A0A087Y5I1_POEFO Loading...

NRDE-2, necessary for RNA interference, domain containing

AlphaFold DB , UniProt , Accession A0A087Y5I1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,170 aa.

						>A0A087Y5I1_POEFO|A0A087Y5I1
MCDAIMALFPAFAEVSENKVEDSSTELDWLNNKSFQAGNALSLHSRFLEKSTEQPNKREESVGRDITCSDGESSGKEDGPPKKKKKKSEKKRKKKKKHKKKSGRASGSSGSDSETIYPSDLKREEEGIRHQPASLGTRFTWLDDLQSPTENPFCVDRKPDPANWTYKSLYRGDVARYRRKGSSSLGLDFRRQGVSWEDSETKKKKKVGVNGNAADRYFSVATRKLLRAAPPVPVIPATPESGDVLNSTSFLPLGDAERDNTRHELDSKAQTSVNPLGVYDSSTSLWMQGKGRLLQDDAKPVAETEEKSEYVAGRTEEFNRRLREQPADTQLWIEFIRYQDELSAAAFGGDEEQQGSDLAERRKSSYRAILEKKLSIADRAVETNPTCVALQLERLRICQDLWEPSTLAKEWKKLVFLHPNSAPLWRKYLLFTQSYFSSFSVTKVNSAYGKCLSTLSAVRDGSMVSHPALPGIEEDMLDIFTQQCHFLRQSGHCEKAISLFQAMIDFSYFKPDSVKKLSTKQQVDFFETFWDSGEARVGEVGARGWKAWMTQQERGGWVQPPAEEEEEEEEEEDEEEVKDRSQPRGTVWLEVESSREAAHWLPWRPDKAKGQSEEDCEDPDRQVLFDDIGPSLICLTSPELQLRFLLSFLAFLGFPVDFVLSAAPYQPSMLLENLSLLTQGASLQRPLTSFNPLETGINPVGHMTTLQGTRKWLGLGKQGEKFLTNVFSMLQPFLPPPHRAVLSLSWMLYEKLKVLHCLRSGNKKRLRAQGKSSKRVAKRLLKEPDNRSSLVLWREYAHLEWVLGNLDEARKVFSTATAMGGTRGLGSPALCELCLLWSQLEVENSAKEPGGVADVTTSPAVAVLTRLAEGTSSSSSSQTLTPVSILKARRSYDQVLSSSLSSLDQKIQNHQQDGNAAQDEPQEDKLRLRGLVGCYALFQYLTVSIQAAIAVYSQARERMEELHRSLTPERQPDHDEATTRPSRTVHSQHVSWLASDSWPYSAPLWSVYIQVENRYHSAGRARRFFTTVTRDNSSSVVPRLFAIVAEQHRKQLVDAAQRSCCLDEALPILPENGLSNRIRGLFEGATSTEIGAHCPLLWRMYIHFLVSEGKVDKARGIFYKALQNIPWVKGLYMDAVQLFPDHLQEFVDLMTEKELRLRLPLEELDILLED
					

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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	44.3	Very low	31.4	Very low	243 Å²	243	139.1 Å²	139.1	100%	1.197	82%	0.817	S	S	*	*				0	102.2	0	-158	178.7	-114.5	0	0	104.6
2	C	28.3	Very low	31.6	Very low	131 Å²	131	145.4 Å²	145.4	89%	0.885	83%	0.827	S	S	*	*			trans	-152.5	139.7	-173	-71.9	0	0	0	0	110.7
3	D	28.1	Very low	31.6	Very low	175 Å²	175	141.5 Å²	141.5	94%	0.936	82%	0.824	S	S	*	*			trans	-100.9	169.3	-164.9	-77.1	-48.2	0	0	0	114.9
4	A	34.1	Very low	31.5	Very low	91 Å²	91	145.5 Å²	145.5	75%	0.752	83%	0.831	S	S	*	*			trans	-55.2	156.4	-173.4	0	0	0	0	0	118.3
5	I	27.4	Very low	31.6	Very low	174 Å²	174	144.4 Å²	144.4	89%	0.892	83%	0.827	S	S	*	*			trans	-144.3	140.2	147.3	-60.4	-173.6	0	0	0	110
6	M	26.9	Very low	31.4	Very low	177 Å²	177	142.6 Å²	142.6	87%	0.872	83%	0.826	S	S	*	*			trans	-78.5	164	-166.1	-61.2	-163.6	78.2	0	0	116.8
7	A	30.6	Very low	31.5	Very low	100 Å²	100	144.3 Å²	144.3	83%	0.826	83%	0.825	S	S	*	*			trans	-90.6	136.5	176.1	0	0	0	0	0	112.9
8	L	26.3	Very low	31.3	Very low	147 Å²	147	145.6 Å²	145.6	77%	0.77	83%	0.829	S	S	*	*			trans	-110	114.5	173.5	-88.9	132.5	0	0	0	109.8
9	F	29.1	Very low	31.5	Very low	91 Å²	91	148.5 Å²	148.5	40%	0.399	83%	0.831	S	S	.	*			trans	99.7	112.1	169.1	-65.8	-75.5	0	0	0	120.5	L27 L30	F9-L27 HydrophobicContact CE1-CB 4.17Å; F9-L27 HydrophobicContact CE1-CD1 4.34Å; F9-L27 HydrophobicContact CE2-CD1 3.46Å; F9-L27 VanDerWaalsContact CE2-CD1 3.46Å; F9-L27 HydrophobicContact CE2-CG 4.46Å; F9-L27 HydrophobicContact CZ-CB 3.71Å; F9-L27 HydrophobicContact CZ-CD1 3.29Å; F9-L27 HydrophobicContact CZ-CG 3.85Å; F9-L30 HydrophobicContact CD1-CD1 3.35Å; F9-L30 HydrophobicContact CD2-CD1 4.26Å; F9-L30 HydrophobicContact CE1-CD1 3.3Å; F9-L30 HydrophobicContact CE2-CD1 4.23Å; F9-L30 HydrophobicContact CG-CD1 3.88Å; F9-L30 HydrophobicContact CZ-CD1 3.8Å
10	P	40.2	Very low	31.3	Very low	118 Å²	118	147.4 Å²	147.4	77%	0.766	83%	0.828	S	S	*	*			trans	-100.3	140.2	-173.3	38.4	-31.1	0	0	0	112.5
11	A	30	Very low	31.4	Very low	83 Å²	83	148.5 Å²	148.5	69%	0.686	83%	0.827	S	S	*	*	S	Bend	trans	-146.3	-14.3	166.8	0	0	0	0	0	116.7
12	F	33.7	Very low	30.7	Very low	215 Å²	215	143.9 Å²	143.9	94%	0.943	81%	0.807	S	S	*	*	S	Bend	trans	-151.4	48.9	174.2	-72.7	-73.5	0	0	0	113.8
13	A	32.1	Very low	31	Very low	95 Å²	95	143.1 Å²	143.1	79%	0.785	80%	0.803	S	S	*	*			trans	-97.8	109.7	158.6	0	0	0	0	0	108.1	V15	A13-V15 PolarHBondContact O-N 3.43Å
14	E	30.4	Very low	31.2	Very low	197 Å²	197	140.2 Å²	140.2	92%	0.921	80%	0.796	S	S	*	*			trans	-70.8	125.2	166.5	-89.5	-174	162.4	0	0	109.7	S16	E14-S16 PolarHBondContact O-N 3.27Å
15	V	32.3	Very low	31.9	Very low	129 Å²	129	142 Å²	142	78%	0.782	80%	0.798	S	S	*	*			trans	-27.4	108.1	166	-177.9	0	0	0	0	113.7	A13 E17	A13-V15 PolarHBondContact O-N 3.43Å; V15-E17 HydrophobicContact CG1-CG 4.22Å
16	S	29.5	Very low	32.3	Very low	115 Å²	115	141.4 Å²	141.4	80%	0.804	79%	0.791	S	S	*	*			trans	-94.8	124.1	138.2	51	0	0	0	0	107.8	E14 N18	E14-S16 PolarHBondContact O-N 3.27Å; S16-N18 PolarHBondContact O-N 2.73Å
17	E	32.2	Very low	32.7	Very low	172 Å²	172	136.2 Å²	136.2	80%	0.804	77%	0.767	S	S	*	*			trans	-64.8	125.1	174	-69.6	176.2	148	0	0	110	V15	V15-E17 HydrophobicContact CG1-CG 4.22Å
18	N	28.5	Very low	33.5	Very low	168 Å²	168	140 Å²	140	90%	0.898	77%	0.773	S	S	*	*			trans	-164.9	138.6	137.4	-94.5	-30.7	0	0	0	111.6	S16	S16-N18 PolarHBondContact O-N 2.73Å
19	K	33.9	Very low	34.3	Very low	200 Å²	200	139.5 Å²	139.5	87%	0.87	76%	0.761	S	S	*	*			trans	-63.2	146.1	-178.2	-68.4	171.1	170.5	178.7	0	112.5
20	V	29.3	Very low	34.6	Very low	127 Å²	127	138.4 Å²	138.4	77%	0.77	76%	0.759	S	S	*	*				155.4	137.8	121.8	167.8	0	0	0	0	110.6
21	E	32.4	Very low	34.7	Very low	171 Å²	171	139.9 Å²	139.9	80%	0.799	76%	0.76	S	S	*	*			trans	-10.6	150.5	163.1	-61	163.1	169	0	0	117.9
22	D	30.7	Very low	35.3	Very low	146 Å²	146	141.7 Å²	141.7	78%	0.781	76%	0.758	S	S	*	*			cis	-172.2	155.8	21.9	-135.4	-12.3	0	0	0	111.1
23	S	34.4	Very low	36	Very low	114 Å²	114	140.9 Å²	140.9	80%	0.797	75%	0.754	S	S	*	*			trans	59.3	143.8	161	74	0	0	0	0	120.2
24	S	32.5	Very low	36.8	Very low	114 Å²	114	141.4 Å²	141.4	80%	0.797	75%	0.752	S	S	*	*			cis	-156.2	169.3	17.8	54.7	0	0	0	0	111.9
25	T	48.3	Very low	37.3	Very low	130 Å²	130	139.7 Å²	139.7	80%	0.798	74%	0.742	S	S	*	*			trans	-38	134.5	-178	48.8	0	0	0	0	119.8
26	E	35.7	Very low	38.1	Very low	160 Å²	160	140.6 Å²	140.6	75%	0.748	74%	0.738	S	S	*	*				169.1	142.8	124.4	-113.6	176.9	-168	0	0	114.7
27	L	35.6	Very low	38.7	Very low	69 Å²	69	138.4 Å²	138.4	36%	0.361	73%	0.727	S	S	.	*			trans	86.9	83	160.8	-41.1	175.5	0	0	0	121.3	F9 W29 L30	F9-L27 HydrophobicContact CE1-CB 4.17Å; F9-L27 HydrophobicContact CE1-CD1 4.34Å; F9-L27 HydrophobicContact CE2-CD1 3.46Å; F9-L27 VanDerWaalsContact CE2-CD1 3.46Å; F9-L27 HydrophobicContact CE2-CG 4.46Å; F9-L27 HydrophobicContact CZ-CB 3.71Å; F9-L27 HydrophobicContact CZ-CD1 3.29Å; F9-L27 HydrophobicContact CZ-CG 3.85Å; L27-W29 HydrophobicContact CD1-CZ2 3.79Å; L27-W29 HydrophobicContact CD2-CZ2 4.19Å; L27-W29 HydrophobicContact CG-CZ2 4.32Å; L27-L30 HydrophobicContact CB-CD1 4.48Å
28	D	46.5	Very low	39.3	Very low	178 Å²	178	132.9 Å²	132.9	95%	0.952	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	4.7	168.4	-107.2	-18.3	0	0	0	115.2
29	W	42.5	Very low	40.1	Very low	138 Å²	138	130.4 Å²	130.4	52%	0.523	70%	0.702	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.3	4.6	-176.6	56.4	-89.2	0	0	0	114.8	L27 E126	L27-W29 HydrophobicContact CD1-CZ2 3.79Å; L27-W29 HydrophobicContact CD2-CZ2 4.19Å; L27-W29 HydrophobicContact CG-CZ2 4.32Å; W29-E126 VanDerWaalsContact CH2-OE2 3.22Å; W29-E126 WeakPolarHBondContact CH2-OE2 3.34Å; W29-E126 WeakPolarHBondContact CZ3-OE1 3.5Å; W29-E126 VanDerWaalsContact CZ3-OE2 3.28Å; W29-E126 WeakPolarHBondContact CZ3-OE2 3.44Å
30	L	36.7	Very low	40.5	Very low	67 Å²	67	123.7 Å²	123.7	35%	0.351	69%	0.685	S	S	.	*			trans	-98.9	13	-173.4	-85.4	162.5	0	0	0	116	F9 L27	F9-L30 HydrophobicContact CD1-CD1 3.35Å; F9-L30 HydrophobicContact CD2-CD1 4.26Å; F9-L30 HydrophobicContact CE1-CD1 3.3Å; F9-L30 HydrophobicContact CE2-CD1 4.23Å; F9-L30 HydrophobicContact CG-CD1 3.88Å; F9-L30 HydrophobicContact CZ-CD1 3.8Å; L27-L30 HydrophobicContact CB-CD1 4.48Å
