7	0	0	0	0	102.1
1410	D	30.2	Very low	29.5	Very low	133 Å²	133	127.4 Å²	127.4	71%	0.711	72%	0.715	S	S	*	*			trans	67.5	93.2	161	-43.8	-41.5	0	0	0	113.9
1411	S	27.7	Very low	29.1	Very low	119 Å²	119	125.6 Å²	125.6	83%	0.832	71%	0.705	S	S	*	*				73.7	137.3	71.2	75.7	0	0	0	0	113.6
1412	G	29.9	Very low	29	Very low	53 Å²	53	125.4 Å²	125.4	55%	0.546	70%	0.704	S	S	.	*			trans	149	135.6	160.8	0	0	0	0	0	113
1413	F	33.2	Very low	28.7	Very low	186 Å²	186	125.8 Å²	125.8	82%	0.816	70%	0.702	S	S	*	*			trans	74.2	108.9	159.1	-49.8	-73.8	0	0	0	115.3
1414	D	31.7	Very low	28.7	Very low	124 Å²	124	131.1 Å²	131.1	66%	0.663	71%	0.714	S	S	*	*				72.8	140.9	53.1	-48.2	-13.3	0	0	0	109.6
1415	D	31.3	Very low	28.6	Very low	132 Å²	132	131 Å²	131	71%	0.706	71%	0.713	S	S	*	*			cis	-155.3	155.2	2.4	-128.3	-22.4	0	0	0	112.8
1416	E	27.8	Very low	28.9	Very low	159 Å²	159	128.6 Å²	128.6	74%	0.743	71%	0.713	S	S	*	*			trans	56	-172	131.9	-137	-172.9	-140.1	0	0	122.1
1417	I	31.5	Very low	29	Very low	134 Å²	134	129 Å²	129	69%	0.687	72%	0.72	S	S	*	*			trans	57.1	92.7	167.1	-56.4	175.2	0	0	0	116.8
1418	S	28.6	Very low	28.8	Very low	88 Å²	88	129.6 Å²	129.6	62%	0.615	72%	0.715	S	S	*	*				77.7	118.2	93.8	119.4	0	0	0	0	116.3
1419	T	27	Very low	28.8	Very low	108 Å²	108	130.8 Å²	130.8	66%	0.663	71%	0.713	S	S	*	*				83.8	158.3	100.6	77	0	0	0	0	116.3
1420	Q	29	Very low	28.9	Very low	165 Å²	165	133.2 Å²	133.2	77%	0.771	72%	0.722	S	S	*	*			trans	63.1	104.3	164.4	-66.5	171.7	75.8	0	0	116.8
1421	S	24.2	Very low	28.7	Very low	87 Å²	87	131.3 Å²	131.3	61%	0.608	72%	0.719	S	S	*	*				82.7	153.7	69	81.1	0	0	0	0	114.7
1422	K	26.8	Very low	28.6	Very low	170 Å²	170	130.6 Å²	130.6	74%	0.739	71%	0.714	S	S	*	*			trans	72	115.2	172.6	-63.1	161.7	-173.6	169.5	0	112.9
1423	T	24.9	Very low	28.6	Very low	117 Å²	117	134.8 Å²	134.8	72%	0.718	73%	0.729	S	S	*	*				47.5	121.7	83.9	65.8	0	0	0	0	114
1424	F	28.9	Very low	28.2	Very low	206 Å²	206	131.3 Å²	131.3	90%	0.904	72%	0.723	S	S	*	*				-158.5	166.7	122.2	-111.4	-73.4	0	0	0	112
1425	L	24.5	Very low	27.9	Very low	149 Å²	149	132 Å²	132	78%	0.78	73%	0.725	S	S	*	*			trans	-94.3	173.2	178.8	-92.3	167.8	0	0	0	110.3
1426	P	36.8	Very low	27.8	Very low	105 Å²	105	131.2 Å²	131.2	68%	0.682	72%	0.721	S	S	*	*			trans	-80.7	175.1	-168.3	36	-38.3	0	0	0	112.7
