A0A087XGS7_POEFO Loading...

Polycystin-2

AlphaFold DB , UniProt , Accession A0A087XGS7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 892 aa.

						>A0A087XGS7_POEFO|A0A087XGS7
MSSSRVRPQSQSGRTAQGPDSSEGIEMENIQHQDLGLGGMIGTPSPPSRQAWSRDNPVFEPEEEIMEADWPQASPGRRSVSTASSGSSSSYNRGGSSAQMPRGGLYPTPTPTINARQQDRREHRSCLKQILQKIRILWGTELMEDSDSSRERYLRNVLREMLTYVGFLITVCVLTYGMVNSNMYYYTKVMSQLFLDTPLSPGDQTTFRSLSTMKDFWKFTQGPFLGGMYWDVWYNNSLPENQSFIFYENLLLGVPRLRQVKVRNESCSVHEDLRDEVQDCYNIYTPSNEDTAPFGPNNGTAWVYTTESEMNSSSYWGQVSKYGGGGYYQDLSRTKEESANRLQFLKDHLWLDRGTRAVFLDFSVYNGNINLFCIARLLVEFPATGGAVTSWHFQTVRLVRYVSSWDYFVGVCEVAFCLFILYYVVEEVLEIHIHRLHYFKSMWNCLDILIVVLSVVAIIMNITRTAMARNLLSGLLENYMAHPSFEPLASLQAQFNNLAAVIVFFSWVKLFKFINFNKTMSQLSTTMSRCAKDLTGFAIMFFIIFLAYAQLAYLVFGTQVNDFSTFQASVFTQFRIILGDFDFSEIEEANPVLGPVYFTTFVFFIFFILMNMFLAIINDTYSEVKADMSQQRCEMEMTDLIKKGCNKALMKLRLKKTPVDKISSGLQQASSKMNFDELRQDLKGKGHTDAEIQAIFAKYDQVGDPELTEHEHQQMRDDLEKEREDLELERNSLTRPSSGRSFPRTQDDSEEDDDEDSGHSSRRRGSSSGGVSYEEFQVLVRRVDQMEHSFGSIVSKIDAVIVKLEGMERAKLKRRDVLGRLLDRVMEDERLGRDTDVHREQMERLVREELERWESDDLGSQVSHTPVGPRARPPSSLSTDGLDASSNGAVHV
					

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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	34.7	Very low	29.5	Very low	232 Å²	232	159.4 Å²	159.4	100%	1.143	84%	0.84	S	S	*	*				0	94.7	0	-70.2	167	164.2	0	0	106.7
2	S	27.6	Very low	29.3	Very low	108 Å²	108	157.1 Å²	157.1	76%	0.755	85%	0.847	S	S	*	*				63.3	96.2	89.5	61	0	0	0	0	111.7
3	S	28.5	Very low	29.1	Very low	124 Å²	124	150.3 Å²	150.3	87%	0.867	84%	0.837	S	S	*	*				80.7	100.8	60.5	-170.1	0	0	0	0	115
4	S	28.1	Very low	29	Very low	108 Å²	108	156.2 Å²	156.2	76%	0.755	84%	0.84	S	S	*	*			trans	-177.8	119.8	156	47.5	0	0	0	0	108.1
5	R	29.6	Very low	29	Very low	242 Å²	242	154.5 Å²	154.5	91%	0.913	84%	0.838	S	S	*	*				51.5	132.8	85.1	-76.6	-173.3	177.3	178.1	0.4	112.5
6	V	27.1	Very low	28.9	Very low	132 Å²	132	150.1 Å²	150.1	80%	0.8	83%	0.828	S	S	*	*				-153.9	157.2	50.6	167.1	0	0	0	0	112.8
7	R	31.4	Very low	28.8	Very low	241 Å²	241	152.7 Å²	152.7	91%	0.909	83%	0.833	S	S	*	*			trans	-128.3	137.4	165	-173.1	-164.2	-155.6	-173.4	9.5	108.5
8	P	35.3	Very low	28.7	Very low	106 Å²	106	148.2 Å²	148.2	69%	0.688	83%	0.827	S	S	*	*			trans	-142.6	159.7	135.7	29.9	-10.7	0	0	0	111.7
9	Q	27.3	Very low	29.2	Very low	169 Å²	169	146.9 Å²	146.9	79%	0.79	83%	0.827	S	S	*	*			cis	98.7	108.3	19	-159.9	-173.8	29.8	0	0	116.1
10	S	26.3	Very low	29.1	Very low	114 Å²	114	147.4 Å²	147.4	80%	0.797	83%	0.827	S	S	*	*			trans	-168.2	134.7	141.7	48.9	0	0	0	0	106.6
11	Q	29.1	Very low	29	Very low	177 Å²	177	145.4 Å²	145.4	83%	0.827	82%	0.822	S	S	*	*			cis	80.3	108	36.7	-82.4	-163.9	-13.7	0	0	116.7
12	S	26.5	Very low	28.6	Very low	132 Å²	132	139.4 Å²	139.4	92%	0.923	80%	0.804	S	S	*	*				-154.9	158.2	123.2	68.3	0	0	0	0	110.8
13	G	27.1	Very low	28.6	Very low	69 Å²	69	143.7 Å²	143.7	71%	0.711	81%	0.812	S	S	*	*			trans	177.4	168.2	176.7	0	0	0	0	0	110.1
14	R	27.2	Very low	28.5	Very low	233 Å²	233	141 Å²	141	88%	0.879	80%	0.803	S	S	*	*			trans	-179.4	121.4	167.2	-102.2	169	179.8	-168	-1.7	109
15	T	28.5	Very low	28.5	Very low	131 Å²	131	142.9 Å²	142.9	80%	0.804	80%	0.804	S	S	*	*				65.1	144	86.1	66.4	0	0	0	0	114.9
16	A	27.8	Very low	28.3	Very low	83 Å²	83	140.2 Å²	140.2	69%	0.686	80%	0.801	S	S	*	*			cis	-157.5	155.4	18.3	0	0	0	0	0	114.7
17	Q	27.1	Very low	28.6	Very low	195 Å²	195	141.5 Å²	141.5	91%	0.911	80%	0.801	S	S	*	*			trans	31.3	146.2	134.2	-65.2	172.5	-49.3	0	0	124.3
18	G	27.3	Very low	28.5	Very low	71 Å²	71	138.6 Å²	138.6	73%	0.732	80%	0.797	S	S	*	*			trans	-90.5	-161.3	179.7	0	0	0	0	0	116.1
19	P	37.8	Very low	27.9	Very low	125 Å²	125	139.2 Å²	139.2	81%	0.812	80%	0.795	S	S	*	*				-154.7	170.9	97.9	42.4	-24.7	0	0	0	118.4
20	D	27.1	Very low	27.9	Very low	156 Å²	156	137.3 Å²	137.3	83%	0.834	79%	0.789	S	S	*	*			trans	36.1	150.4	145.7	-70	-37.2	0	0	0	128
21	S	28.6	Very low	27.8	Very low	105 Å²	105	139.8 Å²	139.8	73%	0.734	79%	0.788	S	S	*	*			trans	-54.3	151.4	179.2	54.2	0	0	0	0	120.5
22	S	26.2	Very low	27.6	Very low	107 Å²	107	138.4 Å²	138.4	75%	0.748	78%	0.781	S	S	*	*				-174.7	130.5	128.4	18.6	0	0	0	0	113.6
23	E	27.4	Very low	27.6	Very low	197 Å²	197	139 Å²	139	92%	0.921	77%	0.769	S	S	*	*			trans	44.1	150	130.2	-57.6	-175	136.6	0	0	124.8
24	G	26.9	Very low	27.7	Very low	67 Å²	67	141.4 Å²	141.4	69%	0.691	77%	0.766	S	S	*	*			trans	110.3	99.5	168	0	0	0	0	0	113.5
25	I	26.6	Very low	27.9	Very low	149 Å²	149	138.1 Å²	138.1	76%	0.764	77%	0.765	S	S	*	*				83.8	126.5	54.5	-60.7	175.9	0	0	0	113.6
26	E	26	Very low	27.9	Very low	186 Å²	186	135 Å²	135	87%	0.869	76%	0.759	S	S	*	*			trans	68.5	119.2	161.7	-76.8	155.7	-173.6	0	0	122
27	M	33.7	Very low	27.9	Very low	159 Å²	159	139.7 Å²	139.7	78%	0.783	77%	0.772	S	S	*	*			trans	-85	138.1	145.4	-64.5	-165.7	-60.7	0	0	109.1
28	E	28.5	Very low	27.9	Very low	180 Å²	180	134.4 Å²	134.4	84%	0.841	77%	0.77	S	S	*	*			trans	170.6	152.9	150.7	-102.6	-157	116.7	0	0	108
29	N	23.8	Very low	28	Very low	118 Å²	118	134.4 Å²	134.4	63%	0.631	77%	0.77	S	S	*	*			cis	-163.5	179.3	-13.7	-155.9	-21.7	0	0	0	108.5
30	I	25.6	Very low	27.6	Very low	129 Å²	129	137.2 Å²	137.2	66%	0.662	77%	0.774	S	S	*	*			trans	72.5	92.7	153.1	-60	155.3	0	0	0	119.4
31	Q	25.9	Very low	27.7	Very low	166 Å²	166	137.2 Å²	137.2	78%	0.776	77%	0.772	S	S	*	*				38.1	132.6	100.6	-146.2	164	13.4	0	0	122.2
32	H	25.3	Very low	27.7	Very low	149 Å²	149	135.3 Å²	135.3	69%	0.69	77%	0.77	S	S	*	*			trans	122.7	111.1	158.9	-74.9	-77.4	0	0	0	113
33	Q	26.5	Very low	28	Very low	143 Å²	143	136.8 Å²	136.8	67%	0.668	77%	0.774	S	S	*	*				92.1	107.3	57.9	-177.7	-178.4	6.2	0	0	112.7
34	D	28.3	Very low	28.3	Very low	121 Å²	121	133.6 Å²	133.6	65%	0.647	77%	0.77	S	S	*	*				168.5	143.3	112.2	-105.4	-23	0	0	0	116.8
35	L	30.5	Very low	28.3	Very low	163 Å²	163	135.8 Å²	135.8	85%	0.853	78%	0.775	S	S	*	*			trans	52.6	142.3	144.5	-62.2	161.6	0	0	0	121.9
36	G	28.2	Very low	29.9	Very low	67 Å²	67	133.9 Å²	133.9	69%	0.691	77%	0.773	S	S	*	*			cis	-162.8	-171.4	-0.1	0	0	0	0	0	108.9
37	L	28.9	Very low	30.3	Very low	181 Å²	181	130.5 Å²	130.5	95%	0.948	77%	0.767	S	S	*	*			cis	-142.2	145	8.9	-72.5	102.7	0	0	0	108.3
38	G	27.7	Very low	30	Very low	84 Å²	84	127.9 Å²	127.9	87%	0.866	76%	0.764	S	S	*	*				92	129	84.7	0	0	0	0	0	113
39	G	28.4	Very low	30.2	Very low	71 Å²	71	130.3 Å²	130.3	73%	0.732	77%	0.766	S	S	*	*			cis	173.8	168.9	-6.9	0	0	0	0	0	113
40	M	29.7	Very low	30.3	Very low	183 Å²	183	132.9 Å²	132.9	90%	0.901	77%	0.774	S	S	*	*			trans	61.6	146	165.2	-63.5	-174.4	165.4	0	0	118.7
41	I	29.8	Very low	30.4	Very low	156 Å²	156	130.8 Å²	130.8	80%	0.8	78%	0.776	S	S	*	*			cis	-158.4	147.8	-10.6	-104.7	161.4	0	0	0	104.3
42	G	27.6	Very low	30.4	Very low	66 Å²	66	134.4 Å²	134.4	68%	0.68	78%	0.783	S	S	*	*			cis	-172.8	-157.2	2.1	0	0	0	0	0	110.2
43	T	33	Very low	30.5	Very low	138 Å²	138	132 Å²	132	85%	0.847	78%	0.783	S	S	*	*			trans	-137.8	172.2	-179.7	59.8	0	0	0	0	110.8
44	P	33.2	Very low	30.8	Very low	129 Å²	129	135.9 Å²	135.9	84%	0.838	79%	0.791	S	S	*	*				-140.3	170.9	82.4	35.7	-18.2	0	0	0	114.9
45	S	27.8	Very low	30.8	Very low	113 Å²	113	137.7 Å²	137.7	79%	0.79	80%	0.801	S	S	*	*			trans	-113.2	-156.7	-171.8	58.8	0	0	0	0	112.7
46	P	60.2	Low	30.7	Very low	110 Å²	110	137.3 Å²	137.3	71%	0.714	80%	0.799	S	S	*	*			trans	-91.9	-173.9	-132.7	41.3	-27.6	0	0	0	114.4
47	P	34.5	Very low	31.8	Very low	115 Å²	115	138.9 Å²	138.9	75%	0.747	80%	0.798	S	S	*	*				-157.5	173.1	104.6	39.1	-19.2	0	0	0	119.2
48	S	26.6	Very low	31.5	Very low	104 Å²	104	136.1 Å²	136.1	73%	0.727	79%	0.788	S	S	*	*			trans	66	116.5	138.7	60.7	0	0	0	0	124.6
49	R	32.3	Very low	31.3	Very low	230 Å²	230	141.2 Å²	141.2	87%	0.868	79%	0.787	S	S	*	*				31.5	146.3	116.2	-83.6	-171.9	177	-155.5	0.1	122.4
50	Q	27	Very low	31.6	Very low	172 Å²	172	146.1 Å²	146.1	80%	0.804	79%	0.79	S	S	*	*			trans	92.1	95	152.9	-76.2	170.6	-26.4	0	0	120.6
51	A	27.4	Very low	31.7	Very low	85 Å²	85	141.7 Å²	141.7	70%	0.702	78%	0.775	S	S	*	*				49.9	153.5	108.2	0	0	0	0	0	123.3
52	W	26.2	Very low	31.6	Very low	243 Å²	243	141.8 Å²	141.8	92%	0.92	77%	0.773	S	S	*	*			trans	74.4	152.1	177.9	-66.3	57.1	0	0	0	114.8
53	S	25.7	Very low	31.7	Very low	99 Å²	99	146.1 Å²	146.1	69%	0.692	78%	0.775	S	S	*	*			cis	-161.4	175.3	-21.1	51.1	0	0	0	0	108.9
54	R	33.4	Very low	31.3	Very low	223 Å²	223	147.3 Å²	147.3	84%	0.842	77%	0.771	S	S	*	*			trans	-61.9	144.5	173.9	-72	158.6	62.4	144	-1.9	111.8
55	D	27.8	Very low	31.1	Very low	160 Å²	160	148.8 Å²	148.8	86%	0.856	77%	0.77	S	S	*	*				-168	161.2	111.9	-91.1	-25.7	0	0	0	113.2
56	N	28.7	Very low	31	Very low	154 Å²	154	151.2 Å²	151.2	82%	0.824	77%	0.771	S	S	*	*			trans	-99.6	-170.7	-171.1	-136.8	10.2	0	0	0	110.1
57	P	50.9	Low	29.4	Very low	101 Å²	101	154.1 Å²	154.1	66%	0.656	78%	0.775	S	S	*	*			cis	-130.1	-166.8	-21.7	34.7	-14.3	0	0	0	112.3
58	V	23.1	Very low	29	Very low	122 Å²	122	152.5 Å²	152.5	74%	0.739	77%	0.771	S	S	*	*			trans	155.5	123.3	131.4	159.5	0	0	0	0	113.8
59	F	24.6	Very low	28.8	Very low	191 Å²	191	153.8 Å²	153.8	84%	0.838	77%	0.77	S	S	*	*			trans	49.9	113.6	154.8	-84.7	-113.3	0	0	0	122.5
60	E	33.6	Very low	28.4	Very low	174 Å²	174	154.7 Å²	154.7	81%	0.813	77%	0.773	S	S	*	*			trans	-81.2	171.4	130.4	-62.7	-177.4	147.6	0	0	109.3
61	P	32.6	Very low	28.5	Very low	90 Å²	90	151.6 Å²	151.6	58%	0.584	77%	0.768	S	S	*	*				-152.2	162.4	99	36.8	-18.2	0	0	0	117.8
62	E	26.3	Very low	28.6	Very low	159 Å²	159	156.8 Å²	156.8	74%	0.743	78%	0.778	S	S	*	*			trans	67.2	142.9	145.8	-67.9	152.8	-155.1	0	0	118.9
63	E	29.9	Very low	28.5	Very low	157 Å²	157	149.9 Å²	149.9	73%	0.734	77%	0.773	S	S	*	*			cis	-161.2	170.1	-4.5	-116.5	163.4	-172	0	0	106.6
64	E	26.2	Very low	28.5	Very low	162 Å²	162	150.8 Å²	150.8	76%	0.757	78%	0.779	S	S	*	*			cis	-161.1	143	29.3	-151.6	176.2	-168	0	0	110.4
65	I	27.2	Very low	28.8	Very low	160 Å²	160	146.5 Å²	146.5	82%	0.821	78%	0.78	S	S	*	*			trans	-136.9	126.3	162.4	-64.4	176	0	0	0	106.6	E67	I65-E67 PolarHBondContact O-N 3.18Å
66	M	26.4	Very low	28.6	Very low	164 Å²	164	142.3 Å²	142.3	81%	0.808	78%	0.775	S	S	*	*			trans	-70.5	108.9	165.7	-65.1	-178.3	108.8	0	0	108.4
67	E	26.1	Very low	28.4	Very low	172 Å²	172	145.6 Å²	145.6	80%	0.804	78%	0.776	S	S	*	*				64.6	142.4	84.3	-77.3	-153.9	138.4	0	0	114.1	I65	I65-E67 PolarHBondContact O-N 3.18Å
68	A	26.9	Very low	27	Very low	80 Å²	80	150.9 Å²	150.9	66%	0.661	78%	0.783	S	S	*	*			cis	-164.8	131.1	-12.9	0	0	0	0	0	105.4
69	D	22.8	Very low	27.3	Very low	132 Å²	132	150 Å²	150	71%	0.706	78%	0.782	S	S	*	*				82.2	131.8	71.2	-162.8	29.2	0	0	0	115.1
70	W	23.5	Very low	27.4	Very low	248 Å²	248	147.4 Å²	147.4	94%	0.939	78%	0.781	S	S	*	*			trans	-163.2	132.4	156.2	-86.8	117.4	0	0	0	109.3
71	P	28.8	Very low	27.1	Very low	107 Å²	107	143.5 Å²	143.5	70%	0.695	77%	0.773	S	S	*	*			trans	-108.8	-167.1	-163.1	42.3	-35.9	0	0	0	115.8
72	Q	29.8	Very low	26.8	Very low	194 Å²	194	146 Å²	146	91%	0.907	79%	0.787	S	S	*	*			trans	-73.5	157	-167.9	-57.2	178.7	-6.5	0	0	116.5
73	A	23.6	Very low	26.9	Very low	98 Å²	98	143 Å²	143	81%	0.81	79%	0.789	S	S	*	*			trans	-154.4	143.9	150.1	0	0	0	0	0	114.7
74	S	26.2	Very low	26.7	Very low	119 Å²	119	140.7 Å²	140.7	83%	0.832	79%	0.791	S	S	*	*			trans	-148.4	154.1	152	-76.4	0	0	0	0	106.4
75	P	40.4	Very low	26.7	Very low	133 Å²	133	138.9 Å²	138.9	86%	0.864	80%	0.796	S	S	*	*			cis	-125.2	177.9	1.1	41.2	-27.2	0	0	0	113.2
76	G	23.6	Very low	26.7	Very low	72 Å²	72	134.2 Å²	134.2	74%	0.742	79%	0.787	S	S	*	*			trans	138	108.5	152.5	0	0	0	0	0	119.2
77	R	23.8	Very low	26.8	Very low	222 Å²	222	132.3 Å²	132.3	84%	0.838	79%	0.79	S	S	*	*			trans	28.9	125.2	143.4	-68.2	-176	176.5	-145.7	-2	121.8
78	R	22.6	Very low	26.9	Very low	213 Å²	213	129 Å²	129	80%	0.804	79%	0.786	S	S	*	*			trans	63.8	97.2	133.4	-70.8	-174.8	173.1	177.8	-3.2	119.5
79	S	29.4	Very low	26.9	Very low	102 Å²	102	130 Å²	130	71%	0.713	79%	0.788	S	S	*	*				24.5	144	108.9	65.4	0	0	0	0	120.8
80	V	25.6	Very low	27.1	Very low	137 Å²	137	128 Å²	128	83%	0.83	78%	0.784	S	S	*	*			trans	120.1	133.7	157.9	170.1	0	0	0	0	111.5
81	S	27.4	Very low	27.4	Very low	93 Å²	93	126 Å²	126	65%	0.65	78%	0.778	S	S	*	*			cis	-175	152	-20.4	59.3	0	0	0	0	110.1
82	T	26.8	Very low	27.3	Very low	143 Å²	143	127.4 Å²	127.4	88%	0.877	78%	0.779	S	S	*	*			trans	-130.7	100	148.5	48.7	0	0	0	0	107.7
83	A	27.3	Very low	27.2	Very low	94 Å²	94	129.2 Å²	129.2	78%	0.777	78%	0.778	S	S	*	*				84.1	90.4	71.5	0	0	0	0	0	113.1
84	S	25.4	Very low	27.3	Very low	110 Å²	110	128.5 Å²	128.5	77%	0.769	78%	0.78	S	S	*	*	S	Bend	trans	-123.8	107.5	142.9	58.1	0	0	0	0	107.7
85	S	26.9	Very low	27.3	Very low	123 Å²	123	126.6 Å²	126.6	86%	0.86	78%	0.779	S	S	*	*			trans	32.9	124	159	57.3	0	0	0	0	119.9
86	G	27	Very low	26.7	Very low	62 Å²	62	125.7 Å²	125.7	64%	0.639	78%	0.777	S	S	*	*			cis	162	166.7	1.5	0	0	0	0	0	111.2
87	S	28	Very low	26.9	Very low	124 Å²	124	128.1 Å²	128.1	87%	0.867	78%	0.782	S	S	*	*			trans	57.6	141.6	171.9	53.1	0	0	0	0	118.6
88	S	28.6	Very low	27	Very low	104 Å²	104	121.2 Å²	121.2	73%	0.727	77%	0.773	S	S	*	*			cis	-170	147.4	-10.5	42.3	0	0	0	0	110.3
89	S	28.2	Very low	27.3	Very low	100 Å²	100	119.8 Å²	119.8	70%	0.699	78%	0.775	S	S	*	*			trans	32.9	110.8	150.1	75	0	0	0	0	119.1
90	S	26.8	Very low	27.1	Very low	90 Å²	90	123.2 Å²	123.2	63%	0.629	78%	0.782	S	S	*	*				101.7	147	62.6	66.7	0	0	0	0	114.1
91	Y	28.2	Very low	28.1	Very low	207 Å²	207	121.5 Å²	121.5	81%	0.812	77%	0.773	S	S	*	*			trans	105.9	100.3	158.3	-70.5	-66.2	0	0	0	120.7
92	N	27.8	Very low	28.2	Very low	135 Å²	135	129 Å²	129	72%	0.722	79%	0.787	S	S	*	*				76.8	138	117.4	-113.4	-8.8	0	0	0	123.5
93	R	27.9	Very low	28.3	Very low	232 Å²	232	126.2 Å²	126.2	88%	0.875	79%	0.787	S	S	*	*			trans	59.8	117.2	149.1	-87.8	-178.8	170.4	178.5	-3.3	121
94	G	25.3	Very low	28.2	Very low	83 Å²	83	125.1 Å²	125.1	86%	0.856	79%	0.785	S	S	*	*			trans	-46.5	168.6	159.8	0	0	0	0	0	118
95	G	27.1	Very low	28.4	Very low	79 Å²	79	127.7 Å²	127.7	81%	0.814	79%	0.789	S	S	*	*			trans	171.9	121.9	176.1	0	0	0	0	0	110.6
96	S	26.2	Very low	28.3	Very low	115 Å²	115	132 Å²	132	80%	0.804	79%	0.788	S	S	*	*			trans	-63.4	170.1	176	-49.2	0	0	0	0	113.8
97	S	27.7	Very low	29.1	Very low	122 Å²	122	134.6 Å²	134.6	85%	0.853	79%	0.794	S	S	*	*			trans	72.6	159.4	164	84.4	0	0	0	0	115.4
98	A	26.6	Very low	29.1	Very low	78 Å²	78	134.3 Å²	134.3	65%	0.645	79%	0.787	S	S	*	*			cis	-168.4	166.9	-29.5	0	0	0	0	0	107.9
99	Q	28.2	Very low	29.3	Very low	182 Å²	182	135.3 Å²	135.3	85%	0.85	79%	0.791	S	S	*	*			trans	62.5	109.7	160	-69.7	163.7	-35.2	0	0	119.8
100	M	26.1	Very low	29.4	Very low	175 Å²	175	136.5 Å²	136.5	86%	0.862	79%	0.794	S	S	*	*				17.5	157.6	104.9	-74.3	-71	-176.1	0	0	119.4
101	P	47	Very low	29.8	Very low	100 Å²	100	138.1 Å²	138.1	65%	0.649	80%	0.802	S	S	*	*			cis	-146.4	-174.9	-13.5	37.1	-15.6	0	0	0	116.9
102	R	29.3	Very low	30.1	Very low	251 Å²	251	134.2 Å²	134.2	95%	0.947	80%	0.8	S	S	*	*			trans	78.4	137.5	138.7	-94.5	176.8	175.7	-176.6	-1.6	122.9
103	G	28.3	Very low	30.2	Very low	85 Å²	85	134.8 Å²	134.8	88%	0.876	80%	0.802	S	S	*	*			trans	113.5	122.9	157.6	0	0	0	0	0	113.7
104	G	26.1	Very low	30.4	Very low	70 Å²	70	129.9 Å²	129.9	72%	0.722	79%	0.793	S	S	*	*			cis	142.4	137	-4.5	0	0	0	0	0	112.1
105	L	29.1	Very low	30.8	Very low	165 Å²	165	130.9 Å²	130.9	86%	0.864	79%	0.794	S	S	*	*			trans	90.3	98.9	168.3	-58.1	147.6	0	0	0	119.4
106	Y	25.7	Very low	31.1	Very low	213 Å²	213	137.4 Å²	137.4	84%	0.835	79%	0.794	S	S	*	*				25.8	158.9	126.4	-66	-72.4	0	0	0	123
107	P	41.8	Very low	31.4	Very low	117 Å²	117	140.2 Å²	140.2	76%	0.76	79%	0.794	S	S	*	*			cis	-134.7	177.7	17.5	30.5	-6.3	0	0	0	119.2
108	T	28.3	Very low	31.6	Very low	117 Å²	117	141.4 Å²	141.4	72%	0.718	79%	0.786	S	S	*	*			trans	-40.1	161.1	169.2	35.3	0	0	0	0	118.7
109	P	34.6	Very low	32	Very low	126 Å²	126	142.8 Å²	142.8	82%	0.818	78%	0.783	S	S	*	*			cis	-139.2	174	45.6	38.8	-18.4	0	0	0	119.4
110	T	29.6	Very low	32.4	Very low	124 Å²	124	144.6 Å²	144.6	76%	0.761	78%	0.782	S	S	*	*			trans	-82.8	163.3	-178.3	52.9	0	0	0	0	112.5
111	P	35.4	Very low	32.7	Very low	124 Å²	124	146.3 Å²	146.3	81%	0.805	78%	0.779	S	S	*	*				-132.2	176.2	85.9	15.5	7	0	0	0	115
112	T	33.3	Very low	32.4	Very low	126 Å²	126	147.4 Å²	147.4	77%	0.773	78%	0.775	S	S	*	*			trans	-68.8	151.2	-175.1	45.1	0	0	0	0	115.4
113	I	31.4	Very low	32.9	Very low	146 Å²	146	141.8 Å²	141.8	75%	0.749	76%	0.759	S	S	*	*				164.1	115.1	129.7	-84.2	154.6	0	0	0	110.4
114	N	31.6	Very low	33.6	Very low	129 Å²	129	147.3 Å²	147.3	69%	0.69	75%	0.753	S	S	*	*			trans	157.4	79.6	135.7	-88.2	-48.3	0	0	0	113.9	R116	N114-R116 PolarHBondContact O-N 3.08Å
115	A	32.4	Very low	34.4	Very low	105 Å²	105	146.9 Å²	146.9	87%	0.868	74%	0.74	S	S	*	*			trans	-77.4	40.5	168.4	0	0	0	0	0	113.2
116	R	34.4	Very low	35.1	Very low	216 Å²	216	141.9 Å²	141.9	82%	0.815	72%	0.718	S	S	*	*			trans	-111.1	0.6	-169.6	-104.3	-178.5	176.4	176.1	-0.2	116.2	N114	N114-R116 PolarHBondContact O-N 3.08Å
117	Q	31.9	Very low	36.1	Very low	174 Å²	174	136.8 Å²	136.8	81%	0.813	70%	0.704	S	S	*	*	S	Bend	trans	-114.8	-14	-173.3	-133	163.4	-8.7	0	0	114.9
118	Q	32	Very low	36.5	Very low	146 Å²	146	138.3 Å²	138.3	68%	0.682	70%	0.699	S	S	*	*	S	Bend	trans	-72.7	-48.2	174.3	-152.9	86.3	-10.4	0	0	111.3	R120 R121	Q118-R120 VanDerWaalsContact C-N 3.32Å; Q118-R120 PolarHBondContact O-N 3.02Å; Q118-R121 PolarHBondContact O-N 3.26Å
119	D	36.2	Very low	37.4	Very low	108 Å²	108	138.4 Å²	138.4	58%	0.578	69%	0.691	S	S	*	*	H	α-helix	trans	-59	-36.7	-168.2	-146.3	-2.9	0	0	0	113.6	R121 E122 H123	D119-R121 VanDerWaalsContact C-N 3.28Å; D119-R121 PolarHBondContact O-N 3.39Å; D119-E122 PolarHBondContact O-N 3.04Å; D119-H123 PolarHBondContact O-N 3.2Å
120	R	34.9	Very low	38.2	Very low	220 Å²	220	136.4 Å²	136.4	83%	0.83	67%	0.673	S	S	*	*	H	α-helix	trans	-69.4	-16.8	179.4	-102.9	-175.3	174.4	-170.7	-0.8	114.8	Q118	Q118-R120 VanDerWaalsContact C-N 3.32Å; Q118-R120 PolarHBondContact O-N 3.02Å
121	R	33.3	Very low	39.1	Very low	211 Å²	211	134.7 Å²	134.7	80%	0.796	66%	0.658	S	S	*	*	H	α-helix	trans	-92.7	-37.7	176.6	-75.9	-175.7	174	-179.1	-0.2	112	Q118 D119 R124 S125	Q118-R121 PolarHBondContact O-N 3.26Å; D119-R121 VanDerWaalsContact C-N 3.28Å; D119-R121 PolarHBondContact O-N 3.39Å; R121-R124 PolarHBondContact O-N 2.9Å; R121-S125 PolarHBondContact O-N 2.98Å
122	E	39.9	Very low	39.8	Very low	122 Å²	122	134.9 Å²	134.9	57%	0.57	65%	0.649	S	S	*	*	H	α-helix	trans	-69.1	-40.8	179.4	-66.6	-172	176.7	0	0	112.3	D119 R124 S125 C126	D119-E122 PolarHBondContact O-N 3.04Å; E122-R124 VanDerWaalsContact C-N 3.28Å; E122-R124 PolarHBondContact O-N 3.31Å; E122-S125 WeakPolarHBondContact O-CA 3.23Å; E122-S125 WeakPolarHBondContact O-CB 3.41Å; E122-S125 PolarHBondContact O-N 3.47Å; E122-C126 PolarHBondContact O-N 3.01Å
123	H	40.6	Very low	40.4	Very low	134 Å²	134	136.5 Å²	136.5	62%	0.62	65%	0.645	S	S	*	*	H	α-helix	trans	-57.5	-36.1	175.1	-106.8	19.5	0	0	0	113.8	D119 S125 L127	D119-H123 PolarHBondContact O-N 3.2Å; H123-S125 VanDerWaalsContact C-N 3.32Å; H123-S125 PolarHBondContact O-N 3.11Å; H123-L127 WeakPolarHBondContact O-CB 3.44Å; H123-L127 PolarHBondContact O-N 3.25Å
124	R	43	Very low	41.4	Very low	200 Å²	200	132.1 Å²	132.1	76%	0.755	62%	0.623	S	S	*	*	H	α-helix	trans	-71.5	-24.1	174.6	-80.7	-174.2	171.1	-171.4	-2.1	113.4	R121 E122 K128	R121-R124 PolarHBondContact O-N 2.9Å; E122-R124 VanDerWaalsContact C-N 3.28Å; E122-R124 PolarHBondContact O-N 3.31Å; R124-K128 WeakPolarHBondContact O-CG 3.4Å
125	S	42.7	Very low	42.1	Very low	62 Å²	62	131.5 Å²	131.5	43%	0.434	61%	0.61	S	S	.	*	H	α-helix	trans	-81.6	-43.8	174.3	-161.9	0	0	0	0	111.1	R121 E122 H123 K128 Q129	R121-S125 PolarHBondContact O-N 2.98Å; E122-S125 WeakPolarHBondContact O-CA 3.23Å; E122-S125 WeakPolarHBondContact O-CB 3.41Å; E122-S125 PolarHBondContact O-N 3.47Å; H123-S125 VanDerWaalsContact C-N 3.32Å; H123-S125 PolarHBondContact O-N 3.11Å; S125-K128 WeakPolarHBondContact O-CB 3.44Å; S125-K128 PolarHBondContact O-N 3.42Å; S125-K128 VanDerWaalsContact O-N 3.14Å; S125-Q129 PolarHBondContact O-N 3.41Å
126	C	44.3	Very low	42.9	Very low	60 Å²	60	133.4 Å²	133.4	41%	0.405	61%	0.605	S	S	.	*	H	α-helix	trans	-60.6	-47.1	176.6	-170.7	0	0	0	0	111.7	E122 K128 Q129 I130	E122-C126 PolarHBondContact O-N 3.01Å; C126-K128 VanDerWaalsContact C-N 3.29Å; C126-K128 PolarHBondContact O-N 3.25Å; C126-Q129 PolarHBondContact O-N 2.93Å; C126-Q129 VanDerWaalsContact O-N 3.17Å; C126-I130 WeakPolarHBondContact O-CB 3.39Å; C126-I130 VanDerWaalsContact O-CG1 3.31Å; C126-I130 WeakPolarHBondContact O-CG1 3.41Å; C126-I130 PolarHBondContact O-N 3.44Å
127	L	45.4	Very low	43.4	Very low	105 Å²	105	128.4 Å²	128.4	55%	0.55	59%	0.593	S	S	.	*	H	α-helix	trans	-57.7	-39.2	173.2	-91.6	162.7	0	0	0	112.8	H123 L131	H123-L127 WeakPolarHBondContact O-CB 3.44Å; H123-L127 PolarHBondContact O-N 3.25Å; L127-L131 VanDerWaalsContact O-CB 3.29Å; L127-L131 WeakPolarHBondContact O-CB 3.34Å; L127-L131 WeakPolarHBondContact O-CD1 3.18Å; L127-L131 VanDerWaalsContact O-CG 3.3Å; L127-L131 WeakPolarHBondContact O-CG 3.47Å; L127-L131 PolarHBondContact O-N 3.35Å
128	K	50.7	Low	44.3	Very low	149 Å²	149	122.8 Å²	122.8	65%	0.648	57%	0.565	S	S	*	*	H	α-helix	trans	-67.6	-40.3	175.7	-79.2	-177.2	173.9	-167	0	112.9	R124 S125 C126 L131 Q132	R124-K128 WeakPolarHBondContact O-CG 3.4Å; S125-K128 WeakPolarHBondContact O-CB 3.44Å; S125-K128 PolarHBondContact O-N 3.42Å; S125-K128 VanDerWaalsContact O-N 3.14Å; C126-K128 VanDerWaalsContact C-N 3.29Å; C126-K128 PolarHBondContact O-N 3.25Å; K128-L131 PolarHBondContact O-N 3.42Å; K128-Q132 WeakPolarHBondContact O-CB 3.48Å; K128-Q132 PolarHBondContact O-N 2.8Å
129	Q	47	Very low	45.1	Very low	119 Å²	119	116.8 Å²	116.8	56%	0.556	54%	0.542	S	S	*	.	H	α-helix	trans	-70.1	-35.2	176.6	-72.1	-179.5	-9.9	0	0	112.5	S125 C126 Q132 K133	S125-Q129 PolarHBondContact O-N 3.41Å; C126-Q129 PolarHBondContact O-N 2.93Å; C126-Q129 VanDerWaalsContact O-N 3.17Å; Q129-Q132 PolarHBondContact O-N 3.39Å; Q129-K133 WeakPolarHBondContact O-CG 3.48Å; Q129-K133 PolarHBondContact O-N 2.86Å
130	I	52.9	Low	45.9	Very low	85 Å²	85	111.9 Å²	111.9	44%	0.436	52%	0.516	S	S	.	.	H	α-helix	trans	-66.6	-47.6	171.8	-69.6	168	0	0	0	109.8	C126 Q132 K133 I134	C126-I130 WeakPolarHBondContact O-CB 3.39Å; C126-I130 VanDerWaalsContact O-CG1 3.31Å; C126-I130 WeakPolarHBondContact O-CG1 3.41Å; C126-I130 PolarHBondContact O-N 3.44Å; I130-Q132 VanDerWaalsContact C-N 3.33Å; I130-Q132 PolarHBondContact O-N 3.23Å; I130-K133 PolarHBondContact O-N 3.44Å; I130-K133 VanDerWaalsContact O-N 3.15Å; I130-I134 HydrophobicContact CG2-CD1 3.69Å; I130-I134 HydrophobicContact CG2-CG1 4.36Å; I130-I134 WeakPolarHBondContact O-CB 3.29Å; I130-I134 VanDerWaalsContact O-CG1 3.29Å; I130-I134 WeakPolarHBondContact O-CG1 3.47Å; I130-I134 PolarHBondContact O-N 2.91Å
131	L	47.5	Very low	46.6	Very low	87 Å²	87	105.7 Å²	105.7	46%	0.455	50%	0.497	S	S	.	.	H	α-helix	trans	-59.2	-39	173.7	-80	161.8	0	0	0	112.7	L127 K128 I134 R135 L429	L127-L131 VanDerWaalsContact O-CB 3.29Å; L127-L131 WeakPolarHBondContact O-CB 3.34Å; L127-L131 WeakPolarHBondContact O-CD1 3.18Å; L127-L131 VanDerWaalsContact O-CG 3.3Å; L127-L131 WeakPolarHBondContact O-CG 3.47Å; L127-L131 PolarHBondContact O-N 3.35Å; K128-L131 PolarHBondContact O-N 3.42Å; L131-I134 PolarHBondContact O-N 3.24Å; L131-R135 WeakPolarHBondContact O-CB 3.32Å; L131-R135 PolarHBondContact O-N 3.2Å; L131-L429 HydrophobicContact CD2-CD2 4.04Å
132	Q	49.8	Very low	47.4	Very low	128 Å²	128	98.8 Å²	98.8	60%	0.598	48%	0.475	S	S	*	.	H	α-helix	trans	-65.8	-40.4	173.5	-89.7	179	-55.6	0	0	112.7	K128 Q129 I130 R135 I136	K128-Q132 WeakPolarHBondContact O-CB 3.48Å; K128-Q132 PolarHBondContact O-N 2.8Å; Q129-Q132 PolarHBondContact O-N 3.39Å; I130-Q132 VanDerWaalsContact C-N 3.33Å; I130-Q132 PolarHBondContact O-N 3.23Å; Q132-R135 PolarHBondContact O-N 2.96Å; Q132-I136 WeakPolarHBondContact O-CG1 3.45Å; Q132-I136 PolarHBondContact O-N 3.42Å
133	K	46.7	Very low	47.8	Very low	161 Å²	161	93.7 Å²	93.7	70%	0.7	45%	0.451	S	S	*	.	H	α-helix	trans	-69.9	-35.1	175.5	-76.5	-177.6	176.5	179.8	0	112.5	Q129 I130 I136 L137	Q129-K133 WeakPolarHBondContact O-CG 3.48Å; Q129-K133 PolarHBondContact O-N 2.86Å; I130-K133 PolarHBondContact O-N 3.44Å; I130-K133 VanDerWaalsContact O-N 3.15Å; K133-I136 PolarHBondContact O-N 3.07Å; K133-L137 PolarHBondContact O-N 2.82Å
134	I	52.6	Low	48.4	Very low	54 Å²	54	91.7 Å²	91.7	28%	0.277	44%	0.442	S	S	.	.	H	α-helix	trans	-63.5	-49.3	171.5	-70.4	169.1	0	0	0	109.4	I130 L131 I136 L137 W138 L429	I130-I134 HydrophobicContact CG2-CD1 3.69Å; I130-I134 HydrophobicContact CG2-CG1 4.36Å; I130-I134 WeakPolarHBondContact O-CB 3.29Å; I130-I134 VanDerWaalsContact O-CG1 3.29Å; I130-I134 WeakPolarHBondContact O-CG1 3.47Å; I130-I134 PolarHBondContact O-N 2.91Å; L131-I134 PolarHBondContact O-N 3.24Å; I134-I136 PolarHBondContact O-N 3.49Å; I134-I136 VanDerWaalsContact O-N 3.1Å; I134-L137 PolarHBondContact O-N 2.96Å; I134-W138 HydrophobicContact CG2-CB 4.17Å; I134-W138 HydrophobicContact CG2-CG 3.98Å; I134-W138 WeakPolarHBondContact O-CB 3.42Å; I134-W138 PolarHBondContact O-N 3.18Å; I134-L429 HydrophobicContact CG2-CD1 4.02Å
135	R	46.4	Very low	48.3	Very low	115 Å²	115	88.2 Å²	88.2	43%	0.434	44%	0.438	S	S	.	.	H	α-helix	trans	-56.7	-28.5	178.6	-169.1	171.9	-178	-166.6	-6.4	113.9	L131 Q132 G139 M143 D145	L131-R135 WeakPolarHBondContact O-CB 3.32Å; L131-R135 PolarHBondContact O-N 3.2Å; Q132-R135 PolarHBondContact O-N 2.96Å; R135-G139 PolarHBondContact O-N 3.19Å; R135-M143 HydrophobicContact CG-CE 4.2Å; R135-M143 PolarHBondContact NE-O 3.21Å; R135-M143 PolarHBondContact NH2-O 3.08Å; R135-D145 IonicContact NH2-OD2 3.53Å; R135-D145 PolarHBondContact NH2-OD2 3.33Å
136	I	48.3	Very low	48.4	Very low	146 Å²	146	90.9 Å²	90.9	75%	0.749	46%	0.457	S	S	*	.	H	α-helix	trans	-78.3	-28	176.1	-66.9	164.9	0	0	0	112.6	Q132 K133 I134	Q132-I136 WeakPolarHBondContact O-CG1 3.45Å; Q132-I136 PolarHBondContact O-N 3.42Å; K133-I136 PolarHBondContact O-N 3.07Å; I134-I136 PolarHBondContact O-N 3.49Å; I134-I136 VanDerWaalsContact O-N 3.1Å
137	L	46	Very low	48.4	Very low	110 Å²	110	95.4 Å²	95.4	58%	0.576	48%	0.477	S	S	*	.	H	α-helix	trans	-96.7	-24.2	-178.4	-173.1	72.2	0	0	0	112.6	K133 I134 R159	K133-L137 PolarHBondContact O-N 2.82Å; I134-L137 PolarHBondContact O-N 2.96Å; L137-R159 PolarHBondContact O-NH1 2.84Å; L137-R159 PolarHBondContact O-NH2 2.85Å
138	W	50	Low	48.5	Very low	57 Å²	57	92 Å²	92	22%	0.216	46%	0.462	C	S	.	.	S	Bend	trans	-121	25.8	-173.1	-63.2	73.2	0	0	0	113.2	I134 T140 Y422 V425	I134-W138 HydrophobicContact CG2-CB 4.17Å; I134-W138 HydrophobicContact CG2-CG 3.98Å; I134-W138 WeakPolarHBondContact O-CB 3.42Å; I134-W138 PolarHBondContact O-N 3.18Å; W138-T140 PolarHBondContact O-N 2.98Å; W138-Y422 HydrophobicContact CD2-CE2 4.35Å; W138-Y422 AromaticContact CE3-CD2 3.94Å; W138-Y422 HydrophobicContact CE3-CD2 3.94Å; W138-Y422 AromaticContact CE3-CE2 3.63Å; W138-Y422 HydrophobicContact CE3-CE2 3.63Å; W138-Y422 AromaticContact CH2-CD2 3.37Å; W138-Y422 HydrophobicContact CH2-CD2 3.37Å; W138-Y422 AromaticContact CH2-CE2 3.92Å; W138-Y422 HydrophobicContact CH2-CE2 3.92Å; W138-Y422 HydrophobicContact CH2-CG 4.14Å; W138-Y422 HydrophobicContact CZ2-CD2 4.23Å; W138-Y422 AromaticContact CZ3-CD2 3.19Å; W138-Y422 HydrophobicContact CZ3-CD2 3.19Å; W138-Y422 AromaticContact CZ3-CE2 3.39Å; W138-Y422 HydrophobicContact CZ3-CE2 3.39Å; W138-Y422 AromaticContact CZ3-CG 3.88Å; W138-Y422 HydrophobicContact CZ3-CG 3.88Å; W138-Y422 WeakPolarHBondContact CZ3-O 3.44Å; W138-V425 HydrophobicContact CE3-CG1 4.3Å; W138-V425 HydrophobicContact CH2-CB 4.22Å; W138-V425 HydrophobicContact CH2-CG1 4.16Å; W138-V425 HydrophobicContact CZ3-CB 4.02Å; W138-V425 HydrophobicContact CZ3-CG1 3.96Å
139	G	49	Very low	49	Very low	19 Å²	19	87.7 Å²	87.7	20%	0.196	45%	0.451	C	S	.	.			trans	-69.1	110.2	175.6	0	0	0	0	0	111.7	R135	R135-G139 PolarHBondContact O-N 3.19Å
140	T	53.3	Low	49.9	Very low	5 Å²	5	88.1 Å²	88.1	3%	0.031	45%	0.448	C	S	.	.			trans	-89.5	169.8	168.2	60.3	0	0	0	0	111.1	W138 L142 M143 E160 E426 E430	W138-T140 PolarHBondContact O-N 2.98Å; T140-L142 PolarHBondContact O-N 2.97Å; T140-L142 VanDerWaalsContact O-N 3.11Å; T140-M143 PolarHBondContact O-N 3.35Å; T140-M143 WeakPolarHBondContact OG1-CG 3.49Å; T140-E160 WeakPolarHBondContact CA-OE1 3.42Å; T140-E426 HydrophobicContact CG2-CG 3.69Å; T140-E426 VanDerWaalsContact CG2-OE1 3.26Å; T140-E426 WeakPolarHBondContact CG2-OE1 3.13Å; T140-E430 VanDerWaalsContact CB-OE1 3.26Å; T140-E430 WeakPolarHBondContact CB-OE1 3.47Å; T140-E430 PolarHBondContact OG1-OE1 2.95Å
141	E	49.9	Very low	50.7	Low	91 Å²	91	91.5 Å²	91.5	43%	0.425	46%	0.462	S	S	.	.	G	3₁₀ helix	trans	-45.3	-39.1	172.9	176.9	171.9	-152.1	0	0	113.6	M143 Y153 E160	E141-M143 PolarHBondContact O-N 3.19Å; E141-Y153 HydrophobicContact CG-CE2 3.88Å; E141-Y153 WeakPolarHBondContact OE1-CE2 3.48Å; E141-Y153 VanDerWaalsContact OE1-CZ 3.28Å; E141-Y153 PolarHBondContact OE1-OH 3.38Å; E141-E160 PolarHBondContact N-OE1 2.91Å
142	L	49.5	Very low	51.7	Low	65 Å²	65	92.8 Å²	92.8	34%	0.34	46%	0.46	S	S	.	.	G	3₁₀ helix	trans	-83.5	-4.3	-175.9	-76.3	164	0	0	0	114.4	T140 E430 H434 Y438	T140-L142 PolarHBondContact O-N 2.97Å; T140-L142 VanDerWaalsContact O-N 3.11Å; L142-E430 HydrophobicContact CB-CG 4.48Å; L142-E430 WeakPolarHBondContact CD1-OE2 3.17Å; L142-H434 PolarHBondContact O-NE2 2.85Å; L142-Y438 HydrophobicContact CD1-CE2 4.14Å
143	M	48.9	Very low	52.7	Low	15 Å²	15	91.8 Å²	91.8	7%	0.074	45%	0.452	C	S	.	.	G	3₁₀ helix	trans	-105.4	-1.1	-174.7	-68.9	-170.8	86.9	0	0	115.4	R135 T140 E141 L429 I433	R135-M143 HydrophobicContact CG-CE 4.2Å; R135-M143 PolarHBondContact NE-O 3.21Å; R135-M143 PolarHBondContact NH2-O 3.08Å; T140-M143 PolarHBondContact O-N 3.35Å; T140-M143 WeakPolarHBondContact OG1-CG 3.49Å; E141-M143 PolarHBondContact O-N 3.19Å; M143-L429 HydrophobicContact CE-CB 4.2Å; M143-L429 HydrophobicContact CE-CD1 4.47Å; M143-I433 HydrophobicContact CE-CD1 3.61Å; M143-I433 HydrophobicContact CG-CD1 4.03Å
144	E	51.7	Low	53.9	Low	93 Å²	93	85.6 Å²	85.6	44%	0.435	43%	0.426	S	S	.	.	S	Bend	trans	-115.6	136	-169.7	-138.4	170	174.4	0	0	113.2	N156	E144-N156 PolarHBondContact OE2-ND2 3.46Å
145	D	42.7	Very low	55	Low	126 Å²	126	91.1 Å²	91.1	67%	0.674	44%	0.444	S	S	*	.			trans	-77.9	150.4	-177.5	-65.6	-71	0	0	0	111.9	R135 D147	R135-D145 IonicContact NH2-OD2 3.53Å; R135-D145 PolarHBondContact NH2-OD2 3.33Å; D145-D147 VanDerWaalsContact C-N 3.31Å; D145-D147 PolarHBondContact O-N 3.37Å
146	S	44.7	Very low	56.6	Low	118 Å²	118	86.5 Å²	86.5	83%	0.825	43%	0.428	S	S	*	.	S	Bend	trans	-64.9	-3.8	-150.7	65.9	0	0	0	0	120.2
147	D	43.9	Very low	58.1	Low	155 Å²	155	79.9 Å²	79.9	83%	0.829	39%	0.394	S	S	*	.			trans	-113.3	29	-161.4	-76.9	-0.9	0	0	0	114.7	D145	D145-D147 VanDerWaalsContact C-N 3.31Å; D145-D147 PolarHBondContact O-N 3.37Å
148	S	47.1	Very low	59.8	Low	33 Å²	33	78.3 Å²	78.3	23%	0.231	39%	0.386	C	S	.	.	S	Bend	trans	-124.8	93.2	-173.1	140.7	0	0	0	0	113.9	R152	S148-R152 WeakPolarHBondContact OG-CD 3.39Å; S148-R152 PolarHBondContact OG-NE 2.85Å; S148-R152 PolarHBondContact OG-NH1 2.97Å
149	S	60.2	Low	61.5	Low	60 Å²	60	80.7 Å²	80.7	42%	0.42	40%	0.395	S	S	.	.			trans	35.3	113.6	157.7	55.8	0	0	0	0	118.3	E151 R152	S149-E151 PolarHBondContact O-N 3.08Å; S149-R152 PolarHBondContact O-N 2.97Å; S149-R152 PolarHBondContact OG-NE 3.15Å
150	R	66.9	Low	63.3	Low	127 Å²	127	81.2 Å²	81.2	48%	0.479	39%	0.392	S	S	.	.	H	α-helix	trans	-43	-35.8	174.4	-78.1	167.6	76	131.7	-3.3	114.2	R152 Y153 L154 E634	R150-R152 VanDerWaalsContact C-N 3.34Å; R150-R152 PolarHBondContact O-N 3.2Å; R150-Y153 WeakPolarHBondContact O-CB 3.33Å; R150-Y153 PolarHBondContact O-N 3.36Å; R150-L154 WeakPolarHBondContact O-CD1 3.48Å; R150-L154 PolarHBondContact O-N 3.42Å; R150-E634 IonicContact CZ-OE1 2.86Å; R150-E634 IonicContact NH1-OE1 2.91Å; R150-E634 PolarHBondContact NH1-OE1 2.95Å; R150-E634 IonicContact NH2-OE1 4Å
151	E	69.8	Low	64.8	Low	156 Å²	156	84.3 Å²	84.3	73%	0.729	41%	0.407	S	S	*	.	H	α-helix	trans	-61.1	-33.6	176.2	-61.6	-169.1	160.4	0	0	114.5	S149 R155	S149-E151 PolarHBondContact O-N 3.08Å; E151-R155 WeakPolarHBondContact O-CB 3.2Å; E151-R155 PolarHBondContact O-N 3.29Å; E151-R155 VanDerWaalsContact O-N 3.15Å
152	R	67.6	Low	66.7	Low	114 Å²	114	85.3 Å²	85.3	43%	0.43	42%	0.415	S	S	.	.	H	α-helix	trans	-70.8	-44.9	174.6	-81.7	-174.6	-114.5	178.8	-5	111.6	S148 S149 R150 L154 R155 N156	S148-R152 WeakPolarHBondContact OG-CD 3.39Å; S148-R152 PolarHBondContact OG-NE 2.85Å; S148-R152 PolarHBondContact OG-NH1 2.97Å; S149-R152 PolarHBondContact O-N 2.97Å; S149-R152 PolarHBondContact OG-NE 3.15Å; R150-R152 VanDerWaalsContact C-N 3.34Å; R150-R152 PolarHBondContact O-N 3.2Å; R152-L154 PolarHBondContact O-N 2.93Å; R152-R155 WeakPolarHBondContact O-CB 3.44Å; R152-R155 PolarHBondContact O-N 2.97Å; R152-N156 PolarHBondContact O-N 3.37Å; R152-N156 PolarHBondContact O-OD1 2.75Å
153	Y	71.1	Confident	68.6	Low	107 Å²	107	84.1 Å²	84.1	42%	0.42	41%	0.41	S	S	.	.	H	α-helix	trans	-53.2	-54.7	174.1	178.7	-93	0	0	0	111.1	E141 R150 R155 N156 V157	E141-Y153 HydrophobicContact CG-CE2 3.88Å; E141-Y153 WeakPolarHBondContact OE1-CE2 3.48Å; E141-Y153 VanDerWaalsContact OE1-CZ 3.28Å; E141-Y153 PolarHBondContact OE1-OH 3.38Å; R150-Y153 WeakPolarHBondContact O-CB 3.33Å; R150-Y153 PolarHBondContact O-N 3.36Å; Y153-R155 PolarHBondContact O-N 2.95Å; Y153-N156 PolarHBondContact O-N 2.73Å; Y153-V157 HydrophobicContact CD1-CG2 4.33Å; Y153-V157 HydrophobicContact CE1-CG2 3.98Å; Y153-V157 HydrophobicContact CE2-CG2 4.27Å; Y153-V157 WeakPolarHBondContact O-CB 3.49Å; Y153-V157 WeakPolarHBondContact O-CG2 3.33Å; Y153-V157 PolarHBondContact O-N 3.37Å
154	L	71.4	Confident	70.7	Confident	32 Å²	32	83.5 Å²	83.5	17%	0.168	41%	0.407	C	S	.	.	H	α-helix	trans	-55.4	-38.5	175.9	-89.1	83.4	0	0	0	112.4	R150 R152 L158 M637 L640	R150-L154 WeakPolarHBondContact O-CD1 3.48Å; R150-L154 PolarHBondContact O-N 3.42Å; R152-L154 PolarHBondContact O-N 2.93Å; L154-L158 WeakPolarHBondContact O-CB 3.36Å; L154-L158 PolarHBondContact O-N 2.92Å; L154-M637 HydrophobicContact CD2-CG 3.81Å; L154-M637 HydrophobicContact CD2-SD 4.27Å; L154-M637 HydrophobicContact CG-CE 4.22Å; L154-M637 HydrophobicContact CG-CG 4.24Å; L154-M637 HydrophobicContact CG-SD 4.03Å; L154-L640 HydrophobicContact CD1-CD1 4.43Å; L154-L640 HydrophobicContact CD2-CB 3.97Å; L154-L640 HydrophobicContact CD2-CD1 4.11Å
155	R	76.9	Confident	72.7	Confident	169 Å²	169	81.5 Å²	81.5	64%	0.638	40%	0.401	S	S	*	.	H	α-helix	trans	-72	-38.4	-178.8	-167.5	-172.6	70.5	178.9	2.1	112.7	E151 R152 Y153 R159	E151-R155 WeakPolarHBondContact O-CB 3.2Å; E151-R155 PolarHBondContact O-N 3.29Å; E151-R155 VanDerWaalsContact O-N 3.15Å; R152-R155 WeakPolarHBondContact O-CB 3.44Å; R152-R155 PolarHBondContact O-N 2.97Å; Y153-R155 PolarHBondContact O-N 2.95Å; R155-R159 WeakPolarHBondContact O-CB 3.41Å; R155-R159 PolarHBondContact O-N 3.22Å
156	N	79.6	Confident	75.1	Confident	19 Å²	19	76.8 Å²	76.8	10%	0.102	38%	0.382	C	S	.	.	H	α-helix	trans	-66.9	-49.7	176.9	-65.2	-3.1	0	0	0	109.4	E144 R152 Y153 L158 R159 E160	E144-N156 PolarHBondContact OE2-ND2 3.46Å; R152-N156 PolarHBondContact O-N 3.37Å; R152-N156 PolarHBondContact O-OD1 2.75Å; Y153-N156 PolarHBondContact O-N 2.73Å; N156-L158 PolarHBondContact O-N 3.4Å; N156-R159 WeakPolarHBondContact O-CA 3.4Å; N156-R159 WeakPolarHBondContact O-CB 3.38Å; N156-R159 PolarHBondContact O-N 2.92Å; N156-E160 WeakPolarHBondContact O-CG 3.37Å; N156-E160 PolarHBondContact O-N 3.4Å
157	V	80.8	Confident	77.5	Confident	6 Å²	6	71.2 Å²	71.2	4%	0.036	34%	0.343	C	S	.	.	H	α-helix	trans	-58.8	-42.7	176.6	171.8	0	0	0	0	112.6	Y153 R159 E160 M161 F516	Y153-V157 HydrophobicContact CD1-CG2 4.33Å; Y153-V157 HydrophobicContact CE1-CG2 3.98Å; Y153-V157 HydrophobicContact CE2-CG2 4.27Å; Y153-V157 WeakPolarHBondContact O-CB 3.49Å; Y153-V157 WeakPolarHBondContact O-CG2 3.33Å; Y153-V157 PolarHBondContact O-N 3.37Å; V157-R159 VanDerWaalsContact C-N 3.33Å; V157-R159 PolarHBondContact O-N 3Å; V157-E160 PolarHBondContact O-N 3.08Å; V157-M161 WeakPolarHBondContact O-CB 3.42Å; V157-M161 PolarHBondContact O-N 3.1Å; V157-F516 HydrophobicContact CG1-CE1 3.56Å; V157-F516 HydrophobicContact CG1-CE2 4.16Å; V157-F516 HydrophobicContact CG1-CZ 3.18Å
158	L	81.1	Confident	79.9	Confident	78 Å²	78	64.4 Å²	64.4	41%	0.408	31%	0.307	S	S	.	.	H	α-helix	trans	-68.5	-32.3	176.6	-172.7	147.6	0	0	0	112.2	L154 N156 L162	L154-L158 WeakPolarHBondContact O-CB 3.36Å; L154-L158 PolarHBondContact O-N 2.92Å; N156-L158 PolarHBondContact O-N 3.4Å; L158-L162 HydrophobicContact CD2-CD1 3.64Å; L158-L162 HydrophobicContact CD2-CG 4.24Å; L158-L162 WeakPolarHBondContact O-CB 3.41Å; L158-L162 VanDerWaalsContact O-CG 3.32Å; L158-L162 WeakPolarHBondContact O-CG 3.4Å; L158-L162 PolarHBondContact O-N 2.65Å
159	R	84.8	Confident	82.1	Confident	106 Å²	106	67.7 Å²	67.7	40%	0.4	32%	0.321	S	S	.	.	H	α-helix	trans	-65.9	-46.6	172	177.1	-173.7	174.6	-163.3	-2.4	111.1	L137 R155 N156 V157 M161 L162 T163	L137-R159 PolarHBondContact O-NH1 2.84Å; L137-R159 PolarHBondContact O-NH2 2.85Å; R155-R159 WeakPolarHBondContact O-CB 3.41Å; R155-R159 PolarHBondContact O-N 3.22Å; N156-R159 WeakPolarHBondContact O-CA 3.4Å; N156-R159 WeakPolarHBondContact O-CB 3.38Å; N156-R159 PolarHBondContact O-N 2.92Å; V157-R159 VanDerWaalsContact C-N 3.33Å; V157-R159 PolarHBondContact O-N 3Å; R159-M161 VanDerWaalsContact C-N 3.35Å; R159-L162 PolarHBondContact O-N 2.8Å; R159-T163 PolarHBondContact O-N 3.49Å; R159-T163 PolarHBondContact O-OG1 3.4Å
160	E	86.5	Confident	83.7	Confident	30 Å²	30	65.8 Å²	65.8	14%	0.14	31%	0.306	C	S	.	.	H	α-helix	trans	-60.7	-42.1	176.2	-69.9	167.7	-159.6	0	0	111.7	T140 E141 N156 V157 T163 Y164 F513	T140-E160 WeakPolarHBondContact CA-OE1 3.42Å; E141-E160 PolarHBondContact N-OE1 2.91Å; N156-E160 WeakPolarHBondContact O-CG 3.37Å; N156-E160 PolarHBondContact O-N 3.4Å; V157-E160 PolarHBondContact O-N 3.08Å; E160-T163 PolarHBondContact O-OG1 3.08Å; E160-Y164 VanDerWaalsContact O-CB 3.23Å; E160-Y164 WeakPolarHBondContact O-CB 3.47Å; E160-Y164 PolarHBondContact O-N 3.44Å; E160-F513 HydrophobicContact CB-CE1 4.41Å
161	M	86.7	Confident	84.9	Confident	70 Å²	70	60 Å²	60	35%	0.345	29%	0.285	S	S	.	.	H	α-helix	trans	-61.2	-45.3	173.7	-176.7	-172.9	176.3	0	0	111.8	V157 R159 Y164 V165 F513	V157-M161 WeakPolarHBondContact O-CB 3.42Å; V157-M161 PolarHBondContact O-N 3.1Å; R159-M161 VanDerWaalsContact C-N 3.35Å; M161-Y164 PolarHBondContact O-N 2.92Å; M161-V165 WeakPolarHBondContact O-CG2 3.46Å; M161-V165 PolarHBondContact O-N 2.93Å; M161-F513 HydrophobicContact CB-CD1 3.92Å; M161-F513 HydrophobicContact CB-CE1 4.33Å; M161-F513 HydrophobicContact CB-CG 4.49Å; M161-F513 HydrophobicContact CG-CB 4.26Å; M161-F513 HydrophobicContact CG-CD1 4.25Å; M161-F513 HydrophobicContact CG-CG 4.34Å
162	L	88.9	Confident	86	Confident	113 Å²	113	54.5 Å²	54.5	59%	0.592	26%	0.263	S	S	*	.	H	α-helix	trans	-68.2	-40.3	-180	-74.7	176.4	0	0	0	112.9	L158 R159 Y164 V165 G166	L158-L162 HydrophobicContact CD2-CD1 3.64Å; L158-L162 HydrophobicContact CD2-CG 4.24Å; L158-L162 WeakPolarHBondContact O-CB 3.41Å; L158-L162 VanDerWaalsContact O-CG 3.32Å; L158-L162 WeakPolarHBondContact O-CG 3.4Å; L158-L162 PolarHBondContact O-N 2.65Å; R159-L162 PolarHBondContact O-N 2.8Å; L162-Y164 VanDerWaalsContact C-N 3.31Å; L162-V165 PolarHBondContact O-N 3.41Å; L162-G166 PolarHBondContact O-N 3.2Å; L162-G166 VanDerWaalsContact O-N 3.08Å
163	T	90.3	Very high	87.2	Confident	40 Å²	40	50.9 Å²	50.9	25%	0.245	25%	0.254	C	S	.	.	H	α-helix	trans	-64.9	-39.5	173.8	54	0	0	0	0	110.8	R159 E160 G166 F167	R159-T163 PolarHBondContact O-N 3.49Å; R159-T163 PolarHBondContact O-OG1 3.4Å; E160-T163 PolarHBondContact O-OG1 3.08Å; T163-G166 PolarHBondContact O-N 3.13Å; T163-F167 PolarHBondContact O-N 3.27Å
164	Y	92.3	Very high	88.1	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.008	24%	0.238	C	C	.	.	H	α-helix	trans	-66	-40.6	177.2	-166.7	-102.8	0	0	0	113.5	E160 M161 L162 G166 F167 L168 S506 K509 F513	E160-Y164 VanDerWaalsContact O-CB 3.23Å; E160-Y164 WeakPolarHBondContact O-CB 3.47Å; E160-Y164 PolarHBondContact O-N 3.44Å; M161-Y164 PolarHBondContact O-N 2.92Å; L162-Y164 VanDerWaalsContact C-N 3.31Å; Y164-G166 VanDerWaalsContact C-N 3.32Å; Y164-G166 PolarHBondContact O-N 2.94Å; Y164-F167 HydrophobicContact CD2-CD1 4.1Å; Y164-F167 AromaticContact CE2-CD1 3.56Å; Y164-F167 HydrophobicContact CE2-CD1 3.56Å; Y164-F167 AromaticContact CE2-CE1 3.97Å; Y164-F167 HydrophobicContact CE2-CE1 3.97Å; Y164-F167 WeakPolarHBondContact O-CB 3.4Å; Y164-F167 PolarHBondContact O-N 3.27Å; Y164-L168 WeakPolarHBondContact O-CB 3.43Å; Y164-L168 PolarHBondContact O-N 3.41Å; Y164-S506 WeakPolarHBondContact OH-CA 3.48Å; Y164-S506 VanDerWaalsContact OH-CB 3.29Å; Y164-S506 WeakPolarHBondContact OH-CB 3.38Å; Y164-S506 PolarHBondContact OH-O 2.9Å; Y164-K509 HydrophobicContact CD2-CD 4.12Å; Y164-K509 HydrophobicContact CE1-CB 4.2Å; Y164-K509 HydrophobicContact CE1-CD 4.31Å; Y164-K509 HydrophobicContact CE1-CG 3.99Å; Y164-K509 HydrophobicContact CE2-CD 3.44Å; Y164-K509 VanDerWaalsContact CE2-CD 3.44Å; Y164-K509 HydrophobicContact CE2-CG 4.05Å; Y164-F513 AromaticContact CD1-CD2 3.89Å; Y164-F513 HydrophobicContact CD1-CD2 3.89Å; Y164-F513 AromaticContact CD1-CE2 3.43Å; Y164-F513 HydrophobicContact CD1-CE2 3.43Å; Y164-F513 VanDerWaalsContact CD1-CE2 3.43Å; Y164-F513 HydrophobicContact CD1-CZ 4.35Å; Y164-F513 HydrophobicContact CD2-CE2 4.32Å; Y164-F513 HydrophobicContact CE1-CE2 4.17Å; Y164-F513 HydrophobicContact CG-CD2 4.4Å; Y164-F513 AromaticContact CG-CE2 3.54Å; Y164-F513 HydrophobicContact CG-CE2 3.54Å; Y164-F513 HydrophobicContact CG-CZ 4.04Å
165	V	92.6	Very high	88.9	Confident	51 Å²	51	47.3 Å²	47.3	31%	0.309	24%	0.244	S	C	.	.	H	α-helix	trans	-63.3	-39.6	173.3	169.2	0	0	0	0	111	M161 L162 L168 I169	M161-V165 WeakPolarHBondContact O-CG2 3.46Å; M161-V165 PolarHBondContact O-N 2.93Å; L162-V165 PolarHBondContact O-N 3.41Å; V165-L168 PolarHBondContact O-N 2.91Å; V165-I169 HydrophobicContact CG1-CD1 3.85Å; V165-I169 HydrophobicContact CG1-CG1 4.47Å; V165-I169 VanDerWaalsContact O-CG1 3.28Å; V165-I169 WeakPolarHBondContact O-CG1 3.48Å; V165-I169 PolarHBondContact O-N 2.99Å
166	G	93.6	Very high	89.3	Confident	26 Å²	26	47.5 Å²	47.5	27%	0.268	25%	0.246	S	C	.	.	H	α-helix	trans	-61.3	-41.8	173	0	0	0	0	0	113.2	L162 T163 Y164 T170	L162-G166 PolarHBondContact O-N 3.2Å; L162-G166 VanDerWaalsContact O-N 3.08Å; T163-G166 PolarHBondContact O-N 3.13Å; Y164-G166 VanDerWaalsContact C-N 3.32Å; Y164-G166 PolarHBondContact O-N 2.94Å; G166-T170 PolarHBondContact O-N 3.37Å; G166-T170 VanDerWaalsContact O-N 3.07Å; G166-T170 PolarHBondContact O-OG1 2.72Å
167	F	94.8	Very high	89.5	Confident	1 Å²	1	47.1 Å²	47.1	0%	0.004	25%	0.247	C	C	.	.	H	α-helix	trans	-61.6	-49.3	172.4	168.7	-100.9	0	0	0	111.9	T163 Y164 I169 T170 V171 F416 F419 I420 Y423 I450	T163-F167 PolarHBondContact O-N 3.27Å; Y164-F167 HydrophobicContact CD2-CD1 4.1Å; Y164-F167 AromaticContact CE2-CD1 3.56Å; Y164-F167 HydrophobicContact CE2-CD1 3.56Å; Y164-F167 AromaticContact CE2-CE1 3.97Å; Y164-F167 HydrophobicContact CE2-CE1 3.97Å; Y164-F167 WeakPolarHBondContact O-CB 3.4Å; Y164-F167 PolarHBondContact O-N 3.27Å; F167-I169 PolarHBondContact O-N 3.4Å; F167-T170 WeakPolarHBondContact O-CB 3.33Å; F167-T170 PolarHBondContact O-N 2.86Å; F167-T170 VanDerWaalsContact O-N 3.08Å; F167-V171 HydrophobicContact CD1-CG2 4.47Å; F167-V171 HydrophobicContact CD2-CG2 4.22Å; F167-V171 HydrophobicContact CE1-CG2 4.03Å; F167-V171 HydrophobicContact CE2-CG2 3.77Å; F167-V171 HydrophobicContact CZ-CG2 3.67Å; F167-V171 WeakPolarHBondContact O-CG2 3.39Å; F167-V171 PolarHBondContact O-N 3.09Å; F167-F416 HydrophobicContact CD2-CD2 4.47Å; F167-F416 AromaticContact CE2-CD2 3.86Å; F167-F416 HydrophobicContact CE2-CD2 3.86Å; F167-F416 AromaticContact CE2-CE2 3.61Å; F167-F416 HydrophobicContact CE2-CE2 3.61Å; F167-F416 HydrophobicContact CZ-CE2 4.09Å; F167-F419 HydrophobicContact CB-CD1 4.32Å; F167-F419 HydrophobicContact CB-CG 4.33Å; F167-F419 HydrophobicContact CD2-CB 3.77Å; F167-F419 HydrophobicContact CD2-CG 4.19Å; F167-F419 HydrophobicContact CE2-CB 4.47Å; F167-I420 HydrophobicContact CE2-CD1 3.71Å; F167-I420 HydrophobicContact CZ-CD1 4.17Å; F167-Y423 HydrophobicContact CB-CE2 4.16Å; F167-Y423 HydrophobicContact CD1-CE2 4.38Å; F167-Y423 HydrophobicContact CD2-CE2 4Å; F167-Y423 HydrophobicContact CE2-CE2 4.49Å; F167-Y423 AromaticContact CG-CE2 3.92Å; F167-Y423 HydrophobicContact CG-CE2 3.92Å; F167-I450 HydrophobicContact CZ-CG2 4.36Å
168	L	94.3	Very high	89.5	Confident	13 Å²	13	49 Å²	49	7%	0.068	26%	0.255	C	S	.	.	H	α-helix	trans	-60.1	-43.1	-179.7	-176.8	65.2	0	0	0	111.9	Y164 V165 T170 V171 C172 W507	Y164-L168 WeakPolarHBondContact O-CB 3.43Å; Y164-L168 PolarHBondContact O-N 3.41Å; V165-L168 PolarHBondContact O-N 2.91Å; L168-T170 VanDerWaalsContact C-N 3.34Å; L168-T170 PolarHBondContact O-N 3.19Å; L168-V171 PolarHBondContact O-N 3.23Å; L168-C172 WeakPolarHBondContact O-CB 3.3Å; L168-C172 PolarHBondContact O-N 3.44Å; L168-C172 PolarHBondContact O-SG 3.23Å; L168-W507 HydrophobicContact CD1-CD2 4.33Å; L168-W507 HydrophobicContact CD2-CD2 4.41Å; L168-W507 HydrophobicContact CD2-CE3 4.2Å; L168-W507 HydrophobicContact CD2-CH2 4.12Å; L168-W507 HydrophobicContact CD2-CZ2 4.3Å; L168-W507 HydrophobicContact CD2-CZ3 4.06Å
169	I	94.3	Very high	89.6	Confident	102 Å²	102	48.8 Å²	48.8	52%	0.523	26%	0.257	S	S	.	.	H	α-helix	trans	-60	-45	173.9	-69.2	165.4	0	0	0	110.4	V165 F167 V171 C172 V173	V165-I169 HydrophobicContact CG1-CD1 3.85Å; V165-I169 HydrophobicContact CG1-CG1 4.47Å; V165-I169 VanDerWaalsContact O-CG1 3.28Å; V165-I169 WeakPolarHBondContact O-CG1 3.48Å; V165-I169 PolarHBondContact O-N 2.99Å; F167-I169 PolarHBondContact O-N 3.4Å; I169-V171 PolarHBondContact O-N 3.46Å; I169-C172 PolarHBondContact O-N 2.85Å; I169-V173 HydrophobicContact CG2-CG2 4.35Å; I169-V173 WeakPolarHBondContact O-CB 3.37Å; I169-V173 VanDerWaalsContact O-CG2 3.32Å; I169-V173 WeakPolarHBondContact O-CG2 3.37Å; I169-V173 PolarHBondContact O-N 2.88Å
170	T	93.5	Very high	89.5	Confident	19 Å²	19	47.4 Å²	47.4	12%	0.117	26%	0.258	C	S	.	.	H	α-helix	trans	-60.6	-45.4	178.6	-53.8	0	0	0	0	111.4	G166 F167 L168 V173 L174 C412 A415 F416	G166-T170 PolarHBondContact O-N 3.37Å; G166-T170 VanDerWaalsContact O-N 3.07Å; G166-T170 PolarHBondContact O-OG1 2.72Å; F167-T170 WeakPolarHBondContact O-CB 3.33Å; F167-T170 PolarHBondContact O-N 2.86Å; F167-T170 VanDerWaalsContact O-N 3.08Å; L168-T170 VanDerWaalsContact C-N 3.34Å; L168-T170 PolarHBondContact O-N 3.19Å; T170-V173 PolarHBondContact O-N 2.94Å; T170-L174 WeakPolarHBondContact O-CG 3.2Å; T170-L174 PolarHBondContact O-N 3.41Å; T170-C412 HydrophobicContact CG2-CB 4.38Å; T170-A415 HydrophobicContact CG2-CB 4.29Å; T170-F416 HydrophobicContact CG2-CB 4.08Å
171	V	92.9	Very high	89.6	Confident	7 Å²	7	49.8 Å²	49.8	4%	0.042	28%	0.278	C	S	.	.	H	α-helix	trans	-63	-44	176.8	172.5	0	0	0	0	111.6	F167 L168 I169 L174 T175 F416 V503	F167-V171 HydrophobicContact CD1-CG2 4.47Å; F167-V171 HydrophobicContact CD2-CG2 4.22Å; F167-V171 HydrophobicContact CE1-CG2 4.03Å; F167-V171 HydrophobicContact CE2-CG2 3.77Å; F167-V171 HydrophobicContact CZ-CG2 3.67Å; F167-V171 WeakPolarHBondContact O-CG2 3.39Å; F167-V171 PolarHBondContact O-N 3.09Å; L168-V171 PolarHBondContact O-N 3.23Å; I169-V171 PolarHBondContact O-N 3.46Å; V171-L174 PolarHBondContact O-N 3.15Å; V171-T175 PolarHBondContact O-N 3.4Å; V171-T175 PolarHBondContact O-OG1 3.23Å; V171-F416 HydrophobicContact CG2-CD2 3.76Å; V171-F416 HydrophobicContact CG2-CE2 3.63Å; V171-V503 HydrophobicContact CG1-CG2 3.61Å
172	C	92.6	Very high	89.7	Confident	39 Å²	39	49.6 Å²	49.6	26%	0.264	28%	0.278	S	S	.	.	H	α-helix	trans	-62.5	-45.5	177.6	-68	0	0	0	0	111.8	L168 I169 L174 T175 Y176	L168-C172 WeakPolarHBondContact O-CB 3.3Å; L168-C172 PolarHBondContact O-N 3.44Å; L168-C172 PolarHBondContact O-SG 3.23Å; I169-C172 PolarHBondContact O-N 2.85Å; C172-L174 VanDerWaalsContact C-N 3.33Å; C172-L174 PolarHBondContact O-N 3.23Å; C172-T175 PolarHBondContact O-N 3.05Å; C172-T175 PolarHBondContact O-OG1 3.39Å; C172-Y176 WeakPolarHBondContact O-CB 2.94Å; C172-Y176 PolarHBondContact O-N 2.82Å
173	V	92.2	Very high	89.8	Confident	38 Å²	38	45.4 Å²	45.4	23%	0.23	26%	0.256	C	S	.	.	H	α-helix	trans	-60.7	-41.3	176.1	169.2	0	0	0	0	111.4	I169 T170 G177 F408 C412	I169-V173 HydrophobicContact CG2-CG2 4.35Å; I169-V173 WeakPolarHBondContact O-CB 3.37Å; I169-V173 VanDerWaalsContact O-CG2 3.32Å; I169-V173 WeakPolarHBondContact O-CG2 3.37Å; I169-V173 PolarHBondContact O-N 2.88Å; T170-V173 PolarHBondContact O-N 2.94Å; V173-G177 PolarHBondContact O-N 3.24Å; V173-F408 HydrophobicContact CG1-CE1 3.83Å; V173-C412 HydrophobicContact CG1-CB 4.42Å
174	L	90.5	Very high	89.9	Confident	19 Å²	19	50.1 Å²	50.1	10%	0.099	27%	0.27	C	S	.	.	H	α-helix	trans	-62.6	-49.4	175.2	-75.9	179.1	0	0	0	112.2	T170 V171 C172 Y176 G177 M178 V409 C412 E413 F416	T170-L174 WeakPolarHBondContact O-CG 3.2Å; T170-L174 PolarHBondContact O-N 3.41Å; V171-L174 PolarHBondContact O-N 3.15Å; C172-L174 VanDerWaalsContact C-N 3.33Å; C172-L174 PolarHBondContact O-N 3.23Å; L174-Y176 PolarHBondContact O-N 3.39Å; L174-G177 PolarHBondContact O-N 3.23Å; L174-M178 WeakPolarHBondContact O-CB 3.36Å; L174-M178 VanDerWaalsContact O-CG 3.32Å; L174-M178 WeakPolarHBondContact O-CG 3.41Å; L174-M178 PolarHBondContact O-N 3.43Å; L174-V409 HydrophobicContact CD2-CG1 4.02Å; L174-C412 HydrophobicContact CD2-CB 3.78Å; L174-C412 HydrophobicContact CG-CB 4.15Å; L174-E413 HydrophobicContact CD2-CB 4.31Å; L174-E413 HydrophobicContact CD2-CG 3.54Å; L174-F416 HydrophobicContact CD1-CB 3.56Å; L174-F416 HydrophobicContact CD1-CD1 4.37Å; L174-F416 HydrophobicContact CD1-CD2 4.3Å; L174-F416 HydrophobicContact CD1-CG 3.84Å
175	T	88.5	Confident	89.9	Confident	45 Å²	45	57 Å²	57	28%	0.276	30%	0.297	S	S	.	.	H	α-helix	trans	-64.4	-40.3	-179.6	49.8	0	0	0	0	113.3	V171 C172 M178 V179 V503	V171-T175 PolarHBondContact O-N 3.4Å; V171-T175 PolarHBondContact O-OG1 3.23Å; C172-T175 PolarHBondContact O-N 3.05Å; C172-T175 PolarHBondContact O-OG1 3.39Å; T175-M178 PolarHBondContact O-N 2.92Å; T175-V179 PolarHBondContact O-N 2.83Å; T175-V503 HydrophobicContact CG2-CG2 3.53Å
176	Y	85.2	Confident	89.9	Confident	173 Å²	173	55.2 Å²	55.2	68%	0.678	29%	0.285	S	S	*	.	H	α-helix	trans	-68.8	-36	174.8	-174.5	-99.6	0	0	0	112.4	C172 L174 M178	C172-Y176 WeakPolarHBondContact O-CB 2.94Å; C172-Y176 PolarHBondContact O-N 2.82Å; L174-Y176 PolarHBondContact O-N 3.39Å; Y176-M178 VanDerWaalsContact C-N 3.28Å; Y176-M178 PolarHBondContact O-N 2.73Å
177	G	83.2	Confident	89.9	Confident	12 Å²	12	55.5 Å²	55.5	12%	0.124	28%	0.281	C	S	.	.	H	α-helix	trans	-67.3	-26.5	174	0	0	0	0	0	113.8	V173 L174	V173-G177 PolarHBondContact O-N 3.24Å; L174-G177 PolarHBondContact O-N 3.23Å
178	M	80.6	Confident	89.9	Confident	44 Å²	44	59.3 Å²	59.3	22%	0.217	30%	0.298	C	S	.	.	H	α-helix	trans	-87.9	-32.1	178	-72.1	-166.6	66.8	0	0	114.1	L174 T175 Y176 F495	L174-M178 WeakPolarHBondContact O-CB 3.36Å; L174-M178 VanDerWaalsContact O-CG 3.32Å; L174-M178 WeakPolarHBondContact O-CG 3.41Å; L174-M178 PolarHBondContact O-N 3.43Å; T175-M178 PolarHBondContact O-N 2.92Å; Y176-M178 VanDerWaalsContact C-N 3.28Å; Y176-M178 PolarHBondContact O-N 2.73Å; M178-F495 HydrophobicContact CE-CD1 4.12Å; M178-F495 HydrophobicContact CE-CE1 3.37Å; M178-F495 HydrophobicContact CE-CZ 4.01Å; M178-F495 HydrophobicContact SD-CE1 3.68Å; M178-F495 HydrophobicContact SD-CZ 3.94Å
179	V	83.3	Confident	89.8	Confident	74 Å²	74	61.5 Å²	61.5	45%	0.448	31%	0.312	S	S	.	.			trans	-112.5	100.9	-177.1	-175.8	0	0	0	0	110.4	T175	T175-V179 PolarHBondContact O-N 2.83Å
180	N	82.7	Confident	89.8	Confident	78 Å²	78	56.8 Å²	56.8	42%	0.417	29%	0.287	S	S	.	.			trans	-89.3	142.4	176.2	-171.9	-1.5	0	0	0	110.8	N182 M183	N180-N182 PolarHBondContact O-N 3.5Å; N180-N182 VanDerWaalsContact O-N 3.17Å; N180-N182 PolarHBondContact OD1-N 2.99Å; N180-M183 HydrophobicContact CB-CG 4.35Å; N180-M183 VanDerWaalsContact O-CB 3.23Å; N180-M183 WeakPolarHBondContact O-CB 3.42Å; N180-M183 VanDerWaalsContact O-CG 3.31Å; N180-M183 WeakPolarHBondContact O-CG 3.4Å; N180-M183 PolarHBondContact O-N 3.37Å
181	S	88.1	Confident	89.8	Confident	80 Å²	80	57 Å²	57	56%	0.559	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-31.3	176.4	56.4	0	0	0	0	113.1	M183 Y184	S181-M183 PolarHBondContact O-N 2.96Å; S181-M183 VanDerWaalsContact O-N 3.17Å; S181-Y184 PolarHBondContact O-N 3.12Å; S181-Y184 VanDerWaalsContact O-N 3.17Å
182	N	88.9	Confident	89.8	Confident	66 Å²	66	61 Å²	61	35%	0.353	31%	0.308	S	S	.	.	H	α-helix	trans	-59.1	-24.9	174.7	-66.9	-9.7	0	0	0	113.4	N180 Y184 Y185 Y186	N180-N182 PolarHBondContact O-N 3.5Å; N180-N182 VanDerWaalsContact O-N 3.17Å; N180-N182 PolarHBondContact OD1-N 2.99Å; N182-Y184 VanDerWaalsContact C-N 3.28Å; N182-Y184 PolarHBondContact O-N 3.3Å; N182-Y185 PolarHBondContact O-N 3.03Å; N182-Y186 WeakPolarHBondContact O-CB 3.45Å; N182-Y186 PolarHBondContact O-N 3.07Å
183	M	90.9	Very high	89.8	Confident	24 Å²	24	60.1 Å²	60.1	12%	0.118	30%	0.301	C	S	.	.	H	α-helix	trans	-62.5	-35.2	177.8	-63.5	177.3	72.5	0	0	112	N180 S181 T187 L371 T395	N180-M183 HydrophobicContact CB-CG 4.35Å; N180-M183 VanDerWaalsContact O-CB 3.23Å; N180-M183 WeakPolarHBondContact O-CB 3.42Å; N180-M183 VanDerWaalsContact O-CG 3.31Å; N180-M183 WeakPolarHBondContact O-CG 3.4Å; N180-M183 PolarHBondContact O-N 3.37Å; S181-M183 PolarHBondContact O-N 2.96Å; S181-M183 VanDerWaalsContact O-N 3.17Å; M183-T187 WeakPolarHBondContact O-CG2 3.48Å; M183-T187 PolarHBondContact O-N 2.86Å; M183-T187 VanDerWaalsContact O-N 3.09Å; M183-T187 PolarHBondContact O-OG1 2.88Å; M183-T187 VanDerWaalsContact O-OG1 3.1Å; M183-L371 HydrophobicContact CB-CD1 4.47Å; M183-L371 HydrophobicContact CG-CD1 3.6Å; M183-L371 HydrophobicContact CG-CD2 4.33Å; M183-T395 WeakPolarHBondContact CE-OG1 3.35Å
184	Y	92.6	Very high	89.9	Confident	139 Å²	139	58.3 Å²	58.3	55%	0.545	29%	0.29	S	S	.	.	H	α-helix	trans	-68.9	-45.6	177.2	171	-98.2	0	0	0	112.2	S181 N182 Y186 T187 K188	S181-Y184 PolarHBondContact O-N 3.12Å; S181-Y184 VanDerWaalsContact O-N 3.17Å; N182-Y184 VanDerWaalsContact C-N 3.28Å; N182-Y184 PolarHBondContact O-N 3.3Å; Y184-Y186 VanDerWaalsContact C-N 3.32Å; Y184-Y186 PolarHBondContact O-N 2.76Å; Y184-T187 PolarHBondContact O-N 3.21Å; Y184-T187 PolarHBondContact O-OG1 3.17Å; Y184-K188 HydrophobicContact CE1-CD 4.08Å; Y184-K188 VanDerWaalsContact O-CB 3.24Å; Y184-K188 WeakPolarHBondContact O-CB 3.38Å; Y184-K188 PolarHBondContact O-N 3.26Å
185	Y	93.1	Very high	90	Very high	147 Å²	147	57.4 Å²	57.4	58%	0.576	29%	0.285	S	S	*	.	H	α-helix	trans	-65.5	-38.2	178.7	-70	-73.8	0	0	0	111.6	N182 K188 V189	N182-Y185 PolarHBondContact O-N 3.03Å; Y185-K188 PolarHBondContact O-N 3.48Å; Y185-V189 WeakPolarHBondContact O-CG2 3.25Å; Y185-V189 PolarHBondContact O-N 3.1Å
186	Y	93.2	Very high	90.2	Very high	14 Å²	14	58.4 Å²	58.4	6%	0.055	29%	0.288	C	S	.	.	H	α-helix	trans	-65.5	-47.2	177.1	-174.5	-146.8	0	0	0	112.2	N182 Y184 K188 M190 N249 V364 N366 I369 L371 C373 T395	N182-Y186 WeakPolarHBondContact O-CB 3.45Å; N182-Y186 PolarHBondContact O-N 3.07Å; Y184-Y186 VanDerWaalsContact C-N 3.32Å; Y184-Y186 PolarHBondContact O-N 2.76Å; Y186-K188 VanDerWaalsContact C-N 3.35Å; Y186-K188 PolarHBondContact O-N 3Å; Y186-M190 HydrophobicContact CD2-CG 4.1Å; Y186-M190 HydrophobicContact CE2-CE 4.3Å; Y186-M190 HydrophobicContact CE2-CG 3.88Å; Y186-M190 HydrophobicContact CE2-SD 4.22Å; Y186-M190 WeakPolarHBondContact O-CG 3.3Å; Y186-M190 PolarHBondContact O-N 2.8Å; Y186-M190 VanDerWaalsContact O-N 3.1Å; Y186-N249 WeakPolarHBondContact CE2-OD1 3.47Å; Y186-V364 PolarHBondContact OH-O 2.8Å; Y186-N366 HydrophobicContact CE1-CB 4.32Å; Y186-N366 HydrophobicContact CE2-CB 4.35Å; Y186-I369 HydrophobicContact CD1-CD1 4.38Å; Y186-I369 HydrophobicContact CG-CD1 4.38Å; Y186-L371 HydrophobicContact CD1-CB 4.14Å; Y186-L371 HydrophobicContact CD1-CD1 4.48Å; Y186-L371 HydrophobicContact CE1-CB 4.14Å; Y186-C373 HydrophobicContact CD1-CB 4.36Å; Y186-C373 HydrophobicContact CE1-CB 3.58Å; Y186-T395 HydrophobicContact CD1-CG2 3.54Å; Y186-T395 HydrophobicContact CE1-CG2 4.05Å; Y186-T395 HydrophobicContact CG-CG2 4.39Å
187	T	93.4	Very high	90.4	Very high	31 Å²	31	52 Å²	52	19%	0.19	27%	0.268	C	S	.	.	H	α-helix	trans	-63.8	-39.5	174.7	51.3	0	0	0	0	112.1	M183 Y184 M190 S191 T395	M183-T187 WeakPolarHBondContact O-CG2 3.48Å; M183-T187 PolarHBondContact O-N 2.86Å; M183-T187 VanDerWaalsContact O-N 3.09Å; M183-T187 PolarHBondContact O-OG1 2.88Å; M183-T187 VanDerWaalsContact O-OG1 3.1Å; Y184-T187 PolarHBondContact O-N 3.21Å; Y184-T187 PolarHBondContact O-OG1 3.17Å; T187-M190 PolarHBondContact O-N 3.18Å; T187-S191 VanDerWaalsContact O-CB 3.3Å; T187-S191 WeakPolarHBondContact O-CB 3.38Å; T187-S191 PolarHBondContact O-N 2.99Å; T187-S191 PolarHBondContact O-OG 3.3Å; T187-T395 HydrophobicContact CG2-CG2 3.53Å