31	N	42.4	Very low	41	Very low	150 Å²	150	124 Å²	124	80%	0.802	68%	0.681	S	S	*	*			trans	-115	89.7	176.4	-99.7	-31.9	0	0	0	112.8	K33	N31-K33 PolarHBondContact O-N 3.33Å
32	N	41	Very low	41.5	Very low	120 Å²	120	119.1 Å²	119.1	64%	0.642	67%	0.666	S	S	*	*			trans	-79.9	104.2	170.8	-172.1	-15.6	0	0	0	110.6	S34	N32-S34 PolarHBondContact O-N 3.4Å; N32-S34 WeakPolarHBondContact OD1-CB 3.47Å; N32-S34 PolarHBondContact OD1-N 3.11Å; N32-S34 PolarHBondContact OD1-OG 2.85Å
33	K	48.5	Very low	42.1	Very low	198 Å²	198	118.3 Å²	118.3	86%	0.861	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	0.8	178.8	-67.8	-173.4	177.7	177.8	0	114.7	N31	N31-K33 PolarHBondContact O-N 3.33Å
34	S	49.8	Very low	42.4	Very low	106 Å²	106	119 Å²	119	74%	0.741	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	-8.8	-172.4	-29.5	0	0	0	0	114.8	N32	N32-S34 PolarHBondContact O-N 3.4Å; N32-S34 WeakPolarHBondContact OD1-CB 3.47Å; N32-S34 PolarHBondContact OD1-N 3.11Å; N32-S34 PolarHBondContact OD1-OG 2.85Å
35	F	40.1	Very low	42.8	Very low	161 Å²	161	116.6 Å²	116.6	71%	0.706	64%	0.635	S	S	*	*			trans	-116.1	111.2	-173.1	-168.4	-100.9	0	0	0	112.1	A37	F35-A37 HydrophobicContact CE1-CB 4.3Å
36	Q	49.6	Very low	42.4	Very low	149 Å²	149	119.6 Å²	119.6	70%	0.696	63%	0.631	S	S	*	*			trans	-113.9	113.7	169.7	-68	-175.2	-3.9	0	0	109.2	G38 N39	Q36-G38 PolarHBondContact O-N 3.44Å; Q36-N39 PolarHBondContact O-N 2.99Å
37	A	41	Very low	42.5	Very low	69 Å²	69	120 Å²	120	57%	0.57	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	-15.2	-171.9	0	0	0	0	0	115.2	F35	F35-A37 HydrophobicContact CE1-CB 4.3Å
38	G	44.8	Very low	42.5	Very low	55 Å²	55	121.9 Å²	121.9	57%	0.567	64%	0.641	S	S	*	*	H	α-helix	trans	-73	-32.5	-177.2	0	0	0	0	0	115.4	Q36 A40	Q36-G38 PolarHBondContact O-N 3.44Å; G38-A40 PolarHBondContact O-N 3.34Å
39	N	45.3	Very low	42	Very low	116 Å²	116	121 Å²	121	62%	0.62	63%	0.631	S	S	*	*	H	α-helix	trans	-74	-26.6	-174.9	-77.5	-18.3	0	0	0	113.3	Q36 L43	Q36-N39 PolarHBondContact O-N 2.99Å; N39-L43 PolarHBondContact O-N 3.23Å
40	A	43.6	Very low	41.7	Very low	60 Å²	60	123.7 Å²	123.7	50%	0.496	65%	0.646	S	S	.	*	H	α-helix	trans	-69.4	-33.3	-179.9	0	0	0	0	0	112.9	G38 H44	G38-A40 PolarHBondContact O-N 3.34Å; A40-H44 PolarHBondContact O-N 3.18Å
41	L	40.4	Very low	41.5	Very low	133 Å²	133	124.7 Å²	124.7	70%	0.696	66%	0.659	S	S	*	*	H	α-helix	trans	-76.5	-31.4	179.6	-70.5	168	0	0	0	112.4	S45	L41-S45 PolarHBondContact O-N 2.67Å
42	S	41.5	Very low	41.1	Very low	68 Å²	68	122.6 Å²	122.6	48%	0.476	65%	0.652	S	S	.	*	H	α-helix	trans	-66.9	-42.7	174.9	-178.6	0	0	0	0	112.1	H44 S45 R46	S42-H44 VanDerWaalsContact C-N 3.32Å; S42-H44 PolarHBondContact O-N 2.61Å; S42-S45 PolarHBondContact O-N 3.19Å; S42-S45 PolarHBondContact O-OG 3.15Å; S42-R46 PolarHBondContact O-N 3.09Å
43	L	44	Very low	40.5	Very low	129 Å²	129	126.3 Å²	126.3	68%	0.675	67%	0.665	S	S	*	*	H	α-helix	trans	-63.5	-35.8	177.1	-87.8	163.7	0	0	0	113.1	N39 F47	N39-L43 PolarHBondContact O-N 3.23Å; L43-F47 PolarHBondContact O-N 3.48Å
44	H	40.4	Very low	39.5	Very low	128 Å²	128	126.1 Å²	126.1	59%	0.593	67%	0.667	S	S	*	*	H	α-helix	trans	-69	-37.5	178.2	-164.2	62.8	0	0	0	112.3	A40 S42 F47	A40-H44 PolarHBondContact O-N 3.18Å; S42-H44 VanDerWaalsContact C-N 3.32Å; S42-H44 PolarHBondContact O-N 2.61Å; H44-F47 PolarHBondContact O-N 3.27Å
45	S	41.3	Very low	38.8	Very low	65 Å²	65	126.2 Å²	126.2	46%	0.455	67%	0.665	S	S	.	*	H	α-helix	trans	-68.6	-37.1	177.3	65.2	0	0	0	0	113.4	L41 S42 F47 L48	L41-S45 PolarHBondContact O-N 2.67Å; S42-S45 PolarHBondContact O-N 3.19Å; S42-S45 PolarHBondContact O-OG 3.15Å; S45-F47 VanDerWaalsContact C-N 3.3Å; S45-F47 PolarHBondContact O-N 3.18Å; S45-L48 PolarHBondContact O-N 3.1Å
46	R	39.8	Very low	38.1	Very low	192 Å²	192	125.9 Å²	125.9	73%	0.725	67%	0.671	S	S	*	*	H	α-helix	trans	-70.2	-23.9	178.3	-118.4	177.5	-178.3	176.4	0.6	114	S42	S42-R46 PolarHBondContact O-N 3.09Å
47	F	36.9	Very low	37.1	Very low	169 Å²	169	127 Å²	127	74%	0.741	67%	0.674	S	S	*	*	H	α-helix	trans	-80.8	-30.5	179.7	-158.8	-93.2	0	0	0	112.1	L43 H44 S45 S51	L43-F47 PolarHBondContact O-N 3.48Å; H44-F47 PolarHBondContact O-N 3.27Å; S45-F47 VanDerWaalsContact C-N 3.3Å; S45-F47 PolarHBondContact O-N 3.18Å; F47-S51 PolarHBondContact O-OG 3.16Å
48	L	36.7	Very low	36.3	Very low	109 Å²	109	134.1 Å²	134.1	57%	0.571	69%	0.686	S	S	*	*	H	α-helix	trans	-76.3	-29	178	-84.8	156.1	0	0	0	113.3	S45 S51	S45-L48 PolarHBondContact O-N 3.1Å; L48-S51 PolarHBondContact O-OG 2.65Å
49	E	35.5	Very low	35.4	Very low	160 Å²	160	139.8 Å²	139.8	75%	0.748	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-16.4	179.4	-75	179.5	161.3	0	0	114.1
50	K	35.7	Very low	34.5	Very low	193 Å²	193	142.9 Å²	142.9	84%	0.839	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-7.6	-179.7	-97.8	-177.3	176	-177.1	0	115.1
51	S	32.4	Very low	33.6	Very low	88 Å²	88	144.6 Å²	144.6	62%	0.615	72%	0.717	S	S	*	*	S	Bend	trans	-98.4	5.9	-172.4	33.5	0	0	0	0	114.7	F47 L48	F47-S51 PolarHBondContact O-OG 3.16Å; L48-S51 PolarHBondContact O-OG 2.65Å
52	T	33.6	Very low	33	Very low	107 Å²	107	145.4 Å²	145.4	66%	0.656	73%	0.727	S	S	*	*	S	Bend	trans	-130.8	85.8	174.9	45.2	0	0	0	0	110.8
53	E	28.7	Very low	32.3	Very low	198 Å²	198	145.3 Å²	145.3	93%	0.925	74%	0.736	S	S	*	*			trans	-177.9	124.3	145.3	-102.1	166.6	-158.9	0	0	110.9
54	Q	29	Very low	31.4	Very low	193 Å²	193	150 Å²	150	90%	0.902	75%	0.745	S	S	*	*			trans	-112.8	156	163.9	-108.5	-164.3	-7.8	0	0	109.5
55	P	35.1	Very low	30.7	Very low	108 Å²	108	149.6 Å²	149.6	70%	0.701	75%	0.747	S	S	*	*			trans	-99.7	152.9	-149.6	37.5	-34.4	0	0	0	113.9
56	N	24.7	Very low	29.9	Very low	154 Å²	154	153 Å²	153	82%	0.824	76%	0.759	S	S	*	*			trans	-163	131.1	140.9	-115.2	-29	0	0	0	115.3
57	K	28.4	Very low	29.3	Very low	174 Å²	174	149.9 Å²	149.9	76%	0.757	76%	0.762	S	S	*	*			trans	91.5	112.9	151.5	-68.1	-176.7	177.7	177.4	0	122
58	R	25.3	Very low	28.6	Very low	217 Å²	217	147.6 Å²	147.6	82%	0.819	77%	0.765	S	S	*	*			trans	80.9	112.2	133.6	-77.7	-175.3	175.4	175	-3.4	120.6
59	E	25.8	Very low	28	Very low	174 Å²	174	146.8 Å²	146.8	81%	0.813	77%	0.769	S	S	*	*				27.9	120.1	129.7	-65	174.3	161.3	0	0	118.7
60	E	25.2	Very low	27.4	Very low	181 Å²	181	146.5 Å²	146.5	85%	0.846	77%	0.772	S	S	*	*				-178.5	135.1	105.8	-101.4	178.2	177.2	0	0	113.5
61	S	25.9	Very low	26.9	Very low	96 Å²	96	140.6 Å²	140.6	67%	0.671	77%	0.766	S	S	*	*			trans	59	119.5	139.8	71.1	0	0	0	0	124.6
62	V	26.6	Very low	26.7	Very low	150 Å²	150	145.3 Å²	145.3	91%	0.909	78%	0.778	S	S	*	*				71.3	124.8	122.4	-177.5	0	0	0	0	120.2
63	G	26.4	Very low	26.2	Very low	66 Å²	66	144.8 Å²	144.8	68%	0.68	78%	0.779	S	S	*	*			trans	139.3	89.9	133.9	0	0	0	0	0	118.7
64	R	26.7	Very low	26	Very low	229 Å²	229	141 Å²	141	86%	0.864	78%	0.775	S	S	*	*				52.1	137.9	129.6	-89.2	-175.2	-172.1	148.2	2.3	123.9
65	D	25	Very low	25.9	Very low	119 Å²	119	135.2 Å²	135.2	64%	0.636	77%	0.766	S	S	*	*			trans	80.5	109.3	139.7	-58.6	-12.2	0	0	0	117.9
66	I	24.9	Very low	25.5	Very low	136 Å²	136	138.8 Å²	138.8	70%	0.697	77%	0.771	S	S	*	*				93.4	139.9	69.4	-76.3	167.8	0	0	0	111.9
67	T	25.9	Very low	25.5	Very low	127 Å²	127	138 Å²	138	78%	0.779	76%	0.762	S	S	*	*			trans	76.6	119	165.4	45.5	0	0	0	0	118
68	C	22.5	Very low	25.4	Very low	120 Å²	120	136.9 Å²	136.9	81%	0.811	76%	0.764	S	S	*	*			cis	91	136.5	43.3	-163.2	0	0	0	0	113.4
69	S	24.4	Very low	25.3	Very low	93 Å²	93	129.7 Å²	129.7	65%	0.65	76%	0.758	S	S	*	*			trans	92.9	106	159.1	-161.2	0	0	0	0	119.2
70	D	24	Very low	26.3	Very low	154 Å²	154	127.2 Å²	127.2	82%	0.824	76%	0.757	S	S	*	*				45.2	141.4	119.5	-51.2	-49.6	0	0	0	122.2
71	G	24.4	Very low	27	Very low	68 Å²	68	123.3 Å²	123.3	70%	0.701	75%	0.747	S	S	*	*				125	113.2	128.8	0	0	0	0	0	117.1