1427	L	28.9	Very low	27.8	Very low	165 Å²	165	133.7 Å²	133.7	86%	0.864	72%	0.723	S	S	*	*			trans	-153.2	147.8	147	-111.8	163.5	0	0	0	111.8
1428	D	26.4	Very low	27.7	Very low	115 Å²	115	133.8 Å²	133.8	62%	0.615	73%	0.725	S	S	*	*			trans	-77.6	-177.1	-162.5	-54.4	-63.3	0	0	0	116.7
1429	N	27.4	Very low	27.9	Very low	124 Å²	124	136.7 Å²	136.7	66%	0.663	73%	0.734	S	S	*	*			trans	85.8	162.7	141.8	-75.2	-32.9	0	0	0	120.9
1430	L	30.8	Very low	28.2	Very low	159 Å²	159	135.4 Å²	135.4	83%	0.832	73%	0.729	S	S	*	*			trans	68.5	80.7	176.7	-60.7	167.3	0	0	0	114.5
1431	S	26.4	Very low	28.3	Very low	93 Å²	93	137.6 Å²	137.6	65%	0.65	73%	0.732	S	S	*	*				87	134.7	67.5	69	0	0	0	0	113.9
1432	S	25.4	Very low	28.7	Very low	104 Å²	104	138.7 Å²	138.7	73%	0.727	73%	0.731	S	S	*	*			trans	39.2	116.3	152.4	61.2	0	0	0	0	119.2
1433	V	30.1	Very low	29	Very low	141 Å²	141	138.4 Å²	138.4	86%	0.855	73%	0.73	S	S	*	*				-157	134.9	97.6	139.9	0	0	0	0	110.7
1434	T	24.5	Very low	29.3	Very low	112 Å²	112	136.8 Å²	136.8	69%	0.687	73%	0.728	S	S	*	*			trans	-84	160.1	-179.4	-1.9	0	0	0	0	111.7
1435	I	25.6	Very low	29.4	Very low	139 Å²	139	134.4 Å²	134.4	71%	0.713	72%	0.723	S	S	*	*			trans	68.8	123.2	151.2	-64.9	162.1	0	0	0	114.5
1436	N	28.7	Very low	29.6	Very low	116 Å²	116	131.5 Å²	131.5	62%	0.62	72%	0.715	S	S	*	*			cis	-154.9	141.8	45.5	-108.9	-39	0	0	0	108.8
1437	R	26.5	Very low	29.2	Very low	211 Å²	211	134.3 Å²	134.3	80%	0.796	73%	0.725	S	S	*	*				46	123.1	87.6	-58.4	-172.8	177	140.9	-7.4	116.1
1438	N	30.5	Very low	29.3	Very low	136 Å²	136	130.3 Å²	130.3	73%	0.727	72%	0.724	S	S	*	*				-173.5	160.2	100.9	-94.1	-24.7	0	0	0	113.5
1439	N	32.5	Very low	29.3	Very low	149 Å²	149	133.1 Å²	133.1	80%	0.797	74%	0.737	S	S	*	*			trans	70.8	138	166.8	-57.1	-17.2	0	0	0	118.7
1440	S	33.1	Very low	29.4	Very low	81 Å²	81	132.7 Å²	132.7	57%	0.566	74%	0.743	S	S	*	*			cis	-171.5	141.8	-15.7	53	0	0	0	0	111.9
1441	Y	31	Very low	29.1	Very low	211 Å²	211	132.5 Å²	132.5	83%	0.827	74%	0.743	S	S	*	*			trans	63	145.4	170.8	-48.9	-67.6	0	0	0	114.6
1442	D	33.2	Very low	29.2	Very low	110 Å²	110	133.8 Å²	133.8	59%	0.588	75%	0.75	S	S	*	*			cis	-162.7	163.1	-4.5	-103.1	-15.7	0	0	0	106
1443	K	33.2	Very low	29.4	Very low	163 Å²	163	133.8 Å²	133.8	71%	0.709	75%	0.75	S	S	*	*			cis	-154.9	154.1	-4.9	-118.9	155.6	-170.3	146.3	0	108.1