188	K	93.9	Very high	90.8	Very high	82 Å²	82	55 Å²	55	36%	0.357	29%	0.285	S	S	.	.	H	α-helix	trans	-58.6	-53.5	177	-176.7	174.4	-177.8	172.6	0	111.6	Y184 Y185 Y186 M190 S191 Q192	Y184-K188 HydrophobicContact CE1-CD 4.08Å; Y184-K188 VanDerWaalsContact O-CB 3.24Å; Y184-K188 WeakPolarHBondContact O-CB 3.38Å; Y184-K188 PolarHBondContact O-N 3.26Å; Y185-K188 PolarHBondContact O-N 3.48Å; Y186-K188 VanDerWaalsContact C-N 3.35Å; Y186-K188 PolarHBondContact O-N 3Å; K188-M190 PolarHBondContact O-N 3.42Å; K188-S191 PolarHBondContact O-N 3.2Å; K188-S191 VanDerWaalsContact O-N 3.17Å; K188-S191 PolarHBondContact O-OG 2.85Å; K188-Q192 WeakPolarHBondContact O-CG 3.33Å; K188-Q192 PolarHBondContact O-N 3.12Å
189	V	93.1	Very high	91	Very high	59 Å²	59	53.5 Å²	53.5	36%	0.358	28%	0.278	S	S	.	.	H	α-helix	trans	-62	-41.4	-179.3	170.5	0	0	0	0	111.9	Y185 Q192 L193 F246	Y185-V189 WeakPolarHBondContact O-CG2 3.25Å; Y185-V189 PolarHBondContact O-N 3.1Å; V189-Q192 PolarHBondContact O-N 2.86Å; V189-L193 PolarHBondContact O-N 3.23Å; V189-L193 VanDerWaalsContact O-N 3.16Å; V189-F246 HydrophobicContact CG1-CD2 3.77Å; V189-F246 HydrophobicContact CG1-CE2 3.36Å; V189-F246 HydrophobicContact CG1-CZ 3.9Å
190	M	93	Very high	90.9	Very high	2 Å²	2	52.5 Å²	52.5	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-62.4	-45	173.1	-69.4	-66	100.8	0	0	111.9	Y186 T187 K188 Q192 L193 F194 I245 F246 F393	Y186-M190 HydrophobicContact CD2-CG 4.1Å; Y186-M190 HydrophobicContact CE2-CE 4.3Å; Y186-M190 HydrophobicContact CE2-CG 3.88Å; Y186-M190 HydrophobicContact CE2-SD 4.22Å; Y186-M190 WeakPolarHBondContact O-CG 3.3Å; Y186-M190 PolarHBondContact O-N 2.8Å; Y186-M190 VanDerWaalsContact O-N 3.1Å; T187-M190 PolarHBondContact O-N 3.18Å; K188-M190 PolarHBondContact O-N 3.42Å; M190-Q192 PolarHBondContact O-N 2.91Å; M190-L193 PolarHBondContact O-N 2.84Å; M190-F194 VanDerWaalsContact O-CD2 3.3Å; M190-F194 WeakPolarHBondContact O-CD2 3.29Å; M190-F194 PolarHBondContact O-N 3.39Å; M190-F194 HydrophobicContact SD-CE2 4.46Å; M190-I245 HydrophobicContact CE-CG2 4.04Å; M190-F246 HydrophobicContact CE-CD2 3.64Å; M190-F246 HydrophobicContact CE-CE2 3.83Å; M190-F393 HydrophobicContact CB-CD1 4.13Å; M190-F393 HydrophobicContact CB-CE1 4.22Å
191	S	94.4	Very high	90.5	Very high	25 Å²	25	55.3 Å²	55.3	18%	0.175	30%	0.296	C	S	.	.	H	α-helix	trans	-63.6	-40.3	179.2	74	0	0	0	0	112.4	T187 K188 L193 F194 L195	T187-S191 VanDerWaalsContact O-CB 3.3Å; T187-S191 WeakPolarHBondContact O-CB 3.38Å; T187-S191 PolarHBondContact O-N 2.99Å; T187-S191 PolarHBondContact O-OG 3.3Å; K188-S191 PolarHBondContact O-N 3.2Å; K188-S191 VanDerWaalsContact O-N 3.17Å; K188-S191 PolarHBondContact O-OG 2.85Å; S191-L193 PolarHBondContact O-N 3.32Å; S191-F194 PolarHBondContact O-N 3.11Å; S191-L195 WeakPolarHBondContact O-CA 3.41Å; S191-L195 WeakPolarHBondContact O-CB 3.35Å; S191-L195 VanDerWaalsContact O-CG 3.24Å; S191-L195 WeakPolarHBondContact O-CG 3.4Å; S191-L195 PolarHBondContact O-N 3.04Å
192	Q	93.3	Very high	89.8	Confident	91 Å²	91	55.1 Å²	55.1	43%	0.425	31%	0.307	S	S	.	.	H	α-helix	trans	-66.5	-38.3	178.6	-70.9	-177.5	-51.5	0	0	112.2	K188 V189 M190 D196	K188-Q192 WeakPolarHBondContact O-CG 3.33Å; K188-Q192 PolarHBondContact O-N 3.12Å; V189-Q192 PolarHBondContact O-N 2.86Å; M190-Q192 PolarHBondContact O-N 2.91Å; Q192-D196 PolarHBondContact O-N 3.45Å
193	L	92.8	Very high	89.3	Confident	19 Å²	19	55.2 Å²	55.2	10%	0.099	31%	0.308	C	S	.	.	H	α-helix	trans	-62.7	-42.2	178	-179.2	63.2	0	0	0	112.8	V189 M190 S191 T197 W230 I245 F246	V189-L193 PolarHBondContact O-N 3.23Å; V189-L193 VanDerWaalsContact O-N 3.16Å; M190-L193 PolarHBondContact O-N 2.84Å; S191-L193 PolarHBondContact O-N 3.32Å; L193-T197 WeakPolarHBondContact O-CG2 3.4Å; L193-T197 PolarHBondContact O-OG1 2.83Å; L193-W230 HydrophobicContact CD1-CZ2 4.26Å; L193-I245 HydrophobicContact CD2-CG2 3.48Å; L193-I245 VanDerWaalsContact CD2-CG2 3.48Å; L193-F246 HydrophobicContact CB-CE2 3.94Å; L193-F246 HydrophobicContact CB-CZ 4Å; L193-F246 HydrophobicContact CD1-CE2 4.39Å; L193-F246 HydrophobicContact CD1-CZ 3.95Å; L193-F246 HydrophobicContact CD2-CD2 4.27Å; L193-F246 HydrophobicContact CD2-CE2 3.62Å; L193-F246 HydrophobicContact CD2-CZ 4.03Å; L193-F246 HydrophobicContact CG-CE2 4.19Å; L193-F246 HydrophobicContact CG-CZ 4.21Å
194	F	93.5	Very high	88.8	Confident	0 Å²	0	63 Å²	63	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-99.6	-23.5	-173.4	-65.7	-67.5	0	0	0	114.9	M190 S191 F219 F224 M228 I245 F362 L377 F393	M190-F194 VanDerWaalsContact O-CD2 3.3Å; M190-F194 WeakPolarHBondContact O-CD2 3.29Å; M190-F194 PolarHBondContact O-N 3.39Å; M190-F194 HydrophobicContact SD-CE2 4.46Å; S191-F194 PolarHBondContact O-N 3.11Å; F194-F219 WeakPolarHBondContact O-CE2 3.45Å; F194-F224 HydrophobicContact CD1-CD2 4.24Å; F194-F224 HydrophobicContact CE1-CD2 4.23Å; F194-F224 HydrophobicContact CE1-CE2 4.45Å; F194-M228 HydrophobicContact CE1-CG 3.9Å; F194-M228 HydrophobicContact CE1-SD 3.68Å; F194-M228 HydrophobicContact CE2-SD 4.42Å; F194-M228 HydrophobicContact CZ-CG 4.18Å; F194-M228 HydrophobicContact CZ-SD 3.39Å; F194-M228 WeakPolarHBondContact CZ-SD 3.36Å; F194-I245 HydrophobicContact CZ-CD1 4.38Å; F194-F362 HydrophobicContact CD1-CZ 4.36Å; F194-F362 HydrophobicContact CD2-CE2 4.33Å; F194-F362 AromaticContact CD2-CZ 3.75Å; F194-F362 HydrophobicContact CD2-CZ 3.75Å; F194-F362 HydrophobicContact CE1-CZ 4.2Å; F194-F362 AromaticContact CE2-CE2 3.73Å; F194-F362 HydrophobicContact CE2-CE2 3.73Å; F194-F362 AromaticContact CE2-CZ 3.56Å; F194-F362 HydrophobicContact CE2-CZ 3.56Å; F194-F362 HydrophobicContact CG-CZ 4.17Å; F194-F362 AromaticContact CZ-CE2 3.94Å; F194-F362 HydrophobicContact CZ-CE2 3.94Å; F194-F362 AromaticContact CZ-CZ 3.81Å; F194-F362 HydrophobicContact CZ-CZ 3.81Å; F194-L377 HydrophobicContact CB-CD1 4.37Å; F194-F393 HydrophobicContact CB-CZ 4.18Å; F194-F393 HydrophobicContact CD2-CE1 4.21Å; F194-F393 HydrophobicContact CD2-CZ 4.41Å
195	L	93.7	Very high	88.5	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-99.4	-37.5	-176.8	-55	179.5	0	0	0	113.8	S191 T206 F207 R208 L377 W391 F393	S191-L195 WeakPolarHBondContact O-CA 3.41Å; S191-L195 WeakPolarHBondContact O-CB 3.35Å; S191-L195 VanDerWaalsContact O-CG 3.24Å; S191-L195 WeakPolarHBondContact O-CG 3.4Å; S191-L195 PolarHBondContact O-N 3.04Å; L195-T206 VanDerWaalsContact O-CB 3.31Å; L195-T206 WeakPolarHBondContact O-CB 3.44Å; L195-F207 HydrophobicContact CD2-CB 4.37Å; L195-F207 HydrophobicContact CD2-CD1 3.5Å; L195-F207 HydrophobicContact CD2-CE1 4.13Å; L195-F207 HydrophobicContact CD2-CG 4.18Å; L195-F207 PolarHBondContact O-N 2.96Å; L195-R208 HydrophobicContact CB-CG 4.26Å; L195-L377 HydrophobicContact CD2-CD2 3.85Å; L195-W391 HydrophobicContact CD1-CB 4.46Å; L195-W391 HydrophobicContact CD1-CD2 3.66Å; L195-W391 HydrophobicContact CD1-CE3 4.35Å; L195-W391 HydrophobicContact CD1-CG 3.64Å; L195-W391 HydrophobicContact CD2-CB 3.83Å; L195-W391 HydrophobicContact CD2-CD2 3.85Å; L195-W391 HydrophobicContact CD2-CE3 3.97Å; L195-W391 HydrophobicContact CD2-CG 3.76Å; L195-W391 HydrophobicContact CG-CD2 4.43Å; L195-W391 HydrophobicContact CG-CG 4.36Å; L195-F393 HydrophobicContact CD1-CE2 3.97Å; L195-F393 HydrophobicContact CD2-CE2 4.13Å; L195-F393 HydrophobicContact CG-CE2 4.01Å; L195-F393 HydrophobicContact CG-CZ 4.48Å
196	D	91.8	Very high	88.5	Confident	65 Å²	65	53 Å²	53	35%	0.348	31%	0.313	S	S	.	.	S	Bend	trans	-105.2	-3.8	-167.1	-55.5	-30.7	0	0	0	112.7	Q192 R208	Q192-D196 PolarHBondContact O-N 3.45Å; D196-R208 IonicContact OD1-CZ 2.71Å; D196-R208 IonicContact OD1-NE 2.75Å; D196-R208 PolarHBondContact OD1-NE 3.29Å; D196-R208 IonicContact OD1-NH2 3.57Å; D196-R208 PolarHBondContact OD1-NH2 3.03Å; D196-R208 IonicContact OD2-NH2 2.73Å; D196-R208 PolarHBondContact OD2-NH2 2.68Å
197	T	89.9	Confident	88.4	Confident	40 Å²	40	52.4 Å²	52.4	25%	0.245	31%	0.31	C	S	.	.	S	Bend	trans	-72.4	133.8	173.6	44.5	0	0	0	0	111	L193	L193-T197 WeakPolarHBondContact O-CG2 3.4Å; L193-T197 PolarHBondContact O-OG1 2.83Å
198	P	90	Very high	88.4	Confident	73 Å²	73	55.8 Å²	55.8	47%	0.474	32%	0.319	S	S	.	.			trans	-72	147.3	179.8	29.2	-34.5	0	0	0	111.5	S200 D203 T205	P198-S200 VanDerWaalsContact C-N 3.3Å; P198-S200 PolarHBondContact O-N 3.49Å; P198-D203 WeakPolarHBondContact CB-O 3.45Å; P198-T205 WeakPolarHBondContact CA-O 3.18Å
199	L	85.6	Confident	88.3	Confident	14 Å²	14	54.7 Å²	54.7	7%	0.073	32%	0.322	C	S	.	.	S	Bend	trans	-62.3	-31.3	180	-92.8	145.6	0	0	0	114.6	T205 L210 D215 K218 F219	L199-T205 VanDerWaalsContact CD1-OG1 3.26Å; L199-T205 WeakPolarHBondContact CD1-OG1 3.44Å; L199-T205 PolarHBondContact N-O 3.3Å; L199-L210 HydrophobicContact CD1-CD2 3.78Å; L199-D215 WeakPolarHBondContact CD2-O 3.23Å; L199-K218 HydrophobicContact CD2-CB 3.46Å; L199-K218 VanDerWaalsContact CD2-CB 3.46Å; L199-K218 HydrophobicContact CD2-CD 4.38Å; L199-F219 HydrophobicContact CD2-CB 3.85Å; L199-F219 VanDerWaalsContact CD2-N 3.26Å
200	S	81.8	Confident	88.2	Confident	53 Å²	53	52.2 Å²	52.2	37%	0.371	31%	0.307	S	S	.	.	S	Bend	trans	-157.5	147.9	-176.3	-176.2	0	0	0	0	109.6	P198 G202 D203	P198-S200 VanDerWaalsContact C-N 3.3Å; P198-S200 PolarHBondContact O-N 3.49Å; S200-G202 VanDerWaalsContact C-N 3.33Å; S200-G202 PolarHBondContact O-N 3.09Å; S200-D203 PolarHBondContact O-N 3.03Å
201	P	74.3	Confident	88	Confident	136 Å²	136	55.3 Å²	55.3	88%	0.883	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	90.1	173.3	27.6	-35.4	0	0	0	111.1
202	G	73.1	Confident	87.9	Confident	77 Å²	77	56.8 Å²	56.8	79%	0.794	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	138.5	-24.4	-177	0	0	0	0	0	113.7	S200	S200-G202 VanDerWaalsContact C-N 3.33Å; S200-G202 PolarHBondContact O-N 3.09Å
203	D	77.3	Confident	87.9	Confident	67 Å²	67	55.5 Å²	55.5	36%	0.358	33%	0.332	S	S	.	.			trans	-90.1	131.7	175.6	-73.8	-22.8	0	0	0	110.1	P198 S200 T205	P198-D203 WeakPolarHBondContact CB-O 3.45Å; S200-D203 PolarHBondContact O-N 3.03Å; D203-T205 VanDerWaalsContact C-N 3.28Å
204	Q	81.1	Confident	87.9	Confident	188 Å²	188	62 Å²	62	88%	0.879	36%	0.359	S	S	*	.			trans	-83.1	-2.2	172.8	-68	-170.4	0.1	0	0	113.5
205	T	87.4	Confident	87.8	Confident	48 Å²	48	63.1 Å²	63.1	29%	0.294	37%	0.365	S	S	.	.			trans	-70.8	134.5	178.4	47.1	0	0	0	0	110.4	P198 L199 D203	P198-T205 WeakPolarHBondContact CA-O 3.18Å; L199-T205 VanDerWaalsContact CD1-OG1 3.26Å; L199-T205 WeakPolarHBondContact CD1-OG1 3.44Å; L199-T205 PolarHBondContact N-O 3.3Å; D203-T205 VanDerWaalsContact C-N 3.28Å
206	T	91.1	Very high	87.8	Confident	28 Å²	28	63.2 Å²	63.2	17%	0.172	37%	0.366	C	S	.	.			trans	-123.6	179.7	178	67.7	0	0	0	0	108.8	L195 R208 S209 L210	L195-T206 VanDerWaalsContact O-CB 3.31Å; L195-T206 WeakPolarHBondContact O-CB 3.44Å; T206-R208 PolarHBondContact O-N 3.08Å; T206-S209 PolarHBondContact N-OG 3.03Å; T206-S209 VanDerWaalsContact N-OG 3.12Å; T206-S209 PolarHBondContact O-N 3.44Å; T206-S209 PolarHBondContact O-OG 3.25Å; T206-L210 PolarHBondContact O-N 3.48Å
207	F	92.3	Very high	88	Confident	1 Å²	1	61.1 Å²	61.1	0%	0.004	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-58.1	-37.5	177.7	-174.3	-96.7	0	0	0	111.9	L195 S209 L210 F219 L377 V379 T389 W391	L195-F207 HydrophobicContact CD2-CB 4.37Å; L195-F207 HydrophobicContact CD2-CD1 3.5Å; L195-F207 HydrophobicContact CD2-CE1 4.13Å; L195-F207 HydrophobicContact CD2-CG 4.18Å; L195-F207 PolarHBondContact O-N 2.96Å; F207-S209 PolarHBondContact O-N 3.01Å; F207-L210 HydrophobicContact CD2-CD1 3.5Å; F207-L210 HydrophobicContact CE2-CD1 3.89Å; F207-L210 HydrophobicContact CG-CD1 4.16Å; F207-L210 WeakPolarHBondContact O-CG 3.41Å; F207-L210 PolarHBondContact O-N 3.05Å; F207-F219 HydrophobicContact CB-CD2 4.34Å; F207-F219 HydrophobicContact CB-CE2 3.93Å; F207-F219 HydrophobicContact CB-CZ 4.42Å; F207-F219 AromaticContact CD2-CD1 3.86Å; F207-F219 HydrophobicContact CD2-CD1 3.86Å; F207-F219 AromaticContact CD2-CD2 3.93Å; F207-F219 HydrophobicContact CD2-CD2 3.93Å; F207-F219 AromaticContact CD2-CE1 3.54Å; F207-F219 HydrophobicContact CD2-CE1 3.54Å; F207-F219 AromaticContact CD2-CE2 3.62Å; F207-F219 HydrophobicContact CD2-CE2 3.62Å; F207-F219 HydrophobicContact CD2-CG 4.06Å; F207-F219 AromaticContact CD2-CZ 3.42Å; F207-F219 HydrophobicContact CD2-CZ 3.42Å; F207-F219 VanDerWaalsContact CD2-CZ 3.42Å; F207-F219 HydrophobicContact CE2-CD1 4.12Å; F207-F219 AromaticContact CE2-CE1 3.75Å; F207-F219 HydrophobicContact CE2-CE1 3.75Å; F207-F219 HydrophobicContact CE2-CZ 4.04Å; F207-F219 HydrophobicContact CG-CE2 4.17Å; F207-F219 HydrophobicContact CG-CZ 4.19Å; F207-L377 HydrophobicContact CE1-CB 4.35Å; F207-L377 HydrophobicContact CE1-CD2 4.16Å; F207-L377 HydrophobicContact CE2-CB 4.21Å; F207-L377 HydrophobicContact CE2-CD1 4.27Å; F207-L377 HydrophobicContact CZ-CB 3.74Å; F207-L377 HydrophobicContact CZ-CD1 4.42Å; F207-L377 HydrophobicContact CZ-CD2 4.33Å; F207-L377 HydrophobicContact CZ-CG 4.38Å; F207-V379 HydrophobicContact CE2-CG2 3.85Å; F207-V379 HydrophobicContact CZ-CG2 3.78Å; F207-T389 HydrophobicContact CD1-CG2 4.48Å; F207-T389 HydrophobicContact CE1-CG2 4.13Å; F207-T389 HydrophobicContact CZ-CG2 4.14Å; F207-T389 WeakPolarHBondContact O-CG2 3.47Å; F207-T389 PolarHBondContact O-OG1 3.36Å; F207-W391 HydrophobicContact CD1-CE3 4.27Å; F207-W391 HydrophobicContact CE1-CE3 4.28Å
208	R	92.6	Very high	88.1	Confident	102 Å²	102	62.8 Å²	62.8	39%	0.385	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-65.9	-22.4	-177.6	-54.8	-176.1	-167.8	-95.1	2.9	114.3	L195 D196 T206 W391	L195-R208 HydrophobicContact CB-CG 4.26Å; D196-R208 IonicContact OD1-CZ 2.71Å; D196-R208 IonicContact OD1-NE 2.75Å; D196-R208 PolarHBondContact OD1-NE 3.29Å; D196-R208 IonicContact OD1-NH2 3.57Å; D196-R208 PolarHBondContact OD1-NH2 3.03Å; D196-R208 IonicContact OD2-NH2 2.73Å; D196-R208 PolarHBondContact OD2-NH2 2.68Å; T206-R208 PolarHBondContact O-N 3.08Å; R208-W391 HydrophobicContact CB-CZ3 4.33Å; R208-W391 HydrophobicContact CG-CH2 4.09Å; R208-W391 HydrophobicContact CG-CZ3 3.96Å
209	S	91.5	Very high	88.3	Confident	60 Å²	60	59.4 Å²	59.4	42%	0.42	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-113.8	18.3	-176.4	54.6	0	0	0	0	112.9	T206 F207 S211	T206-S209 PolarHBondContact N-OG 3.03Å; T206-S209 VanDerWaalsContact N-OG 3.12Å; T206-S209 PolarHBondContact O-N 3.44Å; T206-S209 PolarHBondContact O-OG 3.25Å; F207-S209 PolarHBondContact O-N 3.01Å; S209-S211 PolarHBondContact O-N 3.22Å
210	L	91.2	Very high	88.6	Confident	6 Å²	6	58.8 Å²	58.8	3%	0.031	33%	0.331	C	S	.	.			trans	-65	118.2	173.4	-79.1	173.8	0	0	0	111.1	L199 T206 F207 D215 F219 T389	L199-L210 HydrophobicContact CD1-CD2 3.78Å; T206-L210 PolarHBondContact O-N 3.48Å; F207-L210 HydrophobicContact CD2-CD1 3.5Å; F207-L210 HydrophobicContact CE2-CD1 3.89Å; F207-L210 HydrophobicContact CG-CD1 4.16Å; F207-L210 WeakPolarHBondContact O-CG 3.41Å; F207-L210 PolarHBondContact O-N 3.05Å; L210-D215 VanDerWaalsContact CD2-C 3.45Å; L210-D215 HydrophobicContact CD2-CB 3.49Å; L210-D215 VanDerWaalsContact CD2-CB 3.49Å; L210-F219 HydrophobicContact CD1-CB 4.21Å; L210-F219 HydrophobicContact CD1-CG 4.27Å; L210-F219 HydrophobicContact CD2-CB 4.49Å; L210-T389 HydrophobicContact CB-CG2 3.68Å; L210-T389 HydrophobicContact CD1-CG2 4.11Å; L210-T389 HydrophobicContact CG-CG2 4.45Å
211	S	90.1	Very high	89.1	Confident	68 Å²	68	59.1 Å²	59.1	48%	0.476	33%	0.327	S	S	.	.			trans	-115.1	-14.7	-178.9	58.6	0	0	0	0	114.5	S209 G386 A387	S209-S211 PolarHBondContact O-N 3.22Å; S211-G386 CarbonylContact O-C 3.35Å; S211-G386 WeakPolarHBondContact O-CA 3.43Å; S211-A387 PolarHBondContact O-N 3.36Å
212	T	92.4	Very high	89.9	Confident	56 Å²	56	54.3 Å²	54.3	34%	0.344	30%	0.302	S	S	.	.	S	Bend	trans	-130	151.1	-176.8	85.7	0	0	0	0	113.7	K214 D215 F216	T212-K214 PolarHBondContact O-N 3.39Å; T212-K214 PolarHBondContact OG1-N 2.92Å; T212-D215 PolarHBondContact O-N 3.37Å; T212-D215 VanDerWaalsContact O-N 3.13Å; T212-D215 VanDerWaalsContact OG1-CG 3.29Å; T212-D215 PolarHBondContact OG1-N 2.98Å; T212-D215 VanDerWaalsContact OG1-N 3.11Å; T212-D215 PolarHBondContact OG1-OD2 3Å; T212-F216 PolarHBondContact O-N 3.13Å; T212-F216 VanDerWaalsContact O-N 3.09Å
213	M	92.9	Very high	90.7	Very high	64 Å²	64	51.5 Å²	51.5	32%	0.315	27%	0.27	S	S	.	.	H	α-helix	trans	-56.6	-31.6	170.7	-69.2	173	175.2	0	0	112.7	F216 W217 D352 F381	M213-F216 PolarHBondContact O-N 3.15Å; M213-W217 VanDerWaalsContact O-CD1 3.22Å; M213-W217 PolarHBondContact O-N 2.93Å; M213-W217 VanDerWaalsContact O-N 3.17Å; M213-D352 WeakPolarHBondContact CE-O 3.3Å; M213-F381 HydrophobicContact CB-CE1 4.21Å; M213-F381 HydrophobicContact CE-CB 4.21Å; M213-F381 HydrophobicContact CE-CD1 3.67Å; M213-F381 HydrophobicContact CE-CE1 4.21Å; M213-F381 HydrophobicContact CE-CG 3.89Å; M213-F381 HydrophobicContact CG-CD1 3.69Å; M213-F381 HydrophobicContact CG-CE1 3.28Å; M213-F381 HydrophobicContact CG-CZ 3.91Å
214	K	92	Very high	91.5	Very high	156 Å²	156	48.3 Å²	48.3	68%	0.678	25%	0.252	S	S	*	.	H	α-helix	trans	-68.3	-39.6	177.9	-176.1	178.7	-179.9	179.9	0	111.3	T212 W217 K218	T212-K214 PolarHBondContact O-N 3.39Å; T212-K214 PolarHBondContact OG1-N 2.92Å; K214-W217 PolarHBondContact O-N 2.93Å; K214-K218 PolarHBondContact O-N 3.48Å
215	D	92.4	Very high	91.9	Very high	23 Å²	23	39.6 Å²	39.6	12%	0.123	21%	0.212	C	C	.	.	H	α-helix	trans	-74.4	-30.4	178.2	-57.5	-53.2	0	0	0	111.6	L199 L210 T212 W217 K218 F219	L199-D215 WeakPolarHBondContact CD2-O 3.23Å; L210-D215 VanDerWaalsContact CD2-C 3.45Å; L210-D215 HydrophobicContact CD2-CB 3.49Å; L210-D215 VanDerWaalsContact CD2-CB 3.49Å; T212-D215 PolarHBondContact O-N 3.37Å; T212-D215 VanDerWaalsContact O-N 3.13Å; T212-D215 VanDerWaalsContact OG1-CG 3.29Å; T212-D215 PolarHBondContact OG1-N 2.98Å; T212-D215 VanDerWaalsContact OG1-N 3.11Å; T212-D215 PolarHBondContact OG1-OD2 3Å; D215-W217 VanDerWaalsContact C-N 3.34Å; D215-W217 PolarHBondContact O-N 3.49Å; D215-K218 WeakPolarHBondContact O-CB 3.29Å; D215-K218 PolarHBondContact O-N 3.19Å; D215-K218 WeakPolarHBondContact OD1-CD 3.38Å; D215-K218 WeakPolarHBondContact OD1-CE 3.37Å; D215-K218 IonicContact OD1-NZ 3.84Å; D215-K218 PolarHBondContact OD1-NZ 2.95Å; D215-F219 WeakPolarHBondContact O-CB 3.4Å; D215-F219 PolarHBondContact O-N 3.4Å
216	F	93.9	Very high	92	Very high	3 Å²	3	39.1 Å²	39.1	1%	0.013	22%	0.216	C	C	.	.	H	α-helix	trans	-59.2	-42.4	166.7	176.2	-99.8	0	0	0	112.5	T212 M213 F219 T220 L351 V358 V379	T212-F216 PolarHBondContact O-N 3.13Å; T212-F216 VanDerWaalsContact O-N 3.09Å; M213-F216 PolarHBondContact O-N 3.15Å; F216-F219 WeakPolarHBondContact O-CB 3.46Å; F216-F219 PolarHBondContact O-N 3.15Å; F216-T220 HydrophobicContact CD1-CG2 4.39Å; F216-T220 HydrophobicContact CD2-CG2 4.39Å; F216-T220 HydrophobicContact CE1-CG2 3.78Å; F216-T220 HydrophobicContact CE2-CG2 3.82Å; F216-T220 HydrophobicContact CZ-CG2 3.48Å; F216-T220 VanDerWaalsContact CZ-CG2 3.48Å; F216-T220 PolarHBondContact O-N 2.86Å; F216-T220 PolarHBondContact O-OG1 3.02Å; F216-L351 HydrophobicContact CD1-CD1 3.52Å; F216-L351 HydrophobicContact CE1-CD1 3.68Å; F216-V358 HydrophobicContact CE1-CG1 4.13Å; F216-V358 HydrophobicContact CE2-CG1 4.42Å; F216-V358 HydrophobicContact CZ-CB 4.37Å; F216-V358 HydrophobicContact CZ-CG1 3.64Å; F216-V379 HydrophobicContact CD2-CB 4.2Å; F216-V379 HydrophobicContact CD2-CG1 4.41Å; F216-V379 HydrophobicContact CD2-CG2 3.65Å; F216-V379 HydrophobicContact CE2-CB 4.37Å; F216-V379 HydrophobicContact CE2-CG2 3.78Å
217	W	94.2	Very high	91.9	Very high	20 Å²	20	38 Å²	38	8%	0.076	21%	0.21	C	C	.	.	H	α-helix	trans	-66.7	-35.5	174.4	-76.4	120.7	0	0	0	113.2	M213 K214 D215 T220 Q221 L342 L345 K346 W350 L351	M213-W217 VanDerWaalsContact O-CD1 3.22Å; M213-W217 PolarHBondContact O-N 2.93Å; M213-W217 VanDerWaalsContact O-N 3.17Å; K214-W217 PolarHBondContact O-N 2.93Å; D215-W217 VanDerWaalsContact C-N 3.34Å; D215-W217 PolarHBondContact O-N 3.49Å; W217-T220 WeakPolarHBondContact CA-OG1 3.47Å; W217-T220 PolarHBondContact O-OG1 2.8Å; W217-Q221 WeakPolarHBondContact O-CB 3.32Å; W217-Q221 VanDerWaalsContact O-CG 3.3Å; W217-Q221 WeakPolarHBondContact O-CG 3.4Å; W217-Q221 PolarHBondContact O-N 2.82Å; W217-Q221 VanDerWaalsContact O-N 3.14Å; W217-L342 HydrophobicContact CZ3-CD2 4.29Å; W217-L345 HydrophobicContact CH2-CB 3.74Å; W217-L345 HydrophobicContact CZ3-CB 4.39Å; W217-K346 HydrophobicContact CB-CD 4.2Å; W217-K346 HydrophobicContact CD2-CB 4Å; W217-K346 HydrophobicContact CD2-CD 4.26Å; W217-K346 HydrophobicContact CD2-CG 3.94Å; W217-K346 HydrophobicContact CE3-CB 4.01Å; W217-K346 HydrophobicContact CE3-CD 4.47Å; W217-K346 HydrophobicContact CE3-CG 4.35Å; W217-K346 HydrophobicContact CG-CD 4.17Å; W217-K346 HydrophobicContact CG-CG 4.06Å; W217-K346 HydrophobicContact CH2-CB 4.18Å; W217-K346 HydrophobicContact CZ2-CB 4.14Å; W217-K346 HydrophobicContact CZ3-CB 4.11Å; W217-W350 HydrophobicContact CH2-CE3 4.3Å; W217-L351 HydrophobicContact CH2-CG 4.42Å; W217-L351 HydrophobicContact CZ2-CB 4.2Å; W217-L351 HydrophobicContact CZ2-CD1 3.87Å; W217-L351 HydrophobicContact CZ2-CG 3.63Å
218	K	92.9	Very high	91.7	Very high	76 Å²	76	37.9 Å²	37.9	33%	0.33	21%	0.21	S	C	.	.	H	α-helix	trans	-63.4	-43.1	169.9	-68.8	177.9	-173.6	165.4	0	111.3	L199 K214 D215 Q221 G222	L199-K218 HydrophobicContact CD2-CB 3.46Å; L199-K218 VanDerWaalsContact CD2-CB 3.46Å; L199-K218 HydrophobicContact CD2-CD 4.38Å; K214-K218 PolarHBondContact O-N 3.48Å; D215-K218 WeakPolarHBondContact O-CB 3.29Å; D215-K218 PolarHBondContact O-N 3.19Å; D215-K218 WeakPolarHBondContact OD1-CD 3.38Å; D215-K218 WeakPolarHBondContact OD1-CE 3.37Å; D215-K218 IonicContact OD1-NZ 3.84Å; D215-K218 PolarHBondContact OD1-NZ 2.95Å; K218-Q221 PolarHBondContact O-N 3.01Å; K218-G222 PolarHBondContact O-N 2.95Å
219	F	93.6	Very high	91.4	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.009	19%	0.193	C	C	.	.	H	α-helix	trans	-60.8	-50.5	-179.6	171.5	-99.5	0	0	0	111.2	F194 L199 F207 L210 D215 F216 Q221 G222 P223 F224 L377	F194-F219 WeakPolarHBondContact O-CE2 3.45Å; L199-F219 HydrophobicContact CD2-CB 3.85Å; L199-F219 VanDerWaalsContact CD2-N 3.26Å; F207-F219 HydrophobicContact CB-CD2 4.34Å; F207-F219 HydrophobicContact CB-CE2 3.93Å; F207-F219 HydrophobicContact CB-CZ 4.42Å; F207-F219 AromaticContact CD2-CD1 3.86Å; F207-F219 HydrophobicContact CD2-CD1 3.86Å; F207-F219 AromaticContact CD2-CD2 3.93Å; F207-F219 HydrophobicContact CD2-CD2 3.93Å; F207-F219 AromaticContact CD2-CE1 3.54Å; F207-F219 HydrophobicContact CD2-CE1 3.54Å; F207-F219 AromaticContact CD2-CE2 3.62Å; F207-F219 HydrophobicContact CD2-CE2 3.62Å; F207-F219 HydrophobicContact CD2-CG 4.06Å; F207-F219 AromaticContact CD2-CZ 3.42Å; F207-F219 HydrophobicContact CD2-CZ 3.42Å; F207-F219 VanDerWaalsContact CD2-CZ 3.42Å; F207-F219 HydrophobicContact CE2-CD1 4.12Å; F207-F219 AromaticContact CE2-CE1 3.75Å; F207-F219 HydrophobicContact CE2-CE1 3.75Å; F207-F219 HydrophobicContact CE2-CZ 4.04Å; F207-F219 HydrophobicContact CG-CE2 4.17Å; F207-F219 HydrophobicContact CG-CZ 4.19Å; L210-F219 HydrophobicContact CD1-CB 4.21Å; L210-F219 HydrophobicContact CD1-CG 4.27Å; L210-F219 HydrophobicContact CD2-CB 4.49Å; D215-F219 WeakPolarHBondContact O-CB 3.4Å; D215-F219 PolarHBondContact O-N 3.4Å; F216-F219 WeakPolarHBondContact O-CB 3.46Å; F216-F219 PolarHBondContact O-N 3.15Å; F219-Q221 PolarHBondContact O-N 2.72Å; F219-G222 PolarHBondContact O-N 3.2Å; F219-P223 HydrophobicContact CD2-CG 3.61Å; F219-P223 HydrophobicContact CE2-CG 4.11Å; F219-P223 HydrophobicContact CG-CG 4.37Å; F219-P223 WeakPolarHBondContact O-CD 3.48Å; F219-F224 HydrophobicContact CD1-CB 4.32Å; F219-F224 HydrophobicContact CE1-CB 3.94Å; F219-F224 HydrophobicContact CE1-CG 4.46Å; F219-F224 HydrophobicContact CZ-CB 4.13Å; F219-F224 VanDerWaalsContact O-CB 3.32Å; F219-F224 WeakPolarHBondContact O-CB 3.38Å; F219-F224 PolarHBondContact O-N 3.44Å; F219-L377 HydrophobicContact CE1-CD1 4.09Å; F219-L377 HydrophobicContact CZ-CD1 3.91Å
220	T	93.5	Very high	90.9	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.185	C	C	.	.	I	π-helix	trans	-64.2	-38.4	180	48.3	0	0	0	0	112.4	F216 W217 L225 L360	F216-T220 HydrophobicContact CD1-CG2 4.39Å; F216-T220 HydrophobicContact CD2-CG2 4.39Å; F216-T220 HydrophobicContact CE1-CG2 3.78Å; F216-T220 HydrophobicContact CE2-CG2 3.82Å; F216-T220 HydrophobicContact CZ-CG2 3.48Å; F216-T220 VanDerWaalsContact CZ-CG2 3.48Å; F216-T220 PolarHBondContact O-N 2.86Å; F216-T220 PolarHBondContact O-OG1 3.02Å; W217-T220 WeakPolarHBondContact CA-OG1 3.47Å; W217-T220 PolarHBondContact O-OG1 2.8Å; T220-L225 WeakPolarHBondContact O-CG 3.46Å; T220-L360 HydrophobicContact CG2-CD1 4.27Å
221	Q	91.6	Very high	89.7	Confident	61 Å²	61	37.7 Å²	37.7	29%	0.285	21%	0.206	S	C	.	.	I	π-helix	trans	-80.8	-25.2	179.3	-67.1	-178.2	-39.4	0	0	114	W217 K218 F219	W217-Q221 WeakPolarHBondContact O-CB 3.32Å; W217-Q221 VanDerWaalsContact O-CG 3.3Å; W217-Q221 WeakPolarHBondContact O-CG 3.4Å; W217-Q221 PolarHBondContact O-N 2.82Å; W217-Q221 VanDerWaalsContact O-N 3.14Å; K218-Q221 PolarHBondContact O-N 3.01Å; F219-Q221 PolarHBondContact O-N 2.72Å
222	G	89.9	Confident	88.3	Confident	34 Å²	34	38.1 Å²	38.1	35%	0.351	21%	0.206	S	C	.	.	I	π-helix	trans	-103.2	-100.1	-176.9	0	0	0	0	0	113.6	K218 F219 F224 L225 G226	K218-G222 PolarHBondContact O-N 2.95Å; F219-G222 PolarHBondContact O-N 3.2Å; G222-F224 VanDerWaalsContact C-N 3.27Å; G222-F224 PolarHBondContact O-N 2.8Å; G222-L225 PolarHBondContact O-N 3.4Å; G222-G226 PolarHBondContact O-N 2.96Å
223	P	91.6	Very high	86.7	Confident	18 Å²	18	40.4 Å²	40.4	12%	0.117	21%	0.208	C	C	.	.	I	π-helix	trans	-58.7	-32.5	-171.7	23.6	-35.6	0	0	0	113.8	F219 G227	F219-P223 HydrophobicContact CD2-CG 3.61Å; F219-P223 HydrophobicContact CE2-CG 4.11Å; F219-P223 HydrophobicContact CG-CG 4.37Å; F219-P223 WeakPolarHBondContact O-CD 3.48Å; P223-G227 PolarHBondContact O-N 3.4Å
224	F	92.6	Very high	84.9	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.228	C	C	.	.	I	π-helix	trans	-65.6	-54.8	177.6	176.5	-107.7	0	0	0	112.6	F194 F219 G222 G226 G227 M228 P255 L331 L360 F362	F194-F224 HydrophobicContact CD1-CD2 4.24Å; F194-F224 HydrophobicContact CE1-CD2 4.23Å; F194-F224 HydrophobicContact CE1-CE2 4.45Å; F219-F224 HydrophobicContact CD1-CB 4.32Å; F219-F224 HydrophobicContact CE1-CB 3.94Å; F219-F224 HydrophobicContact CE1-CG 4.46Å; F219-F224 HydrophobicContact CZ-CB 4.13Å; F219-F224 VanDerWaalsContact O-CB 3.32Å; F219-F224 WeakPolarHBondContact O-CB 3.38Å; F219-F224 PolarHBondContact O-N 3.44Å; G222-F224 VanDerWaalsContact C-N 3.27Å; G222-F224 PolarHBondContact O-N 2.8Å; F224-G226 VanDerWaalsContact C-N 3.3Å; F224-G226 PolarHBondContact O-N 3.23Å; F224-G227 PolarHBondContact O-N 2.98Å; F224-M228 HydrophobicContact CD2-CG 3.96Å; F224-M228 HydrophobicContact CE1-CG 4.21Å; F224-M228 HydrophobicContact CE2-CE 4.42Å; F224-M228 HydrophobicContact CE2-CG 3.41Å; F224-M228 VanDerWaalsContact CE2-CG 3.41Å; F224-M228 HydrophobicContact CE2-SD 4Å; F224-M228 HydrophobicContact CZ-CE 4.31Å; F224-M228 HydrophobicContact CZ-CG 3.56Å; F224-M228 HydrophobicContact CZ-SD 4.37Å; F224-M228 VanDerWaalsContact O-CG 3.3Å; F224-M228 WeakPolarHBondContact O-CG 3.34Å; F224-M228 PolarHBondContact O-N 3.47Å; F224-P255 HydrophobicContact CZ-CB 4.14Å; F224-P255 HydrophobicContact CZ-CG 4.35Å; F224-L331 HydrophobicContact CE1-CD1 3.85Å; F224-L360 HydrophobicContact CD1-CD1 4.03Å; F224-L360 HydrophobicContact CD2-CD1 4.1Å; F224-L360 HydrophobicContact CD2-CD2 3.95Å; F224-L360 HydrophobicContact CE1-CD1 3.84Å; F224-L360 HydrophobicContact CE1-CD2 4.38Å; F224-L360 HydrophobicContact CE2-CD1 3.94Å; F224-L360 HydrophobicContact CE2-CD2 3.24Å; F224-L360 HydrophobicContact CE2-CG 4.17Å; F224-L360 HydrophobicContact CG-CD1 4.16Å; F224-L360 HydrophobicContact CZ-CD1 3.8Å; F224-L360 HydrophobicContact CZ-CD2 3.5Å; F224-L360 VanDerWaalsContact CZ-CD2 3.5Å; F224-L360 HydrophobicContact CZ-CG 4.06Å; F224-F362 HydrophobicContact CE2-CD1 4.27Å; F224-F362 HydrophobicContact CE2-CE1 4.11Å
225	L	91.3	Very high	83.2	Confident	6 Å²	6	43.9 Å²	43.9	3%	0.031	22%	0.223	C	C	.	.	H	α-helix	trans	-62.5	-38.3	177.3	-73.1	178.8	0	0	0	111.9	T220 G222 G227 M228 Y229 A339 L342	T220-L225 WeakPolarHBondContact O-CG 3.46Å; G222-L225 PolarHBondContact O-N 3.4Å; L225-G227 VanDerWaalsContact C-N 3.35Å; L225-M228 PolarHBondContact O-N 3.29Å; L225-Y229 HydrophobicContact CD2-CD2 3.87Å; L225-Y229 HydrophobicContact CD2-CE2 3.57Å; L225-Y229 WeakPolarHBondContact O-CD2 3.34Å; L225-Y229 PolarHBondContact O-N 3.02Å; L225-A339 HydrophobicContact CD1-CB 3.77Å; L225-L342 HydrophobicContact CD1-CD1 4.1Å; L225-L342 HydrophobicContact CD2-CD1 4.09Å; L225-L342 HydrophobicContact CG-CD1 4.15Å
226	G	88.1	Confident	81.8	Confident	37 Å²	37	49.5 Å²	49.5	38%	0.381	25%	0.253	S	S	.	.	H	α-helix	trans	-64.6	-35.7	175.1	0	0	0	0	0	113.6	G222 F224	G222-G226 PolarHBondContact O-N 2.96Å; F224-G226 VanDerWaalsContact C-N 3.3Å; F224-G226 PolarHBondContact O-N 3.23Å
227	G	88.8	Confident	80	Confident	4 Å²	4	53 Å²	53	4%	0.041	28%	0.277	C	S	.	.	H	α-helix	trans	-75.7	-31.5	176.5	0	0	0	0	0	113.9	P223 F224 L225 W230	P223-G227 PolarHBondContact O-N 3.4Å; F224-G227 PolarHBondContact O-N 2.98Å; L225-G227 VanDerWaalsContact C-N 3.35Å; G227-W230 VanDerWaalsContact O-CD1 3.28Å; G227-W230 PolarHBondContact O-NE1 2.76Å
228	M	88.6	Confident	78.3	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-85.8	-37.7	-178.8	-67.7	-61.7	-82.3	0	0	114	F194 F224 L225 I245 L251 P255 F362	F194-M228 HydrophobicContact CE1-CG 3.9Å; F194-M228 HydrophobicContact CE1-SD 3.68Å; F194-M228 HydrophobicContact CE2-SD 4.42Å; F194-M228 HydrophobicContact CZ-CG 4.18Å; F194-M228 HydrophobicContact CZ-SD 3.39Å; F194-M228 WeakPolarHBondContact CZ-SD 3.36Å; F224-M228 HydrophobicContact CD2-CG 3.96Å; F224-M228 HydrophobicContact CE1-CG 4.21Å; F224-M228 HydrophobicContact CE2-CE 4.42Å; F224-M228 HydrophobicContact CE2-CG 3.41Å; F224-M228 VanDerWaalsContact CE2-CG 3.41Å; F224-M228 HydrophobicContact CE2-SD 4Å; F224-M228 HydrophobicContact CZ-CE 4.31Å; F224-M228 HydrophobicContact CZ-CG 3.56Å; F224-M228 HydrophobicContact CZ-SD 4.37Å; F224-M228 VanDerWaalsContact O-CG 3.3Å; F224-M228 WeakPolarHBondContact O-CG 3.34Å; F224-M228 PolarHBondContact O-N 3.47Å; L225-M228 PolarHBondContact O-N 3.29Å; M228-I245 HydrophobicContact SD-CD1 3.85Å; M228-L251 HydrophobicContact CE-CD1 3.47Å; M228-L251 VanDerWaalsContact CE-CD1 3.47Å; M228-L251 HydrophobicContact CE-CD2 4.13Å; M228-L251 HydrophobicContact CE-CG 4.46Å; M228-P255 HydrophobicContact CE-CB 4.35Å; M228-P255 HydrophobicContact CE-CG 3.51Å; M228-F362 HydrophobicContact CE-CB 3.73Å; M228-F362 HydrophobicContact CE-CD1 4.23Å; M228-F362 HydrophobicContact CE-CD2 3.43Å; M228-F362 VanDerWaalsContact CE-CD2 3.43Å; M228-F362 HydrophobicContact CE-CE2 4.02Å; M228-F362 HydrophobicContact CE-CG 3.54Å; M228-F362 HydrophobicContact SD-CD2 3.75Å; M228-F362 HydrophobicContact SD-CE1 4.5Å; M228-F362 HydrophobicContact SD-CE2 3.67Å; M228-F362 HydrophobicContact SD-CG 4.2Å; M228-F362 HydrophobicContact SD-CZ 4.06Å
229	Y	87.4	Confident	76.6	Confident	6 Å²	6	55.4 Å²	55.4	2%	0.024	30%	0.3	C	S	.	.			trans	-119	97.4	-175	-50.9	-82.3	0	0	0	109.7	L225 L251 S332 R333 K335 S338	L225-Y229 HydrophobicContact CD2-CD2 3.87Å; L225-Y229 HydrophobicContact CD2-CE2 3.57Å; L225-Y229 WeakPolarHBondContact O-CD2 3.34Å; L225-Y229 PolarHBondContact O-N 3.02Å; Y229-L251 HydrophobicContact CE1-CD2 4.24Å; Y229-S332 PolarHBondContact OH-O 2.93Å; Y229-R333 WeakPolarHBondContact CD1-O 3.49Å; Y229-R333 WeakPolarHBondContact CE1-O 3.24Å; Y229-K335 HydrophobicContact CD2-CB 4.26Å; Y229-K335 HydrophobicContact CD2-CG 4.32Å; Y229-K335 HydrophobicContact CG-CB 3.99Å; Y229-K335 HydrophobicContact CG-CG 4.39Å; Y229-S338 PolarHBondContact OH-OG 3.43Å
230	W	80.4	Confident	74.8	Confident	67 Å²	67	63.4 Å²	63.4	25%	0.254	34%	0.337	S	S	.	.			trans	-90.5	113.8	178.3	-71.7	53.5	0	0	0	109.2	L193 G227 L238 F246 Y247	L193-W230 HydrophobicContact CD1-CZ2 4.26Å; G227-W230 VanDerWaalsContact O-CD1 3.28Å; G227-W230 PolarHBondContact O-NE1 2.76Å; W230-L238 WeakPolarHBondContact O-CD1 3.36Å; W230-F246 AromaticContact CH2-CD1 3.37Å; W230-F246 HydrophobicContact CH2-CD1 3.37Å; W230-F246 AromaticContact CH2-CE1 3.58Å; W230-F246 HydrophobicContact CH2-CE1 3.58Å; W230-F246 HydrophobicContact CH2-CG 4.22Å; W230-F246 AromaticContact CZ2-CD1 3.63Å; W230-F246 HydrophobicContact CZ2-CD1 3.63Å; W230-F246 AromaticContact CZ2-CE1 3.7Å; W230-F246 HydrophobicContact CZ2-CE1 3.7Å; W230-F246 HydrophobicContact CZ2-CG 4.14Å; W230-F246 HydrophobicContact CZ2-CZ 4.28Å; W230-F246 HydrophobicContact CZ3-CD1 4.26Å; W230-Y247 HydrophobicContact CE3-CE1 4.47Å; W230-Y247 HydrophobicContact CE3-CE2 4.39Å; W230-Y247 HydrophobicContact CZ3-CE2 4.25Å
231	D	66.2	Low	73.1	Confident	91 Å²	91	69.5 Å²	69.5	49%	0.487	37%	0.37	S	S	.	.			trans	-89.4	-2	-165.3	-55.7	-45.8	0	0	0	114.8	K335	D231-K335 WeakPolarHBondContact OD1-CD 3.48Å; D231-K335 VanDerWaalsContact OD2-CD 3.31Å; D231-K335 WeakPolarHBondContact OD2-CD 3.49Å; D231-K335 IonicContact OD2-NZ 2.88Å; D231-K335 PolarHBondContact OD2-NZ 3.2Å
232	V	59.4	Low	71.9	Confident	76 Å²	76	71 Å²	71	46%	0.461	38%	0.377	S	S	.	.			trans	-141.4	111.3	-168	-155.8	0	0	0	0	113.5	N236 Y247	V232-N236 WeakPolarHBondContact CG1-OD1 3.42Å; V232-Y247 WeakPolarHBondContact O-CE1 3.38Å; V232-Y247 PolarHBondContact O-OH 2.66Å
233	W	58.7	Low	71	Confident	104 Å²	104	70 Å²	70	39%	0.394	37%	0.365	S	S	.	.			trans	-89.2	162.1	153.9	-169.3	-89.9	0	0	0	109.3	N235 N236 L238 Y247	W233-N235 PolarHBondContact O-N 3Å; W233-N236 PolarHBondContact O-N 2.92Å; W233-L238 HydrophobicContact CB-CD2 4.08Å; W233-Y247 HydrophobicContact CD2-CD1 4.47Å; W233-Y247 AromaticContact CE3-CD1 3.41Å; W233-Y247 HydrophobicContact CE3-CD1 3.41Å; W233-Y247 VanDerWaalsContact CE3-CD1 3.41Å; W233-Y247 AromaticContact CE3-CE1 3.98Å; W233-Y247 HydrophobicContact CE3-CE1 3.98Å; W233-Y247 HydrophobicContact CE3-CG 4.07Å; W233-Y247 AromaticContact CZ3-CD1 3.6Å; W233-Y247 HydrophobicContact CZ3-CD1 3.6Å; W233-Y247 AromaticContact CZ3-CG 3.78Å; W233-Y247 HydrophobicContact CZ3-CG 3.78Å
234	Y	55.3	Low	70.6	Confident	186 Å²	186	71.9 Å²	71.9	73%	0.729	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-14.7	-171.2	70.2	-112.8	0	0	0	116.5
235	N	57.6	Low	70.3	Confident	107 Å²	107	71.9 Å²	71.9	57%	0.572	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.7	8.2	-178.4	-95.9	3.4	0	0	0	114.6	W233 S237	W233-N235 PolarHBondContact O-N 3Å; N235-S237 PolarHBondContact O-N 3.32Å
236	N	61.4	Low	70.1	Confident	142 Å²	142	75 Å²	75	76%	0.759	38%	0.384	S	S	*	.	S	Bend	trans	56.3	10.7	-171.7	-66.1	-12.3	0	0	0	115.2	V232 W233	V232-N236 WeakPolarHBondContact CG1-OD1 3.42Å; W233-N236 PolarHBondContact O-N 2.92Å
237	S	56	Low	69.9	Low	75 Å²	75	78.4 Å²	78.4	52%	0.524	39%	0.387	S	S	.	.			trans	-117	99.7	177.5	63	0	0	0	0	109.7	N235	N235-S237 PolarHBondContact O-N 3.32Å
238	L	58.4	Low	69.7	Low	61 Å²	61	83.3 Å²	83.3	32%	0.319	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-80.5	146.7	162.6	-71.1	166.1	0	0	0	108.9	W230 W233 E240	W230-L238 WeakPolarHBondContact O-CD1 3.36Å; W233-L238 HydrophobicContact CB-CD2 4.08Å; L238-E240 PolarHBondContact O-N 3.4Å
239	P	58.5	Low	69.8	Low	86 Å²	86	83.7 Å²	83.7	56%	0.558	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-59.4	131.2	165.3	26.8	-32.9	0	0	0	108.9	N241 F244	P239-N241 PolarHBondContact O-N 3.04Å; P239-F244 HydrophobicContact CG-CE2 4.4Å
240	E	55.6	Low	69.9	Low	170 Å²	170	85.5 Å²	85.5	79%	0.794	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	135.2	-171.7	-63.3	179.6	163.9	0	0	111.9	L238 Q242	L238-E240 PolarHBondContact O-N 3.4Å; E240-Q242 PolarHBondContact O-N 3.45Å
241	N	58.9	Low	70.3	Confident	128 Å²	128	82.4 Å²	82.4	68%	0.684	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.7	13.5	170.2	-46.2	-57.3	0	0	0	118.2	P239 R333	P239-N241 PolarHBondContact O-N 3.04Å; N241-R333 PolarHBondContact O-NE 3.17Å; N241-R333 VanDerWaalsContact O-NE 3.16Å; N241-R333 PolarHBondContact O-NH2 3.02Å
242	Q	66	Low	71.4	Confident	93 Å²	93	79.2 Å²	79.2	44%	0.435	39%	0.392	S	S	.	.			trans	-127.4	115.7	174.1	-60.2	-169	4.6	0	0	113.8	E240 F244	E240-Q242 PolarHBondContact O-N 3.45Å; Q242-F244 HydrophobicContact CB-CD2 4.45Å; Q242-F244 HydrophobicContact CB-CE2 3.76Å; Q242-F244 HydrophobicContact CB-CZ 4.29Å
243	S	71.1	Confident	72.8	Confident	14 Å²	14	75.7 Å²	75.7	10%	0.098	37%	0.371	C	S	.	.			trans	-85.3	127	169.6	51.8	0	0	0	0	111.1	L251	S243-L251 PolarHBondContact O-N 3.13Å; S243-L251 WeakPolarHBondContact OG-CD2 3.48Å
244	F	82.9	Confident	74.3	Confident	56 Å²	56	71.2 Å²	71.2	25%	0.246	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	126.5	173.3	-67.1	-90.1	0	0	0	109.8	P239 Q242 N249 L250	P239-F244 HydrophobicContact CG-CE2 4.4Å; Q242-F244 HydrophobicContact CB-CD2 4.45Å; Q242-F244 HydrophobicContact CB-CE2 3.76Å; Q242-F244 HydrophobicContact CB-CZ 4.29Å; F244-N249 CarbonylContact C-O 3.06Å; F244-N249 WeakPolarHBondContact CA-O 3.24Å; F244-L250 HydrophobicContact CD1-CB 4.32Å; F244-L250 HydrophobicContact CD1-CD1 4.41Å; F244-L250 HydrophobicContact CE1-CB 4.09Å; F244-L250 HydrophobicContact CE1-CD1 3.88Å; F244-L250 HydrophobicContact CZ-CD1 4.05Å
245	I	86.7	Confident	76.1	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	128.5	175.2	-57	170.8	0	0	0	107.9	M190 L193 F194 M228 Y247 N249 V364	M190-I245 HydrophobicContact CE-CG2 4.04Å; L193-I245 HydrophobicContact CD2-CG2 3.48Å; L193-I245 VanDerWaalsContact CD2-CG2 3.48Å; F194-I245 HydrophobicContact CZ-CD1 4.38Å; M228-I245 HydrophobicContact SD-CD1 3.85Å; I245-Y247 PolarHBondContact O-N 3.03Å; I245-N249 HydrophobicContact CB-CB 4.32Å; I245-N249 PolarHBondContact N-O 3.16Å; I245-N249 VanDerWaalsContact O-CB 3.3Å; I245-N249 WeakPolarHBondContact O-CB 3.07Å; I245-N249 PolarHBondContact O-N 3.26Å; I245-N249 VanDerWaalsContact O-N 3.12Å; I245-N249 PolarHBondContact O-ND2 3.32Å; I245-V364 HydrophobicContact CD1-CG1 4.21Å; I245-V364 HydrophobicContact CD1-CG2 3.95Å
246	F	85.9	Confident	77.8	Confident	71 Å²	71	58.6 Å²	58.6	31%	0.311	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.3	37.8	-170.6	-62.7	-69.7	0	0	0	113.5	V189 M190 L193 W230 E248	V189-F246 HydrophobicContact CG1-CD2 3.77Å; V189-F246 HydrophobicContact CG1-CE2 3.36Å; V189-F246 HydrophobicContact CG1-CZ 3.9Å; M190-F246 HydrophobicContact CE-CD2 3.64Å; M190-F246 HydrophobicContact CE-CE2 3.83Å; L193-F246 HydrophobicContact CB-CE2 3.94Å; L193-F246 HydrophobicContact CB-CZ 4Å; L193-F246 HydrophobicContact CD1-CE2 4.39Å; L193-F246 HydrophobicContact CD1-CZ 3.95Å; L193-F246 HydrophobicContact CD2-CD2 4.27Å; L193-F246 HydrophobicContact CD2-CE2 3.62Å; L193-F246 HydrophobicContact CD2-CZ 4.03Å; L193-F246 HydrophobicContact CG-CE2 4.19Å; L193-F246 HydrophobicContact CG-CZ 4.21Å; W230-F246 AromaticContact CH2-CD1 3.37Å; W230-F246 HydrophobicContact CH2-CD1 3.37Å; W230-F246 AromaticContact CH2-CE1 3.58Å; W230-F246 HydrophobicContact CH2-CE1 3.58Å; W230-F246 HydrophobicContact CH2-CG 4.22Å; W230-F246 AromaticContact CZ2-CD1 3.63Å; W230-F246 HydrophobicContact CZ2-CD1 3.63Å; W230-F246 AromaticContact CZ2-CE1 3.7Å; W230-F246 HydrophobicContact CZ2-CE1 3.7Å; W230-F246 HydrophobicContact CZ2-CG 4.14Å; W230-F246 HydrophobicContact CZ2-CZ 4.28Å; W230-F246 HydrophobicContact CZ3-CD1 4.26Å; F246-E248 PolarHBondContact O-N 3.05Å
247	Y	83.3	Confident	79.4	Confident	109 Å²	109	51.8 Å²	51.8	43%	0.427	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	-20.7	174	-58.1	-53	0	0	0	117.5	W230 V232 W233 I245	W230-Y247 HydrophobicContact CE3-CE1 4.47Å; W230-Y247 HydrophobicContact CE3-CE2 4.39Å; W230-Y247 HydrophobicContact CZ3-CE2 4.25Å; V232-Y247 WeakPolarHBondContact O-CE1 3.38Å; V232-Y247 PolarHBondContact O-OH 2.66Å; W233-Y247 HydrophobicContact CD2-CD1 4.47Å; W233-Y247 AromaticContact CE3-CD1 3.41Å; W233-Y247 HydrophobicContact CE3-CD1 3.41Å; W233-Y247 VanDerWaalsContact CE3-CD1 3.41Å; W233-Y247 AromaticContact CE3-CE1 3.98Å; W233-Y247 HydrophobicContact CE3-CE1 3.98Å; W233-Y247 HydrophobicContact CE3-CG 4.07Å; W233-Y247 AromaticContact CZ3-CD1 3.6Å; W233-Y247 HydrophobicContact CZ3-CD1 3.6Å; W233-Y247 AromaticContact CZ3-CG 3.78Å; W233-Y247 HydrophobicContact CZ3-CG 3.78Å; I245-Y247 PolarHBondContact O-N 3.03Å
248	E	86.1	Confident	81.2	Confident	107 Å²	107	48.3 Å²	48.3	50%	0.5	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-23	-176	-61	-174.1	-173.5	0	0	114.3	F246 N368	F246-E248 PolarHBondContact O-N 3.05Å; E248-N368 PolarHBondContact OE2-ND2 3.11Å
249	N	90.6	Very high	83	Confident	9 Å²	9	45.4 Å²	45.4	5%	0.048	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	113.3	-170	-46.4	-78.1	0	0	0	110.1	Y186 F244 I245 V364 Y365 N366	Y186-N249 WeakPolarHBondContact CE2-OD1 3.47Å; F244-N249 CarbonylContact C-O 3.06Å; F244-N249 WeakPolarHBondContact CA-O 3.24Å; I245-N249 HydrophobicContact CB-CB 4.32Å; I245-N249 PolarHBondContact N-O 3.16Å; I245-N249 VanDerWaalsContact O-CB 3.3Å; I245-N249 WeakPolarHBondContact O-CB 3.07Å; I245-N249 PolarHBondContact O-N 3.26Å; I245-N249 VanDerWaalsContact O-N 3.12Å; I245-N249 PolarHBondContact O-ND2 3.32Å; N249-V364 HydrophobicContact CB-CG1 3.53Å; N249-Y365 CarbonylContact C-O 3.38Å; N249-N366 WeakPolarHBondContact OD1-CB 3.42Å; N249-N366 PolarHBondContact OD1-ND2 2.87Å
250	L	89.4	Confident	84.7	Confident	43 Å²	43	41.3 Å²	41.3	23%	0.225	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	127.7	-178.8	176.8	65	0	0	0	111.4	F244 L252 V364 Y365	F244-L250 HydrophobicContact CD1-CB 4.32Å; F244-L250 HydrophobicContact CD1-CD1 4.41Å; F244-L250 HydrophobicContact CE1-CB 4.09Å; F244-L250 HydrophobicContact CE1-CD1 3.88Å; F244-L250 HydrophobicContact CZ-CD1 4.05Å; L250-L252 HydrophobicContact CD2-CD2 4.22Å; L250-L252 HydrophobicContact CG-CD2 4.44Å; L250-L252 PolarHBondContact O-N 3.01Å; L250-V364 CarbonylContact O-C 3.53Å; L250-V364 WeakPolarHBondContact O-CA 3.21Å; L250-V364 WeakPolarHBondContact O-CG1 3.48Å; L250-Y365 PolarHBondContact N-O 3.33Å; L250-Y365 PolarHBondContact O-N 3.27Å
251	L	89.1	Confident	86.6	Confident	3 Å²	3	33.5 Å²	33.5	2%	0.016	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	121.2	169.7	-178.5	60.9	0	0	0	111.1	M228 Y229 S243 P255	M228-L251 HydrophobicContact CE-CD1 3.47Å; M228-L251 VanDerWaalsContact CE-CD1 3.47Å; M228-L251 HydrophobicContact CE-CD2 4.13Å; M228-L251 HydrophobicContact CE-CG 4.46Å; Y229-L251 HydrophobicContact CE1-CD2 4.24Å; S243-L251 PolarHBondContact O-N 3.13Å; S243-L251 WeakPolarHBondContact OG-CD2 3.48Å; L251-P255 HydrophobicContact CD2-CG 4.49Å
252	L	88.4	Confident	88.3	Confident	23 Å²	23	27.4 Å²	27.4	12%	0.12	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	126.8	177.6	-61.6	-177.8	0	0	0	111.3	L250 V254 S363 F372 L475 P483 F485	L250-L252 HydrophobicContact CD2-CD2 4.22Å; L250-L252 HydrophobicContact CG-CD2 4.44Å; L250-L252 PolarHBondContact O-N 3.01Å; L252-V254 PolarHBondContact O-N 3.08Å; L252-S363 WeakPolarHBondContact CB-O 3.48Å; L252-S363 PolarHBondContact N-O 2.74Å; L252-F372 HydrophobicContact CD1-CD1 3.67Å; L252-F372 HydrophobicContact CD1-CE1 3.77Å; L252-L475 HydrophobicContact CB-CD2 4.29Å; L252-L475 HydrophobicContact CD1-CD2 4.1Å; L252-L475 HydrophobicContact CD2-CD2 4.47Å; L252-P483 HydrophobicContact CB-CG 4.48Å; L252-F485 HydrophobicContact CD1-CE2 4.13Å
253	G	88.1	Confident	89.6	Confident	3 Å²	3	28.5 Å²	28.5	3%	0.031	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	63.6	-127	-178.9	0	0	0	0	0	112.4	R333 A481	G253-R333 PolarHBondContact O-NH1 3.23Å; G253-A481 VanDerWaalsContact CA-O 3.28Å; G253-A481 WeakPolarHBondContact CA-O 3.26Å
254	V	91.1	Very high	90.4	Very high	9 Å²	9	30.3 Å²	30.3	6%	0.055	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	154.5	173.5	-67.8	0	0	0	0	110.6	L252 D330 L331 R333 H482	L252-V254 PolarHBondContact O-N 3.08Å; V254-D330 HydrophobicContact CG2-CB 4.03Å; V254-L331 WeakPolarHBondContact CB-O 3.37Å; V254-L331 WeakPolarHBondContact CG1-O 3.2Å; V254-R333 HydrophobicContact CG1-CG 3.62Å; V254-H482 HydrophobicContact CG2-CB 4.17Å; V254-H482 PolarHBondContact O-ND1 3.1Å
255	P	93.3	Very high	90.4	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	148	171.3	-17.2	32	0	0	0	111.7	F224 M228 L251 L331 D361 F362	F224-P255 HydrophobicContact CZ-CB 4.14Å; F224-P255 HydrophobicContact CZ-CG 4.35Å; M228-P255 HydrophobicContact CE-CB 4.35Å; M228-P255 HydrophobicContact CE-CG 3.51Å; L251-P255 HydrophobicContact CD2-CG 4.49Å; P255-L331 HydrophobicContact CB-CB 4.48Å; P255-L331 HydrophobicContact CB-CD1 4.15Å; P255-L331 HydrophobicContact CG-CD1 4.48Å; P255-L331 PolarHBondContact O-N 3.06Å; P255-D361 WeakPolarHBondContact CA-O 3.2Å; P255-F362 HydrophobicContact CB-CB 4.06Å; P255-F362 HydrophobicContact CG-CB 4.34Å
256	R	93.3	Very high	90.5	Very high	28 Å²	28	37.3 Å²	37.3	11%	0.106	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	129.5	177.5	174.1	170.3	-71.6	-179.1	-3.5	110.3	Y328 D330 L360 D361 H482	R256-Y328 HydrophobicContact CG-CD2 4.32Å; R256-D330 WeakPolarHBondContact CB-OD1 3.5Å; R256-D330 WeakPolarHBondContact CG-OD1 3.22Å; R256-D330 IonicContact CZ-OD1 2.69Å; R256-D330 IonicContact CZ-OD2 3.84Å; R256-D330 IonicContact NE-OD1 2.66Å; R256-D330 PolarHBondContact NE-OD1 2.88Å; R256-D330 IonicContact NE-OD2 3.21Å; R256-D330 IonicContact NH2-OD1 3.29Å; R256-D330 PolarHBondContact NH2-OD1 3.32Å; R256-D330 IonicContact NH2-OD2 3.38Å; R256-D330 PolarHBondContact NH2-OD2 3.31Å; R256-L360 WeakPolarHBondContact O-CA 3.22Å; R256-D361 PolarHBondContact N-O 3.33Å; R256-D361 PolarHBondContact O-N 2.87Å; R256-H482 HydrophobicContact CB-CB 4.5Å
257	L	94.8	Very high	90.5	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	131.5	161.6	-76.2	82.3	0	0	0	108.4	Y328 Q329 L331 L342 W350 F359 L360	L257-Y328 CarbonylContact O-C 3.57Å; L257-Y328 WeakPolarHBondContact O-CA 3.34Å; L257-Y328 WeakPolarHBondContact O-CB 3.39Å; L257-Q329 PolarHBondContact N-O 3.39Å; L257-Q329 PolarHBondContact O-N 2.87Å; L257-L331 HydrophobicContact CD1-CD1 3.72Å; L257-L331 HydrophobicContact CD1-CD2 3.96Å; L257-L331 HydrophobicContact CD1-CG 3.72Å; L257-L342 HydrophobicContact CD1-CD2 4.19Å; L257-L342 HydrophobicContact CD2-CD2 3.83Å; L257-W350 HydrophobicContact CB-CH2 3.99Å; L257-W350 HydrophobicContact CB-CZ3 4.33Å; L257-W350 HydrophobicContact CD2-CZ3 4.18Å; L257-F359 CarbonylContact C-O 3.59Å; L257-F359 WeakPolarHBondContact CA-O 3.36Å; L257-L360 HydrophobicContact CD1-CD1 4.4Å; L257-L360 HydrophobicContact CG-CD1 4.38Å
258	R	94.7	Very high	90.7	Very high	1 Å²	1	36 Å²	36	0%	0.004	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	138.7	173.2	178.9	177	68.2	98.3	-3.5	110	M310 G323 G325 Y327 V358 F359	R258-M310 HydrophobicContact CG-CE 4.06Å; R258-G323 PolarHBondContact NH1-O 3.48Å; R258-G325 PolarHBondContact NH1-O 3.13Å; R258-Y327 CarbonylContact C-O 3.48Å; R258-Y327 VanDerWaalsContact CA-O 3.3Å; R258-Y327 WeakPolarHBondContact CA-O 3.4Å; R258-V358 CarbonylContact O-C 3.59Å; R258-V358 WeakPolarHBondContact O-CA 3.22Å; R258-F359 HydrophobicContact CB-CB 4.29Å; R258-F359 PolarHBondContact N-O 2.94Å; R258-F359 PolarHBondContact O-N 3.02Å
259	Q	95	Very high	90.9	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	140.2	-176.4	-178.7	-168.1	22.5	0	0	110.5	K261 Y327 W350 L351 T355 A357 V358	Q259-K261 HydrophobicContact CG-CG 3.96Å; Q259-Y327 PolarHBondContact N-O 2.68Å; Q259-Y327 PolarHBondContact O-N 3.16Å; Q259-W350 HydrophobicContact CB-CH2 3.55Å; Q259-W350 HydrophobicContact CB-CZ2 3.5Å; Q259-W350 VanDerWaalsContact CB-CZ2 3.5Å; Q259-W350 HydrophobicContact CB-CZ3 4.25Å; Q259-W350 HydrophobicContact CG-CH2 4.5Å; Q259-W350 HydrophobicContact CG-CZ2 4.43Å; Q259-W350 PolarHBondContact NE2-O 2.82Å; Q259-W350 PolarHBondContact OE1-O 3.03Å; Q259-L351 HydrophobicContact CG-CD2 4.29Å; Q259-T355 HydrophobicContact CG-CG2 3.8Å; Q259-T355 PolarHBondContact NE2-OG1 2.94Å; Q259-A357 WeakPolarHBondContact CA-O 3.41Å; Q259-V358 HydrophobicContact CG-CG2 4.44Å
260	V	95	Very high	90.9	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	130.2	172.1	179.2	0	0	0	0	109	Y284 Y322 R356 A357 F359	V260-Y284 HydrophobicContact CG1-CD2 3.56Å; V260-Y284 HydrophobicContact CG1-CE2 3.24Å; V260-Y322 HydrophobicContact CG1-CD1 4.35Å; V260-R356 PolarHBondContact O-N 3.36Å; V260-A357 HydrophobicContact CB-CB 4.39Å; V260-A357 PolarHBondContact N-O 3.28Å; V260-F359 HydrophobicContact CG2-CE2 4.03Å
261	K	94.1	Very high	90.9	Very high	6 Å²	6	42 Å²	42	3%	0.026	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	157.4	-175.7	-60.7	-172.9	67.7	168.4	0	111.8	Q259 E289 D290 F294 Y327 D352 G354	Q259-K261 HydrophobicContact CG-CG 3.96Å; K261-E289 WeakPolarHBondContact O-CA 3.41Å; K261-D290 HydrophobicContact CB-CB 4.2Å; K261-D290 PolarHBondContact O-N 3.48Å; K261-F294 HydrophobicContact CD-CD1 4.14Å; K261-F294 HydrophobicContact CD-CE1 3.58Å; K261-F294 HydrophobicContact CD-CE2 4.26Å; K261-F294 HydrophobicContact CD-CZ 3.65Å; K261-Y327 HydrophobicContact CB-CE2 4.12Å; K261-Y327 HydrophobicContact CD-CD2 4.15Å; K261-Y327 HydrophobicContact CD-CE2 3.95Å; K261-Y327 HydrophobicContact CG-CD2 4.18Å; K261-Y327 HydrophobicContact CG-CE2 4.05Å; K261-D352 VanDerWaalsContact CE-OD1 3.22Å; K261-D352 WeakPolarHBondContact CE-OD1 3.26Å; K261-D352 WeakPolarHBondContact CE-OD2 3.46Å; K261-D352 VanDerWaalsContact NZ-CG 3.32Å; K261-D352 IonicContact NZ-OD1 2.62Å; K261-D352 IonicContact NZ-OD2 2.85Å; K261-D352 PolarHBondContact NZ-OD2 3.06Å; K261-G354 WeakPolarHBondContact CA-O 3.47Å
262	V	94.9	Very high	91	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.006	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-120.6	147.8	177.5	167.7	0	0	0	0	109.5	S266 Y281 Y284 N288 G354 R356	V262-S266 WeakPolarHBondContact CG1-OG 3.25Å; V262-Y281 VanDerWaalsContact O-CD1 3.26Å; V262-Y281 WeakPolarHBondContact O-CD1 3.42Å; V262-Y281 WeakPolarHBondContact O-CE1 3.42Å; V262-Y284 HydrophobicContact CG2-CD2 4.04Å; V262-N288 WeakPolarHBondContact CA-O 3.33Å; V262-N288 HydrophobicContact CG1-CB 4.26Å; V262-G354 PolarHBondContact N-O 3.29Å; V262-R356 HydrophobicContact CB-CG 4.31Å; V262-R356 HydrophobicContact CG2-CG 3.62Å
263	R	93.1	Very high	91.2	Very high	116 Å²	116	51.9 Å²	51.9	44%	0.438	27%	0.267	S	S	.	.			trans	-69.4	150.6	-177.4	-58.4	175.4	-161.9	-168.5	0.6	112.5	E265 S266 N288 E289 D290	R263-E265 VanDerWaalsContact C-N 3.33Å; R263-E265 PolarHBondContact O-N 3.28Å; R263-S266 VanDerWaalsContact O-CB 3.26Å; R263-S266 WeakPolarHBondContact O-CB 3.3Å; R263-S266 PolarHBondContact O-N 2.66Å; R263-S266 PolarHBondContact O-OG 3.34Å; R263-N288 PolarHBondContact N-O 2.96Å; R263-N288 VanDerWaalsContact N-O 3.11Å; R263-E289 PolarHBondContact NE-O 3.22Å; R263-E289 PolarHBondContact NH2-O 3.22Å; R263-D290 HydrophobicContact CG-CB 3.83Å
264	N	88.6	Confident	91.1	Very high	52 Å²	52	57.6 Å²	57.6	28%	0.278	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-22.1	-175.7	-168.5	28.9	0	0	0	115.3	D279 C280 Y281	N264-D279 PolarHBondContact ND2-OD1 2.93Å; N264-D279 WeakPolarHBondContact OD1-CA 3.39Å; N264-D279 WeakPolarHBondContact OD1-CB 3.35Å; N264-D279 PolarHBondContact OD1-OD1 3.26Å; N264-C280 CarbonylContact C-O 3.42Å; N264-C280 CarbonylContact O-C 3.51Å; N264-C280 VanDerWaalsContact O-C 3.25Å; N264-C280 WeakPolarHBondContact O-CA 3.36Å; N264-C280 PolarHBondContact O-N 3.01Å; N264-Y281 HydrophobicContact CB-CE1 3.96Å; N264-Y281 HydrophobicContact CB-CE2 4.4Å; N264-Y281 WeakPolarHBondContact OD1-CE2 3.41Å; N264-Y281 PolarHBondContact OD1-OH 3.02Å
265	E	83.4	Confident	91.1	Very high	182 Å²	182	64.2 Å²	64.2	85%	0.85	32%	0.322	S	S	*	.	B	Isolated β-bridge	trans	-111.1	37.3	178.3	-63.5	-179.6	177.2	0	0	110.9	R263	R263-E265 VanDerWaalsContact C-N 3.33Å; R263-E265 PolarHBondContact O-N 3.28Å
266	S	87.2	Confident	90.9	Very high	20 Å²	20	72.1 Å²	72.1	14%	0.14	36%	0.359	C	S	.	.	S	Bend	trans	-87.7	-7	-175.9	54.3	0	0	0	0	114	V262 R263 C280 N282	V262-S266 WeakPolarHBondContact CG1-OG 3.25Å; R263-S266 VanDerWaalsContact O-CB 3.26Å; R263-S266 WeakPolarHBondContact O-CB 3.3Å; R263-S266 PolarHBondContact O-N 2.66Å; R263-S266 PolarHBondContact O-OG 3.34Å; S266-C280 PolarHBondContact N-O 3.42Å; S266-C280 PolarHBondContact OG-O 3.27Å; S266-N282 WeakPolarHBondContact O-CB 3.28Å; S266-N282 PolarHBondContact O-ND2 2.93Å; S266-N282 WeakPolarHBondContact OG-CB 3.5Å; S266-N282 PolarHBondContact OG-N 2.87Å
267	C	87.6	Confident	90.6	Very high	36 Å²	36	73.8 Å²	73.8	24%	0.243	37%	0.372	C	S	.	.	S	Bend	trans	-134	145.8	169	41.9	0	0	0	0	112.1	C280 N282	C267-C280 HydrophobicContact CB-CB 4.19Å; C267-C280 WeakPolarHBondContact CB-SG 3.27Å; C267-C280 PolarHBondContact N-O 3.42Å; C267-C280 VanDerWaalsContact O-CB 3.3Å; C267-C280 WeakPolarHBondContact O-CB 3.12Å; C267-C280 PolarHBondContact O-SG 2.96Å; C267-C280 WeakPolarHBondContact SG-CB 3.4Å; C267-C280 PolarHBondContact SG-O 3.24Å; C267-C280 CovalentContact SG-SG 2.04Å; C267-C280 PolarHBondContact SG-SG 2.88Å; C267-N282 HydrophobicContact CB-CB 3.97Å
268	S	87.1	Confident	90.1	Very high	118 Å²	118	81.8 Å²	81.8	83%	0.825	41%	0.41	S	S	*	.			trans	-84.6	114.1	173.9	44	0	0	0	0	110.4
269	V	89.1	Confident	89.8	Confident	27 Å²	27	84.5 Å²	84.5	16%	0.164	42%	0.424	C	S	.	.			trans	-72.1	137.7	171.6	-177.4	0	0	0	0	109.7	L273 R274 V277 C280	V269-L273 HydrophobicContact CG1-CB 4.13Å; V269-R274 HydrophobicContact CB-CG 4.23Å; V269-R274 HydrophobicContact CG1-CG 4.22Å; V269-R274 PolarHBondContact O-NE 3.01Å; V269-V277 HydrophobicContact CG1-CB 4.08Å; V269-V277 HydrophobicContact CG2-CB 4.41Å; V269-V277 HydrophobicContact CG2-CG1 4.02Å; V269-C280 HydrophobicContact CG2-CB 3.71Å
270	H	90.8	Very high	89.5	Confident	123 Å²	123	85.6 Å²	85.6	57%	0.569	43%	0.432	S	S	*	.			trans	-58.5	142.2	174.8	-166	-93.2	0	0	0	110.8	D272 L273 R274	H270-D272 VanDerWaalsContact C-N 3.31Å; H270-D272 IonicContact CE1-OD2 3.47Å; H270-D272 PolarHBondContact CE1-OD2 3.47Å; H270-D272 IonicContact ND1-OD2 2.73Å; H270-D272 PolarHBondContact ND1-OD2 3.05Å; H270-D272 VanDerWaalsContact ND1-OD2 3.13Å; H270-D272 PolarHBondContact O-N 3.44Å; H270-L273 PolarHBondContact O-N 3.03Å; H270-R274 PolarHBondContact O-N 3.47Å
271	E	89.4	Confident	89.4	Confident	133 Å²	133	87.8 Å²	87.8	62%	0.621	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-59	-42.7	-165.1	-45	-144.7	118.4	0	0	112.2	L273 R274	E271-L273 PolarHBondContact O-N 3.26Å; E271-L273 VanDerWaalsContact O-N 3.07Å; E271-R274 PolarHBondContact O-N 3.31Å; E271-R274 IonicContact OE1-CZ 2.74Å; E271-R274 VanDerWaalsContact OE1-CZ 3.25Å; E271-R274 IonicContact OE1-NH1 3.78Å; E271-R274 PolarHBondContact OE1-NH1 3.13Å; E271-R274 IonicContact OE1-NH2 3.13Å; E271-R274 PolarHBondContact OE1-NH2 2.72Å
272	D	92.4	Very high	89.3	Confident	136 Å²	136	90.2 Å²	90.2	73%	0.727	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-59.7	-17	178.3	-50	-34.3	0	0	0	115.3	H270	H270-D272 VanDerWaalsContact C-N 3.31Å; H270-D272 IonicContact CE1-OD2 3.47Å; H270-D272 PolarHBondContact CE1-OD2 3.47Å; H270-D272 IonicContact ND1-OD2 2.73Å; H270-D272 PolarHBondContact ND1-OD2 3.05Å; H270-D272 VanDerWaalsContact ND1-OD2 3.13Å; H270-D272 PolarHBondContact O-N 3.44Å
273	L	92.4	Very high	89.2	Confident	99 Å²	99	94.5 Å²	94.5	52%	0.518	48%	0.476	S	S	.	.	G	3₁₀ helix	trans	-116	4.9	-175.9	-65.4	177	0	0	0	113.4	V269 H270 E271 D275 E276 V277	V269-L273 HydrophobicContact CG1-CB 4.13Å; H270-L273 PolarHBondContact O-N 3.03Å; E271-L273 PolarHBondContact O-N 3.26Å; E271-L273 VanDerWaalsContact O-N 3.07Å; L273-D275 VanDerWaalsContact C-N 3.28Å; L273-D275 PolarHBondContact O-N 3.17Å; L273-E276 PolarHBondContact O-N 3.31Å; L273-V277 PolarHBondContact O-N 3.1Å
274	R	86.3	Confident	89.2	Confident	123 Å²	123	89.5 Å²	89.5	46%	0.464	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-28.7	-178.4	-72.1	-176.5	-176.9	154.5	6.6	113.8	V269 H270 E271 E276	V269-R274 HydrophobicContact CB-CG 4.23Å; V269-R274 HydrophobicContact CG1-CG 4.22Å; V269-R274 PolarHBondContact O-NE 3.01Å; H270-R274 PolarHBondContact O-N 3.47Å; E271-R274 PolarHBondContact O-N 3.31Å; E271-R274 IonicContact OE1-CZ 2.74Å; E271-R274 VanDerWaalsContact OE1-CZ 3.25Å; E271-R274 IonicContact OE1-NH1 3.78Å; E271-R274 PolarHBondContact OE1-NH1 3.13Å; E271-R274 IonicContact OE1-NH2 3.13Å; E271-R274 PolarHBondContact OE1-NH2 2.72Å; R274-E276 VanDerWaalsContact C-N 3.33Å
275	D	89.6	Confident	89.4	Confident	147 Å²	147	89.4 Å²	89.4	79%	0.786	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-33.9	177.9	-66.9	-21.7	0	0	0	111.9	L273	L273-D275 VanDerWaalsContact C-N 3.28Å; L273-D275 PolarHBondContact O-N 3.17Å
276	E	90.4	Very high	89.7	Confident	166 Å²	166	86 Å²	86	78%	0.776	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-34.6	179.8	-65.2	-68.4	164.1	0	0	112.7	L273 R274	L273-E276 PolarHBondContact O-N 3.31Å; R274-E276 VanDerWaalsContact C-N 3.33Å