72	E	27.7	Very low	27	Very low	187 Å²	187	126.6 Å²	126.6	87%	0.874	75%	0.75	S	S	*	*			trans	82.9	100.4	136.2	-60	-169.4	158.8	0	0	121.2
73	S	24.3	Very low	27	Very low	97 Å²	97	126.8 Å²	126.8	68%	0.678	74%	0.738	S	S	*	*				56	124.1	110.5	87.3	0	0	0	0	122.4
74	S	24.3	Very low	26.9	Very low	119 Å²	119	131.1 Å²	131.1	83%	0.832	74%	0.738	S	S	*	*				86.6	141.2	128	82.2	0	0	0	0	120.8
75	G	27	Very low	26.9	Very low	70 Å²	70	127.8 Å²	127.8	72%	0.722	73%	0.73	S	S	*	*			trans	102.7	78.1	154	0	0	0	0	0	115.1
76	K	26.5	Very low	26.9	Very low	184 Å²	184	129.7 Å²	129.7	80%	0.8	73%	0.733	S	S	*	*				65.4	133.5	87.4	-92.6	-172	163.2	-150.4	0	117.3
77	E	25.3	Very low	26.9	Very low	138 Å²	138	131.2 Å²	131.2	65%	0.645	73%	0.734	S	S	*	*			trans	98.3	113.1	140.7	-78.3	169	-158.9	0	0	120.1
78	D	25	Very low	26.9	Very low	149 Å²	149	129.2 Å²	129.2	80%	0.797	73%	0.726	S	S	*	*				79.6	100.8	128.1	-65.4	-11.6	0	0	0	120.3
79	G	24.6	Very low	27.1	Very low	67 Å²	67	129.9 Å²	129.9	69%	0.691	72%	0.717	S	S	*	*				125.8	142.4	95.9	0	0	0	0	0	115.8
80	P	45.6	Very low	27.4	Very low	121 Å²	121	131.8 Å²	131.8	79%	0.786	71%	0.713	S	S	*	*			trans	-93.9	-177	-166	41.6	-29.4	0	0	0	109.2
81	P	39.8	Very low	27.7	Very low	100 Å²	100	131.3 Å²	131.3	65%	0.649	70%	0.704	S	S	*	*			cis	-164.5	-176.8	49.3	43.5	-18	0	0	0	120.1
82	K	27	Very low	28.1	Very low	165 Å²	165	136.1 Å²	136.1	72%	0.717	70%	0.701	S	S	*	*			trans	75.3	114.6	141.2	-82.7	165.2	-167.8	170.4	0	120.3
83	K	25.8	Very low	28.3	Very low	154 Å²	154	133.8 Å²	133.8	67%	0.67	69%	0.688	S	S	*	*				85.5	121.5	115.6	-77.8	177.2	-179.2	173.8	0	119.9
84	K	25	Very low	28.7	Very low	156 Å²	156	136 Å²	136	68%	0.678	69%	0.685	S	S	*	*				87.5	118.7	122.4	-79.4	179.7	178.7	177.6	0	119
85	K	25.1	Very low	29.1	Very low	159 Å²	159	137.2 Å²	137.2	69%	0.691	68%	0.676	S	S	*	*				78.6	120.6	122.4	-81.2	-177.3	171.7	173.5	0	118.7
86	K	25.6	Very low	29.4	Very low	159 Å²	159	141.7 Å²	141.7	69%	0.691	68%	0.675	S	S	*	*				93	123	118.8	-89.2	-175	174.4	178.9	0	118.1
87	K	25.2	Very low	29.6	Very low	169 Å²	169	139.9 Å²	139.9	74%	0.735	67%	0.667	S	S	*	*				90	107.9	122.7	-96.1	-170.6	172.1	-173	0	117.8
88	S	25.2	Very low	29.8	Very low	85 Å²	85	139.3 Å²	139.3	59%	0.594	66%	0.664	S	S	*	*				64.4	131.7	111.3	74	0	0	0	0	118.2
89	E	28.4	Very low	30	Very low	134 Å²	134	139.9 Å²	139.9	63%	0.626	66%	0.66	S	S	*	*				174.1	146.2	86.4	-103.3	-163.1	145.2	0	0	113
90	K	29.1	Very low	30.1	Very low	133 Å²	133	145 Å²	145	58%	0.578	66%	0.663	S	S	*	*			trans	65.4	147.7	136.9	-68.4	176.9	173.8	146	0	117.7
91	K	30.8	Very low	29.3	Very low	143 Å²	143	147.7 Å²	147.7	62%	0.622	66%	0.662	S	S	*	*			cis	175.6	159.3	5	-102.6	172.8	-178	171	0	101.6
92	R	32.2	Very low	28.6	Very low	170 Å²	170	148 Å²	148	64%	0.642	67%	0.667	S	S	*	*			cis	-179.1	135.6	22.5	-121.8	175.9	168.4	-168.5	-8.6	106.1
93	K	32.4	Very low	28.5	Very low	137 Å²	137	143.4 Å²	143.4	60%	0.596	67%	0.666	S	S	*	*				70.1	135.6	116.3	-77.9	-177.2	-175.5	-179.5	0	115.3
94	K	33.1	Very low	28.4	Very low	144 Å²	144	148.3 Å²	148.3	63%	0.626	68%	0.681	S	S	*	*			cis	165.1	158.8	40	-120.7	176.8	178.1	175.3	0	103.8
95	K	33.2	Very low	28.3	Very low	145 Å²	145	144.7 Å²	144.7	63%	0.63	68%	0.68	S	S	*	*			cis	173.7	144	8.3	-146	179.7	-159.2	-168.7	0	105.3
96	K	32.1	Very low	28.4	Very low	163 Å²	163	143 Å²	143	71%	0.709	69%	0.688	S	S	*	*				140.6	146.6	105.5	-91.8	172.7	179.5	178.7	0	103.8
97	K	31.6	Very low	28.3	Very low	147 Å²	147	139 Å²	139	64%	0.639	69%	0.692	S	S	*	*			cis	177.7	158.4	5.6	-108.6	169.4	166.1	-144.9	0	102.5
98	H	28.9	Very low	28.2	Very low	126 Å²	126	136.6 Å²	136.6	58%	0.583	70%	0.696	S	S	*	*			cis	-161.3	130.9	17.5	-111.6	-56.2	0	0	0	106.3
99	K	28.7	Very low	28.1	Very low	161 Å²	161	138.2 Å²	138.2	70%	0.7	71%	0.708	S	S	*	*				66.9	113.5	100.1	-97.8	-162.5	171.1	174.3	0	115.2
100	K	28.2	Very low	27.9	Very low	175 Å²	175	135.1 Å²	135.1	76%	0.761	71%	0.712	S	S	*	*				84.8	142.9	84.7	-88.3	-167.9	177.2	-171.5	0	111.4
101	K	28.8	Very low	27.8	Very low	176 Å²	176	133.9 Å²	133.9	77%	0.765	72%	0.72	S	S	*	*			cis	-179.4	149.4	47.9	-146.1	-178	177.8	-168.3	0	112.4
102	S	24.8	Very low	27.5	Very low	107 Å²	107	134 Å²	134	75%	0.748	73%	0.727	S	S	*	*			trans	48.6	146.5	138.4	63.5	0	0	0	0	122.3
103	G	23.6	Very low	27.4	Very low	69 Å²	69	130.8 Å²	130.8	71%	0.711	73%	0.731	S	S	*	*			cis	161.6	-178.3	5.4	0	0	0	0	0	112.1
104	R	24	Very low	27.2	Very low	257 Å²	257	132.2 Å²	132.2	97%	0.97	74%	0.74	S	S	*	*			trans	65.6	150.7	171.5	-78	179.9	169.6	173.8	-4.8	115.9
105	A	24.2	Very low	27.3	Very low	80 Å²	80	131 Å²	131	66%	0.661	74%	0.744	S	S	*	*			cis	-168.4	151.5	-13.7	0	0	0	0	0	106.9
106	S	25.7	Very low	27	Very low	122 Å²	122	130.6 Å²	130.6	85%	0.853	75%	0.748	S	S	*	*			trans	31.1	131.3	149.7	60.5	0	0	0	0	122.4
107	G	23.5	Very low	26.9	Very low	75 Å²	75	132 Å²	132	77%	0.773	75%	0.75	S	S	*	*			trans	156.3	121.8	139.7	0	0	0	0	0	116.9
108	S	23.3	Very low	27.1	Very low	119 Å²	119	130.8 Å²	130.8	83%	0.832	76%	0.757	S	S	*	*			trans	75	107.1	148.1	-143	0	0	0	0	117.5
109	S	24.5	Very low	27.3	Very low	119 Å²	119	129.4 Å²	129.4	83%	0.832	76%	0.762	S	S	*	*				87.5	123.1	78.7	-173.8	0	0	0	0	112.7
110	G	24.1	Very low	27.6	Very low	70 Å²	70	127.5 Å²	127.5	72%	0.722	76%	0.759	S	S	*	*			trans	121.8	102.8	145.2	0	0	0	0	0	116.6
111	S	26.1	Very low	28	Very low	106 Å²	106	127.3 Å²	127.3	74%	0.741	77%	0.766	S	S	*	*			trans	63.6	108	152.4	-93.2	0	0	0	0	120.9
112	D	25.4	Very low	28.3	Very low	146 Å²	146	127.1 Å²	127.1	78%	0.781	77%	0.765	S	S	*	*				67.7	83.5	124.4	-50.1	-27.1	0	0	0	117.3
113	S	28.9	Very low	28.6	Very low	102 Å²	102	132.3 Å²	132.3	71%	0.713	77%	0.768	S	S	*	*			trans	-58.6	142.6	134	-36.8	0	0	0	0	107.6
114	E	29.7	Very low	29	Very low	168 Å²	168	137.4 Å²	137.4	79%	0.785	77%	0.773	S	S	*	*				-159.2	132.1	84.7	-85.2	177.9	179.4	0	0	108.2
115	T	33.4	Very low	29.4	Very low	117 Å²	117	131.9 Å²	131.9	72%	0.718	76%	0.759	S	S	*	*				41.2	81.1	53.9	58.8	0	0	0	0	114.1
116	I	27.5	Very low	30	Very low	138 Å²	138	135.8 Å²	135.8	71%	0.708	76%	0.763	S	S	*	*			trans	-93.8	120.2	163.8	-62.1	173.1	0	0	0	108
117	Y	31.1	Very low	30.5	Very low	191 Å²	191	133.5 Å²	133.5	75%	0.749	76%	0.759	S	S	*	*			trans	-83	158.4	173.4	-110	-105.5	0	0	0	110.6	S119	Y117-S119 VanDerWaalsContact C-N 3.32Å; Y117-S119 PolarHBondContact O-N 2.91Å
118	P	35.9	Very low	30.8	Very low	122 Å²	122	136.4 Å²	136.4	79%	0.792	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	66	-168.9	33.3	-27.3	0	0	0	112.6
119	S	32.8	Very low	31.1	Very low	97 Å²	97	139.2 Å²	139.2	68%	0.678	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138	2.8	168.8	44	0	0	0	0	114.5	Y117	Y117-S119 VanDerWaalsContact C-N 3.32Å; Y117-S119 PolarHBondContact O-N 2.91Å
120	D	34.2	Very low	31.2	Very low	122 Å²	122	142.9 Å²	142.9	65%	0.652	75%	0.751	S	S	*	*			trans	-97.4	9.8	-178.3	-64.6	-26.4	0	0	0	114.9
121	L	37.5	Very low	31.3	Very low	170 Å²	170	145.2 Å²	145.2	89%	0.89	74%	0.743	S	S	*	*	S	Bend	trans	-99.7	16.4	-177.3	-69.4	175.2	0	0	0	114.8
122	K	34.8	Very low	31.3	Very low	173 Å²	173	145.7 Å²	145.7	75%	0.752	74%	0.744	S	S	*	*	S	Bend	trans	-139.9	67.6	174	-74.6	-166.3	173.8	-170.6	0	112.8
123	R	30.5	Very low	31.4	Very low	216 Å²	216	143.4 Å²	143.4	82%	0.815	75%	0.745	S	S	*	*	S	Bend	trans	-154.8	55.8	146.4	-124.3	-177.8	-165.8	-176.5	3.5	110.7
124	E	31	Very low	31.4	Very low	176 Å²	176	142.8 Å²	142.8	82%	0.822	74%	0.74	S	S	*	*			trans	-138.5	57.4	151	-85.7	-164.2	162.8	0	0	107.4
125	E	34	Very low	31.4	Very low	141 Å²	141	142.1 Å²	142.1	66%	0.659	74%	0.742	S	S	*	*			trans	-138.5	54.7	169.4	-91.7	-172.7	159.6	0	0	108.8