1444	A	31.4	Very low	29.2	Very low	83 Å²	83	136.8 Å²	136.8	69%	0.686	75%	0.752	S	S	*	*				41.8	132	100.4	0	0	0	0	0	115.7
1445	I	31	Very low	29.4	Very low	156 Å²	156	138 Å²	138	80%	0.8	75%	0.753	S	S	*	*			cis	-154.7	130.8	7.8	-107.6	153.2	0	0	0	105.8
1446	S	28.5	Very low	29.4	Very low	88 Å²	88	138 Å²	138	62%	0.615	76%	0.755	S	S	*	*				76.2	120.6	71.3	-178.8	0	0	0	0	115.7
1447	N	28.7	Very low	29.4	Very low	164 Å²	164	137.6 Å²	137.6	88%	0.877	76%	0.761	S	S	*	*			trans	61.1	126.6	157.2	-61.7	-17.1	0	0	0	121.6
1448	G	29.8	Very low	29.3	Very low	82 Å²	82	130.8 Å²	130.8	85%	0.845	75%	0.745	S	S	*	*			trans	-171	97.4	166.8	0	0	0	0	0	112.7
1449	I	27.5	Very low	29.2	Very low	174 Å²	174	132.5 Å²	132.5	89%	0.892	75%	0.746	S	S	*	*			trans	-94.2	131.1	179.7	-62.8	167	0	0	0	109.9
1450	S	29.3	Very low	28.8	Very low	114 Å²	114	131.5 Å²	131.5	80%	0.797	74%	0.738	S	S	*	*			trans	-157.9	146.5	149	-159.6	0	0	0	0	113.2
1451	L	24.6	Very low	28.4	Very low	156 Å²	156	135.3 Å²	135.3	82%	0.817	75%	0.745	S	S	*	*			trans	-89.2	145.8	165.9	-107	65.3	0	0	0	109.8
1452	C	28.3	Very low	28.1	Very low	120 Å²	120	130.1 Å²	130.1	81%	0.811	74%	0.735	S	S	*	*			trans	-177.6	152.9	138.7	-110.3	0	0	0	0	111.9
1453	S	29.3	Very low	27.8	Very low	104 Å²	104	131.7 Å²	131.7	73%	0.727	74%	0.743	S	S	*	*			trans	30.3	114.1	156.4	54.7	0	0	0	0	118.4
1454	F	25.5	Very low	27.5	Very low	203 Å²	203	128.2 Å²	128.2	89%	0.89	74%	0.739	S	S	*	*			cis	60.2	136.7	39.8	-134.3	-91.5	0	0	0	114.5
1455	I	28.3	Very low	27.4	Very low	138 Å²	138	135.1 Å²	135.1	71%	0.708	75%	0.747	S	S	*	*			trans	89.8	118	176.4	-51	-173.7	0	0	0	117.7
1456	N	27.6	Very low	27.3	Very low	140 Å²	140	133.7 Å²	133.7	75%	0.749	74%	0.741	S	S	*	*			trans	58.8	105.8	154.2	-61.3	2.4	0	0	0	123.3
1457	S	27.1	Very low	27.4	Very low	107 Å²	107	134 Å²	134	75%	0.748	74%	0.74	S	S	*	*				50	143.1	106.6	-49.5	0	0	0	0	123.2
1458	S	25.9	Very low	27.6	Very low	68 Å²	68	133 Å²	133	48%	0.476	73%	0.734	S	S	.	*			trans	47.5	96	151.3	-58.9	0	0	0	0	118.6
1459	K	27.4	Very low	27.7	Very low	171 Å²	171	134 Å²	134	74%	0.743	72%	0.72	S	S	*	*			trans	-156.8	126.2	147.1	-112.3	149	-164.8	163.4	0	113.9	N1491	K1459-N1491 WeakPolarHBondContact CE-OD1 3.49Å