277	V	87.1	Confident	89.9	Confident	63 Å²	63	89.1 Å²	89.1	38%	0.382	47%	0.474	S	S	.	.			trans	-118.8	88.2	-175.5	-172.5	0	0	0	0	110.6	V269 L273	V269-V277 HydrophobicContact CG1-CB 4.08Å; V269-V277 HydrophobicContact CG2-CB 4.41Å; V269-V277 HydrophobicContact CG2-CG1 4.02Å; L273-V277 PolarHBondContact O-N 3.1Å
278	Q	83.6	Confident	90.1	Very high	169 Å²	169	89.1 Å²	89.1	79%	0.79	47%	0.471	S	S	*	.			trans	-77.5	-25.3	-179.8	-62.2	176.7	12.8	0	0	113.6
279	D	87.7	Confident	90.4	Very high	57 Å²	57	84.1 Å²	84.1	31%	0.305	44%	0.435	S	S	.	.			trans	-121.9	127.6	-170.1	-78.4	-15.2	0	0	0	110.7	N264 Y281 R353	N264-D279 PolarHBondContact ND2-OD1 2.93Å; N264-D279 WeakPolarHBondContact OD1-CA 3.39Å; N264-D279 WeakPolarHBondContact OD1-CB 3.35Å; N264-D279 PolarHBondContact OD1-OD1 3.26Å; D279-Y281 HydrophobicContact CB-CE2 4.24Å; D279-R353 PolarHBondContact O-NH2 2.63Å; D279-R353 IonicContact OD2-CZ 3.28Å; D279-R353 IonicContact OD2-NH1 2.91Å; D279-R353 PolarHBondContact OD2-NH1 2.95Å
280	C	90.2	Very high	90.6	Very high	24 Å²	24	84.4 Å²	84.4	16%	0.162	44%	0.435	C	S	.	.	B	Isolated β-bridge	trans	-135.3	106.5	-173.9	-158.9	0	0	0	0	114.1	N264 S266 C267 V269	N264-C280 CarbonylContact C-O 3.42Å; N264-C280 CarbonylContact O-C 3.51Å; N264-C280 VanDerWaalsContact O-C 3.25Å; N264-C280 WeakPolarHBondContact O-CA 3.36Å; N264-C280 PolarHBondContact O-N 3.01Å; S266-C280 PolarHBondContact N-O 3.42Å; S266-C280 PolarHBondContact OG-O 3.27Å; C267-C280 HydrophobicContact CB-CB 4.19Å; C267-C280 WeakPolarHBondContact CB-SG 3.27Å; C267-C280 PolarHBondContact N-O 3.42Å; C267-C280 VanDerWaalsContact O-CB 3.3Å; C267-C280 WeakPolarHBondContact O-CB 3.12Å; C267-C280 PolarHBondContact O-SG 2.96Å; C267-C280 WeakPolarHBondContact SG-CB 3.4Å; C267-C280 PolarHBondContact SG-O 3.24Å; C267-C280 CovalentContact SG-SG 2.04Å; C267-C280 PolarHBondContact SG-SG 2.88Å; V269-C280 HydrophobicContact CG2-CB 3.71Å
281	Y	92.4	Very high	90.7	Very high	45 Å²	45	81.8 Å²	81.8	18%	0.176	43%	0.428	C	S	.	.			trans	-103.8	112.4	179.1	-60.9	-94.3	0	0	0	111.3	V262 N264 D279 R353 G354 R356	V262-Y281 VanDerWaalsContact O-CD1 3.26Å; V262-Y281 WeakPolarHBondContact O-CD1 3.42Å; V262-Y281 WeakPolarHBondContact O-CE1 3.42Å; N264-Y281 HydrophobicContact CB-CE1 3.96Å; N264-Y281 HydrophobicContact CB-CE2 4.4Å; N264-Y281 WeakPolarHBondContact OD1-CE2 3.41Å; N264-Y281 PolarHBondContact OD1-OH 3.02Å; D279-Y281 HydrophobicContact CB-CE2 4.24Å; Y281-R353 HydrophobicContact CD2-CG 3.91Å; Y281-R353 HydrophobicContact CE2-CG 3.47Å; Y281-R353 VanDerWaalsContact CE2-CG 3.47Å; Y281-G354 VanDerWaalsContact CE1-CA 3.43Å; Y281-R356 PolarHBondContact O-NH2 3.45Å
282	N	92.1	Very high	90.8	Very high	58 Å²	58	77.8 Å²	77.8	31%	0.31	42%	0.418	S	S	.	.			trans	-77.7	-178.3	-177.3	-153.7	-19.2	0	0	0	112.4	S266 C267 R356	S266-N282 WeakPolarHBondContact O-CB 3.28Å; S266-N282 PolarHBondContact O-ND2 2.93Å; S266-N282 WeakPolarHBondContact OG-CB 3.5Å; S266-N282 PolarHBondContact OG-N 2.87Å; C267-N282 HydrophobicContact CB-CB 3.97Å; N282-R356 PolarHBondContact O-NE 3.06Å; N282-R356 PolarHBondContact O-NH2 3.41Å
283	I	92.4	Very high	90.8	Very high	90 Å²	90	74.8 Å²	74.8	46%	0.462	41%	0.406	S	S	.	.			trans	-62.8	150.9	167.8	-57.6	170.8	0	0	0	109.2	T285 A383	I283-T285 PolarHBondContact O-N 3.43Å; I283-A383 HydrophobicContact CG1-CB 3.9Å
284	Y	94	Very high	90.7	Very high	12 Å²	12	71.7 Å²	71.7	5%	0.047	39%	0.388	C	S	.	.			trans	-64.5	125.6	176.2	177.5	-97.5	0	0	0	111.3	V260 V262 E289 K321 Y322 G323	V260-Y284 HydrophobicContact CG1-CD2 3.56Å; V260-Y284 HydrophobicContact CG1-CE2 3.24Å; V262-Y284 HydrophobicContact CG2-CD2 4.04Å; Y284-E289 HydrophobicContact CE2-CB 3.94Å; Y284-E289 HydrophobicContact CE2-CG 4.06Å; Y284-E289 WeakPolarHBondContact CE2-OE2 3.49Å; Y284-E289 PolarHBondContact OH-OE2 2.91Å; Y284-K321 VanDerWaalsContact CE1-O 3.22Å; Y284-K321 WeakPolarHBondContact CE1-O 3.44Å; Y284-Y322 AromaticContact CD1-CD1 3.71Å; Y284-Y322 HydrophobicContact CD1-CD1 3.71Å; Y284-Y322 HydrophobicContact CD1-CE1 4.11Å; Y284-Y322 HydrophobicContact CD2-CD1 4.4Å; Y284-Y322 HydrophobicContact CE1-CD1 4.05Å; Y284-Y322 AromaticContact CG-CD1 3.9Å; Y284-Y322 HydrophobicContact CG-CD1 3.9Å; Y284-Y322 HydrophobicContact CG-CE1 4.03Å; Y284-G323 PolarHBondContact OH-N 2.86Å; Y284-G323 VanDerWaalsContact OH-N 3.1Å
285	T	92.1	Very high	90.8	Very high	49 Å²	49	68.3 Å²	68.3	30%	0.301	39%	0.392	S	S	.	.			trans	-137.2	153.4	163.2	63.4	0	0	0	0	108.4	I283 S287 N288 E289	I283-T285 PolarHBondContact O-N 3.43Å; T285-S287 PolarHBondContact O-N 3.07Å; T285-S287 PolarHBondContact OG1-OG 3.02Å; T285-N288 PolarHBondContact O-N 2.95Å; T285-N288 WeakPolarHBondContact OG1-CB 3.1Å; T285-N288 PolarHBondContact OG1-N 3.47Å; T285-N288 PolarHBondContact OG1-ND2 3Å; T285-N288 PolarHBondContact OG1-OD1 3.07Å; T285-E289 PolarHBondContact O-N 3.47Å
286	P	90.4	Very high	90.6	Very high	111 Å²	111	64.1 Å²	64.1	72%	0.721	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-18.8	176.2	-26.1	35.5	0	0	0	114.6
287	S	90.9	Very high	90	Very high	85 Å²	85	60.6 Å²	60.6	59%	0.594	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-29.6	173.9	60.6	0	0	0	0	113.5	T285	T285-S287 PolarHBondContact O-N 3.07Å; T285-S287 PolarHBondContact OG1-OG 3.02Å
288	N	92.3	Very high	89.9	Confident	36 Å²	36	63.3 Å²	63.3	19%	0.193	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-2.8	-170.7	-62	3.5	0	0	0	112.4	V262 R263 T285 D290	V262-N288 WeakPolarHBondContact CA-O 3.33Å; V262-N288 HydrophobicContact CG1-CB 4.26Å; R263-N288 PolarHBondContact N-O 2.96Å; R263-N288 VanDerWaalsContact N-O 3.11Å; T285-N288 PolarHBondContact O-N 2.95Å; T285-N288 WeakPolarHBondContact OG1-CB 3.1Å; T285-N288 PolarHBondContact OG1-N 3.47Å; T285-N288 PolarHBondContact OG1-ND2 3Å; T285-N288 PolarHBondContact OG1-OD1 3.07Å; N288-D290 PolarHBondContact O-N 2.99Å
289	E	93.1	Very high	89.9	Confident	14 Å²	14	57.3 Å²	57.3	7%	0.065	36%	0.355	C	S	.	.	B	Isolated β-bridge	trans	-58.1	131.9	176.6	-175.9	155.4	-163.5	0	0	111.3	K261 R263 Y284 T285 Y304	K261-E289 WeakPolarHBondContact O-CA 3.41Å; R263-E289 PolarHBondContact NE-O 3.22Å; R263-E289 PolarHBondContact NH2-O 3.22Å; Y284-E289 HydrophobicContact CE2-CB 3.94Å; Y284-E289 HydrophobicContact CE2-CG 4.06Å; Y284-E289 WeakPolarHBondContact CE2-OE2 3.49Å; Y284-E289 PolarHBondContact OH-OE2 2.91Å; T285-E289 PolarHBondContact O-N 3.47Å; E289-Y304 HydrophobicContact CG-CE2 4.27Å
290	D	93.5	Very high	90.1	Very high	32 Å²	32	57.1 Å²	57.1	17%	0.171	36%	0.356	C	S	.	.			trans	-81.9	130.2	175	-163.6	2.6	0	0	0	110.3	K261 R263 N288 A292 Y304 Y327	K261-D290 HydrophobicContact CB-CB 4.2Å; K261-D290 PolarHBondContact O-N 3.48Å; R263-D290 HydrophobicContact CG-CB 3.83Å; N288-D290 PolarHBondContact O-N 2.99Å; D290-A292 WeakPolarHBondContact OD1-CB 3.43Å; D290-A292 PolarHBondContact OD1-N 3.5Å; D290-Y304 WeakPolarHBondContact O-CD2 3.25Å; D290-Y327 PolarHBondContact O-OH 3.33Å
291	T	92.4	Very high	90.1	Very high	69 Å²	69	56 Å²	56	42%	0.423	35%	0.348	S	S	.	.			trans	-122.3	2.1	-179.9	65.6	0	0	0	0	111.7	Y304	T291-Y304 HydrophobicContact CG2-CD1 4.05Å; T291-Y304 HydrophobicContact CG2-CD2 4.25Å; T291-Y304 HydrophobicContact CG2-CE1 3.85Å; T291-Y304 HydrophobicContact CG2-CE2 4.07Å; T291-Y304 HydrophobicContact CG2-CG 4.26Å; T291-Y304 WeakPolarHBondContact O-CB 3.39Å
292	A	91.6	Very high	90.2	Very high	48 Å²	48	53.9 Å²	53.9	40%	0.397	34%	0.34	S	S	.	.	S	Bend	trans	-78.7	145.1	177.9	0	0	0	0	0	110.7	D290 Y327	D290-A292 WeakPolarHBondContact OD1-CB 3.43Å; D290-A292 PolarHBondContact OD1-N 3.5Å; A292-Y327 WeakPolarHBondContact O-CE1 3.44Å; A292-Y327 PolarHBondContact O-OH 3.48Å
293	P	91.7	Very high	90.3	Very high	74 Å²	74	54.3 Å²	54.3	48%	0.481	35%	0.345	S	S	.	.			trans	-68.2	142.9	171.8	30.8	-35	0	0	0	110.5	W302	P293-W302 WeakPolarHBondContact CA-O 3.25Å
294	F	90.6	Very high	90.3	Very high	33 Å²	33	52.6 Å²	52.6	15%	0.145	33%	0.333	C	S	.	.			trans	-134.1	162	-176	78.8	-81.2	0	0	0	113.4	K261 N297 W302 Y327 W350	K261-F294 HydrophobicContact CD-CD1 4.14Å; K261-F294 HydrophobicContact CD-CE1 3.58Å; K261-F294 HydrophobicContact CD-CE2 4.26Å; K261-F294 HydrophobicContact CD-CZ 3.65Å; F294-N297 PolarHBondContact N-OD1 3.1Å; F294-N297 PolarHBondContact O-OD1 3.14Å; F294-W302 HydrophobicContact CD1-CE3 4.46Å; F294-W302 AromaticContact CD2-CE3 3.75Å; F294-W302 HydrophobicContact CD2-CE3 3.75Å; F294-W302 AromaticContact CD2-CZ3 3.78Å; F294-W302 HydrophobicContact CD2-CZ3 3.78Å; F294-W302 HydrophobicContact CE1-CE3 4.28Å; F294-W302 AromaticContact CE2-CE3 3.56Å; F294-W302 HydrophobicContact CE2-CE3 3.56Å; F294-W302 AromaticContact CE2-CZ3 3.38Å; F294-W302 HydrophobicContact CE2-CZ3 3.38Å; F294-W302 HydrophobicContact CG-CE3 4.22Å; F294-W302 AromaticContact CZ-CE3 3.83Å; F294-W302 HydrophobicContact CZ-CE3 3.83Å; F294-W302 AromaticContact CZ-CZ3 3.98Å; F294-W302 HydrophobicContact CZ-CZ3 3.98Å; F294-W302 PolarHBondContact N-O 3.39Å; F294-W302 VanDerWaalsContact N-O 3.08Å; F294-W302 WeakPolarHBondContact O-CB 3.15Å; F294-Y327 AromaticContact CD1-CD1 3.92Å; F294-Y327 HydrophobicContact CD1-CD1 3.92Å; F294-Y327 AromaticContact CD1-CE1 3.57Å; F294-Y327 HydrophobicContact CD1-CE1 3.57Å; F294-Y327 HydrophobicContact CD1-CE2 4.48Å; F294-Y327 HydrophobicContact CD1-CG 4.48Å; F294-Y327 AromaticContact CD1-CZ 3.89Å; F294-Y327 AromaticContact CE1-CD1 3.61Å; F294-Y327 HydrophobicContact CE1-CD1 3.61Å; F294-Y327 HydrophobicContact CE1-CD2 4.08Å; F294-Y327 AromaticContact CE1-CE1 3.72Å; F294-Y327 HydrophobicContact CE1-CE1 3.72Å; F294-Y327 HydrophobicContact CE1-CE2 4.22Å; F294-Y327 AromaticContact CE1-CG 3.78Å; F294-Y327 HydrophobicContact CE1-CG 3.78Å; F294-W350 AromaticContact CZ-CD1 3.68Å; F294-W350 AromaticContact CZ-NE1 3.97Å
295	G	87.6	Confident	90.2	Very high	53 Å²	53	53.2 Å²	53.2	55%	0.546	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.6	-143.4	177.5	0	0	0	0	0	113.2	N297	G295-N297 PolarHBondContact O-N 3.28Å; G295-N297 VanDerWaalsContact O-N 3.13Å
296	P	85.7	Confident	90.2	Very high	58 Å²	58	53.4 Å²	53.4	38%	0.377	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	1.1	-176.3	29.3	-36.6	0	0	0	115.1	N298 W302 F344	P296-N298 PolarHBondContact O-N 3.44Å; P296-W302 HydrophobicContact CG-CD2 3.98Å; P296-W302 HydrophobicContact CG-CG 4.34Å; P296-W302 HydrophobicContact CG-CH2 4.4Å; P296-W302 HydrophobicContact CG-CZ2 3.83Å; P296-F344 HydrophobicContact CG-CZ 4.4Å
297	N	79.4	Confident	90.2	Very high	92 Å²	92	52 Å²	52	49%	0.492	32%	0.323	S	S	.	.			trans	50.3	27.7	178.3	-68.2	-11.7	0	0	0	115.1	F294 G295	F294-N297 PolarHBondContact N-OD1 3.1Å; F294-N297 PolarHBondContact O-OD1 3.14Å; G295-N297 PolarHBondContact O-N 3.28Å; G295-N297 VanDerWaalsContact O-N 3.13Å
298	N	83.2	Confident	89.9	Confident	120 Å²	120	52.5 Å²	52.5	64%	0.642	33%	0.326	S	S	*	.			trans	-116	101.7	-172	-172.8	11.8	0	0	0	111.3	P296 W302	P296-N298 PolarHBondContact O-N 3.44Å; N298-W302 VanDerWaalsContact O-CD1 3.23Å
299	G	85.3	Confident	89.7	Confident	44 Å²	44	57 Å²	57	45%	0.454	35%	0.346	S	S	.	.	S	Bend	trans	90.8	179.4	-177.6	0	0	0	0	0	114.3	A301 W302	G299-A301 VanDerWaalsContact C-N 3.27Å; G299-A301 PolarHBondContact O-N 3.46Å; G299-W302 PolarHBondContact O-N 3.25Å
300	T	90.4	Very high	89.2	Confident	52 Å²	52	56.8 Å²	56.8	32%	0.319	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-18.5	-170.7	59.2	0	0	0	0	114.4	W302 Y328	T300-W302 PolarHBondContact O-N 2.77Å; T300-Y328 CarbonylContact C-O 3.57Å; T300-Y328 WeakPolarHBondContact CB-O 3.36Å; T300-Y328 HydrophobicContact CG2-CE1 4.21Å; T300-Y328 PolarHBondContact O-N 3.17Å; T300-Y328 PolarHBondContact OG1-O 3.37Å
301	A	91.8	Very high	88.8	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-17.8	179.7	0	0	0	0	0	113.7	G299 Y327 Y328 Q329 L345 W350	G299-A301 VanDerWaalsContact C-N 3.27Å; G299-A301 PolarHBondContact O-N 3.46Å; A301-Y327 WeakPolarHBondContact O-CB 3.33Å; A301-Y328 WeakPolarHBondContact CA-O 3.26Å; A301-Y328 PolarHBondContact N-O 3.2Å; A301-Y328 VanDerWaalsContact N-O 3.12Å; A301-Q329 HydrophobicContact CB-CB 4Å; A301-L345 HydrophobicContact CB-CD2 3.83Å; A301-W350 PolarHBondContact O-NE1 3.26Å
302	W	93	Very high	88.3	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.008	35%	0.35	C	S	.	.	S	Bend	trans	-119.2	-9.3	-169	-58.2	103.3	0	0	0	113.2	P293 F294 P296 N298 G299 T300 F344 L345 H348 W350	P293-W302 WeakPolarHBondContact CA-O 3.25Å; F294-W302 HydrophobicContact CD1-CE3 4.46Å; F294-W302 AromaticContact CD2-CE3 3.75Å; F294-W302 HydrophobicContact CD2-CE3 3.75Å; F294-W302 AromaticContact CD2-CZ3 3.78Å; F294-W302 HydrophobicContact CD2-CZ3 3.78Å; F294-W302 HydrophobicContact CE1-CE3 4.28Å; F294-W302 AromaticContact CE2-CE3 3.56Å; F294-W302 HydrophobicContact CE2-CE3 3.56Å; F294-W302 AromaticContact CE2-CZ3 3.38Å; F294-W302 HydrophobicContact CE2-CZ3 3.38Å; F294-W302 HydrophobicContact CG-CE3 4.22Å; F294-W302 AromaticContact CZ-CE3 3.83Å; F294-W302 HydrophobicContact CZ-CE3 3.83Å; F294-W302 AromaticContact CZ-CZ3 3.98Å; F294-W302 HydrophobicContact CZ-CZ3 3.98Å; F294-W302 PolarHBondContact N-O 3.39Å; F294-W302 VanDerWaalsContact N-O 3.08Å; F294-W302 WeakPolarHBondContact O-CB 3.15Å; P296-W302 HydrophobicContact CG-CD2 3.98Å; P296-W302 HydrophobicContact CG-CG 4.34Å; P296-W302 HydrophobicContact CG-CH2 4.4Å; P296-W302 HydrophobicContact CG-CZ2 3.83Å; N298-W302 VanDerWaalsContact O-CD1 3.23Å; G299-W302 PolarHBondContact O-N 3.25Å; T300-W302 PolarHBondContact O-N 2.77Å; W302-F344 HydrophobicContact CZ2-CE1 4.29Å; W302-L345 HydrophobicContact CZ2-CD2 4.07Å; W302-H348 HydrophobicContact CH2-CB 3.56Å; W302-H348 WeakPolarHBondContact CH2-O 3.21Å; W302-H348 HydrophobicContact CZ2-CB 3.73Å; W302-W350 AromaticContact CE3-CD1 3.97Å; W302-W350 HydrophobicContact CH2-CB 3.82Å; W302-W350 AromaticContact CH2-CD1 3.89Å; W302-W350 HydrophobicContact CH2-CG 4.29Å; W302-W350 HydrophobicContact CZ2-CB 4.4Å; W302-W350 HydrophobicContact CZ3-CB 4.27Å; W302-W350 AromaticContact CZ3-CD1 3.79Å; W302-W350 HydrophobicContact CZ3-CG 4.47Å
303	V	93.8	Very high	88.1	Confident	67 Å²	67	57 Å²	57	41%	0.406	34%	0.341	S	S	.	.	S	Bend	trans	-110.2	128.5	178.1	-178.5	0	0	0	0	108.2
304	Y	93.3	Very high	88	Confident	53 Å²	53	55.5 Å²	55.5	21%	0.208	33%	0.332	C	S	.	.			trans	-67.9	132.6	177.2	-179.7	-90.7	0	0	0	110.3	E289 D290 T291 T306 Y327	E289-Y304 HydrophobicContact CG-CE2 4.27Å; D290-Y304 WeakPolarHBondContact O-CD2 3.25Å; T291-Y304 HydrophobicContact CG2-CD1 4.05Å; T291-Y304 HydrophobicContact CG2-CD2 4.25Å; T291-Y304 HydrophobicContact CG2-CE1 3.85Å; T291-Y304 HydrophobicContact CG2-CE2 4.07Å; T291-Y304 HydrophobicContact CG2-CG 4.26Å; T291-Y304 WeakPolarHBondContact O-CB 3.39Å; Y304-T306 HydrophobicContact CE1-CG2 4.35Å; Y304-Y327 HydrophobicContact CD2-CE2 4.07Å
305	T	92.8	Very high	88	Confident	25 Å²	25	56 Å²	56	15%	0.153	33%	0.334	C	S	.	.	B	Isolated β-bridge	trans	-119.3	148.4	171	59	0	0	0	0	111.9	M310 G325 G326 Y328	T305-M310 WeakPolarHBondContact OG1-CE 3.48Å; T305-M310 WeakPolarHBondContact OG1-CG 3.38Å; T305-G325 WeakPolarHBondContact O-CA 3.45Å; T305-G326 PolarHBondContact N-O 3Å; T305-G326 PolarHBondContact O-N 3.4Å; T305-G326 VanDerWaalsContact O-N 3.09Å; T305-Y328 HydrophobicContact CG2-CE1 4Å; T305-Y328 WeakPolarHBondContact OG1-CE1 3.33Å
306	T	92.2	Very high	88.2	Confident	53 Å²	53	62.6 Å²	62.6	33%	0.325	34%	0.342	S	S	.	.			trans	-81.2	156.2	-172.8	64.3	0	0	0	0	112.3	Y304 S308 E309 M310	Y304-T306 HydrophobicContact CE1-CG2 4.35Å; T306-S308 PolarHBondContact O-N 2.93Å; T306-S308 PolarHBondContact OG1-OG 3.11Å; T306-S308 VanDerWaalsContact OG1-OG 3.08Å; T306-E309 WeakPolarHBondContact CB-OE2 3.46Å; T306-E309 PolarHBondContact N-OE2 3.06Å; T306-E309 PolarHBondContact O-N 2.87Å; T306-E309 VanDerWaalsContact OG1-CG 3.29Å; T306-E309 WeakPolarHBondContact OG1-CG 3.36Å; T306-E309 PolarHBondContact OG1-N 3.03Å; T306-E309 PolarHBondContact OG1-OE2 2.9Å; T306-M310 PolarHBondContact O-N 3.17Å
307	E	88.7	Confident	88.4	Confident	82 Å²	82	60.9 Å²	60.9	38%	0.383	34%	0.335	S	S	.	.	H	α-helix	trans	-53.2	-38.8	177.2	-177.8	164.9	-168.3	0	0	112.4	M310 N311 S312 S313 S314	E307-M310 PolarHBondContact O-N 2.75Å; E307-N311 PolarHBondContact O-N 2.71Å; E307-N311 VanDerWaalsContact O-N 3.09Å; E307-S312 VanDerWaalsContact CG-O 3.25Å; E307-S312 WeakPolarHBondContact CG-O 3.41Å; E307-S312 PolarHBondContact O-N 2.81Å; E307-S313 VanDerWaalsContact OE1-CA 3.32Å; E307-S313 WeakPolarHBondContact OE1-CA 3.25Å; E307-S314 PolarHBondContact OE1-N 3.27Å
308	S	86.1	Confident	88.7	Confident	95 Å²	95	62.6 Å²	62.6	66%	0.664	34%	0.34	S	S	*	.	H	α-helix	trans	-67	-33.9	176.4	39.9	0	0	0	0	114.5	T306	T306-S308 PolarHBondContact O-N 2.93Å; T306-S308 PolarHBondContact OG1-OG 3.11Å; T306-S308 VanDerWaalsContact OG1-OG 3.08Å
309	E	87.3	Confident	89	Confident	131 Å²	131	60.1 Å²	60.1	61%	0.612	33%	0.329	S	S	*	.	H	α-helix	trans	-78.6	-35.4	177.6	-68.7	162.2	139.7	0	0	111	T306 N311	T306-E309 WeakPolarHBondContact CB-OE2 3.46Å; T306-E309 PolarHBondContact N-OE2 3.06Å; T306-E309 PolarHBondContact O-N 2.87Å; T306-E309 VanDerWaalsContact OG1-CG 3.29Å; T306-E309 WeakPolarHBondContact OG1-CG 3.36Å; T306-E309 PolarHBondContact OG1-N 3.03Å; T306-E309 PolarHBondContact OG1-OE2 2.9Å; E309-N311 VanDerWaalsContact C-N 3.33Å
310	M	83.1	Confident	89.2	Confident	9 Å²	9	59.2 Å²	59.2	4%	0.044	32%	0.316	C	S	.	.	H	α-helix	trans	-73.1	-20.5	176.7	-72.9	-173	156.1	0	0	114	R258 T305 T306 E307 S312 G326 Y328	R258-M310 HydrophobicContact CG-CE 4.06Å; T305-M310 WeakPolarHBondContact OG1-CE 3.48Å; T305-M310 WeakPolarHBondContact OG1-CG 3.38Å; T306-M310 PolarHBondContact O-N 3.17Å; E307-M310 PolarHBondContact O-N 2.75Å; M310-S312 PolarHBondContact O-N 3.14Å; M310-G326 WeakPolarHBondContact CE-O 3.17Å; M310-Y328 HydrophobicContact CE-CD1 3.37Å; M310-Y328 HydrophobicContact CE-CE1 4.22Å; M310-Y328 HydrophobicContact CE-CG 3.8Å
311	N	84	Confident	89.3	Confident	107 Å²	107	61.1 Å²	61.1	57%	0.572	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	32.3	-166.7	-65.6	-73.7	0	0	0	113.1	E307 E309 P487	E307-N311 PolarHBondContact O-N 2.71Å; E307-N311 VanDerWaalsContact O-N 3.09Å; E309-N311 VanDerWaalsContact C-N 3.33Å; N311-P487 WeakPolarHBondContact O-CG 3.47Å
312	S	83.2	Confident	89.4	Confident	17 Å²	17	61.4 Å²	61.4	12%	0.119	32%	0.321	C	S	.	.			trans	-98.1	170.5	177	-85.1	0	0	0	0	110.8	E307 M310 G324 E486	E307-S312 VanDerWaalsContact CG-O 3.25Å; E307-S312 WeakPolarHBondContact CG-O 3.41Å; E307-S312 PolarHBondContact O-N 2.81Å; M310-S312 PolarHBondContact O-N 3.14Å; S312-G324 VanDerWaalsContact CB-O 3.25Å; S312-G324 WeakPolarHBondContact CB-O 3.35Å; S312-E486 PolarHBondContact OG-OE2 3.07Å
313	S	86.2	Confident	89.3	Confident	30 Å²	30	62 Å²	62	21%	0.21	33%	0.327	C	S	.	.			trans	-124.7	155.6	178.5	55.4	0	0	0	0	111.9	E307 Y315 E486	E307-S313 VanDerWaalsContact OE1-CA 3.32Å; E307-S313 WeakPolarHBondContact OE1-CA 3.25Å; S313-Y315 PolarHBondContact O-N 3.41Å; S313-E486 PolarHBondContact N-OE2 3.07Å; S313-E486 VanDerWaalsContact O-OE1 3.06Å; S313-E486 PolarHBondContact OG-OE1 3.41Å
314	S	90.9	Very high	89.1	Confident	43 Å²	43	58.8 Å²	58.8	30%	0.301	31%	0.308	S	S	.	.			trans	-55.9	131.2	169.8	74.2	0	0	0	0	112.1	E307 K321 Y322	E307-S314 PolarHBondContact OE1-N 3.27Å; S314-K321 WeakPolarHBondContact OG-CE 3.15Å; S314-K321 PolarHBondContact OG-NZ 3.25Å; S314-K321 VanDerWaalsContact OG-NZ 3.11Å; S314-Y322 CarbonylContact C-O 3.59Å; S314-Y322 WeakPolarHBondContact CA-O 3.35Å; S314-Y322 WeakPolarHBondContact CB-O 3.41Å
315	Y	90.9	Very high	89	Confident	43 Å²	43	56.4 Å²	56.4	17%	0.169	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	140.4	-178.5	-172.4	-98.3	0	0	0	111.6	S313 K321 Y322 F359 L378	S313-Y315 PolarHBondContact O-N 3.41Å; Y315-K321 CarbonylContact O-C 3.57Å; Y315-K321 WeakPolarHBondContact O-CA 3.49Å; Y315-Y322 PolarHBondContact N-O 3.44Å; Y315-Y322 PolarHBondContact O-N 3.29Å; Y315-F359 AromaticContact CD1-CE1 3.74Å; Y315-F359 HydrophobicContact CD1-CE1 3.74Å; Y315-F359 HydrophobicContact CD1-CZ 4.49Å; Y315-F359 HydrophobicContact CE1-CE1 4.5Å; Y315-F359 HydrophobicContact CG-CE1 4.02Å; Y315-L378 HydrophobicContact CD1-CD2 3.73Å; Y315-L378 HydrophobicContact CE1-CD2 3.51Å
316	W	90.4	Very high	89	Confident	191 Å²	191	55.2 Å²	55.2	72%	0.723	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	108	174.8	-71.2	87.4	0	0	0	109.6	K321	W316-K321 HydrophobicContact CD2-CB 4.14Å; W316-K321 HydrophobicContact CD2-CD 4.01Å; W316-K321 HydrophobicContact CD2-CG 3.82Å; W316-K321 HydrophobicContact CE3-CB 3.95Å; W316-K321 HydrophobicContact CE3-CD 4.41Å; W316-K321 HydrophobicContact CE3-CG 4.16Å; W316-K321 HydrophobicContact CG-CG 4.12Å; W316-K321 HydrophobicContact CH2-CD 4.18Å; W316-K321 HydrophobicContact CZ2-CD 3.74Å; W316-K321 HydrophobicContact CZ2-CG 4.46Å; W316-K321 HydrophobicContact CZ3-CB 4.26Å; W316-K321 HydrophobicContact CZ3-CD 4.49Å
317	G	89.8	Confident	89.1	Confident	22 Å²	22	52.7 Å²	52.7	23%	0.227	28%	0.277	C	S	.	.			trans	-84.2	-172.9	172.2	0	0	0	0	0	113	S320 E380	G317-S320 WeakPolarHBondContact CA-O 3.47Å; G317-S320 PolarHBondContact N-O 3.32Å; G317-E380 WeakPolarHBondContact CA-OE1 3.28Å
318	Q	86.8	Confident	89.4	Confident	128 Å²	128	50.8 Å²	50.8	60%	0.598	27%	0.266	S	S	*	.	S	Bend	trans	-80.3	-38.6	176.8	-175.7	171.2	-12.2	0	0	111.8	E380	Q318-E380 PolarHBondContact N-OE1 3.43Å; Q318-E380 PolarHBondContact N-OE2 3.11Å
319	V	88.8	Confident	89.7	Confident	69 Å²	69	47.9 Å²	47.9	42%	0.418	24%	0.242	S	C	.	.	S	Bend	trans	-92.5	-35.5	-179.5	178.8	0	0	0	0	112	E380 P382	V319-E380 WeakPolarHBondContact CB-OE2 3.38Å; V319-E380 VanDerWaalsContact CG2-OE2 3.29Å; V319-E380 WeakPolarHBondContact CG2-OE2 3.38Å; V319-E380 PolarHBondContact N-OE2 2.97Å; V319-P382 HydrophobicContact CG2-CG 4.31Å
320	S	90.5	Very high	90	Very high	25 Å²	25	43.1 Å²	43.1	18%	0.175	22%	0.221	C	C	.	.			trans	-158	162.1	-173.8	-74.9	0	0	0	0	113.2	G317 Y322	G317-S320 WeakPolarHBondContact CA-O 3.47Å; G317-S320 PolarHBondContact N-O 3.32Å; S320-Y322 WeakPolarHBondContact O-CD2 3.43Å; S320-Y322 VanDerWaalsContact O-CE2 3.27Å; S320-Y322 WeakPolarHBondContact O-CE2 3.49Å
321	K	92.9	Very high	90.5	Very high	91 Å²	91	42.8 Å²	42.8	40%	0.396	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	121.7	170	-170.3	-166.2	-177.4	-164.2	0	109.5	Y284 S314 Y315 W316	Y284-K321 VanDerWaalsContact CE1-O 3.22Å; Y284-K321 WeakPolarHBondContact CE1-O 3.44Å; S314-K321 WeakPolarHBondContact OG-CE 3.15Å; S314-K321 PolarHBondContact OG-NZ 3.25Å; S314-K321 VanDerWaalsContact OG-NZ 3.11Å; Y315-K321 CarbonylContact O-C 3.57Å; Y315-K321 WeakPolarHBondContact O-CA 3.49Å; W316-K321 HydrophobicContact CD2-CB 4.14Å; W316-K321 HydrophobicContact CD2-CD 4.01Å; W316-K321 HydrophobicContact CD2-CG 3.82Å; W316-K321 HydrophobicContact CE3-CB 3.95Å; W316-K321 HydrophobicContact CE3-CD 4.41Å; W316-K321 HydrophobicContact CE3-CG 4.16Å; W316-K321 HydrophobicContact CG-CG 4.12Å; W316-K321 HydrophobicContact CH2-CD 4.18Å; W316-K321 HydrophobicContact CZ2-CD 3.74Å; W316-K321 HydrophobicContact CZ2-CG 4.46Å; W316-K321 HydrophobicContact CZ3-CB 4.26Å; W316-K321 HydrophobicContact CZ3-CD 4.49Å
322	Y	93.6	Very high	90.8	Very high	6 Å²	6	38.4 Å²	38.4	2%	0.024	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	147.8	-177.7	-58.2	-78	0	0	0	112	V260 Y284 S314 Y315 S320 R356 A357 F359 E380	V260-Y322 HydrophobicContact CG1-CD1 4.35Å; Y284-Y322 AromaticContact CD1-CD1 3.71Å; Y284-Y322 HydrophobicContact CD1-CD1 3.71Å; Y284-Y322 HydrophobicContact CD1-CE1 4.11Å; Y284-Y322 HydrophobicContact CD2-CD1 4.4Å; Y284-Y322 HydrophobicContact CE1-CD1 4.05Å; Y284-Y322 AromaticContact CG-CD1 3.9Å; Y284-Y322 HydrophobicContact CG-CD1 3.9Å; Y284-Y322 HydrophobicContact CG-CE1 4.03Å; S314-Y322 CarbonylContact C-O 3.59Å; S314-Y322 WeakPolarHBondContact CA-O 3.35Å; S314-Y322 WeakPolarHBondContact CB-O 3.41Å; Y315-Y322 PolarHBondContact N-O 3.44Å; Y315-Y322 PolarHBondContact O-N 3.29Å; S320-Y322 WeakPolarHBondContact O-CD2 3.43Å; S320-Y322 VanDerWaalsContact O-CE2 3.27Å; S320-Y322 WeakPolarHBondContact O-CE2 3.49Å; Y322-R356 HydrophobicContact CE1-CB 4.21Å; Y322-R356 PolarHBondContact OH-O 3.47Å; Y322-A357 HydrophobicContact CD1-CB 3.81Å; Y322-A357 HydrophobicContact CD2-CB 4.17Å; Y322-A357 HydrophobicContact CE1-CB 3.61Å; Y322-A357 HydrophobicContact CE2-CB 4Å; Y322-A357 HydrophobicContact CG-CB 4.08Å; Y322-F359 HydrophobicContact CD2-CZ 4.02Å; Y322-F359 HydrophobicContact CG-CZ 4.1Å; Y322-E380 HydrophobicContact CE2-CG 3.92Å; Y322-E380 WeakPolarHBondContact OH-CG 3.3Å
323	G	91.1	Very high	90.8	Very high	14 Å²	14	39.3 Å²	39.3	14%	0.144	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-65.9	163.6	171	0	0	0	0	0	113.4	R258 Y284	R258-G323 PolarHBondContact NH1-O 3.48Å; Y284-G323 PolarHBondContact OH-N 2.86Å; Y284-G323 VanDerWaalsContact OH-N 3.1Å
324	G	88.9	Confident	90.8	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.207	C	C	.	.	S	Bend	trans	-80.3	-14.8	174.7	0	0	0	0	0	114.3	S312	S312-G324 VanDerWaalsContact CB-O 3.25Å; S312-G324 WeakPolarHBondContact CB-O 3.35Å
325	G	91.1	Very high	90.7	Very high	3 Å²	3	42.2 Å²	42.2	3%	0.031	21%	0.207	C	C	.	.			trans	-77.7	-169.1	176.7	0	0	0	0	0	114.3	R258 T305	R258-G325 PolarHBondContact NH1-O 3.13Å; T305-G325 WeakPolarHBondContact O-CA 3.45Å
326	G	92.8	Very high	90.6	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	134.5	-159	171.8	0	0	0	0	0	113.5	T305 M310	T305-G326 PolarHBondContact N-O 3Å; T305-G326 PolarHBondContact O-N 3.4Å; T305-G326 VanDerWaalsContact O-N 3.09Å; M310-G326 WeakPolarHBondContact CE-O 3.17Å
327	Y	94.4	Very high	90.7	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	140.2	175.4	-53.1	-93.8	0	0	0	109	R258 Q259 K261 D290 A292 F294 A301 Y304	R258-Y327 CarbonylContact C-O 3.48Å; R258-Y327 VanDerWaalsContact CA-O 3.3Å; R258-Y327 WeakPolarHBondContact CA-O 3.4Å; Q259-Y327 PolarHBondContact N-O 2.68Å; Q259-Y327 PolarHBondContact O-N 3.16Å; K261-Y327 HydrophobicContact CB-CE2 4.12Å; K261-Y327 HydrophobicContact CD-CD2 4.15Å; K261-Y327 HydrophobicContact CD-CE2 3.95Å; K261-Y327 HydrophobicContact CG-CD2 4.18Å; K261-Y327 HydrophobicContact CG-CE2 4.05Å; D290-Y327 PolarHBondContact O-OH 3.33Å; A292-Y327 WeakPolarHBondContact O-CE1 3.44Å; A292-Y327 PolarHBondContact O-OH 3.48Å; F294-Y327 AromaticContact CD1-CD1 3.92Å; F294-Y327 HydrophobicContact CD1-CD1 3.92Å; F294-Y327 AromaticContact CD1-CE1 3.57Å; F294-Y327 HydrophobicContact CD1-CE1 3.57Å; F294-Y327 HydrophobicContact CD1-CE2 4.48Å; F294-Y327 HydrophobicContact CD1-CG 4.48Å; F294-Y327 AromaticContact CD1-CZ 3.89Å; F294-Y327 AromaticContact CE1-CD1 3.61Å; F294-Y327 HydrophobicContact CE1-CD1 3.61Å; F294-Y327 HydrophobicContact CE1-CD2 4.08Å; F294-Y327 AromaticContact CE1-CE1 3.72Å; F294-Y327 HydrophobicContact CE1-CE1 3.72Å; F294-Y327 HydrophobicContact CE1-CE2 4.22Å; F294-Y327 AromaticContact CE1-CG 3.78Å; F294-Y327 HydrophobicContact CE1-CG 3.78Å; A301-Y327 WeakPolarHBondContact O-CB 3.33Å; Y304-Y327 HydrophobicContact CD2-CE2 4.07Å
328	Y	94	Very high	90.8	Very high	43 Å²	43	41.2 Å²	41.2	17%	0.169	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	142.8	-176.9	77.7	-75	0	0	0	115	R256 L257 T300 A301 T305 M310	R256-Y328 HydrophobicContact CG-CD2 4.32Å; L257-Y328 CarbonylContact O-C 3.57Å; L257-Y328 WeakPolarHBondContact O-CA 3.34Å; L257-Y328 WeakPolarHBondContact O-CB 3.39Å; T300-Y328 CarbonylContact C-O 3.57Å; T300-Y328 WeakPolarHBondContact CB-O 3.36Å; T300-Y328 HydrophobicContact CG2-CE1 4.21Å; T300-Y328 PolarHBondContact O-N 3.17Å; T300-Y328 PolarHBondContact OG1-O 3.37Å; A301-Y328 WeakPolarHBondContact CA-O 3.26Å; A301-Y328 PolarHBondContact N-O 3.2Å; A301-Y328 VanDerWaalsContact N-O 3.12Å; T305-Y328 HydrophobicContact CG2-CE1 4Å; T305-Y328 WeakPolarHBondContact OG1-CE1 3.33Å; M310-Y328 HydrophobicContact CE-CD1 3.37Å; M310-Y328 HydrophobicContact CE-CE1 4.22Å; M310-Y328 HydrophobicContact CE-CG 3.8Å
329	Q	93.8	Very high	91.1	Very high	33 Å²	33	36.7 Å²	36.7	15%	0.154	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	118.2	171.6	-174.7	57.7	70	0	0	109.7	L257 A301 L345	L257-Q329 PolarHBondContact N-O 3.39Å; L257-Q329 PolarHBondContact O-N 2.87Å; A301-Q329 HydrophobicContact CB-CB 4Å; Q329-L345 HydrophobicContact CB-CD1 4.02Å; Q329-L345 HydrophobicContact CG-CD1 4.06Å
330	D	93.4	Very high	91.4	Very high	31 Å²	31	38.4 Å²	38.4	17%	0.166	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	131	166.2	-70.9	-14.9	0	0	0	109	V254 R256 R341	V254-D330 HydrophobicContact CG2-CB 4.03Å; R256-D330 WeakPolarHBondContact CB-OD1 3.5Å; R256-D330 WeakPolarHBondContact CG-OD1 3.22Å; R256-D330 IonicContact CZ-OD1 2.69Å; R256-D330 IonicContact CZ-OD2 3.84Å; R256-D330 IonicContact NE-OD1 2.66Å; R256-D330 PolarHBondContact NE-OD1 2.88Å; R256-D330 IonicContact NE-OD2 3.21Å; R256-D330 IonicContact NH2-OD1 3.29Å; R256-D330 PolarHBondContact NH2-OD1 3.32Å; R256-D330 IonicContact NH2-OD2 3.38Å; R256-D330 PolarHBondContact NH2-OD2 3.31Å; D330-R341 PolarHBondContact O-NH1 2.75Å
331	L	92.5	Very high	91.6	Very high	3 Å²	3	41 Å²	41	2%	0.016	20%	0.203	C	C	.	.			trans	-76.3	180	173.6	-66.6	-174.3	0	0	0	110.8	F224 V254 P255 L257 L342	F224-L331 HydrophobicContact CE1-CD1 3.85Å; V254-L331 WeakPolarHBondContact CB-O 3.37Å; V254-L331 WeakPolarHBondContact CG1-O 3.2Å; P255-L331 HydrophobicContact CB-CB 4.48Å; P255-L331 HydrophobicContact CB-CD1 4.15Å; P255-L331 HydrophobicContact CG-CD1 4.48Å; P255-L331 PolarHBondContact O-N 3.06Å; L257-L331 HydrophobicContact CD1-CD1 3.72Å; L257-L331 HydrophobicContact CD1-CD2 3.96Å; L257-L331 HydrophobicContact CD1-CG 3.72Å; L331-L342 HydrophobicContact CD1-CD1 4.4Å; L331-L342 HydrophobicContact CD2-CD1 4.39Å; L331-L342 HydrophobicContact CD2-CD2 4.13Å; L331-L342 HydrophobicContact CD2-CG 3.92Å
332	S	90.3	Very high	91.6	Very high	15 Å²	15	36.7 Å²	36.7	11%	0.105	18%	0.184	C	C	.	.			trans	-95.9	175.2	175.1	-170.9	0	0	0	0	111.3	Y229 T334 E337 S338	Y229-S332 PolarHBondContact OH-O 2.93Å; S332-T334 PolarHBondContact OG-N 3.48Å; S332-E337 WeakPolarHBondContact CB-OE2 3.46Å; S332-E337 PolarHBondContact OG-OE2 2.95Å; S332-S338 PolarHBondContact N-OG 2.93Å; S332-S338 PolarHBondContact O-OG 2.86Å
333	R	84.3	Confident	91.7	Very high	36 Å²	36	41.1 Å²	41.1	14%	0.136	21%	0.205	C	C	.	.	S	Bend	trans	-82	-15.8	167.7	-66.8	-175.5	62.6	79.7	-3.3	112.7	Y229 N241 G253 V254 M480	Y229-R333 WeakPolarHBondContact CD1-O 3.49Å; Y229-R333 WeakPolarHBondContact CE1-O 3.24Å; N241-R333 PolarHBondContact O-NE 3.17Å; N241-R333 VanDerWaalsContact O-NE 3.16Å; N241-R333 PolarHBondContact O-NH2 3.02Å; G253-R333 PolarHBondContact O-NH1 3.23Å; V254-R333 HydrophobicContact CG1-CG 3.62Å; R333-M480 WeakPolarHBondContact CD-SD 3.15Å
334	T	86.5	Confident	91.9	Very high	66 Å²	66	44.4 Å²	44.4	41%	0.405	22%	0.216	S	C	.	.	S	Bend	trans	-99	147.7	176.3	62	0	0	0	0	111.2	S332 E337 S338	S332-T334 PolarHBondContact OG-N 3.48Å; T334-E337 WeakPolarHBondContact OG1-CB 3.47Å; T334-S338 VanDerWaalsContact O-CB 3.31Å; T334-S338 WeakPolarHBondContact O-CB 3.34Å; T334-S338 PolarHBondContact O-N 3.01Å; T334-S338 PolarHBondContact O-OG 3.05Å
335	K	87.6	Confident	92.1	Very high	68 Å²	68	44.5 Å²	44.5	30%	0.296	22%	0.216	S	C	.	.	H	α-helix	trans	-66.1	-47.4	179.4	-171	175.8	-177.7	166.5	0	112.1	Y229 D231 S338 A339	Y229-K335 HydrophobicContact CD2-CB 4.26Å; Y229-K335 HydrophobicContact CD2-CG 4.32Å; Y229-K335 HydrophobicContact CG-CB 3.99Å; Y229-K335 HydrophobicContact CG-CG 4.39Å; D231-K335 WeakPolarHBondContact OD1-CD 3.48Å; D231-K335 VanDerWaalsContact OD2-CD 3.31Å; D231-K335 WeakPolarHBondContact OD2-CD 3.49Å; D231-K335 IonicContact OD2-NZ 2.88Å; D231-K335 PolarHBondContact OD2-NZ 3.2Å; K335-S338 PolarHBondContact O-N 3.25Å; K335-A339 WeakPolarHBondContact O-CB 3.26Å; K335-A339 PolarHBondContact O-N 3.29Å
336	E	89.3	Confident	92.3	Very high	157 Å²	157	47.9 Å²	47.9	73%	0.734	23%	0.23	S	C	*	.	H	α-helix	trans	-62.9	-46.9	-177	-61.5	-179.1	174.7	0	0	112.1	S338 A339 N340	E336-S338 PolarHBondContact O-N 3.47Å; E336-A339 PolarHBondContact O-N 3.16Å; E336-N340 VanDerWaalsContact O-CG 3.24Å; E336-N340 PolarHBondContact O-N 3.49Å; E336-N340 PolarHBondContact O-ND2 2.88Å
337	E	91.4	Very high	92.4	Very high	78 Å²	78	53 Å²	53	36%	0.364	26%	0.257	S	S	.	.	H	α-helix	trans	-67.5	-38.1	178.4	-163.6	-165.2	161	0	0	111.5	S332 T334 N340 R341	S332-E337 WeakPolarHBondContact CB-OE2 3.46Å; S332-E337 PolarHBondContact OG-OE2 2.95Å; T334-E337 WeakPolarHBondContact OG1-CB 3.47Å; E337-N340 PolarHBondContact O-N 3.22Å; E337-R341 WeakPolarHBondContact O-CG 3.5Å; E337-R341 PolarHBondContact O-N 3.29Å; E337-R341 IonicContact OE1-CZ 2.7Å; E337-R341 VanDerWaalsContact OE1-CZ 3.29Å; E337-R341 IonicContact OE1-NE 3.33Å; E337-R341 PolarHBondContact OE1-NE 3.33Å; E337-R341 IonicContact OE1-NH2 3.2Å; E337-R341 PolarHBondContact OE1-NH2 3.47Å
338	S	92.5	Very high	92.3	Very high	0 Å²	0	57 Å²	57	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-65.7	-38.6	175.6	-57.9	0	0	0	0	112.1	Y229 S332 T334 K335 E336 R341 L342	Y229-S338 PolarHBondContact OH-OG 3.43Å; S332-S338 PolarHBondContact N-OG 2.93Å; S332-S338 PolarHBondContact O-OG 2.86Å; T334-S338 VanDerWaalsContact O-CB 3.31Å; T334-S338 WeakPolarHBondContact O-CB 3.34Å; T334-S338 PolarHBondContact O-N 3.01Å; T334-S338 PolarHBondContact O-OG 3.05Å; K335-S338 PolarHBondContact O-N 3.25Å; E336-S338 PolarHBondContact O-N 3.47Å; S338-R341 PolarHBondContact O-N 3.3Å; S338-L342 WeakPolarHBondContact O-CB 3.18Å; S338-L342 WeakPolarHBondContact O-CG 3.42Å; S338-L342 PolarHBondContact O-N 3.49Å
339	A	93.8	Very high	92.3	Very high	32 Å²	32	61.2 Å²	61.2	26%	0.264	30%	0.301	S	S	.	.	H	α-helix	trans	-62.1	-45.9	172.3	0	0	0	0	0	111.5	L225 K335 E336 R341 L342 Q343	L225-A339 HydrophobicContact CD1-CB 3.77Å; K335-A339 WeakPolarHBondContact O-CB 3.26Å; K335-A339 PolarHBondContact O-N 3.29Å; E336-A339 PolarHBondContact O-N 3.16Å; A339-R341 PolarHBondContact O-N 3.46Å; A339-L342 PolarHBondContact O-N 2.9Å; A339-Q343 WeakPolarHBondContact O-CB 3.17Å; A339-Q343 PolarHBondContact O-N 2.86Å
340	N	94.7	Very high	92.4	Very high	105 Å²	105	59.6 Å²	59.6	56%	0.561	29%	0.293	S	S	*	.	H	α-helix	trans	-62.1	-42.3	176.8	-69.7	-22.1	0	0	0	112.1	E336 E337 Q343 F344	E336-N340 VanDerWaalsContact O-CG 3.24Å; E336-N340 PolarHBondContact O-N 3.49Å; E336-N340 PolarHBondContact O-ND2 2.88Å; E337-N340 PolarHBondContact O-N 3.22Å; N340-Q343 PolarHBondContact O-N 3.28Å; N340-F344 WeakPolarHBondContact O-CB 3.32Å; N340-F344 PolarHBondContact O-N 3.43Å
341	R	93.9	Very high	92.4	Very high	80 Å²	80	58.7 Å²	58.7	30%	0.302	29%	0.288	S	S	.	.	H	α-helix	trans	-62.5	-45.6	174.3	-71.8	-180	-171.9	-162	2.1	111.7	D330 E337 S338 A339 F344 L345	D330-R341 PolarHBondContact O-NH1 2.75Å; E337-R341 WeakPolarHBondContact O-CG 3.5Å; E337-R341 PolarHBondContact O-N 3.29Å; E337-R341 IonicContact OE1-CZ 2.7Å; E337-R341 VanDerWaalsContact OE1-CZ 3.29Å; E337-R341 IonicContact OE1-NE 3.33Å; E337-R341 PolarHBondContact OE1-NE 3.33Å; E337-R341 IonicContact OE1-NH2 3.2Å; E337-R341 PolarHBondContact OE1-NH2 3.47Å; S338-R341 PolarHBondContact O-N 3.3Å; A339-R341 PolarHBondContact O-N 3.46Å; R341-F344 PolarHBondContact O-N 2.87Å; R341-L345 WeakPolarHBondContact O-CG 3.43Å; R341-L345 PolarHBondContact O-N 3.42Å
342	L	94.7	Very high	92.4	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-65.5	-38.4	177.7	-74.3	168.5	0	0	0	112.4	W217 L225 L257 L331 S338 A339 L345 K346	W217-L342 HydrophobicContact CZ3-CD2 4.29Å; L225-L342 HydrophobicContact CD1-CD1 4.1Å; L225-L342 HydrophobicContact CD2-CD1 4.09Å; L225-L342 HydrophobicContact CG-CD1 4.15Å; L257-L342 HydrophobicContact CD1-CD2 4.19Å; L257-L342 HydrophobicContact CD2-CD2 3.83Å; L331-L342 HydrophobicContact CD1-CD1 4.4Å; L331-L342 HydrophobicContact CD2-CD1 4.39Å; L331-L342 HydrophobicContact CD2-CD2 4.13Å; L331-L342 HydrophobicContact CD2-CG 3.92Å; S338-L342 WeakPolarHBondContact O-CB 3.18Å; S338-L342 WeakPolarHBondContact O-CG 3.42Å; S338-L342 PolarHBondContact O-N 3.49Å; A339-L342 PolarHBondContact O-N 2.9Å; L342-L345 PolarHBondContact O-N 3.27Å; L342-K346 WeakPolarHBondContact O-CB 3.45Å; L342-K346 PolarHBondContact O-N 3.37Å; L342-K346 VanDerWaalsContact O-N 3.08Å
343	Q	94.6	Very high	92.4	Very high	100 Å²	100	65.8 Å²	65.8	47%	0.467	32%	0.315	S	S	.	.	H	α-helix	trans	-64.8	-44.6	173.6	-177.9	168	-8.7	0	0	111.3	A339 N340 L345 K346 D347	A339-Q343 WeakPolarHBondContact O-CB 3.17Å; A339-Q343 PolarHBondContact O-N 2.86Å; N340-Q343 PolarHBondContact O-N 3.28Å; Q343-L345 PolarHBondContact O-N 2.93Å; Q343-K346 WeakPolarHBondContact O-CB 3.44Å; Q343-K346 PolarHBondContact O-N 2.87Å; Q343-K346 VanDerWaalsContact O-N 3.13Å; Q343-D347 WeakPolarHBondContact CG-OD2 3.38Å; Q343-D347 WeakPolarHBondContact O-CB 3.48Å; Q343-D347 PolarHBondContact O-N 2.92Å
344	F	94.4	Very high	92.7	Very high	83 Å²	83	64.1 Å²	64.1	36%	0.364	31%	0.309	S	S	.	.	H	α-helix	trans	-57	-44.8	174.7	178.4	-89.3	0	0	0	112.6	P296 W302 N340 R341 K346 D347 H348	P296-F344 HydrophobicContact CG-CZ 4.4Å; W302-F344 HydrophobicContact CZ2-CE1 4.29Å; N340-F344 WeakPolarHBondContact O-CB 3.32Å; N340-F344 PolarHBondContact O-N 3.43Å; R341-F344 PolarHBondContact O-N 2.87Å; F344-K346 VanDerWaalsContact C-N 3.34Å; F344-K346 PolarHBondContact O-N 3.29Å; F344-D347 PolarHBondContact O-N 3.38Å; F344-H348 AromaticContact CD2-CE1 3.46Å; F344-H348 VanDerWaalsContact CD2-CE1 3.46Å; F344-H348 WeakPolarHBondContact CD2-CE1 3.31Å; F344-H348 AromaticContact CD2-ND1 3.65Å; F344-H348 AromaticContact CE1-ND1 3.99Å; F344-H348 AromaticContact CE2-CE1 3.14Å; F344-H348 WeakPolarHBondContact CE2-CE1 3.45Å; F344-H348 AromaticContact CE2-ND1 3.57Å; F344-H348 AromaticContact CE2-NE2 3.8Å; F344-H348 AromaticContact CG-ND1 3.9Å; F344-H348 AromaticContact CZ-CE1 3.62Å; F344-H348 AromaticContact CZ-ND1 3.73Å; F344-H348 PolarHBondContact O-N 3.25Å; F344-H348 VanDerWaalsContact O-N 3.12Å; F344-H348 PolarHBondContact O-ND1 3.13Å
345	L	94.3	Very high	93.1	Very high	1 Å²	1	61 Å²	61	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-63.1	-38.6	176.1	-68	179.2	0	0	0	112.5	W217 A301 W302 Q329 R341 L342 Q343 L349 W350	W217-L345 HydrophobicContact CH2-CB 3.74Å; W217-L345 HydrophobicContact CZ3-CB 4.39Å; A301-L345 HydrophobicContact CB-CD2 3.83Å; W302-L345 HydrophobicContact CZ2-CD2 4.07Å; Q329-L345 HydrophobicContact CB-CD1 4.02Å; Q329-L345 HydrophobicContact CG-CD1 4.06Å; R341-L345 WeakPolarHBondContact O-CG 3.43Å; R341-L345 PolarHBondContact O-N 3.42Å; L342-L345 PolarHBondContact O-N 3.27Å; Q343-L345 PolarHBondContact O-N 2.93Å; L345-L349 PolarHBondContact O-N 2.9Å; L345-W350 HydrophobicContact CB-CB 3.89Å; L345-W350 HydrophobicContact CB-CG 4.31Å; L345-W350 HydrophobicContact CD1-CD2 4.22Å; L345-W350 HydrophobicContact CD1-CE3 4.14Å; L345-W350 HydrophobicContact CD2-CB 4.1Å; L345-W350 HydrophobicContact CD2-CD2 4.21Å; L345-W350 HydrophobicContact CD2-CG 3.83Å; L345-W350 HydrophobicContact CG-CG 4.47Å; L345-W350 VanDerWaalsContact O-CB 3.23Å; L345-W350 WeakPolarHBondContact O-CB 3.5Å; L345-W350 PolarHBondContact O-N 3.29Å
346	K	94.5	Very high	93.5	Very high	75 Å²	75	58.3 Å²	58.3	33%	0.326	28%	0.278	S	S	.	.	H	α-helix	trans	-67.3	-45.5	178	-176.6	-176.7	-175.7	-176.9	0	111.8	W217 L342 Q343 F344 H348 L349	W217-K346 HydrophobicContact CB-CD 4.2Å; W217-K346 HydrophobicContact CD2-CB 4Å; W217-K346 HydrophobicContact CD2-CD 4.26Å; W217-K346 HydrophobicContact CD2-CG 3.94Å; W217-K346 HydrophobicContact CE3-CB 4.01Å; W217-K346 HydrophobicContact CE3-CD 4.47Å; W217-K346 HydrophobicContact CE3-CG 4.35Å; W217-K346 HydrophobicContact CG-CD 4.17Å; W217-K346 HydrophobicContact CG-CG 4.06Å; W217-K346 HydrophobicContact CH2-CB 4.18Å; W217-K346 HydrophobicContact CZ2-CB 4.14Å; W217-K346 HydrophobicContact CZ3-CB 4.11Å; L342-K346 WeakPolarHBondContact O-CB 3.45Å; L342-K346 PolarHBondContact O-N 3.37Å; L342-K346 VanDerWaalsContact O-N 3.08Å; Q343-K346 WeakPolarHBondContact O-CB 3.44Å; Q343-K346 PolarHBondContact O-N 2.87Å; Q343-K346 VanDerWaalsContact O-N 3.13Å; F344-K346 VanDerWaalsContact C-N 3.34Å; F344-K346 PolarHBondContact O-N 3.29Å; K346-H348 VanDerWaalsContact C-N 3.28Å; K346-H348 PolarHBondContact O-N 3.49Å; K346-L349 PolarHBondContact O-N 3.28Å
347	D	94.5	Very high	93.8	Very high	106 Å²	106	50.9 Å²	50.9	57%	0.567	24%	0.243	S	C	*	.	H	α-helix	trans	-67.8	-29.2	-178.5	-65.2	-15.3	0	0	0	111.9	Q343 F344	Q343-D347 WeakPolarHBondContact CG-OD2 3.38Å; Q343-D347 WeakPolarHBondContact O-CB 3.48Å; Q343-D347 PolarHBondContact O-N 2.92Å; F344-D347 PolarHBondContact O-N 3.38Å
348	H	94	Very high	94	Very high	85 Å²	85	47.2 Å²	47.2	39%	0.394	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	13.2	175.6	-66	81.3	0	0	0	114.2	W302 F344 K346 W350	W302-H348 HydrophobicContact CH2-CB 3.56Å; W302-H348 WeakPolarHBondContact CH2-O 3.21Å; W302-H348 HydrophobicContact CZ2-CB 3.73Å; F344-H348 AromaticContact CD2-CE1 3.46Å; F344-H348 VanDerWaalsContact CD2-CE1 3.46Å; F344-H348 WeakPolarHBondContact CD2-CE1 3.31Å; F344-H348 AromaticContact CD2-ND1 3.65Å; F344-H348 AromaticContact CE1-ND1 3.99Å; F344-H348 AromaticContact CE2-CE1 3.14Å; F344-H348 WeakPolarHBondContact CE2-CE1 3.45Å; F344-H348 AromaticContact CE2-ND1 3.57Å; F344-H348 AromaticContact CE2-NE2 3.8Å; F344-H348 AromaticContact CG-ND1 3.9Å; F344-H348 AromaticContact CZ-CE1 3.62Å; F344-H348 AromaticContact CZ-ND1 3.73Å; F344-H348 PolarHBondContact O-N 3.25Å; F344-H348 VanDerWaalsContact O-N 3.12Å; F344-H348 PolarHBondContact O-ND1 3.13Å; K346-H348 VanDerWaalsContact C-N 3.28Å; K346-H348 PolarHBondContact O-N 3.49Å; H348-W350 VanDerWaalsContact C-N 3.34Å; H348-W350 PolarHBondContact O-N 3.19Å
349	L	93.8	Very high	94.1	Very high	131 Å²	131	47.2 Å²	47.2	69%	0.686	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.7	45.7	178.3	-59.7	174.1	0	0	0	113.6	L345 K346 L351	L345-L349 PolarHBondContact O-N 2.9Å; K346-L349 PolarHBondContact O-N 3.28Å; L349-L351 PolarHBondContact O-N 2.95Å
350	W	94.4	Very high	94.2	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	21%	0.214	C	C	.	.			trans	-55.1	-41.7	177	-174.4	65.4	0	0	0	111.9	W217 L257 Q259 F294 A301 W302 L345 H348 V358	W217-W350 HydrophobicContact CH2-CE3 4.3Å; L257-W350 HydrophobicContact CB-CH2 3.99Å; L257-W350 HydrophobicContact CB-CZ3 4.33Å; L257-W350 HydrophobicContact CD2-CZ3 4.18Å; Q259-W350 HydrophobicContact CB-CH2 3.55Å; Q259-W350 HydrophobicContact CB-CZ2 3.5Å; Q259-W350 VanDerWaalsContact CB-CZ2 3.5Å; Q259-W350 HydrophobicContact CB-CZ3 4.25Å; Q259-W350 HydrophobicContact CG-CH2 4.5Å; Q259-W350 HydrophobicContact CG-CZ2 4.43Å; Q259-W350 PolarHBondContact NE2-O 2.82Å; Q259-W350 PolarHBondContact OE1-O 3.03Å; F294-W350 AromaticContact CZ-CD1 3.68Å; F294-W350 AromaticContact CZ-NE1 3.97Å; A301-W350 PolarHBondContact O-NE1 3.26Å; W302-W350 AromaticContact CE3-CD1 3.97Å; W302-W350 HydrophobicContact CH2-CB 3.82Å; W302-W350 AromaticContact CH2-CD1 3.89Å; W302-W350 HydrophobicContact CH2-CG 4.29Å; W302-W350 HydrophobicContact CZ2-CB 4.4Å; W302-W350 HydrophobicContact CZ3-CB 4.27Å; W302-W350 AromaticContact CZ3-CD1 3.79Å; W302-W350 HydrophobicContact CZ3-CG 4.47Å; L345-W350 HydrophobicContact CB-CB 3.89Å; L345-W350 HydrophobicContact CB-CG 4.31Å; L345-W350 HydrophobicContact CD1-CD2 4.22Å; L345-W350 HydrophobicContact CD1-CE3 4.14Å; L345-W350 HydrophobicContact CD2-CB 4.1Å; L345-W350 HydrophobicContact CD2-CD2 4.21Å; L345-W350 HydrophobicContact CD2-CG 3.83Å; L345-W350 HydrophobicContact CG-CG 4.47Å; L345-W350 VanDerWaalsContact O-CB 3.23Å; L345-W350 WeakPolarHBondContact O-CB 3.5Å; L345-W350 PolarHBondContact O-N 3.29Å; H348-W350 VanDerWaalsContact C-N 3.34Å; H348-W350 PolarHBondContact O-N 3.19Å; W350-V358 HydrophobicContact CZ3-CG1 4.44Å
351	L	94.3	Very high	94.1	Very high	11 Å²	11	41.5 Å²	41.5	6%	0.058	19%	0.191	C	C	.	.	S	Bend	trans	-88.2	125.9	169.1	-57.1	-172.4	0	0	0	110.6	F216 W217 Q259 L349 T355 V358	F216-L351 HydrophobicContact CD1-CD1 3.52Å; F216-L351 HydrophobicContact CE1-CD1 3.68Å; W217-L351 HydrophobicContact CH2-CG 4.42Å; W217-L351 HydrophobicContact CZ2-CB 4.2Å; W217-L351 HydrophobicContact CZ2-CD1 3.87Å; W217-L351 HydrophobicContact CZ2-CG 3.63Å; Q259-L351 HydrophobicContact CG-CD2 4.29Å; L349-L351 PolarHBondContact O-N 2.95Å; L351-T355 HydrophobicContact CD2-CG2 4.2Å; L351-V358 HydrophobicContact CD1-CG2 4.3Å; L351-V358 HydrophobicContact CD2-CG2 3.44Å; L351-V358 VanDerWaalsContact CD2-CG2 3.44Å
352	D	91.8	Very high	94.1	Very high	39 Å²	39	37.8 Å²	37.8	21%	0.209	18%	0.177	C	C	.	.			trans	-134.7	177.9	-177.9	68.4	-2.3	0	0	0	112	M213 K261 G354 T355	M213-D352 WeakPolarHBondContact CE-O 3.3Å; K261-D352 VanDerWaalsContact CE-OD1 3.22Å; K261-D352 WeakPolarHBondContact CE-OD1 3.26Å; K261-D352 WeakPolarHBondContact CE-OD2 3.46Å; K261-D352 VanDerWaalsContact NZ-CG 3.32Å; K261-D352 IonicContact NZ-OD1 2.62Å; K261-D352 IonicContact NZ-OD2 2.85Å; K261-D352 PolarHBondContact NZ-OD2 3.06Å; D352-G354 PolarHBondContact O-N 2.9Å; D352-G354 PolarHBondContact OD1-N 3.4Å; D352-T355 PolarHBondContact N-OG1 3.04Å; D352-T355 WeakPolarHBondContact O-CB 3.49Å; D352-T355 PolarHBondContact O-N 3.06Å; D352-T355 PolarHBondContact O-OG1 3.05Å; D352-T355 VanDerWaalsContact O-OG1 3.12Å; D352-T355 PolarHBondContact OD1-N 3.36Å; D352-T355 PolarHBondContact OD1-OG1 3.1Å
353	R	90.3	Very high	93.9	Very high	129 Å²	129	38 Å²	38	49%	0.487	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-21.9	176.6	60.3	-178.7	-64.1	-165.2	-3.5	114.8	D279 Y281 R356	D279-R353 PolarHBondContact O-NH2 2.63Å; D279-R353 IonicContact OD2-CZ 3.28Å; D279-R353 IonicContact OD2-NH1 2.91Å; D279-R353 PolarHBondContact OD2-NH1 2.95Å; Y281-R353 HydrophobicContact CD2-CG 3.91Å; Y281-R353 HydrophobicContact CE2-CG 3.47Å; Y281-R353 VanDerWaalsContact CE2-CG 3.47Å; R353-R356 PolarHBondContact O-NH1 3.48Å
354	G	91.6	Very high	93.8	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-8.5	176.4	0	0	0	0	0	114.3	K261 V262 Y281 D352	K261-G354 WeakPolarHBondContact CA-O 3.47Å; V262-G354 PolarHBondContact N-O 3.29Å; Y281-G354 VanDerWaalsContact CE1-CA 3.43Å; D352-G354 PolarHBondContact O-N 2.9Å; D352-G354 PolarHBondContact OD1-N 3.4Å
355	T	95.1	Very high	93.7	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	139.5	175.8	-56.3	0	0	0	0	110.7	Q259 L351 D352 V358 F381	Q259-T355 HydrophobicContact CG-CG2 3.8Å; Q259-T355 PolarHBondContact NE2-OG1 2.94Å; L351-T355 HydrophobicContact CD2-CG2 4.2Å; D352-T355 PolarHBondContact N-OG1 3.04Å; D352-T355 WeakPolarHBondContact O-CB 3.49Å; D352-T355 PolarHBondContact O-N 3.06Å; D352-T355 PolarHBondContact O-OG1 3.05Å; D352-T355 VanDerWaalsContact O-OG1 3.12Å; D352-T355 PolarHBondContact OD1-N 3.36Å; D352-T355 PolarHBondContact OD1-OG1 3.1Å; T355-V358 HydrophobicContact CG2-CG2 3.92Å; T355-F381 HydrophobicContact CG2-CD2 4.02Å; T355-F381 HydrophobicContact CG2-CE2 4.5Å
356	R	94.8	Very high	93.6	Very high	13 Å²	13	32.3 Å²	32.3	5%	0.049	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	-27.8	179.4	-67.8	-67.6	171.7	-100.2	9.3	114.5	V260 V262 Y281 N282 Y322 R353 E380 F381	V260-R356 PolarHBondContact O-N 3.36Å; V262-R356 HydrophobicContact CB-CG 4.31Å; V262-R356 HydrophobicContact CG2-CG 3.62Å; Y281-R356 PolarHBondContact O-NH2 3.45Å; N282-R356 PolarHBondContact O-NE 3.06Å; N282-R356 PolarHBondContact O-NH2 3.41Å; Y322-R356 HydrophobicContact CE1-CB 4.21Å; Y322-R356 PolarHBondContact OH-O 3.47Å; R353-R356 PolarHBondContact O-NH1 3.48Å; R356-E380 WeakPolarHBondContact O-CA 3.33Å; R356-F381 WeakPolarHBondContact CD-O 3.3Å; R356-F381 PolarHBondContact O-N 2.81Å
357	A	95.9	Very high	93.3	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	142.4	174.2	0	0	0	0	0	110.9	Q259 V260 Y322 F359 L378 V379	Q259-A357 WeakPolarHBondContact CA-O 3.41Å; V260-A357 HydrophobicContact CB-CB 4.39Å; V260-A357 PolarHBondContact N-O 3.28Å; Y322-A357 HydrophobicContact CD1-CB 3.81Å; Y322-A357 HydrophobicContact CD2-CB 4.17Å; Y322-A357 HydrophobicContact CE1-CB 3.61Å; Y322-A357 HydrophobicContact CE2-CB 4Å; Y322-A357 HydrophobicContact CG-CB 4.08Å; A357-F359 HydrophobicContact CB-CD2 4.45Å; A357-F359 HydrophobicContact CB-CE2 3.72Å; A357-F359 HydrophobicContact CB-CZ 4.17Å; A357-L378 HydrophobicContact CB-CD1 3.84Å; A357-V379 WeakPolarHBondContact CA-O 3.45Å
358	V	96	Very high	93.1	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.006	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	119.8	168.4	-178.4	0	0	0	0	108.4	F216 R258 Q259 W350 L351 T355 L378 V379 F381	F216-V358 HydrophobicContact CE1-CG1 4.13Å; F216-V358 HydrophobicContact CE2-CG1 4.42Å; F216-V358 HydrophobicContact CZ-CB 4.37Å; F216-V358 HydrophobicContact CZ-CG1 3.64Å; R258-V358 CarbonylContact O-C 3.59Å; R258-V358 WeakPolarHBondContact O-CA 3.22Å; Q259-V358 HydrophobicContact CG-CG2 4.44Å; W350-V358 HydrophobicContact CZ3-CG1 4.44Å; L351-V358 HydrophobicContact CD1-CG2 4.3Å; L351-V358 HydrophobicContact CD2-CG2 3.44Å; L351-V358 VanDerWaalsContact CD2-CG2 3.44Å; T355-V358 HydrophobicContact CG2-CG2 3.92Å; V358-L378 WeakPolarHBondContact O-CA 3.39Å; V358-V379 PolarHBondContact N-O 3.4Å; V358-V379 PolarHBondContact O-N 2.86Å; V358-F381 HydrophobicContact CB-CE2 4.4Å; V358-F381 HydrophobicContact CG2-CD2 4.42Å; V358-F381 HydrophobicContact CG2-CE2 3.8Å
359	F	95.5	Very high	92.8	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	137.8	174.3	-57.6	-96.8	0	0	0	108.8	L257 R258 V260 Y315 Y322 A357 L377 L378	L257-F359 CarbonylContact C-O 3.59Å; L257-F359 WeakPolarHBondContact CA-O 3.36Å; R258-F359 HydrophobicContact CB-CB 4.29Å; R258-F359 PolarHBondContact N-O 2.94Å; R258-F359 PolarHBondContact O-N 3.02Å; V260-F359 HydrophobicContact CG2-CE2 4.03Å; Y315-F359 AromaticContact CD1-CE1 3.74Å; Y315-F359 HydrophobicContact CD1-CE1 3.74Å; Y315-F359 HydrophobicContact CD1-CZ 4.49Å; Y315-F359 HydrophobicContact CE1-CE1 4.5Å; Y315-F359 HydrophobicContact CG-CE1 4.02Å; Y322-F359 HydrophobicContact CD2-CZ 4.02Å; Y322-F359 HydrophobicContact CG-CZ 4.1Å; A357-F359 HydrophobicContact CB-CD2 4.45Å; A357-F359 HydrophobicContact CB-CE2 3.72Å; A357-F359 HydrophobicContact CB-CZ 4.17Å; F359-L377 CarbonylContact C-O 3.58Å; F359-L377 WeakPolarHBondContact CA-O 3.41Å; F359-L378 HydrophobicContact CD1-CB 4.38Å; F359-L378 HydrophobicContact CD1-CD1 3.89Å; F359-L378 HydrophobicContact CD1-CD2 4.49Å; F359-L378 HydrophobicContact CD1-CG 4.48Å; F359-L378 HydrophobicContact CD2-CD1 4.36Å; F359-L378 HydrophobicContact CE1-CD1 3.69Å; F359-L378 HydrophobicContact CE1-CD2 3.85Å; F359-L378 HydrophobicContact CE1-CG 4.24Å; F359-L378 HydrophobicContact CE2-CD1 4.17Å; F359-L378 HydrophobicContact CG-CD1 4.22Å; F359-L378 HydrophobicContact CZ-CD1 3.82Å; F359-L378 HydrophobicContact CZ-CD2 4.32Å
360	L	94.7	Very high	92.6	Very high	4 Å²	4	24.6 Å²	24.6	2%	0.021	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	109.6	169.8	-174.3	152.9	0	0	0	107.1	T220 F224 R256 L257 F362 L377	T220-L360 HydrophobicContact CG2-CD1 4.27Å; F224-L360 HydrophobicContact CD1-CD1 4.03Å; F224-L360 HydrophobicContact CD2-CD1 4.1Å; F224-L360 HydrophobicContact CD2-CD2 3.95Å; F224-L360 HydrophobicContact CE1-CD1 3.84Å; F224-L360 HydrophobicContact CE1-CD2 4.38Å; F224-L360 HydrophobicContact CE2-CD1 3.94Å; F224-L360 HydrophobicContact CE2-CD2 3.24Å; F224-L360 HydrophobicContact CE2-CG 4.17Å; F224-L360 HydrophobicContact CG-CD1 4.16Å; F224-L360 HydrophobicContact CZ-CD1 3.8Å; F224-L360 HydrophobicContact CZ-CD2 3.5Å; F224-L360 VanDerWaalsContact CZ-CD2 3.5Å; F224-L360 HydrophobicContact CZ-CG 4.06Å; R256-L360 WeakPolarHBondContact O-CA 3.22Å; L257-L360 HydrophobicContact CD1-CD1 4.4Å; L257-L360 HydrophobicContact CG-CD1 4.38Å; L360-F362 HydrophobicContact CD2-CD1 3.6Å; L360-F362 HydrophobicContact CD2-CE1 3.76Å; L360-L377 HydrophobicContact CB-CB 4.32Å; L360-L377 HydrophobicContact CD2-CD1 4.28Å; L360-L377 PolarHBondContact N-O 2.81Å; L360-L377 PolarHBondContact O-N 3.26Å
361	D	93.3	Very high	92.5	Very high	13 Å²	13	24.8 Å²	24.8	7%	0.07	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	130.3	-171.7	-72.6	-23.5	0	0	0	110.5	P255 R256 R376 H482	P255-D361 WeakPolarHBondContact CA-O 3.2Å; R256-D361 PolarHBondContact N-O 3.33Å; R256-D361 PolarHBondContact O-N 2.87Å; D361-R376 VanDerWaalsContact OD1-CB 3.29Å; D361-R376 WeakPolarHBondContact OD1-CB 3.46Å; D361-R376 VanDerWaalsContact OD1-CG 3.26Å; D361-R376 WeakPolarHBondContact OD1-CG 3.48Å; D361-R376 IonicContact OD1-CZ 2.73Å; D361-R376 IonicContact OD1-NE 3.82Å; D361-R376 PolarHBondContact OD1-NE 3.17Å; D361-R376 IonicContact OD1-NH2 3.55Å; D361-R376 IonicContact OD2-CZ 3.09Å; D361-R376 IonicContact OD2-NE 3.33Å; D361-R376 PolarHBondContact OD2-NE 2.97Å; D361-R376 IonicContact OD2-NH2 2.68Å; D361-R376 PolarHBondContact OD2-NH2 3.18Å; D361-H482 PolarHBondContact O-CE1 3.25Å
362	F	92.6	Very high	92.3	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.009	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	160.9	174.9	62.8	-83.4	0	0	0	112.3	F194 F224 M228 P255 L360 V364 A375	F194-F362 HydrophobicContact CD1-CZ 4.36Å; F194-F362 HydrophobicContact CD2-CE2 4.33Å; F194-F362 AromaticContact CD2-CZ 3.75Å; F194-F362 HydrophobicContact CD2-CZ 3.75Å; F194-F362 HydrophobicContact CE1-CZ 4.2Å; F194-F362 AromaticContact CE2-CE2 3.73Å; F194-F362 HydrophobicContact CE2-CE2 3.73Å; F194-F362 AromaticContact CE2-CZ 3.56Å; F194-F362 HydrophobicContact CE2-CZ 3.56Å; F194-F362 HydrophobicContact CG-CZ 4.17Å; F194-F362 AromaticContact CZ-CE2 3.94Å; F194-F362 HydrophobicContact CZ-CE2 3.94Å; F194-F362 AromaticContact CZ-CZ 3.81Å; F194-F362 HydrophobicContact CZ-CZ 3.81Å; F224-F362 HydrophobicContact CE2-CD1 4.27Å; F224-F362 HydrophobicContact CE2-CE1 4.11Å; M228-F362 HydrophobicContact CE-CB 3.73Å; M228-F362 HydrophobicContact CE-CD1 4.23Å; M228-F362 HydrophobicContact CE-CD2 3.43Å; M228-F362 VanDerWaalsContact CE-CD2 3.43Å; M228-F362 HydrophobicContact CE-CE2 4.02Å; M228-F362 HydrophobicContact CE-CG 3.54Å; M228-F362 HydrophobicContact SD-CD2 3.75Å; M228-F362 HydrophobicContact SD-CE1 4.5Å; M228-F362 HydrophobicContact SD-CE2 3.67Å; M228-F362 HydrophobicContact SD-CG 4.2Å; M228-F362 HydrophobicContact SD-CZ 4.06Å; P255-F362 HydrophobicContact CB-CB 4.06Å; P255-F362 HydrophobicContact CG-CB 4.34Å; L360-F362 HydrophobicContact CD2-CD1 3.6Å; L360-F362 HydrophobicContact CD2-CE1 3.76Å; F362-V364 HydrophobicContact CD2-CG2 3.74Å; F362-V364 HydrophobicContact CE2-CG2 3.97Å; F362-A375 HydrophobicContact CD1-CB 4.08Å; F362-A375 HydrophobicContact CD2-CB 4.01Å; F362-A375 HydrophobicContact CE1-CB 3.67Å; F362-A375 HydrophobicContact CE2-CB 3.6Å; F362-A375 HydrophobicContact CG-CB 4.25Å; F362-A375 HydrophobicContact CZ-CB 3.42Å; F362-A375 VanDerWaalsContact CZ-CB 3.42Å; F362-A375 PolarHBondContact N-O 3.4Å; F362-A375 PolarHBondContact O-N 2.83Å
363	S	92.3	Very high	92.3	Very high	4 Å²	4	23 Å²	23	3%	0.028	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	133.3	-174.5	-63.8	0	0	0	0	110.9	L252 F485	L252-S363 WeakPolarHBondContact CB-O 3.48Å; L252-S363 PolarHBondContact N-O 2.74Å; S363-F485 WeakPolarHBondContact OG-CD2 3.11Å
364	V	92.4	Very high	92.5	Very high	1 Å²	1	17.7 Å²	17.7	1%	0.006	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	138.2	-173.9	-166	0	0	0	0	109.7	Y186 I245 N249 L250 F362 F372 C373	Y186-V364 PolarHBondContact OH-O 2.8Å; I245-V364 HydrophobicContact CD1-CG1 4.21Å; I245-V364 HydrophobicContact CD1-CG2 3.95Å; N249-V364 HydrophobicContact CB-CG1 3.53Å; L250-V364 CarbonylContact O-C 3.53Å; L250-V364 WeakPolarHBondContact O-CA 3.21Å; L250-V364 WeakPolarHBondContact O-CG1 3.48Å; F362-V364 HydrophobicContact CD2-CG2 3.74Å; F362-V364 HydrophobicContact CE2-CG2 3.97Å; V364-F372 CarbonylContact O-C 3.53Å; V364-F372 WeakPolarHBondContact O-CA 3.29Å; V364-C373 PolarHBondContact N-O 2.91Å; V364-C373 PolarHBondContact O-N 3.01Å
365	Y	91.4	Very high	92.5	Very high	56 Å²	56	17.7 Å²	17.7	22%	0.22	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	125.1	179.1	172.5	-109.9	0	0	0	111.6	N249 L250 F372	N249-Y365 CarbonylContact C-O 3.38Å; L250-Y365 PolarHBondContact N-O 3.33Å; L250-Y365 PolarHBondContact O-N 3.27Å; Y365-F372 AromaticContact CD2-CD1 3.82Å; Y365-F372 HydrophobicContact CD2-CD1 3.82Å; Y365-F372 AromaticContact CD2-CD2 3.68Å; Y365-F372 HydrophobicContact CD2-CD2 3.68Å; Y365-F372 AromaticContact CD2-CE1 3.62Å; Y365-F372 HydrophobicContact CD2-CE1 3.62Å; Y365-F372 AromaticContact CD2-CE2 3.43Å; Y365-F372 HydrophobicContact CD2-CE2 3.43Å; Y365-F372 VanDerWaalsContact CD2-CE2 3.43Å; Y365-F372 AromaticContact CD2-CG 3.84Å; Y365-F372 HydrophobicContact CD2-CG 3.84Å; Y365-F372 AromaticContact CD2-CZ 3.4Å; Y365-F372 HydrophobicContact CD2-CZ 3.4Å; Y365-F372 VanDerWaalsContact CD2-CZ 3.4Å; Y365-F372 HydrophobicContact CE2-CD2 4.02Å; Y365-F372 HydrophobicContact CE2-CE1 4.3Å; Y365-F372 AromaticContact CE2-CE2 3.45Å; Y365-F372 HydrophobicContact CE2-CE2 3.45Å; Y365-F372 VanDerWaalsContact CE2-CE2 3.45Å; Y365-F372 AromaticContact CE2-CZ 3.62Å; Y365-F372 HydrophobicContact CE2-CZ 3.62Å; Y365-F372 HydrophobicContact CG-CD1 4.34Å; Y365-F372 HydrophobicContact CG-CE1 4.08Å; Y365-F372 HydrophobicContact CG-CZ 4.19Å