126	E	36.1	Very low	31.3	Very low	161 Å²	161	139.7 Å²	139.7	75%	0.752	74%	0.74	S	S	*	*	S	Bend	trans	-131.2	88.2	143.4	-82.7	-171.9	165.6	0	0	106	W29	W29-E126 VanDerWaalsContact CH2-OE2 3.22Å; W29-E126 WeakPolarHBondContact CH2-OE2 3.34Å; W29-E126 WeakPolarHBondContact CZ3-OE1 3.5Å; W29-E126 VanDerWaalsContact CZ3-OE2 3.28Å; W29-E126 WeakPolarHBondContact CZ3-OE2 3.44Å
127	G	36.9	Very low	31.5	Very low	74 Å²	74	138 Å²	138	76%	0.763	74%	0.736	S	S	*	*	S	Bend	trans	147.9	15.5	-177.7	0	0	0	0	0	116.8
128	I	29.7	Very low	31.9	Very low	136 Å²	136	139.9 Å²	139.9	70%	0.697	74%	0.742	S	S	*	*			trans	-139.8	110.3	173.7	-56	180	0	0	0	110.6
129	R	28.8	Very low	31.9	Very low	179 Å²	179	140.7 Å²	140.7	68%	0.675	73%	0.733	S	S	*	*			trans	-49.5	134.2	168.8	-83.2	172.8	166.6	-175.8	-6.3	110.8	Q131 D357	R129-Q131 PolarHBondContact O-N 3.37Å; R129-D357 IonicContact NH1-OD1 3.72Å
130	H	26.9	Very low	32	Very low	195 Å²	195	139.5 Å²	139.5	90%	0.903	72%	0.722	S	S	*	*			trans	-44.7	109.8	164.3	-72.1	-69.9	0	0	0	111.9
131	Q	25.7	Very low	32.3	Very low	120 Å²	120	137.5 Å²	137.5	56%	0.561	71%	0.705	S	S	*	*			trans	-101.1	131.7	158.8	-74	-157.2	19.6	0	0	109.2	R129 A133	R129-Q131 PolarHBondContact O-N 3.37Å; Q131-A133 PolarHBondContact O-N 3Å
132	P	27.2	Very low	32.6	Very low	116 Å²	116	136.4 Å²	136.4	75%	0.753	70%	0.699	S	S	*	*			trans	-69.2	124.6	165.2	29	-29.7	0	0	0	108.4	S134	P132-S134 PolarHBondContact O-N 3.39Å
133	A	26.1	Very low	32.9	Very low	97 Å²	97	131.2 Å²	131.2	80%	0.802	68%	0.68	S	S	*	*			trans	-64.2	98.6	173.9	0	0	0	0	0	109.9	Q131 L135	Q131-A133 PolarHBondContact O-N 3Å; A133-L135 VanDerWaalsContact C-N 3.3Å; A133-L135 PolarHBondContact O-N 3.19Å
134	S	29.1	Very low	33.5	Very low	89 Å²	89	122.8 Å²	122.8	62%	0.622	65%	0.651	S	S	*	*			trans	-71.5	86	163.5	54.2	0	0	0	0	108.6	P132 G136	P132-S134 PolarHBondContact O-N 3.39Å; S134-G136 PolarHBondContact O-N 3.38Å
135	L	30.8	Very low	34.3	Very low	155 Å²	155	118.7 Å²	118.7	81%	0.812	63%	0.634	S	S	*	*			trans	-70.5	76	154.3	-81.6	163.8	0	0	0	107.7	A133 T137	A133-L135 VanDerWaalsContact C-N 3.3Å; A133-L135 PolarHBondContact O-N 3.19Å; L135-T137 PolarHBondContact O-N 3.36Å
136	G	31.2	Very low	35	Very low	66 Å²	66	120.1 Å²	120.1	68%	0.68	64%	0.641	S	S	*	*			trans	-72.6	58.4	160.4	0	0	0	0	0	109.4	S134 R138	S134-G136 PolarHBondContact O-N 3.38Å; G136-R138 VanDerWaalsContact C-N 3.3Å; G136-R138 PolarHBondContact O-N 3.13Å
137	T	32	Very low	35.1	Very low	101 Å²	101	116.2 Å²	116.2	62%	0.62	63%	0.631	S	S	*	*			trans	-65.6	101.9	160.3	-27.8	0	0	0	0	104.9	L135 F139	L135-T137 PolarHBondContact O-N 3.36Å; T137-F139 HydrophobicContact CG2-CB 4.42Å; T137-F139 PolarHBondContact O-N 3.15Å
138	R	38.6	Very low	35.2	Very low	232 Å²	232	118.9 Å²	118.9	88%	0.875	64%	0.635	S	S	*	*			trans	-61.9	75	153.9	-94.3	-175.3	175.6	170.3	1.1	106.8	G136 T140	G136-R138 VanDerWaalsContact C-N 3.3Å; G136-R138 PolarHBondContact O-N 3.13Å; R138-T140 PolarHBondContact O-N 2.86Å
139	F	36	Very low	35.5	Very low	139 Å²	139	116.2 Å²	116.2	61%	0.61	63%	0.625	S	S	*	*			trans	-80.2	76.8	161.5	-157.7	-85.9	0	0	0	105.8	T137 W141	T137-F139 HydrophobicContact CG2-CB 4.42Å; T137-F139 PolarHBondContact O-N 3.15Å; F139-W141 HydrophobicContact CD1-CD2 4.26Å; F139-W141 HydrophobicContact CD1-CZ2 4.29Å; F139-W141 AromaticContact CE1-CD2 3.94Å; F139-W141 HydrophobicContact CE1-CD2 3.94Å; F139-W141 AromaticContact CE1-CE2 3.9Å; F139-W141 AromaticContact CE1-CE3 3.99Å; F139-W141 HydrophobicContact CE1-CE3 3.99Å; F139-W141 HydrophobicContact CE1-CH2 4.01Å; F139-W141 AromaticContact CE1-CZ2 3.94Å; F139-W141 HydrophobicContact CE1-CZ2 3.94Å; F139-W141 HydrophobicContact CE1-CZ3 4.03Å; F139-W141 PolarHBondContact O-N 3.4Å
140	T	34.7	Very low	36	Very low	71 Å²	71	116.5 Å²	116.5	44%	0.436	63%	0.634	S	S	.	*			trans	-74.6	115.7	169.8	-33.7	0	0	0	0	105.3	R138 D144 L145	R138-T140 PolarHBondContact O-N 2.86Å; T140-D144 HydrophobicContact CG2-CB 3.76Å; T140-L145 HydrophobicContact CG2-CD2 4.24Å
141	W	41.4	Very low	36.7	Very low	80 Å²	80	113.6 Å²	113.6	30%	0.303	63%	0.625	S	S	.	*			trans	-60.2	145.9	172.2	-67.3	88.5	0	0	0	107.7	F139 D143 D144	F139-W141 HydrophobicContact CD1-CD2 4.26Å; F139-W141 HydrophobicContact CD1-CZ2 4.29Å; F139-W141 AromaticContact CE1-CD2 3.94Å; F139-W141 HydrophobicContact CE1-CD2 3.94Å; F139-W141 AromaticContact CE1-CE2 3.9Å; F139-W141 AromaticContact CE1-CE3 3.99Å; F139-W141 HydrophobicContact CE1-CE3 3.99Å; F139-W141 HydrophobicContact CE1-CH2 4.01Å; F139-W141 AromaticContact CE1-CZ2 3.94Å; F139-W141 HydrophobicContact CE1-CZ2 3.94Å; F139-W141 HydrophobicContact CE1-CZ3 4.03Å; F139-W141 PolarHBondContact O-N 3.4Å; W141-D143 PolarHBondContact O-N 3.42Å; W141-D144 PolarHBondContact N-OD2 2.82Å; W141-D144 WeakPolarHBondContact O-CB 3.27Å; W141-D144 PolarHBondContact O-N 3.28Å
142	L	42.9	Very low	37.4	Very low	148 Å²	148	112.2 Å²	112.2	78%	0.775	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-53.7	-25.7	177	-125.6	118.6	0	0	0	112
143	D	41.6	Very low	37.8	Very low	64 Å²	64	114.9 Å²	114.9	34%	0.342	63%	0.627	S	S	.	*	G	3₁₀ helix	trans	-76.6	-13.2	175.5	-69.9	-40.5	0	0	0	115.4	W141 R1023	W141-D143 PolarHBondContact O-N 3.42Å; D143-R1023 IonicContact OD1-CZ 2.79Å; D143-R1023 IonicContact OD1-NE 3.81Å; D143-R1023 IonicContact OD1-NH2 3.83Å; D143-R1023 PolarHBondContact OD1-NH2 3.37Å
144	D	43.1	Very low	38.6	Very low	38 Å²	38	116.5 Å²	116.5	20%	0.203	63%	0.631	C	S	.	*	G	3₁₀ helix	trans	-95.1	-3.3	-179.3	-70.2	-40.5	0	0	0	112.8	T140 W141 R1077	T140-D144 HydrophobicContact CG2-CB 3.76Å; W141-D144 PolarHBondContact N-OD2 2.82Å; W141-D144 WeakPolarHBondContact O-CB 3.27Å; W141-D144 PolarHBondContact O-N 3.28Å; D144-R1077 IonicContact OD1-CZ 2.68Å; D144-R1077 IonicContact OD1-NH1 3.34Å; D144-R1077 PolarHBondContact OD1-NH1 3.33Å; D144-R1077 IonicContact OD1-NH2 3.16Å; D144-R1077 PolarHBondContact OD1-NH2 3.17Å; D144-R1077 IonicContact OD2-NH1 3.32Å; D144-R1077 PolarHBondContact OD2-NH1 3.41Å
145	L	47.9	Very low	39	Very low	91 Å²	91	117.7 Å²	117.7	48%	0.476	63%	0.634	S	S	.	*			trans	-77.3	123.4	175.4	-67.6	171.5	0	0	0	110.6	T140	T140-L145 HydrophobicContact CG2-CD2 4.24Å
146	Q	47.7	Very low	39.4	Very low	171 Å²	171	115.8 Å²	115.8	80%	0.799	63%	0.625	S	S	*	*			trans	-86.5	-10.3	-170.2	-63.6	179.8	-2.9	0	0	114.2
147	S	39.8	Very low	40.1	Very low	78 Å²	78	123.9 Å²	123.9	55%	0.545	64%	0.635	S	S	.	*	S	Bend	trans	-145.6	153.2	177.2	56.8	0	0	0	0	110.9	T149	S147-T149 VanDerWaalsContact C-N 3.29Å; S147-T149 PolarHBondContact O-N 3.14Å; S147-T149 PolarHBondContact O-OG1 3.46Å
148	P	37.8	Very low	40.8	Very low	130 Å²	130	126.9 Å²	126.9	84%	0.844	64%	0.639	S	S	*	*			trans	-66.4	93.8	169	28	-30.6	0	0	0	107.8	E150	P148-E150 PolarHBondContact O-N 3.43Å
149	T	36.8	Very low	41.5	Very low	80 Å²	80	120.6 Å²	120.6	49%	0.491	63%	0.628	S	S	.	*			trans	-66.4	131.2	171	-25.8	0	0	0	0	107.2	S147 N151	S147-T149 VanDerWaalsContact C-N 3.29Å; S147-T149 PolarHBondContact O-N 3.14Å; S147-T149 PolarHBondContact O-OG1 3.46Å; T149-N151 PolarHBondContact O-N 3.26Å
150	E	38.9	Very low	42.6	Very low	186 Å²	186	117.3 Å²	117.3	87%	0.869	62%	0.617	S	S	*	*	S	Bend	trans	-57.4	-16.5	-177.6	-69.3	-174.6	153.7	0	0	113.6	P148	P148-E150 PolarHBondContact O-N 3.43Å
151	N	41.9	Very low	43.6	Very low	133 Å²	133	118.5 Å²	118.5	71%	0.711	63%	0.626	S	S	*	*			trans	-123.7	88.2	176.1	-69.4	-40.6	0	0	0	111.7	T149 F153	T149-N151 PolarHBondContact O-N 3.26Å; N151-F153 PolarHBondContact O-N 3.07Å; N151-F153 VanDerWaalsContact O-N 3.09Å
152	P	38.8	Very low	44.1	Very low	92 Å²	92	116.6 Å²	116.6	60%	0.597	63%	0.627	S	S	*	*			trans	-71.3	4.5	175.7	27.6	-32.9	0	0	0	114
153	F	37.4	Very low	44.9	Very low	172 Å²	172	111.7 Å²	111.7	75%	0.754	60%	0.602	S	S	*	*			trans	-125.7	121.4	179.5	-58.6	-77.8	0	0	0	109.9	N151	N151-F153 PolarHBondContact O-N 3.07Å; N151-F153 VanDerWaalsContact O-N 3.09Å