1460	M	24.2	Very low	28	Very low	129 Å²	129	131.3 Å²	131.3	64%	0.635	71%	0.712	S	S	*	*			trans	-72.5	152.4	153.4	-64	171.2	60.6	0	0	109	A1490	M1460-A1490 HydrophobicContact CB-CB 4.16Å; M1460-A1490 HydrophobicContact CG-CB 3.97Å; M1460-A1490 HydrophobicContact SD-CB 3.66Å
1461	F	24.8	Very low	28.2	Very low	161 Å²	161	132.6 Å²	132.6	71%	0.706	70%	0.703	S	S	*	*				177.3	131.6	114.8	-112.3	-112.2	0	0	0	113.3
1462	V	24.6	Very low	28.4	Very low	102 Å²	102	131.6 Å²	131.6	62%	0.618	69%	0.693	S	S	*	*			trans	39	120.4	136.4	179.7	0	0	0	0	120.7
1463	N	27.2	Very low	28.4	Very low	142 Å²	142	133.9 Å²	133.9	76%	0.759	69%	0.691	S	S	*	*				-160.1	130.5	118.5	-101.8	-48.1	0	0	0	109.3
1464	C	26.8	Very low	28.4	Very low	91 Å²	91	135 Å²	135	62%	0.615	68%	0.679	S	S	*	*				57.1	120.7	91.9	-68.7	0	0	0	0	112.2
1465	R	28.4	Very low	28.5	Very low	227 Å²	227	132.9 Å²	132.9	86%	0.857	67%	0.666	S	S	*	*			cis	-156.5	174.9	18.1	-89.8	152.5	-177.2	167.2	-1.9	107.2
1466	N	30.3	Very low	28.5	Very low	126 Å²	126	131.8 Å²	131.8	67%	0.674	66%	0.662	S	S	*	*			cis	-163.6	162.7	16	-136.6	36.2	0	0	0	110.6
1467	T	30.8	Very low	28.6	Very low	96 Å²	96	131.2 Å²	131.2	59%	0.589	66%	0.658	S	S	*	*			trans	24.3	140.2	141.1	58.3	0	0	0	0	121.5
1468	D	31.8	Very low	28.6	Very low	141 Å²	141	131.6 Å²	131.6	75%	0.754	65%	0.651	S	S	*	*			cis	-161.2	138.4	2.8	-93.4	-23.9	0	0	0	108.3
1469	D	32.9	Very low	28.9	Very low	105 Å²	105	135.2 Å²	135.2	56%	0.561	67%	0.665	S	S	*	*				85.6	150.6	75.8	-166.4	42.3	0	0	0	115.3	K1471	D1469-K1471 IonicContact OD1-NZ 3.98Å; D1469-K1471 IonicContact OD2-NZ 2.61Å; D1469-K1471 PolarHBondContact OD2-NZ 3.5Å
1470	T	33.8	Very low	29	Very low	117 Å²	117	134 Å²	134	72%	0.718	66%	0.66	S	S	*	*			trans	96.1	143.9	-174.4	75.4	0	0	0	0	116.6
1471	K	31.9	Very low	29.3	Very low	141 Å²	141	136.3 Å²	136.3	61%	0.613	67%	0.667	S	S	*	*			cis	-167.7	105.4	-45.8	-106.8	150.6	-171.6	120.9	0	107.3	D1469	D1469-K1471 IonicContact OD1-NZ 3.98Å; D1469-K1471 IonicContact OD2-NZ 2.61Å; D1469-K1471 PolarHBondContact OD2-NZ 3.5Å
1472	F	28.9	Very low	29.7	Very low	135 Å²	135	135.1 Å²	135.1	59%	0.592	67%	0.668	S	S	*	*				77.1	129.9	95.8	-95.9	-57.8	0	0	0	118.1	R1474	F1472-R1474 HydrophobicContact CD1-CG 3.58Å; F1472-R1474 HydrophobicContact CE1-CG 3.84Å
1473	H	30.1	Very low	29.9	Very low	167 Å²	167	138.1 Å²	138.1	77%	0.773	68%	0.679	S	S	*	*				-169.7	124.7	107.2	-100.7	-91.6	0	0	0	107.9