366	N	92.4	Very high	92.4	Very high	8 Å²	8	18.3 Å²	18.3	4%	0.043	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	116.9	170.7	-175.1	-61.7	0	0	0	109.6	Y186 N249 N368 I369 N370 L371	Y186-N366 HydrophobicContact CE1-CB 4.32Å; Y186-N366 HydrophobicContact CE2-CB 4.35Å; N249-N366 WeakPolarHBondContact OD1-CB 3.42Å; N249-N366 PolarHBondContact OD1-ND2 2.87Å; N366-N368 WeakPolarHBondContact OD1-CA 3.28Å; N366-N368 WeakPolarHBondContact OD1-CB 3.23Å; N366-N368 PolarHBondContact OD1-N 3.45Å; N366-I369 HydrophobicContact CB-CD1 4.28Å; N366-I369 HydrophobicContact CB-CG1 3.98Å; N366-I369 PolarHBondContact OD1-N 2.93Å; N366-I369 VanDerWaalsContact OD1-N 3.11Å; N366-N370 WeakPolarHBondContact O-CA 3.45Å; N366-N370 PolarHBondContact O-N 3.23Å; N366-L371 PolarHBondContact N-O 3.42Å; N366-L371 PolarHBondContact O-N 3.37Å
367	G	88.1	Confident	92.5	Very high	45 Å²	45	17.8 Å²	17.8	46%	0.464	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-28.2	-179.4	0	0	0	0	0	114.7
368	N	89.5	Confident	92.4	Very high	116 Å²	116	17.8 Å²	17.8	62%	0.62	10%	0.1	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-35.5	-177.1	-64.4	-26.2	0	0	0	112.2	E248 N366	E248-N368 PolarHBondContact OE2-ND2 3.11Å; N366-N368 WeakPolarHBondContact OD1-CA 3.28Å; N366-N368 WeakPolarHBondContact OD1-CB 3.23Å; N366-N368 PolarHBondContact OD1-N 3.45Å
369	I	88.9	Confident	92.5	Very high	56 Å²	56	17.8 Å²	17.8	29%	0.287	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.9	-0.4	-178.5	67.6	-168.4	0	0	0	113.9	Y186 N366 L371	Y186-I369 HydrophobicContact CD1-CD1 4.38Å; Y186-I369 HydrophobicContact CG-CD1 4.38Å; N366-I369 HydrophobicContact CB-CD1 4.28Å; N366-I369 HydrophobicContact CB-CG1 3.98Å; N366-I369 PolarHBondContact OD1-N 2.93Å; N366-I369 VanDerWaalsContact OD1-N 3.11Å; I369-L371 HydrophobicContact CD1-CB 4.31Å; I369-L371 HydrophobicContact CD1-CD1 3.79Å; I369-L371 HydrophobicContact CD1-CG 4.3Å; I369-L371 HydrophobicContact CG1-CB 3.95Å; I369-L371 HydrophobicContact CG1-CD1 3.96Å; I369-L371 HydrophobicContact CG1-CG 3.93Å; I369-L371 PolarHBondContact O-N 2.73Å
370	N	90.1	Very high	92.5	Very high	18 Å²	18	17.8 Å²	17.8	10%	0.096	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.6	53.3	-176.8	177.9	22.5	0	0	0	112	N366 V399	N366-N370 WeakPolarHBondContact O-CA 3.45Å; N366-N370 PolarHBondContact O-N 3.23Å; N370-V399 PolarHBondContact ND2-O 3.31Å
371	L	90.6	Very high	92.5	Very high	5 Å²	5	17.7 Å²	17.7	3%	0.026	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	137.6	175	-68.6	178.6	0	0	0	110.9	M183 Y186 N366 I369 R397	M183-L371 HydrophobicContact CB-CD1 4.47Å; M183-L371 HydrophobicContact CG-CD1 3.6Å; M183-L371 HydrophobicContact CG-CD2 4.33Å; Y186-L371 HydrophobicContact CD1-CB 4.14Å; Y186-L371 HydrophobicContact CD1-CD1 4.48Å; Y186-L371 HydrophobicContact CE1-CB 4.14Å; N366-L371 PolarHBondContact N-O 3.42Å; N366-L371 PolarHBondContact O-N 3.37Å; I369-L371 HydrophobicContact CD1-CB 4.31Å; I369-L371 HydrophobicContact CD1-CD1 3.79Å; I369-L371 HydrophobicContact CD1-CG 4.3Å; I369-L371 HydrophobicContact CG1-CB 3.95Å; I369-L371 HydrophobicContact CG1-CD1 3.96Å; I369-L371 HydrophobicContact CG1-CG 3.93Å; I369-L371 PolarHBondContact O-N 2.73Å; L371-R397 HydrophobicContact CD2-CB 3.89Å; L371-R397 HydrophobicContact CD2-CG 4.19Å
372	F	91	Very high	92.5	Very high	12 Å²	12	18.2 Å²	18.2	5%	0.053	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	138.2	171.7	-60.6	-109.1	0	0	0	107.6	L252 V364 Y365 T395 V396 L398 V399	L252-F372 HydrophobicContact CD1-CD1 3.67Å; L252-F372 HydrophobicContact CD1-CE1 3.77Å; V364-F372 CarbonylContact O-C 3.53Å; V364-F372 WeakPolarHBondContact O-CA 3.29Å; Y365-F372 AromaticContact CD2-CD1 3.82Å; Y365-F372 HydrophobicContact CD2-CD1 3.82Å; Y365-F372 AromaticContact CD2-CD2 3.68Å; Y365-F372 HydrophobicContact CD2-CD2 3.68Å; Y365-F372 AromaticContact CD2-CE1 3.62Å; Y365-F372 HydrophobicContact CD2-CE1 3.62Å; Y365-F372 AromaticContact CD2-CE2 3.43Å; Y365-F372 HydrophobicContact CD2-CE2 3.43Å; Y365-F372 VanDerWaalsContact CD2-CE2 3.43Å; Y365-F372 AromaticContact CD2-CG 3.84Å; Y365-F372 HydrophobicContact CD2-CG 3.84Å; Y365-F372 AromaticContact CD2-CZ 3.4Å; Y365-F372 HydrophobicContact CD2-CZ 3.4Å; Y365-F372 VanDerWaalsContact CD2-CZ 3.4Å; Y365-F372 HydrophobicContact CE2-CD2 4.02Å; Y365-F372 HydrophobicContact CE2-CE1 4.3Å; Y365-F372 AromaticContact CE2-CE2 3.45Å; Y365-F372 HydrophobicContact CE2-CE2 3.45Å; Y365-F372 VanDerWaalsContact CE2-CE2 3.45Å; Y365-F372 AromaticContact CE2-CZ 3.62Å; Y365-F372 HydrophobicContact CE2-CZ 3.62Å; Y365-F372 HydrophobicContact CG-CD1 4.34Å; Y365-F372 HydrophobicContact CG-CE1 4.08Å; Y365-F372 HydrophobicContact CG-CZ 4.19Å; F372-T395 CarbonylContact O-C 3.56Å; F372-T395 VanDerWaalsContact O-CA 3.23Å; F372-T395 WeakPolarHBondContact O-CA 3.24Å; F372-V396 WeakPolarHBondContact CB-O 3.37Å; F372-V396 PolarHBondContact N-O 3.38Å; F372-V396 PolarHBondContact O-N 3Å; F372-L398 HydrophobicContact CB-CD1 3.84Å; F372-L398 HydrophobicContact CD1-CD1 4.25Å; F372-L398 HydrophobicContact CD2-CB 3.93Å; F372-L398 HydrophobicContact CD2-CD1 3.72Å; F372-L398 HydrophobicContact CD2-CG 4.34Å; F372-L398 HydrophobicContact CE2-CB 3.76Å; F372-L398 HydrophobicContact CE2-CD1 4.38Å; F372-L398 HydrophobicContact CG-CD1 3.67Å; F372-L398 HydrophobicContact CZ-CB 4.22Å; F372-V399 HydrophobicContact CE2-CG2 4.27Å; F372-V399 HydrophobicContact CZ-CG2 4.36Å
373	C	92.8	Very high	92.4	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.007	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	121.9	167	-176.2	0	0	0	0	107.6	Y186 V364 T395	Y186-C373 HydrophobicContact CD1-CB 4.36Å; Y186-C373 HydrophobicContact CE1-CB 3.58Å; V364-C373 PolarHBondContact N-O 2.91Å; V364-C373 PolarHBondContact O-N 3.01Å; C373-T395 HydrophobicContact CB-CG2 4.12Å
374	I	92.8	Very high	92.3	Very high	16 Å²	16	26.8 Å²	26.8	8%	0.082	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	117.1	174.2	-59.4	158.2	0	0	0	105.3	Q394 V396 F485 A489	I374-Q394 PolarHBondContact N-O 3.5Å; I374-Q394 PolarHBondContact O-N 3.01Å; I374-V396 HydrophobicContact CD1-CG2 3.85Å; I374-F485 HydrophobicContact CD1-CB 3.61Å; I374-F485 HydrophobicContact CD1-CG 4.41Å; I374-F485 HydrophobicContact CG1-CB 3.95Å; I374-F485 HydrophobicContact CG2-CB 4.44Å; I374-A489 HydrophobicContact CB-CB 4.31Å; I374-A489 HydrophobicContact CD1-CB 3.83Å; I374-A489 HydrophobicContact CG2-CB 4.13Å
375	A	93.3	Very high	92.1	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.008	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	128.8	-174.7	0	0	0	0	0	109.7	F362 F393	F362-A375 HydrophobicContact CD1-CB 4.08Å; F362-A375 HydrophobicContact CD2-CB 4.01Å; F362-A375 HydrophobicContact CE1-CB 3.67Å; F362-A375 HydrophobicContact CE2-CB 3.6Å; F362-A375 HydrophobicContact CG-CB 4.25Å; F362-A375 HydrophobicContact CZ-CB 3.42Å; F362-A375 VanDerWaalsContact CZ-CB 3.42Å; F362-A375 PolarHBondContact N-O 3.4Å; F362-A375 PolarHBondContact O-N 2.83Å; A375-F393 HydrophobicContact CB-CD1 3.67Å; A375-F393 HydrophobicContact CB-CE1 3.62Å
376	R	93.2	Very high	92.1	Very high	13 Å²	13	28.3 Å²	28.3	5%	0.049	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	122.4	172.2	168.5	165	-71.5	173.7	-1.6	108.7	D361 W391 H392 E486	D361-R376 VanDerWaalsContact OD1-CB 3.29Å; D361-R376 WeakPolarHBondContact OD1-CB 3.46Å; D361-R376 VanDerWaalsContact OD1-CG 3.26Å; D361-R376 WeakPolarHBondContact OD1-CG 3.48Å; D361-R376 IonicContact OD1-CZ 2.73Å; D361-R376 IonicContact OD1-NE 3.82Å; D361-R376 PolarHBondContact OD1-NE 3.17Å; D361-R376 IonicContact OD1-NH2 3.55Å; D361-R376 IonicContact OD2-CZ 3.09Å; D361-R376 IonicContact OD2-NE 3.33Å; D361-R376 PolarHBondContact OD2-NE 2.97Å; D361-R376 IonicContact OD2-NH2 2.68Å; D361-R376 PolarHBondContact OD2-NH2 3.18Å; R376-W391 CarbonylContact O-C 3.55Å; R376-W391 WeakPolarHBondContact O-CA 3.47Å; R376-H392 HydrophobicContact CB-CB 4.41Å; R376-H392 PolarHBondContact N-O 3.43Å; R376-H392 PolarHBondContact O-N 2.92Å; R376-E486 IonicContact CZ-OE1 3.98Å; R376-E486 IonicContact CZ-OE2 3.65Å; R376-E486 IonicContact NH1-OE1 2.65Å; R376-E486 PolarHBondContact NH1-OE1 3.48Å; R376-E486 IonicContact NH1-OE2 3.18Å; R376-E486 IonicContact NH2-OE1 3.35Å; R376-E486 PolarHBondContact NH2-OE1 3.26Å; R376-E486 IonicContact NH2-OE2 2.69Å; R376-E486 PolarHBondContact NH2-OE2 3.29Å
377	L	95.2	Very high	92.1	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.01	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	130	167.8	-58.3	-179.2	0	0	0	107.5	F194 L195 F207 F219 F359 L360 W391 F393	F194-L377 HydrophobicContact CB-CD1 4.37Å; L195-L377 HydrophobicContact CD2-CD2 3.85Å; F207-L377 HydrophobicContact CE1-CB 4.35Å; F207-L377 HydrophobicContact CE1-CD2 4.16Å; F207-L377 HydrophobicContact CE2-CB 4.21Å; F207-L377 HydrophobicContact CE2-CD1 4.27Å; F207-L377 HydrophobicContact CZ-CB 3.74Å; F207-L377 HydrophobicContact CZ-CD1 4.42Å; F207-L377 HydrophobicContact CZ-CD2 4.33Å; F207-L377 HydrophobicContact CZ-CG 4.38Å; F219-L377 HydrophobicContact CE1-CD1 4.09Å; F219-L377 HydrophobicContact CZ-CD1 3.91Å; F359-L377 CarbonylContact C-O 3.58Å; F359-L377 WeakPolarHBondContact CA-O 3.41Å; L360-L377 HydrophobicContact CB-CB 4.32Å; L360-L377 HydrophobicContact CD2-CD1 4.28Å; L360-L377 PolarHBondContact N-O 2.81Å; L360-L377 PolarHBondContact O-N 3.26Å; L377-W391 HydrophobicContact CD2-CB 3.75Å; L377-F393 HydrophobicContact CD2-CE2 4.11Å; L377-F393 HydrophobicContact CD2-CZ 3.92Å
378	L	95.4	Very high	92.4	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	128.6	-179.5	167.7	58	0	0	0	109	Y315 A357 V358 F359 E380 T389 S390	Y315-L378 HydrophobicContact CD1-CD2 3.73Å; Y315-L378 HydrophobicContact CE1-CD2 3.51Å; A357-L378 HydrophobicContact CB-CD1 3.84Å; V358-L378 WeakPolarHBondContact O-CA 3.39Å; F359-L378 HydrophobicContact CD1-CB 4.38Å; F359-L378 HydrophobicContact CD1-CD1 3.89Å; F359-L378 HydrophobicContact CD1-CD2 4.49Å; F359-L378 HydrophobicContact CD1-CG 4.48Å; F359-L378 HydrophobicContact CD2-CD1 4.36Å; F359-L378 HydrophobicContact CE1-CD1 3.69Å; F359-L378 HydrophobicContact CE1-CD2 3.85Å; F359-L378 HydrophobicContact CE1-CG 4.24Å; F359-L378 HydrophobicContact CE2-CD1 4.17Å; F359-L378 HydrophobicContact CG-CD1 4.22Å; F359-L378 HydrophobicContact CZ-CD1 3.82Å; F359-L378 HydrophobicContact CZ-CD2 4.32Å; L378-E380 HydrophobicContact CD1-CG 3.94Å; L378-E380 HydrophobicContact CD2-CG 4.03Å; L378-E380 VanDerWaalsContact CD2-OE1 3.23Å; L378-E380 WeakPolarHBondContact CD2-OE1 3.45Å; L378-E380 HydrophobicContact CG-CG 3.84Å; L378-T389 WeakPolarHBondContact O-CA 3.4Å; L378-S390 WeakPolarHBondContact CB-OG 3.28Å; L378-S390 PolarHBondContact N-O 3.31Å; L378-S390 PolarHBondContact O-N 2.96Å; L378-S390 VanDerWaalsContact O-O 3.06Å
379	V	96.3	Very high	92.6	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.006	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	111.1	170.3	-172.8	0	0	0	0	108.2	F207 F216 A357 V358 F381 A387 T389	F207-V379 HydrophobicContact CE2-CG2 3.85Å; F207-V379 HydrophobicContact CZ-CG2 3.78Å; F216-V379 HydrophobicContact CD2-CB 4.2Å; F216-V379 HydrophobicContact CD2-CG1 4.41Å; F216-V379 HydrophobicContact CD2-CG2 3.65Å; F216-V379 HydrophobicContact CE2-CB 4.37Å; F216-V379 HydrophobicContact CE2-CG2 3.78Å; A357-V379 WeakPolarHBondContact CA-O 3.45Å; V358-V379 PolarHBondContact N-O 3.4Å; V358-V379 PolarHBondContact O-N 2.86Å; V379-F381 HydrophobicContact CB-CE2 4.34Å; V379-F381 HydrophobicContact CB-CZ 4.39Å; V379-F381 HydrophobicContact CG1-CE1 4.06Å; V379-F381 HydrophobicContact CG1-CE2 3.9Å; V379-F381 HydrophobicContact CG1-CZ 3.56Å; V379-A387 HydrophobicContact CG1-CB 4.02Å; V379-T389 HydrophobicContact CG1-CG2 4.3Å; V379-T389 HydrophobicContact CG2-CG2 4.03Å
380	E	95.9	Very high	92.9	Very high	0 Å²	0	22 Å²	22	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	139.1	177.3	-62.7	172.2	-157.6	0	0	108.8	G317 Q318 V319 Y322 R356 L378 A387 V388	G317-E380 WeakPolarHBondContact CA-OE1 3.28Å; Q318-E380 PolarHBondContact N-OE1 3.43Å; Q318-E380 PolarHBondContact N-OE2 3.11Å; V319-E380 WeakPolarHBondContact CB-OE2 3.38Å; V319-E380 VanDerWaalsContact CG2-OE2 3.29Å; V319-E380 WeakPolarHBondContact CG2-OE2 3.38Å; V319-E380 PolarHBondContact N-OE2 2.97Å; Y322-E380 HydrophobicContact CE2-CG 3.92Å; Y322-E380 WeakPolarHBondContact OH-CG 3.3Å; R356-E380 WeakPolarHBondContact O-CA 3.33Å; L378-E380 HydrophobicContact CD1-CG 3.94Å; L378-E380 HydrophobicContact CD2-CG 4.03Å; L378-E380 VanDerWaalsContact CD2-OE1 3.23Å; L378-E380 WeakPolarHBondContact CD2-OE1 3.45Å; L378-E380 HydrophobicContact CG-CG 3.84Å; E380-A387 CarbonylContact O-C 3.44Å; E380-A387 WeakPolarHBondContact O-CA 3.25Å; E380-V388 HydrophobicContact CB-CB 4.4Å; E380-V388 PolarHBondContact N-O 2.62Å; E380-V388 PolarHBondContact O-N 2.99Å
381	F	95.7	Very high	93.1	Very high	2 Å²	2	25.7 Å²	25.7	1%	0.009	17%	0.169	C	C	.	.			trans	-116.6	95.9	175.6	-63.7	-77.7	0	0	0	107.2	M213 T355 R356 V358 V379 G386 A387	M213-F381 HydrophobicContact CB-CE1 4.21Å; M213-F381 HydrophobicContact CE-CB 4.21Å; M213-F381 HydrophobicContact CE-CD1 3.67Å; M213-F381 HydrophobicContact CE-CE1 4.21Å; M213-F381 HydrophobicContact CE-CG 3.89Å; M213-F381 HydrophobicContact CG-CD1 3.69Å; M213-F381 HydrophobicContact CG-CE1 3.28Å; M213-F381 HydrophobicContact CG-CZ 3.91Å; T355-F381 HydrophobicContact CG2-CD2 4.02Å; T355-F381 HydrophobicContact CG2-CE2 4.5Å; R356-F381 WeakPolarHBondContact CD-O 3.3Å; R356-F381 PolarHBondContact O-N 2.81Å; V358-F381 HydrophobicContact CB-CE2 4.4Å; V358-F381 HydrophobicContact CG2-CD2 4.42Å; V358-F381 HydrophobicContact CG2-CE2 3.8Å; V379-F381 HydrophobicContact CB-CE2 4.34Å; V379-F381 HydrophobicContact CB-CZ 4.39Å; V379-F381 HydrophobicContact CG1-CE1 4.06Å; V379-F381 HydrophobicContact CG1-CE2 3.9Å; V379-F381 HydrophobicContact CG1-CZ 3.56Å; F381-G386 WeakPolarHBondContact CD1-O 3.38Å; F381-A387 HydrophobicContact CD1-CB 4.05Å; F381-A387 HydrophobicContact CE1-CB 3.74Å
382	P	93.3	Very high	93.2	Very high	23 Å²	23	28.7 Å²	28.7	15%	0.149	18%	0.182	C	C	.	.			trans	-57.3	156.4	178.8	-24.5	34.2	0	0	0	112.1	V319 T384 G385 V388	V319-P382 HydrophobicContact CG2-CG 4.31Å; P382-T384 WeakPolarHBondContact CB-OG1 3.37Å; P382-T384 PolarHBondContact O-N 3.17Å; P382-T384 VanDerWaalsContact O-N 3.16Å; P382-G385 PolarHBondContact O-N 3.32Å; P382-V388 HydrophobicContact CG-CG2 3.96Å
383	A	91	Very high	93.3	Very high	50 Å²	50	29.5 Å²	29.5	41%	0.413	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-20.2	176.2	0	0	0	0	0	113.2	I283 G385	I283-A383 HydrophobicContact CG1-CB 3.9Å; A383-G385 PolarHBondContact O-N 3.38Å
384	T	89.5	Confident	93.2	Very high	137 Å²	137	31 Å²	31	84%	0.84	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-6.4	170.7	52.3	0	0	0	0	113.9	P382	P382-T384 WeakPolarHBondContact CB-OG1 3.37Å; P382-T384 PolarHBondContact O-N 3.17Å; P382-T384 VanDerWaalsContact O-N 3.16Å
385	G	88.3	Confident	93.2	Very high	41 Å²	41	30.6 Å²	30.6	42%	0.423	19%	0.191	S	C	.	.	S	Bend	trans	83.9	-169.2	-167.7	0	0	0	0	0	112.9	P382 A383	P382-G385 PolarHBondContact O-N 3.32Å; A383-G385 PolarHBondContact O-N 3.38Å
386	G	91.4	Very high	92.9	Very high	47 Å²	47	30.7 Å²	30.7	49%	0.485	19%	0.192	S	C	.	.	S	Bend	trans	73.4	-174.5	-169.8	0	0	0	0	0	112.8	S211 F381	S211-G386 CarbonylContact O-C 3.35Å; S211-G386 WeakPolarHBondContact O-CA 3.43Å; F381-G386 WeakPolarHBondContact CD1-O 3.38Å
387	A	93.2	Very high	92.6	Very high	15 Å²	15	33.6 Å²	33.6	12%	0.124	20%	0.203	C	C	.	.			trans	-134.3	143.2	174.1	0	0	0	0	0	109.7	S211 V379 E380 F381	S211-A387 PolarHBondContact O-N 3.36Å; V379-A387 HydrophobicContact CG1-CB 4.02Å; E380-A387 CarbonylContact O-C 3.44Å; E380-A387 WeakPolarHBondContact O-CA 3.25Å; F381-A387 HydrophobicContact CD1-CB 4.05Å; F381-A387 HydrophobicContact CE1-CB 3.74Å
388	V	93.5	Very high	92	Very high	42 Å²	42	34.5 Å²	34.5	26%	0.255	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	126.6	174.6	178.9	0	0	0	0	107.7	E380 P382	E380-V388 HydrophobicContact CB-CB 4.4Å; E380-V388 PolarHBondContact N-O 2.62Å; E380-V388 PolarHBondContact O-N 2.99Å; P382-V388 HydrophobicContact CG-CG2 3.96Å
389	T	94.5	Very high	91.4	Very high	14 Å²	14	37.1 Å²	37.1	9%	0.086	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	133.2	-175.8	58.4	0	0	0	0	112.9	F207 L210 L378 V379	F207-T389 HydrophobicContact CD1-CG2 4.48Å; F207-T389 HydrophobicContact CE1-CG2 4.13Å; F207-T389 HydrophobicContact CZ-CG2 4.14Å; F207-T389 WeakPolarHBondContact O-CG2 3.47Å; F207-T389 PolarHBondContact O-OG1 3.36Å; L210-T389 HydrophobicContact CB-CG2 3.68Å; L210-T389 HydrophobicContact CD1-CG2 4.11Å; L210-T389 HydrophobicContact CG-CG2 4.45Å; L378-T389 WeakPolarHBondContact O-CA 3.4Å; V379-T389 HydrophobicContact CG1-CG2 4.3Å; V379-T389 HydrophobicContact CG2-CG2 4.03Å
390	S	94.7	Very high	90.7	Very high	22 Å²	22	39 Å²	39	15%	0.154	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	161.5	169.7	61.9	0	0	0	0	110.6	L378	L378-S390 WeakPolarHBondContact CB-OG 3.28Å; L378-S390 PolarHBondContact N-O 3.31Å; L378-S390 PolarHBondContact O-N 2.96Å; L378-S390 VanDerWaalsContact O-O 3.06Å
391	W	94.2	Very high	90	Very high	96 Å²	96	44.4 Å²	44.4	36%	0.364	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	150.1	-175.9	56.2	80	0	0	0	111	L195 F207 R208 R376 L377 F393	L195-W391 HydrophobicContact CD1-CB 4.46Å; L195-W391 HydrophobicContact CD1-CD2 3.66Å; L195-W391 HydrophobicContact CD1-CE3 4.35Å; L195-W391 HydrophobicContact CD1-CG 3.64Å; L195-W391 HydrophobicContact CD2-CB 3.83Å; L195-W391 HydrophobicContact CD2-CD2 3.85Å; L195-W391 HydrophobicContact CD2-CE3 3.97Å; L195-W391 HydrophobicContact CD2-CG 3.76Å; L195-W391 HydrophobicContact CG-CD2 4.43Å; L195-W391 HydrophobicContact CG-CG 4.36Å; F207-W391 HydrophobicContact CD1-CE3 4.27Å; F207-W391 HydrophobicContact CE1-CE3 4.28Å; R208-W391 HydrophobicContact CB-CZ3 4.33Å; R208-W391 HydrophobicContact CG-CH2 4.09Å; R208-W391 HydrophobicContact CG-CZ3 3.96Å; R376-W391 CarbonylContact O-C 3.55Å; R376-W391 WeakPolarHBondContact O-CA 3.47Å; L377-W391 HydrophobicContact CD2-CB 3.75Å; W391-F393 HydrophobicContact CB-CE2 4.1Å; W391-F393 HydrophobicContact CG-CE2 4.38Å
392	H	92.4	Very high	89.5	Confident	68 Å²	68	48.7 Å²	48.7	32%	0.315	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	114.4	176	-169.3	69.8	0	0	0	110	R376	R376-H392 HydrophobicContact CB-CB 4.41Å; R376-H392 PolarHBondContact N-O 3.43Å; R376-H392 PolarHBondContact O-N 2.92Å
393	F	92.9	Very high	89.1	Confident	29 Å²	29	50.6 Å²	50.6	13%	0.127	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	102.1	175.5	-69.2	-87.2	0	0	0	108.7	M190 F194 L195 A375 L377 W391	M190-F393 HydrophobicContact CB-CD1 4.13Å; M190-F393 HydrophobicContact CB-CE1 4.22Å; F194-F393 HydrophobicContact CB-CZ 4.18Å; F194-F393 HydrophobicContact CD2-CE1 4.21Å; F194-F393 HydrophobicContact CD2-CZ 4.41Å; L195-F393 HydrophobicContact CD1-CE2 3.97Å; L195-F393 HydrophobicContact CD2-CE2 4.13Å; L195-F393 HydrophobicContact CG-CE2 4.01Å; L195-F393 HydrophobicContact CG-CZ 4.48Å; A375-F393 HydrophobicContact CB-CD1 3.67Å; A375-F393 HydrophobicContact CB-CE1 3.62Å; L377-F393 HydrophobicContact CD2-CE2 4.11Å; L377-F393 HydrophobicContact CD2-CZ 3.92Å; W391-F393 HydrophobicContact CB-CE2 4.1Å; W391-F393 HydrophobicContact CG-CE2 4.38Å
394	Q	91.7	Very high	89	Confident	31 Å²	31	53.3 Å²	53.3	15%	0.145	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	120.8	179	-176	58.1	53.3	0	0	110.1	I374 V396 A489	I374-Q394 PolarHBondContact N-O 3.5Å; I374-Q394 PolarHBondContact O-N 3.01Å; Q394-V396 HydrophobicContact CG-CG2 3.91Å; Q394-A489 HydrophobicContact CB-CB 4.29Å; Q394-A489 HydrophobicContact CG-CB 4.28Å
395	T	91.2	Very high	88.9	Confident	8 Å²	8	52.6 Å²	52.6	5%	0.049	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	137.4	168.3	42.9	0	0	0	0	111.1	M183 Y186 T187 F372 C373	M183-T395 WeakPolarHBondContact CE-OG1 3.35Å; Y186-T395 HydrophobicContact CD1-CG2 3.54Å; Y186-T395 HydrophobicContact CE1-CG2 4.05Å; Y186-T395 HydrophobicContact CG-CG2 4.39Å; T187-T395 HydrophobicContact CG2-CG2 3.53Å; F372-T395 CarbonylContact O-C 3.56Å; F372-T395 VanDerWaalsContact O-CA 3.23Å; F372-T395 WeakPolarHBondContact O-CA 3.24Å; C373-T395 HydrophobicContact CB-CG2 4.12Å
396	V	87.7	Confident	88.8	Confident	4 Å²	4	51.1 Å²	51.1	2%	0.024	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	137.5	-175.6	-166.6	0	0	0	0	109.4	F372 I374 Q394 L398 Q492	F372-V396 WeakPolarHBondContact CB-O 3.37Å; F372-V396 PolarHBondContact N-O 3.38Å; F372-V396 PolarHBondContact O-N 3Å; I374-V396 HydrophobicContact CD1-CG2 3.85Å; Q394-V396 HydrophobicContact CG-CG2 3.91Å; V396-L398 HydrophobicContact CB-CD1 3.73Å; V396-L398 HydrophobicContact CG1-CD1 3.61Å; V396-Q492 HydrophobicContact CG1-CB 4.38Å; V396-Q492 HydrophobicContact CG1-CG 4.07Å; V396-Q492 HydrophobicContact CG2-CB 4.33Å; V396-Q492 HydrophobicContact CG2-CG 4.05Å
397	R	86.5	Confident	88.7	Confident	73 Å²	73	55.5 Å²	55.5	28%	0.275	28%	0.275	S	S	.	.			trans	-100.5	89	173	-166.9	170.4	-173.5	-152.1	-7.4	109.8	L371 D406	L371-R397 HydrophobicContact CD2-CB 3.89Å; L371-R397 HydrophobicContact CD2-CG 4.19Å; R397-D406 IonicContact CZ-OD1 2.83Å; R397-D406 IonicContact CZ-OD2 4Å; R397-D406 IonicContact NH1-OD1 2.92Å; R397-D406 PolarHBondContact NH1-OD1 2.94Å; R397-D406 IonicContact NH1-OD2 3.25Å; R397-D406 IonicContact NH2-OD1 3.71Å; R397-D406 PolarHBondContact NH2-OD1 3.44Å; R397-D406 IonicContact NH2-OD2 2.82Å; R397-D406 PolarHBondContact NH2-OD2 2.77Å
398	L	82.3	Confident	88.6	Confident	21 Å²	21	59.4 Å²	59.4	11%	0.11	29%	0.289	C	S	.	.			trans	-71.7	-46.8	-178.6	-81.9	77.1	0	0	0	111.5	F372 V396 R400 A468 F485 L488	F372-L398 HydrophobicContact CB-CD1 3.84Å; F372-L398 HydrophobicContact CD1-CD1 4.25Å; F372-L398 HydrophobicContact CD2-CB 3.93Å; F372-L398 HydrophobicContact CD2-CD1 3.72Å; F372-L398 HydrophobicContact CD2-CG 4.34Å; F372-L398 HydrophobicContact CE2-CB 3.76Å; F372-L398 HydrophobicContact CE2-CD1 4.38Å; F372-L398 HydrophobicContact CG-CD1 3.67Å; F372-L398 HydrophobicContact CZ-CB 4.22Å; V396-L398 HydrophobicContact CB-CD1 3.73Å; V396-L398 HydrophobicContact CG1-CD1 3.61Å; L398-R400 PolarHBondContact O-N 3.23Å; L398-A468 HydrophobicContact CD2-CB 4.43Å; L398-A468 HydrophobicContact CG-CB 4.3Å; L398-F485 HydrophobicContact CD2-CD1 4.41Å; L398-F485 HydrophobicContact CD2-CE1 3.89Å; L398-F485 HydrophobicContact CD2-CZ 4.33Å; L398-L488 HydrophobicContact CD1-CD2 4.12Å; L398-L488 HydrophobicContact CD2-CD2 3.72Å; L398-L488 HydrophobicContact CG-CD2 3.88Å
399	V	83.4	Confident	88.4	Confident	55 Å²	55	58.1 Å²	58.1	33%	0.333	28%	0.281	S	S	.	.			trans	-89.2	101.9	-179.8	-169.9	0	0	0	0	109.3	N370 F372 V402 L472	N370-V399 PolarHBondContact ND2-O 3.31Å; F372-V399 HydrophobicContact CE2-CG2 4.27Å; F372-V399 HydrophobicContact CZ-CG2 4.36Å; V399-V402 HydrophobicContact CG1-CG2 3.65Å; V399-L472 HydrophobicContact CG2-CD2 4.01Å
400	R	80.4	Confident	88.2	Confident	42 Å²	42	58 Å²	58	16%	0.158	28%	0.283	C	S	.	.			trans	-82.8	-62	-170.5	-69.4	177.5	163.4	-131.5	-15.2	114.1	L398 V402 D406 E413 N461	L398-R400 PolarHBondContact O-N 3.23Å; R400-V402 PolarHBondContact O-N 2.83Å; R400-V402 VanDerWaalsContact O-N 3.12Å; R400-D406 WeakPolarHBondContact O-CB 3.39Å; R400-E413 IonicContact CZ-OE1 2.76Å; R400-E413 IonicContact NH1-OE1 3.41Å; R400-E413 PolarHBondContact NH1-OE1 3.22Å; R400-E413 IonicContact NH1-OE2 3.79Å; R400-N461 PolarHBondContact NH1-OD1 2.81Å
401	Y	81.7	Confident	88.1	Confident	113 Å²	113	61.6 Å²	61.6	44%	0.443	30%	0.304	S	S	.	.			trans	-88.7	78.8	-166.1	-49.7	-64.8	0	0	0	112	E413	Y401-E413 PolarHBondContact OH-OE2 3.36Å
402	V	85.2	Confident	88	Confident	92 Å²	92	57.7 Å²	57.7	56%	0.558	29%	0.291	S	S	*	.			trans	-116.4	-51.7	179.8	-174.2	0	0	0	0	111.5	V399 R400 D406	V399-V402 HydrophobicContact CG1-CG2 3.65Å; R400-V402 PolarHBondContact O-N 2.83Å; R400-V402 VanDerWaalsContact O-N 3.12Å; V402-D406 PolarHBondContact N-OD2 3Å
403	S	86.1	Confident	87.9	Confident	63 Å²	63	55.6 Å²	55.6	44%	0.441	28%	0.281	S	S	.	.	S	Bend	trans	-90.3	154.9	-179.7	-177.8	0	0	0	0	111.8	W405 D406 Y407	S403-W405 PolarHBondContact O-N 2.65Å; S403-W405 VanDerWaalsContact O-N 3.15Å; S403-D406 WeakPolarHBondContact CA-OD2 3.48Å; S403-D406 VanDerWaalsContact CB-OD2 3.28Å; S403-D406 WeakPolarHBondContact CB-OD2 3.38Å; S403-D406 PolarHBondContact N-OD2 3.11Å; S403-D406 WeakPolarHBondContact O-CA 3.41Å; S403-D406 WeakPolarHBondContact O-CB 3.45Å; S403-D406 PolarHBondContact O-N 3.31Å; S403-Y407 VanDerWaalsContact O-CD2 3.28Å; S403-Y407 WeakPolarHBondContact O-CD2 3.49Å; S403-Y407 PolarHBondContact O-N 3.06Å
404	S	88.5	Confident	87.9	Confident	106 Å²	106	58.6 Å²	58.6	74%	0.741	30%	0.301	S	S	*	.	H	α-helix	trans	-53	-33.1	171.5	-50.7	0	0	0	0	112.9	D406 Y407 F408	S404-D406 VanDerWaalsContact C-N 3.32Å; S404-D406 PolarHBondContact O-N 3.13Å; S404-Y407 PolarHBondContact O-N 2.82Å; S404-F408 PolarHBondContact O-N 3.31Å
405	W	86.7	Confident	88	Confident	122 Å²	122	58.6 Å²	58.6	46%	0.462	31%	0.307	S	S	.	.	H	α-helix	trans	-65.2	-35	174.3	-175.5	-107.5	0	0	0	112.5	S403 F408 V409	S403-W405 PolarHBondContact O-N 2.65Å; S403-W405 VanDerWaalsContact O-N 3.15Å; W405-F408 AromaticContact CE3-CD1 4Å; W405-F408 HydrophobicContact CE3-CD1 4Å; W405-F408 AromaticContact CH2-CD1 3.94Å; W405-F408 HydrophobicContact CH2-CD1 3.94Å; W405-F408 AromaticContact CH2-CE1 3.91Å; W405-F408 HydrophobicContact CH2-CE1 3.91Å; W405-F408 HydrophobicContact CZ2-CD1 4.45Å; W405-F408 AromaticContact CZ3-CD1 3.7Å; W405-F408 HydrophobicContact CZ3-CD1 3.7Å; W405-F408 AromaticContact CZ3-CE1 3.96Å; W405-F408 HydrophobicContact CZ3-CE1 3.96Å; W405-F408 WeakPolarHBondContact O-CB 3.45Å; W405-F408 PolarHBondContact O-N 3.24Å; W405-V409 WeakPolarHBondContact O-CG2 3.44Å; W405-V409 PolarHBondContact O-N 3.12Å
406	D	86.4	Confident	88.2	Confident	10 Å²	10	59.5 Å²	59.5	5%	0.053	31%	0.31	C	S	.	.	H	α-helix	trans	-72.3	-33.9	-179.6	-50.3	-38.4	0	0	0	111.7	R397 R400 V402 S403 S404 F408 V409 G410	R397-D406 IonicContact CZ-OD1 2.83Å; R397-D406 IonicContact CZ-OD2 4Å; R397-D406 IonicContact NH1-OD1 2.92Å; R397-D406 PolarHBondContact NH1-OD1 2.94Å; R397-D406 IonicContact NH1-OD2 3.25Å; R397-D406 IonicContact NH2-OD1 3.71Å; R397-D406 PolarHBondContact NH2-OD1 3.44Å; R397-D406 IonicContact NH2-OD2 2.82Å; R397-D406 PolarHBondContact NH2-OD2 2.77Å; R400-D406 WeakPolarHBondContact O-CB 3.39Å; V402-D406 PolarHBondContact N-OD2 3Å; S403-D406 WeakPolarHBondContact CA-OD2 3.48Å; S403-D406 VanDerWaalsContact CB-OD2 3.28Å; S403-D406 WeakPolarHBondContact CB-OD2 3.38Å; S403-D406 PolarHBondContact N-OD2 3.11Å; S403-D406 WeakPolarHBondContact O-CA 3.41Å; S403-D406 WeakPolarHBondContact O-CB 3.45Å; S403-D406 PolarHBondContact O-N 3.31Å; S404-D406 VanDerWaalsContact C-N 3.32Å; S404-D406 PolarHBondContact O-N 3.13Å; D406-F408 VanDerWaalsContact C-N 3.34Å; D406-V409 PolarHBondContact O-N 3.05Å; D406-G410 PolarHBondContact O-N 3.01Å
407	Y	89.9	Confident	88.5	Confident	140 Å²	140	62 Å²	62	55%	0.549	33%	0.327	S	S	.	.	H	α-helix	trans	-65.1	-38.5	170.6	-71	-76.7	0	0	0	111.5	S403 S404 G410 V411	S403-Y407 VanDerWaalsContact O-CD2 3.28Å; S403-Y407 WeakPolarHBondContact O-CD2 3.49Å; S403-Y407 PolarHBondContact O-N 3.06Å; S404-Y407 PolarHBondContact O-N 2.82Å; Y407-G410 PolarHBondContact O-N 3.41Å; Y407-V411 WeakPolarHBondContact O-CG2 3.29Å; Y407-V411 PolarHBondContact O-N 3.34Å
408	F	90.9	Very high	88.9	Confident	97 Å²	97	63.9 Å²	63.9	43%	0.425	34%	0.342	S	S	.	.	H	α-helix	trans	-63.9	-43.8	172.8	174.7	-104.2	0	0	0	112.2	V173 S404 W405 D406 G410 V411 C412	V173-F408 HydrophobicContact CG1-CE1 3.83Å; S404-F408 PolarHBondContact O-N 3.31Å; W405-F408 AromaticContact CE3-CD1 4Å; W405-F408 HydrophobicContact CE3-CD1 4Å; W405-F408 AromaticContact CH2-CD1 3.94Å; W405-F408 HydrophobicContact CH2-CD1 3.94Å; W405-F408 AromaticContact CH2-CE1 3.91Å; W405-F408 HydrophobicContact CH2-CE1 3.91Å; W405-F408 HydrophobicContact CZ2-CD1 4.45Å; W405-F408 AromaticContact CZ3-CD1 3.7Å; W405-F408 HydrophobicContact CZ3-CD1 3.7Å; W405-F408 AromaticContact CZ3-CE1 3.96Å; W405-F408 HydrophobicContact CZ3-CE1 3.96Å; W405-F408 WeakPolarHBondContact O-CB 3.45Å; W405-F408 PolarHBondContact O-N 3.24Å; D406-F408 VanDerWaalsContact C-N 3.34Å; F408-G410 VanDerWaalsContact C-N 3.3Å; F408-G410 PolarHBondContact O-N 2.85Å; F408-V411 PolarHBondContact O-N 3.35Å; F408-C412 PolarHBondContact O-N 3.02Å; F408-C412 PolarHBondContact O-SG 3.5Å
409	V	89.8	Confident	89.5	Confident	14 Å²	14	65.5 Å²	65.5	9%	0.085	35%	0.348	C	S	.	.	H	α-helix	trans	-60	-40.2	172.2	173.1	0	0	0	0	111	L174 W405 D406 V411 C412 E413	L174-V409 HydrophobicContact CD2-CG1 4.02Å; W405-V409 WeakPolarHBondContact O-CG2 3.44Å; W405-V409 PolarHBondContact O-N 3.12Å; D406-V409 PolarHBondContact O-N 3.05Å; V409-V411 PolarHBondContact O-N 3.36Å; V409-C412 CarbonylContact O-C 3.6Å; V409-C412 WeakPolarHBondContact O-CA 3.47Å; V409-C412 WeakPolarHBondContact O-CB 3.34Å; V409-C412 PolarHBondContact O-N 3.32Å; V409-C412 VanDerWaalsContact O-N 3.09Å; V409-E413 PolarHBondContact O-N 3.25Å
410	G	90	Very high	90	Very high	12 Å²	12	63.1 Å²	63.1	12%	0.124	33%	0.334	C	S	.	.	H	α-helix	trans	-62.3	-37.5	174.4	0	0	0	0	0	114	D406 Y407 F408 C412 E413 V414	D406-G410 PolarHBondContact O-N 3.01Å; Y407-G410 PolarHBondContact O-N 3.41Å; F408-G410 VanDerWaalsContact C-N 3.3Å; F408-G410 PolarHBondContact O-N 2.85Å; G410-C412 VanDerWaalsContact C-N 3.32Å; G410-E413 PolarHBondContact O-N 3.05Å; G410-V414 PolarHBondContact O-N 3.05Å; G410-V414 VanDerWaalsContact O-N 3.17Å
411	V	91.6	Very high	90.7	Very high	98 Å²	98	66.4 Å²	66.4	59%	0.594	35%	0.354	S	S	*	.	H	α-helix	trans	-64.6	-38.4	171.1	173.6	0	0	0	0	110.8	Y407 F408 V409 V414 A415	Y407-V411 WeakPolarHBondContact O-CG2 3.29Å; Y407-V411 PolarHBondContact O-N 3.34Å; F408-V411 PolarHBondContact O-N 3.35Å; V409-V411 PolarHBondContact O-N 3.36Å; V411-V414 PolarHBondContact O-N 3.03Å; V411-A415 PolarHBondContact O-N 3.37Å
412	C	91.9	Very high	91.2	Very high	14 Å²	14	63.1 Å²	63.1	10%	0.095	34%	0.341	C	S	.	.	H	α-helix	trans	-66.8	-33.5	173.7	-61.4	0	0	0	0	112.6	T170 V173 L174 F408 V409 G410 V414 A415 F416	T170-C412 HydrophobicContact CG2-CB 4.38Å; V173-C412 HydrophobicContact CG1-CB 4.42Å; L174-C412 HydrophobicContact CD2-CB 3.78Å; L174-C412 HydrophobicContact CG-CB 4.15Å; F408-C412 PolarHBondContact O-N 3.02Å; F408-C412 PolarHBondContact O-SG 3.5Å; V409-C412 CarbonylContact O-C 3.6Å; V409-C412 WeakPolarHBondContact O-CA 3.47Å; V409-C412 WeakPolarHBondContact O-CB 3.34Å; V409-C412 PolarHBondContact O-N 3.32Å; V409-C412 VanDerWaalsContact O-N 3.09Å; G410-C412 VanDerWaalsContact C-N 3.32Å; C412-V414 VanDerWaalsContact C-N 3.35Å; C412-A415 PolarHBondContact O-N 3.25Å; C412-F416 WeakPolarHBondContact O-CB 3.46Å; C412-F416 PolarHBondContact O-N 3.01Å
413	E	91.6	Very high	91.6	Very high	24 Å²	24	59.4 Å²	59.4	11%	0.112	32%	0.317	C	S	.	.	H	α-helix	trans	-63.6	-41.6	174.4	-74.5	-170.7	132.3	0	0	110.4	L174 R400 Y401 V409 G410 F416 C417 N461	L174-E413 HydrophobicContact CD2-CB 4.31Å; L174-E413 HydrophobicContact CD2-CG 3.54Å; R400-E413 IonicContact CZ-OE1 2.76Å; R400-E413 IonicContact NH1-OE1 3.41Å; R400-E413 PolarHBondContact NH1-OE1 3.22Å; R400-E413 IonicContact NH1-OE2 3.79Å; Y401-E413 PolarHBondContact OH-OE2 3.36Å; V409-E413 PolarHBondContact O-N 3.25Å; G410-E413 PolarHBondContact O-N 3.05Å; E413-F416 PolarHBondContact O-N 3.42Å; E413-C417 PolarHBondContact O-N 2.97Å; E413-C417 VanDerWaalsContact O-N 3.13Å; E413-C417 PolarHBondContact O-SG 2.87Å; E413-C417 VanDerWaalsContact O-SG 3.38Å; E413-N461 PolarHBondContact OE1-ND2 3.39Å; E413-N461 VanDerWaalsContact OE1-ND2 3.14Å
414	V	92.7	Very high	92	Very high	91 Å²	91	58.9 Å²	58.9	55%	0.552	31%	0.311	S	S	*	.	H	α-helix	trans	-66.2	-43.8	174.5	177.4	0	0	0	0	111.4	G410 V411 C412 F416 C417 L418	G410-V414 PolarHBondContact O-N 3.05Å; G410-V414 VanDerWaalsContact O-N 3.17Å; V411-V414 PolarHBondContact O-N 3.03Å; C412-V414 VanDerWaalsContact C-N 3.35Å; V414-F416 VanDerWaalsContact C-N 3.34Å; V414-F416 PolarHBondContact O-N 3.45Å; V414-C417 PolarHBondContact O-N 3.21Å; V414-L418 HydrophobicContact CG1-CD1 4.47Å; V414-L418 WeakPolarHBondContact O-CG 3.49Å; V414-L418 PolarHBondContact O-N 2.88Å; V414-L418 VanDerWaalsContact O-N 3.09Å
415	A	93.6	Very high	92.1	Very high	32 Å²	32	56.4 Å²	56.4	26%	0.264	29%	0.291	S	S	.	.	H	α-helix	trans	-60.9	-41.8	177	0	0	0	0	0	112.1	T170 V411 C412 L418 F419	T170-A415 HydrophobicContact CG2-CB 4.29Å; V411-A415 PolarHBondContact O-N 3.37Å; C412-A415 PolarHBondContact O-N 3.25Å; A415-L418 WeakPolarHBondContact O-CB 3.25Å; A415-L418 PolarHBondContact O-N 2.85Å; A415-F419 WeakPolarHBondContact O-CD2 3.36Å; A415-F419 PolarHBondContact O-N 3.22Å
416	F	94.7	Very high	92.2	Very high	26 Å²	26	51.6 Å²	51.6	11%	0.114	27%	0.274	C	S	.	.	H	α-helix	trans	-60	-46.8	174.4	175.2	-101.4	0	0	0	112	F167 T170 V171 L174 C412 E413 V414 L418 F419 I420 I458	F167-F416 HydrophobicContact CD2-CD2 4.47Å; F167-F416 AromaticContact CE2-CD2 3.86Å; F167-F416 HydrophobicContact CE2-CD2 3.86Å; F167-F416 AromaticContact CE2-CE2 3.61Å; F167-F416 HydrophobicContact CE2-CE2 3.61Å; F167-F416 HydrophobicContact CZ-CE2 4.09Å; T170-F416 HydrophobicContact CG2-CB 4.08Å; V171-F416 HydrophobicContact CG2-CD2 3.76Å; V171-F416 HydrophobicContact CG2-CE2 3.63Å; L174-F416 HydrophobicContact CD1-CB 3.56Å; L174-F416 HydrophobicContact CD1-CD1 4.37Å; L174-F416 HydrophobicContact CD1-CD2 4.3Å; L174-F416 HydrophobicContact CD1-CG 3.84Å; C412-F416 WeakPolarHBondContact O-CB 3.46Å; C412-F416 PolarHBondContact O-N 3.01Å; E413-F416 PolarHBondContact O-N 3.42Å; V414-F416 VanDerWaalsContact C-N 3.34Å; V414-F416 PolarHBondContact O-N 3.45Å; F416-L418 VanDerWaalsContact C-N 3.25Å; F416-L418 PolarHBondContact O-N 2.86Å; F416-F419 PolarHBondContact O-N 3.07Å; F416-F419 VanDerWaalsContact O-N 3.13Å; F416-I420 HydrophobicContact CD1-CG1 4.29Å; F416-I420 HydrophobicContact CD2-CG1 4.34Å; F416-I420 HydrophobicContact CE1-CG1 3.87Å; F416-I420 HydrophobicContact CE2-CD1 3.93Å; F416-I420 HydrophobicContact CE2-CG1 3.92Å; F416-I420 HydrophobicContact CZ-CD1 3.92Å; F416-I420 HydrophobicContact CZ-CG1 3.68Å; F416-I420 WeakPolarHBondContact O-CG1 3.44Å; F416-I420 PolarHBondContact O-N 2.84Å; F416-I458 HydrophobicContact CD1-CD1 4.47Å; F416-I458 HydrophobicContact CD1-CG1 4.45Å; F416-I458 HydrophobicContact CE1-CD1 4.07Å; F416-I458 HydrophobicContact CE1-CG1 3.97Å
417	C	94.6	Very high	92.4	Very high	56 Å²	56	51.8 Å²	51.8	38%	0.378	28%	0.275	S	S	.	.	H	α-helix	trans	-58.1	-36.3	175.1	-71.2	0	0	0	0	112.8	E413 V414 L421	E413-C417 PolarHBondContact O-N 2.97Å; E413-C417 VanDerWaalsContact O-N 3.13Å; E413-C417 PolarHBondContact O-SG 2.87Å; E413-C417 VanDerWaalsContact O-SG 3.38Å; V414-C417 PolarHBondContact O-N 3.21Å; C417-L421 WeakPolarHBondContact O-CB 3.21Å; C417-L421 PolarHBondContact O-N 3.27Å
418	L	94.4	Very high	92.3	Very high	114 Å²	114	49.5 Å²	49.5	60%	0.597	28%	0.275	S	S	*	.	H	α-helix	trans	-69.3	-40.7	174.7	-67.7	172.8	0	0	0	112.6	V414 A415 F416 L421 Y422	V414-L418 HydrophobicContact CG1-CD1 4.47Å; V414-L418 WeakPolarHBondContact O-CG 3.49Å; V414-L418 PolarHBondContact O-N 2.88Å; V414-L418 VanDerWaalsContact O-N 3.09Å; A415-L418 WeakPolarHBondContact O-CB 3.25Å; A415-L418 PolarHBondContact O-N 2.85Å; F416-L418 VanDerWaalsContact C-N 3.25Å; F416-L418 PolarHBondContact O-N 2.86Å; L418-L421 PolarHBondContact O-N 3.15Å; L418-Y422 WeakPolarHBondContact O-CB 3.47Å; L418-Y422 PolarHBondContact O-N 3.25Å
419	F	94.9	Very high	92.2	Very high	54 Å²	54	46.4 Å²	46.4	24%	0.237	26%	0.263	C	S	.	.	H	α-helix	trans	-63.8	-41.2	173.7	-78.4	-65.2	0	0	0	112.4	F167 A415 F416 Y422 Y423	F167-F419 HydrophobicContact CB-CD1 4.32Å; F167-F419 HydrophobicContact CB-CG 4.33Å; F167-F419 HydrophobicContact CD2-CB 3.77Å; F167-F419 HydrophobicContact CD2-CG 4.19Å; F167-F419 HydrophobicContact CE2-CB 4.47Å; A415-F419 WeakPolarHBondContact O-CD2 3.36Å; A415-F419 PolarHBondContact O-N 3.22Å; F416-F419 PolarHBondContact O-N 3.07Å; F416-F419 VanDerWaalsContact O-N 3.13Å; F419-Y422 WeakPolarHBondContact O-CB 3.34Å; F419-Y422 PolarHBondContact O-N 3.4Å; F419-Y423 WeakPolarHBondContact O-CD2 3.46Å; F419-Y423 PolarHBondContact O-N 3.05Å
420	I	94.6	Very high	92	Very high	6 Å²	6	46.3 Å²	46.3	3%	0.031	26%	0.262	C	S	.	.	H	α-helix	trans	-65.8	-40.4	176.1	-62.7	-54.5	0	0	0	110.9	F167 F416 Y422 Y423 V424 V455 I458	F167-I420 HydrophobicContact CE2-CD1 3.71Å; F167-I420 HydrophobicContact CZ-CD1 4.17Å; F416-I420 HydrophobicContact CD1-CG1 4.29Å; F416-I420 HydrophobicContact CD2-CG1 4.34Å; F416-I420 HydrophobicContact CE1-CG1 3.87Å; F416-I420 HydrophobicContact CE2-CD1 3.93Å; F416-I420 HydrophobicContact CE2-CG1 3.92Å; F416-I420 HydrophobicContact CZ-CD1 3.92Å; F416-I420 HydrophobicContact CZ-CG1 3.68Å; F416-I420 WeakPolarHBondContact O-CG1 3.44Å; F416-I420 PolarHBondContact O-N 2.84Å; I420-Y422 VanDerWaalsContact C-N 3.32Å; I420-Y422 PolarHBondContact O-N 2.77Å; I420-Y423 PolarHBondContact O-N 3.5Å; I420-V424 HydrophobicContact CG2-CG2 4.27Å; I420-V424 WeakPolarHBondContact O-CB 3.29Å; I420-V424 VanDerWaalsContact O-CG2 3.23Å; I420-V424 WeakPolarHBondContact O-CG2 3.42Å; I420-V424 PolarHBondContact O-N 3.09Å; I420-V455 HydrophobicContact CG2-CG2 4.03Å; I420-I458 HydrophobicContact CB-CD1 4.17Å; I420-I458 HydrophobicContact CG1-CD1 4.24Å; I420-I458 HydrophobicContact CG2-CD1 4.07Å
421	L	94.4	Very high	91.9	Very high	110 Å²	110	48.2 Å²	48.2	58%	0.576	27%	0.268	S	S	*	.	H	α-helix	trans	-62.3	-40.3	173.9	-174	151.2	0	0	0	111.9	C417 L418 V424 V425	C417-L421 WeakPolarHBondContact O-CB 3.21Å; C417-L421 PolarHBondContact O-N 3.27Å; L418-L421 PolarHBondContact O-N 3.15Å; L421-V424 PolarHBondContact O-N 3.06Å; L421-V425 HydrophobicContact CD2-CG2 4.44Å; L421-V425 WeakPolarHBondContact O-CG2 3.47Å; L421-V425 PolarHBondContact O-N 2.91Å; L421-V425 VanDerWaalsContact O-N 3.16Å
422	Y	93.5	Very high	91.7	Very high	45 Å²	45	50.7 Å²	50.7	18%	0.176	27%	0.273	C	S	.	.	H	α-helix	trans	-57.9	-54.2	173.5	169.6	-87.3	0	0	0	110.9	W138 L418 F419 I420 V424 V425 E426	W138-Y422 HydrophobicContact CD2-CE2 4.35Å; W138-Y422 AromaticContact CE3-CD2 3.94Å; W138-Y422 HydrophobicContact CE3-CD2 3.94Å; W138-Y422 AromaticContact CE3-CE2 3.63Å; W138-Y422 HydrophobicContact CE3-CE2 3.63Å; W138-Y422 AromaticContact CH2-CD2 3.37Å; W138-Y422 HydrophobicContact CH2-CD2 3.37Å; W138-Y422 AromaticContact CH2-CE2 3.92Å; W138-Y422 HydrophobicContact CH2-CE2 3.92Å; W138-Y422 HydrophobicContact CH2-CG 4.14Å; W138-Y422 HydrophobicContact CZ2-CD2 4.23Å; W138-Y422 AromaticContact CZ3-CD2 3.19Å; W138-Y422 HydrophobicContact CZ3-CD2 3.19Å; W138-Y422 AromaticContact CZ3-CE2 3.39Å; W138-Y422 HydrophobicContact CZ3-CE2 3.39Å; W138-Y422 AromaticContact CZ3-CG 3.88Å; W138-Y422 HydrophobicContact CZ3-CG 3.88Å; W138-Y422 WeakPolarHBondContact CZ3-O 3.44Å; L418-Y422 WeakPolarHBondContact O-CB 3.47Å; L418-Y422 PolarHBondContact O-N 3.25Å; F419-Y422 WeakPolarHBondContact O-CB 3.34Å; F419-Y422 PolarHBondContact O-N 3.4Å; I420-Y422 VanDerWaalsContact C-N 3.32Å; I420-Y422 PolarHBondContact O-N 2.77Å; Y422-V424 PolarHBondContact O-N 3.35Å; Y422-V425 PolarHBondContact O-N 2.65Å; Y422-V425 VanDerWaalsContact O-N 3.17Å; Y422-E426 WeakPolarHBondContact CE1-OE2 3.19Å; Y422-E426 VanDerWaalsContact CZ-OE2 3.3Å; Y422-E426 PolarHBondContact O-N 2.88Å; Y422-E426 VanDerWaalsContact O-N 3.07Å; Y422-E426 PolarHBondContact OH-OE2 2.92Å
423	Y	93.3	Very high	91.5	Very high	13 Å²	13	54 Å²	54	5%	0.051	29%	0.289	C	S	.	.	H	α-helix	trans	-64.1	-37.7	178.9	-69.6	-54.8	0	0	0	113.1	F167 F419 I420 V425 E426 E427	F167-Y423 HydrophobicContact CB-CE2 4.16Å; F167-Y423 HydrophobicContact CD1-CE2 4.38Å; F167-Y423 HydrophobicContact CD2-CE2 4Å; F167-Y423 HydrophobicContact CE2-CE2 4.49Å; F167-Y423 AromaticContact CG-CE2 3.92Å; F167-Y423 HydrophobicContact CG-CE2 3.92Å; F419-Y423 WeakPolarHBondContact O-CD2 3.46Å; F419-Y423 PolarHBondContact O-N 3.05Å; I420-Y423 PolarHBondContact O-N 3.5Å; Y423-V425 VanDerWaalsContact C-N 3.28Å; Y423-V425 PolarHBondContact O-N 3.44Å; Y423-E426 WeakPolarHBondContact CD1-OE2 3.27Å; Y423-E426 WeakPolarHBondContact O-CB 3.5Å; Y423-E426 PolarHBondContact O-N 3.4Å; Y423-E427 WeakPolarHBondContact O-CB 3.11Å; Y423-E427 VanDerWaalsContact O-CG 3.23Å; Y423-E427 WeakPolarHBondContact O-CG 2.98Å; Y423-E427 PolarHBondContact O-N 2.74Å
424	V	93.1	Very high	90.9	Very high	53 Å²	53	55.5 Å²	55.5	32%	0.321	30%	0.296	S	S	.	.	H	α-helix	trans	-57.9	-40.4	174.3	167.9	0	0	0	0	111.8	I420 L421 Y422 V428 V451 V455	I420-V424 HydrophobicContact CG2-CG2 4.27Å; I420-V424 WeakPolarHBondContact O-CB 3.29Å; I420-V424 VanDerWaalsContact O-CG2 3.23Å; I420-V424 WeakPolarHBondContact O-CG2 3.42Å; I420-V424 PolarHBondContact O-N 3.09Å; L421-V424 PolarHBondContact O-N 3.06Å; Y422-V424 PolarHBondContact O-N 3.35Å; V424-V428 WeakPolarHBondContact O-CB 3.35Å; V424-V428 WeakPolarHBondContact O-CG2 3.49Å; V424-V428 PolarHBondContact O-N 3.27Å; V424-V428 VanDerWaalsContact O-N 3.17Å; V424-V451 HydrophobicContact CG2-CG1 3.44Å; V424-V451 VanDerWaalsContact CG2-CG1 3.44Å; V424-V455 HydrophobicContact CG2-CG2 4.33Å
425	V	91.5	Very high	90.5	Very high	53 Å²	53	59.9 Å²	59.9	32%	0.321	30%	0.302	S	S	.	.	H	α-helix	trans	-69.9	-41.2	177.9	171.9	0	0	0	0	111.3	W138 L421 Y422 Y423 L429	W138-V425 HydrophobicContact CE3-CG1 4.3Å; W138-V425 HydrophobicContact CH2-CB 4.22Å; W138-V425 HydrophobicContact CH2-CG1 4.16Å; W138-V425 HydrophobicContact CZ3-CB 4.02Å; W138-V425 HydrophobicContact CZ3-CG1 3.96Å; L421-V425 HydrophobicContact CD2-CG2 4.44Å; L421-V425 WeakPolarHBondContact O-CG2 3.47Å; L421-V425 PolarHBondContact O-N 2.91Å; L421-V425 VanDerWaalsContact O-N 3.16Å; Y422-V425 PolarHBondContact O-N 2.65Å; Y422-V425 VanDerWaalsContact O-N 3.17Å; Y423-V425 VanDerWaalsContact C-N 3.28Å; Y423-V425 PolarHBondContact O-N 3.44Å; V425-L429 HydrophobicContact CG1-CD1 4.02Å; V425-L429 VanDerWaalsContact O-CG 3.26Å; V425-L429 WeakPolarHBondContact O-CG 3.09Å; V425-L429 PolarHBondContact O-N 3.4Å; V425-L429 VanDerWaalsContact O-N 3.12Å
426	E	88.5	Confident	89.8	Confident	22 Å²	22	65.5 Å²	65.5	10%	0.103	33%	0.327	C	S	.	.	H	α-helix	trans	-59.4	-58.1	176.6	-169	173.8	167.1	0	0	111.2	T140 Y422 Y423 V428 L429 E430	T140-E426 HydrophobicContact CG2-CG 3.69Å; T140-E426 VanDerWaalsContact CG2-OE1 3.26Å; T140-E426 WeakPolarHBondContact CG2-OE1 3.13Å; Y422-E426 WeakPolarHBondContact CE1-OE2 3.19Å; Y422-E426 VanDerWaalsContact CZ-OE2 3.3Å; Y422-E426 PolarHBondContact O-N 2.88Å; Y422-E426 VanDerWaalsContact O-N 3.07Å; Y422-E426 PolarHBondContact OH-OE2 2.92Å; Y423-E426 WeakPolarHBondContact CD1-OE2 3.27Å; Y423-E426 WeakPolarHBondContact O-CB 3.5Å; Y423-E426 PolarHBondContact O-N 3.4Å; E426-V428 VanDerWaalsContact C-N 3.34Å; E426-V428 PolarHBondContact O-N 3.16Å; E426-L429 WeakPolarHBondContact O-CB 3.24Å; E426-L429 PolarHBondContact O-N 2.97Å; E426-L429 VanDerWaalsContact O-N 3.08Å; E426-E430 PolarHBondContact O-N 3.07Å
427	E	90.2	Very high	89.2	Confident	13 Å²	13	71 Å²	71	6%	0.061	35%	0.353	C	S	.	.	H	α-helix	trans	-55.3	-44.7	178.6	-66.1	-68	135.1	0	0	112.3	Y423 L429 E430 I431 Y438 D447 I448 V451	Y423-E427 WeakPolarHBondContact O-CB 3.11Å; Y423-E427 VanDerWaalsContact O-CG 3.23Å; Y423-E427 WeakPolarHBondContact O-CG 2.98Å; Y423-E427 PolarHBondContact O-N 2.74Å; E427-L429 VanDerWaalsContact C-N 3.33Å; E427-L429 PolarHBondContact O-N 3.13Å; E427-E430 PolarHBondContact O-N 3.26Å; E427-I431 WeakPolarHBondContact O-CB 3.39Å; E427-I431 WeakPolarHBondContact O-CD1 3.4Å; E427-I431 WeakPolarHBondContact O-CG1 3.34Å; E427-I431 PolarHBondContact O-N 2.81Å; E427-Y438 PolarHBondContact OE1-OH 3.5Å; E427-Y438 PolarHBondContact OE2-OH 3.48Å; E427-D447 WeakPolarHBondContact OE1-CB 3.23Å; E427-I448 VanDerWaalsContact OE2-CG1 3.24Å; E427-I448 WeakPolarHBondContact OE2-CG1 3.25Å; E427-V451 HydrophobicContact CG-CG2 4.15Å
428	V	89	Confident	88.5	Confident	93 Å²	93	68.5 Å²	68.5	56%	0.564	34%	0.336	S	S	*	.	H	α-helix	trans	-66	-34.9	-179.9	168.6	0	0	0	0	111.9	V424 E426 H432	V424-V428 WeakPolarHBondContact O-CB 3.35Å; V424-V428 WeakPolarHBondContact O-CG2 3.49Å; V424-V428 PolarHBondContact O-N 3.27Å; V424-V428 VanDerWaalsContact O-N 3.17Å; E426-V428 VanDerWaalsContact C-N 3.34Å; E426-V428 PolarHBondContact O-N 3.16Å; V428-H432 VanDerWaalsContact O-CB 3.31Å; V428-H432 WeakPolarHBondContact O-CB 3.44Å; V428-H432 PolarHBondContact O-N 3.46Å
429	L	87.4	Confident	88	Confident	31 Å²	31	68.5 Å²	68.5	16%	0.162	33%	0.331	C	S	.	.	H	α-helix	trans	-68.8	-44.2	175	-73.1	169.5	0	0	0	111.4	L131 I134 M143 V425 E426 E427 H432 I433	L131-L429 HydrophobicContact CD2-CD2 4.04Å; I134-L429 HydrophobicContact CG2-CD1 4.02Å; M143-L429 HydrophobicContact CE-CB 4.2Å; M143-L429 HydrophobicContact CE-CD1 4.47Å; V425-L429 HydrophobicContact CG1-CD1 4.02Å; V425-L429 VanDerWaalsContact O-CG 3.26Å; V425-L429 WeakPolarHBondContact O-CG 3.09Å; V425-L429 PolarHBondContact O-N 3.4Å; V425-L429 VanDerWaalsContact O-N 3.12Å; E426-L429 WeakPolarHBondContact O-CB 3.24Å; E426-L429 PolarHBondContact O-N 2.97Å; E426-L429 VanDerWaalsContact O-N 3.08Å; E427-L429 VanDerWaalsContact C-N 3.33Å; E427-L429 PolarHBondContact O-N 3.13Å; L429-H432 PolarHBondContact O-N 2.75Å; L429-I433 WeakPolarHBondContact O-CG1 3.31Å; L429-I433 PolarHBondContact O-N 2.77Å; L429-I433 VanDerWaalsContact O-N 3.15Å
430	E	86.4	Confident	87.4	Confident	13 Å²	13	74.5 Å²	74.5	6%	0.061	36%	0.357	C	S	.	.	H	α-helix	trans	-66.2	-44.1	179	-65	-167.3	158.6	0	0	112.3	T140 L142 E426 E427 H432 I433 H434 Y438	T140-E430 VanDerWaalsContact CB-OE1 3.26Å; T140-E430 WeakPolarHBondContact CB-OE1 3.47Å; T140-E430 PolarHBondContact OG1-OE1 2.95Å; L142-E430 HydrophobicContact CB-CG 4.48Å; L142-E430 WeakPolarHBondContact CD1-OE2 3.17Å; E426-E430 PolarHBondContact O-N 3.07Å; E427-E430 PolarHBondContact O-N 3.26Å; E430-H432 VanDerWaalsContact C-N 3.28Å; E430-H432 PolarHBondContact O-N 3.14Å; E430-I433 PolarHBondContact O-N 3.3Å; E430-H434 PolarHBondContact O-N 3.48Å; E430-Y438 HydrophobicContact CB-CD2 4.06Å; E430-Y438 HydrophobicContact CB-CE2 3.55Å; E430-Y438 HydrophobicContact CG-CE2 4.48Å; E430-Y438 WeakPolarHBondContact OE2-CE2 3.48Å; E430-Y438 PolarHBondContact OE2-OH 3.38Å
431	I	88.4	Confident	86.8	Confident	51 Å²	51	76.1 Å²	76.1	26%	0.262	37%	0.369	S	S	.	.	H	α-helix	trans	-61.2	-36.5	173.7	-67.5	163.7	0	0	0	110.9	E427 I433 R435 Y438 I448	E427-I431 WeakPolarHBondContact O-CB 3.39Å; E427-I431 WeakPolarHBondContact O-CD1 3.4Å; E427-I431 WeakPolarHBondContact O-CG1 3.34Å; E427-I431 PolarHBondContact O-N 2.81Å; I431-I433 VanDerWaalsContact C-N 3.33Å; I431-I433 PolarHBondContact O-N 2.8Å; I431-R435 WeakPolarHBondContact O-CA 3.37Å; I431-R435 PolarHBondContact O-N 3.26Å; I431-Y438 HydrophobicContact CD1-CD1 4.44Å; I431-Y438 HydrophobicContact CD1-CE1 4.41Å; I431-Y438 HydrophobicContact CG1-CD1 3.64Å; I431-Y438 HydrophobicContact CG1-CE1 3.9Å; I431-Y438 HydrophobicContact CG1-CG 4.05Å; I431-I448 HydrophobicContact CD1-CD1 3.85Å; I431-I448 HydrophobicContact CD1-CG1 4.32Å
432	H	87.3	Confident	86.2	Confident	151 Å²	151	78.3 Å²	78.3	70%	0.699	38%	0.378	S	S	*	.	H	α-helix	trans	-67.6	-33.9	178.1	-163.8	81.6	0	0	0	113	V428 L429 E430	V428-H432 VanDerWaalsContact O-CB 3.31Å; V428-H432 WeakPolarHBondContact O-CB 3.44Å; V428-H432 PolarHBondContact O-N 3.46Å; L429-H432 PolarHBondContact O-N 2.75Å; E430-H432 VanDerWaalsContact C-N 3.28Å; E430-H432 PolarHBondContact O-N 3.14Å
433	I	86.4	Confident	85.9	Confident	82 Å²	82	79.7 Å²	79.7	42%	0.421	38%	0.383	S	S	.	.	H	α-helix	trans	-78.3	-54.7	178.6	-67.2	167.8	0	0	0	110.7	M143 L429 E430 I431	M143-I433 HydrophobicContact CE-CD1 3.61Å; M143-I433 HydrophobicContact CG-CD1 4.03Å; L429-I433 WeakPolarHBondContact O-CG1 3.31Å; L429-I433 PolarHBondContact O-N 2.77Å; L429-I433 VanDerWaalsContact O-N 3.15Å; E430-I433 PolarHBondContact O-N 3.3Å; I431-I433 VanDerWaalsContact C-N 3.33Å; I431-I433 PolarHBondContact O-N 2.8Å
434	H	79.7	Confident	85.7	Confident	57 Å²	57	79.8 Å²	79.8	26%	0.264	38%	0.384	S	S	.	.	H	α-helix	trans	-91.9	-13.6	-169.9	-67.2	-66.1	0	0	0	114.7	L142 E430 L436 H437 Y438	L142-H434 PolarHBondContact O-NE2 2.85Å; E430-H434 PolarHBondContact O-N 3.48Å; H434-L436 PolarHBondContact O-N 3.38Å; H434-L436 VanDerWaalsContact O-N 3.09Å; H434-H437 WeakPolarHBondContact O-CB 3.35Å; H434-H437 PolarHBondContact O-N 2.91Å; H434-Y438 HydrophobicContact CB-CD2 4.47Å
435	R	84.3	Confident	85.5	Confident	182 Å²	182	80.5 Å²	80.5	69%	0.687	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	-111.7	177.8	-59.2	-177.7	178.9	-175.4	-0.5	112.6	I431 Y438	I431-R435 WeakPolarHBondContact O-CA 3.37Å; I431-R435 PolarHBondContact O-N 3.26Å; R435-Y438 WeakPolarHBondContact O-CB 3.2Å
436	L	79.8	Confident	85.5	Confident	150 Å²	150	79.2 Å²	79.2	79%	0.785	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-19.1	-176.5	-63.9	175.5	0	0	0	113.3	H434 Y438	H434-L436 PolarHBondContact O-N 3.38Å; H434-L436 VanDerWaalsContact O-N 3.09Å; L436-Y438 VanDerWaalsContact C-N 3.26Å; L436-Y438 PolarHBondContact O-N 3Å
437	H	81.6	Confident	85.6	Confident	142 Å²	142	78.4 Å²	78.4	66%	0.657	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-31.3	177	-165	81.9	0	0	0	111.4	H434 F439 K440	H434-H437 WeakPolarHBondContact O-CB 3.35Å; H434-H437 PolarHBondContact O-N 2.91Å; H437-F439 VanDerWaalsContact C-N 3.34Å; H437-F439 PolarHBondContact O-N 3.43Å; H437-K440 WeakPolarHBondContact O-CB 3.5Å; H437-K440 PolarHBondContact O-N 3.42Å; H437-K440 VanDerWaalsContact O-N 3.16Å
438	Y	80.6	Confident	85.7	Confident	4 Å²	4	79.7 Å²	79.7	2%	0.016	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-53.2	-47.5	178.9	-164.5	-99.7	0	0	0	112.9	L142 E427 E430 I431 H434 R435 L436 K440 S441 N444 I448	L142-Y438 HydrophobicContact CD1-CE2 4.14Å; E427-Y438 PolarHBondContact OE1-OH 3.5Å; E427-Y438 PolarHBondContact OE2-OH 3.48Å; E430-Y438 HydrophobicContact CB-CD2 4.06Å; E430-Y438 HydrophobicContact CB-CE2 3.55Å; E430-Y438 HydrophobicContact CG-CE2 4.48Å; E430-Y438 WeakPolarHBondContact OE2-CE2 3.48Å; E430-Y438 PolarHBondContact OE2-OH 3.38Å; I431-Y438 HydrophobicContact CD1-CD1 4.44Å; I431-Y438 HydrophobicContact CD1-CE1 4.41Å; I431-Y438 HydrophobicContact CG1-CD1 3.64Å; I431-Y438 HydrophobicContact CG1-CE1 3.9Å; I431-Y438 HydrophobicContact CG1-CG 4.05Å; H434-Y438 HydrophobicContact CB-CD2 4.47Å; R435-Y438 WeakPolarHBondContact O-CB 3.2Å; L436-Y438 VanDerWaalsContact C-N 3.26Å; L436-Y438 PolarHBondContact O-N 3Å; Y438-K440 PolarHBondContact O-N 2.97Å; Y438-K440 VanDerWaalsContact O-N 3.11Å; Y438-S441 PolarHBondContact O-N 3.47Å; Y438-N444 HydrophobicContact CD1-CB 4.07Å; Y438-N444 HydrophobicContact CD2-CB 4.5Å; Y438-N444 VanDerWaalsContact CD2-ND2 3.33Å; Y438-N444 WeakPolarHBondContact CD2-ND2 3.5Å; Y438-N444 HydrophobicContact CE1-CB 3.6Å; Y438-N444 HydrophobicContact CE2-CB 4.07Å; Y438-N444 WeakPolarHBondContact CE2-ND2 3.38Å; Y438-N444 HydrophobicContact CG-CB 4.48Å; Y438-I448 HydrophobicContact CD1-CD1 3.95Å; Y438-I448 HydrophobicContact CE1-CD1 3.69Å; Y438-I448 HydrophobicContact CE1-CG1 4.01Å
439	F	83.4	Confident	85.9	Confident	114 Å²	114	78.3 Å²	78.3	50%	0.5	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-70.4	-5.4	-176.5	-65.6	-79.4	0	0	0	114.8	H437 I448	H437-F439 VanDerWaalsContact C-N 3.34Å; H437-F439 PolarHBondContact O-N 3.43Å; F439-I448 HydrophobicContact CD1-CD1 4.15Å; F439-I448 HydrophobicContact CE1-CD1 3.47Å; F439-I448 VanDerWaalsContact CE1-CD1 3.47Å; F439-I448 HydrophobicContact CZ-CD1 4.04Å
440	K	81.4	Confident	86.3	Confident	180 Å²	180	77.2 Å²	77.2	78%	0.783	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-81.3	-18.9	176	-164.6	175.9	178.1	-175.9	0	112.7	H437 Y438	H437-K440 WeakPolarHBondContact O-CB 3.5Å; H437-K440 PolarHBondContact O-N 3.42Å; H437-K440 VanDerWaalsContact O-N 3.16Å; Y438-K440 PolarHBondContact O-N 2.97Å; Y438-K440 VanDerWaalsContact O-N 3.11Å
441	S	82.8	Confident	86.6	Confident	39 Å²	39	77.4 Å²	77.4	27%	0.273	37%	0.371	S	S	.	.			trans	-86.9	124.7	176.9	172.1	0	0	0	0	111	Y438 W443 N444 C445	Y438-S441 PolarHBondContact O-N 3.47Å; S441-W443 VanDerWaalsContact C-N 3.28Å; S441-W443 PolarHBondContact O-N 2.89Å; S441-N444 VanDerWaalsContact CB-CG 3.45Å; S441-N444 VanDerWaalsContact CB-OD1 3.25Å; S441-N444 WeakPolarHBondContact CB-OD1 3.46Å; S441-N444 PolarHBondContact O-N 2.91Å; S441-N444 PolarHBondContact OG-N 2.91Å; S441-N444 PolarHBondContact OG-OD1 3.09Å; S441-C445 PolarHBondContact O-N 3.14Å; S441-C445 VanDerWaalsContact O-N 3.07Å
442	M	82.1	Confident	87	Confident	157 Å²	157	78.8 Å²	78.8	77%	0.773	38%	0.382	S	S	*	.	H	α-helix	trans	-60.4	-37.6	176.8	-69	-61.6	-65.3	0	0	112.4	C445 L446	M442-C445 PolarHBondContact O-N 2.89Å; M442-L446 PolarHBondContact O-N 2.73Å
443	W	86.3	Confident	87.3	Confident	73 Å²	73	73.2 Å²	73.2	28%	0.277	36%	0.357	S	S	.	.	H	α-helix	trans	-65.8	-43.6	178.6	-59	110.6	0	0	0	111.4	S441 C445 L446 D447 F511 K512	S441-W443 VanDerWaalsContact C-N 3.28Å; S441-W443 PolarHBondContact O-N 2.89Å; W443-C445 VanDerWaalsContact C-N 3.32Å; W443-C445 PolarHBondContact O-N 2.9Å; W443-L446 CarbonylContact O-C 3.58Å; W443-L446 WeakPolarHBondContact O-CB 3.17Å; W443-L446 PolarHBondContact O-N 2.94Å; W443-L446 VanDerWaalsContact O-N 3.11Å; W443-D447 WeakPolarHBondContact O-CB 3.4Å; W443-D447 PolarHBondContact O-N 3.14Å; W443-F511 HydrophobicContact CH2-CB 4.01Å; W443-F511 HydrophobicContact CZ3-CB 4.44Å; W443-K512 HydrophobicContact CB-CD 4.17Å; W443-K512 HydrophobicContact CD2-CB 4.18Å; W443-K512 HydrophobicContact CD2-CG 4.15Å; W443-K512 HydrophobicContact CE3-CB 3.85Å; W443-K512 HydrophobicContact CE3-CG 4.26Å; W443-K512 HydrophobicContact CG-CD 4.41Å; W443-K512 HydrophobicContact CG-CG 4.28Å; W443-K512 HydrophobicContact CZ3-CB 4.05Å
444	N	88.7	Confident	87.7	Confident	15 Å²	15	69.3 Å²	69.3	8%	0.08	34%	0.337	C	S	.	.	H	α-helix	trans	-65.7	-35.8	178.8	-62.4	40.3	0	0	0	111.4	Y438 S441 D447 I448	Y438-N444 HydrophobicContact CD1-CB 4.07Å; Y438-N444 HydrophobicContact CD2-CB 4.5Å; Y438-N444 VanDerWaalsContact CD2-ND2 3.33Å; Y438-N444 WeakPolarHBondContact CD2-ND2 3.5Å; Y438-N444 HydrophobicContact CE1-CB 3.6Å; Y438-N444 HydrophobicContact CE2-CB 4.07Å; Y438-N444 WeakPolarHBondContact CE2-ND2 3.38Å; Y438-N444 HydrophobicContact CG-CB 4.48Å; S441-N444 VanDerWaalsContact CB-CG 3.45Å; S441-N444 VanDerWaalsContact CB-OD1 3.25Å; S441-N444 WeakPolarHBondContact CB-OD1 3.46Å; S441-N444 PolarHBondContact O-N 2.91Å; S441-N444 PolarHBondContact OG-N 2.91Å; S441-N444 PolarHBondContact OG-OD1 3.09Å; N444-D447 PolarHBondContact O-N 3.18Å; N444-I448 WeakPolarHBondContact O-CG1 3.41Å; N444-I448 PolarHBondContact O-N 3.05Å
445	C	89.7	Confident	88.5	Confident	68 Å²	68	69.3 Å²	69.3	46%	0.459	34%	0.341	S	S	.	.	H	α-helix	trans	-65.6	-38.4	171.9	-172.1	0	0	0	0	112.5	S441 M442 W443 L449	S441-C445 PolarHBondContact O-N 3.14Å; S441-C445 VanDerWaalsContact O-N 3.07Å; M442-C445 PolarHBondContact O-N 2.89Å; W443-C445 VanDerWaalsContact C-N 3.32Å; W443-C445 PolarHBondContact O-N 2.9Å; C445-L449 WeakPolarHBondContact O-CB 3.43Å; C445-L449 PolarHBondContact O-N 3.31Å
446	L	90.9	Very high	89	Confident	26 Å²	26	63.8 Å²	63.8	14%	0.136	33%	0.327	C	S	.	.	H	α-helix	trans	-68.2	-36.5	174.9	-173.6	153.7	0	0	0	111.4	M442 W443 L449 I450 F505 V508 K509	M442-L446 PolarHBondContact O-N 2.73Å; W443-L446 CarbonylContact O-C 3.58Å; W443-L446 WeakPolarHBondContact O-CB 3.17Å; W443-L446 PolarHBondContact O-N 2.94Å; W443-L446 VanDerWaalsContact O-N 3.11Å; L446-L449 WeakPolarHBondContact O-CB 3.48Å; L446-L449 PolarHBondContact O-N 3.47Å; L446-I450 HydrophobicContact CD2-CD1 3.56Å; L446-I450 HydrophobicContact CD2-CG1 4.23Å; L446-I450 WeakPolarHBondContact O-CG1 3.23Å; L446-I450 PolarHBondContact O-N 2.91Å; L446-F505 HydrophobicContact CD1-CD1 4.44Å; L446-V508 HydrophobicContact CD1-CG1 3.9Å; L446-K509 HydrophobicContact CD2-CB 3.74Å; L446-K509 HydrophobicContact CD2-CD 4.26Å; L446-K509 HydrophobicContact CD2-CG 4.27Å
447	D	91.1	Very high	89.7	Confident	6 Å²	6	57 Å²	57	3%	0.032	29%	0.292	C	S	.	.	H	α-helix	trans	-63.3	-49.5	176.9	-65.6	-26.4	0	0	0	110.8	E427 W443 N444 L449 I450 V451 K509 K512	E427-D447 WeakPolarHBondContact OE1-CB 3.23Å; W443-D447 WeakPolarHBondContact O-CB 3.4Å; W443-D447 PolarHBondContact O-N 3.14Å; N444-D447 PolarHBondContact O-N 3.18Å; D447-L449 VanDerWaalsContact C-N 3.35Å; D447-L449 PolarHBondContact O-N 3.09Å; D447-I450 PolarHBondContact O-N 3.23Å; D447-V451 WeakPolarHBondContact O-CG2 3.45Å; D447-V451 PolarHBondContact O-N 3.04Å; D447-K509 VanDerWaalsContact CG-NZ 3.3Å; D447-K509 WeakPolarHBondContact OD1-CD 3.42Å; D447-K509 WeakPolarHBondContact OD1-CE 3.37Å; D447-K509 IonicContact OD1-NZ 2.83Å; D447-K509 PolarHBondContact OD1-NZ 2.68Å; D447-K509 IonicContact OD2-NZ 3.49Å; D447-K512 IonicContact OD2-NZ 3.6Å; D447-K512 PolarHBondContact OD2-NZ 3.25Å