154	C	41.6	Very low	45.5	Very low	130 Å²	130	118.6 Å²	118.6	88%	0.878	62%	0.623	S	S	*	*			trans	-84.7	114.1	162.7	-174.3	0	0	0	0	107.6
155	V	38.1	Very low	45.9	Very low	114 Å²	114	121.4 Å²	121.4	69%	0.691	64%	0.642	S	S	*	*			trans	-89.2	103.6	168.9	179.9	0	0	0	0	106.7	R157	V155-R157 HydrophobicContact CG1-CG 4.43Å; V155-R157 PolarHBondContact O-N 3.4Å; V155-R157 VanDerWaalsContact O-N 3.1Å
156	D	39.6	Very low	46.5	Very low	116 Å²	116	125.1 Å²	125.1	62%	0.62	65%	0.651	S	S	*	*			trans	-65.3	111.1	168.9	-169	-3.6	0	0	0	108.4	K158	D156-K158 VanDerWaalsContact C-N 3.28Å; D156-K158 VanDerWaalsContact OD1-CB 3.28Å; D156-K158 WeakPolarHBondContact OD1-CB 3.5Å; D156-K158 PolarHBondContact OD1-N 3.15Å
157	R	45.4	Very low	46.5	Very low	235 Å²	235	126.3 Å²	126.3	89%	0.887	65%	0.653	S	S	*	*			trans	-85.3	-5.3	177.1	-69.3	-175.1	174.2	171.7	-0.5	111.9	V155	V155-R157 HydrophobicContact CG1-CG 4.43Å; V155-R157 PolarHBondContact O-N 3.4Å; V155-R157 VanDerWaalsContact O-N 3.1Å
158	K	47.3	Very low	47.3	Very low	164 Å²	164	126.1 Å²	126.1	71%	0.713	65%	0.652	S	S	*	*	S	Bend	trans	-78.9	134.7	175.3	-65.1	-177.4	178.1	176.6	0	109	D156 D160	D156-K158 VanDerWaalsContact C-N 3.28Å; D156-K158 VanDerWaalsContact OD1-CB 3.28Å; D156-K158 WeakPolarHBondContact OD1-CB 3.5Å; D156-K158 PolarHBondContact OD1-N 3.15Å; K158-D160 PolarHBondContact O-N 3.04Å
159	P	53.6	Low	48.3	Very low	100 Å²	100	125.4 Å²	125.4	65%	0.649	64%	0.641	S	S	*	*			trans	-62.1	127	172.9	25.4	-31.1	0	0	0	108.5	P161	P159-P161 VanDerWaalsContact O-CD 3.25Å; P159-P161 WeakPolarHBondContact O-CD 3.17Å; P159-P161 VanDerWaalsContact O-N 3.08Å
160	D	58	Low	49.3	Very low	71 Å²	71	129 Å²	129	38%	0.38	65%	0.646	S	S	.	*			trans	-52.7	115.8	174.9	176.6	-9.6	0	0	0	109.4	K158 A162 N163 W164	K158-D160 PolarHBondContact O-N 3.04Å; D160-A162 PolarHBondContact O-N 2.6Å; D160-A162 VanDerWaalsContact O-N 3.15Å; D160-A162 VanDerWaalsContact OD1-CB 3.26Å; D160-A162 WeakPolarHBondContact OD1-CB 3.28Å; D160-A162 PolarHBondContact OD1-N 3.29Å; D160-N163 HydrophobicContact CB-CB 4.06Å; D160-N163 VanDerWaalsContact CB-ND2 3.34Å; D160-N163 WeakPolarHBondContact CB-ND2 3.34Å; D160-N163 PolarHBondContact O-N 2.87Å; D160-N163 PolarHBondContact OD2-ND2 2.73Å; D160-W164 PolarHBondContact O-N 2.68Å
161	P	56	Low	49.8	Very low	96 Å²	96	131 Å²	131	62%	0.623	65%	0.646	S	S	*	*	H	α-helix	trans	-58	-29.3	-178.1	-23.6	33.1	0	0	0	112.4	P159 W164 T165	P159-P161 VanDerWaalsContact O-CD 3.25Å; P159-P161 WeakPolarHBondContact O-CD 3.17Å; P159-P161 VanDerWaalsContact O-N 3.08Å; P161-W164 PolarHBondContact O-N 2.99Å; P161-T165 VanDerWaalsContact O-CB 3.27Å; P161-T165 WeakPolarHBondContact O-CB 3.2Å; P161-T165 PolarHBondContact O-N 2.79Å; P161-T165 PolarHBondContact O-OG1 3.17Å
162	A	52	Low	50.3	Low	39 Å²	39	127.4 Å²	127.4	32%	0.322	64%	0.64	S	S	.	*	H	α-helix	trans	-69.7	-41.7	176.3	0	0	0	0	0	111.1	D160 W164 T165 Y166	D160-A162 PolarHBondContact O-N 2.6Å; D160-A162 VanDerWaalsContact O-N 3.15Å; D160-A162 VanDerWaalsContact OD1-CB 3.26Å; D160-A162 WeakPolarHBondContact OD1-CB 3.28Å; D160-A162 PolarHBondContact OD1-N 3.29Å; A162-W164 VanDerWaalsContact C-N 3.28Å; A162-W164 PolarHBondContact O-N 3.31Å; A162-T165 PolarHBondContact O-N 3.03Å; A162-Y166 HydrophobicContact CB-CD2 4.32Å; A162-Y166 HydrophobicContact CB-CE2 4.45Å; A162-Y166 WeakPolarHBondContact O-CD2 3.22Å; A162-Y166 PolarHBondContact O-N 2.89Å
163	N	59.3	Low	50.8	Low	46 Å²	46	129.2 Å²	129.2	25%	0.246	65%	0.645	C	S	.	*	H	α-helix	trans	-66.1	-33.1	175.9	-66.6	-27.9	0	0	0	112	D160 K167 S168 L169	D160-N163 HydrophobicContact CB-CB 4.06Å; D160-N163 VanDerWaalsContact CB-ND2 3.34Å; D160-N163 WeakPolarHBondContact CB-ND2 3.34Å; D160-N163 PolarHBondContact O-N 2.87Å; D160-N163 PolarHBondContact OD2-ND2 2.73Å; N163-K167 VanDerWaalsContact O-CA 3.29Å; N163-K167 WeakPolarHBondContact O-CA 3.28Å; N163-K167 PolarHBondContact O-N 2.84Å; N163-S168 PolarHBondContact OD1-O 2.94Å; N163-L169 WeakPolarHBondContact OD1-CA 3.41Å
164	W	53.9	Low	51.6	Low	209 Å²	209	124.3 Å²	124.3	79%	0.792	63%	0.629	S	S	*	*	H	α-helix	trans	-69.9	-42.9	173	-165.3	-103.1	0	0	0	112.2	D160 P161 A162	D160-W164 PolarHBondContact O-N 2.68Å; P161-W164 PolarHBondContact O-N 2.99Å; A162-W164 VanDerWaalsContact C-N 3.28Å; A162-W164 PolarHBondContact O-N 3.31Å
165	T	51.6	Low	51.7	Low	96 Å²	96	120.8 Å²	120.8	59%	0.589	61%	0.609	S	S	*	*	H	α-helix	trans	-68.2	-40.2	-178.6	-56.5	0	0	0	0	112.1	P161 A162	P161-T165 VanDerWaalsContact O-CB 3.27Å; P161-T165 WeakPolarHBondContact O-CB 3.2Å; P161-T165 PolarHBondContact O-N 2.79Å; P161-T165 PolarHBondContact O-OG1 3.17Å; A162-T165 PolarHBondContact O-N 3.03Å
166	Y	59.8	Low	52.4	Low	169 Å²	169	125.6 Å²	125.6	66%	0.663	62%	0.615	S	S	*	*	H	α-helix	trans	-102.9	3.4	-175	-58.4	-66.6	0	0	0	114	A162 S168	A162-Y166 HydrophobicContact CB-CD2 4.32Å; A162-Y166 HydrophobicContact CB-CE2 4.45Å; A162-Y166 WeakPolarHBondContact O-CD2 3.22Å; A162-Y166 PolarHBondContact O-N 2.89Å; Y166-S168 PolarHBondContact O-N 2.82Å; Y166-S168 PolarHBondContact O-OG 3.2Å
167	K	49.6	Very low	53.1	Low	196 Å²	196	125.8 Å²	125.8	85%	0.852	61%	0.608	S	S	*	*	S	Bend	trans	44.4	28.2	-177.3	-65.5	-171.3	177.2	179.6	0	114	N163	N163-K167 VanDerWaalsContact O-CA 3.29Å; N163-K167 WeakPolarHBondContact O-CA 3.28Å; N163-K167 PolarHBondContact O-N 2.84Å
168	S	56.6	Low	53.5	Low	74 Å²	74	124.3 Å²	124.3	52%	0.517	60%	0.602	S	S	.	*	S	Bend	trans	-163.3	152.7	179.7	65	0	0	0	0	109.9	N163 Y166	N163-S168 PolarHBondContact OD1-O 2.94Å; Y166-S168 PolarHBondContact O-N 2.82Å; Y166-S168 PolarHBondContact O-OG 3.2Å
169	L	57.6	Low	53.8	Low	116 Å²	116	121.3 Å²	121.3	61%	0.607	59%	0.586	S	S	*	*			trans	-62.8	136.8	175.3	-73.1	158.2	0	0	0	110.4	N163 R171 V174	N163-L169 WeakPolarHBondContact OD1-CA 3.41Å; L169-R171 PolarHBondContact O-N 3.04Å; L169-R171 VanDerWaalsContact O-N 3.12Å; L169-V174 HydrophobicContact CB-CG2 3.64Å; L169-V174 HydrophobicContact CD1-CG2 4.4Å
170	Y	57.7	Low	53.8	Low	154 Å²	154	123.5 Å²	123.5	60%	0.604	59%	0.586	S	S	*	*			trans	-54.3	120.9	174.2	-177.5	-112.1	0	0	0	110.2	G172 D173 V174	Y170-G172 PolarHBondContact O-N 3.24Å; Y170-D173 WeakPolarHBondContact CD1-OD2 3.42Å; Y170-D173 PolarHBondContact O-N 3.41Å; Y170-V174 PolarHBondContact O-N 3.29Å
171	R	49.3	Very low	53.7	Low	228 Å²	228	122.4 Å²	122.4	86%	0.86	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.6	-20.7	-171.8	-113.7	-176.8	-179.7	-155.2	0.2	114.2	L169	L169-R171 PolarHBondContact O-N 3.04Å; L169-R171 VanDerWaalsContact O-N 3.12Å
172	G	52.5	Low	53.5	Low	58 Å²	58	124.1 Å²	124.1	60%	0.598	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	-26.8	175.2	0	0	0	0	0	113.7	Y170	Y170-G172 PolarHBondContact O-N 3.24Å
173	D	50.7	Low	53.4	Low	130 Å²	130	125.1 Å²	125.1	70%	0.695	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.5	-11.7	-174.8	-59	-24.4	0	0	0	112.3	Y170 A175	Y170-D173 WeakPolarHBondContact CD1-OD2 3.42Å; Y170-D173 PolarHBondContact O-N 3.41Å; D173-A175 PolarHBondContact O-N 3.05Å
174	V	53	Low	52.9	Low	69 Å²	69	128.7 Å²	128.7	42%	0.418	64%	0.639	S	S	.	*	S	Bend	trans	-76.3	108.1	171.2	-175.9	0	0	0	0	109.1	L169 Y170 R176	L169-V174 HydrophobicContact CB-CG2 3.64Å; L169-V174 HydrophobicContact CD1-CG2 4.4Å; Y170-V174 PolarHBondContact O-N 3.29Å; V174-R176 PolarHBondContact O-N 2.65Å; V174-R176 VanDerWaalsContact O-N 3.14Å
175	A	45.1	Very low	52.3	Low	56 Å²	56	125.8 Å²	125.8	46%	0.463	64%	0.638	S	S	.	*			trans	-52.7	119.8	172.9	0	0	0	0	0	110.7	D173 Y177	D173-A175 PolarHBondContact O-N 3.05Å; A175-Y177 HydrophobicContact CB-CD1 3.92Å; A175-Y177 HydrophobicContact CB-CE1 3.63Å; A175-Y177 PolarHBondContact O-N 3.05Å