1474	R	27.6	Very low	30.1	Very low	129 Å²	129	140.6 Å²	140.6	49%	0.487	68%	0.684	S	S	.	*				75.7	142	55.8	-71.5	171.7	174	-154.2	-3.6	113	F1472	F1472-R1474 HydrophobicContact CD1-CG 3.58Å; F1472-R1474 HydrophobicContact CE1-CG 3.84Å
1475	Y	27.6	Very low	30.3	Very low	157 Å²	157	141.5 Å²	141.5	62%	0.616	68%	0.677	S	S	*	*			cis	-156.5	173.2	-2.5	-97.7	-41.3	0	0	0	106.8
1476	N	28.8	Very low	30.5	Very low	115 Å²	115	136.5 Å²	136.5	62%	0.615	67%	0.667	S	S	*	*			cis	-153.4	161	2.9	-115.3	-5.5	0	0	0	105.9
1477	I	28.9	Very low	30.6	Very low	129 Å²	129	134.6 Å²	134.6	66%	0.662	66%	0.664	S	S	*	*			cis	77	107.9	27.1	-50.2	174.5	0	0	0	116
1478	N	28.5	Very low	30.7	Very low	115 Å²	115	138.5 Å²	138.5	62%	0.615	67%	0.667	S	S	*	*			trans	173.1	139	139.9	-84.4	-29.9	0	0	0	105.7
1479	D	31.4	Very low	30.9	Very low	144 Å²	144	136.6 Å²	136.6	77%	0.77	66%	0.656	S	S	*	*			cis	-137.5	173.6	15.1	-85	-48	0	0	0	110.6
1480	K	30.5	Very low	30.8	Very low	144 Å²	144	131.9 Å²	131.9	63%	0.626	63%	0.632	S	S	*	*			cis	178.3	124.7	-42.9	-112.4	-163.5	179.2	176.5	0	107.2
1481	F	29.5	Very low	30.7	Very low	178 Å²	178	130.5 Å²	130.5	78%	0.781	62%	0.62	S	S	*	*			trans	63.5	162.6	158.2	-72.7	-103.9	0	0	0	117.1
1482	N	33.2	Very low	30.6	Very low	137 Å²	137	130.8 Å²	130.8	73%	0.733	63%	0.629	S	S	*	*			cis	-137.5	144.9	8.7	-150	-27.1	0	0	0	113.2
1483	L	28.6	Very low	30.7	Very low	164 Å²	164	130.6 Å²	130.6	86%	0.859	63%	0.63	S	S	*	*			trans	-92.7	119.5	178.2	-78.9	158.4	0	0	0	110.4
1484	K	32.1	Very low	30.7	Very low	195 Å²	195	128.7 Å²	128.7	85%	0.848	62%	0.623	S	S	*	*			trans	-154.7	19.3	172.8	-132.3	175.3	-173.8	179.5	0	117.1
1485	F	30.5	Very low	30.9	Very low	110 Å²	110	128.7 Å²	128.7	48%	0.482	63%	0.63	S	S	.	*	S	Bend	trans	-114.9	-41.3	-172.7	-161.5	-112.6	0	0	0	115.3	S1333 S1487 R1488 I1489	S1333-F1485 VanDerWaalsContact CB-CZ 3.44Å; S1333-F1485 WeakPolarHBondContact OG-CZ 3.5Å; F1485-S1487 VanDerWaalsContact C-N 3.27Å; F1485-S1487 PolarHBondContact O-N 3.07Å; F1485-R1488 PolarHBondContact O-N 2.95Å; F1485-R1488 VanDerWaalsContact O-N 3.14Å; F1485-I1489 HydrophobicContact CD1-CD1 4.43Å; F1485-I1489 HydrophobicContact CE1-CD1 4.03Å