448	I	92.5	Very high	90.3	Very high	39 Å²	39	52 Å²	52	20%	0.2	27%	0.27	C	S	.	.	H	α-helix	trans	-56.4	-45.3	169.7	-67.3	175.8	0	0	0	111.7	E427 I431 Y438 F439 N444 I450 V451 V452	E427-I448 VanDerWaalsContact OE2-CG1 3.24Å; E427-I448 WeakPolarHBondContact OE2-CG1 3.25Å; I431-I448 HydrophobicContact CD1-CD1 3.85Å; I431-I448 HydrophobicContact CD1-CG1 4.32Å; Y438-I448 HydrophobicContact CD1-CD1 3.95Å; Y438-I448 HydrophobicContact CE1-CD1 3.69Å; Y438-I448 HydrophobicContact CE1-CG1 4.01Å; F439-I448 HydrophobicContact CD1-CD1 4.15Å; F439-I448 HydrophobicContact CE1-CD1 3.47Å; F439-I448 VanDerWaalsContact CE1-CD1 3.47Å; F439-I448 HydrophobicContact CZ-CD1 4.04Å; N444-I448 WeakPolarHBondContact O-CG1 3.41Å; N444-I448 PolarHBondContact O-N 3.05Å; I448-I450 PolarHBondContact O-N 2.95Å; I448-V451 PolarHBondContact O-N 3Å; I448-V452 HydrophobicContact CG2-CG2 4.04Å; I448-V452 WeakPolarHBondContact O-CG2 3.11Å; I448-V452 PolarHBondContact O-N 3.08Å
449	L	93.6	Very high	90.9	Very high	65 Å²	65	56.5 Å²	56.5	34%	0.34	29%	0.294	S	S	.	.	H	α-helix	trans	-59.8	-46.4	-177.7	179	64	0	0	0	111.6	C445 L446 D447 V451 V452 L453 F505	C445-L449 WeakPolarHBondContact O-CB 3.43Å; C445-L449 PolarHBondContact O-N 3.31Å; L446-L449 WeakPolarHBondContact O-CB 3.48Å; L446-L449 PolarHBondContact O-N 3.47Å; D447-L449 VanDerWaalsContact C-N 3.35Å; D447-L449 PolarHBondContact O-N 3.09Å; L449-V451 VanDerWaalsContact C-N 3.33Å; L449-V451 PolarHBondContact O-N 2.89Å; L449-V452 PolarHBondContact O-N 2.93Å; L449-L453 HydrophobicContact CD1-CD1 3.9Å; L449-L453 HydrophobicContact CD1-CG 4.04Å; L449-L453 HydrophobicContact CG-CD1 3.9Å; L449-L453 HydrophobicContact CG-CG 4.42Å; L449-L453 WeakPolarHBondContact O-CB 3.12Å; L449-L453 VanDerWaalsContact O-CG 3.23Å; L449-L453 WeakPolarHBondContact O-CG 3.35Å; L449-L453 PolarHBondContact O-N 3.04Å; L449-F505 HydrophobicContact CD2-CD1 4.44Å; L449-F505 HydrophobicContact CD2-CD2 4.09Å; L449-F505 HydrophobicContact CD2-CE1 4.17Å; L449-F505 HydrophobicContact CD2-CE2 3.77Å; L449-F505 HydrophobicContact CD2-CG 4.41Å; L449-F505 HydrophobicContact CD2-CZ 3.84Å
450	I	94.5	Very high	91.4	Very high	7 Å²	7	52.3 Å²	52.3	4%	0.036	28%	0.276	C	S	.	.	H	α-helix	trans	-60.1	-44.2	176.4	-69.6	174.3	0	0	0	110.6	F167 L446 D447 I448 S454 F505 K509	F167-I450 HydrophobicContact CZ-CG2 4.36Å; L446-I450 HydrophobicContact CD2-CD1 3.56Å; L446-I450 HydrophobicContact CD2-CG1 4.23Å; L446-I450 WeakPolarHBondContact O-CG1 3.23Å; L446-I450 PolarHBondContact O-N 2.91Å; D447-I450 PolarHBondContact O-N 3.23Å; I448-I450 PolarHBondContact O-N 2.95Å; I450-S454 VanDerWaalsContact O-CB 3.23Å; I450-S454 WeakPolarHBondContact O-CB 3.46Å; I450-S454 PolarHBondContact O-N 2.71Å; I450-S454 PolarHBondContact O-OG 3.06Å; I450-F505 HydrophobicContact CD1-CB 4.13Å; I450-F505 HydrophobicContact CG1-CB 3.85Å; I450-K509 HydrophobicContact CD1-CB 4.18Å; I450-K509 HydrophobicContact CD1-CD 3.95Å
451	V	94.6	Very high	91.8	Very high	18 Å²	18	45.3 Å²	45.3	11%	0.109	25%	0.247	C	C	.	.	H	α-helix	trans	-63.7	-47.1	-179.9	170.2	0	0	0	0	111.5	V424 E427 D447 I448 L449 S454 V455	V424-V451 HydrophobicContact CG2-CG1 3.44Å; V424-V451 VanDerWaalsContact CG2-CG1 3.44Å; E427-V451 HydrophobicContact CG-CG2 4.15Å; D447-V451 WeakPolarHBondContact O-CG2 3.45Å; D447-V451 PolarHBondContact O-N 3.04Å; I448-V451 PolarHBondContact O-N 3Å; L449-V451 VanDerWaalsContact C-N 3.33Å; L449-V451 PolarHBondContact O-N 2.89Å; V451-S454 PolarHBondContact O-N 3.25Å; V451-V455 WeakPolarHBondContact O-CG2 3.47Å; V451-V455 PolarHBondContact O-N 2.82Å
452	V	94.9	Very high	92.2	Very high	80 Å²	80	48.7 Å²	48.7	49%	0.485	26%	0.261	S	S	.	.	H	α-helix	trans	-61.5	-49.5	178.5	171	0	0	0	0	111.3	I448 L449 S454 V455 V456	I448-V452 HydrophobicContact CG2-CG2 4.04Å; I448-V452 WeakPolarHBondContact O-CG2 3.11Å; I448-V452 PolarHBondContact O-N 3.08Å; L449-V452 PolarHBondContact O-N 2.93Å; V452-S454 VanDerWaalsContact C-N 3.28Å; V452-S454 PolarHBondContact O-N 3.32Å; V452-V455 PolarHBondContact O-N 3.21Å; V452-V456 WeakPolarHBondContact O-CG2 3.33Å; V452-V456 PolarHBondContact O-N 3.17Å; V452-V456 VanDerWaalsContact O-N 3.1Å
453	L	95.1	Very high	92.6	Very high	34 Å²	34	44.4 Å²	44.4	18%	0.178	24%	0.244	C	C	.	.	H	α-helix	trans	-60.9	-39.2	178.1	-66.7	173.8	0	0	0	111.5	L449 V456 A457 L498 V501 I502 F505	L449-L453 HydrophobicContact CD1-CD1 3.9Å; L449-L453 HydrophobicContact CD1-CG 4.04Å; L449-L453 HydrophobicContact CG-CD1 3.9Å; L449-L453 HydrophobicContact CG-CG 4.42Å; L449-L453 WeakPolarHBondContact O-CB 3.12Å; L449-L453 VanDerWaalsContact O-CG 3.23Å; L449-L453 WeakPolarHBondContact O-CG 3.35Å; L449-L453 PolarHBondContact O-N 3.04Å; L453-V456 PolarHBondContact O-N 3.43Å; L453-A457 WeakPolarHBondContact O-CB 3.47Å; L453-A457 PolarHBondContact O-N 3.28Å; L453-L498 HydrophobicContact CB-CD1 4.01Å; L453-L498 HydrophobicContact CD2-CD1 3.64Å; L453-L498 HydrophobicContact CG-CD1 4.34Å; L453-V501 HydrophobicContact CD1-CG1 4Å; L453-I502 HydrophobicContact CB-CD1 4.08Å; L453-I502 HydrophobicContact CB-CG1 3.65Å; L453-I502 HydrophobicContact CD1-CG1 4.48Å; L453-F505 HydrophobicContact CD1-CD2 4.16Å; L453-F505 HydrophobicContact CD1-CE2 4.4Å
454	S	94.9	Very high	92.8	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-67	-39.7	178.5	-60.5	0	0	0	0	113	I450 V451 V452 A457 I458	I450-S454 VanDerWaalsContact O-CB 3.23Å; I450-S454 WeakPolarHBondContact O-CB 3.46Å; I450-S454 PolarHBondContact O-N 2.71Å; I450-S454 PolarHBondContact O-OG 3.06Å; V451-S454 PolarHBondContact O-N 3.25Å; V452-S454 VanDerWaalsContact C-N 3.28Å; V452-S454 PolarHBondContact O-N 3.32Å; S454-A457 PolarHBondContact O-N 3.4Å; S454-I458 WeakPolarHBondContact O-CG1 3.45Å; S454-I458 PolarHBondContact O-N 3.17Å
455	V	95.1	Very high	92.7	Very high	57 Å²	57	43.1 Å²	43.1	35%	0.345	24%	0.244	S	C	.	.	H	α-helix	trans	-63.3	-43.1	174.1	170.6	0	0	0	0	110.8	I420 V424 V451 V452 A457 I458 I459	I420-V455 HydrophobicContact CG2-CG2 4.03Å; V424-V455 HydrophobicContact CG2-CG2 4.33Å; V451-V455 WeakPolarHBondContact O-CG2 3.47Å; V451-V455 PolarHBondContact O-N 2.82Å; V452-V455 PolarHBondContact O-N 3.21Å; V455-A457 VanDerWaalsContact C-N 3.34Å; V455-A457 PolarHBondContact O-N 2.68Å; V455-I458 PolarHBondContact O-N 3.24Å; V455-I459 HydrophobicContact CG1-CD1 4.08Å; V455-I459 WeakPolarHBondContact O-CG1 3.48Å; V455-I459 PolarHBondContact O-N 3.3Å; V455-I459 VanDerWaalsContact O-N 3.07Å
456	V	95.9	Very high	92.7	Very high	65 Å²	65	42.2 Å²	42.2	39%	0.394	24%	0.241	S	C	.	.	H	α-helix	trans	-61.1	-43.2	174	176.3	0	0	0	0	110.9	V452 L453 I458 I459 M460 L498	V452-V456 WeakPolarHBondContact O-CG2 3.33Å; V452-V456 PolarHBondContact O-N 3.17Å; V452-V456 VanDerWaalsContact O-N 3.1Å; L453-V456 PolarHBondContact O-N 3.43Å; V456-I458 VanDerWaalsContact C-N 3.35Å; V456-I458 PolarHBondContact O-N 2.82Å; V456-I459 PolarHBondContact O-N 2.98Å; V456-M460 HydrophobicContact CG1-CG 4.33Å; V456-M460 HydrophobicContact CG1-SD 3.9Å; V456-M460 WeakPolarHBondContact O-CG 3.46Å; V456-M460 PolarHBondContact O-N 3.23Å; V456-L498 HydrophobicContact CB-CD2 4.2Å; V456-L498 HydrophobicContact CG1-CD2 3.79Å
457	A	94.3	Very high	92.5	Very high	8 Å²	8	44.3 Å²	44.3	7%	0.066	25%	0.251	C	S	.	.	H	α-helix	trans	-62.9	-37.3	177.8	0	0	0	0	0	113	L453 S454 V455 M460 N461 L498 I502	L453-A457 WeakPolarHBondContact O-CB 3.47Å; L453-A457 PolarHBondContact O-N 3.28Å; S454-A457 PolarHBondContact O-N 3.4Å; V455-A457 VanDerWaalsContact C-N 3.34Å; V455-A457 PolarHBondContact O-N 2.68Å; A457-M460 PolarHBondContact O-N 3.07Å; A457-N461 WeakPolarHBondContact O-CB 3.46Å; A457-N461 PolarHBondContact O-N 3.17Å; A457-L498 HydrophobicContact CB-CD2 3.76Å; A457-L498 HydrophobicContact CB-CG 4.18Å; A457-I502 HydrophobicContact CB-CD1 3.71Å
458	I	93.9	Very high	92.3	Very high	37 Å²	37	44.6 Å²	44.6	19%	0.19	25%	0.254	C	S	.	.	H	α-helix	trans	-64.2	-46.3	174	-69.1	164.5	0	0	0	110.5	F416 I420 S454 V455 V456 M460 N461 I462	F416-I458 HydrophobicContact CD1-CD1 4.47Å; F416-I458 HydrophobicContact CD1-CG1 4.45Å; F416-I458 HydrophobicContact CE1-CD1 4.07Å; F416-I458 HydrophobicContact CE1-CG1 3.97Å; I420-I458 HydrophobicContact CB-CD1 4.17Å; I420-I458 HydrophobicContact CG1-CD1 4.24Å; I420-I458 HydrophobicContact CG2-CD1 4.07Å; S454-I458 WeakPolarHBondContact O-CG1 3.45Å; S454-I458 PolarHBondContact O-N 3.17Å; V455-I458 PolarHBondContact O-N 3.24Å; V456-I458 VanDerWaalsContact C-N 3.35Å; V456-I458 PolarHBondContact O-N 2.82Å; I458-M460 PolarHBondContact O-N 2.62Å; I458-N461 WeakPolarHBondContact O-CB 3.49Å; I458-N461 PolarHBondContact O-N 3.04Å; I458-I462 HydrophobicContact CG2-CD1 3.96Å; I458-I462 WeakPolarHBondContact O-CG1 3.34Å; I458-I462 PolarHBondContact O-N 3.03Å
459	I	94.3	Very high	92	Very high	99 Å²	99	52 Å²	52	51%	0.508	28%	0.28	S	S	.	.	H	α-helix	trans	-60.5	-46	177.2	-65.7	165.3	0	0	0	110.4	V455 V456 N461 I462 T463	V455-I459 HydrophobicContact CG1-CD1 4.08Å; V455-I459 WeakPolarHBondContact O-CG1 3.48Å; V455-I459 PolarHBondContact O-N 3.3Å; V455-I459 VanDerWaalsContact O-N 3.07Å; V456-I459 PolarHBondContact O-N 2.98Å; I459-N461 VanDerWaalsContact C-N 3.34Å; I459-N461 PolarHBondContact O-N 3.49Å; I459-I462 PolarHBondContact O-N 3.05Å; I459-T463 WeakPolarHBondContact O-CG2 3.32Å; I459-T463 PolarHBondContact O-N 3.1Å; I459-T463 PolarHBondContact O-OG1 2.99Å; I459-T463 VanDerWaalsContact O-OG1 3.14Å
460	M	92.6	Very high	91.7	Very high	26 Å²	26	54.3 Å²	54.3	13%	0.128	29%	0.292	C	S	.	.	H	α-helix	trans	-63.9	-34.2	176.1	-69.4	177.4	77.5	0	0	113	V456 A457 I458 T463 R464 L491 Q494 F495 L498	V456-M460 HydrophobicContact CG1-CG 4.33Å; V456-M460 HydrophobicContact CG1-SD 3.9Å; V456-M460 WeakPolarHBondContact O-CG 3.46Å; V456-M460 PolarHBondContact O-N 3.23Å; A457-M460 PolarHBondContact O-N 3.07Å; I458-M460 PolarHBondContact O-N 2.62Å; M460-T463 WeakPolarHBondContact CA-OG1 2.99Å; M460-T463 PolarHBondContact O-OG1 3.44Å; M460-R464 WeakPolarHBondContact O-CB 3.37Å; M460-R464 PolarHBondContact O-N 3.1Å; M460-L491 HydrophobicContact CB-CD1 4.45Å; M460-L491 HydrophobicContact CE-CD1 3.69Å; M460-L491 HydrophobicContact CG-CD1 4.36Å; M460-Q494 HydrophobicContact CE-CB 3.6Å; M460-F495 HydrophobicContact CB-CD2 4.23Å; M460-F495 HydrophobicContact CE-CB 4.41Å; M460-L498 HydrophobicContact SD-CD2 3.61Å
461	N	90.1	Very high	91.2	Very high	32 Å²	32	56.1 Å²	56.1	17%	0.171	30%	0.302	C	S	.	.	H	α-helix	trans	-63.8	-46.2	174.5	-172.2	13.3	0	0	0	111.3	R400 E413 A457 I458 I459 R464 T465 F495	R400-N461 PolarHBondContact NH1-OD1 2.81Å; E413-N461 PolarHBondContact OE1-ND2 3.39Å; E413-N461 VanDerWaalsContact OE1-ND2 3.14Å; A457-N461 WeakPolarHBondContact O-CB 3.46Å; A457-N461 PolarHBondContact O-N 3.17Å; I458-N461 WeakPolarHBondContact O-CB 3.49Å; I458-N461 PolarHBondContact O-N 3.04Å; I459-N461 VanDerWaalsContact C-N 3.34Å; I459-N461 PolarHBondContact O-N 3.49Å; N461-R464 VanDerWaalsContact CG-NH2 3.32Å; N461-R464 PolarHBondContact OD1-NH2 2.82Å; N461-T465 WeakPolarHBondContact O-CB 3.42Å; N461-T465 PolarHBondContact O-N 3.33Å; N461-T465 PolarHBondContact O-OG1 3.33Å; N461-T465 PolarHBondContact OD1-OG1 3.2Å; N461-F495 HydrophobicContact CB-CE2 3.99Å
462	I	91.3	Very high	90.7	Very high	110 Å²	110	57.2 Å²	57.2	56%	0.564	31%	0.307	S	S	*	.	H	α-helix	trans	-65	-49.5	-179.3	-65.8	165.7	0	0	0	110.4	I458 I459 T465 A466	I458-I462 HydrophobicContact CG2-CD1 3.96Å; I458-I462 WeakPolarHBondContact O-CG1 3.34Å; I458-I462 PolarHBondContact O-N 3.03Å; I459-I462 PolarHBondContact O-N 3.05Å; I462-T465 PolarHBondContact O-N 3.42Å; I462-A466 WeakPolarHBondContact O-CB 3.38Å; I462-A466 PolarHBondContact O-N 3.08Å
463	T	90.9	Very high	90.3	Very high	68 Å²	68	56.5 Å²	56.5	42%	0.417	31%	0.305	S	S	.	.	H	α-helix	trans	-63.8	-43	179.6	54.2	0	0	0	0	112.1	I459 M460 T465 A466 M467	I459-T463 WeakPolarHBondContact O-CG2 3.32Å; I459-T463 PolarHBondContact O-N 3.1Å; I459-T463 PolarHBondContact O-OG1 2.99Å; I459-T463 VanDerWaalsContact O-OG1 3.14Å; M460-T463 WeakPolarHBondContact CA-OG1 2.99Å; M460-T463 PolarHBondContact O-OG1 3.44Å; T463-T465 PolarHBondContact O-N 2.91Å; T463-A466 PolarHBondContact O-N 3.15Å; T463-M467 WeakPolarHBondContact O-CB 3.2Å; T463-M467 PolarHBondContact O-N 2.81Å
464	R	89.1	Confident	89.7	Confident	6 Å²	6	56.4 Å²	56.4	2%	0.023	31%	0.313	C	S	.	.	H	α-helix	trans	-56.2	-48.7	172.5	176.4	-171.2	57	-153.2	-17.3	111.6	M460 N461 M467 A468 L488 L491	M460-R464 WeakPolarHBondContact O-CB 3.37Å; M460-R464 PolarHBondContact O-N 3.1Å; N461-R464 VanDerWaalsContact CG-NH2 3.32Å; N461-R464 PolarHBondContact OD1-NH2 2.82Å; R464-M467 PolarHBondContact O-N 3.46Å; R464-A468 VanDerWaalsContact O-CB 3.26Å; R464-A468 WeakPolarHBondContact O-CB 3.32Å; R464-A468 PolarHBondContact O-N 3.18Å; R464-L488 HydrophobicContact CG-CD1 3.68Å; R464-L491 HydrophobicContact CB-CD2 3.81Å; R464-L491 HydrophobicContact CB-CG 4.24Å
465	T	87.4	Confident	89.1	Confident	55 Å²	55	57.4 Å²	57.4	34%	0.337	32%	0.318	S	S	.	.	H	α-helix	trans	-68.8	-36.9	-175.2	-56.1	0	0	0	0	111.4	N461 I462 T463 R469	N461-T465 WeakPolarHBondContact O-CB 3.42Å; N461-T465 PolarHBondContact O-N 3.33Å; N461-T465 PolarHBondContact O-OG1 3.33Å; N461-T465 PolarHBondContact OD1-OG1 3.2Å; I462-T465 PolarHBondContact O-N 3.42Å; T463-T465 PolarHBondContact O-N 2.91Å; T465-R469 WeakPolarHBondContact O-CB 3.33Å; T465-R469 PolarHBondContact O-N 2.94Å; T465-R469 VanDerWaalsContact O-N 3.11Å
466	A	88.9	Confident	88.5	Confident	49 Å²	49	61.3 Å²	61.3	41%	0.405	34%	0.336	S	S	.	.	H	α-helix	trans	-64.9	-48.3	172.4	0	0	0	0	0	112.1	I462 T463 R469 N470	I462-A466 WeakPolarHBondContact O-CB 3.38Å; I462-A466 PolarHBondContact O-N 3.08Å; T463-A466 PolarHBondContact O-N 3.15Å; A466-R469 PolarHBondContact O-N 3.07Å; A466-N470 VanDerWaalsContact O-CG 3.3Å; A466-N470 PolarHBondContact O-N 2.83Å; A466-N470 VanDerWaalsContact O-N 3.09Å; A466-N470 PolarHBondContact O-OD1 3.33Å
467	M	87.6	Confident	87.9	Confident	70 Å²	70	65.6 Å²	65.6	35%	0.345	35%	0.352	S	S	.	.	H	α-helix	trans	-61.5	-45.8	177.5	178.4	178.1	-90.2	0	0	111.8	T463 R464 R469 N470 L471 P487 L488	T463-M467 WeakPolarHBondContact O-CB 3.2Å; T463-M467 PolarHBondContact O-N 2.81Å; R464-M467 PolarHBondContact O-N 3.46Å; M467-R469 VanDerWaalsContact C-N 3.32Å; M467-R469 PolarHBondContact O-N 2.89Å; M467-N470 PolarHBondContact O-N 3.22Å; M467-L471 HydrophobicContact CG-CD1 3.74Å; M467-L471 HydrophobicContact CG-CG 4.27Å; M467-L471 WeakPolarHBondContact O-CB 3.48Å; M467-L471 WeakPolarHBondContact O-CG 3.46Å; M467-L471 PolarHBondContact O-N 3.2Å; M467-L471 HydrophobicContact SD-CD1 4.43Å; M467-P487 HydrophobicContact CE-CB 4.07Å; M467-P487 HydrophobicContact SD-CB 4.01Å; M467-L488 HydrophobicContact SD-CB 4.27Å
468	A	86.9	Confident	87.3	Confident	11 Å²	11	70 Å²	70	9%	0.091	37%	0.374	C	S	.	.	H	α-helix	trans	-58.4	-42.8	177.2	0	0	0	0	0	112.1	L398 R464 L472 L488	L398-A468 HydrophobicContact CD2-CB 4.43Å; L398-A468 HydrophobicContact CG-CB 4.3Å; R464-A468 VanDerWaalsContact O-CB 3.26Å; R464-A468 WeakPolarHBondContact O-CB 3.32Å; R464-A468 PolarHBondContact O-N 3.18Å; A468-L472 WeakPolarHBondContact O-CB 3.29Å; A468-L472 PolarHBondContact O-N 3.43Å; A468-L488 HydrophobicContact CB-CD1 3.86Å; A468-L488 HydrophobicContact CB-CD2 3.91Å
469	R	86.4	Confident	86.5	Confident	196 Å²	196	75.6 Å²	75.6	74%	0.74	39%	0.394	S	S	*	.	H	α-helix	trans	-62.6	-47.2	177.5	-174.6	175.7	-179	168.1	0.5	111.5	T465 A466 M467 L472 S473	T465-R469 WeakPolarHBondContact O-CB 3.33Å; T465-R469 PolarHBondContact O-N 2.94Å; T465-R469 VanDerWaalsContact O-N 3.11Å; A466-R469 PolarHBondContact O-N 3.07Å; M467-R469 VanDerWaalsContact C-N 3.32Å; M467-R469 PolarHBondContact O-N 2.89Å; R469-L472 PolarHBondContact O-N 3.2Å; R469-S473 PolarHBondContact O-N 2.9Å; R469-S473 PolarHBondContact O-OG 3.36Å
470	N	86.8	Confident	85.8	Confident	112 Å²	112	76 Å²	76	60%	0.599	40%	0.395	S	S	*	.	H	α-helix	trans	-65.3	-45.9	-178.1	-66.9	-4.9	0	0	0	112.1	A466 M467 S473 G474	A466-N470 VanDerWaalsContact O-CG 3.3Å; A466-N470 PolarHBondContact O-N 2.83Å; A466-N470 VanDerWaalsContact O-N 3.09Å; A466-N470 PolarHBondContact O-OD1 3.33Å; M467-N470 PolarHBondContact O-N 3.22Å; N470-S473 WeakPolarHBondContact CA-OG 3.49Å; N470-S473 PolarHBondContact O-N 2.93Å; N470-S473 PolarHBondContact O-OG 3.17Å; N470-G474 PolarHBondContact O-N 2.65Å; N470-G474 VanDerWaalsContact O-N 3.08Å
471	L	84.4	Confident	85.5	Confident	46 Å²	46	77.2 Å²	77.2	24%	0.241	41%	0.409	C	S	.	.	H	α-helix	trans	-65.2	-39.8	177.5	-68.9	173.9	0	0	0	111.8	M467 G474 L475 F485 L488	M467-L471 HydrophobicContact CG-CD1 3.74Å; M467-L471 HydrophobicContact CG-CG 4.27Å; M467-L471 WeakPolarHBondContact O-CB 3.48Å; M467-L471 WeakPolarHBondContact O-CG 3.46Å; M467-L471 PolarHBondContact O-N 3.2Å; M467-L471 HydrophobicContact SD-CD1 4.43Å; L471-G474 PolarHBondContact O-N 3.46Å; L471-L475 PolarHBondContact O-N 2.99Å; L471-F485 HydrophobicContact CB-CD1 4.15Å; L471-F485 HydrophobicContact CB-CE1 3.8Å; L471-F485 HydrophobicContact CD1-CD1 4.03Å; L471-L488 HydrophobicContact CD1-CB 4.31Å
472	L	84.7	Confident	85.2	Confident	41 Å²	41	76.8 Å²	76.8	22%	0.215	41%	0.406	C	S	.	.	H	α-helix	trans	-66.2	-39.7	177.4	-174.4	62.7	0	0	0	111.9	V399 A468 R469 L475 L476	V399-L472 HydrophobicContact CG2-CD2 4.01Å; A468-L472 WeakPolarHBondContact O-CB 3.29Å; A468-L472 PolarHBondContact O-N 3.43Å; R469-L472 PolarHBondContact O-N 3.2Å; L472-L475 PolarHBondContact O-N 3.38Å; L472-L476 WeakPolarHBondContact O-CG 3.37Å; L472-L476 PolarHBondContact O-N 3.39Å; L472-L476 VanDerWaalsContact O-N 3.1Å
473	S	84.9	Confident	84.8	Confident	65 Å²	65	72.1 Å²	72.1	46%	0.455	38%	0.383	S	S	.	.	H	α-helix	trans	-63.5	-41.6	173	42.6	0	0	0	0	112.6	R469 N470 L475 L476 E477	R469-S473 PolarHBondContact O-N 2.9Å; R469-S473 PolarHBondContact O-OG 3.36Å; N470-S473 WeakPolarHBondContact CA-OG 3.49Å; N470-S473 PolarHBondContact O-N 2.93Å; N470-S473 PolarHBondContact O-OG 3.17Å; S473-L475 PolarHBondContact O-N 3.21Å; S473-L476 PolarHBondContact O-N 3.29Å; S473-E477 PolarHBondContact O-N 3.21Å; S473-E477 VanDerWaalsContact O-N 3.13Å
474	G	83.6	Confident	84.4	Confident	32 Å²	32	70.1 Å²	70.1	33%	0.33	37%	0.371	S	S	.	.	H	α-helix	trans	-65.5	-35.8	177.6	0	0	0	0	0	113.4	N470 L471 E477 N478	N470-G474 PolarHBondContact O-N 2.65Å; N470-G474 VanDerWaalsContact O-N 3.08Å; L471-G474 PolarHBondContact O-N 3.46Å; G474-E477 PolarHBondContact O-N 3.44Å; G474-N478 PolarHBondContact O-N 2.97Å
475	L	82.5	Confident	84.2	Confident	21 Å²	21	70 Å²	70	11%	0.11	37%	0.371	C	S	.	.	H	α-helix	trans	-69	-35.5	174.4	177.8	60.4	0	0	0	112.6	L252 L471 L472 S473 E477 N478 Y479 P483 F485	L252-L475 HydrophobicContact CB-CD2 4.29Å; L252-L475 HydrophobicContact CD1-CD2 4.1Å; L252-L475 HydrophobicContact CD2-CD2 4.47Å; L471-L475 PolarHBondContact O-N 2.99Å; L472-L475 PolarHBondContact O-N 3.38Å; S473-L475 PolarHBondContact O-N 3.21Å; L475-E477 VanDerWaalsContact C-N 3.29Å; L475-N478 CarbonylContact O-C 3.57Å; L475-Y479 WeakPolarHBondContact O-CA 3.47Å; L475-Y479 PolarHBondContact O-N 3.02Å; L475-P483 HydrophobicContact CD1-CB 4.12Å; L475-P483 HydrophobicContact CD1-CG 4.19Å; L475-P483 HydrophobicContact CD2-CB 4.21Å; L475-P483 HydrophobicContact CD2-CG 4.29Å; L475-F485 HydrophobicContact CD2-CE2 3.89Å; L475-F485 HydrophobicContact CD2-CZ 3.74Å
476	L	81.5	Confident	84.1	Confident	139 Å²	139	68.1 Å²	68.1	73%	0.728	36%	0.359	S	S	*	.	H	α-helix	trans	-68.8	-29.2	175.1	-71.9	171.1	0	0	0	112.4	L472 S473	L472-L476 WeakPolarHBondContact O-CG 3.37Å; L472-L476 PolarHBondContact O-N 3.39Å; L472-L476 VanDerWaalsContact O-N 3.1Å; S473-L476 PolarHBondContact O-N 3.29Å
477	E	83.9	Confident	83.9	Confident	155 Å²	155	67.1 Å²	67.1	72%	0.724	35%	0.348	S	S	*	.	H	α-helix	trans	-76.5	-44	173.5	-170.7	170.9	-161.1	0	0	111.9	S473 G474 L475	S473-E477 PolarHBondContact O-N 3.21Å; S473-E477 VanDerWaalsContact O-N 3.13Å; G474-E477 PolarHBondContact O-N 3.44Å; L475-E477 VanDerWaalsContact C-N 3.29Å
478	N	81.3	Confident	83.9	Confident	101 Å²	101	63.8 Å²	63.8	54%	0.54	33%	0.331	S	S	.	.			trans	-120.7	69.6	-176.8	-74.9	-60.7	0	0	0	113	G474 L475 M480 A481	G474-N478 PolarHBondContact O-N 2.97Å; L475-N478 CarbonylContact O-C 3.57Å; N478-M480 PolarHBondContact O-N 2.87Å; N478-A481 HydrophobicContact CB-CB 4.38Å; N478-A481 PolarHBondContact O-N 3.31Å
479	Y	78.3	Confident	84	Confident	153 Å²	153	63.5 Å²	63.5	60%	0.6	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-14.3	-176	79.6	-86.3	0	0	0	115.8	L475	L475-Y479 WeakPolarHBondContact O-CA 3.47Å; L475-Y479 PolarHBondContact O-N 3.02Å
480	M	79.7	Confident	84	Confident	109 Å²	109	56.2 Å²	56.2	54%	0.537	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-14.8	-179.5	-66.5	-67.3	-99.9	0	0	113.7	R333 N478	R333-M480 WeakPolarHBondContact CD-SD 3.15Å; N478-M480 PolarHBondContact O-N 2.87Å
481	A	85.1	Confident	84.1	Confident	50 Å²	50	52.3 Å²	52.3	41%	0.413	29%	0.287	S	S	.	.	S	Bend	trans	-84.7	157	179.3	0	0	0	0	0	111.6	G253 N478 P483	G253-A481 VanDerWaalsContact CA-O 3.28Å; G253-A481 WeakPolarHBondContact CA-O 3.26Å; N478-A481 HydrophobicContact CB-CB 4.38Å; N478-A481 PolarHBondContact O-N 3.31Å; A481-P483 WeakPolarHBondContact O-CD 3.26Å
482	H	84	Confident	84.4	Confident	23 Å²	23	51 Å²	51	11%	0.106	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-71.5	123.2	170.7	175.6	84.1	0	0	0	110.9	V254 R256 D361	V254-H482 HydrophobicContact CG2-CB 4.17Å; V254-H482 PolarHBondContact O-ND1 3.1Å; R256-H482 HydrophobicContact CB-CB 4.5Å; D361-H482 PolarHBondContact O-CE1 3.25Å
483	P	83.6	Confident	84.6	Confident	13 Å²	13	50 Å²	50	8%	0.084	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-80.9	119.8	175.7	30.5	-32.1	0	0	0	112	L252 L475 A481 F485	L252-P483 HydrophobicContact CB-CG 4.48Å; L475-P483 HydrophobicContact CD1-CB 4.12Å; L475-P483 HydrophobicContact CD1-CG 4.19Å; L475-P483 HydrophobicContact CD2-CB 4.21Å; L475-P483 HydrophobicContact CD2-CG 4.29Å; A481-P483 WeakPolarHBondContact O-CD 3.26Å; P483-F485 VanDerWaalsContact C-N 3.26Å; P483-F485 HydrophobicContact CB-CD2 3.69Å; P483-F485 HydrophobicContact CB-CE2 3.45Å; P483-F485 VanDerWaalsContact CB-CE2 3.45Å; P483-F485 HydrophobicContact CB-CG 4.35Å; P483-F485 HydrophobicContact CB-CZ 3.93Å; P483-F485 HydrophobicContact CG-CD2 3.79Å; P483-F485 HydrophobicContact CG-CE2 3.6Å; P483-F485 HydrophobicContact CG-CZ 4.49Å; P483-F485 PolarHBondContact O-N 3.41Å
484	S	82.2	Confident	84.9	Confident	25 Å²	25	52.2 Å²	52.2	18%	0.175	28%	0.28	C	S	.	.			trans	-73.9	70.4	175.3	50.8	0	0	0	0	112.5	E486	S484-E486 VanDerWaalsContact C-N 3.33Å; S484-E486 PolarHBondContact O-N 3.04Å
485	F	85.5	Confident	85.3	Confident	3 Å²	3	51.5 Å²	51.5	1%	0.013	27%	0.268	C	S	.	.			trans	-82.9	0.3	177.3	-67.6	-55.2	0	0	0	114.8	L252 S363 I374 L398 L471 L475 P483 L488 A489	L252-F485 HydrophobicContact CD1-CE2 4.13Å; S363-F485 WeakPolarHBondContact OG-CD2 3.11Å; I374-F485 HydrophobicContact CD1-CB 3.61Å; I374-F485 HydrophobicContact CD1-CG 4.41Å; I374-F485 HydrophobicContact CG1-CB 3.95Å; I374-F485 HydrophobicContact CG2-CB 4.44Å; L398-F485 HydrophobicContact CD2-CD1 4.41Å; L398-F485 HydrophobicContact CD2-CE1 3.89Å; L398-F485 HydrophobicContact CD2-CZ 4.33Å; L471-F485 HydrophobicContact CB-CD1 4.15Å; L471-F485 HydrophobicContact CB-CE1 3.8Å; L471-F485 HydrophobicContact CD1-CD1 4.03Å; L475-F485 HydrophobicContact CD2-CE2 3.89Å; L475-F485 HydrophobicContact CD2-CZ 3.74Å; P483-F485 VanDerWaalsContact C-N 3.26Å; P483-F485 HydrophobicContact CB-CD2 3.69Å; P483-F485 HydrophobicContact CB-CE2 3.45Å; P483-F485 VanDerWaalsContact CB-CE2 3.45Å; P483-F485 HydrophobicContact CB-CG 4.35Å; P483-F485 HydrophobicContact CB-CZ 3.93Å; P483-F485 HydrophobicContact CG-CD2 3.79Å; P483-F485 HydrophobicContact CG-CE2 3.6Å; P483-F485 HydrophobicContact CG-CZ 4.49Å; P483-F485 PolarHBondContact O-N 3.41Å; F485-L488 HydrophobicContact CD1-CD2 4.08Å; F485-L488 WeakPolarHBondContact O-CB 3.49Å; F485-L488 PolarHBondContact O-N 2.69Å; F485-A489 PolarHBondContact O-N 3.03Å
486	E	83.5	Confident	85.7	Confident	17 Å²	17	53.6 Å²	53.6	8%	0.079	28%	0.279	C	S	.	.	H	α-helix	trans	-52.7	-53.7	177.4	160.3	-173.6	-159.1	0	0	113.4	S312 S313 R376 S484 L488 A489 S490	S312-E486 PolarHBondContact OG-OE2 3.07Å; S313-E486 PolarHBondContact N-OE2 3.07Å; S313-E486 VanDerWaalsContact O-OE1 3.06Å; S313-E486 PolarHBondContact OG-OE1 3.41Å; R376-E486 IonicContact CZ-OE1 3.98Å; R376-E486 IonicContact CZ-OE2 3.65Å; R376-E486 IonicContact NH1-OE1 2.65Å; R376-E486 PolarHBondContact NH1-OE1 3.48Å; R376-E486 IonicContact NH1-OE2 3.18Å; R376-E486 IonicContact NH2-OE1 3.35Å; R376-E486 PolarHBondContact NH2-OE1 3.26Å; R376-E486 IonicContact NH2-OE2 2.69Å; R376-E486 PolarHBondContact NH2-OE2 3.29Å; S484-E486 VanDerWaalsContact C-N 3.33Å; S484-E486 PolarHBondContact O-N 3.04Å; E486-L488 PolarHBondContact O-N 3.16Å; E486-L488 VanDerWaalsContact O-N 3.17Å; E486-A489 WeakPolarHBondContact O-CB 3.31Å; E486-A489 PolarHBondContact O-N 3.11Å; E486-S490 PolarHBondContact O-N 3.35Å; E486-S490 PolarHBondContact O-OG 3.38Å
487	P	85.9	Confident	86.2	Confident	27 Å²	27	52 Å²	52	18%	0.175	27%	0.271	C	S	.	.	H	α-helix	trans	-63.3	-28.3	-175	-23.8	35.8	0	0	0	111.8	N311 M467 S490 L491	N311-P487 WeakPolarHBondContact O-CG 3.47Å; M467-P487 HydrophobicContact CE-CB 4.07Å; M467-P487 HydrophobicContact SD-CB 4.01Å; P487-S490 PolarHBondContact O-OG 2.72Å; P487-L491 WeakPolarHBondContact O-CB 3.31Å; P487-L491 PolarHBondContact O-N 3.5Å; P487-L491 VanDerWaalsContact O-N 3.12Å
488	L	88.2	Confident	86.6	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-72.4	-39.9	173.7	-177.3	66.3	0	0	0	112.2	L398 R464 M467 A468 L471 F485 E486 Q492	L398-L488 HydrophobicContact CD1-CD2 4.12Å; L398-L488 HydrophobicContact CD2-CD2 3.72Å; L398-L488 HydrophobicContact CG-CD2 3.88Å; R464-L488 HydrophobicContact CG-CD1 3.68Å; M467-L488 HydrophobicContact SD-CB 4.27Å; A468-L488 HydrophobicContact CB-CD1 3.86Å; A468-L488 HydrophobicContact CB-CD2 3.91Å; L471-L488 HydrophobicContact CD1-CB 4.31Å; F485-L488 HydrophobicContact CD1-CD2 4.08Å; F485-L488 WeakPolarHBondContact O-CB 3.49Å; F485-L488 PolarHBondContact O-N 2.69Å; E486-L488 PolarHBondContact O-N 3.16Å; E486-L488 VanDerWaalsContact O-N 3.17Å; L488-Q492 VanDerWaalsContact O-CB 3.26Å; L488-Q492 WeakPolarHBondContact O-CB 3.17Å; L488-Q492 PolarHBondContact O-N 3.29Å
489	A	87.5	Confident	87.2	Confident	5 Å²	5	41.7 Å²	41.7	4%	0.041	22%	0.223	C	C	.	.	H	α-helix	trans	-65.1	-46.6	176.5	0	0	0	0	0	111.8	I374 Q394 F485 E486 Q492 A493	I374-A489 HydrophobicContact CB-CB 4.31Å; I374-A489 HydrophobicContact CD1-CB 3.83Å; I374-A489 HydrophobicContact CG2-CB 4.13Å; Q394-A489 HydrophobicContact CB-CB 4.29Å; Q394-A489 HydrophobicContact CG-CB 4.28Å; F485-A489 PolarHBondContact O-N 3.03Å; E486-A489 WeakPolarHBondContact O-CB 3.31Å; E486-A489 PolarHBondContact O-N 3.11Å; A489-Q492 WeakPolarHBondContact O-CB 3Å; A489-Q492 PolarHBondContact O-N 2.84Å; A489-A493 PolarHBondContact O-N 3.49Å
490	S	87.6	Confident	87.9	Confident	43 Å²	43	37.1 Å²	37.1	30%	0.301	22%	0.218	S	C	.	.	H	α-helix	trans	-65.2	-43	178.7	62.2	0	0	0	0	111.6	E486 P487 Q492 A493 Q494	E486-S490 PolarHBondContact O-N 3.35Å; E486-S490 PolarHBondContact O-OG 3.38Å; P487-S490 PolarHBondContact O-OG 2.72Å; S490-Q492 VanDerWaalsContact C-N 3.32Å; S490-Q492 PolarHBondContact O-N 3.11Å; S490-A493 PolarHBondContact O-N 2.92Å; S490-Q494 WeakPolarHBondContact O-CG 3.43Å; S490-Q494 PolarHBondContact O-N 3.01Å
491	L	89.3	Confident	88.7	Confident	29 Å²	29	34.9 Å²	34.9	15%	0.152	21%	0.21	C	C	.	.	H	α-helix	trans	-63.2	-36.7	173.8	-175.9	62.2	0	0	0	112.2	M460 R464 P487 F495	M460-L491 HydrophobicContact CB-CD1 4.45Å; M460-L491 HydrophobicContact CE-CD1 3.69Å; M460-L491 HydrophobicContact CG-CD1 4.36Å; R464-L491 HydrophobicContact CB-CD2 3.81Å; R464-L491 HydrophobicContact CB-CG 4.24Å; P487-L491 WeakPolarHBondContact O-CB 3.31Å; P487-L491 PolarHBondContact O-N 3.5Å; P487-L491 VanDerWaalsContact O-N 3.12Å; L491-F495 VanDerWaalsContact O-CB 3.27Å; L491-F495 WeakPolarHBondContact O-CB 3.13Å; L491-F495 PolarHBondContact O-N 3.31Å
492	Q	89.1	Confident	89.1	Confident	20 Å²	20	32.8 Å²	32.8	9%	0.093	19%	0.192	C	C	.	.	H	α-helix	trans	-65.5	-43.3	173.3	173.7	62.4	34.2	0	0	112.1	V396 L488 A489 S490 F495 N496	V396-Q492 HydrophobicContact CG1-CB 4.38Å; V396-Q492 HydrophobicContact CG1-CG 4.07Å; V396-Q492 HydrophobicContact CG2-CB 4.33Å; V396-Q492 HydrophobicContact CG2-CG 4.05Å; L488-Q492 VanDerWaalsContact O-CB 3.26Å; L488-Q492 WeakPolarHBondContact O-CB 3.17Å; L488-Q492 PolarHBondContact O-N 3.29Å; A489-Q492 WeakPolarHBondContact O-CB 3Å; A489-Q492 PolarHBondContact O-N 2.84Å; S490-Q492 VanDerWaalsContact C-N 3.32Å; S490-Q492 PolarHBondContact O-N 3.11Å; Q492-F495 PolarHBondContact O-N 2.94Å; Q492-N496 WeakPolarHBondContact O-CB 3.26Å; Q492-N496 PolarHBondContact O-N 2.87Å
493	A	89.4	Confident	89.6	Confident	19 Å²	19	32.9 Å²	32.9	16%	0.157	19%	0.194	C	C	.	.	H	α-helix	trans	-64.2	-46.2	178	0	0	0	0	0	111.3	A489 S490 F495 N496 N497	A489-A493 PolarHBondContact O-N 3.49Å; S490-A493 PolarHBondContact O-N 2.92Å; A493-F495 PolarHBondContact O-N 3.35Å; A493-N496 PolarHBondContact O-N 2.94Å; A493-N497 VanDerWaalsContact O-CG 3.28Å; A493-N497 PolarHBondContact O-N 3.28Å; A493-N497 PolarHBondContact O-OD1 3.21Å
494	Q	91.1	Very high	90.2	Very high	112 Å²	112	38.4 Å²	38.4	52%	0.523	22%	0.217	S	C	.	.	H	α-helix	trans	-61.2	-42.6	174.7	-68	174.6	7.9	0	0	112	M460 S490 N496 N497 L498	M460-Q494 HydrophobicContact CE-CB 3.6Å; S490-Q494 WeakPolarHBondContact O-CG 3.43Å; S490-Q494 PolarHBondContact O-N 3.01Å; Q494-N496 VanDerWaalsContact C-N 3.34Å; Q494-N496 PolarHBondContact O-N 3.02Å; Q494-N497 PolarHBondContact O-N 3.47Å; Q494-L498 WeakPolarHBondContact O-CB 3.36Å; Q494-L498 PolarHBondContact O-N 3.42Å
495	F	91.8	Very high	90.8	Very high	17 Å²	17	39.8 Å²	39.8	8%	0.075	22%	0.22	C	C	.	.	H	α-helix	trans	-59.9	-42.7	174.1	173.2	-81.7	0	0	0	111.8	M178 M460 N461 L491 Q492 A493 L498 A499	M178-F495 HydrophobicContact CE-CD1 4.12Å; M178-F495 HydrophobicContact CE-CE1 3.37Å; M178-F495 HydrophobicContact CE-CZ 4.01Å; M178-F495 HydrophobicContact SD-CE1 3.68Å; M178-F495 HydrophobicContact SD-CZ 3.94Å; M460-F495 HydrophobicContact CB-CD2 4.23Å; M460-F495 HydrophobicContact CE-CB 4.41Å; N461-F495 HydrophobicContact CB-CE2 3.99Å; L491-F495 VanDerWaalsContact O-CB 3.27Å; L491-F495 WeakPolarHBondContact O-CB 3.13Å; L491-F495 PolarHBondContact O-N 3.31Å; Q492-F495 PolarHBondContact O-N 2.94Å; A493-F495 PolarHBondContact O-N 3.35Å; F495-L498 PolarHBondContact O-N 3.5Å; F495-A499 HydrophobicContact CE1-CB 4.28Å; F495-A499 WeakPolarHBondContact O-CB 3.29Å; F495-A499 PolarHBondContact O-N 3.2Å
496	N	90.9	Very high	91.1	Very high	64 Å²	64	39.7 Å²	39.7	34%	0.342	22%	0.219	S	C	.	.	H	α-helix	trans	-65	-43.5	-179.9	-168.9	48.4	0	0	0	111.5	Q492 A493 Q494 A499 A500	Q492-N496 WeakPolarHBondContact O-CB 3.26Å; Q492-N496 PolarHBondContact O-N 2.87Å; A493-N496 PolarHBondContact O-N 2.94Å; Q494-N496 VanDerWaalsContact C-N 3.34Å; Q494-N496 PolarHBondContact O-N 3.02Å; N496-A499 PolarHBondContact O-N 3.16Å; N496-A500 WeakPolarHBondContact O-CB 3.38Å; N496-A500 PolarHBondContact O-N 3.26Å
497	N	92.5	Very high	91.6	Very high	105 Å²	105	45.1 Å²	45.1	56%	0.561	24%	0.239	S	C	*	.	H	α-helix	trans	-61.3	-45.5	175.3	-65.9	-7.6	0	0	0	111.1	A493 Q494 A500 V501	A493-N497 VanDerWaalsContact O-CG 3.28Å; A493-N497 PolarHBondContact O-N 3.28Å; A493-N497 PolarHBondContact O-OD1 3.21Å; Q494-N497 PolarHBondContact O-N 3.47Å; N497-A500 PolarHBondContact O-N 2.95Å; N497-V501 WeakPolarHBondContact O-CG2 3.24Å; N497-V501 PolarHBondContact O-N 2.91Å
498	L	93.3	Very high	91.8	Very high	24 Å²	24	45.7 Å²	45.7	13%	0.126	24%	0.242	C	C	.	.	H	α-helix	trans	-62.1	-43.9	176.8	179.9	60.2	0	0	0	112.1	L453 V456 A457 M460 Q494 F495 V501 I502	L453-L498 HydrophobicContact CB-CD1 4.01Å; L453-L498 HydrophobicContact CD2-CD1 3.64Å; L453-L498 HydrophobicContact CG-CD1 4.34Å; V456-L498 HydrophobicContact CB-CD2 4.2Å; V456-L498 HydrophobicContact CG1-CD2 3.79Å; A457-L498 HydrophobicContact CB-CD2 3.76Å; A457-L498 HydrophobicContact CB-CG 4.18Å; M460-L498 HydrophobicContact SD-CD2 3.61Å; Q494-L498 WeakPolarHBondContact O-CB 3.36Å; Q494-L498 PolarHBondContact O-N 3.42Å; F495-L498 PolarHBondContact O-N 3.5Å; L498-V501 PolarHBondContact O-N 3.36Å; L498-I502 HydrophobicContact CD1-CD1 4.28Å; L498-I502 HydrophobicContact CG-CD1 4.03Å; L498-I502 VanDerWaalsContact O-CG1 3.31Å; L498-I502 WeakPolarHBondContact O-CG1 3.45Å; L498-I502 PolarHBondContact O-N 3.48Å
499	A	92.6	Very high	91.8	Very high	16 Å²	16	46.4 Å²	46.4	13%	0.132	25%	0.245	C	C	.	.	H	α-helix	trans	-61.7	-43.2	176.6	0	0	0	0	0	112	F495 N496 V501 I502 V503	F495-A499 HydrophobicContact CE1-CB 4.28Å; F495-A499 WeakPolarHBondContact O-CB 3.29Å; F495-A499 PolarHBondContact O-N 3.2Å; N496-A499 PolarHBondContact O-N 3.16Å; A499-V501 VanDerWaalsContact C-N 3.35Å; A499-V501 PolarHBondContact O-N 2.91Å; A499-I502 PolarHBondContact O-N 3.37Å; A499-V503 WeakPolarHBondContact O-CG2 3.23Å; A499-V503 PolarHBondContact O-N 2.99Å
500	A	94.2	Very high	91.8	Very high	58 Å²	58	47.9 Å²	47.9	48%	0.479	25%	0.252	S	S	.	.	H	α-helix	trans	-61.2	-41.5	175.7	0	0	0	0	0	112.3	N496 N497 V503 F504	N496-A500 WeakPolarHBondContact O-CB 3.38Å; N496-A500 PolarHBondContact O-N 3.26Å; N497-A500 PolarHBondContact O-N 2.95Å; A500-V503 PolarHBondContact O-N 2.9Å; A500-F504 WeakPolarHBondContact O-CB 3.48Å; A500-F504 PolarHBondContact O-N 3.02Å
501	V	95.2	Very high	91.6	Very high	61 Å²	61	51.3 Å²	51.3	37%	0.37	26%	0.262	S	S	.	.	H	α-helix	trans	-64.9	-41.2	175.8	173.5	0	0	0	0	111.7	L453 N497 L498 A499 F504 F505	L453-V501 HydrophobicContact CD1-CG1 4Å; N497-V501 WeakPolarHBondContact O-CG2 3.24Å; N497-V501 PolarHBondContact O-N 2.91Å; L498-V501 PolarHBondContact O-N 3.36Å; A499-V501 VanDerWaalsContact C-N 3.35Å; A499-V501 PolarHBondContact O-N 2.91Å; V501-F504 PolarHBondContact O-N 3.06Å; V501-F505 HydrophobicContact CG1-CD2 3.66Å; V501-F505 HydrophobicContact CG1-CE2 3.48Å; V501-F505 VanDerWaalsContact CG1-CE2 3.48Å; V501-F505 VanDerWaalsContact O-CD2 3.29Å; V501-F505 WeakPolarHBondContact O-CD2 3.32Å; V501-F505 PolarHBondContact O-N 2.9Å
502	I	94.1	Very high	91.3	Very high	7 Å²	7	52.8 Å²	52.8	4%	0.036	27%	0.267	C	S	.	.	H	α-helix	trans	-61.9	-43.9	175	-68.4	160.8	0	0	0	111.1	L453 A457 L498 A499 S506	L453-I502 HydrophobicContact CB-CD1 4.08Å; L453-I502 HydrophobicContact CB-CG1 3.65Å; L453-I502 HydrophobicContact CD1-CG1 4.48Å; A457-I502 HydrophobicContact CB-CD1 3.71Å; L498-I502 HydrophobicContact CD1-CD1 4.28Å; L498-I502 HydrophobicContact CG-CD1 4.03Å; L498-I502 VanDerWaalsContact O-CG1 3.31Å; L498-I502 WeakPolarHBondContact O-CG1 3.45Å; L498-I502 PolarHBondContact O-N 3.48Å; A499-I502 PolarHBondContact O-N 3.37Å; I502-S506 VanDerWaalsContact O-CB 3.31Å; I502-S506 WeakPolarHBondContact O-CB 3.42Å; I502-S506 PolarHBondContact O-N 3.37Å; I502-S506 PolarHBondContact O-OG 2.94Å
503	V	94.7	Very high	90.8	Very high	25 Å²	25	52.7 Å²	52.7	15%	0.152	27%	0.267	C	S	.	.	H	α-helix	trans	-62.3	-45.4	176.8	174.9	0	0	0	0	110.7	V171 T175 A499 A500 S506 W507	V171-V503 HydrophobicContact CG1-CG2 3.61Å; T175-V503 HydrophobicContact CG2-CG2 3.53Å; A499-V503 WeakPolarHBondContact O-CG2 3.23Å; A499-V503 PolarHBondContact O-N 2.99Å; A500-V503 PolarHBondContact O-N 2.9Å; V503-S506 WeakPolarHBondContact O-CB 3.46Å; V503-S506 PolarHBondContact O-N 3.07Å; V503-W507 VanDerWaalsContact O-CD1 3.28Å; V503-W507 PolarHBondContact O-N 3.5Å
504	F	95.7	Very high	90.2	Very high	129 Å²	129	54.9 Å²	54.9	57%	0.566	28%	0.275	S	S	*	.	H	α-helix	trans	-57.8	-53.2	177.7	174.6	-100	0	0	0	112	A500 V501 S506 W507 V508	A500-F504 WeakPolarHBondContact O-CB 3.48Å; A500-F504 PolarHBondContact O-N 3.02Å; V501-F504 PolarHBondContact O-N 3.06Å; F504-S506 PolarHBondContact O-N 2.92Å; F504-W507 PolarHBondContact O-N 3.2Å; F504-W507 VanDerWaalsContact O-N 3.16Å; F504-V508 HydrophobicContact CD1-CG2 4.46Å; F504-V508 HydrophobicContact CE1-CG2 4.04Å; F504-V508 HydrophobicContact CE2-CG2 4.33Å; F504-V508 HydrophobicContact CZ-CG2 3.97Å; F504-V508 WeakPolarHBondContact O-CG2 3.37Å; F504-V508 PolarHBondContact O-N 3.37Å
505	F	94.7	Very high	89.2	Confident	54 Å²	54	51.4 Å²	51.4	24%	0.237	26%	0.26	C	S	.	.	H	α-helix	trans	-64.1	-30.8	177.5	-73.5	-58.9	0	0	0	112.7	L446 L449 I450 L453 V501 V508 K509	L446-F505 HydrophobicContact CD1-CD1 4.44Å; L449-F505 HydrophobicContact CD2-CD1 4.44Å; L449-F505 HydrophobicContact CD2-CD2 4.09Å; L449-F505 HydrophobicContact CD2-CE1 4.17Å; L449-F505 HydrophobicContact CD2-CE2 3.77Å; L449-F505 HydrophobicContact CD2-CG 4.41Å; L449-F505 HydrophobicContact CD2-CZ 3.84Å; I450-F505 HydrophobicContact CD1-CB 4.13Å; I450-F505 HydrophobicContact CG1-CB 3.85Å; L453-F505 HydrophobicContact CD1-CD2 4.16Å; L453-F505 HydrophobicContact CD1-CE2 4.4Å; V501-F505 HydrophobicContact CG1-CD2 3.66Å; V501-F505 HydrophobicContact CG1-CE2 3.48Å; V501-F505 VanDerWaalsContact CG1-CE2 3.48Å; V501-F505 VanDerWaalsContact O-CD2 3.29Å; V501-F505 WeakPolarHBondContact O-CD2 3.32Å; V501-F505 PolarHBondContact O-N 2.9Å; F505-V508 PolarHBondContact O-N 3.03Å; F505-K509 PolarHBondContact O-N 3.21Å
506	S	92.4	Very high	88	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-66.1	-39.4	174.3	-59.8	0	0	0	0	112.4	Y164 I502 V503 F504 K509 L510	Y164-S506 WeakPolarHBondContact OH-CA 3.48Å; Y164-S506 VanDerWaalsContact OH-CB 3.29Å; Y164-S506 WeakPolarHBondContact OH-CB 3.38Å; Y164-S506 PolarHBondContact OH-O 2.9Å; I502-S506 VanDerWaalsContact O-CB 3.31Å; I502-S506 WeakPolarHBondContact O-CB 3.42Å; I502-S506 PolarHBondContact O-N 3.37Å; I502-S506 PolarHBondContact O-OG 2.94Å; V503-S506 WeakPolarHBondContact O-CB 3.46Å; V503-S506 PolarHBondContact O-N 3.07Å; F504-S506 PolarHBondContact O-N 2.92Å; S506-K509 PolarHBondContact O-N 3.04Å; S506-L510 PolarHBondContact O-N 3.28Å
507	W	93.3	Very high	87	Confident	131 Å²	131	55.3 Å²	55.3	50%	0.496	28%	0.278	S	S	.	.	H	α-helix	trans	-66.8	-37.8	171.2	-80	105.5	0	0	0	112.5	L168 V503 F504 K509 L510	L168-W507 HydrophobicContact CD1-CD2 4.33Å; L168-W507 HydrophobicContact CD2-CD2 4.41Å; L168-W507 HydrophobicContact CD2-CE3 4.2Å; L168-W507 HydrophobicContact CD2-CH2 4.12Å; L168-W507 HydrophobicContact CD2-CZ2 4.3Å; L168-W507 HydrophobicContact CD2-CZ3 4.06Å; V503-W507 VanDerWaalsContact O-CD1 3.28Å; V503-W507 PolarHBondContact O-N 3.5Å; F504-W507 PolarHBondContact O-N 3.2Å; F504-W507 VanDerWaalsContact O-N 3.16Å; W507-K509 PolarHBondContact O-N 3.24Å; W507-L510 HydrophobicContact CE3-CD2 3.99Å; W507-L510 HydrophobicContact CZ3-CD2 3.88Å; W507-L510 WeakPolarHBondContact O-CB 3.28Å; W507-L510 PolarHBondContact O-N 2.93Å
508	V	90.8	Very high	86	Confident	40 Å²	40	54 Å²	54	24%	0.242	27%	0.267	C	S	.	.	H	α-helix	trans	-64.5	-38.4	174.7	175.4	0	0	0	0	111.8	L446 F504 F505 L510 F511	L446-V508 HydrophobicContact CD1-CG1 3.9Å; F504-V508 HydrophobicContact CD1-CG2 4.46Å; F504-V508 HydrophobicContact CE1-CG2 4.04Å; F504-V508 HydrophobicContact CE2-CG2 4.33Å; F504-V508 HydrophobicContact CZ-CG2 3.97Å; F504-V508 WeakPolarHBondContact O-CG2 3.37Å; F504-V508 PolarHBondContact O-N 3.37Å; F505-V508 PolarHBondContact O-N 3.03Å; V508-L510 PolarHBondContact O-N 3.25Å; V508-F511 HydrophobicContact CG1-CD2 4.39Å; V508-F511 WeakPolarHBondContact O-CB 3.46Å; V508-F511 VanDerWaalsContact O-CD2 3.29Å; V508-F511 WeakPolarHBondContact O-CD2 3.29Å; V508-F511 PolarHBondContact O-N 3.43Å; V508-F511 VanDerWaalsContact O-N 3.07Å
509	K	88.6	Confident	85.2	Confident	15 Å²	15	56.6 Å²	56.6	7%	0.065	28%	0.284	C	S	.	.	H	α-helix	trans	-59	-26.6	175.2	-179.3	163.6	172.4	161.7	0	112.9	Y164 L446 D447 I450 F505 S506 W507 F511 K512 F513	Y164-K509 HydrophobicContact CD2-CD 4.12Å; Y164-K509 HydrophobicContact CE1-CB 4.2Å; Y164-K509 HydrophobicContact CE1-CD 4.31Å; Y164-K509 HydrophobicContact CE1-CG 3.99Å; Y164-K509 HydrophobicContact CE2-CD 3.44Å; Y164-K509 VanDerWaalsContact CE2-CD 3.44Å; Y164-K509 HydrophobicContact CE2-CG 4.05Å; L446-K509 HydrophobicContact CD2-CB 3.74Å; L446-K509 HydrophobicContact CD2-CD 4.26Å; L446-K509 HydrophobicContact CD2-CG 4.27Å; D447-K509 VanDerWaalsContact CG-NZ 3.3Å; D447-K509 WeakPolarHBondContact OD1-CD 3.42Å; D447-K509 WeakPolarHBondContact OD1-CE 3.37Å; D447-K509 IonicContact OD1-NZ 2.83Å; D447-K509 PolarHBondContact OD1-NZ 2.68Å; D447-K509 IonicContact OD2-NZ 3.49Å; I450-K509 HydrophobicContact CD1-CB 4.18Å; I450-K509 HydrophobicContact CD1-CD 3.95Å; F505-K509 PolarHBondContact O-N 3.21Å; S506-K509 PolarHBondContact O-N 3.04Å; W507-K509 PolarHBondContact O-N 3.24Å; K509-F511 PolarHBondContact O-N 3.18Å; K509-F511 VanDerWaalsContact O-N 3.17Å; K509-K512 VanDerWaalsContact O-CB 3.24Å; K509-K512 WeakPolarHBondContact O-CB 3.21Å; K509-K512 PolarHBondContact O-N 3.43Å; K509-F513 HydrophobicContact CG-CE2 4.25Å
510	L	86.8	Confident	84.4	Confident	36 Å²	36	59.8 Å²	59.8	19%	0.188	30%	0.297	C	S	.	.	H	α-helix	trans	-58	-29.1	175.7	-165.3	67.5	0	0	0	112.4	S506 W507 V508 K512 F513 I514	S506-L510 PolarHBondContact O-N 3.28Å; W507-L510 HydrophobicContact CE3-CD2 3.99Å; W507-L510 HydrophobicContact CZ3-CD2 3.88Å; W507-L510 WeakPolarHBondContact O-CB 3.28Å; W507-L510 PolarHBondContact O-N 2.93Å; V508-L510 PolarHBondContact O-N 3.25Å; L510-K512 VanDerWaalsContact C-N 3.27Å; L510-K512 PolarHBondContact O-N 3.21Å; L510-F513 PolarHBondContact O-N 3.45Å; L510-I514 HydrophobicContact CD2-CD1 4.09Å; L510-I514 HydrophobicContact CG-CD1 3.9Å; L510-I514 HydrophobicContact CG-CG1 4.37Å; L510-I514 WeakPolarHBondContact O-CG1 3.36Å; L510-I514 PolarHBondContact O-N 2.97Å; L510-I514 VanDerWaalsContact O-N 3.1Å
511	F	83.6	Confident	83.6	Confident	116 Å²	116	58.9 Å²	58.9	51%	0.509	29%	0.287	S	S	.	.	H	α-helix	trans	-60.9	-31.9	176.1	-68.1	-59.4	0	0	0	113.3	W443 V508 K509 F513 I514 N515	W443-F511 HydrophobicContact CH2-CB 4.01Å; W443-F511 HydrophobicContact CZ3-CB 4.44Å; V508-F511 HydrophobicContact CG1-CD2 4.39Å; V508-F511 WeakPolarHBondContact O-CB 3.46Å; V508-F511 VanDerWaalsContact O-CD2 3.29Å; V508-F511 WeakPolarHBondContact O-CD2 3.29Å; V508-F511 PolarHBondContact O-N 3.43Å; V508-F511 VanDerWaalsContact O-N 3.07Å; K509-F511 PolarHBondContact O-N 3.18Å; K509-F511 VanDerWaalsContact O-N 3.17Å; F511-F513 PolarHBondContact O-N 3.46Å; F511-I514 HydrophobicContact CD1-CD1 4.26Å; F511-I514 PolarHBondContact O-N 3.05Å; F511-I514 VanDerWaalsContact O-N 3.1Å; F511-N515 PolarHBondContact O-N 3.29Å; F511-N515 PolarHBondContact O-ND2 3.43Å
512	K	82.6	Confident	82.9	Confident	59 Å²	59	57.2 Å²	57.2	26%	0.257	28%	0.276	S	S	.	.	H	α-helix	trans	-53.3	-41.1	172.3	-167.2	-175.5	-173.8	-180	0	110.9	W443 D447 K509 L510	W443-K512 HydrophobicContact CB-CD 4.17Å; W443-K512 HydrophobicContact CD2-CB 4.18Å; W443-K512 HydrophobicContact CD2-CG 4.15Å; W443-K512 HydrophobicContact CE3-CB 3.85Å; W443-K512 HydrophobicContact CE3-CG 4.26Å; W443-K512 HydrophobicContact CG-CD 4.41Å; W443-K512 HydrophobicContact CG-CG 4.28Å; W443-K512 HydrophobicContact CZ3-CB 4.05Å; D447-K512 IonicContact OD2-NZ 3.6Å; D447-K512 PolarHBondContact OD2-NZ 3.25Å; K509-K512 VanDerWaalsContact O-CB 3.24Å; K509-K512 WeakPolarHBondContact O-CB 3.21Å; K509-K512 PolarHBondContact O-N 3.43Å; L510-K512 VanDerWaalsContact C-N 3.27Å; L510-K512 PolarHBondContact O-N 3.21Å
513	F	79.4	Confident	82.4	Confident	19 Å²	19	61.1 Å²	61.1	8%	0.083	30%	0.296	C	S	.	.	H	α-helix	trans	-90.2	-9.7	-179.1	-54.1	-74.7	0	0	0	114.4	E160 M161 Y164 K509 L510 F511 F516	E160-F513 HydrophobicContact CB-CE1 4.41Å; M161-F513 HydrophobicContact CB-CD1 3.92Å; M161-F513 HydrophobicContact CB-CE1 4.33Å; M161-F513 HydrophobicContact CB-CG 4.49Å; M161-F513 HydrophobicContact CG-CB 4.26Å; M161-F513 HydrophobicContact CG-CD1 4.25Å; M161-F513 HydrophobicContact CG-CG 4.34Å; Y164-F513 AromaticContact CD1-CD2 3.89Å; Y164-F513 HydrophobicContact CD1-CD2 3.89Å; Y164-F513 AromaticContact CD1-CE2 3.43Å; Y164-F513 HydrophobicContact CD1-CE2 3.43Å; Y164-F513 VanDerWaalsContact CD1-CE2 3.43Å; Y164-F513 HydrophobicContact CD1-CZ 4.35Å; Y164-F513 HydrophobicContact CD2-CE2 4.32Å; Y164-F513 HydrophobicContact CE1-CE2 4.17Å; Y164-F513 HydrophobicContact CG-CD2 4.4Å; Y164-F513 AromaticContact CG-CE2 3.54Å; Y164-F513 HydrophobicContact CG-CE2 3.54Å; Y164-F513 HydrophobicContact CG-CZ 4.04Å; K509-F513 HydrophobicContact CG-CE2 4.25Å; L510-F513 PolarHBondContact O-N 3.45Å; F511-F513 PolarHBondContact O-N 3.46Å; F513-F516 HydrophobicContact CB-CE2 4.28Å; F513-F516 WeakPolarHBondContact O-CD2 3.44Å; F513-F516 WeakPolarHBondContact O-CE2 3.18Å
514	I	75.8	Confident	81.8	Confident	64 Å²	64	61.7 Å²	61.7	33%	0.328	30%	0.301	S	S	.	.	H	α-helix	trans	-87.3	-19.8	175	-69.3	167.3	0	0	0	111.2	L510 F511 F516 N517 M520	L510-I514 HydrophobicContact CD2-CD1 4.09Å; L510-I514 HydrophobicContact CG-CD1 3.9Å; L510-I514 HydrophobicContact CG-CG1 4.37Å; L510-I514 WeakPolarHBondContact O-CG1 3.36Å; L510-I514 PolarHBondContact O-N 2.97Å; L510-I514 VanDerWaalsContact O-N 3.1Å; F511-I514 HydrophobicContact CD1-CD1 4.26Å; F511-I514 PolarHBondContact O-N 3.05Å; F511-I514 VanDerWaalsContact O-N 3.1Å; I514-F516 PolarHBondContact O-N 3.09Å; I514-N517 PolarHBondContact O-N 2.79Å; I514-M520 HydrophobicContact CG2-CB 4.14Å; I514-M520 HydrophobicContact CG2-CG 3.85Å; I514-M520 HydrophobicContact CG2-SD 4.44Å
515	N	69.4	Low	81.2	Confident	39 Å²	39	57.4 Å²	57.4	21%	0.209	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	2.6	179.1	-76	-19.5	0	0	0	115.6	F511 N517 M520 S521 S524	F511-N515 PolarHBondContact O-N 3.29Å; F511-N515 PolarHBondContact O-ND2 3.43Å; N515-N517 PolarHBondContact O-N 3.03Å; N515-M520 PolarHBondContact OD1-O 2.99Å; N515-S521 WeakPolarHBondContact O-CB 3.23Å; N515-S524 PolarHBondContact ND2-OG 2.98Å; N515-S524 WeakPolarHBondContact OD1-CB 3.38Å
516	F	67.3	Low	80.8	Confident	77 Å²	77	55.4 Å²	55.4	34%	0.338	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-19.4	170.6	-59.1	-54.6	0	0	0	114	V157 F513 I514 M637	V157-F516 HydrophobicContact CG1-CE1 3.56Å; V157-F516 HydrophobicContact CG1-CE2 4.16Å; V157-F516 HydrophobicContact CG1-CZ 3.18Å; F513-F516 HydrophobicContact CB-CE2 4.28Å; F513-F516 WeakPolarHBondContact O-CD2 3.44Å; F513-F516 WeakPolarHBondContact O-CE2 3.18Å; I514-F516 PolarHBondContact O-N 3.09Å; F516-M637 HydrophobicContact CD1-CE 3.85Å; F516-M637 HydrophobicContact CD1-SD 3.71Å; F516-M637 HydrophobicContact CD2-CE 4.39Å; F516-M637 HydrophobicContact CE1-CE 4.05Å; F516-M637 HydrophobicContact CE1-SD 4.28Å; F516-M637 HydrophobicContact CG-CE 4.08Å; F516-M637 HydrophobicContact CG-SD 4.19Å; F516-M637 HydrophobicContact CZ-CE 4.44Å
517	N	70.2	Confident	80.5	Confident	86 Å²	86	61 Å²	61	46%	0.46	31%	0.306	S	S	.	.	S	Bend	trans	-85.3	130.5	172.5	-171.7	-11.7	0	0	0	110.4	I514 N515 T519 M520 S521	I514-N517 PolarHBondContact O-N 2.79Å; N515-N517 PolarHBondContact O-N 3.03Å; N517-T519 PolarHBondContact ND2-OG1 3.26Å; N517-T519 PolarHBondContact O-N 3.43Å; N517-T519 VanDerWaalsContact O-N 3.14Å; N517-T519 PolarHBondContact OD1-N 3.37Å; N517-T519 PolarHBondContact OD1-OG1 3.23Å; N517-M520 HydrophobicContact CB-CB 4.37Å; N517-M520 HydrophobicContact CB-CG 4.32Å; N517-M520 PolarHBondContact O-N 3.39Å; N517-S521 PolarHBondContact O-N 3.46Å
518	K	71.9	Confident	80.1	Confident	79 Å²	79	59.3 Å²	59.3	34%	0.343	31%	0.313	S	S	.	.	H	α-helix	trans	-51.2	-38.6	178.1	-174	171.8	-179.7	174.1	0	112.5	Q522 M628	K518-Q522 WeakPolarHBondContact O-CB 3.02Å; K518-Q522 PolarHBondContact O-N 3.26Å; K518-M628 VanDerWaalsContact CE-O 3.26Å; K518-M628 WeakPolarHBondContact CE-O 3.43Å; K518-M628 PolarHBondContact NZ-O 2.84Å
519	T	76	Confident	79.9	Confident	77 Å²	77	61.8 Å²	61.8	47%	0.472	32%	0.318	S	S	.	.	H	α-helix	trans	-70.6	-33.7	179.4	58.9	0	0	0	0	113.5	N517 L523	N517-T519 PolarHBondContact ND2-OG1 3.26Å; N517-T519 PolarHBondContact O-N 3.43Å; N517-T519 VanDerWaalsContact O-N 3.14Å; N517-T519 PolarHBondContact OD1-N 3.37Å; N517-T519 PolarHBondContact OD1-OG1 3.23Å; T519-L523 PolarHBondContact O-N 3.06Å
520	M	76	Confident	80	Confident	84 Å²	84	61.1 Å²	61.1	41%	0.414	32%	0.316	S	S	.	.	H	α-helix	trans	-79.7	-39.6	177.5	-67.9	-65.3	179.6	0	0	111.4	I514 N515 N517 Q522 L523 S524	I514-M520 HydrophobicContact CG2-CB 4.14Å; I514-M520 HydrophobicContact CG2-CG 3.85Å; I514-M520 HydrophobicContact CG2-SD 4.44Å; N515-M520 PolarHBondContact OD1-O 2.99Å; N517-M520 HydrophobicContact CB-CB 4.37Å; N517-M520 HydrophobicContact CB-CG 4.32Å; N517-M520 PolarHBondContact O-N 3.39Å; M520-Q522 VanDerWaalsContact C-N 3.27Å; M520-Q522 PolarHBondContact O-N 3.18Å; M520-L523 PolarHBondContact O-N 2.88Å; M520-L523 VanDerWaalsContact O-N 3.11Å; M520-L523 HydrophobicContact SD-CD1 4.11Å; M520-S524 PolarHBondContact O-N 3.46Å
521	S	77.5	Confident	80.2	Confident	39 Å²	39	61.3 Å²	61.3	27%	0.273	32%	0.323	S	S	.	.	H	α-helix	trans	-58.7	-39	171.2	-173.8	0	0	0	0	111.9	N515 N517 S524 T525	N515-S521 WeakPolarHBondContact O-CB 3.23Å; N517-S521 PolarHBondContact O-N 3.46Å; S521-S524 PolarHBondContact O-N 3.27Å; S521-T525 VanDerWaalsContact O-CB 3.26Å; S521-T525 WeakPolarHBondContact O-CB 3.24Å; S521-T525 PolarHBondContact O-N 2.57Å; S521-T525 PolarHBondContact O-OG1 3.4Å
522	Q	81	Confident	80.4	Confident	26 Å²	26	63.8 Å²	63.8	12%	0.121	33%	0.333	C	S	.	.	H	α-helix	trans	-56.8	-50.8	171.4	-175.2	-173.9	-13.9	0	0	111.3	K518 M520 T525 T526 V624 M628	K518-Q522 WeakPolarHBondContact O-CB 3.02Å; K518-Q522 PolarHBondContact O-N 3.26Å; M520-Q522 VanDerWaalsContact C-N 3.27Å; M520-Q522 PolarHBondContact O-N 3.18Å; Q522-T525 PolarHBondContact O-N 3.11Å; Q522-T526 WeakPolarHBondContact O-CG2 3.48Å; Q522-T526 PolarHBondContact O-N 3.18Å; Q522-T526 PolarHBondContact O-OG1 3.47Å; Q522-V624 HydrophobicContact CG-CG1 4.07Å; Q522-M628 HydrophobicContact CG-CG 4.36Å
523	L	82.2	Confident	80.9	Confident	88 Å²	88	65.2 Å²	65.2	46%	0.461	34%	0.344	S	S	.	.	H	α-helix	trans	-61.7	-45	179.2	-69.3	170.8	0	0	0	112.7	T519 M520 T525 T526 M527 Y621	T519-L523 PolarHBondContact O-N 3.06Å; M520-L523 PolarHBondContact O-N 2.88Å; M520-L523 VanDerWaalsContact O-N 3.11Å; M520-L523 HydrophobicContact SD-CD1 4.11Å; L523-T525 VanDerWaalsContact C-N 3.29Å; L523-T525 PolarHBondContact O-N 3.38Å; L523-T526 WeakPolarHBondContact CA-OG1 3.4Å; L523-T526 PolarHBondContact O-N 3.03Å; L523-T526 PolarHBondContact O-OG1 3.12Å; L523-M527 PolarHBondContact O-N 3.26Å; L523-Y621 HydrophobicContact CD2-CD2 4.45Å; L523-Y621 HydrophobicContact CD2-CE2 4.03Å
524	S	82.4	Confident	81.5	Confident	37 Å²	37	65.9 Å²	65.9	26%	0.259	35%	0.348	S	S	.	.	H	α-helix	trans	-63.3	-36.7	176.2	-170.7	0	0	0	0	111.8	N515 M520 S521 S528	N515-S524 PolarHBondContact ND2-OG 2.98Å; N515-S524 WeakPolarHBondContact OD1-CB 3.38Å; M520-S524 PolarHBondContact O-N 3.46Å; S521-S524 PolarHBondContact O-N 3.27Å; S524-S528 WeakPolarHBondContact O-CB 3.19Å; S524-S528 PolarHBondContact O-N 3.29Å; S524-S528 VanDerWaalsContact O-N 3.07Å
525	T	82.9	Confident	82.1	Confident	39 Å²	39	66.9 Å²	66.9	24%	0.239	36%	0.357	C	S	.	.	H	α-helix	trans	-69.7	-41.9	176.8	-57.7	0	0	0	0	111.2	S521 Q522 L523 M527 S528 R529 V624 M628	S521-T525 VanDerWaalsContact O-CB 3.26Å; S521-T525 WeakPolarHBondContact O-CB 3.24Å; S521-T525 PolarHBondContact O-N 2.57Å; S521-T525 PolarHBondContact O-OG1 3.4Å; Q522-T525 PolarHBondContact O-N 3.11Å; L523-T525 VanDerWaalsContact C-N 3.29Å; L523-T525 PolarHBondContact O-N 3.38Å; T525-M527 PolarHBondContact O-N 2.7Å; T525-S528 PolarHBondContact O-N 2.76Å; T525-R529 HydrophobicContact CG2-CG 4.48Å; T525-R529 PolarHBondContact O-N 2.97Å; T525-V624 HydrophobicContact CG2-CG1 3.92Å; T525-V624 HydrophobicContact CG2-CG2 4.35Å; T525-M628 HydrophobicContact CG2-CE 4.28Å
526	T	87.5	Confident	83.1	Confident	13 Å²	13	66.9 Å²	66.9	8%	0.08	37%	0.366	C	S	.	.	H	α-helix	trans	-60	-46.7	176	48.4	0	0	0	0	111.6	Q522 L523 S528 R529 C530 Y621 V624	Q522-T526 WeakPolarHBondContact O-CG2 3.48Å; Q522-T526 PolarHBondContact O-N 3.18Å; Q522-T526 PolarHBondContact O-OG1 3.47Å; L523-T526 WeakPolarHBondContact CA-OG1 3.4Å; L523-T526 PolarHBondContact O-N 3.03Å; L523-T526 PolarHBondContact O-OG1 3.12Å; T526-S528 VanDerWaalsContact C-N 3.33Å; T526-S528 PolarHBondContact O-N 3.33Å; T526-R529 PolarHBondContact O-N 3Å; T526-C530 WeakPolarHBondContact O-CB 3.35Å; T526-C530 PolarHBondContact O-N 3.46Å; T526-C530 PolarHBondContact O-SG 3.05Å; T526-C530 VanDerWaalsContact O-SG 3.36Å; T526-Y621 HydrophobicContact CG2-CD2 3.96Å; T526-V624 HydrophobicContact CG2-CB 3.42Å; T526-V624 VanDerWaalsContact CG2-CB 3.42Å; T526-V624 HydrophobicContact CG2-CG1 3.87Å; T526-V624 HydrophobicContact CG2-CG2 3.56Å
527	M	85.1	Confident	84.3	Confident	118 Å²	118	63.7 Å²	63.7	58%	0.581	35%	0.352	S	S	*	.	H	α-helix	trans	-60.8	-42.4	176.8	-171.6	66.4	76.3	0	0	111.5	L523 T525 C530 A531	L523-M527 PolarHBondContact O-N 3.26Å; T525-M527 PolarHBondContact O-N 2.7Å; M527-C530 PolarHBondContact O-SG 3.37Å; M527-A531 VanDerWaalsContact O-CB 3.28Å; M527-A531 WeakPolarHBondContact O-CB 3.34Å; M527-A531 PolarHBondContact O-N 3.35Å
528	S	84.4	Confident	85.3	Confident	94 Å²	94	61 Å²	61	66%	0.657	34%	0.342	S	S	*	.	H	α-helix	trans	-70.8	-29.4	179.8	-171.3	0	0	0	0	114.1	S524 T525 T526	S524-S528 WeakPolarHBondContact O-CB 3.19Å; S524-S528 PolarHBondContact O-N 3.29Å; S524-S528 VanDerWaalsContact O-N 3.07Å; T525-S528 PolarHBondContact O-N 2.76Å; T526-S528 VanDerWaalsContact C-N 3.33Å; T526-S528 PolarHBondContact O-N 3.33Å
529	R	87.1	Confident	86.3	Confident	92 Å²	92	62.1 Å²	62.1	35%	0.347	35%	0.351	S	S	.	.	H	α-helix	trans	-76	-51	174.3	-71.3	-167.8	-169	-178.7	1.4	110.9	T525 T526 A531 E623 V624 D627	T525-R529 HydrophobicContact CG2-CG 4.48Å; T525-R529 PolarHBondContact O-N 2.97Å; T526-R529 PolarHBondContact O-N 3Å; R529-A531 PolarHBondContact O-N 2.95Å; R529-E623 IonicContact NH1-OE2 2.88Å; R529-E623 PolarHBondContact NH1-OE2 3.45Å; R529-V624 HydrophobicContact CG-CG2 4.46Å; R529-D627 IonicContact CZ-OD2 3.98Å; R529-D627 IonicContact NH1-OD2 2.69Å; R529-D627 PolarHBondContact NH1-OD2 2.85Å; R529-D627 IonicContact NH2-OD2 3.25Å; R529-D627 PolarHBondContact NH2-OD2 2.9Å
530	C	91.9	Very high	87.1	Confident	2 Å²	2	63.8 Å²	63.8	1%	0.014	35%	0.354	C	S	.	.	H	α-helix	trans	-67.8	-21.7	-177.4	80.6	0	0	0	0	113.2	T526 M527 K532 D533 L534 T620	T526-C530 WeakPolarHBondContact O-CB 3.35Å; T526-C530 PolarHBondContact O-N 3.46Å; T526-C530 PolarHBondContact O-SG 3.05Å; T526-C530 VanDerWaalsContact O-SG 3.36Å; M527-C530 PolarHBondContact O-SG 3.37Å; C530-K532 PolarHBondContact O-N 3.29Å; C530-D533 PolarHBondContact O-N 2.97Å; C530-D533 VanDerWaalsContact O-N 3.13Å; C530-L534 WeakPolarHBondContact O-CB 3.48Å; C530-L534 PolarHBondContact O-N 3.26Å; C530-T620 HydrophobicContact CB-CG2 3.83Å; C530-T620 VanDerWaalsContact CB-OG1 3.24Å; C530-T620 WeakPolarHBondContact CB-OG1 3.41Å
531	A	89.3	Confident	87.8	Confident	40 Å²	40	61.2 Å²	61.2	33%	0.331	34%	0.341	S	S	.	.	H	α-helix	trans	-50.5	-34.4	179.8	0	0	0	0	0	114.2	M527 R529 T535	M527-A531 VanDerWaalsContact O-CB 3.28Å; M527-A531 WeakPolarHBondContact O-CB 3.34Å; M527-A531 PolarHBondContact O-N 3.35Å; R529-A531 PolarHBondContact O-N 2.95Å; A531-T535 VanDerWaalsContact O-CB 3.29Å; A531-T535 WeakPolarHBondContact O-CB 3.48Å; A531-T535 PolarHBondContact O-N 3.17Å; A531-T535 PolarHBondContact O-OG1 3.05Å
532	K	89.1	Confident	88.6	Confident	168 Å²	168	64.1 Å²	64.1	73%	0.73	35%	0.349	S	S	*	.	H	α-helix	trans	-68	-52	178.6	-174.3	-171.5	173.3	-163.5	0	111.6	C530 L534 T535 G536	C530-K532 PolarHBondContact O-N 3.29Å; K532-L534 VanDerWaalsContact C-N 3.34Å; K532-T535 PolarHBondContact O-N 3.07Å; K532-G536 PolarHBondContact O-N 2.81Å; K532-G536 VanDerWaalsContact O-N 3.15Å
533	D	92.1	Very high	89.2	Confident	89 Å²	89	68.2 Å²	68.2	48%	0.476	37%	0.37	S	S	.	.	H	α-helix	trans	-71.3	-36.4	-177.2	-53.9	-34.2	0	0	0	110.4	C530 T535 G536 F537 I616	C530-D533 PolarHBondContact O-N 2.97Å; C530-D533 VanDerWaalsContact O-N 3.13Å; D533-T535 PolarHBondContact O-N 2.72Å; D533-G536 PolarHBondContact O-N 2.65Å; D533-F537 PolarHBondContact O-N 2.83Å; D533-I616 HydrophobicContact CB-CG2 4.27Å
534	L	91.6	Very high	89.8	Confident	32 Å²	32	66.9 Å²	66.9	17%	0.168	36%	0.363	C	S	.	.	H	α-helix	trans	-62.5	-38.7	171.2	179.2	59.7	0	0	0	112.3	C530 K532 G536 F537 A538 F613	C530-L534 WeakPolarHBondContact O-CB 3.48Å; C530-L534 PolarHBondContact O-N 3.26Å; K532-L534 VanDerWaalsContact C-N 3.34Å; L534-G536 VanDerWaalsContact C-N 3.34Å; L534-F537 HydrophobicContact CD1-CD1 4.36Å; L534-F537 PolarHBondContact O-N 3.3Å; L534-A538 WeakPolarHBondContact O-CB 3.43Å; L534-A538 PolarHBondContact O-N 3.29Å; L534-F613 HydrophobicContact CD1-CD2 3.4Å; L534-F613 HydrophobicContact CD1-CE2 3.38Å; L534-F613 HydrophobicContact CD1-CZ 4.49Å; L534-F613 HydrophobicContact CD2-CE2 4.1Å; L534-F613 HydrophobicContact CG-CE2 4.37Å