176	R	52.3	Low	52.1	Low	216 Å²	216	124 Å²	124	82%	0.815	64%	0.639	S	S	*	*	S	Bend	trans	-72.9	8.2	-175.9	-58.3	-177.6	-179.4	-175.1	0.5	114.5	V174 W196	V174-R176 PolarHBondContact O-N 2.65Å; V174-R176 VanDerWaalsContact O-N 3.14Å; R176-W196 VanDerWaalsContact C-CE3 3.47Å; R176-W196 HydrophobicContact CB-CE3 4Å; R176-W196 HydrophobicContact CB-CZ3 3.82Å; R176-W196 VanDerWaalsContact O-CE3 3.28Å
177	Y	54.4	Low	51.5	Low	119 Å²	119	121.3 Å²	121.3	47%	0.467	64%	0.635	S	S	.	*			trans	-110.3	143.1	178.1	64.9	-93.8	0	0	0	111.6	A175 V194 W196	A175-Y177 HydrophobicContact CB-CD1 3.92Å; A175-Y177 HydrophobicContact CB-CE1 3.63Å; A175-Y177 PolarHBondContact O-N 3.05Å; Y177-V194 VanDerWaalsContact CB-CG1 3.41Å; Y177-V194 HydrophobicContact CD2-CG1 3.57Å; Y177-V194 HydrophobicContact CG-CG1 3.71Å; Y177-W196 AromaticContact CD1-CH2 3.45Å; Y177-W196 HydrophobicContact CD1-CH2 3.45Å; Y177-W196 VanDerWaalsContact CD1-CH2 3.45Å; Y177-W196 AromaticContact CD1-CZ2 3.91Å; Y177-W196 HydrophobicContact CD1-CZ2 3.91Å; Y177-W196 AromaticContact CD1-CZ3 3.92Å; Y177-W196 HydrophobicContact CD1-CZ3 3.92Å; Y177-W196 HydrophobicContact CE1-CH2 4.46Å; Y177-W196 HydrophobicContact CG-CH2 4.01Å; Y177-W196 HydrophobicContact CG-CZ2 4.14Å; Y177-W196 HydrophobicContact CG-CZ3 4.31Å
178	R	53.5	Low	51.7	Low	205 Å²	205	115.2 Å²	115.2	77%	0.774	61%	0.612	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-110.2	134.7	168.9	-70.7	-166.3	-176.9	-159.8	2.6	110.6	S195	R178-S195 PolarHBondContact N-O 3.18Å; R178-S195 PolarHBondContact O-N 3.32Å; R178-S195 PolarHBondContact O-OG 2.96Å
179	R	52.8	Low	51.3	Low	100 Å²	100	120.4 Å²	120.4	38%	0.377	63%	0.625	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.1	126.7	171.8	-178.6	178.6	156.8	103.2	3.2	108.8	S183	R179-S183 PolarHBondContact NH2-O 2.86Å
180	K	53.8	Low	51	Low	147 Å²	147	125.4 Å²	125.4	64%	0.639	64%	0.636	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-86.3	109.1	173.8	-144.1	176.4	-174.2	176.3	0	108	Q192 G193	K180-Q192 WeakPolarHBondContact O-CA 3.4Å; K180-G193 VanDerWaalsContact CB-O 3.28Å; K180-G193 WeakPolarHBondContact CB-O 3.13Å; K180-G193 PolarHBondContact N-O 3.16Å
181	G	56.8	Low	50.6	Low	48 Å²	48	128.2 Å²	128.2	50%	0.495	65%	0.646	S	S	.	*	S	Bend	trans	114.9	148.2	178.4	0	0	0	0	0	114.5
182	S	51	Low	51	Low	132 Å²	132	119.2 Å²	119.2	92%	0.923	61%	0.613	S	S	*	*			trans	-106.5	17.3	-165.3	56.3	0	0	0	0	116.3
183	S	51	Low	51.2	Low	60 Å²	60	118 Å²	118	42%	0.42	60%	0.601	S	S	.	*			trans	-90.3	143.2	173.5	175.8	0	0	0	0	111.4	R179 L185	R179-S183 PolarHBondContact NH2-O 2.86Å; S183-L185 PolarHBondContact OG-N 3.27Å
184	S	48.8	Very low	51.3	Low	121 Å²	121	115.4 Å²	115.4	85%	0.846	59%	0.589	S	S	*	*	S	Bend	trans	-96.2	2.3	179.1	43.2	0	0	0	0	114.6
185	L	40.3	Very low	51.2	Low	147 Å²	147	114 Å²	114	77%	0.77	58%	0.582	S	S	*	*	S	Bend	trans	-132.9	118	-179.9	-70.9	166.7	0	0	0	111.7	S183	S183-L185 PolarHBondContact OG-N 3.27Å
186	G	47.4	Very low	51.5	Low	59 Å²	59	119.4 Å²	119.4	61%	0.608	59%	0.591	S	S	*	*			trans	75.1	137.5	172.5	0	0	0	0	0	116.1	Q192	G186-Q192 PolarHBondContact O-NE2 3.13Å; G186-Q192 VanDerWaalsContact O-NE2 3.15Å; G186-Q192 PolarHBondContact O-OE1 3Å
187	L	48.3	Very low	51.2	Low	112 Å²	112	117 Å²	117	59%	0.586	59%	0.589	S	S	*	*			trans	-88.7	103	173.8	-79.3	165.6	0	0	0	110.8	F189 Q192	L187-F189 PolarHBondContact O-N 2.88Å; L187-Q192 VanDerWaalsContact CA-OE1 3.3Å; L187-Q192 HydrophobicContact CD2-CB 4.04Å
188	D	52.4	Low	50.6	Low	68 Å²	68	119.4 Å²	119.4	36%	0.364	61%	0.61	S	S	.	*			trans	-77.3	104.8	166.4	-179.1	0.3	0	0	0	109.4	R190 R191 Q192	D188-R190 PolarHBondContact O-N 3.5Å; D188-R190 PolarHBondContact OD1-N 2.84Å; D188-R191 PolarHBondContact O-N 3.2Å; D188-Q192 HydrophobicContact CB-CG 4.25Å; D188-Q192 WeakPolarHBondContact O-CB 3.33Å; D188-Q192 PolarHBondContact O-N 3.39Å
189	F	48.7	Very low	49.8	Very low	183 Å²	183	114.6 Å²	114.6	80%	0.803	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-12.2	-175	28.5	-90.3	0	0	0	114.6	L187	L187-F189 PolarHBondContact O-N 2.88Å
190	R	51.5	Low	48.9	Very low	222 Å²	222	118 Å²	118	84%	0.838	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	-22.5	175.6	-64.2	-170.8	-176.8	-162.2	2.6	114	D188	D188-R190 PolarHBondContact O-N 3.5Å; D188-R190 PolarHBondContact OD1-N 2.84Å
191	R	50	Low	47.9	Very low	213 Å²	213	117.4 Å²	117.4	80%	0.804	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.4	-13.3	-173.1	-67.7	-172.9	175.7	-160.9	1.1	114.2	D188	D188-R191 PolarHBondContact O-N 3.2Å
192	Q	57	Low	47.2	Very low	38 Å²	38	125.1 Å²	125.1	18%	0.178	66%	0.657	C	S	.	*			trans	-121.1	135.4	-176.7	-54.1	-178.7	19.5	0	0	109.6	K180 G186 L187 D188	K180-Q192 WeakPolarHBondContact O-CA 3.4Å; G186-Q192 PolarHBondContact O-NE2 3.13Å; G186-Q192 VanDerWaalsContact O-NE2 3.15Å; G186-Q192 PolarHBondContact O-OE1 3Å; L187-Q192 VanDerWaalsContact CA-OE1 3.3Å; L187-Q192 HydrophobicContact CD2-CB 4.04Å; D188-Q192 HydrophobicContact CB-CG 4.25Å; D188-Q192 WeakPolarHBondContact O-CB 3.33Å; D188-Q192 PolarHBondContact O-N 3.39Å
193	G	57.5	Low	46.3	Very low	32 Å²	32	128.8 Å²	128.8	33%	0.33	66%	0.656	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-157.5	161.4	-179.8	0	0	0	0	0	111.1	K180	K180-G193 VanDerWaalsContact CB-O 3.28Å; K180-G193 WeakPolarHBondContact CB-O 3.13Å; K180-G193 PolarHBondContact N-O 3.16Å
194	V	52.8	Low	45.7	Very low	76 Å²	76	136 Å²	136	46%	0.461	68%	0.68	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.2	111.4	177.6	178.7	0	0	0	0	107.7	Y177	Y177-V194 VanDerWaalsContact CB-CG1 3.41Å; Y177-V194 HydrophobicContact CD2-CG1 3.57Å; Y177-V194 HydrophobicContact CG-CG1 3.71Å
195	S	49.7	Very low	44.8	Very low	39 Å²	39	139.9 Å²	139.9	27%	0.273	68%	0.682	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.8	124.6	175.6	64.6	0	0	0	0	110	R178	R178-S195 PolarHBondContact N-O 3.18Å; R178-S195 PolarHBondContact O-N 3.32Å; R178-S195 PolarHBondContact O-OG 2.96Å
196	W	50.8	Low	44.3	Very low	171 Å²	171	142.3 Å²	142.3	65%	0.648	69%	0.686	S	S	*	*			trans	-94.6	96.9	162.4	-52.4	87.1	0	0	0	105.5	R176 Y177	R176-W196 VanDerWaalsContact C-CE3 3.47Å; R176-W196 HydrophobicContact CB-CE3 4Å; R176-W196 HydrophobicContact CB-CZ3 3.82Å; R176-W196 VanDerWaalsContact O-CE3 3.28Å; Y177-W196 AromaticContact CD1-CH2 3.45Å; Y177-W196 HydrophobicContact CD1-CH2 3.45Å; Y177-W196 VanDerWaalsContact CD1-CH2 3.45Å; Y177-W196 AromaticContact CD1-CZ2 3.91Å; Y177-W196 HydrophobicContact CD1-CZ2 3.91Å; Y177-W196 AromaticContact CD1-CZ3 3.92Å; Y177-W196 HydrophobicContact CD1-CZ3 3.92Å; Y177-W196 HydrophobicContact CE1-CH2 4.46Å; Y177-W196 HydrophobicContact CG-CH2 4.01Å; Y177-W196 HydrophobicContact CG-CZ2 4.14Å; Y177-W196 HydrophobicContact CG-CZ3 4.31Å
197	E	46.6	Very low	43.7	Very low	164 Å²	164	146.3 Å²	146.3	77%	0.766	70%	0.698	S	S	*	*			trans	-124.4	113.5	173.8	-103.7	-179.8	173.1	0	0	109.7
198	D	43	Very low	42.7	Very low	170 Å²	170	144.6 Å²	144.6	91%	0.909	71%	0.707	S	S	*	*			trans	-72.6	118.7	149	-76.2	-36.4	0	0	0	107.3
199	S	35	Very low	42.3	Very low	104 Å²	104	147.4 Å²	147.4	73%	0.727	73%	0.727	S	S	*	*			trans	-75.7	134	179.1	-44.6	0	0	0	0	111.4
200	E	35.4	Very low	41.5	Very low	173 Å²	173	146.2 Å²	146.2	81%	0.808	73%	0.729	S	S	*	*			trans	94.3	99.5	153.5	-49.5	-161.3	165.3	0	0	119.3
201	T	32.8	Very low	40.5	Very low	134 Å²	134	139.4 Å²	139.4	82%	0.822	73%	0.728	S	S	*	*				178.4	142.5	83.9	37.1	0	0	0	0	111.5	K203	T201-K203 PolarHBondContact O-N 3.46Å
202	K	41.5	Very low	39.6	Very low	210 Å²	210	137.3 Å²	137.3	91%	0.913	73%	0.732	S	S	*	*			trans	-60.6	121.3	-179.3	-66.3	169.5	177	171.7	0	112.2
203	K	32.3	Very low	38.6	Very low	209 Å²	209	139.7 Å²	139.7	91%	0.909	76%	0.759	S	S	*	*			trans	-161	119.9	143.5	-109.3	168.2	-171.1	176	0	111.8	T201	T201-K203 PolarHBondContact O-N 3.46Å