1486	L	33.5	Very low	31.1	Very low	121 Å²	121	127 Å²	127	63%	0.634	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	5.4	-173.1	-61.5	-176.6	0	0	0	115.7	R1488 I1489	L1486-R1488 PolarHBondContact O-N 3.48Å; L1486-I1489 HydrophobicContact CD2-CB 4.18Å; L1486-I1489 HydrophobicContact CD2-CD1 3.6Å; L1486-I1489 HydrophobicContact CD2-CG1 3.89Å
1487	S	32.6	Very low	31.2	Very low	87 Å²	87	127.8 Å²	127.8	61%	0.608	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	0.9	161.6	66.1	0	0	0	0	113.1	F1485	F1485-S1487 VanDerWaalsContact C-N 3.27Å; F1485-S1487 PolarHBondContact O-N 3.07Å
1488	R	32.7	Very low	31.4	Very low	177 Å²	177	127.7 Å²	127.7	67%	0.668	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.1	-42.2	170.6	-84.3	-177.8	159.1	148.9	-6.4	113.7	F1485 L1486 A1490 N1491 D1492	F1485-R1488 PolarHBondContact O-N 2.95Å; F1485-R1488 VanDerWaalsContact O-N 3.14Å; L1486-R1488 PolarHBondContact O-N 3.48Å; R1488-A1490 PolarHBondContact O-N 3.43Å; R1488-N1491 PolarHBondContact O-N 3.38Å; R1488-D1492 PolarHBondContact O-N 3.11Å
1489	I	35	Very low	31.6	Very low	101 Å²	101	128.6 Å²	128.6	52%	0.518	63%	0.631	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.9	26.5	175.9	-40.6	-169.5	0	0	0	112.6	F1485 L1486	F1485-I1489 HydrophobicContact CD1-CD1 4.43Å; F1485-I1489 HydrophobicContact CE1-CD1 4.03Å; L1486-I1489 HydrophobicContact CD2-CB 4.18Å; L1486-I1489 HydrophobicContact CD2-CD1 3.6Å; L1486-I1489 HydrophobicContact CD2-CG1 3.89Å
1490	A	32	Very low	31.6	Very low	7 Å²	7	127.4 Å²	127.4	6%	0.058	62%	0.621	C	S	.	*	T	Hydrogen-bonded Turn	trans	-116.6	2	165.2	0	0	0	0	0	111.4	M1460 R1488	M1460-A1490 HydrophobicContact CB-CB 4.16Å; M1460-A1490 HydrophobicContact CG-CB 3.97Å; M1460-A1490 HydrophobicContact SD-CB 3.66Å; R1488-A1490 PolarHBondContact O-N 3.43Å
1491	N	31.6	Very low	31.7	Very low	88 Å²	88	126 Å²	126	47%	0.471	62%	0.62	S	S	.	*	T	Hydrogen-bonded Turn	trans	-138.7	-6.5	-177.7	-66.5	-78.7	0	0	0	112.9	K1459 R1488	K1459-N1491 WeakPolarHBondContact CE-OD1 3.49Å; R1488-N1491 PolarHBondContact O-N 3.38Å
1492	D	29.4	Very low	31.9	Very low	147 Å²	147	121.3 Å²	121.3	79%	0.786	61%	0.606	S	S	*	*			trans	-110.2	0	160.4	-58	-54.1	0	0	0	106.5	R1488	R1488-D1492 PolarHBondContact O-N 3.11Å

Retrieved 1,492 of 1,492 residues in 1376.4 ms (Link to these results)

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