535	T	89.5	Confident	90.3	Very high	85 Å²	85	65.1 Å²	65.1	52%	0.521	35%	0.351	S	S	.	.	H	α-helix	trans	-64.7	-40.8	175	-61.1	0	0	0	0	111	A531 K532 D533 A538 I539	A531-T535 VanDerWaalsContact O-CB 3.29Å; A531-T535 WeakPolarHBondContact O-CB 3.48Å; A531-T535 PolarHBondContact O-N 3.17Å; A531-T535 PolarHBondContact O-OG1 3.05Å; K532-T535 PolarHBondContact O-N 3.07Å; D533-T535 PolarHBondContact O-N 2.72Å; T535-A538 PolarHBondContact O-N 3.01Å; T535-I539 WeakPolarHBondContact O-CG1 3.49Å; T535-I539 PolarHBondContact O-N 3.24Å
536	G	91.2	Very high	90.9	Very high	39 Å²	39	66.9 Å²	66.9	40%	0.402	36%	0.358	S	S	.	.	H	α-helix	trans	-60.3	-47.4	173.6	0	0	0	0	0	112.4	K532 D533 L534 I539	K532-G536 PolarHBondContact O-N 2.81Å; K532-G536 VanDerWaalsContact O-N 3.15Å; D533-G536 PolarHBondContact O-N 2.65Å; L534-G536 VanDerWaalsContact C-N 3.34Å; G536-I539 PolarHBondContact O-N 3.4Å
537	F	92.3	Very high	91.4	Very high	11 Å²	11	69.2 Å²	69.2	5%	0.048	38%	0.379	C	S	.	.	H	α-helix	trans	-65.2	-40	175.9	175.9	-114.2	0	0	0	113.1	D533 L534 I539 M540 F541 L609 M612 F613 I616	D533-F537 PolarHBondContact O-N 2.83Å; L534-F537 HydrophobicContact CD1-CD1 4.36Å; L534-F537 PolarHBondContact O-N 3.3Å; F537-I539 VanDerWaalsContact C-N 3.25Å; F537-I539 PolarHBondContact O-N 2.73Å; F537-M540 WeakPolarHBondContact O-CA 3.23Å; F537-M540 WeakPolarHBondContact O-CB 3.42Å; F537-M540 PolarHBondContact O-N 2.92Å; F537-F541 PolarHBondContact O-N 3Å; F537-L609 HydrophobicContact CE2-CD2 3.75Å; F537-L609 HydrophobicContact CZ-CB 3.96Å; F537-L609 HydrophobicContact CZ-CD2 3.85Å; F537-L609 HydrophobicContact CZ-CG 4.48Å; F537-L609 WeakPolarHBondContact CZ-O 3.33Å; F537-M612 HydrophobicContact CD2-CE 3.33Å; F537-M612 HydrophobicContact CD2-CG 4.31Å; F537-M612 HydrophobicContact CD2-SD 3.72Å; F537-M612 HydrophobicContact CE2-CB 4.23Å; F537-M612 HydrophobicContact CE2-CE 3.72Å; F537-M612 HydrophobicContact CE2-CG 3.95Å; F537-M612 HydrophobicContact CE2-SD 3.39Å; F537-M612 WeakPolarHBondContact CE2-SD 3.46Å; F537-M612 HydrophobicContact CG-CE 4.15Å; F537-M612 HydrophobicContact CZ-CB 4.14Å; F537-M612 HydrophobicContact CZ-CG 4.28Å; F537-M612 HydrophobicContact CZ-SD 4.23Å; F537-F613 HydrophobicContact CE1-CB 3.89Å; F537-F613 HydrophobicContact CE1-CD2 4.44Å; F537-I616 HydrophobicContact CB-CD1 3.92Å; F537-I616 HydrophobicContact CD1-CD1 4.35Å; F537-I616 HydrophobicContact CG-CD1 4.05Å
538	A	91.4	Very high	91.9	Very high	29 Å²	29	65.2 Å²	65.2	24%	0.24	36%	0.357	C	S	.	.	H	α-helix	trans	-60.1	-35.8	179.4	0	0	0	0	0	111.9	L534 T535 F541 F542	L534-A538 WeakPolarHBondContact O-CB 3.43Å; L534-A538 PolarHBondContact O-N 3.29Å; T535-A538 PolarHBondContact O-N 3.01Å; A538-F541 PolarHBondContact O-N 3.44Å; A538-F542 WeakPolarHBondContact O-CB 3.23Å; A538-F542 WeakPolarHBondContact O-CD2 3.49Å; A538-F542 PolarHBondContact O-N 2.91Å
539	I	92.9	Very high	92.4	Very high	103 Å²	103	60.7 Å²	60.7	53%	0.528	33%	0.326	S	S	.	.	H	α-helix	trans	-62.2	-45.6	173.2	-66.2	163.4	0	0	0	110.6	T535 G536 F537 F542 I543	T535-I539 WeakPolarHBondContact O-CG1 3.49Å; T535-I539 PolarHBondContact O-N 3.24Å; G536-I539 PolarHBondContact O-N 3.4Å; F537-I539 VanDerWaalsContact C-N 3.25Å; F537-I539 PolarHBondContact O-N 2.73Å; I539-F542 PolarHBondContact O-N 2.94Å; I539-I543 HydrophobicContact CG2-CD1 4.02Å; I539-I543 VanDerWaalsContact O-CG1 3.3Å; I539-I543 WeakPolarHBondContact O-CG1 3.45Å; I539-I543 PolarHBondContact O-N 3.47Å
540	M	91.7	Very high	92.8	Very high	111 Å²	111	60.5 Å²	60.5	55%	0.547	33%	0.329	S	S	.	.	H	α-helix	trans	-62.5	-42.9	176	-62.6	177.6	63.6	0	0	112	F537 I543 I544	F537-M540 WeakPolarHBondContact O-CA 3.23Å; F537-M540 WeakPolarHBondContact O-CB 3.42Å; F537-M540 PolarHBondContact O-N 2.92Å; M540-I543 PolarHBondContact O-N 3.46Å; M540-I544 PolarHBondContact O-N 3.48Å
541	F	91.8	Very high	93	Very high	31 Å²	31	63.9 Å²	63.9	14%	0.136	35%	0.346	C	S	.	.	H	α-helix	trans	-57.5	-51.8	174.1	170.6	-89.9	0	0	0	111.3	F537 A538 I543 I544 F545 I577 I605 L609	F537-F541 PolarHBondContact O-N 3Å; A538-F541 PolarHBondContact O-N 3.44Å; F541-I543 VanDerWaalsContact C-N 3.32Å; F541-I543 PolarHBondContact O-N 3.43Å; F541-I544 PolarHBondContact O-N 3.03Å; F541-F545 HydrophobicContact CD1-CB 4.45Å; F541-F545 HydrophobicContact CE1-CB 4.13Å; F541-F545 HydrophobicContact CE1-CD2 4.17Å; F541-F545 HydrophobicContact CE1-CG 4.08Å; F541-F545 HydrophobicContact CZ-CB 4.36Å; F541-F545 AromaticContact CZ-CD2 3.8Å; F541-F545 HydrophobicContact CZ-CD2 3.8Å; F541-F545 HydrophobicContact CZ-CE2 4.34Å; F541-F545 HydrophobicContact CZ-CG 4.17Å; F541-F545 WeakPolarHBondContact O-CB 3.43Å; F541-F545 PolarHBondContact O-N 3.49Å; F541-I577 HydrophobicContact CZ-CD1 4.49Å; F541-I605 HydrophobicContact CE2-CG2 4.17Å; F541-L609 HydrophobicContact CD2-CB 4.13Å; F541-L609 HydrophobicContact CD2-CD1 3.73Å; F541-L609 HydrophobicContact CE2-CD1 4.39Å
542	F	93.2	Very high	93.2	Very high	99 Å²	99	62 Å²	62	43%	0.434	33%	0.331	S	S	.	.	H	α-helix	trans	-64.7	-32.7	-178.1	-80.5	-60.7	0	0	0	113.1	A538 I539 F545 L546 F574	A538-F542 WeakPolarHBondContact O-CB 3.23Å; A538-F542 WeakPolarHBondContact O-CD2 3.49Å; A538-F542 PolarHBondContact O-N 2.91Å; I539-F542 PolarHBondContact O-N 2.94Å; F542-F545 HydrophobicContact CD1-CD1 4.43Å; F542-L546 VanDerWaalsContact O-CB 3.25Å; F542-L546 WeakPolarHBondContact O-CB 3.4Å; F542-L546 WeakPolarHBondContact O-CG 3.44Å; F542-L546 PolarHBondContact O-N 3.46Å; F542-F574 HydrophobicContact CE1-CZ 4.4Å
543	I	94.4	Very high	93.6	Very high	112 Å²	112	58.3 Å²	58.3	57%	0.574	31%	0.313	S	S	*	.	H	α-helix	trans	-61.7	-49	173.8	-70.1	163.3	0	0	0	110.7	I539 M540 F541 A547	I539-I543 HydrophobicContact CG2-CD1 4.02Å; I539-I543 VanDerWaalsContact O-CG1 3.3Å; I539-I543 WeakPolarHBondContact O-CG1 3.45Å; I539-I543 PolarHBondContact O-N 3.47Å; M540-I543 PolarHBondContact O-N 3.46Å; F541-I543 VanDerWaalsContact C-N 3.32Å; F541-I543 PolarHBondContact O-N 3.43Å; I543-A547 WeakPolarHBondContact O-CB 3.36Å; I543-A547 PolarHBondContact O-N 3.17Å
544	I	93.9	Very high	93.7	Very high	60 Å²	60	59.9 Å²	59.9	31%	0.308	32%	0.321	S	S	.	.	H	α-helix	trans	-66.1	-45.6	178.9	-64.5	170.7	0	0	0	110.4	M540 F541 A547 Y548 I605 L609	M540-I544 PolarHBondContact O-N 3.48Å; F541-I544 PolarHBondContact O-N 3.03Å; I544-A547 WeakPolarHBondContact O-CB 3.31Å; I544-A547 PolarHBondContact O-N 2.96Å; I544-Y548 HydrophobicContact CG2-CD2 3.84Å; I544-Y548 HydrophobicContact CG2-CE2 3.78Å; I544-Y548 WeakPolarHBondContact O-CD2 3.23Å; I544-Y548 PolarHBondContact O-N 3.16Å; I544-I605 HydrophobicContact CG2-CD1 4.08Å; I544-L609 HydrophobicContact CB-CD1 4.44Å; I544-L609 HydrophobicContact CD1-CD1 4.17Å; I544-L609 HydrophobicContact CD1-CD2 4.33Å; I544-L609 HydrophobicContact CG2-CD1 4.34Å
545	F	94.1	Very high	93.8	Very high	1 Å²	1	60 Å²	60	0%	0.004	32%	0.322	C	S	.	.	H	α-helix	trans	-59.5	-50.3	-179.6	-172.7	-100.8	0	0	0	111.8	F541 F542 A547 Y548 A549 V570 Q573 F574 I577 F601	F541-F545 HydrophobicContact CD1-CB 4.45Å; F541-F545 HydrophobicContact CE1-CB 4.13Å; F541-F545 HydrophobicContact CE1-CD2 4.17Å; F541-F545 HydrophobicContact CE1-CG 4.08Å; F541-F545 HydrophobicContact CZ-CB 4.36Å; F541-F545 AromaticContact CZ-CD2 3.8Å; F541-F545 HydrophobicContact CZ-CD2 3.8Å; F541-F545 HydrophobicContact CZ-CE2 4.34Å; F541-F545 HydrophobicContact CZ-CG 4.17Å; F541-F545 WeakPolarHBondContact O-CB 3.43Å; F541-F545 PolarHBondContact O-N 3.49Å; F542-F545 HydrophobicContact CD1-CD1 4.43Å; F545-A547 VanDerWaalsContact C-N 3.33Å; F545-A547 PolarHBondContact O-N 3.46Å; F545-Y548 PolarHBondContact O-N 3.32Å; F545-A549 PolarHBondContact O-N 3.45Å; F545-V570 HydrophobicContact CE1-CG1 4.22Å; F545-Q573 HydrophobicContact CE1-CB 4.47Å; F545-Q573 HydrophobicContact CE2-CB 3.6Å; F545-Q573 HydrophobicContact CZ-CB 3.54Å; F545-Q573 PolarHBondContact O-OE1 2.81Å; F545-F574 HydrophobicContact CE1-CD2 4.07Å; F545-F574 HydrophobicContact CE1-CE1 4.41Å; F545-F574 AromaticContact CE1-CE2 3.52Å; F545-F574 HydrophobicContact CE1-CE2 3.52Å; F545-F574 AromaticContact CE1-CZ 3.72Å; F545-F574 HydrophobicContact CE1-CZ 3.72Å; F545-F574 HydrophobicContact CE2-CD1 4.47Å; F545-F574 HydrophobicContact CE2-CE1 4.37Å; F545-F574 HydrophobicContact CE2-CZ 4.45Å; F545-F574 HydrophobicContact CZ-CD1 4.05Å; F545-F574 AromaticContact CZ-CD2 3.65Å; F545-F574 HydrophobicContact CZ-CD2 3.65Å; F545-F574 AromaticContact CZ-CE1 3.92Å; F545-F574 HydrophobicContact CZ-CE1 3.92Å; F545-F574 AromaticContact CZ-CE2 3.51Å; F545-F574 HydrophobicContact CZ-CE2 3.51Å; F545-F574 AromaticContact CZ-CG 3.91Å; F545-F574 HydrophobicContact CZ-CG 3.91Å; F545-F574 AromaticContact CZ-CZ 3.66Å; F545-F574 HydrophobicContact CZ-CZ 3.66Å; F545-I577 HydrophobicContact CD2-CD1 4.38Å; F545-I577 HydrophobicContact CE2-CD1 3.74Å; F545-F601 HydrophobicContact CD2-CE2 4.37Å; F545-F601 HydrophobicContact CE2-CE2 4.46Å; F545-F601 HydrophobicContact CE2-CZ 4.27Å
546	L	95.4	Very high	94	Very high	76 Å²	76	56 Å²	56	40%	0.398	30%	0.298	S	S	.	.	H	α-helix	trans	-66.9	-31.2	177	-66.6	172.5	0	0	0	112.9	F542 A549 Q550 F566 V570	F542-L546 VanDerWaalsContact O-CB 3.25Å; F542-L546 WeakPolarHBondContact O-CB 3.4Å; F542-L546 WeakPolarHBondContact O-CG 3.44Å; F542-L546 PolarHBondContact O-N 3.46Å; L546-A549 WeakPolarHBondContact O-CB 3.34Å; L546-A549 PolarHBondContact O-N 3.38Å; L546-Q550 WeakPolarHBondContact O-CB 3.49Å; L546-Q550 PolarHBondContact O-N 2.91Å; L546-F566 HydrophobicContact CD2-CZ 4.08Å; L546-V570 HydrophobicContact CD2-CG2 4.05Å
547	A	96.5	Very high	94.1	Very high	61 Å²	61	55 Å²	55	50%	0.504	29%	0.288	S	S	.	.	H	α-helix	trans	-64.2	-44.2	172.8	0	0	0	0	0	111.7	I543 I544 F545 A549 Q550 L551	I543-A547 WeakPolarHBondContact O-CB 3.36Å; I543-A547 PolarHBondContact O-N 3.17Å; I544-A547 WeakPolarHBondContact O-CB 3.31Å; I544-A547 PolarHBondContact O-N 2.96Å; F545-A547 VanDerWaalsContact C-N 3.33Å; F545-A547 PolarHBondContact O-N 3.46Å; A547-A549 VanDerWaalsContact C-N 3.33Å; A547-Q550 PolarHBondContact O-N 2.99Å; A547-L551 WeakPolarHBondContact O-CB 2.88Å; A547-L551 PolarHBondContact O-N 3.42Å
548	Y	95.5	Very high	94.1	Very high	34 Å²	34	60.3 Å²	60.3	13%	0.133	32%	0.321	C	S	.	.	H	α-helix	trans	-65.1	-35.3	170.7	-81.1	-77.4	0	0	0	111.9	I544 F545 L551 A552 Q573 Y597 F601 F604	I544-Y548 HydrophobicContact CG2-CD2 3.84Å; I544-Y548 HydrophobicContact CG2-CE2 3.78Å; I544-Y548 WeakPolarHBondContact O-CD2 3.23Å; I544-Y548 PolarHBondContact O-N 3.16Å; F545-Y548 PolarHBondContact O-N 3.32Å; Y548-L551 HydrophobicContact CD1-CD2 4.34Å; Y548-L551 PolarHBondContact O-N 3.17Å; Y548-A552 WeakPolarHBondContact O-CB 3.36Å; Y548-A552 PolarHBondContact O-N 2.93Å; Y548-Q573 VanDerWaalsContact CB-NE2 3.3Å; Y548-Q573 PolarHBondContact O-NE2 3.13Å; Y548-Y597 AromaticContact CD1-CD2 3.96Å; Y548-Y597 HydrophobicContact CD1-CD2 3.96Å; Y548-Y597 AromaticContact CD1-CE2 3.76Å; Y548-Y597 HydrophobicContact CD1-CE2 3.76Å; Y548-Y597 HydrophobicContact CG-CE2 4.46Å; Y548-F601 HydrophobicContact CD1-CB 4.3Å; Y548-F601 HydrophobicContact CD1-CD2 4.18Å; Y548-F601 HydrophobicContact CD2-CD2 4.23Å; Y548-F601 HydrophobicContact CE1-CB 4.31Å; Y548-F601 AromaticContact CG-CD2 3.88Å; Y548-F601 HydrophobicContact CG-CD2 3.88Å; Y548-F604 WeakPolarHBondContact OH-CD2 3.42Å
549	A	96	Very high	94.1	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-64.3	-43	178.7	0	0	0	0	0	111.4	F545 L546 A547 A552 Y553 F566 V570 Q573	F545-A549 PolarHBondContact O-N 3.45Å; L546-A549 WeakPolarHBondContact O-CB 3.34Å; L546-A549 PolarHBondContact O-N 3.38Å; A547-A549 VanDerWaalsContact C-N 3.33Å; A549-A552 PolarHBondContact O-N 3.47Å; A549-Y553 WeakPolarHBondContact O-CB 3.47Å; A549-Y553 PolarHBondContact O-N 3.37Å; A549-F566 HydrophobicContact CB-CE2 4.13Å; A549-V570 HydrophobicContact CB-CG2 3.82Å; A549-Q573 VanDerWaalsContact CA-NE2 3.32Å
550	Q	96.1	Very high	94.1	Very high	87 Å²	87	61.2 Å²	61.2	41%	0.407	32%	0.319	S	S	.	.	H	α-helix	trans	-64.8	-41.5	174.8	-170.5	66.7	22.7	0	0	111.5	L546 A547 L554 F566	L546-Q550 WeakPolarHBondContact O-CB 3.49Å; L546-Q550 PolarHBondContact O-N 2.91Å; A547-Q550 PolarHBondContact O-N 2.99Å; Q550-L554 HydrophobicContact CG-CD1 4.22Å; Q550-L554 WeakPolarHBondContact O-CB 3.3Å; Q550-L554 VanDerWaalsContact O-CG 3.29Å; Q550-L554 WeakPolarHBondContact O-CG 3.48Å; Q550-L554 PolarHBondContact O-N 3.08Å; Q550-F566 HydrophobicContact CB-CE2 4.33Å; Q550-F566 VanDerWaalsContact OE1-CE2 3.24Å
551	L	94.8	Very high	94	Very high	73 Å²	73	61.1 Å²	61.1	38%	0.382	32%	0.321	S	S	.	.	H	α-helix	trans	-60.9	-47.6	174.5	179.1	63	0	0	0	111.2	A547 Y548 L554 V555 Y597	A547-L551 WeakPolarHBondContact O-CB 2.88Å; A547-L551 PolarHBondContact O-N 3.42Å; Y548-L551 HydrophobicContact CD1-CD2 4.34Å; Y548-L551 PolarHBondContact O-N 3.17Å; L551-L554 PolarHBondContact O-N 3.3Å; L551-V555 HydrophobicContact CD1-CG2 3.99Å; L551-V555 WeakPolarHBondContact O-CB 3.19Å; L551-V555 VanDerWaalsContact O-CG2 3.26Å; L551-V555 WeakPolarHBondContact O-CG2 3.42Å; L551-V555 PolarHBondContact O-N 3.4Å; L551-Y597 HydrophobicContact CD2-CD2 4.1Å; L551-Y597 HydrophobicContact CG-CD2 4.43Å
552	A	94.7	Very high	94	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-63.2	-43.3	179.3	0	0	0	0	0	112.2	Y548 A549 L554 V555 F556 F563 Y597	Y548-A552 WeakPolarHBondContact O-CB 3.36Å; Y548-A552 PolarHBondContact O-N 2.93Å; A549-A552 PolarHBondContact O-N 3.47Å; A552-L554 PolarHBondContact O-N 3.07Å; A552-V555 PolarHBondContact O-N 2.96Å; A552-F556 HydrophobicContact CB-CD2 4.08Å; A552-F556 HydrophobicContact CB-CE2 4.45Å; A552-F556 WeakPolarHBondContact O-CD2 3.34Å; A552-F556 PolarHBondContact O-N 3.34Å; A552-F563 HydrophobicContact CB-CD1 3.66Å; A552-F563 HydrophobicContact CB-CE1 3.64Å; A552-F563 HydrophobicContact CB-CZ 4.49Å; A552-Y597 HydrophobicContact CB-CE1 4.42Å; A552-Y597 HydrophobicContact CB-CE2 3.82Å
553	Y	95.8	Very high	94	Very high	92 Å²	92	57.2 Å²	57.2	36%	0.361	31%	0.306	S	S	.	.	H	α-helix	trans	-59.5	-45	175.8	179	-114.6	0	0	0	112.1	A549 G557 F563 F566	A549-Y553 WeakPolarHBondContact O-CB 3.47Å; A549-Y553 PolarHBondContact O-N 3.37Å; Y553-G557 WeakPolarHBondContact O-CA 3.24Å; Y553-G557 PolarHBondContact O-N 3.49Å; Y553-G557 VanDerWaalsContact O-N 3.09Å; Y553-F563 WeakPolarHBondContact CD2-O 3.33Å; Y553-F566 HydrophobicContact CG-CB 4.43Å
554	L	94.9	Very high	93.9	Very high	122 Å²	122	54.2 Å²	54.2	64%	0.639	29%	0.294	S	S	*	.	H	α-helix	trans	-71.6	-29.4	-179.9	-70	172.9	0	0	0	113.8	Q550 L551 A552	Q550-L554 HydrophobicContact CG-CD1 4.22Å; Q550-L554 WeakPolarHBondContact O-CB 3.3Å; Q550-L554 VanDerWaalsContact O-CG 3.29Å; Q550-L554 WeakPolarHBondContact O-CG 3.48Å; Q550-L554 PolarHBondContact O-N 3.08Å; L551-L554 PolarHBondContact O-N 3.3Å; A552-L554 PolarHBondContact O-N 3.07Å
555	V	94	Very high	93.8	Very high	33 Å²	33	54.6 Å²	54.6	20%	0.2	30%	0.3	C	S	.	.	H	α-helix	trans	-90	-48	-177.9	176.3	0	0	0	0	112.3	L551 A552 L593	L551-V555 HydrophobicContact CD1-CG2 3.99Å; L551-V555 WeakPolarHBondContact O-CB 3.19Å; L551-V555 VanDerWaalsContact O-CG2 3.26Å; L551-V555 WeakPolarHBondContact O-CG2 3.42Å; L551-V555 PolarHBondContact O-N 3.4Å; A552-V555 PolarHBondContact O-N 2.96Å; V555-L593 HydrophobicContact CB-CD2 4.33Å; V555-L593 HydrophobicContact CG1-CB 4.38Å; V555-L593 HydrophobicContact CG1-CD2 3.73Å; V555-L593 HydrophobicContact CG1-CG 4.1Å; V555-L593 HydrophobicContact CG2-CD2 3.53Å; V555-L593 HydrophobicContact CG2-CG 4.35Å
556	F	94.5	Very high	93.7	Very high	1 Å²	1	58.4 Å²	58.4	0%	0.004	32%	0.316	C	S	.	.	H	α-helix	trans	-105.4	-16.8	-170.4	-49.4	-68.4	0	0	0	113.6	A552 T558 Q559 V560 F563 I586 A589 N590 Y597	A552-F556 HydrophobicContact CB-CD2 4.08Å; A552-F556 HydrophobicContact CB-CE2 4.45Å; A552-F556 WeakPolarHBondContact O-CD2 3.34Å; A552-F556 PolarHBondContact O-N 3.34Å; F556-T558 PolarHBondContact O-N 2.92Å; F556-Q559 PolarHBondContact O-N 3.26Å; F556-V560 HydrophobicContact CB-CB 4.29Å; F556-V560 HydrophobicContact CB-CG2 4.18Å; F556-V560 PolarHBondContact O-N 2.87Å; F556-F563 HydrophobicContact CB-CB 3.97Å; F556-F563 HydrophobicContact CB-CD2 3.69Å; F556-F563 HydrophobicContact CB-CE2 4.47Å; F556-F563 HydrophobicContact CB-CG 3.97Å; F556-F563 HydrophobicContact CD2-CD2 4.3Å; F556-F563 HydrophobicContact CD2-CE2 4.4Å; F556-F563 HydrophobicContact CG-CD2 4.26Å; F556-I586 HydrophobicContact CD1-CG2 4.37Å; F556-I586 HydrophobicContact CE1-CG2 3.85Å; F556-I586 HydrophobicContact CZ-CG2 3.99Å; F556-A589 HydrophobicContact CD1-CB 4.1Å; F556-N590 HydrophobicContact CE1-CB 4.29Å; F556-Y597 AromaticContact CE2-CD1 3.64Å; F556-Y597 HydrophobicContact CE2-CD1 3.64Å; F556-Y597 HydrophobicContact CE2-CD2 4.35Å; F556-Y597 HydrophobicContact CE2-CE1 4.13Å; F556-Y597 AromaticContact CE2-CG 3.79Å; F556-Y597 HydrophobicContact CE2-CG 3.79Å; F556-Y597 HydrophobicContact CZ-CD1 4.09Å; F556-Y597 HydrophobicContact CZ-CG 4.17Å
557	G	93.3	Very high	93.6	Very high	19 Å²	19	61.2 Å²	61.2	20%	0.196	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-8.2	-171.7	0	0	0	0	0	116.1	Y553 F563	Y553-G557 WeakPolarHBondContact O-CA 3.24Å; Y553-G557 PolarHBondContact O-N 3.49Å; Y553-G557 VanDerWaalsContact O-N 3.09Å; G557-F563 WeakPolarHBondContact CA-O 3.1Å
558	T	91.5	Very high	93.4	Very high	122 Å²	122	59.5 Å²	59.5	75%	0.748	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-16.2	171.9	53.9	0	0	0	0	114.1	F556	F556-T558 PolarHBondContact O-N 2.92Å
559	Q	91.3	Very high	93.3	Very high	145 Å²	145	57.9 Å²	57.9	68%	0.678	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119	-38.9	-174	-60	-65.7	-6.1	0	0	112.7	F556 A589	F556-Q559 PolarHBondContact O-N 3.26Å; Q559-A589 HydrophobicContact CB-CB 3.78Å; Q559-A589 HydrophobicContact CG-CB 4.27Å
560	V	93.1	Very high	93.3	Very high	7 Å²	7	59.2 Å²	59.2	4%	0.042	32%	0.315	C	S	.	.			trans	-107.5	123.3	-170.5	-178.2	0	0	0	0	110.3	F556 D562 F563 S564 E585 A589	F556-V560 HydrophobicContact CB-CB 4.29Å; F556-V560 HydrophobicContact CB-CG2 4.18Å; F556-V560 PolarHBondContact O-N 2.87Å; V560-D562 VanDerWaalsContact C-N 3.29Å; V560-D562 HydrophobicContact CG1-CB 4.17Å; V560-D562 PolarHBondContact O-N 3.27Å; V560-F563 HydrophobicContact CB-CD2 3.98Å; V560-F563 HydrophobicContact CG1-CD2 3.73Å; V560-F563 HydrophobicContact CG1-CE2 4.31Å; V560-F563 CarbonylContact O-C 3.51Å; V560-F563 PolarHBondContact O-N 2.94Å; V560-S564 PolarHBondContact O-N 2.77Å; V560-E585 HydrophobicContact CG1-CB 4.3Å; V560-E585 HydrophobicContact CG2-CB 4.33Å; V560-E585 WeakPolarHBondContact CG2-O 3.32Å; V560-A589 HydrophobicContact CG2-CB 3.65Å
561	N	89.1	Confident	93.2	Very high	109 Å²	109	60.7 Å²	60.7	58%	0.583	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-62.1	-35.9	-176.3	-177.2	46.3	0	0	0	112.8	F563 S564	N561-F563 PolarHBondContact O-N 3.08Å; N561-F563 VanDerWaalsContact O-N 3.17Å; N561-S564 WeakPolarHBondContact O-CB 3.36Å; N561-S564 PolarHBondContact O-N 3.48Å; N561-S564 PolarHBondContact O-OG 3.38Å
562	D	92.5	Very high	93.1	Very high	46 Å²	46	57.8 Å²	57.8	25%	0.246	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-64.3	-16	176.6	-86.3	7	0	0	0	113.7	V560 A568 T572 R575	V560-D562 VanDerWaalsContact C-N 3.29Å; V560-D562 HydrophobicContact CG1-CB 4.17Å; V560-D562 PolarHBondContact O-N 3.27Å; D562-A568 CarbonylContact O-C 3.48Å; D562-T572 HydrophobicContact CB-CG2 3.86Å; D562-T572 PolarHBondContact O-OG1 3.31Å; D562-R575 IonicContact OD1-NH1 2.66Å; D562-R575 IonicContact OD2-CZ 3.2Å; D562-R575 IonicContact OD2-NH1 2.86Å; D562-R575 PolarHBondContact OD2-NH1 3.38Å
563	F	93.6	Very high	93	Very high	2 Å²	2	57.8 Å²	57.8	1%	0.009	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-112.5	7.1	173	-62	-73.2	0	0	0	113.3	A552 Y553 F556 G557 V560 N561 T565 S569 T572 I576 I586	A552-F563 HydrophobicContact CB-CD1 3.66Å; A552-F563 HydrophobicContact CB-CE1 3.64Å; A552-F563 HydrophobicContact CB-CZ 4.49Å; Y553-F563 WeakPolarHBondContact CD2-O 3.33Å; F556-F563 HydrophobicContact CB-CB 3.97Å; F556-F563 HydrophobicContact CB-CD2 3.69Å; F556-F563 HydrophobicContact CB-CE2 4.47Å; F556-F563 HydrophobicContact CB-CG 3.97Å; F556-F563 HydrophobicContact CD2-CD2 4.3Å; F556-F563 HydrophobicContact CD2-CE2 4.4Å; F556-F563 HydrophobicContact CG-CD2 4.26Å; G557-F563 WeakPolarHBondContact CA-O 3.1Å; V560-F563 HydrophobicContact CB-CD2 3.98Å; V560-F563 HydrophobicContact CG1-CD2 3.73Å; V560-F563 HydrophobicContact CG1-CE2 4.31Å; V560-F563 CarbonylContact O-C 3.51Å; V560-F563 PolarHBondContact O-N 2.94Å; N561-F563 PolarHBondContact O-N 3.08Å; N561-F563 VanDerWaalsContact O-N 3.17Å; F563-T565 PolarHBondContact O-N 2.93Å; F563-T565 VanDerWaalsContact O-N 3.08Å; F563-S569 WeakPolarHBondContact CA-OG 3.32Å; F563-S569 PolarHBondContact O-OG 3.19Å; F563-T572 HydrophobicContact CD1-CG2 4.45Å; F563-T572 HydrophobicContact CE1-CG2 3.73Å; F563-T572 HydrophobicContact CE2-CG2 4.03Å; F563-T572 HydrophobicContact CZ-CG2 3.49Å; F563-T572 VanDerWaalsContact CZ-CG2 3.49Å; F563-I576 HydrophobicContact CZ-CD1 4.34Å; F563-I586 HydrophobicContact CE2-CD1 4.01Å; F563-I586 HydrophobicContact CE2-CG1 4.07Å; F563-I586 HydrophobicContact CZ-CD1 4.37Å
564	S	90.7	Very high	92.9	Very high	48 Å²	48	57.3 Å²	57.3	34%	0.336	31%	0.305	S	S	.	.	S	Bend	trans	-57.3	-26.5	-174.1	58.2	0	0	0	0	115.5	V560 N561	V560-S564 PolarHBondContact O-N 2.77Å; N561-S564 WeakPolarHBondContact O-CB 3.36Å; N561-S564 PolarHBondContact O-N 3.48Å; N561-S564 PolarHBondContact O-OG 3.38Å
565	T	92.3	Very high	92.8	Very high	69 Å²	69	55.2 Å²	55.2	42%	0.423	29%	0.289	S	S	.	.	S	Bend	trans	-130.7	155.2	173.6	65.7	0	0	0	0	110	F563 Q567 A568 S569	F563-T565 PolarHBondContact O-N 2.93Å; F563-T565 VanDerWaalsContact O-N 3.08Å; T565-Q567 PolarHBondContact O-N 3.48Å; T565-A568 PolarHBondContact O-N 3.17Å; T565-A568 VanDerWaalsContact OG1-CB 3.23Å; T565-A568 WeakPolarHBondContact OG1-CB 3.23Å; T565-A568 PolarHBondContact OG1-N 3.39Å; T565-S569 WeakPolarHBondContact O-CB 3.31Å; T565-S569 PolarHBondContact O-N 3.17Å; T565-S569 PolarHBondContact O-OG 3.03Å
566	F	93.2	Very high	92.7	Very high	81 Å²	81	54.1 Å²	54.1	36%	0.355	28%	0.282	S	S	.	.	H	α-helix	trans	-58	-38	174.9	-179.4	-103.1	0	0	0	112.1	L546 A549 Q550 Y553 S569 V570	L546-F566 HydrophobicContact CD2-CZ 4.08Å; A549-F566 HydrophobicContact CB-CE2 4.13Å; Q550-F566 HydrophobicContact CB-CE2 4.33Å; Q550-F566 VanDerWaalsContact OE1-CE2 3.24Å; Y553-F566 HydrophobicContact CG-CB 4.43Å; F566-S569 WeakPolarHBondContact O-CB 3.49Å; F566-S569 PolarHBondContact O-N 3.08Å; F566-V570 HydrophobicContact CE1-CG2 4.25Å; F566-V570 HydrophobicContact CZ-CG2 4.3Å; F566-V570 WeakPolarHBondContact O-CG2 3.37Å; F566-V570 PolarHBondContact O-N 3.22Å; F566-V570 VanDerWaalsContact O-N 3.1Å
567	Q	92.9	Very high	92.6	Very high	135 Å²	135	56 Å²	56	63%	0.631	29%	0.292	S	S	*	.	H	α-helix	trans	-67.9	-42.6	176.4	-175.7	177.2	1.6	0	0	112.4	T565 S569 V570 F571	T565-Q567 PolarHBondContact O-N 3.48Å; Q567-S569 VanDerWaalsContact C-N 3.34Å; Q567-V570 PolarHBondContact O-N 3.13Å; Q567-F571 HydrophobicContact CG-CD2 4.12Å; Q567-F571 HydrophobicContact CG-CE2 3.64Å; Q567-F571 HydrophobicContact CG-CZ 4.46Å; Q567-F571 VanDerWaalsContact O-CD2 3.23Å; Q567-F571 WeakPolarHBondContact O-CD2 3.49Å; Q567-F571 PolarHBondContact O-N 2.9Å
568	A	91.7	Very high	92.5	Very high	25 Å²	25	62.2 Å²	62.2	21%	0.207	32%	0.319	C	S	.	.	H	α-helix	trans	-60.8	-45	173.1	0	0	0	0	0	110.9	D562 T565 V570 F571 T572	D562-A568 CarbonylContact O-C 3.48Å; T565-A568 PolarHBondContact O-N 3.17Å; T565-A568 VanDerWaalsContact OG1-CB 3.23Å; T565-A568 WeakPolarHBondContact OG1-CB 3.23Å; T565-A568 PolarHBondContact OG1-N 3.39Å; A568-V570 VanDerWaalsContact C-N 3.3Å; A568-V570 PolarHBondContact O-N 3.41Å; A568-F571 CarbonylContact O-C 3.14Å; A568-F571 WeakPolarHBondContact O-CA 3.2Å; A568-F571 PolarHBondContact O-N 3.16Å; A568-T572 PolarHBondContact O-N 2.78Å; A568-T572 PolarHBondContact O-OG1 2.62Å; A568-T572 VanDerWaalsContact O-OG1 3.06Å
569	S	94.1	Very high	92.4	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-54.3	-44	177.6	-56.6	0	0	0	0	112.5	F563 T565 F566 Q567 T572 Q573	F563-S569 WeakPolarHBondContact CA-OG 3.32Å; F563-S569 PolarHBondContact O-OG 3.19Å; T565-S569 WeakPolarHBondContact O-CB 3.31Å; T565-S569 PolarHBondContact O-N 3.17Å; T565-S569 PolarHBondContact O-OG 3.03Å; F566-S569 WeakPolarHBondContact O-CB 3.49Å; F566-S569 PolarHBondContact O-N 3.08Å; Q567-S569 VanDerWaalsContact C-N 3.34Å; S569-T572 PolarHBondContact O-N 2.88Å; S569-Q573 WeakPolarHBondContact O-CG 3.48Å; S569-Q573 PolarHBondContact O-N 3.11Å
570	V	94.8	Very high	92.4	Very high	27 Å²	27	56 Å²	56	16%	0.164	30%	0.299	C	S	.	.	H	α-helix	trans	-61.3	-42.4	174.9	162.9	0	0	0	0	112	F545 L546 A549 F566 Q567 A568 F574	F545-V570 HydrophobicContact CE1-CG1 4.22Å; L546-V570 HydrophobicContact CD2-CG2 4.05Å; A549-V570 HydrophobicContact CB-CG2 3.82Å; F566-V570 HydrophobicContact CE1-CG2 4.25Å; F566-V570 HydrophobicContact CZ-CG2 4.3Å; F566-V570 WeakPolarHBondContact O-CG2 3.37Å; F566-V570 PolarHBondContact O-N 3.22Å; F566-V570 VanDerWaalsContact O-N 3.1Å; Q567-V570 PolarHBondContact O-N 3.13Å; A568-V570 VanDerWaalsContact C-N 3.3Å; A568-V570 PolarHBondContact O-N 3.41Å; V570-F574 HydrophobicContact CG1-CE2 4.28Å; V570-F574 VanDerWaalsContact O-CD2 3.27Å; V570-F574 WeakPolarHBondContact O-CD2 3.48Å; V570-F574 PolarHBondContact O-N 2.86Å
571	F	94.3	Very high	92.1	Very high	119 Å²	119	59.5 Å²	59.5	52%	0.522	31%	0.313	S	S	.	.	H	α-helix	trans	-71.2	-39.9	176.7	-69.1	-53.2	0	0	0	112.8	Q567 A568 Q573 F574 R575	Q567-F571 HydrophobicContact CG-CD2 4.12Å; Q567-F571 HydrophobicContact CG-CE2 3.64Å; Q567-F571 HydrophobicContact CG-CZ 4.46Å; Q567-F571 VanDerWaalsContact O-CD2 3.23Å; Q567-F571 WeakPolarHBondContact O-CD2 3.49Å; Q567-F571 PolarHBondContact O-N 2.9Å; A568-F571 CarbonylContact O-C 3.14Å; A568-F571 WeakPolarHBondContact O-CA 3.2Å; A568-F571 PolarHBondContact O-N 3.16Å; F571-Q573 VanDerWaalsContact C-N 3.26Å; F571-Q573 PolarHBondContact O-N 3.04Å; F571-F574 WeakPolarHBondContact O-CB 3.1Å; F571-F574 PolarHBondContact O-N 3.3Å; F571-R575 PolarHBondContact O-N 2.89Å
572	T	93.4	Very high	92.1	Very high	11 Å²	11	58 Å²	58	7%	0.067	31%	0.306	C	S	.	.	H	α-helix	trans	-60.5	-36.3	176.6	-60.5	0	0	0	0	111.3	D562 F563 A568 S569 F574 R575 I576	D562-T572 HydrophobicContact CB-CG2 3.86Å; D562-T572 PolarHBondContact O-OG1 3.31Å; F563-T572 HydrophobicContact CD1-CG2 4.45Å; F563-T572 HydrophobicContact CE1-CG2 3.73Å; F563-T572 HydrophobicContact CE2-CG2 4.03Å; F563-T572 HydrophobicContact CZ-CG2 3.49Å; F563-T572 VanDerWaalsContact CZ-CG2 3.49Å; A568-T572 PolarHBondContact O-N 2.78Å; A568-T572 PolarHBondContact O-OG1 2.62Å; A568-T572 VanDerWaalsContact O-OG1 3.06Å; S569-T572 PolarHBondContact O-N 2.88Å; T572-F574 PolarHBondContact O-N 2.83Å; T572-R575 WeakPolarHBondContact O-CB 3.34Å; T572-R575 PolarHBondContact O-N 2.87Å; T572-R575 VanDerWaalsContact O-N 3.16Å; T572-I576 HydrophobicContact CG2-CD1 4.43Å; T572-I576 WeakPolarHBondContact O-CG1 3.49Å; T572-I576 PolarHBondContact O-N 3.27Å
573	Q	93.1	Very high	92	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-64.5	-37.7	171.7	-75.4	-176.4	-24.6	0	0	114.1	F545 Y548 A549 S569 F571 R575 I576 I577 Y597 F601	F545-Q573 HydrophobicContact CE1-CB 4.47Å; F545-Q573 HydrophobicContact CE2-CB 3.6Å; F545-Q573 HydrophobicContact CZ-CB 3.54Å; F545-Q573 PolarHBondContact O-OE1 2.81Å; Y548-Q573 VanDerWaalsContact CB-NE2 3.3Å; Y548-Q573 PolarHBondContact O-NE2 3.13Å; A549-Q573 VanDerWaalsContact CA-NE2 3.32Å; S569-Q573 WeakPolarHBondContact O-CG 3.48Å; S569-Q573 PolarHBondContact O-N 3.11Å; F571-Q573 VanDerWaalsContact C-N 3.26Å; F571-Q573 PolarHBondContact O-N 3.04Å; Q573-R575 VanDerWaalsContact C-N 3.33Å; Q573-I576 PolarHBondContact O-N 3.09Å; Q573-I577 WeakPolarHBondContact O-CG1 3.27Å; Q573-I577 PolarHBondContact O-N 3.24Å; Q573-I577 VanDerWaalsContact O-N 3.09Å; Q573-Y597 PolarHBondContact NE2-OH 2.87Å; Q573-F601 HydrophobicContact CB-CE2 4.15Å; Q573-F601 HydrophobicContact CB-CZ 3.84Å; Q573-F601 HydrophobicContact CG-CE2 3.9Å; Q573-F601 HydrophobicContact CG-CZ 3.98Å
574	F	92.9	Very high	91.9	Very high	82 Å²	82	61.8 Å²	61.8	36%	0.36	33%	0.328	S	S	.	.	H	α-helix	trans	-65.7	-36.6	170.8	-76.3	-66.4	0	0	0	111.8	F542 F545 V570 F571 T572 I577 L578	F542-F574 HydrophobicContact CE1-CZ 4.4Å; F545-F574 HydrophobicContact CE1-CD2 4.07Å; F545-F574 HydrophobicContact CE1-CE1 4.41Å; F545-F574 AromaticContact CE1-CE2 3.52Å; F545-F574 HydrophobicContact CE1-CE2 3.52Å; F545-F574 AromaticContact CE1-CZ 3.72Å; F545-F574 HydrophobicContact CE1-CZ 3.72Å; F545-F574 HydrophobicContact CE2-CD1 4.47Å; F545-F574 HydrophobicContact CE2-CE1 4.37Å; F545-F574 HydrophobicContact CE2-CZ 4.45Å; F545-F574 HydrophobicContact CZ-CD1 4.05Å; F545-F574 AromaticContact CZ-CD2 3.65Å; F545-F574 HydrophobicContact CZ-CD2 3.65Å; F545-F574 AromaticContact CZ-CE1 3.92Å; F545-F574 HydrophobicContact CZ-CE1 3.92Å; F545-F574 AromaticContact CZ-CE2 3.51Å; F545-F574 HydrophobicContact CZ-CE2 3.51Å; F545-F574 AromaticContact CZ-CG 3.91Å; F545-F574 HydrophobicContact CZ-CG 3.91Å; F545-F574 AromaticContact CZ-CZ 3.66Å; F545-F574 HydrophobicContact CZ-CZ 3.66Å; V570-F574 HydrophobicContact CG1-CE2 4.28Å; V570-F574 VanDerWaalsContact O-CD2 3.27Å; V570-F574 WeakPolarHBondContact O-CD2 3.48Å; V570-F574 PolarHBondContact O-N 2.86Å; F571-F574 WeakPolarHBondContact O-CB 3.1Å; F571-F574 PolarHBondContact O-N 3.3Å; T572-F574 PolarHBondContact O-N 2.83Å; F574-I577 HydrophobicContact CD1-CD1 4.31Å; F574-I577 PolarHBondContact O-N 3.22Å; F574-L578 WeakPolarHBondContact O-CG 3.1Å; F574-L578 PolarHBondContact O-N 2.88Å; F574-L578 VanDerWaalsContact O-N 3.1Å
575	R	92.8	Very high	91.9	Very high	79 Å²	79	63.7 Å²	63.7	30%	0.298	33%	0.332	S	S	.	.	H	α-helix	trans	-63.1	-42.5	173.4	-65.1	174.3	62.5	-146.3	-9.2	111.8	D562 F571 T572 Q573 I577 L578 G579 D580	D562-R575 IonicContact OD1-NH1 2.66Å; D562-R575 IonicContact OD2-CZ 3.2Å; D562-R575 IonicContact OD2-NH1 2.86Å; D562-R575 PolarHBondContact OD2-NH1 3.38Å; F571-R575 PolarHBondContact O-N 2.89Å; T572-R575 WeakPolarHBondContact O-CB 3.34Å; T572-R575 PolarHBondContact O-N 2.87Å; T572-R575 VanDerWaalsContact O-N 3.16Å; Q573-R575 VanDerWaalsContact C-N 3.33Å; R575-I577 VanDerWaalsContact C-N 3.35Å; R575-I577 PolarHBondContact O-N 2.89Å; R575-L578 CarbonylContact O-C 3.59Å; R575-L578 WeakPolarHBondContact O-CA 3.48Å; R575-L578 WeakPolarHBondContact O-CB 3.49Å; R575-L578 PolarHBondContact O-N 3.47Å; R575-G579 PolarHBondContact O-N 3.21Å; R575-D580 CarbonylContact C-O 3.2Å; R575-D580 HydrophobicContact CB-CB 4.33Å; R575-D580 VanDerWaalsContact CB-O 3.23Å; R575-D580 WeakPolarHBondContact CB-O 3.22Å; R575-D580 IonicContact CZ-OD2 2.73Å; R575-D580 VanDerWaalsContact CZ-OD2 3.25Å; R575-D580 IonicContact NE-OD2 2.81Å; R575-D580 PolarHBondContact NE-OD2 3.43Å; R575-D580 VanDerWaalsContact NH2-CG 3.31Å; R575-D580 IonicContact NH2-OD1 3.62Å; R575-D580 PolarHBondContact NH2-OD1 2.99Å; R575-D580 VanDerWaalsContact NH2-OD1 3.13Å; R575-D580 IonicContact NH2-OD2 3.65Å; R575-D580 PolarHBondContact NH2-OD2 2.89Å; R575-D580 PolarHBondContact O-N 3.15Å
576	I	92.4	Very high	91.9	Very high	9 Å²	9	60.6 Å²	60.6	5%	0.046	31%	0.313	C	S	.	.	H	α-helix	trans	-58.1	-43.7	172.9	-65.5	162.5	0	0	0	111.4	F563 T572 Q573 L578 G579 F581 F598 F601 V602	F563-I576 HydrophobicContact CZ-CD1 4.34Å; T572-I576 HydrophobicContact CG2-CD1 4.43Å; T572-I576 WeakPolarHBondContact O-CG1 3.49Å; T572-I576 PolarHBondContact O-N 3.27Å; Q573-I576 PolarHBondContact O-N 3.09Å; I576-L578 VanDerWaalsContact C-N 3.26Å; I576-L578 PolarHBondContact O-N 3.07Å; I576-G579 PolarHBondContact O-N 2.78Å; I576-F581 HydrophobicContact CG1-CB 3.75Å; I576-F581 HydrophobicContact CG1-CG 4.37Å; I576-F581 HydrophobicContact CG2-CD1 4.45Å; I576-F598 HydrophobicContact CG2-CD2 4.46Å; I576-F598 HydrophobicContact CG2-CE2 3.88Å; I576-F601 HydrophobicContact CB-CE1 4.02Å; I576-F601 HydrophobicContact CG2-CD1 3.84Å; I576-F601 HydrophobicContact CG2-CE1 3.61Å; I576-V602 HydrophobicContact CG2-CG2 4.42Å
577	I	90.9	Very high	91.9	Very high	42 Å²	42	61.2 Å²	61.2	22%	0.215	32%	0.316	C	S	.	.	H	α-helix	trans	-62	-34.2	176.3	-66.2	166.5	0	0	0	111.8	F541 F545 Q573 F574 R575 G579 F601 I605 M610	F541-I577 HydrophobicContact CZ-CD1 4.49Å; F545-I577 HydrophobicContact CD2-CD1 4.38Å; F545-I577 HydrophobicContact CE2-CD1 3.74Å; Q573-I577 WeakPolarHBondContact O-CG1 3.27Å; Q573-I577 PolarHBondContact O-N 3.24Å; Q573-I577 VanDerWaalsContact O-N 3.09Å; F574-I577 HydrophobicContact CD1-CD1 4.31Å; F574-I577 PolarHBondContact O-N 3.22Å; R575-I577 VanDerWaalsContact C-N 3.35Å; R575-I577 PolarHBondContact O-N 2.89Å; I577-G579 VanDerWaalsContact C-N 3.3Å; I577-F601 HydrophobicContact CD1-CZ 4.34Å; I577-F601 HydrophobicContact CG1-CE1 4.15Å; I577-F601 HydrophobicContact CG1-CZ 4.13Å; I577-I605 HydrophobicContact CD1-CG2 3.68Å; I577-I605 HydrophobicContact CG1-CG2 3.83Å; I577-M610 HydrophobicContact CG2-CE 3.91Å
578	L	91.2	Very high	91.9	Very high	148 Å²	148	62.7 Å²	62.7	78%	0.775	32%	0.324	S	S	*	.	H	α-helix	trans	-79.1	-9.9	176.1	-66.2	171.1	0	0	0	113.6	F574 R575 I576	F574-L578 WeakPolarHBondContact O-CG 3.1Å; F574-L578 PolarHBondContact O-N 2.88Å; F574-L578 VanDerWaalsContact O-N 3.1Å; R575-L578 CarbonylContact O-C 3.59Å; R575-L578 WeakPolarHBondContact O-CA 3.48Å; R575-L578 WeakPolarHBondContact O-CB 3.49Å; R575-L578 PolarHBondContact O-N 3.47Å; I576-L578 VanDerWaalsContact C-N 3.26Å; I576-L578 PolarHBondContact O-N 3.07Å
579	G	90	Very high	91.9	Very high	52 Å²	52	62.9 Å²	62.9	54%	0.536	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.8	13.1	-177.7	0	0	0	0	0	115.3	R575 I576 I577	R575-G579 PolarHBondContact O-N 3.21Å; I576-G579 PolarHBondContact O-N 2.78Å; I577-G579 VanDerWaalsContact C-N 3.3Å
580	D	91.2	Very high	91.9	Very high	85 Å²	85	65.3 Å²	65.3	46%	0.455	34%	0.338	S	S	.	.			trans	-102.9	101.5	174.4	171.2	32.4	0	0	0	109.5	R575	R575-D580 CarbonylContact C-O 3.2Å; R575-D580 HydrophobicContact CB-CB 4.33Å; R575-D580 VanDerWaalsContact CB-O 3.23Å; R575-D580 WeakPolarHBondContact CB-O 3.22Å; R575-D580 IonicContact CZ-OD2 2.73Å; R575-D580 VanDerWaalsContact CZ-OD2 3.25Å; R575-D580 IonicContact NE-OD2 2.81Å; R575-D580 PolarHBondContact NE-OD2 3.43Å; R575-D580 VanDerWaalsContact NH2-CG 3.31Å; R575-D580 IonicContact NH2-OD1 3.62Å; R575-D580 PolarHBondContact NH2-OD1 2.99Å; R575-D580 VanDerWaalsContact NH2-OD1 3.13Å; R575-D580 IonicContact NH2-OD2 3.65Å; R575-D580 PolarHBondContact NH2-OD2 2.89Å; R575-D580 PolarHBondContact O-N 3.15Å
581	F	87.7	Confident	91.8	Very high	80 Å²	80	68.4 Å²	68.4	35%	0.351	36%	0.359	S	S	.	.			trans	-157.4	142.2	179.7	57.6	-89	0	0	0	111	I576 F583 F598	I576-F581 HydrophobicContact CG1-CB 3.75Å; I576-F581 HydrophobicContact CG1-CG 4.37Å; I576-F581 HydrophobicContact CG2-CD1 4.45Å; F581-F583 HydrophobicContact CD2-CB 4.07Å; F581-F583 HydrophobicContact CE2-CB 4.09Å; F581-F598 HydrophobicContact CD1-CE2 4.28Å; F581-F598 HydrophobicContact CD1-CZ 4.49Å; F581-F598 AromaticContact CD2-CE2 3.63Å; F581-F598 HydrophobicContact CD2-CE2 3.63Å; F581-F598 AromaticContact CD2-CZ 3.93Å; F581-F598 HydrophobicContact CD2-CZ 3.93Å; F581-F598 HydrophobicContact CE1-CE2 4.25Å; F581-F598 HydrophobicContact CE1-CZ 4.01Å; F581-F598 HydrophobicContact CE2-CE1 4.34Å; F581-F598 AromaticContact CE2-CE2 3.61Å; F581-F598 HydrophobicContact CE2-CE2 3.61Å; F581-F598 AromaticContact CE2-CZ 3.38Å; F581-F598 HydrophobicContact CE2-CZ 3.38Å; F581-F598 AromaticContact CG-CE2 4Å; F581-F598 HydrophobicContact CG-CE2 4Å; F581-F598 HydrophobicContact CG-CZ 4.47Å; F581-F598 HydrophobicContact CZ-CE1 4.47Å; F581-F598 AromaticContact CZ-CE2 3.95Å; F581-F598 HydrophobicContact CZ-CE2 3.95Å; F581-F598 AromaticContact CZ-CZ 3.44Å; F581-F598 HydrophobicContact CZ-CZ 3.44Å; F581-F598 VanDerWaalsContact CZ-CZ 3.44Å
582	D	89.1	Confident	91.8	Very high	79 Å²	79	68 Å²	68	42%	0.422	37%	0.366	S	S	.	.			trans	-92.8	105.9	164.4	-158.7	-34.2	0	0	0	109	S584 E585	D582-S584 VanDerWaalsContact C-N 3.29Å; D582-S584 WeakPolarHBondContact OD1-CA 3.45Å; D582-S584 WeakPolarHBondContact OD1-CB 3.39Å; D582-S584 PolarHBondContact OD1-N 3.45Å; D582-S584 PolarHBondContact OD1-OG 3.42Å; D582-E585 HydrophobicContact CB-CG 4.38Å
583	F	90.4	Very high	91.8	Very high	60 Å²	60	70.7 Å²	70.7	26%	0.263	38%	0.379	S	S	.	.	H	α-helix	trans	-72.8	-25.8	177.1	-177.7	-101.3	0	0	0	112	F581 I586 E587 P595 F598	F581-F583 HydrophobicContact CD2-CB 4.07Å; F581-F583 HydrophobicContact CE2-CB 4.09Å; F583-I586 PolarHBondContact O-N 3.34Å; F583-E587 HydrophobicContact CD1-CB 4.48Å; F583-E587 HydrophobicContact CE1-CB 4.12Å; F583-E587 WeakPolarHBondContact CE1-OE2 3.05Å; F583-E587 PolarHBondContact O-N 2.89Å; F583-P595 HydrophobicContact CZ-CB 4.15Å; F583-P595 HydrophobicContact CZ-CG 4.04Å; F583-F598 HydrophobicContact CD2-CB 4.29Å; F583-F598 AromaticContact CD2-CD1 3.96Å; F583-F598 HydrophobicContact CD2-CD1 3.96Å; F583-F598 HydrophobicContact CD2-CD2 4.16Å; F583-F598 HydrophobicContact CD2-CE1 4.37Å; F583-F598 AromaticContact CD2-CG 3.85Å; F583-F598 HydrophobicContact CD2-CG 3.85Å; F583-F598 HydrophobicContact CE2-CB 3.89Å; F583-F598 AromaticContact CE2-CD1 3.81Å; F583-F598 HydrophobicContact CE2-CD1 3.81Å; F583-F598 AromaticContact CE2-CG 3.82Å; F583-F598 HydrophobicContact CE2-CG 3.82Å
584	S	91.1	Very high	91.8	Very high	66 Å²	66	70.7 Å²	70.7	46%	0.462	38%	0.379	S	S	.	.	H	α-helix	trans	-63.7	-47.4	-176.1	-22.9	0	0	0	0	110.6	D582 I586 E587 E588	D582-S584 VanDerWaalsContact C-N 3.29Å; D582-S584 WeakPolarHBondContact OD1-CA 3.45Å; D582-S584 WeakPolarHBondContact OD1-CB 3.39Å; D582-S584 PolarHBondContact OD1-N 3.45Å; D582-S584 PolarHBondContact OD1-OG 3.42Å; S584-I586 PolarHBondContact O-N 3.21Å; S584-E587 PolarHBondContact O-N 3.3Å; S584-E588 WeakPolarHBondContact O-CB 3.46Å; S584-E588 WeakPolarHBondContact O-CG 3.31Å; S584-E588 PolarHBondContact O-N 3.08Å
585	E	90.8	Very high	91.9	Very high	89 Å²	89	68.3 Å²	68.3	42%	0.416	37%	0.372	S	S	.	.	H	α-helix	trans	-61.5	-33	176.7	-62.5	-166.4	168	0	0	112.3	V560 D582 A589	V560-E585 HydrophobicContact CG1-CB 4.3Å; V560-E585 HydrophobicContact CG2-CB 4.33Å; V560-E585 WeakPolarHBondContact CG2-O 3.32Å; D582-E585 HydrophobicContact CB-CG 4.38Å; E585-A589 VanDerWaalsContact O-CB 3.22Å; E585-A589 WeakPolarHBondContact O-CB 3.44Å; E585-A589 PolarHBondContact O-N 3.03Å
586	I	92.2	Very high	92	Very high	4 Å²	4	68.3 Å²	68.3	2%	0.021	38%	0.38	C	S	.	.	H	α-helix	trans	-74	-40.7	179.4	-61	174.5	0	0	0	111.2	F556 F563 F583 S584 N590	F556-I586 HydrophobicContact CD1-CG2 4.37Å; F556-I586 HydrophobicContact CE1-CG2 3.85Å; F556-I586 HydrophobicContact CZ-CG2 3.99Å; F563-I586 HydrophobicContact CE2-CD1 4.01Å; F563-I586 HydrophobicContact CE2-CG1 4.07Å; F563-I586 HydrophobicContact CZ-CD1 4.37Å; F583-I586 PolarHBondContact O-N 3.34Å; S584-I586 PolarHBondContact O-N 3.21Å; I586-N590 PolarHBondContact O-N 3.22Å
587	E	93.1	Very high	92.1	Very high	93 Å²	93	68 Å²	68	44%	0.435	38%	0.379	S	S	.	.	H	α-helix	trans	-69.2	-42.6	176.2	-173.3	173.9	-171.9	0	0	111.6	F583 S584 N590 P591 P595	F583-E587 HydrophobicContact CD1-CB 4.48Å; F583-E587 HydrophobicContact CE1-CB 4.12Å; F583-E587 WeakPolarHBondContact CE1-OE2 3.05Å; F583-E587 PolarHBondContact O-N 2.89Å; S584-E587 PolarHBondContact O-N 3.3Å; E587-N590 CarbonylContact O-C 3.51Å; E587-N590 PolarHBondContact O-N 2.82Å; E587-P591 VanDerWaalsContact O-CA 3.3Å; E587-P591 WeakPolarHBondContact O-CA 3.46Å; E587-P591 VanDerWaalsContact O-N 3.13Å; E587-P595 HydrophobicContact CG-CG 4.41Å
588	E	92.5	Very high	92.3	Very high	167 Å²	167	67.5 Å²	67.5	78%	0.78	38%	0.375	S	S	*	.	H	α-helix	trans	-64.5	-38.4	176.2	-73.5	-174.4	-177.5	0	0	112.4	S584	S584-E588 WeakPolarHBondContact O-CB 3.46Å; S584-E588 WeakPolarHBondContact O-CG 3.31Å; S584-E588 PolarHBondContact O-N 3.08Å
589	A	92.9	Very high	92.4	Very high	29 Å²	29	64.8 Å²	64.8	24%	0.24	37%	0.365	C	S	.	.	H	α-helix	trans	-67	-37.9	177.6	0	0	0	0	0	113.3	F556 Q559 V560 E585	F556-A589 HydrophobicContact CD1-CB 4.1Å; Q559-A589 HydrophobicContact CB-CB 3.78Å; Q559-A589 HydrophobicContact CG-CB 4.27Å; V560-A589 HydrophobicContact CG2-CB 3.65Å; E585-A589 VanDerWaalsContact O-CB 3.22Å; E585-A589 WeakPolarHBondContact O-CB 3.44Å; E585-A589 PolarHBondContact O-N 3.03Å
590	N	92.7	Very high	92.6	Very high	51 Å²	51	64.6 Å²	64.6	27%	0.273	35%	0.353	S	S	.	.			trans	-154.8	106.5	170.3	-167.8	-44.1	0	0	0	111.9	F556 I586 E587 V592 L593 G594	F556-N590 HydrophobicContact CE1-CB 4.29Å; I586-N590 PolarHBondContact O-N 3.22Å; E587-N590 CarbonylContact O-C 3.51Å; E587-N590 PolarHBondContact O-N 2.82Å; N590-V592 PolarHBondContact O-N 2.99Å; N590-V592 VanDerWaalsContact O-N 3.1Å; N590-V592 PolarHBondContact OD1-N 3.19Å; N590-L593 HydrophobicContact CB-CB 4.27Å; N590-L593 PolarHBondContact OD1-N 3.47Å; N590-G594 WeakPolarHBondContact O-CA 3.46Å; N590-G594 PolarHBondContact O-N 3.43Å
591	P	93.2	Very high	92.7	Very high	92 Å²	92	60.7 Å²	60.7	60%	0.597	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-12.8	-171.2	27.4	-36.3	0	0	0	114.3	E587	E587-P591 VanDerWaalsContact O-CA 3.3Å; E587-P591 WeakPolarHBondContact O-CA 3.46Å; E587-P591 VanDerWaalsContact O-N 3.13Å
592	V	93.6	Very high	93	Very high	111 Å²	111	58.9 Å²	58.9	67%	0.673	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	-51.9	176.4	-179.3	0	0	0	0	110.5	N590 V596	N590-V592 PolarHBondContact O-N 2.99Å; N590-V592 VanDerWaalsContact O-N 3.1Å; N590-V592 PolarHBondContact OD1-N 3.19Å; V592-V596 VanDerWaalsContact O-CG2 3.22Å; V592-V596 WeakPolarHBondContact O-CG2 3.49Å; V592-V596 PolarHBondContact O-N 3.39Å
593	L	93.3	Very high	93.1	Very high	67 Å²	67	60.4 Å²	60.4	35%	0.351	33%	0.331	S	S	.	.	H	α-helix	trans	-79.7	-25.7	-173	-162.8	54.1	0	0	0	112.5	V555 N590 Y597	V555-L593 HydrophobicContact CB-CD2 4.33Å; V555-L593 HydrophobicContact CG1-CB 4.38Å; V555-L593 HydrophobicContact CG1-CD2 3.73Å; V555-L593 HydrophobicContact CG1-CG 4.1Å; V555-L593 HydrophobicContact CG2-CD2 3.53Å; V555-L593 HydrophobicContact CG2-CG 4.35Å; N590-L593 HydrophobicContact CB-CB 4.27Å; N590-L593 PolarHBondContact OD1-N 3.47Å; L593-Y597 WeakPolarHBondContact O-CB 3.45Å; L593-Y597 PolarHBondContact O-N 2.94Å
594	G	93.4	Very high	93.2	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-59	-63.6	173.5	0	0	0	0	0	112.9	N590 V596 Y597 F598	N590-G594 WeakPolarHBondContact O-CA 3.46Å; N590-G594 PolarHBondContact O-N 3.43Å; G594-V596 VanDerWaalsContact C-N 3.29Å; G594-V596 PolarHBondContact O-N 3.36Å; G594-Y597 PolarHBondContact O-N 2.93Å; G594-F598 WeakPolarHBondContact O-CB 3.48Å; G594-F598 PolarHBondContact O-N 3.4Å
595	P	94.7	Very high	93.2	Very high	32 Å²	32	58.8 Å²	58.8	21%	0.208	32%	0.316	C	S	.	.	H	α-helix	trans	-59.5	-36.3	178.1	-25.8	35.1	0	0	0	113.4	F583 E587 T599	F583-P595 HydrophobicContact CZ-CB 4.15Å; F583-P595 HydrophobicContact CZ-CG 4.04Å; E587-P595 HydrophobicContact CG-CG 4.41Å; P595-T599 VanDerWaalsContact O-CB 3.23Å; P595-T599 WeakPolarHBondContact O-CB 3.35Å; P595-T599 PolarHBondContact O-N 2.94Å; P595-T599 PolarHBondContact O-OG1 3.32Å
596	V	95.7	Very high	92.9	Very high	78 Å²	78	59.8 Å²	59.8	47%	0.473	32%	0.319	S	S	.	.	H	α-helix	trans	-66.6	-48	176.8	170.2	0	0	0	0	111.4	V592 G594 T600	V592-V596 VanDerWaalsContact O-CG2 3.22Å; V592-V596 WeakPolarHBondContact O-CG2 3.49Å; V592-V596 PolarHBondContact O-N 3.39Å; G594-V596 VanDerWaalsContact C-N 3.29Å; G594-V596 PolarHBondContact O-N 3.36Å; V596-T600 WeakPolarHBondContact O-CB 3.44Å; V596-T600 WeakPolarHBondContact O-CG2 3.4Å; V596-T600 PolarHBondContact O-N 3.46Å; V596-T600 PolarHBondContact O-OG1 3.24Å
597	Y	95.1	Very high	92.7	Very high	4 Å²	4	65 Å²	65	2%	0.016	34%	0.342	C	S	.	.	H	α-helix	trans	-57.7	-50.4	175.1	163.7	-96.1	0	0	0	110.6	Y548 L551 A552 F556 Q573 L593 G594 T600 F601	Y548-Y597 AromaticContact CD1-CD2 3.96Å; Y548-Y597 HydrophobicContact CD1-CD2 3.96Å; Y548-Y597 AromaticContact CD1-CE2 3.76Å; Y548-Y597 HydrophobicContact CD1-CE2 3.76Å; Y548-Y597 HydrophobicContact CG-CE2 4.46Å; L551-Y597 HydrophobicContact CD2-CD2 4.1Å; L551-Y597 HydrophobicContact CG-CD2 4.43Å; A552-Y597 HydrophobicContact CB-CE1 4.42Å; A552-Y597 HydrophobicContact CB-CE2 3.82Å; F556-Y597 AromaticContact CE2-CD1 3.64Å; F556-Y597 HydrophobicContact CE2-CD1 3.64Å; F556-Y597 HydrophobicContact CE2-CD2 4.35Å; F556-Y597 HydrophobicContact CE2-CE1 4.13Å; F556-Y597 AromaticContact CE2-CG 3.79Å; F556-Y597 HydrophobicContact CE2-CG 3.79Å; F556-Y597 HydrophobicContact CZ-CD1 4.09Å; F556-Y597 HydrophobicContact CZ-CG 4.17Å; Q573-Y597 PolarHBondContact NE2-OH 2.87Å; L593-Y597 WeakPolarHBondContact O-CB 3.45Å; L593-Y597 PolarHBondContact O-N 2.94Å; G594-Y597 PolarHBondContact O-N 2.93Å; Y597-T600 PolarHBondContact O-N 3.2Å; Y597-T600 PolarHBondContact O-OG1 3.07Å; Y597-T600 VanDerWaalsContact O-OG1 3.13Å; Y597-F601 WeakPolarHBondContact O-CB 3.48Å; Y597-F601 PolarHBondContact O-N 3.32Å
598	F	93.9	Very high	92.6	Very high	31 Å²	31	64.1 Å²	64.1	14%	0.136	34%	0.339	C	S	.	.	H	α-helix	trans	-63.1	-48.4	-176.4	-178.2	-94	0	0	0	111.8	I576 F581 F583 G594 T600 F601 V602	I576-F598 HydrophobicContact CG2-CD2 4.46Å; I576-F598 HydrophobicContact CG2-CE2 3.88Å; F581-F598 HydrophobicContact CD1-CE2 4.28Å; F581-F598 HydrophobicContact CD1-CZ 4.49Å; F581-F598 AromaticContact CD2-CE2 3.63Å; F581-F598 HydrophobicContact CD2-CE2 3.63Å; F581-F598 AromaticContact CD2-CZ 3.93Å; F581-F598 HydrophobicContact CD2-CZ 3.93Å; F581-F598 HydrophobicContact CE1-CE2 4.25Å; F581-F598 HydrophobicContact CE1-CZ 4.01Å; F581-F598 HydrophobicContact CE2-CE1 4.34Å; F581-F598 AromaticContact CE2-CE2 3.61Å; F581-F598 HydrophobicContact CE2-CE2 3.61Å; F581-F598 AromaticContact CE2-CZ 3.38Å; F581-F598 HydrophobicContact CE2-CZ 3.38Å; F581-F598 AromaticContact CG-CE2 4Å; F581-F598 HydrophobicContact CG-CE2 4Å; F581-F598 HydrophobicContact CG-CZ 4.47Å; F581-F598 HydrophobicContact CZ-CE1 4.47Å; F581-F598 AromaticContact CZ-CE2 3.95Å; F581-F598 HydrophobicContact CZ-CE2 3.95Å; F581-F598 AromaticContact CZ-CZ 3.44Å; F581-F598 HydrophobicContact CZ-CZ 3.44Å; F581-F598 VanDerWaalsContact CZ-CZ 3.44Å; F583-F598 HydrophobicContact CD2-CB 4.29Å; F583-F598 AromaticContact CD2-CD1 3.96Å; F583-F598 HydrophobicContact CD2-CD1 3.96Å; F583-F598 HydrophobicContact CD2-CD2 4.16Å; F583-F598 HydrophobicContact CD2-CE1 4.37Å; F583-F598 AromaticContact CD2-CG 3.85Å; F583-F598 HydrophobicContact CD2-CG 3.85Å; F583-F598 HydrophobicContact CE2-CB 3.89Å; F583-F598 AromaticContact CE2-CD1 3.81Å; F583-F598 HydrophobicContact CE2-CD1 3.81Å; F583-F598 AromaticContact CE2-CG 3.82Å; F583-F598 HydrophobicContact CE2-CG 3.82Å; G594-F598 WeakPolarHBondContact O-CB 3.48Å; G594-F598 PolarHBondContact O-N 3.4Å; F598-T600 PolarHBondContact O-N 3.35Å; F598-F601 PolarHBondContact O-N 3.36Å; F598-V602 HydrophobicContact CD1-CG2 4.39Å; F598-V602 HydrophobicContact CE1-CG2 3.97Å; F598-V602 HydrophobicContact CE2-CG2 4.16Å; F598-V602 HydrophobicContact CZ-CG2 3.82Å; F598-V602 WeakPolarHBondContact O-CG2 3.26Å; F598-V602 PolarHBondContact O-N 2.68Å
599	T	93.1	Very high	92.3	Very high	90 Å²	90	56.9 Å²	56.9	55%	0.552	31%	0.306	S	S	*	.	H	α-helix	trans	-63.5	-43	-179.4	-55.5	0	0	0	0	111.9	P595 F603	P595-T599 VanDerWaalsContact O-CB 3.23Å; P595-T599 WeakPolarHBondContact O-CB 3.35Å; P595-T599 PolarHBondContact O-N 2.94Å; P595-T599 PolarHBondContact O-OG1 3.32Å; T599-F603 VanDerWaalsContact O-CB 3.29Å; T599-F603 WeakPolarHBondContact O-CB 3.26Å; T599-F603 PolarHBondContact O-N 3.31Å
600	T	94.8	Very high	92.1	Very high	49 Å²	49	58.6 Å²	58.6	30%	0.301	31%	0.31	S	S	.	.	H	α-helix	trans	-70.3	-42.2	178.7	54.1	0	0	0	0	111.7	V596 Y597 F598 F603 F604	V596-T600 WeakPolarHBondContact O-CB 3.44Å; V596-T600 WeakPolarHBondContact O-CG2 3.4Å; V596-T600 PolarHBondContact O-N 3.46Å; V596-T600 PolarHBondContact O-OG1 3.24Å; Y597-T600 PolarHBondContact O-N 3.2Å; Y597-T600 PolarHBondContact O-OG1 3.07Å; Y597-T600 VanDerWaalsContact O-OG1 3.13Å; F598-T600 PolarHBondContact O-N 3.35Å; T600-F603 PolarHBondContact O-N 3.46Å; T600-F604 VanDerWaalsContact O-CD2 3.3Å; T600-F604 WeakPolarHBondContact O-CD2 3.37Å; T600-F604 PolarHBondContact O-N 2.94Å
601	F	94.2	Very high	91.9	Very high	2 Å²	2	60.4 Å²	60.4	1%	0.009	32%	0.319	C	S	.	.	H	α-helix	trans	-57.7	-52.1	174.6	178.2	-92.9	0	0	0	111.4	F545 Y548 Q573 I576 I577 Y597 F598 F603 F604 I605	F545-F601 HydrophobicContact CD2-CE2 4.37Å; F545-F601 HydrophobicContact CE2-CE2 4.46Å; F545-F601 HydrophobicContact CE2-CZ 4.27Å; Y548-F601 HydrophobicContact CD1-CB 4.3Å; Y548-F601 HydrophobicContact CD1-CD2 4.18Å; Y548-F601 HydrophobicContact CD2-CD2 4.23Å; Y548-F601 HydrophobicContact CE1-CB 4.31Å; Y548-F601 AromaticContact CG-CD2 3.88Å; Y548-F601 HydrophobicContact CG-CD2 3.88Å; Q573-F601 HydrophobicContact CB-CE2 4.15Å; Q573-F601 HydrophobicContact CB-CZ 3.84Å; Q573-F601 HydrophobicContact CG-CE2 3.9Å; Q573-F601 HydrophobicContact CG-CZ 3.98Å; I576-F601 HydrophobicContact CB-CE1 4.02Å; I576-F601 HydrophobicContact CG2-CD1 3.84Å; I576-F601 HydrophobicContact CG2-CE1 3.61Å; I577-F601 HydrophobicContact CD1-CZ 4.34Å; I577-F601 HydrophobicContact CG1-CE1 4.15Å; I577-F601 HydrophobicContact CG1-CZ 4.13Å; Y597-F601 WeakPolarHBondContact O-CB 3.48Å; Y597-F601 PolarHBondContact O-N 3.32Å; F598-F601 PolarHBondContact O-N 3.36Å; F601-F603 VanDerWaalsContact C-N 3.33Å; F601-F603 PolarHBondContact O-N 3.49Å; F601-F604 PolarHBondContact O-N 2.72Å; F601-I605 HydrophobicContact CD1-CG1 4.44Å; F601-I605 HydrophobicContact CD2-CG1 3.75Å; F601-I605 HydrophobicContact CE1-CG1 4.32Å; F601-I605 HydrophobicContact CE2-CD1 4.39Å; F601-I605 HydrophobicContact CE2-CG1 3.63Å; F601-I605 HydrophobicContact CG-CG1 4.17Å; F601-I605 HydrophobicContact CZ-CB 4.49Å; F601-I605 HydrophobicContact CZ-CG1 3.93Å; F601-I605 VanDerWaalsContact O-CB 3.25Å; F601-I605 WeakPolarHBondContact O-CB 3.16Å; F601-I605 VanDerWaalsContact O-CG1 3.28Å; F601-I605 WeakPolarHBondContact O-CG1 3.32Å; F601-I605 PolarHBondContact O-N 2.84Å
602	V	92.7	Very high	91.8	Very high	43 Å²	43	59.8 Å²	59.8	26%	0.261	31%	0.309	S	S	.	.	H	α-helix	trans	-61	-42.9	177.4	173.4	0	0	0	0	110.7	I576 F598 F606 F607	I576-V602 HydrophobicContact CG2-CG2 4.42Å; F598-V602 HydrophobicContact CD1-CG2 4.39Å; F598-V602 HydrophobicContact CE1-CG2 3.97Å; F598-V602 HydrophobicContact CE2-CG2 4.16Å; F598-V602 HydrophobicContact CZ-CG2 3.82Å; F598-V602 WeakPolarHBondContact O-CG2 3.26Å; F598-V602 PolarHBondContact O-N 2.68Å; V602-F606 HydrophobicContact CG1-CB 4.4Å; V602-F606 WeakPolarHBondContact O-CB 3.32Å; V602-F606 PolarHBondContact O-N 2.9Å; V602-F607 HydrophobicContact CG1-CE2 4.36Å
603	F	92.8	Very high	91.5	Very high	111 Å²	111	58.1 Å²	58.1	49%	0.487	29%	0.293	S	S	.	.	I	π-helix	trans	-59	-54.3	177.8	-175	-102	0	0	0	112.8	T599 T600 F601 F607 I608	T599-F603 VanDerWaalsContact O-CB 3.29Å; T599-F603 WeakPolarHBondContact O-CB 3.26Å; T599-F603 PolarHBondContact O-N 3.31Å; T600-F603 PolarHBondContact O-N 3.46Å; F601-F603 VanDerWaalsContact C-N 3.33Å; F601-F603 PolarHBondContact O-N 3.49Å; F603-F607 HydrophobicContact CD2-CD2 4.39Å; F603-F607 WeakPolarHBondContact O-CB 3.3Å; F603-F607 PolarHBondContact O-N 3.17Å; F603-I608 HydrophobicContact CD1-CD1 4.41Å; F603-I608 HydrophobicContact CE1-CD1 3.93Å
604	F	91.8	Very high	91.4	Very high	88 Å²	88	59.5 Å²	59.5	39%	0.386	30%	0.3	S	S	.	.	I	π-helix	trans	-71.2	-46.6	-176.7	-80.5	-78.6	0	0	0	112.8	Y548 T600 F601 I608 L609	Y548-F604 WeakPolarHBondContact OH-CD2 3.42Å; T600-F604 VanDerWaalsContact O-CD2 3.3Å; T600-F604 WeakPolarHBondContact O-CD2 3.37Å; T600-F604 PolarHBondContact O-N 2.94Å; F601-F604 PolarHBondContact O-N 2.72Å; F604-I608 HydrophobicContact CD1-CD1 3.75Å; F604-I608 HydrophobicContact CE1-CD1 4.03Å; F604-I608 WeakPolarHBondContact O-CB 3.32Å; F604-I608 PolarHBondContact O-N 2.9Å; F604-L609 PolarHBondContact O-N 2.85Å
605	I	90.1	Very high	91.4	Very high	3 Å²	3	62.3 Å²	62.3	2%	0.015	32%	0.323	C	S	.	.	I	π-helix	trans	-73.9	-46.7	-174.7	-58.4	-55.8	0	0	0	111.3	F541 I544 I577 F601 L609 M610	F541-I605 HydrophobicContact CE2-CG2 4.17Å; I544-I605 HydrophobicContact CG2-CD1 4.08Å; I577-I605 HydrophobicContact CD1-CG2 3.68Å; I577-I605 HydrophobicContact CG1-CG2 3.83Å; F601-I605 HydrophobicContact CD1-CG1 4.44Å; F601-I605 HydrophobicContact CD2-CG1 3.75Å; F601-I605 HydrophobicContact CE1-CG1 4.32Å; F601-I605 HydrophobicContact CE2-CD1 4.39Å; F601-I605 HydrophobicContact CE2-CG1 3.63Å; F601-I605 HydrophobicContact CG-CG1 4.17Å; F601-I605 HydrophobicContact CZ-CB 4.49Å; F601-I605 HydrophobicContact CZ-CG1 3.93Å; F601-I605 VanDerWaalsContact O-CB 3.25Å; F601-I605 WeakPolarHBondContact O-CB 3.16Å; F601-I605 VanDerWaalsContact O-CG1 3.28Å; F601-I605 WeakPolarHBondContact O-CG1 3.32Å; F601-I605 PolarHBondContact O-N 2.84Å; I605-L609 HydrophobicContact CD1-CD1 3.66Å; I605-M610 PolarHBondContact O-N 3.29Å
606	F	85.9	Confident	91.3	Very high	110 Å²	110	62.4 Å²	62.4	48%	0.482	32%	0.322	S	S	.	.	I	π-helix	trans	-80.2	-54.3	-175.1	-167	-98.1	0	0	0	112	V602 M610	V602-F606 HydrophobicContact CG1-CB 4.4Å; V602-F606 WeakPolarHBondContact O-CB 3.32Å; V602-F606 PolarHBondContact O-N 2.9Å; F606-M610 VanDerWaalsContact O-CB 3.27Å; F606-M610 WeakPolarHBondContact O-CB 3.47Å
607	F	88.4	Confident	91.2	Very high	114 Å²	114	61.3 Å²	61.3	50%	0.5	31%	0.313	S	S	.	.	I	π-helix	trans	-80.8	-29.3	-172.2	-65.6	-90.5	0	0	0	114.1	V602 F603 N611	V602-F607 HydrophobicContact CG1-CE2 4.36Å; F603-F607 HydrophobicContact CD2-CD2 4.39Å; F603-F607 WeakPolarHBondContact O-CB 3.3Å; F603-F607 PolarHBondContact O-N 3.17Å; F607-N611 PolarHBondContact O-ND2 3.16Å
608	I	89.6	Confident	91	Very high	75 Å²	75	66 Å²	66	39%	0.385	34%	0.338	S	S	.	.	I	π-helix	trans	-96.7	-62.2	179.9	-55.8	177.8	0	0	0	110.3	F603 F604 M612	F603-I608 HydrophobicContact CD1-CD1 4.41Å; F603-I608 HydrophobicContact CE1-CD1 3.93Å; F604-I608 HydrophobicContact CD1-CD1 3.75Å; F604-I608 HydrophobicContact CE1-CD1 4.03Å; F604-I608 WeakPolarHBondContact O-CB 3.32Å; F604-I608 PolarHBondContact O-N 2.9Å; I608-M612 WeakPolarHBondContact O-CB 3.29Å; I608-M612 PolarHBondContact O-N 2.81Å
609	L	87.4	Confident	91	Very high	14 Å²	14	70.1 Å²	70.1	7%	0.073	36%	0.362	C	S	.	.	I	π-helix	trans	-71.5	-42.1	-169.6	-61	-179.9	0	0	0	113.5	F537 F541 I544 F604 I605 N611 M612 F613	F537-L609 HydrophobicContact CE2-CD2 3.75Å; F537-L609 HydrophobicContact CZ-CB 3.96Å; F537-L609 HydrophobicContact CZ-CD2 3.85Å; F537-L609 HydrophobicContact CZ-CG 4.48Å; F537-L609 WeakPolarHBondContact CZ-O 3.33Å; F541-L609 HydrophobicContact CD2-CB 4.13Å; F541-L609 HydrophobicContact CD2-CD1 3.73Å; F541-L609 HydrophobicContact CE2-CD1 4.39Å; I544-L609 HydrophobicContact CB-CD1 4.44Å; I544-L609 HydrophobicContact CD1-CD1 4.17Å; I544-L609 HydrophobicContact CD1-CD2 4.33Å; I544-L609 HydrophobicContact CG2-CD1 4.34Å; F604-L609 PolarHBondContact O-N 2.85Å; I605-L609 HydrophobicContact CD1-CD1 3.66Å; L609-N611 PolarHBondContact O-N 3.1Å; L609-M612 PolarHBondContact O-N 2.93Å; L609-F613 PolarHBondContact O-N 3.42Å
610	M	86.9	Confident	91	Very high	66 Å²	66	66.5 Å²	66.5	33%	0.325	34%	0.339	S	S	.	.	I	π-helix	trans	-65.6	-38.7	177.9	-161.4	66.9	71.2	0	0	112.3	I577 I605 F606 F613 L614	I577-M610 HydrophobicContact CG2-CE 3.91Å; I605-M610 PolarHBondContact O-N 3.29Å; F606-M610 VanDerWaalsContact O-CB 3.27Å; F606-M610 WeakPolarHBondContact O-CB 3.47Å; M610-F613 WeakPolarHBondContact O-CB 3.33Å; M610-F613 PolarHBondContact O-N 3.1Å; M610-L614 WeakPolarHBondContact O-CG 3.27Å; M610-L614 PolarHBondContact O-N 3.1Å; M610-L614 VanDerWaalsContact O-N 3.1Å
611	N	88.9	Confident	90.8	Very high	89 Å²	89	67.8 Å²	67.8	48%	0.476	34%	0.339	S	S	.	.	H	α-helix	trans	-69.6	-35	176.7	-73.6	-34.5	0	0	0	112.3	F607 L609 L614 A615	F607-N611 PolarHBondContact O-ND2 3.16Å; L609-N611 PolarHBondContact O-N 3.1Å; N611-L614 PolarHBondContact O-N 3.47Å; N611-A615 WeakPolarHBondContact O-CB 3.46Å; N611-A615 PolarHBondContact O-N 3.36Å
612	M	90.6	Very high	90.6	Very high	79 Å²	79	70.5 Å²	70.5	39%	0.389	36%	0.358	S	S	.	.	H	α-helix	trans	-66	-40.1	173.2	-174.7	177.4	160.5	0	0	112.1	F537 I608 L609 L614 A615 I616	F537-M612 HydrophobicContact CD2-CE 3.33Å; F537-M612 HydrophobicContact CD2-CG 4.31Å; F537-M612 HydrophobicContact CD2-SD 3.72Å; F537-M612 HydrophobicContact CE2-CB 4.23Å; F537-M612 HydrophobicContact CE2-CE 3.72Å; F537-M612 HydrophobicContact CE2-CG 3.95Å; F537-M612 HydrophobicContact CE2-SD 3.39Å; F537-M612 WeakPolarHBondContact CE2-SD 3.46Å; F537-M612 HydrophobicContact CG-CE 4.15Å; F537-M612 HydrophobicContact CZ-CB 4.14Å; F537-M612 HydrophobicContact CZ-CG 4.28Å; F537-M612 HydrophobicContact CZ-SD 4.23Å; I608-M612 WeakPolarHBondContact O-CB 3.29Å; I608-M612 PolarHBondContact O-N 2.81Å; L609-M612 PolarHBondContact O-N 2.93Å; M612-L614 PolarHBondContact O-N 3.09Å; M612-A615 PolarHBondContact O-N 3.03Å; M612-I616 HydrophobicContact CE-CD1 4.17Å; M612-I616 HydrophobicContact CG-CD1 4.35Å; M612-I616 WeakPolarHBondContact O-CG1 3.4Å; M612-I616 PolarHBondContact O-N 3.47Å; M612-I616 VanDerWaalsContact O-N 3.14Å