204	K	38	Very low	37.5	Very low	211 Å²	211	143.2 Å²	143.2	92%	0.917	79%	0.785	S	S	*	*			trans	-56.1	130.6	171.5	-75.8	176.8	171.7	177.2	0	111.3
205	K	30.2	Very low	36.5	Very low	203 Å²	203	145.9 Å²	145.9	88%	0.883	80%	0.796	S	S	*	*			trans	-162	115.2	141.8	-113.8	175.4	-176.6	-177.7	0	113
206	K	29.1	Very low	36	Very low	197 Å²	197	152 Å²	152	86%	0.857	81%	0.813	S	S	*	*			trans	30.3	116.3	147.6	-77.2	-178.3	169.7	-176.9	0	120.6
207	V	34.8	Very low	35.3	Very low	144 Å²	144	152.6 Å²	152.6	87%	0.873	82%	0.817	S	S	*	*				11.1	114.4	129.3	-175.4	0	0	0	0	116.1
208	G	28.6	Very low	35.1	Very low	75 Å²	75	152.9 Å²	152.9	77%	0.773	82%	0.816	S	S	*	*			trans	-153.2	113.3	157.2	0	0	0	0	0	107.6	N210	G208-N210 PolarHBondContact O-N 3.03Å
209	V	43	Very low	35.4	Very low	128 Å²	128	146.5 Å²	146.5	78%	0.776	79%	0.785	S	S	*	*			trans	-60.3	120.1	-175.7	173.8	0	0	0	0	110.8
210	N	31.6	Very low	36	Very low	157 Å²	157	146.2 Å²	146.2	84%	0.84	78%	0.778	S	S	*	*			trans	168	88.7	141.2	-88.3	-9.1	0	0	0	109.5	G208	G208-N210 PolarHBondContact O-N 3.03Å
211	G	31.5	Very low	36.5	Very low	79 Å²	79	141 Å²	141	81%	0.814	77%	0.765	S	S	*	*			trans	-97.8	100.8	171.9	0	0	0	0	0	110.7
212	N	31.4	Very low	37.2	Very low	169 Å²	169	137.5 Å²	137.5	90%	0.904	74%	0.743	S	S	*	*			trans	-96.4	90.5	153.9	-87.8	-2.2	0	0	0	107
213	A	34.8	Very low	37.4	Very low	89 Å²	89	134.2 Å²	134.2	74%	0.736	73%	0.725	S	S	*	*			trans	-70.9	125.8	162.9	0	0	0	0	0	107.7	D215	A213-D215 PolarHBondContact O-N 3.26Å
214	A	35.6	Very low	38.2	Very low	105 Å²	105	131.4 Å²	131.4	87%	0.868	71%	0.713	S	S	*	*			trans	-67.9	95.8	178.9	0	0	0	0	0	110.4	R216	A214-R216 PolarHBondContact O-N 2.85Å
215	D	31.4	Very low	38.8	Very low	132 Å²	132	128 Å²	128	71%	0.706	70%	0.704	S	S	*	*			trans	-68.6	111.5	167.9	-89.9	-21.6	0	0	0	109.9	A213	A213-D215 PolarHBondContact O-N 3.26Å
216	R	38.2	Very low	39.4	Very low	168 Å²	168	124.6 Å²	124.6	63%	0.634	70%	0.695	S	S	*	*	S	Bend	trans	-80.3	133.6	172.9	-153.6	-178.2	-100.3	-173.7	-7.8	109.2	A214	A214-R216 PolarHBondContact O-N 2.85Å
217	Y	37.2	Very low	40.1	Very low	184 Å²	184	123 Å²	123	72%	0.722	68%	0.683	S	S	*	*	S	Bend	trans	87.1	-14.5	173.3	-54.3	-73.4	0	0	0	119.6
218	F	40.7	Very low	40.4	Very low	169 Å²	169	120.4 Å²	120.4	74%	0.741	68%	0.677	S	S	*	*			trans	-144.5	37.5	179.1	-66.7	-77.7	0	0	0	114.9	V220	F218-V220 PolarHBondContact O-N 3.25Å
219	S	51.1	Low	41.1	Very low	37 Å²	37	120.3 Å²	120.3	26%	0.259	67%	0.669	S	S	.	*			trans	-62	134.2	175.4	105.4	0	0	0	0	110.8	A221 T222 R223	S219-A221 PolarHBondContact O-N 3.46Å; S219-A221 PolarHBondContact OG-N 2.95Å; S219-T222 PolarHBondContact O-N 3.47Å; S219-T222 PolarHBondContact OG-N 3.33Å; S219-T222 PolarHBondContact OG-OG1 3.36Å; S219-R223 PolarHBondContact O-N 3.28Å
220	V	46.8	Very low	40.8	Very low	98 Å²	98	120.1 Å²	120.1	59%	0.594	67%	0.671	S	S	*	*	H	α-helix	trans	-59.9	-27.6	177.2	176.7	0	0	0	0	110.9	F218 K224	F218-V220 PolarHBondContact O-N 3.25Å; V220-K224 HydrophobicContact CG1-CD 4.13Å; V220-K224 HydrophobicContact CG1-CG 4.48Å; V220-K224 WeakPolarHBondContact O-CB 3.49Å; V220-K224 WeakPolarHBondContact O-CG 3.23Å; V220-K224 PolarHBondContact O-N 3.39Å
221	A	46.9	Very low	40.9	Very low	63 Å²	63	118.7 Å²	118.7	52%	0.521	67%	0.67	S	S	.	*	H	α-helix	trans	-69.4	-48.2	175.6	0	0	0	0	0	112	S219 R223 K224 L225	S219-A221 PolarHBondContact O-N 3.46Å; S219-A221 PolarHBondContact OG-N 2.95Å; A221-R223 VanDerWaalsContact C-N 3.3Å; A221-R223 PolarHBondContact O-N 3.16Å; A221-K224 PolarHBondContact O-N 2.95Å; A221-L225 PolarHBondContact O-N 3.35Å
222	T	46.3	Very low	40.9	Very low	61 Å²	61	121.3 Å²	121.3	37%	0.374	67%	0.67	S	S	.	*	H	α-helix	trans	-64	-37.6	177.4	-41.1	0	0	0	0	111.1	S219 L225 L226	S219-T222 PolarHBondContact O-N 3.47Å; S219-T222 PolarHBondContact OG-N 3.33Å; S219-T222 PolarHBondContact OG-OG1 3.36Å; T222-L225 PolarHBondContact O-N 3.42Å; T222-L226 HydrophobicContact CG2-CD1 4.49Å; T222-L226 WeakPolarHBondContact O-CG 3.43Å; T222-L226 PolarHBondContact O-N 3.12Å
223	R	46.8	Very low	41.1	Very low	140 Å²	140	119 Å²	119	53%	0.528	66%	0.664	S	S	.	*	H	α-helix	trans	-70.9	-29.7	176.2	-153.2	179	-162.4	-175.8	5.8	113.2	S219 A221 R227	S219-R223 PolarHBondContact O-N 3.28Å; A221-R223 VanDerWaalsContact C-N 3.3Å; A221-R223 PolarHBondContact O-N 3.16Å; R223-R227 VanDerWaalsContact O-CB 3.3Å; R223-R227 WeakPolarHBondContact O-CB 3.27Å; R223-R227 WeakPolarHBondContact O-CG 3.18Å; R223-R227 PolarHBondContact O-N 3.31Å
224	K	47.3	Very low	40.9	Very low	150 Å²	150	121.5 Å²	121.5	65%	0.652	67%	0.67	S	S	*	*	H	α-helix	trans	-75.2	-37.9	174.1	-80.6	176	178.8	-177.9	0	111.8	V220 A221 R227 A228	V220-K224 HydrophobicContact CG1-CD 4.13Å; V220-K224 HydrophobicContact CG1-CG 4.48Å; V220-K224 WeakPolarHBondContact O-CB 3.49Å; V220-K224 WeakPolarHBondContact O-CG 3.23Å; V220-K224 PolarHBondContact O-N 3.39Å; A221-K224 PolarHBondContact O-N 2.95Å; K224-R227 CarbonylContact O-C 3.32Å; K224-R227 PolarHBondContact O-N 3.44Å; K224-A228 PolarHBondContact O-N 3.15Å
225	L	51.1	Low	40.7	Very low	141 Å²	141	123.7 Å²	123.7	74%	0.738	67%	0.665	S	S	*	*	H	α-helix	trans	-63.7	-42.6	173.3	-81	159.1	0	0	0	112	A221 T222 R227 A228	A221-L225 PolarHBondContact O-N 3.35Å; T222-L225 PolarHBondContact O-N 3.42Å; L225-R227 VanDerWaalsContact C-N 3.25Å; L225-R227 PolarHBondContact O-N 3.05Å; L225-A228 PolarHBondContact O-N 3.23Å
226	L	44.2	Very low	40.7	Very low	131 Å²	131	122.6 Å²	122.6	69%	0.686	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	-18.7	174.2	-69.8	169.8	0	0	0	113.9	T222	T222-L226 HydrophobicContact CG2-CD1 4.49Å; T222-L226 WeakPolarHBondContact O-CG 3.43Å; T222-L226 PolarHBondContact O-N 3.12Å
227	R	42.2	Very low	40.3	Very low	163 Å²	163	119.5 Å²	119.5	62%	0.615	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	7.8	178.1	-79.6	179.3	176	173.8	-2.8	113.6	R223 K224 L225 A229	R223-R227 VanDerWaalsContact O-CB 3.3Å; R223-R227 WeakPolarHBondContact O-CB 3.27Å; R223-R227 WeakPolarHBondContact O-CG 3.18Å; R223-R227 PolarHBondContact O-N 3.31Å; K224-R227 CarbonylContact O-C 3.32Å; K224-R227 PolarHBondContact O-N 3.44Å; L225-R227 VanDerWaalsContact C-N 3.25Å; L225-R227 PolarHBondContact O-N 3.05Å; R227-A229 PolarHBondContact O-N 3.46Å
228	A	42.6	Very low	39.8	Very low	90 Å²	90	116.9 Å²	116.9	74%	0.744	68%	0.679	S	S	*	*			trans	-75.4	38.4	-179.4	0	0	0	0	0	114.1	K224 L225	K224-A228 PolarHBondContact O-N 3.15Å; L225-A228 PolarHBondContact O-N 3.23Å
229	A	42.8	Very low	39.5	Very low	73 Å²	73	114 Å²	114	60%	0.603	68%	0.677	S	S	*	*	S	Bend	trans	-122.7	148	161.6	0	0	0	0	0	107.1	R227	R227-A229 PolarHBondContact O-N 3.46Å
230	P	36.3	Very low	38.6	Very low	124 Å²	124	121.3 Å²	121.3	81%	0.805	71%	0.708	S	S	*	*			trans	-59.4	139.8	-157.1	24.2	-33.4	0	0	0	112.7
231	P	34.6	Very low	37.7	Very low	127 Å²	127	122.6 Å²	122.6	83%	0.825	72%	0.721	S	S	*	*			trans	-82.9	141.6	-174.6	33.1	-32.4	0	0	0	111.8
232	V	31.1	Very low	36.8	Very low	134 Å²	134	122.3 Å²	122.3	81%	0.812	72%	0.724	S	S	*	*			trans	-125.6	142.5	164.7	174.5	0	0	0	0	107.7
233	P	34.8	Very low	35.9	Very low	120 Å²	120	126.8 Å²	126.8	78%	0.779	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-76.6	140.8	-155.1	28	-33.4	0	0	0	113.7
234	V	31.4	Very low	35.1	Very low	142 Å²	142	125.9 Å²	125.9	86%	0.861	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-82.7	128.6	172.3	178.2	0	0	0	0	108.6
235	I	30.6	Very low	34.3	Very low	151 Å²	151	125.5 Å²	125.5	77%	0.774	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-58.2	135.3	177.5	-60.4	166.8	0	0	0	110.2
236	P	31.3	Very low	33.4	Very low	108 Å²	108	126 Å²	126	70%	0.701	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-77.5	123.4	170.9	30.1	-29.1	0	0	0	109.8	T238	P236-T238 PolarHBondContact O-N 3.36Å