613	F	89.2	Confident	90.5	Very high	76 Å²	76	73.1 Å²	73.1	33%	0.333	37%	0.368	S	S	.	.	H	α-helix	trans	-56.8	-48.5	172.1	178.1	-89.8	0	0	0	111.7	L534 F537 L609 M610 A615 I616 I617	L534-F613 HydrophobicContact CD1-CD2 3.4Å; L534-F613 HydrophobicContact CD1-CE2 3.38Å; L534-F613 HydrophobicContact CD1-CZ 4.49Å; L534-F613 HydrophobicContact CD2-CE2 4.1Å; L534-F613 HydrophobicContact CG-CE2 4.37Å; F537-F613 HydrophobicContact CE1-CB 3.89Å; F537-F613 HydrophobicContact CE1-CD2 4.44Å; L609-F613 PolarHBondContact O-N 3.42Å; M610-F613 WeakPolarHBondContact O-CB 3.33Å; M610-F613 PolarHBondContact O-N 3.1Å; F613-A615 VanDerWaalsContact C-N 3.35Å; F613-A615 PolarHBondContact O-N 3.32Å; F613-I616 PolarHBondContact O-N 3.25Å; F613-I617 HydrophobicContact CD1-CD1 3.79Å; F613-I617 HydrophobicContact CE1-CD1 3.31Å; F613-I617 HydrophobicContact CE2-CD1 4.3Å; F613-I617 HydrophobicContact CG-CD1 4.45Å; F613-I617 HydrophobicContact CZ-CD1 3.61Å; F613-I617 WeakPolarHBondContact O-CG1 3.23Å; F613-I617 PolarHBondContact O-N 2.97Å
614	L	89.6	Confident	90.3	Very high	96 Å²	96	67.9 Å²	67.9	50%	0.503	35%	0.345	S	S	.	.	H	α-helix	trans	-63.8	-37.9	177.8	-69.3	172.9	0	0	0	112.4	M610 N611 M612 I617 N618	M610-L614 WeakPolarHBondContact O-CG 3.27Å; M610-L614 PolarHBondContact O-N 3.1Å; M610-L614 VanDerWaalsContact O-N 3.1Å; N611-L614 PolarHBondContact O-N 3.47Å; M612-L614 PolarHBondContact O-N 3.09Å; L614-I617 PolarHBondContact O-N 3.06Å; L614-N618 VanDerWaalsContact O-CB 3.32Å; L614-N618 WeakPolarHBondContact O-CB 3.41Å; L614-N618 PolarHBondContact O-N 2.95Å
615	A	93.1	Very high	90.1	Very high	58 Å²	58	69.3 Å²	69.3	48%	0.479	35%	0.351	S	S	.	.	H	α-helix	trans	-62.4	-47.1	177.8	0	0	0	0	0	112.3	N611 M612 F613 I617 N618 D619	N611-A615 WeakPolarHBondContact O-CB 3.46Å; N611-A615 PolarHBondContact O-N 3.36Å; M612-A615 PolarHBondContact O-N 3.03Å; F613-A615 VanDerWaalsContact C-N 3.35Å; F613-A615 PolarHBondContact O-N 3.32Å; A615-I617 VanDerWaalsContact C-N 3.32Å; A615-I617 PolarHBondContact O-N 3.43Å; A615-N618 PolarHBondContact O-N 2.97Å; A615-D619 WeakPolarHBondContact O-CB 3.46Å; A615-D619 PolarHBondContact O-N 2.97Å
616	I	93.6	Very high	90	Very high	34 Å²	34	71.7 Å²	71.7	17%	0.174	37%	0.371	C	S	.	.	H	α-helix	trans	-59.9	-42.7	178.3	-65.6	164.8	0	0	0	111.1	D533 F537 M612 F613 T620	D533-I616 HydrophobicContact CB-CG2 4.27Å; F537-I616 HydrophobicContact CB-CD1 3.92Å; F537-I616 HydrophobicContact CD1-CD1 4.35Å; F537-I616 HydrophobicContact CG-CD1 4.05Å; M612-I616 HydrophobicContact CE-CD1 4.17Å; M612-I616 HydrophobicContact CG-CD1 4.35Å; M612-I616 WeakPolarHBondContact O-CG1 3.4Å; M612-I616 PolarHBondContact O-N 3.47Å; M612-I616 VanDerWaalsContact O-N 3.14Å; F613-I616 PolarHBondContact O-N 3.25Å; I616-T620 WeakPolarHBondContact O-CG2 3.29Å; I616-T620 PolarHBondContact O-N 3.28Å; I616-T620 PolarHBondContact O-OG1 3.31Å
617	I	92.9	Very high	89.9	Confident	56 Å²	56	69.3 Å²	69.3	29%	0.287	36%	0.363	S	S	.	.	H	α-helix	trans	-68.5	-40.5	178.3	-66.3	174.1	0	0	0	111.2	F613 L614 A615 T620 Y621	F613-I617 HydrophobicContact CD1-CD1 3.79Å; F613-I617 HydrophobicContact CE1-CD1 3.31Å; F613-I617 HydrophobicContact CE2-CD1 4.3Å; F613-I617 HydrophobicContact CG-CD1 4.45Å; F613-I617 HydrophobicContact CZ-CD1 3.61Å; F613-I617 WeakPolarHBondContact O-CG1 3.23Å; F613-I617 PolarHBondContact O-N 2.97Å; L614-I617 PolarHBondContact O-N 3.06Å; A615-I617 VanDerWaalsContact C-N 3.32Å; A615-I617 PolarHBondContact O-N 3.43Å; I617-T620 PolarHBondContact O-OG1 3.23Å; I617-Y621 WeakPolarHBondContact O-CB 3.46Å; I617-Y621 PolarHBondContact O-N 3.25Å
618	N	92.3	Very high	89.4	Confident	102 Å²	102	65.2 Å²	65.2	55%	0.545	35%	0.346	S	S	.	.	H	α-helix	trans	-69.8	-37	-178.6	-173.7	51.4	0	0	0	113	L614 A615 S622	L614-N618 VanDerWaalsContact O-CB 3.32Å; L614-N618 WeakPolarHBondContact O-CB 3.41Å; L614-N618 PolarHBondContact O-N 2.95Å; A615-N618 PolarHBondContact O-N 2.97Å; N618-S622 WeakPolarHBondContact O-CB 3.46Å; N618-S622 PolarHBondContact O-N 3.29Å; N618-S622 PolarHBondContact O-OG 3Å
619	D	93.9	Very high	88.7	Confident	118 Å²	118	66.2 Å²	66.2	63%	0.631	36%	0.36	S	S	*	.	H	α-helix	trans	-65.3	-54.7	176.8	-171	50.4	0	0	0	111	A615 Y621 S622 E623	A615-D619 WeakPolarHBondContact O-CB 3.46Å; A615-D619 PolarHBondContact O-N 2.97Å; D619-Y621 VanDerWaalsContact C-N 3.31Å; D619-Y621 PolarHBondContact O-N 2.85Å; D619-S622 WeakPolarHBondContact O-CA 3.47Å; D619-S622 WeakPolarHBondContact O-CB 3.3Å; D619-S622 PolarHBondContact O-N 3.47Å; D619-E623 PolarHBondContact O-N 3.31Å
620	T	92.2	Very high	87.8	Confident	13 Å²	13	73.3 Å²	73.3	8%	0.08	39%	0.392	C	S	.	.	H	α-helix	trans	-62.3	-33.6	175.7	53.4	0	0	0	0	113.2	C530 I616 I617 S622 V624	C530-T620 HydrophobicContact CB-CG2 3.83Å; C530-T620 VanDerWaalsContact CB-OG1 3.24Å; C530-T620 WeakPolarHBondContact CB-OG1 3.41Å; I616-T620 WeakPolarHBondContact O-CG2 3.29Å; I616-T620 PolarHBondContact O-N 3.28Å; I616-T620 PolarHBondContact O-OG1 3.31Å; I617-T620 PolarHBondContact O-OG1 3.23Å; T620-S622 VanDerWaalsContact C-N 3.35Å; T620-V624 WeakPolarHBondContact O-CG2 3.3Å; T620-V624 PolarHBondContact O-N 2.04Å; T620-V624 VanDerWaalsContact O-N 3.11Å
621	Y	90.5	Very high	86.8	Confident	77 Å²	77	76.2 Å²	76.2	30%	0.302	41%	0.405	S	S	.	.	H	α-helix	trans	-62.9	-41.8	171.3	176.5	-94.6	0	0	0	112.2	L523 T526 I617 D619 K625	L523-Y621 HydrophobicContact CD2-CD2 4.45Å; L523-Y621 HydrophobicContact CD2-CE2 4.03Å; T526-Y621 HydrophobicContact CG2-CD2 3.96Å; I617-Y621 WeakPolarHBondContact O-CB 3.46Å; I617-Y621 PolarHBondContact O-N 3.25Å; D619-Y621 VanDerWaalsContact C-N 3.31Å; D619-Y621 PolarHBondContact O-N 2.85Å; Y621-K625 HydrophobicContact CE1-CD 4.09Å; Y621-K625 VanDerWaalsContact O-CB 3.25Å; Y621-K625 WeakPolarHBondContact O-CB 3.38Å; Y621-K625 PolarHBondContact O-N 3.07Å
622	S	89.9	Confident	84.9	Confident	58 Å²	58	83.3 Å²	83.3	41%	0.406	43%	0.425	S	S	.	.	H	α-helix	trans	-68.3	-39.5	178.5	-59.8	0	0	0	0	111.9	N618 D619 T620 K625 A626	N618-S622 WeakPolarHBondContact O-CB 3.46Å; N618-S622 PolarHBondContact O-N 3.29Å; N618-S622 PolarHBondContact O-OG 3Å; D619-S622 WeakPolarHBondContact O-CA 3.47Å; D619-S622 WeakPolarHBondContact O-CB 3.3Å; D619-S622 PolarHBondContact O-N 3.47Å; T620-S622 VanDerWaalsContact C-N 3.35Å; S622-K625 PolarHBondContact O-N 3.37Å; S622-A626 PolarHBondContact O-N 2.94Å
623	E	90.2	Very high	82.7	Confident	99 Å²	99	83.8 Å²	83.8	46%	0.463	44%	0.435	S	S	.	.	H	α-helix	trans	-59.6	-55.9	173.9	-171	-155	-148	0	0	111.7	R529 D619 K625 A626 D627	R529-E623 IonicContact NH1-OE2 2.88Å; R529-E623 PolarHBondContact NH1-OE2 3.45Å; D619-E623 PolarHBondContact O-N 3.31Å; E623-K625 PolarHBondContact O-N 3.17Å; E623-A626 WeakPolarHBondContact O-CB 3.43Å; E623-A626 PolarHBondContact O-N 3.31Å; E623-D627 PolarHBondContact O-N 3.01Å
624	V	89.5	Confident	80.8	Confident	0 Å²	0	87 Å²	87	0%	0	45%	0.452	C	S	.	.	H	α-helix	trans	-63.7	-32.4	-179.9	-178.6	0	0	0	0	111.4	Q522 T525 T526 R529 T620 A626 D627 M628	Q522-V624 HydrophobicContact CG-CG1 4.07Å; T525-V624 HydrophobicContact CG2-CG1 3.92Å; T525-V624 HydrophobicContact CG2-CG2 4.35Å; T526-V624 HydrophobicContact CG2-CB 3.42Å; T526-V624 VanDerWaalsContact CG2-CB 3.42Å; T526-V624 HydrophobicContact CG2-CG1 3.87Å; T526-V624 HydrophobicContact CG2-CG2 3.56Å; R529-V624 HydrophobicContact CG-CG2 4.46Å; T620-V624 WeakPolarHBondContact O-CG2 3.3Å; T620-V624 PolarHBondContact O-N 2.04Å; T620-V624 VanDerWaalsContact O-N 3.11Å; V624-A626 VanDerWaalsContact C-N 3.32Å; V624-D627 PolarHBondContact O-N 2.92Å; V624-M628 HydrophobicContact CG1-CE 4.22Å; V624-M628 HydrophobicContact CG1-CG 3.87Å; V624-M628 VanDerWaalsContact O-CB 3.25Å; V624-M628 WeakPolarHBondContact O-CB 3.45Å; V624-M628 WeakPolarHBondContact O-CG 3.23Å; V624-M628 PolarHBondContact O-N 3.36Å
625	K	87.4	Confident	79	Confident	118 Å²	118	89 Å²	89	51%	0.513	46%	0.46	S	S	.	.	H	α-helix	trans	-62.9	-39.5	174	-172.6	176.4	176.4	-176.8	0	111.7	Y621 S622 E623 S629	Y621-K625 HydrophobicContact CE1-CD 4.09Å; Y621-K625 VanDerWaalsContact O-CB 3.25Å; Y621-K625 WeakPolarHBondContact O-CB 3.38Å; Y621-K625 PolarHBondContact O-N 3.07Å; S622-K625 PolarHBondContact O-N 3.37Å; E623-K625 PolarHBondContact O-N 3.17Å; K625-S629 WeakPolarHBondContact O-CB 3.41Å; K625-S629 PolarHBondContact O-N 2.94Å; K625-S629 VanDerWaalsContact O-N 3.16Å
626	A	87.3	Confident	77.4	Confident	53 Å²	53	90.7 Å²	90.7	44%	0.438	46%	0.458	S	S	.	.	H	α-helix	trans	-64.8	-52.1	174.1	0	0	0	0	0	111	S622 E623 V624 M628 S629 Q630	S622-A626 PolarHBondContact O-N 2.94Å; E623-A626 WeakPolarHBondContact O-CB 3.43Å; E623-A626 PolarHBondContact O-N 3.31Å; V624-A626 VanDerWaalsContact C-N 3.32Å; A626-M628 PolarHBondContact O-N 2.84Å; A626-S629 WeakPolarHBondContact O-CB 3.49Å; A626-S629 PolarHBondContact O-N 2.85Å; A626-S629 PolarHBondContact O-OG 3.31Å; A626-Q630 PolarHBondContact O-N 3.32Å; A626-Q630 VanDerWaalsContact O-N 3.13Å
627	D	85.3	Confident	75.4	Confident	61 Å²	61	90.9 Å²	90.9	33%	0.326	46%	0.458	S	S	.	.	H	α-helix	trans	-53.1	-49	176.9	-80.9	-3.1	0	0	0	112.6	R529 E623 V624 S629 Q630 Q631	R529-D627 IonicContact CZ-OD2 3.98Å; R529-D627 IonicContact NH1-OD2 2.69Å; R529-D627 PolarHBondContact NH1-OD2 2.85Å; R529-D627 IonicContact NH2-OD2 3.25Å; R529-D627 PolarHBondContact NH2-OD2 2.9Å; E623-D627 PolarHBondContact O-N 3.01Å; V624-D627 PolarHBondContact O-N 2.92Å; D627-S629 PolarHBondContact O-N 3.46Å; D627-Q630 PolarHBondContact O-N 3.17Å; D627-Q631 PolarHBondContact O-N 3.22Å
628	M	76.7	Confident	73.7	Confident	27 Å²	27	92.2 Å²	92.2	13%	0.133	47%	0.469	C	S	.	.	H	α-helix	trans	-69.8	-19.5	-178.4	-69.7	-73.6	175	0	0	113.1	K518 Q522 T525 V624 A626	K518-M628 VanDerWaalsContact CE-O 3.26Å; K518-M628 WeakPolarHBondContact CE-O 3.43Å; K518-M628 PolarHBondContact NZ-O 2.84Å; Q522-M628 HydrophobicContact CG-CG 4.36Å; T525-M628 HydrophobicContact CG2-CE 4.28Å; V624-M628 HydrophobicContact CG1-CE 4.22Å; V624-M628 HydrophobicContact CG1-CG 3.87Å; V624-M628 VanDerWaalsContact O-CB 3.25Å; V624-M628 WeakPolarHBondContact O-CB 3.45Å; V624-M628 WeakPolarHBondContact O-CG 3.23Å; V624-M628 PolarHBondContact O-N 3.36Å; A626-M628 PolarHBondContact O-N 2.84Å
629	S	75.1	Confident	72.3	Confident	97 Å²	97	90.9 Å²	90.9	68%	0.678	46%	0.462	S	S	*	.	H	α-helix	trans	-79.3	-29.7	170.2	79.8	0	0	0	0	112.3	K625 A626 D627	K625-S629 WeakPolarHBondContact O-CB 3.41Å; K625-S629 PolarHBondContact O-N 2.94Å; K625-S629 VanDerWaalsContact O-N 3.16Å; A626-S629 WeakPolarHBondContact O-CB 3.49Å; A626-S629 PolarHBondContact O-N 2.85Å; A626-S629 PolarHBondContact O-OG 3.31Å; D627-S629 PolarHBondContact O-N 3.46Å
630	Q	69.8	Low	70.7	Confident	162 Å²	162	88.1 Å²	88.1	76%	0.757	45%	0.447	S	S	*	.	H	α-helix	trans	-82.8	-28.7	-179.9	-165.6	169.2	-1	0	0	112.7	A626 D627 R632	A626-Q630 PolarHBondContact O-N 3.32Å; A626-Q630 VanDerWaalsContact O-N 3.13Å; D627-Q630 PolarHBondContact O-N 3.17Å; Q630-R632 PolarHBondContact O-N 2.82Å; Q630-R632 VanDerWaalsContact O-N 3.08Å
631	Q	65.5	Low	69.2	Low	128 Å²	128	91 Å²	91	60%	0.598	46%	0.462	S	S	*	.	S	Bend	trans	-67.1	103.4	166.4	-78.3	-174.4	-36.9	0	0	111.1	D627 C633	D627-Q631 PolarHBondContact O-N 3.22Å; Q631-C633 PolarHBondContact O-N 3.05Å
632	R	48.6	Very low	68	Low	238 Å²	238	93.7 Å²	93.7	90%	0.898	47%	0.474	S	S	*	.			trans	-53	133.4	168.1	-68.9	-173.3	177.8	-168.9	-0.5	109.3	Q630 E634	Q630-R632 PolarHBondContact O-N 2.82Å; Q630-R632 VanDerWaalsContact O-N 3.08Å; R632-E634 PolarHBondContact O-N 3Å
633	C	45.2	Very low	66.8	Low	88 Å²	88	97 Å²	97	60%	0.595	48%	0.482	S	S	*	.			trans	-56.6	108.6	-174.5	-59.2	0	0	0	0	111.7	Q631 M635	Q631-C633 PolarHBondContact O-N 3.05Å; C633-M635 PolarHBondContact O-N 3.47Å
634	E	49.1	Very low	65.6	Low	145 Å²	145	94.1 Å²	94.1	68%	0.678	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-57	127.8	155	-74.3	-152.2	91.6	0	0	108	R150 R632 E636	R150-E634 IonicContact CZ-OE1 2.86Å; R150-E634 IonicContact NH1-OE1 2.91Å; R150-E634 PolarHBondContact NH1-OE1 2.95Å; R150-E634 IonicContact NH2-OE1 4Å; R632-E634 PolarHBondContact O-N 3Å; E634-E636 PolarHBondContact O-N 3.24Å
635	M	51.6	Low	64.2	Low	138 Å²	138	97.5 Å²	97.5	68%	0.68	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-47.4	122.4	-172.5	-72.3	171.1	-82.6	0	0	111.7	C633	C633-M635 PolarHBondContact O-N 3.47Å
636	E	59.5	Low	63.1	Low	92 Å²	92	94.6 Å²	94.6	43%	0.43	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-63.1	141.3	-164.9	-63.9	-170.4	174	0	0	112.6	E634 T638 D639 L640	E634-E636 PolarHBondContact O-N 3.24Å; E636-T638 PolarHBondContact O-N 3.1Å; E636-T638 PolarHBondContact OE2-OG1 2.81Å; E636-D639 PolarHBondContact O-N 3.3Å; E636-L640 PolarHBondContact O-N 2.9Å
637	M	51.3	Low	62	Low	38 Å²	38	98.6 Å²	98.6	19%	0.187	50%	0.499	C	S	.	.	H	α-helix	trans	-56.6	-30	170.6	-174.4	154.4	160.9	0	0	111.3	L154 F516 D639 L640 I641	L154-M637 HydrophobicContact CD2-CG 3.81Å; L154-M637 HydrophobicContact CD2-SD 4.27Å; L154-M637 HydrophobicContact CG-CE 4.22Å; L154-M637 HydrophobicContact CG-CG 4.24Å; L154-M637 HydrophobicContact CG-SD 4.03Å; F516-M637 HydrophobicContact CD1-CE 3.85Å; F516-M637 HydrophobicContact CD1-SD 3.71Å; F516-M637 HydrophobicContact CD2-CE 4.39Å; F516-M637 HydrophobicContact CE1-CE 4.05Å; F516-M637 HydrophobicContact CE1-SD 4.28Å; F516-M637 HydrophobicContact CG-CE 4.08Å; F516-M637 HydrophobicContact CG-SD 4.19Å; F516-M637 HydrophobicContact CZ-CE 4.44Å; M637-D639 PolarHBondContact O-N 3.37Å; M637-L640 PolarHBondContact O-N 2.97Å; M637-I641 HydrophobicContact CE-CD1 4.39Å; M637-I641 HydrophobicContact CG-CD1 3.9Å; M637-I641 HydrophobicContact CG-CG1 4.4Å; M637-I641 WeakPolarHBondContact O-CB 3.47Å; M637-I641 VanDerWaalsContact O-CG1 3.28Å; M637-I641 WeakPolarHBondContact O-CG1 3.19Å; M637-I641 PolarHBondContact O-N 3.29Å
638	T	57	Low	60.7	Low	85 Å²	85	97.8 Å²	97.8	52%	0.521	50%	0.501	S	S	.	.	H	α-helix	trans	-54.7	-46.5	169.9	-38.7	0	0	0	0	112.8	E636 I641 K642	E636-T638 PolarHBondContact O-N 3.1Å; E636-T638 PolarHBondContact OE2-OG1 2.81Å; T638-I641 PolarHBondContact O-N 3.17Å; T638-K642 WeakPolarHBondContact O-CB 3.42Å; T638-K642 PolarHBondContact O-N 3.36Å
639	D	63	Low	59.8	Low	74 Å²	74	100 Å²	100	40%	0.396	51%	0.513	S	S	.	.	H	α-helix	trans	-71.6	-32.1	179.3	-89.1	-23.8	0	0	0	112.1	E636 M637 K643	E636-D639 PolarHBondContact O-N 3.3Å; M637-D639 PolarHBondContact O-N 3.37Å; D639-K643 VanDerWaalsContact O-CB 3.32Å; D639-K643 WeakPolarHBondContact O-CB 3.3Å; D639-K643 WeakPolarHBondContact O-CD 3.43Å; D639-K643 WeakPolarHBondContact O-CG 3.35Å; D639-K643 PolarHBondContact O-N 2.86Å
640	L	59.2	Low	58.8	Low	60 Å²	60	99.8 Å²	99.8	31%	0.314	50%	0.502	S	S	.	.	H	α-helix	trans	-72.8	-38.4	174.3	-66.6	175.9	0	0	0	112.1	L154 E636 M637 K643 G644	L154-L640 HydrophobicContact CD1-CD1 4.43Å; L154-L640 HydrophobicContact CD2-CB 3.97Å; L154-L640 HydrophobicContact CD2-CD1 4.11Å; E636-L640 PolarHBondContact O-N 2.9Å; M637-L640 PolarHBondContact O-N 2.97Å; L640-K643 HydrophobicContact CD2-CD 4.43Å; L640-K643 PolarHBondContact O-N 3.14Å; L640-G644 PolarHBondContact O-N 3.05Å
641	I	61.8	Low	58.2	Low	74 Å²	74	99.5 Å²	99.5	38%	0.379	50%	0.498	S	S	.	.	H	α-helix	trans	-66.8	-42.5	171.4	-68.4	165.7	0	0	0	109.9	M637 T638 K643 G644 C645	M637-I641 HydrophobicContact CE-CD1 4.39Å; M637-I641 HydrophobicContact CG-CD1 3.9Å; M637-I641 HydrophobicContact CG-CG1 4.4Å; M637-I641 WeakPolarHBondContact O-CB 3.47Å; M637-I641 VanDerWaalsContact O-CG1 3.28Å; M637-I641 WeakPolarHBondContact O-CG1 3.19Å; M637-I641 PolarHBondContact O-N 3.29Å; T638-I641 PolarHBondContact O-N 3.17Å; I641-K643 VanDerWaalsContact C-N 3.34Å; I641-K643 PolarHBondContact O-N 3.15Å; I641-G644 CarbonylContact O-C 3.51Å; I641-G644 PolarHBondContact O-N 3.12Å; I641-G644 VanDerWaalsContact O-N 3.14Å; I641-C645 WeakPolarHBondContact O-CB 3.39Å; I641-C645 PolarHBondContact O-N 3.43Å
642	K	64.4	Low	57.7	Low	132 Å²	132	99.4 Å²	99.4	57%	0.574	50%	0.501	S	S	*	.	H	α-helix	trans	-60.2	-41.9	173.9	-172.4	175.8	-179.9	-178.1	0	111.4	T638 N646	T638-K642 WeakPolarHBondContact O-CB 3.42Å; T638-K642 PolarHBondContact O-N 3.36Å; K642-N646 VanDerWaalsContact O-CB 3.28Å; K642-N646 WeakPolarHBondContact O-CB 3.45Å; K642-N646 PolarHBondContact O-N 2.9Å; K642-N646 PolarHBondContact O-ND2 3.44Å
643	K	66.1	Low	57.9	Low	129 Å²	129	97 Å²	97	56%	0.561	49%	0.492	S	S	*	.	H	α-helix	trans	-65.5	-42	171.5	-75.3	164.6	-176	172.8	0	111.9	D639 L640 I641 N646 K647	D639-K643 VanDerWaalsContact O-CB 3.32Å; D639-K643 WeakPolarHBondContact O-CB 3.3Å; D639-K643 WeakPolarHBondContact O-CD 3.43Å; D639-K643 WeakPolarHBondContact O-CG 3.35Å; D639-K643 PolarHBondContact O-N 2.86Å; L640-K643 HydrophobicContact CD2-CD 4.43Å; L640-K643 PolarHBondContact O-N 3.14Å; I641-K643 VanDerWaalsContact C-N 3.34Å; I641-K643 PolarHBondContact O-N 3.15Å; K643-N646 PolarHBondContact O-N 2.94Å; K643-K647 VanDerWaalsContact O-CB 3.25Å; K643-K647 WeakPolarHBondContact O-CB 3.43Å; K643-K647 PolarHBondContact O-N 2.93Å
644	G	64.8	Low	58.3	Low	38 Å²	38	99 Å²	99	39%	0.392	50%	0.497	S	S	.	.	H	α-helix	trans	-64.5	-49.3	178.4	0	0	0	0	0	113.2	L640 I641 K647 A648	L640-G644 PolarHBondContact O-N 3.05Å; I641-G644 CarbonylContact O-C 3.51Å; I641-G644 PolarHBondContact O-N 3.12Å; I641-G644 VanDerWaalsContact O-N 3.14Å; G644-K647 PolarHBondContact O-N 3.41Å; G644-A648 WeakPolarHBondContact O-CB 3.17Å; G644-A648 PolarHBondContact O-N 2.87Å
645	C	59.6	Low	58.2	Low	70 Å²	70	96.9 Å²	96.9	47%	0.473	49%	0.485	S	S	.	.	H	α-helix	trans	-61	-43.8	172.5	-73.2	0	0	0	0	111.4	I641 K647 A648 L649	I641-C645 WeakPolarHBondContact O-CB 3.39Å; I641-C645 PolarHBondContact O-N 3.43Å; C645-K647 PolarHBondContact O-N 3.47Å; C645-A648 PolarHBondContact O-N 3.43Å; C645-L649 WeakPolarHBondContact O-CB 3.33Å; C645-L649 WeakPolarHBondContact O-CD1 3.33Å; C645-L649 PolarHBondContact O-N 2.9Å
646	N	63.9	Low	58.3	Low	58 Å²	58	95.1 Å²	95.1	31%	0.31	47%	0.474	S	S	.	.	H	α-helix	trans	-61.3	-42.7	173.9	-84.5	-60.6	0	0	0	112.2	K642 K643 A648 L649 M650 K655	K642-N646 VanDerWaalsContact O-CB 3.28Å; K642-N646 WeakPolarHBondContact O-CB 3.45Å; K642-N646 PolarHBondContact O-N 2.9Å; K642-N646 PolarHBondContact O-ND2 3.44Å; K643-N646 PolarHBondContact O-N 2.94Å; N646-A648 VanDerWaalsContact C-N 3.34Å; N646-L649 PolarHBondContact O-N 3.25Å; N646-M650 WeakPolarHBondContact O-CB 3.28Å; N646-M650 WeakPolarHBondContact O-CG 3.49Å; N646-M650 PolarHBondContact O-N 2.9Å; N646-K655 PolarHBondContact OD1-NZ 3.25Å; N646-K655 VanDerWaalsContact OD1-NZ 3.11Å
647	K	64.6	Low	58	Low	136 Å²	136	93.1 Å²	93.1	59%	0.591	47%	0.467	S	S	*	.	H	α-helix	trans	-67.1	-34	177.3	-164.5	171.4	-172	174.5	0	111.9	K643 G644 C645 K651	K643-K647 VanDerWaalsContact O-CB 3.25Å; K643-K647 WeakPolarHBondContact O-CB 3.43Å; K643-K647 PolarHBondContact O-N 2.93Å; G644-K647 PolarHBondContact O-N 3.41Å; C645-K647 PolarHBondContact O-N 3.47Å; K647-K651 WeakPolarHBondContact O-CB 3.3Å; K647-K651 WeakPolarHBondContact O-CG 3.36Å; K647-K651 PolarHBondContact O-N 2.93Å
648	A	58.3	Low	58.2	Low	45 Å²	45	94.9 Å²	94.9	37%	0.372	48%	0.482	S	S	.	.	H	α-helix	trans	-71.8	-42.7	172.9	0	0	0	0	0	112.3	G644 C645 N646 M650 K651 L652	G644-A648 WeakPolarHBondContact O-CB 3.17Å; G644-A648 PolarHBondContact O-N 2.87Å; C645-A648 PolarHBondContact O-N 3.43Å; N646-A648 VanDerWaalsContact C-N 3.34Å; A648-M650 VanDerWaalsContact C-N 3.34Å; A648-M650 PolarHBondContact O-N 3.23Å; A648-K651 CarbonylContact O-C 3.25Å; A648-K651 PolarHBondContact O-N 2.96Å; A648-L652 WeakPolarHBondContact O-CB 3.37Å; A648-L652 VanDerWaalsContact O-CG 3.31Å; A648-L652 WeakPolarHBondContact O-CG 2.98Å; A648-L652 PolarHBondContact O-N 3.27Å
649	L	56.8	Low	58.1	Low	74 Å²	74	91.9 Å²	91.9	39%	0.387	46%	0.464	S	S	.	.	H	α-helix	trans	-60.9	-40.7	173.1	-101.1	125	0	0	0	112.1	C645 N646 L652 R653 L654	C645-L649 WeakPolarHBondContact O-CB 3.33Å; C645-L649 WeakPolarHBondContact O-CD1 3.33Å; C645-L649 PolarHBondContact O-N 2.9Å; N646-L649 PolarHBondContact O-N 3.25Å; L649-L652 PolarHBondContact O-N 2.9Å; L649-R653 PolarHBondContact O-N 3.49Å; L649-L654 HydrophobicContact CD2-CB 3.84Å; L649-L654 PolarHBondContact O-N 2.89Å; L649-L654 VanDerWaalsContact O-N 3.08Å
650	M	55.4	Low	57.7	Low	92 Å²	92	90.4 Å²	90.4	45%	0.453	46%	0.455	S	S	.	.	H	α-helix	trans	-64.6	-44.2	172	-76.3	179.2	163.8	0	0	111.6	N646 A648 L652 R653 K655	N646-M650 WeakPolarHBondContact O-CB 3.28Å; N646-M650 WeakPolarHBondContact O-CG 3.49Å; N646-M650 PolarHBondContact O-N 2.9Å; A648-M650 VanDerWaalsContact C-N 3.34Å; A648-M650 PolarHBondContact O-N 3.23Å; M650-L652 VanDerWaalsContact C-N 3.32Å; M650-L652 PolarHBondContact O-N 3.47Å; M650-R653 PolarHBondContact O-N 3.42Å; M650-K655 HydrophobicContact CE-CD 4.41Å; M650-K655 HydrophobicContact CG-CB 4.32Å
651	K	56.9	Low	57.4	Low	156 Å²	156	93 Å²	93	68%	0.678	46%	0.464	S	S	*	.	H	α-helix	trans	-64.2	-32.5	175.1	-81.1	-171.4	170.9	-165.7	0	113.9	K647 A648 R653	K647-K651 WeakPolarHBondContact O-CB 3.3Å; K647-K651 WeakPolarHBondContact O-CG 3.36Å; K647-K651 PolarHBondContact O-N 2.93Å; A648-K651 CarbonylContact O-C 3.25Å; A648-K651 PolarHBondContact O-N 2.96Å; K651-R653 PolarHBondContact O-N 3.3Å
652	L	55.1	Low	57.2	Low	126 Å²	126	91.8 Å²	91.8	66%	0.66	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	11	176.6	-70.1	168.2	0	0	0	113.3	A648 L649 M650 L654	A648-L652 WeakPolarHBondContact O-CB 3.37Å; A648-L652 VanDerWaalsContact O-CG 3.31Å; A648-L652 WeakPolarHBondContact O-CG 2.98Å; A648-L652 PolarHBondContact O-N 3.27Å; L649-L652 PolarHBondContact O-N 2.9Å; M650-L652 VanDerWaalsContact C-N 3.32Å; M650-L652 PolarHBondContact O-N 3.47Å; L652-L654 HydrophobicContact CB-CD1 4.16Å; L652-L654 PolarHBondContact O-N 3.49Å
653	R	53.4	Low	56.6	Low	186 Å²	186	86.5 Å²	86.5	70%	0.702	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	15	-178	-64.3	-169.2	174.9	-157	-0.4	115.5	L649 M650 K651 K655	L649-R653 PolarHBondContact O-N 3.49Å; M650-R653 PolarHBondContact O-N 3.42Å; K651-R653 PolarHBondContact O-N 3.3Å; R653-K655 VanDerWaalsContact C-N 3.27Å; R653-K655 PolarHBondContact O-N 2.86Å
654	L	52.5	Low	56	Low	132 Å²	132	83 Å²	83	69%	0.691	43%	0.43	S	S	*	.			trans	-82.1	0.4	-179.6	-77.8	161.8	0	0	0	113.6	L649 L652	L649-L654 HydrophobicContact CD2-CB 3.84Å; L649-L654 PolarHBondContact O-N 2.89Å; L649-L654 VanDerWaalsContact O-N 3.08Å; L652-L654 HydrophobicContact CB-CD1 4.16Å; L652-L654 PolarHBondContact O-N 3.49Å
655	K	46.7	Very low	55.5	Low	100 Å²	100	82.2 Å²	82.2	44%	0.435	42%	0.421	S	S	.	.	S	Bend	trans	-142.9	110.6	179.2	-161.7	172.5	-172.6	177.5	0	110.1	N646 M650 R653	N646-K655 PolarHBondContact OD1-NZ 3.25Å; N646-K655 VanDerWaalsContact OD1-NZ 3.11Å; M650-K655 HydrophobicContact CE-CD 4.41Å; M650-K655 HydrophobicContact CG-CB 4.32Å; R653-K655 VanDerWaalsContact C-N 3.27Å; R653-K655 PolarHBondContact O-N 2.86Å
656	K	53.5	Low	55.2	Low	101 Å²	101	80.7 Å²	80.7	44%	0.439	41%	0.408	S	S	.	.			trans	-56.5	139.7	173.8	-67.8	165.6	-175.7	149.5	0	110	D660 K661 E787	K656-D660 HydrophobicContact CB-CB 4.48Å; K656-K661 HydrophobicContact CB-CG 4.18Å; K656-E787 IonicContact NZ-OE1 3.54Å; K656-E787 PolarHBondContact NZ-OE1 3.12Å; K656-E787 IonicContact NZ-OE2 3.01Å; K656-E787 PolarHBondContact NZ-OE2 2.98Å
657	T	54.4	Low	54.7	Low	49 Å²	49	85 Å²	85	30%	0.301	43%	0.426	S	S	.	.			trans	-68.1	158.6	177.1	69.4	0	0	0	0	110.7	V659 D660 K661	T657-V659 PolarHBondContact O-N 3.16Å; T657-D660 WeakPolarHBondContact CB-OD2 3.49Å; T657-D660 WeakPolarHBondContact CG2-OD2 3.26Å; T657-D660 PolarHBondContact N-OD2 3.42Å; T657-D660 PolarHBondContact O-N 3.46Å; T657-D660 WeakPolarHBondContact OG1-CB 3.26Å; T657-D660 PolarHBondContact OG1-N 2.86Å; T657-D660 PolarHBondContact OG1-OD2 3.45Å; T657-K661 WeakPolarHBondContact O-CG 3.16Å; T657-K661 PolarHBondContact O-N 3.17Å; T657-K661 VanDerWaalsContact O-N 3.17Å
658	P	54.1	Low	54.1	Low	75 Å²	75	86.9 Å²	86.9	49%	0.487	44%	0.437	S	S	.	.	H	α-helix	trans	-58.6	-37	172.4	22.7	-32.8	0	0	0	111.9	K661 I662	P658-K661 PolarHBondContact O-N 3.46Å; P658-K661 VanDerWaalsContact O-N 3.16Å; P658-I662 WeakPolarHBondContact O-CG1 3.37Å; P658-I662 PolarHBondContact O-N 2.98Å
659	V	55	Low	53.6	Low	23 Å²	23	86.7 Å²	86.7	14%	0.139	44%	0.436	C	S	.	.	H	α-helix	trans	-64.2	-43.6	177.1	-174.5	0	0	0	0	111.6	T657 K661 I662 S663 R723 L726	T657-V659 PolarHBondContact O-N 3.16Å; V659-K661 PolarHBondContact O-N 2.85Å; V659-I662 PolarHBondContact O-N 3.02Å; V659-S663 PolarHBondContact O-N 2.98Å; V659-S663 PolarHBondContact O-OG 2.85Å; V659-S663 VanDerWaalsContact O-OG 3.13Å; V659-R723 HydrophobicContact CG1-CB 4.26Å; V659-L726 HydrophobicContact CB-CD1 4.48Å; V659-L726 HydrophobicContact CG2-CD1 4.09Å
660	D	54.6	Low	53	Low	42 Å²	42	88.6 Å²	88.6	23%	0.225	46%	0.455	C	S	.	.	H	α-helix	trans	-62.1	-30	173.9	-67.8	-54.2	0	0	0	112.8	K656 T657 S663 S664	K656-D660 HydrophobicContact CB-CB 4.48Å; T657-D660 WeakPolarHBondContact CB-OD2 3.49Å; T657-D660 WeakPolarHBondContact CG2-OD2 3.26Å; T657-D660 PolarHBondContact N-OD2 3.42Å; T657-D660 PolarHBondContact O-N 3.46Å; T657-D660 WeakPolarHBondContact OG1-CB 3.26Å; T657-D660 PolarHBondContact OG1-N 2.86Å; T657-D660 PolarHBondContact OG1-OD2 3.45Å; D660-S663 PolarHBondContact O-OG 3.15Å; D660-S664 WeakPolarHBondContact O-CB 3.4Å; D660-S664 PolarHBondContact O-N 3.26Å; D660-S664 PolarHBondContact O-OG 3.49Å
661	K	54	Low	52.6	Low	115 Å²	115	89.1 Å²	89.1	50%	0.5	47%	0.468	S	S	.	.	H	α-helix	trans	-78.8	-30.6	177	-71.1	-173.8	176.8	-164.3	0	113.1	K656 T657 P658 V659 S664 G665	K656-K661 HydrophobicContact CB-CG 4.18Å; T657-K661 WeakPolarHBondContact O-CG 3.16Å; T657-K661 PolarHBondContact O-N 3.17Å; T657-K661 VanDerWaalsContact O-N 3.17Å; P658-K661 PolarHBondContact O-N 3.46Å; P658-K661 VanDerWaalsContact O-N 3.16Å; V659-K661 PolarHBondContact O-N 2.85Å; K661-S664 WeakPolarHBondContact CA-OG 3.46Å; K661-S664 PolarHBondContact O-OG 3.39Å; K661-G665 PolarHBondContact O-N 3.35Å
662	I	56.3	Low	52.3	Low	48 Å²	48	90.3 Å²	90.3	25%	0.246	47%	0.473	C	S	.	.	H	α-helix	trans	-76.3	-45.4	175.9	-66.7	163.2	0	0	0	109.8	P658 V659 S664 G665 L666 L719	P658-I662 WeakPolarHBondContact O-CG1 3.37Å; P658-I662 PolarHBondContact O-N 2.98Å; V659-I662 PolarHBondContact O-N 3.02Å; I662-S664 PolarHBondContact O-N 3.21Å; I662-G665 PolarHBondContact O-N 3.2Å; I662-G665 VanDerWaalsContact O-N 3.17Å; I662-L666 HydrophobicContact CG2-CD1 4.01Å; I662-L666 PolarHBondContact O-N 3.41Å; I662-L719 HydrophobicContact CG2-CD1 3.88Å
663	S	53	Low	52.1	Low	21 Å²	21	89 Å²	89	15%	0.147	47%	0.465	C	S	.	.	H	α-helix	trans	-64.8	-39.6	178.7	62	0	0	0	0	113	V659 D660 G665 L666 Q667	V659-S663 PolarHBondContact O-N 2.98Å; V659-S663 PolarHBondContact O-OG 2.85Å; V659-S663 VanDerWaalsContact O-OG 3.13Å; D660-S663 PolarHBondContact O-OG 3.15Å; S663-G665 VanDerWaalsContact C-N 3.33Å; S663-G665 PolarHBondContact O-N 2.95Å; S663-L666 PolarHBondContact O-N 3.2Å; S663-Q667 WeakPolarHBondContact O-CB 3.45Å; S663-Q667 WeakPolarHBondContact O-CG 3.21Å; S663-Q667 PolarHBondContact O-N 3.09Å
664	S	53.1	Low	52.2	Low	57 Å²	57	85.8 Å²	85.8	40%	0.399	46%	0.461	S	S	.	.	H	α-helix	trans	-66.6	-32.4	172.8	49.9	0	0	0	0	113.3	D660 K661 I662 Q668	D660-S664 WeakPolarHBondContact O-CB 3.4Å; D660-S664 PolarHBondContact O-N 3.26Å; D660-S664 PolarHBondContact O-OG 3.49Å; K661-S664 WeakPolarHBondContact CA-OG 3.46Å; K661-S664 PolarHBondContact O-OG 3.39Å; I662-S664 PolarHBondContact O-N 3.21Å; S664-Q668 WeakPolarHBondContact O-CB 3.22Å; S664-Q668 PolarHBondContact O-N 2.92Å
665	G	53.5	Low	52.4	Low	20 Å²	20	82.7 Å²	82.7	21%	0.206	44%	0.443	C	S	.	.	H	α-helix	trans	-63.7	-45.7	169.7	0	0	0	0	0	112.7	K661 I662 S663 Q668 A669	K661-G665 PolarHBondContact O-N 3.35Å; I662-G665 PolarHBondContact O-N 3.2Å; I662-G665 VanDerWaalsContact O-N 3.17Å; S663-G665 VanDerWaalsContact C-N 3.33Å; S663-G665 PolarHBondContact O-N 2.95Å; G665-Q668 PolarHBondContact O-N 2.88Å; G665-A669 PolarHBondContact O-N 3.28Å
666	L	53.8	Low	52.9	Low	38 Å²	38	83.4 Å²	83.4	20%	0.199	45%	0.451	C	S	.	.	H	α-helix	trans	-67.3	-35.8	177.9	-73.4	164.5	0	0	0	113	I662 S663 Q668 A669 R716 L719	I662-L666 HydrophobicContact CG2-CD1 4.01Å; I662-L666 PolarHBondContact O-N 3.41Å; S663-L666 PolarHBondContact O-N 3.2Å; L666-Q668 VanDerWaalsContact C-N 3.32Å; L666-Q668 PolarHBondContact O-N 3.02Å; L666-A669 PolarHBondContact O-N 3.28Å; L666-R716 HydrophobicContact CD1-CG 4.45Å; L666-L719 HydrophobicContact CD1-CD1 3.81Å
667	Q	53	Low	53.3	Low	148 Å²	148	83.6 Å²	83.6	69%	0.692	45%	0.454	S	S	*	.	H	α-helix	trans	-70.8	-25.2	175.8	-76.9	-177.4	-8.3	0	0	113.2	S663	S663-Q667 WeakPolarHBondContact O-CB 3.45Å; S663-Q667 WeakPolarHBondContact O-CG 3.21Å; S663-Q667 PolarHBondContact O-N 3.09Å
668	Q	53.6	Low	53.7	Low	176 Å²	176	83.2 Å²	83.2	82%	0.822	45%	0.449	S	S	*	.	H	α-helix	trans	-86.9	-15	178.3	-161.8	162.9	16.6	0	0	113.2	S664 G665 L666	S664-Q668 WeakPolarHBondContact O-CB 3.22Å; S664-Q668 PolarHBondContact O-N 2.92Å; G665-Q668 PolarHBondContact O-N 2.88Å; L666-Q668 VanDerWaalsContact C-N 3.32Å; L666-Q668 PolarHBondContact O-N 3.02Å
669	A	46.8	Very low	54.4	Low	41 Å²	41	82.1 Å²	82.1	34%	0.339	44%	0.436	S	S	.	.			trans	-108.1	72.9	-178.5	0	0	0	0	0	112.3	G665 L666 M673	G665-A669 PolarHBondContact O-N 3.28Å; L666-A669 PolarHBondContact O-N 3.28Å; A669-M673 HydrophobicContact CB-SD 4.15Å
670	S	43.2	Very low	54.8	Low	115 Å²	115	88 Å²	88	80%	0.804	46%	0.462	S	S	*	.			trans	-84.1	130.6	169.5	-172.5	0	0	0	0	111
671	S	47.9	Very low	55.1	Low	102 Å²	102	89.2 Å²	89.2	71%	0.713	47%	0.468	S	S	*	.	S	Bend	trans	77.5	90.1	176.5	-175.9	0	0	0	0	117.9
672	K	50.9	Low	55.5	Low	182 Å²	182	85.3 Å²	85.3	79%	0.791	45%	0.453	S	S	*	.			trans	59.3	95.2	155.4	-60.2	-172.7	175.2	-168.2	0	117.2
673	M	50	Low	56	Low	97 Å²	97	87.5 Å²	87.5	48%	0.478	46%	0.46	S	S	.	.			trans	-104.5	148.2	164.2	-82.6	179.4	150.4	0	0	111.3	A669 E677	A669-M673 HydrophobicContact CB-SD 4.15Å; M673-E677 HydrophobicContact CE-CG 4.09Å
674	N	55.8	Low	56.2	Low	119 Å²	119	89.9 Å²	89.9	64%	0.636	49%	0.488	S	S	*	.			trans	-81.4	152.9	171.7	-79.6	-20.6	0	0	0	111.4	D676 E677 L678	N674-D676 VanDerWaalsContact C-N 3.32Å; N674-D676 PolarHBondContact O-N 2.93Å; N674-E677 WeakPolarHBondContact O-CB 3.44Å; N674-E677 PolarHBondContact O-N 3.39Å; N674-L678 PolarHBondContact O-N 3.13Å
675	F	56.4	Low	56.2	Low	68 Å²	68	92.4 Å²	92.4	30%	0.298	49%	0.492	S	S	.	.	H	α-helix	trans	-49.6	-44.8	-176.3	176.6	-103.7	0	0	0	114.3	E677 R679 F696 L707	F675-E677 VanDerWaalsContact C-N 3.33Å; F675-E677 PolarHBondContact O-N 2.91Å; F675-R679 WeakPolarHBondContact O-CB 3.16Å; F675-R679 PolarHBondContact O-N 3.13Å; F675-F696 HydrophobicContact CE2-CD1 4.44Å; F675-F696 AromaticContact CE2-CD2 3.99Å; F675-F696 HydrophobicContact CE2-CD2 3.99Å; F675-F696 HydrophobicContact CE2-CE2 4.04Å; F675-F696 HydrophobicContact CE2-CG 4.2Å; F675-F696 HydrophobicContact CE2-CZ 4.32Å; F675-L707 HydrophobicContact CD2-CD1 4.24Å
676	D	57.9	Low	55.9	Low	115 Å²	115	94.6 Å²	94.6	62%	0.615	51%	0.514	S	S	*	.	H	α-helix	trans	-67.4	-30.7	-179.6	-74	-40.2	0	0	0	113.4	N674 Q680	N674-D676 VanDerWaalsContact C-N 3.32Å; N674-D676 PolarHBondContact O-N 2.93Å; D676-Q680 WeakPolarHBondContact O-CB 3.36Å; D676-Q680 PolarHBondContact O-N 2.97Å
677	E	62.2	Low	56	Low	105 Å²	105	95.7 Å²	95.7	49%	0.491	52%	0.518	S	S	.	.	H	α-helix	trans	-71.7	-44.3	179.7	-167.4	173.6	-168.9	0	0	110.8	M673 N674 F675 Q680 D681	M673-E677 HydrophobicContact CE-CG 4.09Å; N674-E677 WeakPolarHBondContact O-CB 3.44Å; N674-E677 PolarHBondContact O-N 3.39Å; F675-E677 VanDerWaalsContact C-N 3.33Å; F675-E677 PolarHBondContact O-N 2.91Å; E677-Q680 PolarHBondContact O-N 2.88Å; E677-D681 PolarHBondContact O-N 2.83Å
678	L	62.9	Low	56.7	Low	40 Å²	40	92.4 Å²	92.4	21%	0.209	51%	0.508	C	S	.	.	H	α-helix	trans	-64.3	-40.7	173.7	-177.3	59.8	0	0	0	111.6	N674 Q680 D681 L682 F696	N674-L678 PolarHBondContact O-N 3.13Å; L678-Q680 VanDerWaalsContact C-N 3.33Å; L678-Q680 PolarHBondContact O-N 3.41Å; L678-D681 PolarHBondContact O-N 2.76Å; L678-L682 HydrophobicContact CD1-CD1 4.35Å; L678-L682 HydrophobicContact CD1-CG 4.49Å; L678-L682 HydrophobicContact CG-CD1 4.23Å; L678-L682 WeakPolarHBondContact O-CB 3.35Å; L678-L682 VanDerWaalsContact O-CG 3.3Å; L678-L682 WeakPolarHBondContact O-CG 3.36Å; L678-L682 PolarHBondContact O-N 3.26Å; L678-F696 HydrophobicContact CD2-CE1 4.13Å; L678-F696 HydrophobicContact CD2-CZ 3.82Å; L678-F696 HydrophobicContact CG-CZ 4.22Å
679	R	67.9	Low	57.1	Low	52 Å²	52	87 Å²	87	20%	0.196	49%	0.485	C	S	.	.	H	α-helix	trans	-64.1	-36.6	174.5	-172.8	172.5	-170.4	163.1	0.7	112.2	F675 K683 D689 I692	F675-R679 WeakPolarHBondContact O-CB 3.16Å; F675-R679 PolarHBondContact O-N 3.13Å; R679-K683 WeakPolarHBondContact O-CB 3.35Å; R679-K683 WeakPolarHBondContact O-CG 3.38Å; R679-K683 PolarHBondContact O-N 3.45Å; R679-D689 IonicContact CZ-OD1 3.99Å; R679-D689 VanDerWaalsContact CZ-OD1 3.25Å; R679-D689 IonicContact NE-OD1 3.2Å; R679-D689 PolarHBondContact NE-OD1 3.4Å; R679-D689 IonicContact NH2-OD1 3.73Å; R679-D689 PolarHBondContact NH2-OD1 2.93Å; R679-D689 IonicContact NH2-OD2 2.78Å; R679-D689 PolarHBondContact NH2-OD2 3.09Å; R679-I692 HydrophobicContact CG-CG2 4.25Å
680	Q	63.2	Low	58	Low	147 Å²	147	88.4 Å²	88.4	69%	0.687	50%	0.497	S	S	*	.	H	α-helix	trans	-74.5	-37.2	179.2	-169.7	167.4	3.9	0	0	112.4	D676 E677 L678 G684	D676-Q680 WeakPolarHBondContact O-CB 3.36Å; D676-Q680 PolarHBondContact O-N 2.97Å; E677-Q680 PolarHBondContact O-N 2.88Å; L678-Q680 VanDerWaalsContact C-N 3.33Å; L678-Q680 PolarHBondContact O-N 3.41Å; Q680-G684 PolarHBondContact O-N 2.8Å
681	D	61.3	Low	59	Low	67 Å²	67	87.5 Å²	87.5	36%	0.358	48%	0.48	S	S	.	.	H	α-helix	trans	-66.2	-43.3	172.4	178.4	62.7	0	0	0	112.1	E677 L678 K683 G684 K685	E677-D681 PolarHBondContact O-N 2.83Å; L678-D681 PolarHBondContact O-N 2.76Å; D681-K683 PolarHBondContact O-N 2.96Å; D681-G684 CarbonylContact O-C 3.59Å; D681-G684 PolarHBondContact O-N 3.35Å; D681-G684 VanDerWaalsContact O-N 3.15Å; D681-K685 WeakPolarHBondContact O-CG 3.44Å; D681-K685 PolarHBondContact O-N 2.78Å; D681-K685 WeakPolarHBondContact OD1-CE 3.3Å; D681-K685 IonicContact OD1-NZ 3.23Å; D681-K685 PolarHBondContact OD1-NZ 3.43Å; D681-K685 WeakPolarHBondContact OD2-CE 3.29Å; D681-K685 IonicContact OD2-NZ 2.74Å; D681-K685 PolarHBondContact OD2-NZ 3.5Å
682	L	63.3	Low	59.8	Low	34 Å²	34	82.8 Å²	82.8	18%	0.178	45%	0.447	C	S	.	.	H	α-helix	trans	-64.2	-38.5	175.3	-71	171.1	0	0	0	112.7	L678 K685 G686 H687 I692	L678-L682 HydrophobicContact CD1-CD1 4.35Å; L678-L682 HydrophobicContact CD1-CG 4.49Å; L678-L682 HydrophobicContact CG-CD1 4.23Å; L678-L682 WeakPolarHBondContact O-CB 3.35Å; L678-L682 VanDerWaalsContact O-CG 3.3Å; L678-L682 WeakPolarHBondContact O-CG 3.36Å; L678-L682 PolarHBondContact O-N 3.26Å; L682-K685 PolarHBondContact O-N 2.86Å; L682-G686 PolarHBondContact O-N 2.89Å; L682-H687 PolarHBondContact O-N 3.35Å; L682-I692 HydrophobicContact CB-CD1 3.79Å; L682-I692 HydrophobicContact CB-CG1 4.07Å; L682-I692 HydrophobicContact CD1-CG2 4.25Å
683	K	67.1	Low	60.3	Low	94 Å²	94	79.9 Å²	79.9	41%	0.409	44%	0.436	S	S	.	.	H	α-helix	trans	-63.6	-43.9	169.2	-81.1	-179.7	175.4	173.6	0	112	R679 D681 K685 G686 D689 I692	R679-K683 WeakPolarHBondContact O-CB 3.35Å; R679-K683 WeakPolarHBondContact O-CG 3.38Å; R679-K683 PolarHBondContact O-N 3.45Å; D681-K683 PolarHBondContact O-N 2.96Å; K683-K685 PolarHBondContact O-N 2.83Å; K683-G686 PolarHBondContact O-N 3.12Å; K683-D689 WeakPolarHBondContact CE-OD1 3.44Å; K683-D689 WeakPolarHBondContact CE-OD2 3.46Å; K683-D689 IonicContact NZ-OD1 2.8Å; K683-D689 PolarHBondContact NZ-OD1 3.17Å; K683-D689 IonicContact NZ-OD2 2.78Å; K683-D689 PolarHBondContact NZ-OD2 3.03Å; K683-I692 HydrophobicContact CG-CD1 3.74Å
684	G	57.4	Low	61	Low	71 Å²	71	78.4 Å²	78.4	73%	0.732	44%	0.439	S	S	*	.	H	α-helix	trans	-61.2	-26.7	176.8	0	0	0	0	0	113.6	Q680 D681	Q680-G684 PolarHBondContact O-N 2.8Å; D681-G684 CarbonylContact O-C 3.59Å; D681-G684 PolarHBondContact O-N 3.35Å; D681-G684 VanDerWaalsContact O-N 3.15Å
685	K	53	Low	61.4	Low	110 Å²	110	76.6 Å²	76.6	48%	0.478	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	1.3	175.7	-71	166.7	-179.2	167.9	0	114.2	D681 L682 K683	D681-K685 WeakPolarHBondContact O-CG 3.44Å; D681-K685 PolarHBondContact O-N 2.78Å; D681-K685 WeakPolarHBondContact OD1-CE 3.3Å; D681-K685 IonicContact OD1-NZ 3.23Å; D681-K685 PolarHBondContact OD1-NZ 3.43Å; D681-K685 WeakPolarHBondContact OD2-CE 3.29Å; D681-K685 IonicContact OD2-NZ 2.74Å; D681-K685 PolarHBondContact OD2-NZ 3.5Å; L682-K685 PolarHBondContact O-N 2.86Å; K683-K685 PolarHBondContact O-N 2.83Å
686	G	46.1	Very low	61.7	Low	65 Å²	65	74.2 Å²	74.2	67%	0.67	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.6	14.1	168.2	0	0	0	0	0	116.3	L682 K683	L682-G686 PolarHBondContact O-N 2.89Å; K683-G686 PolarHBondContact O-N 3.12Å
687	H	55.9	Low	62.1	Low	62 Å²	62	72.5 Å²	72.5	29%	0.287	42%	0.42	S	S	.	.			trans	-84	143.9	174	-69.1	-78	0	0	0	111.9	L682 I692	L682-H687 PolarHBondContact O-N 3.35Å; H687-I692 HydrophobicContact CB-CD1 4.09Å; H687-I692 HydrophobicContact CB-CG1 3.92Å
688	T	67.8	Low	62.3	Low	79 Å²	79	73.5 Å²	73.5	49%	0.485	42%	0.423	S	S	.	.			trans	-78.5	151.8	177.9	67.2	0	0	0	0	111.3	A690 E691 I692	T688-A690 PolarHBondContact O-N 3.43Å; T688-A690 VanDerWaalsContact O-N 3.17Å; T688-E691 WeakPolarHBondContact CB-OE2 3.38Å; T688-E691 PolarHBondContact N-OE2 2.74Å; T688-E691 PolarHBondContact O-N 2.86Å; T688-E691 VanDerWaalsContact O-N 3.08Å; T688-E691 VanDerWaalsContact OG1-CG 3.25Å; T688-E691 WeakPolarHBondContact OG1-CG 3.39Å; T688-E691 PolarHBondContact OG1-OE2 2.88Å; T688-I692 WeakPolarHBondContact O-CG1 3.48Å; T688-I692 PolarHBondContact O-N 2.87Å; T688-I692 VanDerWaalsContact O-N 3.09Å
689	D	62.6	Low	62.3	Low	62 Å²	62	72.7 Å²	72.7	33%	0.332	42%	0.417	S	S	.	.	H	α-helix	trans	-62.4	-28.6	-174.3	-144.8	11.3	0	0	0	113	R679 K683 Q693	R679-D689 IonicContact CZ-OD1 3.99Å; R679-D689 VanDerWaalsContact CZ-OD1 3.25Å; R679-D689 IonicContact NE-OD1 3.2Å; R679-D689 PolarHBondContact NE-OD1 3.4Å; R679-D689 IonicContact NH2-OD1 3.73Å; R679-D689 PolarHBondContact NH2-OD1 2.93Å; R679-D689 IonicContact NH2-OD2 2.78Å; R679-D689 PolarHBondContact NH2-OD2 3.09Å; K683-D689 WeakPolarHBondContact CE-OD1 3.44Å; K683-D689 WeakPolarHBondContact CE-OD2 3.46Å; K683-D689 IonicContact NZ-OD1 2.8Å; K683-D689 PolarHBondContact NZ-OD1 3.17Å; K683-D689 IonicContact NZ-OD2 2.78Å; K683-D689 PolarHBondContact NZ-OD2 3.03Å; D689-Q693 VanDerWaalsContact O-CB 3.3Å; D689-Q693 WeakPolarHBondContact O-CB 3.45Å; D689-Q693 PolarHBondContact O-N 2.69Å
690	A	65.1	Low	61.9	Low	71 Å²	71	73.3 Å²	73.3	59%	0.587	42%	0.424	S	S	*	.	H	α-helix	trans	-73	-37.3	175.6	0	0	0	0	0	112.9	T688 A694	T688-A690 PolarHBondContact O-N 3.43Å; T688-A690 VanDerWaalsContact O-N 3.17Å; A690-A694 VanDerWaalsContact O-CB 3.29Å; A690-A694 WeakPolarHBondContact O-CB 3.44Å; A690-A694 PolarHBondContact O-N 3.27Å
691	E	64.6	Low	61.6	Low	96 Å²	96	73.6 Å²	73.6	45%	0.449	43%	0.425	S	S	.	.	H	α-helix	trans	-66.6	-43.9	174.4	-69.7	163.3	138.5	0	0	110.7	T688 Q693 A694 I695	T688-E691 WeakPolarHBondContact CB-OE2 3.38Å; T688-E691 PolarHBondContact N-OE2 2.74Å; T688-E691 PolarHBondContact O-N 2.86Å; T688-E691 VanDerWaalsContact O-N 3.08Å; T688-E691 VanDerWaalsContact OG1-CG 3.25Å; T688-E691 WeakPolarHBondContact OG1-CG 3.39Å; T688-E691 PolarHBondContact OG1-OE2 2.88Å; E691-Q693 PolarHBondContact O-N 2.78Å; E691-A694 PolarHBondContact O-N 3.47Å; E691-I695 WeakPolarHBondContact O-CG1 3.44Å; E691-I695 PolarHBondContact O-N 3.2Å
692	I	64	Low	61.3	Low	3 Å²	3	75.5 Å²	75.5	2%	0.015	44%	0.439	C	S	.	.	H	α-helix	trans	-59.9	-48	177	-63.3	167.6	0	0	0	109.9	R679 L682 K683 H687 T688 A694 I695 F696	R679-I692 HydrophobicContact CG-CG2 4.25Å; L682-I692 HydrophobicContact CB-CD1 3.79Å; L682-I692 HydrophobicContact CB-CG1 4.07Å; L682-I692 HydrophobicContact CD1-CG2 4.25Å; K683-I692 HydrophobicContact CG-CD1 3.74Å; H687-I692 HydrophobicContact CB-CD1 4.09Å; H687-I692 HydrophobicContact CB-CG1 3.92Å; T688-I692 WeakPolarHBondContact O-CG1 3.48Å; T688-I692 PolarHBondContact O-N 2.87Å; T688-I692 VanDerWaalsContact O-N 3.09Å; I692-A694 VanDerWaalsContact C-N 3.35Å; I692-A694 PolarHBondContact O-N 2.88Å; I692-I695 PolarHBondContact O-N 3.11Å; I692-F696 HydrophobicContact CG2-CD2 3.79Å; I692-F696 HydrophobicContact CG2-CE2 3.49Å; I692-F696 VanDerWaalsContact CG2-CE2 3.49Å; I692-F696 WeakPolarHBondContact O-CD2 3.43Å; I692-F696 PolarHBondContact O-N 3.5Å; I692-F696 VanDerWaalsContact O-N 3.13Å
693	Q	62.2	Low	60.9	Low	121 Å²	121	77 Å²	77	57%	0.565	46%	0.463	S	S	*	.	H	α-helix	trans	-66.4	-33.6	179.5	-166	167.4	15.2	0	0	113.1	D689 E691 A697	D689-Q693 VanDerWaalsContact O-CB 3.3Å; D689-Q693 WeakPolarHBondContact O-CB 3.45Å; D689-Q693 PolarHBondContact O-N 2.69Å; E691-Q693 PolarHBondContact O-N 2.78Å; Q693-A697 WeakPolarHBondContact O-CB 3.26Å; Q693-A697 PolarHBondContact O-N 2.81Å
694	A	65	Low	60.3	Low	65 Å²	65	76.2 Å²	76.2	54%	0.537	46%	0.463	S	S	.	.	H	α-helix	trans	-70.4	-32.3	175.2	0	0	0	0	0	113.3	A690 E691 I692	A690-A694 VanDerWaalsContact O-CB 3.29Å; A690-A694 WeakPolarHBondContact O-CB 3.44Å; A690-A694 PolarHBondContact O-N 3.27Å; E691-A694 PolarHBondContact O-N 3.47Å; I692-A694 VanDerWaalsContact C-N 3.35Å; I692-A694 PolarHBondContact O-N 2.88Å
695	I	63	Low	60.2	Low	81 Å²	81	77.9 Å²	77.9	42%	0.415	46%	0.461	S	S	.	.	H	α-helix	trans	-68.7	-46.7	173.4	-67.5	163.1	0	0	0	110	E691 I692 A697 K698 Y699	E691-I695 WeakPolarHBondContact O-CG1 3.44Å; E691-I695 PolarHBondContact O-N 3.2Å; I692-I695 PolarHBondContact O-N 3.11Å; I695-A697 PolarHBondContact O-N 2.87Å; I695-K698 WeakPolarHBondContact O-CB 3.12Å; I695-K698 PolarHBondContact O-N 3.23Å; I695-K698 VanDerWaalsContact O-N 3.15Å; I695-Y699 WeakPolarHBondContact O-CD2 3.16Å
696	F	63.7	Low	60.3	Low	18 Å²	18	79.4 Å²	79.4	8%	0.079	47%	0.47	C	S	.	.	H	α-helix	trans	-62.1	-43.4	177.4	-74.7	-61.3	0	0	0	112.5	F675 L678 I692 K698 Y699 D700 L707	F675-F696 HydrophobicContact CE2-CD1 4.44Å; F675-F696 AromaticContact CE2-CD2 3.99Å; F675-F696 HydrophobicContact CE2-CD2 3.99Å; F675-F696 HydrophobicContact CE2-CE2 4.04Å; F675-F696 HydrophobicContact CE2-CG 4.2Å; F675-F696 HydrophobicContact CE2-CZ 4.32Å; L678-F696 HydrophobicContact CD2-CE1 4.13Å; L678-F696 HydrophobicContact CD2-CZ 3.82Å; L678-F696 HydrophobicContact CG-CZ 4.22Å; I692-F696 HydrophobicContact CG2-CD2 3.79Å; I692-F696 HydrophobicContact CG2-CE2 3.49Å; I692-F696 VanDerWaalsContact CG2-CE2 3.49Å; I692-F696 WeakPolarHBondContact O-CD2 3.43Å; I692-F696 PolarHBondContact O-N 3.5Å; I692-F696 VanDerWaalsContact O-N 3.13Å; F696-K698 PolarHBondContact O-N 3.15Å; F696-Y699 PolarHBondContact O-N 3.47Å; F696-D700 WeakPolarHBondContact O-CB 3.37Å; F696-D700 PolarHBondContact O-N 3.21Å; F696-L707 HydrophobicContact CD1-CD1 3.81Å; F696-L707 HydrophobicContact CD1-CD2 4.2Å; F696-L707 HydrophobicContact CE1-CD1 3.7Å; F696-L707 HydrophobicContact CE1-CD2 4.38Å
697	A	66.3	Low	60.7	Low	79 Å²	79	78.7 Å²	78.7	65%	0.653	45%	0.451	S	S	*	.	H	α-helix	trans	-63.7	-7.8	176.7	0	0	0	0	0	115	Q693 I695	Q693-A697 WeakPolarHBondContact O-CB 3.26Å; Q693-A697 PolarHBondContact O-N 2.81Å; I695-A697 PolarHBondContact O-N 2.87Å
698	K	65.7	Low	60.8	Low	127 Å²	127	79.4 Å²	79.4	55%	0.552	46%	0.459	S	S	*	.	H	α-helix	trans	-87.2	-23.1	173	-169	-171.7	170.4	-151.1	0	112.5	I695 F696	I695-K698 WeakPolarHBondContact O-CB 3.12Å; I695-K698 PolarHBondContact O-N 3.23Å; I695-K698 VanDerWaalsContact O-N 3.15Å; F696-K698 PolarHBondContact O-N 3.15Å
699	Y	62.8	Low	60.4	Low	23 Å²	23	81.8 Å²	81.8	9%	0.09	47%	0.465	C	S	.	.	H	α-helix	trans	-120.8	-24.8	-170.2	-69.4	-71.2	0	0	0	114.6	I695 F696 Q701 M715 D718	I695-Y699 WeakPolarHBondContact O-CD2 3.16Å; F696-Y699 PolarHBondContact O-N 3.47Å; Y699-Q701 PolarHBondContact O-N 3.13Å; Y699-M715 HydrophobicContact CD1-CB 4.45Å; Y699-M715 HydrophobicContact CD2-SD 4.44Å; Y699-M715 HydrophobicContact CG-CB 4.44Å; Y699-D718 HydrophobicContact CE1-CB 4.43Å; Y699-D718 VanDerWaalsContact CE1-OD2 3.24Å; Y699-D718 WeakPolarHBondContact CE1-OD2 3.49Å; Y699-D718 PolarHBondContact OH-OD2 3.1Å
700	D	60.7	Low	60.2	Low	65 Å²	65	86 Å²	86	35%	0.348	48%	0.483	S	S	.	.			trans	-70.2	114.2	169.2	173.1	5.1	0	0	0	109.9	F696 V702 G703	F696-D700 WeakPolarHBondContact O-CB 3.37Å; F696-D700 PolarHBondContact O-N 3.21Å; D700-V702 PolarHBondContact OD1-N 2.91Å; D700-G703 WeakPolarHBondContact OD1-CA 3.45Å; D700-G703 PolarHBondContact OD1-N 2.86Å
701	Q	56.6	Low	60.2	Low	153 Å²	153	83.4 Å²	83.4	72%	0.715	46%	0.458	S	S	*	.			trans	-108.2	-5.1	178.1	-70.1	-171.1	11	0	0	114.3	Y699 E711	Y699-Q701 PolarHBondContact O-N 3.13Å; Q701-E711 PolarHBondContact N-OE1 3.48Å
702	V	53.9	Low	60.1	Low	106 Å²	106	81 Å²	81	64%	0.642	45%	0.447	S	S	*	.	S	Bend	trans	-120	-20.9	-169.3	-171.6	0	0	0	0	112.7	D700	D700-V702 PolarHBondContact OD1-N 2.91Å
703	G	55.6	Low	60.1	Low	66 Å²	66	84.5 Å²	84.5	68%	0.68	46%	0.463	S	S	*	.			trans	76.6	27.5	171.1	0	0	0	0	0	114.4	D700	D700-G703 WeakPolarHBondContact OD1-CA 3.45Å; D700-G703 PolarHBondContact OD1-N 2.86Å
704	D	54.8	Low	60.4	Low	78 Å²	78	82.6 Å²	82.6	42%	0.417	45%	0.454	S	S	.	.	S	Bend	trans	-108.7	156.9	171.9	63.5	-33.5	0	0	0	111.8	E706	D704-E706 PolarHBondContact O-N 3.47Å; D704-E706 VanDerWaalsContact O-N 3.1Å
705	P	54.5	Low	60.4	Low	106 Å²	106	80.3 Å²	80.3	69%	0.688	43%	0.433	S	S	*	.	S	Bend	trans	-79.7	13.1	-167.5	31.8	-36.3	0	0	0	115.2
706	E	54.7	Low	60.5	Low	142 Å²	142	79.9 Å²	79.9	66%	0.664	43%	0.426	S	S	*	.	S	Bend	trans	-132.7	111.5	-179.6	-68.7	-174.5	-177.2	0	0	110.4	D704 T708	D704-E706 PolarHBondContact O-N 3.47Å; D704-E706 VanDerWaalsContact O-N 3.1Å; E706-T708 PolarHBondContact O-N 2.93Å
707	L	55.5	Low	60.7	Low	50 Å²	50	83 Å²	83	26%	0.262	44%	0.443	S	S	.	.			trans	-63	128.1	174.6	-74.4	99.9	0	0	0	110.7	F675 F696 E711 M715	F675-L707 HydrophobicContact CD2-CD1 4.24Å; F696-L707 HydrophobicContact CD1-CD1 3.81Å; F696-L707 HydrophobicContact CD1-CD2 4.2Å; F696-L707 HydrophobicContact CE1-CD1 3.7Å; F696-L707 HydrophobicContact CE1-CD2 4.38Å; L707-E711 HydrophobicContact CD2-CB 4.39Å; L707-M715 HydrophobicContact CD2-CE 4.1Å
708	T	58.5	Low	61	Low	77 Å²	77	82.1 Å²	82.1	47%	0.472	43%	0.428	S	S	.	.			trans	-69	151.7	177	0.4	0	0	0	0	111.6	E706 H710 E711 H712	E706-T708 PolarHBondContact O-N 2.93Å; T708-H710 PolarHBondContact O-N 2.85Å; T708-E711 PolarHBondContact N-OE2 3.2Å; T708-E711 PolarHBondContact O-N 3.01Å; T708-E711 PolarHBondContact OG1-OE2 2.69Å; T708-H712 PolarHBondContact O-N 2.92Å
709	E	57.9	Low	60.7	Low	129 Å²	129	77.6 Å²	77.6	60%	0.603	41%	0.409	S	S	*	.	H	α-helix	trans	-50.6	-29.4	176.3	-166.8	85.3	-131.2	0	0	112.5	Q713	E709-Q713 WeakPolarHBondContact O-CB 3.44Å; E709-Q713 PolarHBondContact O-N 3.37Å
710	H	59.4	Low	60.8	Low	151 Å²	151	81.2 Å²	81.2	70%	0.699	43%	0.427	S	S	*	.	H	α-helix	trans	-76.1	-36.8	178.3	-155.3	-38.5	0	0	0	113.9	T708 Q713 Q714	T708-H710 PolarHBondContact O-N 2.85Å; H710-Q713 PolarHBondContact O-N 2.85Å; H710-Q714 PolarHBondContact O-N 3.37Å
711	E	64.9	Low	61.3	Low	15 Å²	15	84.2 Å²	84.2	7%	0.07	44%	0.437	C	S	.	.	H	α-helix	trans	-73.3	-38.6	174.9	-64	167.4	130.4	0	0	110.1	Q701 L707 T708 Q713 Q714 M715	Q701-E711 PolarHBondContact N-OE1 3.48Å; L707-E711 HydrophobicContact CD2-CB 4.39Å; T708-E711 PolarHBondContact N-OE2 3.2Å; T708-E711 PolarHBondContact O-N 3.01Å; T708-E711 PolarHBondContact OG1-OE2 2.69Å; E711-Q713 VanDerWaalsContact C-N 3.29Å; E711-Q713 PolarHBondContact O-N 2.9Å; E711-Q714 PolarHBondContact O-N 3.23Å; E711-M715 WeakPolarHBondContact O-CB 3.39Å; E711-M715 PolarHBondContact O-N 3.18Å
712	H	62.6	Low	61.5	Low	47 Å²	47	81.7 Å²	81.7	22%	0.218	43%	0.425	C	S	.	.	H	α-helix	trans	-62.3	-35.4	172.8	-167.7	-91.7	0	0	0	112.2	T708 R716	T708-H712 PolarHBondContact O-N 2.92Å; H712-R716 PolarHBondContact CE1-NH1 3.37Å; H712-R716 VanDerWaalsContact CE1-NH1 3.26Å; H712-R716 VanDerWaalsContact ND1-CZ 3.29Å; H712-R716 PolarHBondContact ND1-NH1 3.39Å; H712-R716 PolarHBondContact ND1-NH2 3.36Å; H712-R716 WeakPolarHBondContact O-CG 3.47Å; H712-R716 PolarHBondContact O-N 2.9Å
713	Q	62.9	Low	61.8	Low	76 Å²	76	79.6 Å²	79.6	36%	0.355	41%	0.406	S	S	.	.	H	α-helix	trans	-69.8	-45.7	171.6	-169.8	59.8	32.7	0	0	112.1	E709 H710 E711 M715 R716 D717	E709-Q713 WeakPolarHBondContact O-CB 3.44Å; E709-Q713 PolarHBondContact O-N 3.37Å; H710-Q713 PolarHBondContact O-N 2.85Å; E711-Q713 VanDerWaalsContact C-N 3.29Å; E711-Q713 PolarHBondContact O-N 2.9Å; Q713-M715 VanDerWaalsContact C-N 3.3Å; Q713-M715 PolarHBondContact O-N 3.19Å; Q713-R716 WeakPolarHBondContact O-CB 3.48Å; Q713-R716 PolarHBondContact O-N 3.23Å; Q713-D717 PolarHBondContact NE2-OD1 2.8Å; Q713-D717 VanDerWaalsContact O-CG 3.31Å; Q713-D717 PolarHBondContact O-N 3.12Å
714	Q	68.5	Low	62.1	Low	80 Å²	80	82.1 Å²	82.1	37%	0.374	40%	0.4	S	S	.	.	H	α-helix	trans	-59.9	-39.7	179.5	-175	173.5	-4.8	0	0	112.5	H710 E711 D717 D718	H710-Q714 PolarHBondContact O-N 3.37Å; E711-Q714 PolarHBondContact O-N 3.23Å; Q714-D717 PolarHBondContact O-N 3.18Å; Q714-D718 WeakPolarHBondContact O-CB 3.31Å; Q714-D718 PolarHBondContact O-N 2.97Å
715	M	66.4	Low	62.5	Low	18 Å²	18	82.7 Å²	82.7	9%	0.089	40%	0.403	C	S	.	.	H	α-helix	trans	-66.4	-34.6	174.3	176.5	168.4	43	0	0	112.7	Y699 L707 E711 Q713 L719	Y699-M715 HydrophobicContact CD1-CB 4.45Å; Y699-M715 HydrophobicContact CD2-SD 4.44Å; Y699-M715 HydrophobicContact CG-CB 4.44Å; L707-M715 HydrophobicContact CD2-CE 4.1Å; E711-M715 WeakPolarHBondContact O-CB 3.39Å; E711-M715 PolarHBondContact O-N 3.18Å; Q713-M715 VanDerWaalsContact C-N 3.3Å; Q713-M715 PolarHBondContact O-N 3.19Å; M715-L719 HydrophobicContact CG-CD1 4.08Å; M715-L719 WeakPolarHBondContact O-CB 3.48Å; M715-L719 WeakPolarHBondContact O-CD1 3.37Å; M715-L719 VanDerWaalsContact O-CG 3.25Å; M715-L719 WeakPolarHBondContact O-CG 3.38Å; M715-L719 PolarHBondContact O-N 2.91Å
716	R	63.5	Low	62.5	Low	72 Å²	72	81.3 Å²	81.3	27%	0.272	39%	0.389	S	S	.	.	H	α-helix	trans	-66.3	-47.9	172.3	-77.6	-171.2	-69.7	-133	-4.7	111.5	L666 H712 Q713 D718 L719 E720	L666-R716 HydrophobicContact CD1-CG 4.45Å; H712-R716 PolarHBondContact CE1-NH1 3.37Å; H712-R716 VanDerWaalsContact CE1-NH1 3.26Å; H712-R716 VanDerWaalsContact ND1-CZ 3.29Å; H712-R716 PolarHBondContact ND1-NH1 3.39Å; H712-R716 PolarHBondContact ND1-NH2 3.36Å; H712-R716 WeakPolarHBondContact O-CG 3.47Å; H712-R716 PolarHBondContact O-N 2.9Å; Q713-R716 WeakPolarHBondContact O-CB 3.48Å; Q713-R716 PolarHBondContact O-N 3.23Å; R716-D718 PolarHBondContact O-N 3.06Å; R716-L719 PolarHBondContact O-N 2.58Å; R716-E720 WeakPolarHBondContact O-CB 3.33Å; R716-E720 PolarHBondContact O-N 2.8Å
717	D	69.6	Low	62.3	Low	83 Å²	83	76.9 Å²	76.9	44%	0.444	37%	0.368	S	S	.	.	H	α-helix	trans	-64.5	-40.3	-177	-62	-12	0	0	0	111.6	Q713 Q714 K721	Q713-D717 PolarHBondContact NE2-OD1 2.8Å; Q713-D717 VanDerWaalsContact O-CG 3.31Å; Q713-D717 PolarHBondContact O-N 3.12Å; Q714-D717 PolarHBondContact O-N 3.18Å; D717-K721 VanDerWaalsContact O-CB 3.31Å; D717-K721 WeakPolarHBondContact O-CB 3.47Å; D717-K721 PolarHBondContact O-N 3.11Å
718	D	71.2	Confident	62.5	Low	61 Å²	61	79.9 Å²	79.9	33%	0.326	38%	0.384	S	S	.	.	H	α-helix	trans	-63.2	-43.5	173.7	-98	11.2	0	0	0	112.4	Y699 Q714 R716 K721 E722	Y699-D718 HydrophobicContact CE1-CB 4.43Å; Y699-D718 VanDerWaalsContact CE1-OD2 3.24Å; Y699-D718 WeakPolarHBondContact CE1-OD2 3.49Å; Y699-D718 PolarHBondContact OH-OD2 3.1Å; Q714-D718 WeakPolarHBondContact O-CB 3.31Å; Q714-D718 PolarHBondContact O-N 2.97Å; R716-D718 PolarHBondContact O-N 3.06Å; D718-K721 PolarHBondContact O-N 2.93Å; D718-E722 PolarHBondContact O-N 2.79Å
719	L	61	Low	62.3	Low	32 Å²	32	82 Å²	82	17%	0.168	39%	0.389	C	S	.	.	H	α-helix	trans	-70.6	-35.5	179.1	-76.7	170	0	0	0	112.5	I662 L666 M715 R716 K721 R723	I662-L719 HydrophobicContact CG2-CD1 3.88Å; L666-L719 HydrophobicContact CD1-CD1 3.81Å; M715-L719 HydrophobicContact CG-CD1 4.08Å; M715-L719 WeakPolarHBondContact O-CB 3.48Å; M715-L719 WeakPolarHBondContact O-CD1 3.37Å; M715-L719 VanDerWaalsContact O-CG 3.25Å; M715-L719 WeakPolarHBondContact O-CG 3.38Å; M715-L719 PolarHBondContact O-N 2.91Å; R716-L719 PolarHBondContact O-N 2.58Å; L719-K721 VanDerWaalsContact C-N 3.34Å; L719-R723 WeakPolarHBondContact O-CB 3.46Å; L719-R723 PolarHBondContact O-N 2.85Å
720	E	64.6	Low	62	Low	99 Å²	99	80.7 Å²	80.7	46%	0.463	38%	0.378	S	S	.	.	H	α-helix	trans	-69.2	-36.3	175.4	-166.5	136.5	-126.5	0	0	110.6	R716 R723 E724	R716-E720 WeakPolarHBondContact O-CB 3.33Å; R716-E720 PolarHBondContact O-N 2.8Å; E720-R723 WeakPolarHBondContact O-CB 3.44Å; E720-R723 PolarHBondContact O-N 3.37Å; E720-E724 WeakPolarHBondContact O-CG 3.38Å; E720-E724 PolarHBondContact O-N 2.73Å
721	K	70.1	Confident	61.4	Low	127 Å²	127	78.5 Å²	78.5	55%	0.552	37%	0.372	S	S	*	.	H	α-helix	trans	-67.3	-47.6	171.9	-174.6	-179.1	176.1	-173	0	113.5	D717 D718 L719 R723 E724 D725	D717-K721 VanDerWaalsContact O-CB 3.31Å; D717-K721 WeakPolarHBondContact O-CB 3.47Å; D717-K721 PolarHBondContact O-N 3.11Å; D718-K721 PolarHBondContact O-N 2.93Å; L719-K721 VanDerWaalsContact C-N 3.34Å; K721-R723 PolarHBondContact O-N 2.96Å; K721-E724 PolarHBondContact O-N 2.94Å; K721-E724 VanDerWaalsContact O-N 3.14Å; K721-D725 PolarHBondContact O-N 3.47Å
722	E	60.8	Low	60.4	Low	101 Å²	101	82 Å²	82	47%	0.472	40%	0.398	S	S	.	.	H	α-helix	trans	-60.2	-34.5	173	-81.6	-166.4	170.6	0	0	111.4	D718 L726	D718-E722 PolarHBondContact O-N 2.79Å; E722-L726 WeakPolarHBondContact O-CB 3.39Å; E722-L726 VanDerWaalsContact O-CG 3.24Å; E722-L726 WeakPolarHBondContact O-CG 3.48Å; E722-L726 PolarHBondContact O-N 2.73Å
723	R	60.1	Low	59.6	Low	62 Å²	62	85.7 Å²	85.7	23%	0.234	42%	0.418	C	S	.	.	H	α-helix	trans	-64.7	-44.8	173.2	-177.4	-169.8	177.6	-65.7	-24.5	111.6	V659 L719 E720 K721 L726 E727	V659-R723 HydrophobicContact CG1-CB 4.26Å; L719-R723 WeakPolarHBondContact O-CB 3.46Å; L719-R723 PolarHBondContact O-N 2.85Å; E720-R723 WeakPolarHBondContact O-CB 3.44Å; E720-R723 PolarHBondContact O-N 3.37Å; K721-R723 PolarHBondContact O-N 2.96Å; R723-L726 PolarHBondContact O-N 3.41Å; R723-E727 IonicContact CZ-OE1 2.83Å; R723-E727 IonicContact CZ-OE2 2.76Å; R723-E727 VanDerWaalsContact CZ-OE2 3.28Å; R723-E727 IonicContact NH1-OE1 2.8Å; R723-E727 IonicContact NH1-OE2 3.25Å; R723-E727 PolarHBondContact NH1-OE2 2.81Å; R723-E727 IonicContact NH2-OE1 3.21Å; R723-E727 PolarHBondContact NH2-OE1 3.39Å; R723-E727 IonicContact NH2-OE2 3.07Å; R723-E727 PolarHBondContact NH2-OE2 3.45Å; R723-E727 VanDerWaalsContact NH2-OE2 3.09Å; R723-E727 WeakPolarHBondContact O-CG 3.44Å; R723-E727 PolarHBondContact O-N 2.87Å
724	E	62	Low	58.2	Low	118 Å²	118	87.2 Å²	87.2	55%	0.551	43%	0.433	S	S	*	.	H	α-helix	trans	-63	-43.6	175.3	-75.5	-172.1	161.9	0	0	112.3	E720 K721 L726 E727 L728	E720-E724 WeakPolarHBondContact O-CG 3.38Å; E720-E724 PolarHBondContact O-N 2.73Å; K721-E724 PolarHBondContact O-N 2.94Å; K721-E724 VanDerWaalsContact O-N 3.14Å; E724-L726 PolarHBondContact O-N 2.76Å; E724-E727 PolarHBondContact O-N 2.86Å; E724-L728 WeakPolarHBondContact O-CB 3.34Å; E724-L728 WeakPolarHBondContact O-CG 3.37Å; E724-L728 PolarHBondContact O-N 2.86Å
725	D	64.6	Low	56.4	Low	91 Å²	91	94.7 Å²	94.7	49%	0.487	46%	0.458	S	S	.	.	H	α-helix	trans	-61.7	-41.9	176	-77	-30.4	0	0	0	111.5	K721 L728 E729	K721-D725 PolarHBondContact O-N 3.47Å; D725-L728 WeakPolarHBondContact O-CB 3.14Å; D725-L728 PolarHBondContact O-N 3.14Å; D725-E729 PolarHBondContact O-N 3.32Å
726	L	53.5	Low	54.7	Low	76 Å²	76	99.6 Å²	99.6	40%	0.398	49%	0.491	S	S	.	.	H	α-helix	trans	-68.3	-33.4	173.7	-73.5	168.8	0	0	0	112.9	V659 E722 R723 E724 R730	V659-L726 HydrophobicContact CB-CD1 4.48Å; V659-L726 HydrophobicContact CG2-CD1 4.09Å; E722-L726 WeakPolarHBondContact O-CB 3.39Å; E722-L726 VanDerWaalsContact O-CG 3.24Å; E722-L726 WeakPolarHBondContact O-CG 3.48Å; E722-L726 PolarHBondContact O-N 2.73Å; R723-L726 PolarHBondContact O-N 3.41Å; E724-L726 PolarHBondContact O-N 2.76Å; L726-R730 WeakPolarHBondContact O-CB 3.33Å; L726-R730 PolarHBondContact O-N 2.89Å
727	E	51.8	Low	53.1	Low	49 Å²	49	101.6 Å²	101.6	23%	0.229	52%	0.516	C	S	.	.	H	α-helix	trans	-72.2	-33.5	173.2	-72.1	-159.3	130.2	0	0	112.2	R723 E724 R730 N731	R723-E727 IonicContact CZ-OE1 2.83Å; R723-E727 IonicContact CZ-OE2 2.76Å; R723-E727 VanDerWaalsContact CZ-OE2 3.28Å; R723-E727 IonicContact NH1-OE1 2.8Å; R723-E727 IonicContact NH1-OE2 3.25Å; R723-E727 PolarHBondContact NH1-OE2 2.81Å; R723-E727 IonicContact NH2-OE1 3.21Å; R723-E727 PolarHBondContact NH2-OE1 3.39Å; R723-E727 IonicContact NH2-OE2 3.07Å; R723-E727 PolarHBondContact NH2-OE2 3.45Å; R723-E727 VanDerWaalsContact NH2-OE2 3.09Å; R723-E727 WeakPolarHBondContact O-CG 3.44Å; R723-E727 PolarHBondContact O-N 2.87Å; E724-E727 PolarHBondContact O-N 2.86Å; E727-R730 VanDerWaalsContact CD-NH2 3.33Å; E727-R730 IonicContact OE1-CZ 3.01Å; E727-R730 IonicContact OE1-NH1 3.2Å; E727-R730 PolarHBondContact OE1-NH1 2.99Å; E727-R730 IonicContact OE1-NH2 3.06Å; E727-R730 PolarHBondContact OE1-NH2 2.95Å; E727-N731 WeakPolarHBondContact O-CB 3.28Å; E727-N731 PolarHBondContact O-N 3.15Å; E727-N731 PolarHBondContact O-ND2 3.34Å
728	L	58.8	Low	51.3	Low	113 Å²	113	103.7 Å²	103.7	59%	0.592	54%	0.537	S	S	*	.	H	α-helix	trans	-65	-47.4	169.9	-82.3	161.5	0	0	0	111.7	E724 D725 R730 N731 S732	E724-L728 WeakPolarHBondContact O-CB 3.34Å; E724-L728 WeakPolarHBondContact O-CG 3.37Å; E724-L728 PolarHBondContact O-N 2.86Å; D725-L728 WeakPolarHBondContact O-CB 3.14Å; D725-L728 PolarHBondContact O-N 3.14Å; L728-R730 VanDerWaalsContact C-N 3.32Å; L728-R730 PolarHBondContact O-N 2.91Å; L728-N731 PolarHBondContact O-N 2.99Å; L728-S732 PolarHBondContact O-N 3.17Å
729	E	54.7	Low	49.3	Very low	123 Å²	123	104 Å²	104	58%	0.575	56%	0.555	S	S	*	*	H	α-helix	trans	-60.9	-42.7	175.5	-164.2	-176.1	-160.1	0	0	110.7	D725 N731 S732	D725-E729 PolarHBondContact O-N 3.32Å; E729-N731 VanDerWaalsContact C-N 3.35Å; E729-N731 PolarHBondContact O-N 3.39Å; E729-S732 PolarHBondContact O-N 2.95Å; E729-S732 PolarHBondContact O-OG 3.24Å
730	R	51.2	Low	47.8	Very low	101 Å²	101	114.5 Å²	114.5	38%	0.381	59%	0.592	S	S	.	*	H	α-helix	trans	-61.2	-38.8	174.5	-171.1	-179.6	72.7	-168	-0.8	112.7	L726 E727 L728	L726-R730 WeakPolarHBondContact O-CB 3.33Å; L726-R730 PolarHBondContact O-N 2.89Å; E727-R730 VanDerWaalsContact CD-NH2 3.33Å; E727-R730 IonicContact OE1-CZ 3.01Å; E727-R730 IonicContact OE1-NH1 3.2Å; E727-R730 PolarHBondContact OE1-NH1 2.99Å; E727-R730 IonicContact OE1-NH2 3.06Å; E727-R730 PolarHBondContact OE1-NH2 2.95Å; L728-R730 VanDerWaalsContact C-N 3.32Å; L728-R730 PolarHBondContact O-N 2.91Å
731	N	45.8	Very low	46.1	Very low	104 Å²	104	115.3 Å²	115.3	56%	0.556	61%	0.608	S	S	*	*	H	α-helix	trans	-74.4	-30.6	178.7	-71.5	-18.6	0	0	0	112.4	E727 L728 E729 L733	E727-N731 WeakPolarHBondContact O-CB 3.28Å; E727-N731 PolarHBondContact O-N 3.15Å; E727-N731 PolarHBondContact O-ND2 3.34Å; L728-N731 PolarHBondContact O-N 2.99Å; E729-N731 VanDerWaalsContact C-N 3.35Å; E729-N731 PolarHBondContact O-N 3.39Å; N731-L733 PolarHBondContact O-N 3.12Å
732	S	45.5	Very low	44	Very low	88 Å²	88	118.8 Å²	118.8	62%	0.615	62%	0.624	S	S	*	*	H	α-helix	trans	-63	-23.5	176.3	80.8	0	0	0	0	113.8	L728 E729 T734	L728-S732 PolarHBondContact O-N 3.17Å; E729-S732 PolarHBondContact O-N 2.95Å; E729-S732 PolarHBondContact O-OG 3.24Å; S732-T734 PolarHBondContact O-N 3.21Å
733	L	44.9	Very low	42.9	Very low	125 Å²	125	119.6 Å²	119.6	65%	0.654	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	30.1	-172.9	-82	166.8	0	0	0	115	N731	N731-L733 PolarHBondContact O-N 3.12Å
734	T	34.2	Very low	41.3	Very low	108 Å²	108	128 Å²	128	66%	0.663	67%	0.67	S	S	*	*			trans	-140.6	83.4	178.2	-6.2	0	0	0	0	115.9	S732	S732-T734 PolarHBondContact O-N 3.21Å
735	R	29.5	Very low	39.7	Very low	238 Å²	238	128.4 Å²	128.4	90%	0.898	68%	0.68	S	S	*	*			trans	-160.7	103.6	143.5	-145.8	174.3	-171.7	175.9	2.9	113.6
736	P	31.8	Very low	37.9	Very low	120 Å²	120	132.3 Å²	132.3	78%	0.779	70%	0.696	S	S	*	*			trans	-76.2	126.3	159.6	-8.3	25.8	0	0	0	109.2	S738	P736-S738 PolarHBondContact O-N 3.14Å
737	S	28.6	Very low	36.7	Very low	115 Å²	115	134.8 Å²	134.8	80%	0.804	71%	0.709	S	S	*	*			trans	-77.4	104.6	173.5	39.5	0	0	0	0	111.1	G739	S737-G739 PolarHBondContact O-N 3.44Å; S737-G739 VanDerWaalsContact O-N 3.13Å
738	S	33.4	Very low	35.7	Very low	127 Å²	127	139 Å²	139	89%	0.888	73%	0.734	S	S	*	*			trans	-71.1	97	160.9	53.8	0	0	0	0	109.2	P736	P736-S738 PolarHBondContact O-N 3.14Å
739	G	28.6	Very low	34.4	Very low	67 Å²	67	138.6 Å²	138.6	69%	0.691	74%	0.74	S	S	*	*			trans	167.1	89.6	176.8	0	0	0	0	0	115.1	S737	S737-G739 PolarHBondContact O-N 3.44Å; S737-G739 VanDerWaalsContact O-N 3.13Å
740	R	30.1	Very low	33.3	Very low	253 Å²	253	141.5 Å²	141.5	96%	0.955	75%	0.754	S	S	*	*			trans	-149.6	82.4	156.1	-125.8	-177.7	-172.5	179.8	3.8	111.2
741	S	27.8	Very low	32.3	Very low	115 Å²	115	145.3 Å²	145.3	80%	0.804	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-77.1	162.4	152.5	41.4	0	0	0	0	109.9
742	F	26.4	Very low	31.6	Very low	201 Å²	201	147.1 Å²	147.1	88%	0.882	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-77.1	161.1	-171.5	-84.1	-100.9	0	0	0	113.4
743	P	37.8	Very low	31.1	Very low	118 Å²	118	149.7 Å²	149.7	77%	0.766	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-88	153.3	-170.4	35.5	-35.4	0	0	0	113.5
744	R	26.8	Very low	30.6	Very low	238 Å²	238	151.2 Å²	151.2	90%	0.898	80%	0.801	S	S	*	*			trans	-149.8	127.6	153	-127.2	178.4	176.4	117.7	-2.2	112.4
745	T	28.1	Very low	30.7	Very low	126 Å²	126	154.8 Å²	154.8	77%	0.773	81%	0.81	S	S	*	*			trans	0.6	121.3	157.9	50.1	0	0	0	0	119.8
746	Q	26.7	Very low	30.8	Very low	174 Å²	174	149.9 Å²	149.9	81%	0.813	80%	0.802	S	S	*	*			trans	-39.1	124.7	138.9	170.5	175.1	19.6	0	0	113.1
747	D	29	Very low	30.9	Very low	127 Å²	127	149.3 Å²	149.3	68%	0.679	80%	0.801	S	S	*	*				-174	158.7	104.1	-107.6	-21.1	0	0	0	114
748	D	30.4	Very low	31.1	Very low	138 Å²	138	147.5 Å²	147.5	74%	0.738	80%	0.801	S	S	*	*			trans	70.4	135.1	154.6	-63.6	-26.2	0	0	0	125.5
749	S	31.5	Very low	31.1	Very low	105 Å²	105	150.7 Å²	150.7	73%	0.734	80%	0.801	S	S	*	*			trans	60.7	119.3	155.8	44.5	0	0	0	0	118.7
750	E	31.3	Very low	31.4	Very low	184 Å²	184	152.2 Å²	152.2	86%	0.86	80%	0.801	S	S	*	*				80.6	144.7	59.5	-74	-167.4	151.6	0	0	114
751	E	30.3	Very low	31.7	Very low	180 Å²	180	144.7 Å²	144.7	84%	0.841	79%	0.788	S	S	*	*			trans	66.4	149.6	178.6	-60.3	174.7	-176.4	0	0	115.3
752	D	31.6	Very low	32	Very low	143 Å²	143	150.7 Å²	150.7	77%	0.765	79%	0.792	S	S	*	*			cis	179.8	180	-33.5	-112.6	-28.4	0	0	0	104.8
753	D	34.2	Very low	32.4	Very low	141 Å²	141	153.1 Å²	153.1	75%	0.754	80%	0.796	S	S	*	*			trans	64.6	96.3	163.6	-61.7	-17.9	0	0	0	120
754	D	34.3	Very low	32.3	Very low	157 Å²	157	159.8 Å²	159.8	84%	0.84	81%	0.806	S	S	*	*				37.3	154.9	112.9	-77	-27.4	0	0	0	124.1
755	E	35.6	Very low	32.6	Very low	183 Å²	183	151.8 Å²	151.8	86%	0.855	80%	0.797	S	S	*	*			trans	101	131.1	155	-62.2	-140.3	137.9	0	0	122.4
756	D	32.1	Very low	33.1	Very low	136 Å²	136	152.1 Å²	152.1	73%	0.727	81%	0.805	S	S	*	*			trans	76.8	107.4	143.5	-122.5	20.5	0	0	0	124.5
757	S	34.7	Very low	33.6	Very low	107 Å²	107	149.2 Å²	149.2	75%	0.748	80%	0.804	S	S	*	*				35.1	128.1	120.1	-52.2	0	0	0	0	121.3
758	G	31.8	Very low	34.2	Very low	78 Å²	78	148.8 Å²	148.8	80%	0.804	81%	0.811	S	S	*	*			trans	-179.2	77.8	165.3	0	0	0	0	0	117.4
759	H	33.9	Very low	34.6	Very low	193 Å²	193	146 Å²	146	89%	0.894	82%	0.815	S	S	*	*			trans	-33.2	133.8	162.6	-96.7	-107	0	0	0	115.9
760	S	34.5	Very low	35.3	Very low	100 Å²	100	144.6 Å²	144.6	70%	0.699	82%	0.816	S	S	*	*				156.6	133.6	95.8	-161.7	0	0	0	0	117.1
761	S	36.9	Very low	36.4	Very low	95 Å²	95	141.3 Å²	141.3	66%	0.664	81%	0.809	S	S	*	*			trans	79.6	110.4	141.6	72	0	0	0	0	123.5
762	R	35.1	Very low	37.7	Very low	240 Å²	240	135.1 Å²	135.1	91%	0.906	79%	0.785	S	S	*	*				53.7	109.8	124.4	-62.6	176.4	172.1	176.4	-2.7	119.6
763	R	33.8	Very low	39.1	Very low	253 Å²	253	136.4 Å²	136.4	96%	0.955	78%	0.781	S	S	*	*				-162.6	142.4	91.2	-103.5	177.1	179.8	-168.2	0.1	111.9
764	R	36.8	Very low	40.5	Very low	257 Å²	257	136.8 Å²	136.8	97%	0.97	78%	0.778	S	S	*	*			trans	-85.4	127.3	-179.2	-126.4	177.8	-174.7	174.5	0.5	109.5
765	G	33.1	Very low	41.9	Very low	70 Å²	70	134.9 Å²	134.9	72%	0.722	76%	0.764	S	S	*	*			trans	-111.4	145.3	161.9	0	0	0	0	0	109.7
766	S	37.6	Very low	43.2	Very low	134 Å²	134	131.7 Å²	131.7	94%	0.937	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-67.5	130.2	179.8	-59.1	0	0	0	0	111.9
767	S	37.7	Very low	44.8	Very low	113 Å²	113	128.5 Å²	128.5	79%	0.79	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-91.3	145.6	163	50.5	0	0	0	0	110.6	G769	S767-G769 PolarHBondContact O-N 3.2Å
768	S	40.3	Very low	46.5	Very low	117 Å²	117	126.9 Å²	126.9	82%	0.818	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-56.2	128.5	179.9	50.4	0	0	0	0	113.2
769	G	38.9	Very low	48.2	Very low	80 Å²	80	128.3 Å²	128.3	83%	0.825	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-70	129.5	163.2	0	0	0	0	0	110.5	S767	S767-G769 PolarHBondContact O-N 3.2Å
770	G	47.2	Very low	49.7	Very low	75 Å²	75	122.6 Å²	122.6	77%	0.773	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-74.3	152.5	168.7	0	0	0	0	0	111.4
771	V	53.3	Low	51.3	Low	115 Å²	115	125.4 Å²	125.4	70%	0.697	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-55.9	137.1	174.7	176.9	0	0	0	0	110.1	E775	V771-E775 HydrophobicContact CG1-CB 3.67Å
772	S	58.5	Low	52.6	Low	50 Å²	50	129.1 Å²	129.1	35%	0.35	68%	0.675	S	S	.	*	P	Polyproline II helix	trans	-72.9	154.4	-178.6	87.3	0	0	0	0	111.5	E774 E775 F776	S772-E774 PolarHBondContact O-N 2.99Å; S772-E774 PolarHBondContact OG-N 2.99Å; S772-E775 PolarHBondContact N-OE2 3.07Å; S772-E775 VanDerWaalsContact N-OE2 3.08Å; S772-E775 PolarHBondContact O-N 3.47Å; S772-E775 WeakPolarHBondContact OG-CG 3.48Å; S772-E775 PolarHBondContact OG-N 3.29Å; S772-F776 PolarHBondContact O-N 3.05Å
773	Y	60.6	Low	53.9	Low	170 Å²	170	121.4 Å²	121.4	67%	0.667	66%	0.655	S	S	*	*	H	α-helix	trans	-59.8	-28.4	177.4	-178.3	-110.6	0	0	0	112.6	Q777	Y773-Q777 HydrophobicContact CE1-CG 4.36Å; Y773-Q777 PolarHBondContact O-N 2.81Å; Y773-Q777 PolarHBondContact OH-NE2 3.17Å
774	E	63.6	Low	55.1	Low	149 Å²	149	113.1 Å²	113.1	70%	0.696	63%	0.629	S	S	*	*	H	α-helix	trans	-73.9	-43.2	178	-62.6	174.8	176.1	0	0	111.7	S772 F776 Q777 V778	S772-E774 PolarHBondContact O-N 2.99Å; S772-E774 PolarHBondContact OG-N 2.99Å; E774-F776 VanDerWaalsContact C-N 3.29Å; E774-F776 PolarHBondContact O-N 3.46Å; E774-Q777 PolarHBondContact O-N 2.84Å; E774-V778 WeakPolarHBondContact O-CG2 3.42Å; E774-V778 PolarHBondContact O-N 2.87Å
775	E	64.6	Low	56.5	Low	117 Å²	117	108 Å²	108	55%	0.547	62%	0.617	S	S	.	*	H	α-helix	trans	-61.2	-39.8	172.8	-70.4	175.9	141	0	0	111.2	V771 S772 V778 L779	V771-E775 HydrophobicContact CG1-CB 3.67Å; S772-E775 PolarHBondContact N-OE2 3.07Å; S772-E775 VanDerWaalsContact N-OE2 3.08Å; S772-E775 PolarHBondContact O-N 3.47Å; S772-E775 WeakPolarHBondContact OG-CG 3.48Å; S772-E775 PolarHBondContact OG-N 3.29Å; E775-V778 PolarHBondContact O-N 3.42Å; E775-L779 PolarHBondContact O-N 2.71Å
776	F	62.5	Low	57.7	Low	117 Å²	117	109.8 Å²	109.8	51%	0.513	61%	0.608	S	S	.	*	H	α-helix	trans	-61.4	-46.2	173	-178.1	-101.7	0	0	0	112	S772 E774 V778 L779 V780	S772-F776 PolarHBondContact O-N 3.05Å; E774-F776 VanDerWaalsContact C-N 3.29Å; E774-F776 PolarHBondContact O-N 3.46Å; F776-V778 PolarHBondContact O-N 2.76Å; F776-L779 WeakPolarHBondContact O-CB 3.47Å; F776-L779 PolarHBondContact O-N 3.43Å; F776-V780 HydrophobicContact CD1-CG2 4.17Å; F776-V780 HydrophobicContact CE1-CG2 3.78Å; F776-V780 HydrophobicContact CE2-CG2 4.35Å; F776-V780 HydrophobicContact CZ-CG2 3.88Å; F776-V780 WeakPolarHBondContact O-CG2 3.15Å; F776-V780 PolarHBondContact O-N 3.38Å
777	Q	64.5	Low	58.7	Low	69 Å²	69	107.8 Å²	107.8	32%	0.322	58%	0.583	S	S	.	*	H	α-helix	trans	-62.6	-38.7	176.2	-76.8	-159.2	8.4	0	0	113.3	Y773 E774 L779 V780 R781	Y773-Q777 HydrophobicContact CE1-CG 4.36Å; Y773-Q777 PolarHBondContact O-N 2.81Å; Y773-Q777 PolarHBondContact OH-NE2 3.17Å; E774-Q777 PolarHBondContact O-N 2.84Å; Q777-L779 VanDerWaalsContact C-N 3.31Å; Q777-V780 PolarHBondContact O-N 2.62Å; Q777-R781 WeakPolarHBondContact O-CG 3.49Å; Q777-R781 PolarHBondContact O-N 3.46Å
778	V	70.9	Confident	60	Low	72 Å²	72	109.4 Å²	109.4	44%	0.436	58%	0.578	S	S	.	*	H	α-helix	trans	-64.1	-39.4	175.3	172.4	0	0	0	0	110.8	E774 E775 F776 R782	E774-V778 WeakPolarHBondContact O-CG2 3.42Å; E774-V778 PolarHBondContact O-N 2.87Å; E775-V778 PolarHBondContact O-N 3.42Å; F776-V778 PolarHBondContact O-N 2.76Å; V778-R782 WeakPolarHBondContact O-CG 3.23Å; V778-R782 PolarHBondContact O-N 2.85Å
779	L	68.6	Low	61.1	Low	109 Å²	109	106.6 Å²	106.6	57%	0.571	56%	0.558	S	S	*	*	H	α-helix	trans	-65.6	-44.5	175.7	-156.3	77.1	0	0	0	111.7	E775 F776 Q777 R781 R782 V783	E775-L779 PolarHBondContact O-N 2.71Å; F776-L779 WeakPolarHBondContact O-CB 3.47Å; F776-L779 PolarHBondContact O-N 3.43Å; Q777-L779 VanDerWaalsContact C-N 3.31Å; L779-R781 PolarHBondContact O-N 3.14Å; L779-R782 PolarHBondContact O-N 2.97Å; L779-V783 WeakPolarHBondContact O-CG2 3.3Å; L779-V783 PolarHBondContact O-N 2.93Å
780	V	64.1	Low	62.3	Low	72 Å²	72	108.4 Å²	108.4	44%	0.436	54%	0.544	S	S	.	.	H	α-helix	trans	-57.8	-48	176.2	171.9	0	0	0	0	111.1	F776 Q777 R782 V783 D784	F776-V780 HydrophobicContact CD1-CG2 4.17Å; F776-V780 HydrophobicContact CE1-CG2 3.78Å; F776-V780 HydrophobicContact CE2-CG2 4.35Å; F776-V780 HydrophobicContact CZ-CG2 3.88Å; F776-V780 WeakPolarHBondContact O-CG2 3.15Å; F776-V780 PolarHBondContact O-N 3.38Å; Q777-V780 PolarHBondContact O-N 2.62Å; V780-R782 VanDerWaalsContact C-N 3.29Å; V780-R782 PolarHBondContact O-N 2.98Å; V780-V783 PolarHBondContact O-N 2.93Å; V780-V783 VanDerWaalsContact O-N 3.14Å; V780-D784 WeakPolarHBondContact O-CB 3.49Å; V780-D784 PolarHBondContact O-N 3.18Å
781	R	69.6	Low	63.1	Low	159 Å²	159	106.8 Å²	106.8	60%	0.6	53%	0.527	S	S	*	.	H	α-helix	trans	-61.7	-34.2	178.1	-68	178.9	-160.9	155.6	10.6	113.3	Q777 L779 Q785	Q777-R781 WeakPolarHBondContact O-CG 3.49Å; Q777-R781 PolarHBondContact O-N 3.46Å; L779-R781 PolarHBondContact O-N 3.14Å; R781-Q785 PolarHBondContact O-N 3.17Å; R781-Q785 VanDerWaalsContact O-N 3.12Å
782	R	64.3	Low	63.6	Low	173 Å²	173	104.2 Å²	104.2	65%	0.653	51%	0.514	S	S	*	.	H	α-helix	trans	-70.3	-39.6	174.3	-74.8	-178.4	176.9	-173	0.9	112.2	V778 L779 V780 D784 M786	V778-R782 WeakPolarHBondContact O-CG 3.23Å; V778-R782 PolarHBondContact O-N 2.85Å; L779-R782 PolarHBondContact O-N 2.97Å; V780-R782 VanDerWaalsContact C-N 3.29Å; V780-R782 PolarHBondContact O-N 2.98Å; R782-D784 VanDerWaalsContact C-N 3.32Å; R782-M786 WeakPolarHBondContact O-CB 3.32Å; R782-M786 PolarHBondContact O-N 3.35Å
783	V	61.1	Low	64	Low	78 Å²	78	106 Å²	106	47%	0.473	52%	0.519	S	S	.	.	H	α-helix	trans	-64.2	-39.2	174.3	171.6	0	0	0	0	110.7	L779 V780 M786 E787	L779-V783 WeakPolarHBondContact O-CG2 3.3Å; L779-V783 PolarHBondContact O-N 2.93Å; V780-V783 PolarHBondContact O-N 2.93Å; V780-V783 VanDerWaalsContact O-N 3.14Å; V783-M786 CarbonylContact O-C 3.51Å; V783-M786 WeakPolarHBondContact O-CA 3.25Å; V783-M786 WeakPolarHBondContact O-CB 3.25Å; V783-M786 PolarHBondContact O-N 2.79Å; V783-M786 VanDerWaalsContact O-N 3.11Å; V783-E787 PolarHBondContact O-N 3.04Å
784	D	59.8	Low	64.3	Low	79 Å²	79	101.3 Å²	101.3	42%	0.422	51%	0.508	S	S	.	.	H	α-helix	trans	-66.6	-43	179	-144.1	33	0	0	0	112.1	V780 R782 M786 E787 H788	V780-D784 WeakPolarHBondContact O-CB 3.49Å; V780-D784 PolarHBondContact O-N 3.18Å; R782-D784 VanDerWaalsContact C-N 3.32Å; D784-M786 PolarHBondContact O-N 2.82Å; D784-E787 PolarHBondContact O-N 2.94Å; D784-H788 PolarHBondContact O-CD2 3.3Å; D784-H788 PolarHBondContact O-N 2.76Å
785	Q	65.8	Low	64.4	Low	151 Å²	151	98 Å²	98	71%	0.706	50%	0.501	S	S	*	.	H	α-helix	trans	-60.6	-34.6	169.4	-78.4	-174.2	-20.9	0	0	112.6	R781 S789	R781-Q785 PolarHBondContact O-N 3.17Å; R781-Q785 VanDerWaalsContact O-N 3.12Å; Q785-S789 PolarHBondContact O-N 3.29Å; Q785-S789 VanDerWaalsContact O-N 3.16Å
786	M	59.4	Low	64.7	Low	107 Å²	107	99 Å²	99	53%	0.527	50%	0.504	S	S	.	.	H	α-helix	trans	-74.3	-35.3	176.3	-154.2	176	75.2	0	0	111.9	R782 V783 D784 S789 F790	R782-M786 WeakPolarHBondContact O-CB 3.32Å; R782-M786 PolarHBondContact O-N 3.35Å; V783-M786 CarbonylContact O-C 3.51Å; V783-M786 WeakPolarHBondContact O-CA 3.25Å; V783-M786 WeakPolarHBondContact O-CB 3.25Å; V783-M786 PolarHBondContact O-N 2.79Å; V783-M786 VanDerWaalsContact O-N 3.11Å; D784-M786 PolarHBondContact O-N 2.82Å; M786-S789 PolarHBondContact O-N 2.9Å; M786-S789 PolarHBondContact O-OG 2.98Å; M786-F790 HydrophobicContact CG-CD2 4.07Å; M786-F790 HydrophobicContact CG-CE2 4.19Å; M786-F790 WeakPolarHBondContact O-CB 3.43Å; M786-F790 WeakPolarHBondContact O-CD2 3.47Å; M786-F790 PolarHBondContact O-N 2.79Å
787	E	58.4	Low	65.1	Low	91 Å²	91	97.6 Å²	97.6	43%	0.425	50%	0.5	S	S	.	.	H	α-helix	trans	-61.3	-44	173.3	-168.5	176.4	161	0	0	110.3	K656 V783 D784 F790 G791	K656-E787 IonicContact NZ-OE1 3.54Å; K656-E787 PolarHBondContact NZ-OE1 3.12Å; K656-E787 IonicContact NZ-OE2 3.01Å; K656-E787 PolarHBondContact NZ-OE2 2.98Å; V783-E787 PolarHBondContact O-N 3.04Å; D784-E787 PolarHBondContact O-N 2.94Å; E787-F790 PolarHBondContact O-N 3.35Å; E787-G791 PolarHBondContact O-N 2.96Å
788	H	64.3	Low	65.2	Low	147 Å²	147	98.5 Å²	98.5	68%	0.681	51%	0.507	S	S	*	.	H	α-helix	trans	-63	-41.2	174.1	-87.2	-73.6	0	0	0	113.7	D784 G791 S792	D784-H788 PolarHBondContact O-CD2 3.3Å; D784-H788 PolarHBondContact O-N 2.76Å; H788-G791 PolarHBondContact O-N 2.81Å; H788-S792 PolarHBondContact O-N 3.05Å
789	S	62.8	Low	65.3	Low	58 Å²	58	98 Å²	98	41%	0.406	51%	0.511	S	S	.	.	H	α-helix	trans	-68.8	-39.5	178	72.8	0	0	0	0	111.9	Q785 M786 S792 I793	Q785-S789 PolarHBondContact O-N 3.29Å; Q785-S789 VanDerWaalsContact O-N 3.16Å; M786-S789 PolarHBondContact O-N 2.9Å; M786-S789 PolarHBondContact O-OG 2.98Å; S789-S792 PolarHBondContact O-N 3.11Å; S789-I793 WeakPolarHBondContact O-CG1 3.44Å; S789-I793 PolarHBondContact O-N 3.26Å
790	F	64.2	Low	65.6	Low	119 Å²	119	96.9 Å²	96.9	52%	0.522	51%	0.509	S	S	.	.	H	α-helix	trans	-64	-39.7	172.1	-95.2	-86.4	0	0	0	112.6	M786 E787 S792 I793 V794	M786-F790 HydrophobicContact CG-CD2 4.07Å; M786-F790 HydrophobicContact CG-CE2 4.19Å; M786-F790 WeakPolarHBondContact O-CB 3.43Å; M786-F790 WeakPolarHBondContact O-CD2 3.47Å; M786-F790 PolarHBondContact O-N 2.79Å; E787-F790 PolarHBondContact O-N 3.35Å; F790-S792 VanDerWaalsContact C-N 3.32Å; F790-S792 PolarHBondContact O-N 2.76Å; F790-I793 PolarHBondContact O-N 3.38Å; F790-I793 VanDerWaalsContact O-N 3.13Å; F790-V794 WeakPolarHBondContact O-CG2 3.42Å; F790-V794 PolarHBondContact O-N 2.94Å
791	G	64.6	Low	66	Low	41 Å²	41	97.3 Å²	97.3	42%	0.423	51%	0.507	S	S	.	.	H	α-helix	trans	-57.9	-42.8	175	0	0	0	0	0	112.8	E787 H788 I793 V794 S795	E787-G791 PolarHBondContact O-N 2.96Å; H788-G791 PolarHBondContact O-N 2.81Å; G791-I793 VanDerWaalsContact C-N 3.35Å; G791-I793 PolarHBondContact O-N 3.5Å; G791-V794 PolarHBondContact O-N 3.29Å; G791-S795 WeakPolarHBondContact O-CB 3.43Å; G791-S795 PolarHBondContact O-N 2.69Å
792	S	63.5	Low	66.5	Low	60 Å²	60	94.6 Å²	94.6	42%	0.42	51%	0.509	S	S	.	.	H	α-helix	trans	-64.7	-36.7	174.8	-171.2	0	0	0	0	112.9	H788 S789 F790 K796	H788-S792 PolarHBondContact O-N 3.05Å; S789-S792 PolarHBondContact O-N 3.11Å; F790-S792 VanDerWaalsContact C-N 3.32Å; F790-S792 PolarHBondContact O-N 2.76Å; S792-K796 WeakPolarHBondContact O-CG 3.2Å; S792-K796 PolarHBondContact O-N 3.12Å
793	I	66.9	Low	67.1	Low	87 Å²	87	93.3 Å²	93.3	45%	0.446	51%	0.508	S	S	.	.	H	α-helix	trans	-70.3	-45.2	177.8	-67.3	164.7	0	0	0	110.8	S789 F790 G791 K796 I797	S789-I793 WeakPolarHBondContact O-CG1 3.44Å; S789-I793 PolarHBondContact O-N 3.26Å; F790-I793 PolarHBondContact O-N 3.38Å; F790-I793 VanDerWaalsContact O-N 3.13Å; G791-I793 VanDerWaalsContact C-N 3.35Å; G791-I793 PolarHBondContact O-N 3.5Å; I793-K796 PolarHBondContact O-N 3.41Å; I793-I797 HydrophobicContact CG2-CD1 3.82Å; I793-I797 WeakPolarHBondContact O-CG1 3.44Å; I793-I797 PolarHBondContact O-N 2.93Å
794	V	66.6	Low	67.5	Low	72 Å²	72	94 Å²	94	44%	0.436	51%	0.508	S	S	.	.	H	α-helix	trans	-61.2	-46.2	177.4	172.5	0	0	0	0	110.8	F790 G791 K796 I797 D798	F790-V794 WeakPolarHBondContact O-CG2 3.42Å; F790-V794 PolarHBondContact O-N 2.94Å; G791-V794 PolarHBondContact O-N 3.29Å; V794-K796 VanDerWaalsContact C-N 3.28Å; V794-K796 PolarHBondContact O-N 3.32Å; V794-I797 WeakPolarHBondContact O-CB 3.39Å; V794-I797 PolarHBondContact O-N 3.2Å; V794-D798 PolarHBondContact O-N 3.37Å
795	S	65.4	Low	68.3	Low	79 Å²	79	94.2 Å²	94.2	55%	0.552	51%	0.507	S	S	*	.	H	α-helix	trans	-57.6	-38.6	175.7	175	0	0	0	0	113	G791 A799	G791-S795 WeakPolarHBondContact O-CB 3.43Å; G791-S795 PolarHBondContact O-N 2.69Å; S795-A799 WeakPolarHBondContact O-CB 3.47Å; S795-A799 PolarHBondContact O-N 2.79Å
796	K	71.6	Confident	68.8	Low	139 Å²	139	88.8 Å²	88.8	60%	0.604	49%	0.491	S	S	*	.	H	α-helix	trans	-69.1	-36.6	174.2	-73.7	172.9	-178.8	175.8	0	112.8	S792 I793 V794 V800	S792-K796 WeakPolarHBondContact O-CG 3.2Å; S792-K796 PolarHBondContact O-N 3.12Å; I793-K796 PolarHBondContact O-N 3.41Å; V794-K796 VanDerWaalsContact C-N 3.28Å; V794-K796 PolarHBondContact O-N 3.32Å; K796-V800 VanDerWaalsContact O-CG2 3.3Å; K796-V800 WeakPolarHBondContact O-CG2 3.37Å; K796-V800 PolarHBondContact O-N 3.44Å
797	I	70.2	Confident	69.4	Low	87 Å²	87	88.2 Å²	88.2	45%	0.446	49%	0.488	S	S	.	.	H	α-helix	trans	-66.6	-45.5	175.9	-69.7	166.1	0	0	0	110.2	I793 V794 A799 V800 I801	I793-I797 HydrophobicContact CG2-CD1 3.82Å; I793-I797 WeakPolarHBondContact O-CG1 3.44Å; I793-I797 PolarHBondContact O-N 2.93Å; V794-I797 WeakPolarHBondContact O-CB 3.39Å; V794-I797 PolarHBondContact O-N 3.2Å; I797-A799 PolarHBondContact O-N 2.77Å; I797-V800 CarbonylContact O-C 3.59Å; I797-V800 WeakPolarHBondContact O-CB 3.43Å; I797-V800 PolarHBondContact O-N 2.8Å; I797-V800 VanDerWaalsContact O-N 3.11Å; I797-I801 HydrophobicContact CG2-CD1 3.73Å; I797-I801 HydrophobicContact CG2-CG1 4.35Å; I797-I801 WeakPolarHBondContact O-CG1 3.45Å; I797-I801 PolarHBondContact O-N 3.09Å
798	D	66.9	Low	69.9	Low	88 Å²	88	89.9 Å²	89.9	47%	0.471	50%	0.496	S	S	.	.	H	α-helix	trans	-62.8	-41.4	177.4	-68.7	-28.2	0	0	0	111.4	V794 V800 I801 V802	V794-D798 PolarHBondContact O-N 3.37Å; D798-V800 VanDerWaalsContact C-N 3.3Å; D798-V800 PolarHBondContact O-N 3.01Å; D798-I801 PolarHBondContact O-N 2.8Å; D798-V802 WeakPolarHBondContact O-CG2 3.43Å; D798-V802 PolarHBondContact O-N 3.47Å
799	A	74	Confident	70.4	Confident	62 Å²	62	90 Å²	90	51%	0.512	49%	0.49	S	S	.	.	H	α-helix	trans	-60.8	-37.5	173	0	0	0	0	0	112.7	S795 I797 K803	S795-A799 WeakPolarHBondContact O-CB 3.47Å; S795-A799 PolarHBondContact O-N 2.79Å; I797-A799 PolarHBondContact O-N 2.77Å; A799-K803 WeakPolarHBondContact O-CB 3.35Å; A799-K803 PolarHBondContact O-N 2.87Å; A799-K803 VanDerWaalsContact O-N 3.12Å
800	V	73.3	Confident	71	Confident	86 Å²	86	89 Å²	89	52%	0.521	49%	0.486	S	S	.	.	H	α-helix	trans	-69.5	-41.5	174.4	166.9	0	0	0	0	111.5	K796 I797 D798 K803 L804	K796-V800 VanDerWaalsContact O-CG2 3.3Å; K796-V800 WeakPolarHBondContact O-CG2 3.37Å; K796-V800 PolarHBondContact O-N 3.44Å; I797-V800 CarbonylContact O-C 3.59Å; I797-V800 WeakPolarHBondContact O-CB 3.43Å; I797-V800 PolarHBondContact O-N 2.8Å; I797-V800 VanDerWaalsContact O-N 3.11Å; D798-V800 VanDerWaalsContact C-N 3.3Å; D798-V800 PolarHBondContact O-N 3.01Å; V800-K803 PolarHBondContact O-N 3.13Å; V800-L804 HydrophobicContact CG1-CD1 4.01Å; V800-L804 WeakPolarHBondContact O-CB 3.41Å; V800-L804 PolarHBondContact O-N 3.38Å
801	I	74.1	Confident	71.4	Confident	80 Å²	80	89 Å²	89	41%	0.41	49%	0.486	S	S	.	.	H	α-helix	trans	-62.8	-47.7	177.5	-69.8	167	0	0	0	110.7	I797 D798 K803 L804 E805	I797-I801 HydrophobicContact CG2-CD1 3.73Å; I797-I801 HydrophobicContact CG2-CG1 4.35Å; I797-I801 WeakPolarHBondContact O-CG1 3.45Å; I797-I801 PolarHBondContact O-N 3.09Å; D798-I801 PolarHBondContact O-N 2.8Å; I801-K803 VanDerWaalsContact C-N 3.3Å; I801-K803 PolarHBondContact O-N 3.08Å; I801-L804 WeakPolarHBondContact O-CB 3.44Å; I801-L804 PolarHBondContact O-N 3.48Å; I801-L804 VanDerWaalsContact O-N 3.12Å; I801-E805 PolarHBondContact O-N 3.28Å
802	V	79.3	Confident	71.6	Confident	103 Å²	103	92.4 Å²	92.4	62%	0.624	49%	0.494	S	S	*	.	H	α-helix	trans	-60.5	-39.7	176.4	171.8	0	0	0	0	111.2	D798 G806	D798-V802 WeakPolarHBondContact O-CG2 3.43Å; D798-V802 PolarHBondContact O-N 3.47Å; V802-G806 PolarHBondContact O-N 3.01Å
803	K	76.4	Confident	72.2	Confident	145 Å²	145	96.7 Å²	96.7	63%	0.63	51%	0.505	S	S	*	.	H	α-helix	trans	-68.6	-35.1	175.8	-164.1	169.9	-174.5	175.2	0	112.3	A799 V800 I801 G806 M807	A799-K803 WeakPolarHBondContact O-CB 3.35Å; A799-K803 PolarHBondContact O-N 2.87Å; A799-K803 VanDerWaalsContact O-N 3.12Å; V800-K803 PolarHBondContact O-N 3.13Å; I801-K803 VanDerWaalsContact C-N 3.3Å; I801-K803 PolarHBondContact O-N 3.08Å; K803-G806 PolarHBondContact O-N 3.47Å; K803-M807 WeakPolarHBondContact O-CB 3.37Å; K803-M807 PolarHBondContact O-N 2.86Å
804	L	70.6	Confident	72.7	Confident	92 Å²	92	96 Å²	96	48%	0.482	50%	0.497	S	S	.	.	H	α-helix	trans	-66.7	-47	173.9	-108.1	148.7	0	0	0	111.9	V800 I801 G806 M807 E808	V800-L804 HydrophobicContact CG1-CD1 4.01Å; V800-L804 WeakPolarHBondContact O-CB 3.41Å; V800-L804 PolarHBondContact O-N 3.38Å; I801-L804 WeakPolarHBondContact O-CB 3.44Å; I801-L804 PolarHBondContact O-N 3.48Å; I801-L804 VanDerWaalsContact O-N 3.12Å; L804-G806 VanDerWaalsContact C-N 3.31Å; L804-G806 PolarHBondContact O-N 3.03Å; L804-M807 HydrophobicContact CD2-CE 4.05Å; L804-M807 HydrophobicContact CG-CE 4.35Å; L804-M807 PolarHBondContact O-N 2.87Å; L804-E808 WeakPolarHBondContact O-CB 3.31Å; L804-E808 PolarHBondContact O-N 2.91Å
805	E	75.1	Confident	73	Confident	85 Å²	85	102 Å²	102	40%	0.397	51%	0.511	S	S	.	.	H	α-helix	trans	-60.6	-40.8	173.8	-75.5	-165.1	-169.1	0	0	112	I801 E808 R809	I801-E805 PolarHBondContact O-N 3.28Å; E805-E808 PolarHBondContact O-N 3.49Å; E805-R809 WeakPolarHBondContact O-CB 3.31Å; E805-R809 WeakPolarHBondContact O-CG 3.4Å; E805-R809 PolarHBondContact O-N 3.25Å; E805-R809 IonicContact OE2-CZ 2.65Å; E805-R809 IonicContact OE2-NH1 3.52Å; E805-R809 PolarHBondContact OE2-NH1 3.42Å; E805-R809 IonicContact OE2-NH2 3.57Å; E805-R809 PolarHBondContact OE2-NH2 3.33Å
806	G	76.3	Confident	73.4	Confident	37 Å²	37	102.5 Å²	102.5	38%	0.381	51%	0.508	S	S	.	.	H	α-helix	trans	-59.7	-47.2	174.6	0	0	0	0	0	112	V802 K803 L804 A810	V802-G806 PolarHBondContact O-N 3.01Å; K803-G806 PolarHBondContact O-N 3.47Å; L804-G806 VanDerWaalsContact C-N 3.31Å; L804-G806 PolarHBondContact O-N 3.03Å; G806-A810 WeakPolarHBondContact O-CB 3.17Å; G806-A810 PolarHBondContact O-N 2.9Å
807	M	73.3	Confident	73.6	Confident	95 Å²	95	98.3 Å²	98.3	47%	0.468	49%	0.494	S	S	.	.	H	α-helix	trans	-66.4	-35.6	177	-176.6	175.3	55.7	0	0	112.7	K803 L804 A810 K811	K803-M807 WeakPolarHBondContact O-CB 3.37Å; K803-M807 PolarHBondContact O-N 2.86Å; L804-M807 HydrophobicContact CD2-CE 4.05Å; L804-M807 HydrophobicContact CG-CE 4.35Å; L804-M807 PolarHBondContact O-N 2.87Å; M807-A810 PolarHBondContact O-N 2.84Å; M807-K811 WeakPolarHBondContact O-CG 3.26Å; M807-K811 PolarHBondContact O-N 3.3Å
808	E	69.3	Low	73.6	Confident	125 Å²	125	98 Å²	98	58%	0.584	49%	0.493	S	S	*	.	H	α-helix	trans	-70.6	-44	177.1	-172	168.8	-156.1	0	0	111.5	L804 E805 A810 K811 L812	L804-E808 WeakPolarHBondContact O-CB 3.31Å; L804-E808 PolarHBondContact O-N 2.91Å; E805-E808 PolarHBondContact O-N 3.49Å; E808-A810 VanDerWaalsContact C-N 3.28Å; E808-A810 PolarHBondContact O-N 2.95Å; E808-K811 PolarHBondContact O-N 3.42Å; E808-L812 HydrophobicContact CG-CD1 4.4Å; E808-L812 WeakPolarHBondContact O-CB 3.38Å; E808-L812 PolarHBondContact O-N 2.96Å
809	R	74.5	Confident	73.8	Confident	149 Å²	149	95.1 Å²	95.1	56%	0.562	48%	0.484	S	S	*	.	H	α-helix	trans	-59.9	-37.7	170.7	-71.5	179.7	-173.9	110.2	9.3	111.8	E805 K813	E805-R809 WeakPolarHBondContact O-CB 3.31Å; E805-R809 WeakPolarHBondContact O-CG 3.4Å; E805-R809 PolarHBondContact O-N 3.25Å; E805-R809 IonicContact OE2-CZ 2.65Å; E805-R809 IonicContact OE2-NH1 3.52Å; E805-R809 PolarHBondContact OE2-NH1 3.42Å; E805-R809 IonicContact OE2-NH2 3.57Å; E805-R809 PolarHBondContact OE2-NH2 3.33Å; R809-K813 WeakPolarHBondContact O-CG 3.44Å; R809-K813 PolarHBondContact O-N 2.88Å
810	A	74.4	Confident	73.8	Confident	39 Å²	39	98.9 Å²	98.9	32%	0.322	49%	0.485	S	S	.	.	H	α-helix	trans	-65.5	-47.1	173.9	0	0	0	0	0	111.8	G806 M807 E808 L812 K813 R814	G806-A810 WeakPolarHBondContact O-CB 3.17Å; G806-A810 PolarHBondContact O-N 2.9Å; M807-A810 PolarHBondContact O-N 2.84Å; E808-A810 VanDerWaalsContact C-N 3.28Å; E808-A810 PolarHBondContact O-N 2.95Å; A810-L812 PolarHBondContact O-N 3.49Å; A810-K813 PolarHBondContact O-N 3.45Å; A810-R814 WeakPolarHBondContact O-CG 3.42Å; A810-R814 PolarHBondContact O-N 2.81Å
811	K	72.4	Confident	73.6	Confident	117 Å²	117	96.5 Å²	96.5	51%	0.509	47%	0.469	S	S	.	.	H	α-helix	trans	-62.5	-38.6	176.3	-76.4	-178.9	-180	-178.4	0	112.9	M807 E808 R814 R815	M807-K811 WeakPolarHBondContact O-CG 3.26Å; M807-K811 PolarHBondContact O-N 3.3Å; E808-K811 PolarHBondContact O-N 3.42Å; K811-R814 PolarHBondContact O-N 3.5Å; K811-R815 WeakPolarHBondContact O-CG 3.21Å; K811-R815 PolarHBondContact O-N 3.45Å
812	L	70.1	Confident	73.3	Confident	113 Å²	113	97.6 Å²	97.6	59%	0.592	48%	0.475	S	S	*	.	H	α-helix	trans	-60.2	-48.7	172.4	-89.4	158	0	0	0	111.2	E808 A810 R814 R815 D816	E808-L812 HydrophobicContact CG-CD1 4.4Å; E808-L812 WeakPolarHBondContact O-CB 3.38Å; E808-L812 PolarHBondContact O-N 2.96Å; A810-L812 PolarHBondContact O-N 3.49Å; L812-R814 PolarHBondContact O-N 2.92Å; L812-R815 PolarHBondContact O-N 3.32Å; L812-D816 WeakPolarHBondContact O-CB 3.44Å; L812-D816 PolarHBondContact O-N 2.85Å
813	K	75.9	Confident	72.8	Confident	151 Å²	151	97.1 Å²	97.1	66%	0.657	47%	0.469	S	S	*	.	H	α-helix	trans	-59	-44.5	173.8	-74.8	177.7	176.3	-175.6	0	112.7	R809 A810 R815 D816 V817	R809-K813 WeakPolarHBondContact O-CG 3.44Å; R809-K813 PolarHBondContact O-N 2.88Å; A810-K813 PolarHBondContact O-N 3.45Å; K813-R815 VanDerWaalsContact C-N 3.32Å; K813-R815 PolarHBondContact O-N 2.94Å; K813-D816 PolarHBondContact O-N 3.34Å; K813-V817 WeakPolarHBondContact O-CG2 3.47Å; K813-V817 PolarHBondContact O-N 3.03Å
814	R	76.8	Confident	72.2	Confident	71 Å²	71	98 Å²	98	27%	0.268	47%	0.469	S	S	.	.	H	α-helix	trans	-57.4	-43.2	176.1	-70.6	-178.1	-178.6	174.5	6.1	111.3	A810 K811 L812 L818 W853 D857	A810-R814 WeakPolarHBondContact O-CG 3.42Å; A810-R814 PolarHBondContact O-N 2.81Å; K811-R814 PolarHBondContact O-N 3.5Å; L812-R814 PolarHBondContact O-N 2.92Å; R814-L818 WeakPolarHBondContact O-CB 3.46Å; R814-L818 PolarHBondContact O-N 3.25Å; R814-L818 VanDerWaalsContact O-N 3.08Å; R814-W853 HydrophobicContact CB-CE3 4.28Å; R814-W853 HydrophobicContact CB-CH2 3.61Å; R814-W853 HydrophobicContact CB-CZ2 4Å; R814-W853 HydrophobicContact CB-CZ3 3.78Å; R814-W853 VanDerWaalsContact CD-CE3 3.48Å; R814-W853 HydrophobicContact CG-CD2 3.73Å; R814-W853 HydrophobicContact CG-CE3 3.73Å; R814-W853 HydrophobicContact CG-CG 4.47Å; R814-W853 HydrophobicContact CG-CH2 3.79Å; R814-W853 HydrophobicContact CG-CZ2 3.81Å; R814-W853 HydrophobicContact CG-CZ3 3.76Å; R814-W853 PolarHBondContact NH2-O 2.91Å; R814-D857 IonicContact CZ-OD2 2.75Å; R814-D857 IonicContact NH1-OD2 3.33Å; R814-D857 PolarHBondContact NH1-OD2 2.86Å; R814-D857 IonicContact NH2-OD2 3.86Å; R814-D857 PolarHBondContact NH2-OD2 3.41Å
815	R	72.1	Confident	71.9	Confident	198 Å²	198	96.5 Å²	96.5	75%	0.747	46%	0.463	S	S	*	.	H	α-helix	trans	-68.3	-37.9	175.3	-68.3	-178.8	82.1	155	6.8	113.3	K811 L812 K813 L818 G819	K811-R815 WeakPolarHBondContact O-CG 3.21Å; K811-R815 PolarHBondContact O-N 3.45Å; L812-R815 PolarHBondContact O-N 3.32Å; K813-R815 VanDerWaalsContact C-N 3.32Å; K813-R815 PolarHBondContact O-N 2.94Å; R815-L818 PolarHBondContact O-N 3.37Å; R815-G819 PolarHBondContact O-N 2.67Å
816	D	74.3	Confident	71.3	Confident	91 Å²	91	97.4 Å²	97.4	49%	0.487	47%	0.469	S	S	.	.	H	α-helix	trans	-74.2	-25.5	-179.1	-161.3	54.5	0	0	0	112.7	L812 K813 R820	L812-D816 WeakPolarHBondContact O-CB 3.44Å; L812-D816 PolarHBondContact O-N 2.85Å; K813-D816 PolarHBondContact O-N 3.34Å; D816-R820 VanDerWaalsContact CG-NH2 3.32Å; D816-R820 PolarHBondContact O-NE 3.35Å; D816-R820 PolarHBondContact O-NH2 2.74Å; D816-R820 VanDerWaalsContact O-NH2 3.1Å; D816-R820 IonicContact OD2-CZ 3.96Å; D816-R820 IonicContact OD2-NH1 3.7Å; D816-R820 IonicContact OD2-NH2 3.24Å; D816-R820 PolarHBondContact OD2-NH2 3.11Å
817	V	77.1	Confident	70.6	Confident	50 Å²	50	102.1 Å²	102.1	30%	0.303	48%	0.48	S	S	.	.	H	α-helix	trans	-76	-47.6	168	172.3	0	0	0	0	110.6	K813 G819 R820 L821	K813-V817 WeakPolarHBondContact O-CG2 3.47Å; K813-V817 PolarHBondContact O-N 3.03Å; V817-G819 VanDerWaalsContact C-N 3.33Å; V817-G819 PolarHBondContact O-N 2.98Å; V817-R820 PolarHBondContact O-N 2.84Å; V817-L821 HydrophobicContact CG1-CD1 4.15Å; V817-L821 PolarHBondContact O-N 3.33Å; V817-L821 VanDerWaalsContact O-N 3.08Å
818	L	69.7	Low	70	Confident	82 Å²	82	100 Å²	100	43%	0.429	47%	0.471	S	S	.	.	H	α-helix	trans	-62.8	-37.8	178.9	-170.2	66.4	0	0	0	112.5	R814 R815 L821 L822	R814-L818 WeakPolarHBondContact O-CB 3.46Å; R814-L818 PolarHBondContact O-N 3.25Å; R814-L818 VanDerWaalsContact O-N 3.08Å; R815-L818 PolarHBondContact O-N 3.37Å; L818-L821 PolarHBondContact O-N 3.39Å; L818-L822 HydrophobicContact CG-CD1 4.22Å; L818-L822 WeakPolarHBondContact O-CG 3.47Å; L818-L822 PolarHBondContact O-N 2.94Å
819	G	70.8	Confident	69.5	Low	27 Å²	27	101.3 Å²	101.3	28%	0.278	48%	0.477	S	S	.	.	H	α-helix	trans	-59.9	-46.4	173.4	0	0	0	0	0	112.5	R815 V817 L821 L822 D823	R815-G819 PolarHBondContact O-N 2.67Å; V817-G819 VanDerWaalsContact C-N 3.33Å; V817-G819 PolarHBondContact O-N 2.98Å; G819-L821 VanDerWaalsContact C-N 3.3Å; G819-L821 PolarHBondContact O-N 3.4Å; G819-L822 PolarHBondContact O-N 3.26Å; G819-D823 PolarHBondContact O-N 3.37Å
820	R	74.2	Confident	68.7	Low	140 Å²	140	104.9 Å²	104.9	53%	0.528	49%	0.491	S	S	.	.	H	α-helix	trans	-66	-27.9	176.1	-80.9	178.8	-73.2	-137.7	-8.7	114.2	D816 V817 R824	D816-R820 VanDerWaalsContact CG-NH2 3.32Å; D816-R820 PolarHBondContact O-NE 3.35Å; D816-R820 PolarHBondContact O-NH2 2.74Å; D816-R820 VanDerWaalsContact O-NH2 3.1Å; D816-R820 IonicContact OD2-CZ 3.96Å; D816-R820 IonicContact OD2-NH1 3.7Å; D816-R820 IonicContact OD2-NH2 3.24Å; D816-R820 PolarHBondContact OD2-NH2 3.11Å; V817-R820 PolarHBondContact O-N 2.84Å; R820-R824 WeakPolarHBondContact O-CG 3.32Å; R820-R824 PolarHBondContact O-N 3.36Å
821	L	69.4	Low	68.1	Low	37 Å²	37	109.1 Å²	109.1	19%	0.194	51%	0.507	C	S	.	.	H	α-helix	trans	-72.3	-43.2	172.1	-71.8	165	0	0	0	110.9	V817 L818 G819 R824 V825 M842 V846	V817-L821 HydrophobicContact CG1-CD1 4.15Å; V817-L821 PolarHBondContact O-N 3.33Å; V817-L821 VanDerWaalsContact O-N 3.08Å; L818-L821 PolarHBondContact O-N 3.39Å; G819-L821 VanDerWaalsContact C-N 3.3Å; G819-L821 PolarHBondContact O-N 3.4Å; L821-R824 PolarHBondContact O-N 2.98Å; L821-V825 WeakPolarHBondContact O-CG2 3.47Å; L821-V825 PolarHBondContact O-N 3Å; L821-V825 VanDerWaalsContact O-N 3.08Å; L821-M842 HydrophobicContact CD2-SD 3.89Å; L821-V846 HydrophobicContact CD1-CG2 4.21Å
822	L	67.3	Low	67.3	Low	102 Å²	102	106.9 Å²	106.9	53%	0.534	52%	0.517	S	S	.	.	H	α-helix	trans	-65.5	-40.3	175.9	-76.6	162.3	0	0	0	113	L818 G819 R824 V825 M826	L818-L822 HydrophobicContact CG-CD1 4.22Å; L818-L822 WeakPolarHBondContact O-CG 3.47Å; L818-L822 PolarHBondContact O-N 2.94Å; G819-L822 PolarHBondContact O-N 3.26Å; L822-R824 VanDerWaalsContact C-N 3.32Å; L822-R824 PolarHBondContact O-N 3.45Å; L822-V825 PolarHBondContact O-N 3.19Å; L822-M826 PolarHBondContact O-N 3.33Å
823	D	67.9	Low	66.8	Low	93 Å²	93	111.1 Å²	111.1	50%	0.497	53%	0.526	S	S	.	.	H	α-helix	trans	-63.1	-38.3	175.6	-75.7	-25	0	0	0	111.6	G819 M826 E827	G819-D823 PolarHBondContact O-N 3.37Å; D823-M826 PolarHBondContact O-N 3.08Å; D823-M826 WeakPolarHBondContact OD1-CE 3.41Å; D823-E827 PolarHBondContact O-N 2.6Å
824	R	64.6	Low	65.8	Low	164 Å²	164	110.9 Å²	110.9	62%	0.619	53%	0.531	S	S	*	.	H	α-helix	trans	-63.3	-43.4	172	-80.7	-176.6	174.1	-179	-1.5	112.4	R820 L821 L822 M826 E827 D828	R820-R824 WeakPolarHBondContact O-CG 3.32Å; R820-R824 PolarHBondContact O-N 3.36Å; L821-R824 PolarHBondContact O-N 2.98Å; L822-R824 VanDerWaalsContact C-N 3.32Å; L822-R824 PolarHBondContact O-N 3.45Å; R824-M826 VanDerWaalsContact C-N 3.31Å; R824-M826 PolarHBondContact O-N 2.95Å; R824-E827 PolarHBondContact O-N 3.42Å; R824-D828 PolarHBondContact O-N 3.25Å
825	V	63.8	Low	65	Low	60 Å²	60	112.3 Å²	112.3	36%	0.364	55%	0.548	S	S	.	.	H	α-helix	trans	-59.5	-42.4	175.7	171.6	0	0	0	0	111	L821 L822 D828 E829 M842	L821-V825 WeakPolarHBondContact O-CG2 3.47Å; L821-V825 PolarHBondContact O-N 3Å; L821-V825 VanDerWaalsContact O-N 3.08Å; L822-V825 PolarHBondContact O-N 3.19Å; V825-D828 PolarHBondContact O-N 3.43Å; V825-E829 WeakPolarHBondContact O-CB 3.48Å; V825-E829 PolarHBondContact O-N 2.94Å; V825-M842 HydrophobicContact CG2-CE 4.24Å
826	M	62.1	Low	64.3	Low	105 Å²	105	106.3 Å²	106.3	52%	0.517	53%	0.531	S	S	.	.	H	α-helix	trans	-69.1	-30.1	176	-72.5	-165.1	-62	0	0	114.2	L822 D823 R824 R830	L822-M826 PolarHBondContact O-N 3.33Å; D823-M826 PolarHBondContact O-N 3.08Å; D823-M826 WeakPolarHBondContact OD1-CE 3.41Å; R824-M826 VanDerWaalsContact C-N 3.31Å; R824-M826 PolarHBondContact O-N 2.95Å; M826-R830 PolarHBondContact O-N 3.02Å
827	E	63.6	Low	63.7	Low	135 Å²	135	107.3 Å²	107.3	63%	0.631	54%	0.54	S	S	*	.	H	α-helix	trans	-73.5	-40.3	172.4	-75.2	-155.7	140.3	0	0	112.2	D823 R824 R830 L831	D823-E827 PolarHBondContact O-N 2.6Å; R824-E827 PolarHBondContact O-N 3.42Å; E827-R830 VanDerWaalsContact O-CB 3.32Å; E827-R830 WeakPolarHBondContact O-CB 3.34Å; E827-R830 PolarHBondContact O-N 3.02Å; E827-L831 PolarHBondContact O-N 2.89Å
828	D	60.5	Low	62.9	Low	50 Å²	50	108.8 Å²	108.8	27%	0.267	54%	0.544	S	S	.	.	H	α-helix	trans	-73.6	-34.8	179.1	-79.8	-46.9	0	0	0	112.7	R824 V825 R830 L831 G832 H838	R824-D828 PolarHBondContact O-N 3.25Å; V825-D828 PolarHBondContact O-N 3.43Å; D828-R830 PolarHBondContact O-N 3.2Å; D828-L831 PolarHBondContact O-N 3.09Å; D828-G832 PolarHBondContact O-N 3.49Å; D828-G832 VanDerWaalsContact O-N 3.08Å; D828-H838 IonicContact OD2-NE2 3.4Å
829	E	57.1	Low	62.6	Low	154 Å²	154	111.7 Å²	111.7	72%	0.72	55%	0.549	S	S	*	.	H	α-helix	trans	-59.2	-35.2	167.7	-84.1	-167.3	140.5	0	0	111.9	V825 L831	V825-E829 WeakPolarHBondContact O-CB 3.48Å; V825-E829 PolarHBondContact O-N 2.94Å; E829-L831 VanDerWaalsContact C-N 3.25Å; E829-L831 PolarHBondContact O-N 3.46Å
830	R	58	Low	62.3	Low	223 Å²	223	116 Å²	116	84%	0.842	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-18.6	174.1	-97.4	178.9	166.9	147.2	0	114	M826 E827 D828	M826-R830 PolarHBondContact O-N 3.02Å; E827-R830 VanDerWaalsContact O-CB 3.32Å; E827-R830 WeakPolarHBondContact O-CB 3.34Å; E827-R830 PolarHBondContact O-N 3.02Å; D828-R830 PolarHBondContact O-N 3.2Å
831	L	62	Low	62	Low	128 Å²	128	114.7 Å²	114.7	67%	0.67	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.9	-8.8	-177	-76.5	163.2	0	0	0	113.8	E827 D828 E829	E827-L831 PolarHBondContact O-N 2.89Å; D828-L831 PolarHBondContact O-N 3.09Å; E829-L831 VanDerWaalsContact C-N 3.25Å; E829-L831 PolarHBondContact O-N 3.46Å
832	G	57.1	Low	61.6	Low	70 Å²	70	114.2 Å²	114.2	72%	0.722	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	66.2	43.3	166.7	0	0	0	0	0	114.9	D828	D828-G832 PolarHBondContact O-N 3.49Å; D828-G832 VanDerWaalsContact O-N 3.08Å
833	R	58.3	Low	61.6	Low	202 Å²	202	113.8 Å²	113.8	76%	0.762	55%	0.554	S	S	*	*			trans	-91.5	154.8	171.4	-86.4	-179.2	169.5	164.4	-2	112.3	T835	R833-T835 PolarHBondContact O-N 3.26Å
834	D	55.3	Low	61.8	Low	146 Å²	146	117.4 Å²	117.4	78%	0.781	56%	0.561	S	S	*	*			trans	-46.7	117.4	-177.2	-71.3	-49.8	0	0	0	112.9
835	T	59.2	Low	62.1	Low	102 Å²	102	113.8 Å²	113.8	63%	0.626	55%	0.553	S	S	*	*	H	α-helix	trans	-76.4	-35.3	-162.2	47.9	0	0	0	0	113.7	R833 R839	R833-T835 PolarHBondContact O-N 3.26Å; T835-R839 VanDerWaalsContact O-CB 3.23Å; T835-R839 WeakPolarHBondContact O-CB 3.42Å; T835-R839 PolarHBondContact O-N 3.06Å
836	D	59	Low	62.5	Low	72 Å²	72	113.2 Å²	113.2	39%	0.385	55%	0.55	S	S	.	.	H	α-helix	trans	-82.8	-45.1	-164.3	-65.5	-36.5	0	0	0	113.3	H838 R839 E840	D836-H838 VanDerWaalsContact C-N 3.3Å; D836-H838 PolarHBondContact O-N 3.12Å; D836-R839 PolarHBondContact O-N 3.48Å; D836-R839 IonicContact OD1-NH1 2.65Å; D836-E840 PolarHBondContact O-N 2.85Å
837	V	61.6	Low	63	Low	112 Å²	112	115.5 Å²	115.5	68%	0.679	55%	0.553	S	S	*	*	H	α-helix	trans	-64.4	-37	177.5	-178.1	0	0	0	0	111.2	Q841	V837-Q841 PolarHBondContact O-N 2.83Å
838	H	60.3	Low	63.5	Low	81 Å²	81	114.7 Å²	114.7	38%	0.375	55%	0.549	S	S	.	.	H	α-helix	trans	-75.5	-33.6	177.7	-156.2	51.8	0	0	0	112.3	D828 D836 Q841 M842	D828-H838 IonicContact OD2-NE2 3.4Å; D836-H838 VanDerWaalsContact C-N 3.3Å; D836-H838 PolarHBondContact O-N 3.12Å; H838-Q841 PolarHBondContact O-N 2.79Å; H838-M842 WeakPolarHBondContact O-CB 3.22Å; H838-M842 PolarHBondContact O-N 3.27Å
839	R	62.1	Low	63.9	Low	142 Å²	142	114.9 Å²	114.9	54%	0.536	55%	0.548	S	S	.	.	H	α-helix	trans	-61.5	-46.3	172.2	-167.3	-179.3	81	-141.3	-7	111.4	T835 D836 Q841 M842 E843	T835-R839 VanDerWaalsContact O-CB 3.23Å; T835-R839 WeakPolarHBondContact O-CB 3.42Å; T835-R839 PolarHBondContact O-N 3.06Å; D836-R839 PolarHBondContact O-N 3.48Å; D836-R839 IonicContact OD1-NH1 2.65Å; R839-Q841 VanDerWaalsContact C-N 3.31Å; R839-Q841 PolarHBondContact O-N 2.89Å; R839-M842 PolarHBondContact O-N 3.45Å; R839-E843 HydrophobicContact CG-CG 4.42Å; R839-E843 IonicContact NE-OE1 3.59Å; R839-E843 PolarHBondContact NE-OE1 2.77Å; R839-E843 WeakPolarHBondContact O-CB 3.43Å; R839-E843 WeakPolarHBondContact O-CG 3.5Å; R839-E843 PolarHBondContact O-N 3.18Å
840	E	65.4	Low	64.4	Low	119 Å²	119	112.3 Å²	112.3	56%	0.556	54%	0.539	S	S	*	.	H	α-helix	trans	-60.5	-40.1	175.6	-72.2	-164.4	164	0	0	112.7	D836 E843 R844	D836-E840 PolarHBondContact O-N 2.85Å; E840-E843 PolarHBondContact O-N 3.21Å; E840-R844 WeakPolarHBondContact O-CG 3.14Å; E840-R844 PolarHBondContact O-N 2.69Å
841	Q	66.6	Low	64.8	Low	112 Å²	112	106.8 Å²	106.8	52%	0.523	52%	0.523	S	S	.	.	H	α-helix	trans	-67.1	-37.8	177.8	-165.3	175.8	13	0	0	112	V837 H838 R839 L845	V837-Q841 PolarHBondContact O-N 2.83Å; H838-Q841 PolarHBondContact O-N 2.79Å; R839-Q841 VanDerWaalsContact C-N 3.31Å; R839-Q841 PolarHBondContact O-N 2.89Å; Q841-L845 WeakPolarHBondContact O-CG 3.46Å; Q841-L845 PolarHBondContact O-N 3.34Å; Q841-L845 VanDerWaalsContact O-N 3.11Å
842	M	62.4	Low	65.2	Low	26 Å²	26	108 Å²	108	13%	0.128	52%	0.518	C	S	.	.	H	α-helix	trans	-71.8	-39.8	175.3	-159.6	73.6	74.4	0	0	111.9	L821 V825 H838 R839 R844 L845 V846	L821-M842 HydrophobicContact CD2-SD 3.89Å; V825-M842 HydrophobicContact CG2-CE 4.24Å; H838-M842 WeakPolarHBondContact O-CB 3.22Å; H838-M842 PolarHBondContact O-N 3.27Å; R839-M842 PolarHBondContact O-N 3.45Å; M842-R844 VanDerWaalsContact C-N 3.29Å; M842-R844 PolarHBondContact O-N 3.22Å; M842-L845 PolarHBondContact O-N 3.49Å; M842-V846 WeakPolarHBondContact O-CB 3.38Å; M842-V846 WeakPolarHBondContact O-CG2 3.39Å; M842-V846 PolarHBondContact O-N 2.56Å
843	E	66	Low	65.6	Low	94 Å²	94	107.2 Å²	107.2	44%	0.439	49%	0.494	S	S	.	.	H	α-helix	trans	-61	-37.2	173.2	-78.5	-178.7	-150.9	0	0	111.6	R839 E840 R847	R839-E843 HydrophobicContact CG-CG 4.42Å; R839-E843 IonicContact NE-OE1 3.59Å; R839-E843 PolarHBondContact NE-OE1 2.77Å; R839-E843 WeakPolarHBondContact O-CB 3.43Å; R839-E843 WeakPolarHBondContact O-CG 3.5Å; R839-E843 PolarHBondContact O-N 3.18Å; E840-E843 PolarHBondContact O-N 3.21Å; E843-R847 WeakPolarHBondContact O-CB 3.2Å; E843-R847 PolarHBondContact O-N 3.34Å
844	R	72.4	Confident	65.8	Low	169 Å²	169	103.9 Å²	103.9	64%	0.638	49%	0.487	S	S	*	.	H	α-helix	trans	-64.2	-47.9	170.6	-74.9	-175.2	-172	-169.7	5.6	112.3	E840 M842 V846 R847 E848	E840-R844 WeakPolarHBondContact O-CG 3.14Å; E840-R844 PolarHBondContact O-N 2.69Å; M842-R844 VanDerWaalsContact C-N 3.29Å; M842-R844 PolarHBondContact O-N 3.22Å; R844-V846 VanDerWaalsContact C-N 3.35Å; R844-V846 PolarHBondContact O-N 3.48Å; R844-R847 PolarHBondContact O-N 2.99Å; R844-E848 WeakPolarHBondContact O-CB 3.49Å; R844-E848 WeakPolarHBondContact O-CG 3.28Å; R844-E848 PolarHBondContact O-N 2.8Å
845	L	71.8	Confident	66	Low	87 Å²	87	100.7 Å²	100.7	46%	0.455	48%	0.476	S	S	.	.	H	α-helix	trans	-62.5	-39.7	178.8	-73.6	167.6	0	0	0	112.8	Q841 M842 E849	Q841-L845 WeakPolarHBondContact O-CG 3.46Å; Q841-L845 PolarHBondContact O-N 3.34Å; Q841-L845 VanDerWaalsContact O-N 3.11Å; M842-L845 PolarHBondContact O-N 3.49Å; L845-E849 PolarHBondContact O-N 3.08Å; L845-E849 VanDerWaalsContact O-N 3.07Å
846	V	72.1	Confident	66	Low	49 Å²	49	101 Å²	101	30%	0.297	47%	0.474	S	S	.	.	H	α-helix	trans	-66.9	-38.9	174.8	170.4	0	0	0	0	111.1	L821 M842 R844 L850	L821-V846 HydrophobicContact CD1-CG2 4.21Å; M842-V846 WeakPolarHBondContact O-CB 3.38Å; M842-V846 WeakPolarHBondContact O-CG2 3.39Å; M842-V846 PolarHBondContact O-N 2.56Å; R844-V846 VanDerWaalsContact C-N 3.35Å; R844-V846 PolarHBondContact O-N 3.48Å; V846-L850 HydrophobicContact CG1-CD1 4.15Å; V846-L850 WeakPolarHBondContact O-CB 3.37Å; V846-L850 PolarHBondContact O-N 3.43Å
847	R	72.1	Confident	65.7	Low	152 Å²	152	101.3 Å²	101.3	57%	0.574	48%	0.475	S	S	*	.	H	α-helix	trans	-66.9	-44.7	175.6	-173.9	-177.9	-58.6	-91.2	-0.9	112.1	E843 R844 E849 L850 E851	E843-R847 WeakPolarHBondContact O-CB 3.2Å; E843-R847 PolarHBondContact O-N 3.34Å; R844-R847 PolarHBondContact O-N 2.99Å; R847-E849 PolarHBondContact O-N 3.27Å; R847-L850 WeakPolarHBondContact O-CB 3.2Å; R847-L850 PolarHBondContact O-N 3.45Å; R847-E851 WeakPolarHBondContact O-CG 3.45Å; R847-E851 PolarHBondContact O-N 2.96Å
848	E	73.7	Confident	65.1	Low	119 Å²	119	101 Å²	101	56%	0.556	47%	0.47	S	S	*	.	H	α-helix	trans	-61	-42	176.1	-75.8	176.7	-178.6	0	0	111.8	R844 R852	R844-E848 WeakPolarHBondContact O-CB 3.49Å; R844-E848 WeakPolarHBondContact O-CG 3.28Å; R844-E848 PolarHBondContact O-N 2.8Å; E848-R852 VanDerWaalsContact O-CB 3.29Å; E848-R852 WeakPolarHBondContact O-CB 3.39Å; E848-R852 PolarHBondContact O-N 3.41Å
849	E	70	Confident	64.4	Low	54 Å²	54	99.9 Å²	99.9	25%	0.252	48%	0.479	S	S	.	.	H	α-helix	trans	-70.2	-32.5	173.7	-83.4	-68.2	132.2	0	0	113	L845 R847 R852 W853	L845-E849 PolarHBondContact O-N 3.08Å; L845-E849 VanDerWaalsContact O-N 3.07Å; R847-E849 PolarHBondContact O-N 3.27Å; E849-R852 WeakPolarHBondContact O-CB 3.4Å; E849-R852 PolarHBondContact O-N 3.22Å; E849-R852 WeakPolarHBondContact OE1-CD 3.49Å; E849-R852 IonicContact OE1-CZ 2.83Å; E849-R852 IonicContact OE1-NE 3.13Å; E849-R852 IonicContact OE1-NH1 3.03Å; E849-R852 PolarHBondContact OE1-NH1 3.44Å; E849-W853 PolarHBondContact O-N 3.47Å; E849-W853 PolarHBondContact O-NE1 3.09Å; E849-W853 PolarHBondContact OE2-NE1 3.16Å
850	L	67.2	Low	63.7	Low	100 Å²	100	95.7 Å²	95.7	52%	0.524	47%	0.472	S	S	.	.	H	α-helix	trans	-65.1	-47.7	172.1	-102.9	153.8	0	0	0	112.2	V846 R847 R852 W853 E854	V846-L850 HydrophobicContact CG1-CD1 4.15Å; V846-L850 WeakPolarHBondContact O-CB 3.37Å; V846-L850 PolarHBondContact O-N 3.43Å; R847-L850 WeakPolarHBondContact O-CB 3.2Å; R847-L850 PolarHBondContact O-N 3.45Å; L850-R852 VanDerWaalsContact C-N 3.25Å; L850-R852 PolarHBondContact O-N 3.45Å; L850-W853 PolarHBondContact O-N 3.1Å; L850-W853 VanDerWaalsContact O-N 3.15Å; L850-E854 PolarHBondContact O-N 2.95Å
851	E	66.3	Low	62.5	Low	107 Å²	107	97 Å²	97	50%	0.5	48%	0.478	S	S	.	.	H	α-helix	trans	-61.5	-35.1	175.1	-73.5	176.3	-167.9	0	0	111.4	R847 S855	R847-E851 WeakPolarHBondContact O-CG 3.45Å; R847-E851 PolarHBondContact O-N 2.96Å; E851-S855 WeakPolarHBondContact O-CB 3.4Å; E851-S855 PolarHBondContact O-N 3.03Å; E851-S855 PolarHBondContact O-OG 3.36Å
852	R	71.1	Confident	61	Low	153 Å²	153	97.2 Å²	97.2	58%	0.577	49%	0.487	S	S	*	.	H	α-helix	trans	-64.5	-44	172.5	-166.8	-177.1	-151.9	153	12.2	112.3	E848 E849 L850 S855 D856	E848-R852 VanDerWaalsContact O-CB 3.29Å; E848-R852 WeakPolarHBondContact O-CB 3.39Å; E848-R852 PolarHBondContact O-N 3.41Å; E849-R852 WeakPolarHBondContact O-CB 3.4Å; E849-R852 PolarHBondContact O-N 3.22Å; E849-R852 WeakPolarHBondContact OE1-CD 3.49Å; E849-R852 IonicContact OE1-CZ 2.83Å; E849-R852 IonicContact OE1-NE 3.13Å; E849-R852 IonicContact OE1-NH1 3.03Å; E849-R852 PolarHBondContact OE1-NH1 3.44Å; L850-R852 VanDerWaalsContact C-N 3.25Å; L850-R852 PolarHBondContact O-N 3.45Å; R852-S855 WeakPolarHBondContact O-CB 3.35Å; R852-S855 PolarHBondContact O-N 3.49Å; R852-D856 PolarHBondContact O-N 3.13Å
853	W	65.9	Low	59.8	Low	53 Å²	53	99.9 Å²	99.9	20%	0.201	51%	0.508	C	S	.	.	H	α-helix	trans	-68.7	-35	178.2	-62.7	-1.3	0	0	0	112.3	R814 E849 L850 D857	R814-W853 HydrophobicContact CB-CE3 4.28Å; R814-W853 HydrophobicContact CB-CH2 3.61Å; R814-W853 HydrophobicContact CB-CZ2 4Å; R814-W853 HydrophobicContact CB-CZ3 3.78Å; R814-W853 VanDerWaalsContact CD-CE3 3.48Å; R814-W853 HydrophobicContact CG-CD2 3.73Å; R814-W853 HydrophobicContact CG-CE3 3.73Å; R814-W853 HydrophobicContact CG-CG 4.47Å; R814-W853 HydrophobicContact CG-CH2 3.79Å; R814-W853 HydrophobicContact CG-CZ2 3.81Å; R814-W853 HydrophobicContact CG-CZ3 3.76Å; R814-W853 PolarHBondContact NH2-O 2.91Å; E849-W853 PolarHBondContact O-N 3.47Å; E849-W853 PolarHBondContact O-NE1 3.09Å; E849-W853 PolarHBondContact OE2-NE1 3.16Å; L850-W853 PolarHBondContact O-N 3.1Å; L850-W853 VanDerWaalsContact O-N 3.15Å; W853-D857 PolarHBondContact O-N 2.99Å; W853-D857 VanDerWaalsContact O-N 3.08Å
854	E	60.7	Low	58.4	Low	132 Å²	132	102.8 Å²	102.8	62%	0.617	52%	0.521	S	S	*	.	H	α-helix	trans	-70.1	-36.6	174.9	-163.3	165.8	-137.7	0	0	111.3	L850 D857 L858	L850-E854 PolarHBondContact O-N 2.95Å; E854-D857 PolarHBondContact O-N 3.28Å; E854-L858 HydrophobicContact CG-CD1 4.32Å; E854-L858 WeakPolarHBondContact O-CD1 3.44Å; E854-L858 PolarHBondContact O-N 3.02Å
855	S	60.3	Low	56.2	Low	79 Å²	79	101 Å²	101	55%	0.552	53%	0.529	S	S	*	.	H	α-helix	trans	-63.5	-42.7	171.9	-60.8	0	0	0	0	112.8	E851 R852 L858 G859	E851-S855 WeakPolarHBondContact O-CB 3.4Å; E851-S855 PolarHBondContact O-N 3.03Å; E851-S855 PolarHBondContact O-OG 3.36Å; R852-S855 WeakPolarHBondContact O-CB 3.35Å; R852-S855 PolarHBondContact O-N 3.49Å; S855-L858 PolarHBondContact O-N 2.86Å; S855-G859 PolarHBondContact O-N 3.4Å
856	D	59	Low	54.4	Low	110 Å²	110	102.8 Å²	102.8	59%	0.588	55%	0.546	S	S	*	.	H	α-helix	trans	-65	-40.2	175.4	-81.9	-15.5	0	0	0	111.9	R852 G859 S860	R852-D856 PolarHBondContact O-N 3.13Å; D856-G859 PolarHBondContact O-N 2.66Å; D856-S860 PolarHBondContact O-N 3.19Å
857	D	53	Low	52.5	Low	77 Å²	77	107.3 Å²	107.3	41%	0.412	57%	0.574	S	S	.	*	H	α-helix	trans	-67.1	-38.9	175.7	-90.6	-56.9	0	0	0	111.3	R814 W853 E854 S860	R814-D857 IonicContact CZ-OD2 2.75Å; R814-D857 IonicContact NH1-OD2 3.33Å; R814-D857 PolarHBondContact NH1-OD2 2.86Å; R814-D857 IonicContact NH2-OD2 3.86Å; R814-D857 PolarHBondContact NH2-OD2 3.41Å; W853-D857 PolarHBondContact O-N 2.99Å; W853-D857 VanDerWaalsContact O-N 3.08Å; E854-D857 PolarHBondContact O-N 3.28Å; D857-S860 PolarHBondContact O-N 2.66Å; D857-S860 PolarHBondContact O-OG 3.5Å
858	L	48.5	Very low	50.5	Low	107 Å²	107	102.6 Å²	102.6	56%	0.56	57%	0.572	S	S	*	*	H	α-helix	trans	-63.7	-42.9	171.3	-102	94.5	0	0	0	112.8	E854 S855 S860 Q861 V862	E854-L858 HydrophobicContact CG-CD1 4.32Å; E854-L858 WeakPolarHBondContact O-CD1 3.44Å; E854-L858 PolarHBondContact O-N 3.02Å; S855-L858 PolarHBondContact O-N 2.86Å; L858-S860 PolarHBondContact O-N 3.08Å; L858-S860 VanDerWaalsContact O-N 3.13Å; L858-Q861 PolarHBondContact O-N 3.39Å; L858-V862 WeakPolarHBondContact O-CG2 3.2Å; L858-V862 PolarHBondContact O-N 3.21Å
859	G	45.3	Very low	48.7	Very low	56 Å²	56	103.4 Å²	103.4	58%	0.577	59%	0.588	S	S	*	*	H	α-helix	trans	-56.2	-28.9	175.7	0	0	0	0	0	112.9	S855 D856	S855-G859 PolarHBondContact O-N 3.4Å; D856-G859 PolarHBondContact O-N 2.66Å
860	S	48.2	Very low	46.7	Very low	54 Å²	54	112.8 Å²	112.8	38%	0.378	62%	0.621	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.1	-15.3	175.6	87.5	0	0	0	0	115.2	D856 D857 L858	D856-S860 PolarHBondContact O-N 3.19Å; D857-S860 PolarHBondContact O-N 2.66Å; D857-S860 PolarHBondContact O-OG 3.5Å; L858-S860 PolarHBondContact O-N 3.08Å; L858-S860 VanDerWaalsContact O-N 3.13Å
861	Q	39.5	Very low	44.9	Very low	146 Å²	146	112.4 Å²	112.4	68%	0.682	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	-27.7	177.6	-67.7	-169.2	15.5	0	0	113.5	L858 S863 H864	L858-Q861 PolarHBondContact O-N 3.39Å; Q861-S863 PolarHBondContact O-N 3.13Å; Q861-S863 VanDerWaalsContact O-N 3.09Å; Q861-H864 PolarHBondContact O-N 2.95Å; Q861-H864 VanDerWaalsContact O-N 3.15Å
862	V	36.4	Very low	43.1	Very low	117 Å²	117	118.8 Å²	118.8	71%	0.709	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	-14.7	-176.3	171.9	0	0	0	0	113.6	L858 H864	L858-V862 WeakPolarHBondContact O-CG2 3.2Å; L858-V862 PolarHBondContact O-N 3.21Å; V862-H864 VanDerWaalsContact C-N 3.3Å; V862-H864 PolarHBondContact O-N 3.05Å
863	S	36.8	Very low	41.2	Very low	83 Å²	83	117 Å²	117	58%	0.58	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-3.1	174.7	55.1	0	0	0	0	115.2	Q861	Q861-S863 PolarHBondContact O-N 3.13Å; Q861-S863 VanDerWaalsContact O-N 3.09Å
864	H	36.2	Very low	39.5	Very low	155 Å²	155	120.6 Å²	120.6	72%	0.718	69%	0.69	S	S	*	*			trans	-137.2	79.9	-178.8	-69.7	-50.8	0	0	0	114.7	Q861 V862 P866	Q861-H864 PolarHBondContact O-N 2.95Å; Q861-H864 VanDerWaalsContact O-N 3.15Å; V862-H864 VanDerWaalsContact C-N 3.3Å; V862-H864 PolarHBondContact O-N 3.05Å; H864-P866 WeakPolarHBondContact O-CD 3.29Å
865	T	27.3	Very low	37.9	Very low	131 Å²	131	120.2 Å²	120.2	80%	0.804	70%	0.702	S	S	*	*			trans	-83.3	119.5	155	32.9	0	0	0	0	110.7
866	P	34	Very low	36.5	Very low	125 Å²	125	121.5 Å²	121.5	81%	0.812	71%	0.711	S	S	*	*			trans	-79	123.1	173.8	30.6	-32.1	0	0	0	110.6	H864 G868	H864-P866 WeakPolarHBondContact O-CD 3.29Å; P866-G868 PolarHBondContact O-N 3.28Å
867	V	31	Very low	35.1	Very low	144 Å²	144	124 Å²	124	87%	0.873	72%	0.724	S	S	*	*			trans	-72.1	112.3	171.3	177.1	0	0	0	0	109.2
868	G	30.5	Very low	33.9	Very low	52 Å²	52	124.8 Å²	124.8	54%	0.536	74%	0.735	S	S	.	*	P	Polyproline II helix	trans	-64.9	157.7	175.8	0	0	0	0	0	113.5	P866 R870	P866-G868 PolarHBondContact O-N 3.28Å; G868-R870 PolarHBondContact O-N 2.99Å
869	P	35.6	Very low	33	Very low	137 Å²	137	125.8 Å²	125.8	89%	0.89	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-71.4	125.4	-168.2	28.3	-34.9	0	0	0	112.7
870	R	28.2	Very low	32.3	Very low	250 Å²	250	130.9 Å²	130.9	94%	0.943	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-83.7	136.2	173.3	-145.7	172.6	-170.9	169.4	2.2	110.1	G868	G868-R870 PolarHBondContact O-N 2.99Å
871	A	28.6	Very low	31.2	Very low	92 Å²	92	131.6 Å²	131.6	76%	0.76	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-63.2	146.7	-172.8	0	0	0	0	0	113.9
872	R	29.6	Very low	30.7	Very low	242 Å²	242	132 Å²	132	91%	0.913	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-67.3	134.8	168.6	-73.6	-179.8	174.6	174.3	-2.5	110.7
873	P	31.4	Very low	30.3	Very low	115 Å²	115	133.4 Å²	133.4	75%	0.747	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-75.3	154.8	154.8	0.7	17	0	0	0	110.6
874	P	29.9	Very low	29.9	Very low	128 Å²	128	133.5 Å²	133.5	83%	0.831	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-78.3	149.2	-178.5	32.2	-35.1	0	0	0	112.9
875	S	27.2	Very low	29.5	Very low	124 Å²	124	131.6 Å²	131.6	87%	0.867	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-79.4	131.7	172.8	51.6	0	0	0	0	112.1
876	S	29.6	Very low	29.5	Very low	107 Å²	107	129.9 Å²	129.9	75%	0.748	79%	0.788	S	S	*	*			trans	-126.9	126.5	166.5	57.8	0	0	0	0	111.1
877	L	29.7	Very low	29.3	Very low	163 Å²	163	131.7 Å²	131.7	85%	0.853	79%	0.791	S	S	*	*			trans	8.9	152.3	144.4	-77.1	85.7	0	0	0	119.7
878	S	28.5	Very low	29.2	Very low	92 Å²	92	128.1 Å²	128.1	64%	0.643	78%	0.784	S	S	*	*			cis	170.7	148.9	-11.1	51.9	0	0	0	0	108.6
879	T	30.2	Very low	29.2	Very low	129 Å²	129	130.5 Å²	130.5	79%	0.791	80%	0.798	S	S	*	*			trans	-166.6	122.4	143.2	34.5	0	0	0	0	111.6
880	D	29.7	Very low	29.1	Very low	163 Å²	163	129.9 Å²	129.9	87%	0.872	79%	0.792	S	S	*	*			trans	47.1	137	142.7	-51.6	-21.8	0	0	0	123.4
881	G	26.2	Very low	29.3	Very low	69 Å²	69	125.8 Å²	125.8	71%	0.711	78%	0.783	S	S	*	*			cis	170.9	-159.5	-3.3	0	0	0	0	0	117.7
882	L	27.9	Very low	29.7	Very low	155 Å²	155	131.3 Å²	131.3	81%	0.812	81%	0.807	S	S	*	*			trans	79.1	101.9	170.7	-66.1	164.4	0	0	0	120.3
883	D	27.8	Very low	29.8	Very low	145 Å²	145	125.8 Å²	125.8	78%	0.775	80%	0.802	S	S	*	*				94.8	123.6	125.7	-69.2	-8.8	0	0	0	125.2
884	A	28.7	Very low	29.7	Very low	86 Å²	86	126.4 Å²	126.4	71%	0.711	80%	0.804	S	S	*	*			trans	85.7	107.1	139.2	0	0	0	0	0	122.2
885	S	27.1	Very low	29.7	Very low	114 Å²	114	126.3 Å²	126.3	80%	0.797	80%	0.803	S	S	*	*			trans	49.5	142	132.7	60.8	0	0	0	0	121.7
886	S	29	Very low	29.8	Very low	95 Å²	95	126.4 Å²	126.4	66%	0.664	80%	0.799	S	S	*	*			cis	-176.7	160.5	-3.1	51.7	0	0	0	0	111.2
887	N	29.7	Very low	29.8	Very low	163 Å²	163	127.6 Å²	127.6	87%	0.872	80%	0.802	S	S	*	*			trans	73	139	151.9	-66.4	-13.1	0	0	0	123.1
888	G	28.5	Very low	29.8	Very low	70 Å²	70	125.3 Å²	125.3	72%	0.722	80%	0.799	S	S	*	*			trans	97.8	108.4	158.1	0	0	0	0	0	114.5
889	A	30.1	Very low	29.9	Very low	102 Å²	102	127.6 Å²	127.6	84%	0.843	81%	0.81	S	S	*	*				62.7	133.7	51.4	0	0	0	0	0	112.7
890	V	34.3	Very low	29.9	Very low	124 Å²	124	127.5 Å²	127.5	75%	0.752	81%	0.812	S	S	*	*			cis	-162.7	173.6	2.1	111.9	0	0	0	0	109
891	H	31.5	Very low	29.9	Very low	164 Å²	164	124.6 Å²	124.6	76%	0.759	81%	0.807	S	S	*	*			trans	-8.6	147	164	-65.2	-81.7	0	0	0	119.1
892	V	38.3	Very low	30.3	Very low	208 Å²	208	129.6 Å²	129.6	100%	1.261	82%	0.815	S	S	*	*			cis	-135.9	0	47.9	172.7	0	0	0	0	113.1

Retrieved 892 of 892 residues in 381.1 ms (Link to these results)

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