237	A	30.5	Very low	33	Very low	104 Å²	104	125 Å²	125	86%	0.86	77%	0.767	S	S	*	*			trans	-74.2	114.5	163.3	0	0	0	0	0	108
238	T	27.2	Very low	32.6	Very low	129 Å²	129	122.9 Å²	122.9	79%	0.791	77%	0.772	S	S	*	*			trans	-78.6	154.2	170.5	41.2	0	0	0	0	111.8	P236	P236-T238 PolarHBondContact O-N 3.36Å
239	P	34.6	Very low	32.2	Very low	108 Å²	108	124.5 Å²	124.5	70%	0.701	78%	0.778	S	S	*	*			trans	-100.2	156.7	-168.6	20.8	-0.5	0	0	0	113.9
240	E	30.5	Very low	32	Very low	191 Å²	191	129.9 Å²	129.9	89%	0.893	79%	0.788	S	S	*	*			trans	63	123.4	142.5	-66.1	-175.8	-164.9	0	0	123
241	S	28.1	Very low	31.8	Very low	125 Å²	125	131.8 Å²	131.8	87%	0.874	79%	0.791	S	S	*	*				-175.9	122.8	121.3	-178.4	0	0	0	0	106.4
242	G	28.5	Very low	31.7	Very low	57 Å²	57	131.4 Å²	131.4	59%	0.588	79%	0.788	S	S	*	*			cis	116	100.1	24.3	0	0	0	0	0	108.3
243	D	27	Very low	31.7	Very low	155 Å²	155	133.1 Å²	133.1	83%	0.829	79%	0.792	S	S	*	*			trans	169.6	107.9	137	-84.1	-13.8	0	0	0	110.2
244	V	31	Very low	31.4	Very low	120 Å²	120	131.1 Å²	131.1	73%	0.727	79%	0.793	S	S	*	*				75.4	113.7	70.5	171.2	0	0	0	0	109
245	L	30.6	Very low	31.3	Very low	143 Å²	143	132.4 Å²	132.4	75%	0.749	80%	0.795	S	S	*	*			cis	-153.1	150.6	19.1	-70.4	135.8	0	0	0	107.7
246	N	32	Very low	31.5	Very low	152 Å²	152	129.9 Å²	129.9	81%	0.813	80%	0.797	S	S	*	*				-174.4	147.8	78.5	-102.4	-32.5	0	0	0	111.1
247	S	35.3	Very low	31.4	Very low	108 Å²	108	134.1 Å²	134.1	76%	0.755	81%	0.808	S	S	*	*			trans	-48.5	128	173.2	-164.5	0	0	0	0	113.7
248	T	32.8	Very low	31.5	Very low	119 Å²	119	140.5 Å²	140.5	73%	0.73	81%	0.809	S	S	*	*				162.1	95.1	125	45.9	0	0	0	0	109.4	F250	T248-F250 VanDerWaalsContact C-N 3.32Å; T248-F250 PolarHBondContact O-N 3.47Å
249	S	36.1	Very low	31.5	Very low	125 Å²	125	141.5 Å²	141.5	87%	0.874	81%	0.81	S	S	*	*			trans	-82.9	80.8	163.2	49.8	0	0	0	0	108.9
250	F	37.6	Very low	31.3	Very low	185 Å²	185	142.9 Å²	142.9	81%	0.811	81%	0.811	S	S	*	*			trans	-131.8	124.4	161.5	-88.3	-83.2	0	0	0	108	T248	T248-F250 VanDerWaalsContact C-N 3.32Å; T248-F250 PolarHBondContact O-N 3.47Å
251	L	32.3	Very low	31.2	Very low	164 Å²	164	140 Å²	140	86%	0.859	81%	0.807	S	S	*	*			trans	-75.9	118	157	-82.7	155.6	0	0	0	106.2	L253	L251-L253 PolarHBondContact O-N 3.45Å
252	P	32.4	Very low	31.3	Very low	119 Å²	119	144.6 Å²	144.6	77%	0.773	81%	0.805	S	S	*	*			trans	-75.3	118.2	179.6	29.6	-29.5	0	0	0	108.8
253	L	30.4	Very low	31.4	Very low	171 Å²	171	149.5 Å²	149.5	90%	0.895	81%	0.813	S	S	*	*			trans	-94.3	106.6	160.7	-70.4	170.7	0	0	0	106	L251	L251-L253 PolarHBondContact O-N 3.45Å
254	G	28.6	Very low	31.4	Very low	78 Å²	78	149.7 Å²	149.7	80%	0.804	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-68.8	136.4	-178.8	0	0	0	0	0	112
255	D	29.7	Very low	31.3	Very low	169 Å²	169	151.2 Å²	151.2	90%	0.904	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-63.6	150.9	169.2	-78.5	-43.4	0	0	0	111.8
256	A	34.3	Very low	31.2	Very low	98 Å²	98	152.5 Å²	152.5	81%	0.81	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-64	135.9	-178.8	0	0	0	0	0	113.4
257	E	29.5	Very low	31.1	Very low	197 Å²	197	150.5 Å²	150.5	92%	0.921	82%	0.817	S	S	*	*			trans	-137.8	151	145.7	-78.4	-154.1	154.2	0	0	111.8
258	R	32.7	Very low	31.3	Very low	238 Å²	238	154.9 Å²	154.9	90%	0.898	82%	0.823	S	S	*	*			trans	-67.4	146.4	-166.9	-62	159.4	171.1	166.6	-3	112.4
259	D	27.9	Very low	31.5	Very low	150 Å²	150	153.4 Å²	153.4	80%	0.802	82%	0.823	S	S	*	*				-166.8	156.3	111	-120.1	-31.8	0	0	0	115.2
260	N	29.4	Very low	31.7	Very low	137 Å²	137	156.6 Å²	156.6	73%	0.733	82%	0.824	S	S	*	*			trans	-62.7	142.6	-171.2	-65.5	-75.1	0	0	0	115.9
261	T	29.7	Very low	32.1	Very low	131 Å²	131	151.1 Å²	151.1	80%	0.804	81%	0.805	S	S	*	*				-178.8	118	111.2	17.1	0	0	0	0	114.7
262	R	29.2	Very low	33	Very low	221 Å²	221	148.6 Å²	148.6	83%	0.834	80%	0.802	S	S	*	*			trans	32.8	116.7	139.6	-63.3	176.8	174.6	170.8	-2.5	120.8
263	H	30.3	Very low	33.9	Very low	160 Å²	160	145.5 Å²	145.5	74%	0.741	78%	0.781	S	S	*	*				-174.8	115.9	93	-106.8	-80.7	0	0	0	112.1
264	E	27.5	Very low	35.5	Very low	159 Å²	159	138.9 Å²	138.9	74%	0.743	75%	0.746	S	S	*	*			trans	31.4	113.3	137.5	-74.7	175.6	161.2	0	0	121.8
265	L	28.1	Very low	36.6	Very low	152 Å²	152	140.7 Å²	140.7	80%	0.796	74%	0.744	S	S	*	*				147.8	94.7	90.7	-101.2	156.7	0	0	0	110.2
266	D	29.4	Very low	37.9	Very low	170 Å²	170	139.9 Å²	139.9	91%	0.909	74%	0.739	S	S	*	*			trans	-156	108.1	146.9	-144	8.5	0	0	0	110.2
267	S	30.9	Very low	39	Very low	110 Å²	110	138.1 Å²	138.1	77%	0.769	73%	0.73	S	S	*	*			trans	-99.5	100	-178.9	52.4	0	0	0	0	110.9	A269	S267-A269 PolarHBondContact O-N 2.57Å
268	K	38.4	Very low	40.3	Very low	199 Å²	199	134.2 Å²	134.2	87%	0.865	72%	0.719	S	S	*	*			trans	-62.7	122.4	154.4	-82	177.3	175.6	171.8	0	109.4
269	A	36.3	Very low	41.9	Very low	89 Å²	89	128.4 Å²	128.4	74%	0.736	70%	0.698	S	S	*	*			trans	-95.6	98.4	155.6	0	0	0	0	0	108.9	S267 T271	S267-A269 PolarHBondContact O-N 2.57Å; A269-T271 PolarHBondContact O-N 3.49Å
270	Q	40.6	Very low	43.8	Very low	192 Å²	192	125.4 Å²	125.4	90%	0.897	68%	0.682	S	S	*	*			trans	-60.5	116	159.7	-82.2	174.8	-27.3	0	0	108.1
271	T	45.9	Very low	45.1	Very low	69 Å²	69	123.2 Å²	123.2	42%	0.423	68%	0.677	S	S	.	*			trans	-84.9	138.3	173.5	32.9	0	0	0	0	109.3	A269 V273 N274 Q288	A269-T271 PolarHBondContact O-N 3.49Å; T271-V273 PolarHBondContact O-N 3.06Å; T271-N274 PolarHBondContact O-N 3.32Å; T271-Q288 PolarHBondContact OG1-NE2 3.04Å
272	S	51.4	Low	46.5	Very low	112 Å²	112	120.7 Å²	120.7	78%	0.783	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.2	-2.9	-173.5	57.7	0	0	0	0	116
273	V	52.8	Low	48.4	Very low	54 Å²	54	112.9 Å²	112.9	33%	0.327	64%	0.642	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.2	-9.4	-170.3	-157.4	0	0	0	0	112.4	T271 M287 Q288	T271-V273 PolarHBondContact O-N 3.06Å; V273-M287 HydrophobicContact CG1-CB 4Å; V273-M287 HydrophobicContact CG1-CE 4.47Å; V273-Q288 HydrophobicContact CG2-CG 4Å
274	N	62.7	Low	50.4	Low	32 Å²	32	106 Å²	106	17%	0.171	61%	0.612	C	S	.	*			trans	-136.9	60	173.5	-167.1	9.4	0	0	0	112.5	T271 L276 G277 V278 Y279	T271-N274 PolarHBondContact O-N 3.32Å; N274-L276 PolarHBondContact O-N 2.85Å; N274-G277 PolarHBondContact O-N 3.29Å; N274-G277 WeakPolarHBondContact OD1-CA 3.33Å; N274-G277 PolarHBondContact OD1-N 3.17Å; N274-V278 PolarHBondContact OD1-N 3.36Å; N274-Y279 HydrophobicContact CB-CD2 4.14Å; N274-Y279 PolarHBondContact ND2-N 2.97Å; N274-Y279 PolarHBondContact ND2-O 3.44Å; N274-Y279 PolarHBondContact OD1-N 3.23Å
275	P	52.7	Low	52.4	Low	116 Å²	116	102.2 Å²	102.2	75%	0.753	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	-10.7	-174.3	27.7	-34.7	0	0	0	114.1
276	L	55.7	Low	54.1	Low	152 Å²	152	104 Å²	104	80%	0.796	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.6	-0.8	179.5	-63.4	172.9	0	0	0	113.5	N274 V278	N274-L276 PolarHBondContact O-N 2.85Å; L276-V278 VanDerWaalsContact C-N 3.3Å; L276-V278 HydrophobicContact CB-CG2 3.95Å; L276-V278 PolarHBondContact O-N 3.16Å
277	G	58.5	Low	55.5	Low	61 Å²	61	99.4 Å²	99.4	63%	0.629	57%	0.567	S	S	*	*	S	Bend	trans	67	23	177	0	0	0	0	0	115.5	N274	N274-G277 PolarHBondContact O-N 3.29Å; N274-G277 WeakPolarHBondContact OD1-CA 3.33Å; N274-G277 PolarHBondContact OD1-N 3.17Å
278	V	56.2	Low	57.2	Low	115 Å²	115	97.1 Å²	97.1	70%	0.697	54%	0.544	S	S	*	.			trans	-87.9	-28.1	-172.4	-178	0	0	0	0	112.4	N274 L276	N274-V278 PolarHBondContact OD1-N 3.36Å; L276-V278 VanDerWaalsContact C-N 3.3Å; L276-V278 HydrophobicContact CB-CG2 3.95Å; L276-V278 PolarHBondContact O-N 3.16Å
279	Y	65.9	Low	58	Low	116 Å²	116	91 Å²	91	46%	0.455	54%	0.537	S	S	.	.	S	Bend	trans	-83.9	142	177.5	-54.5	-63.1	0	0	0	112	N274 T283 M287	N274-Y279 HydrophobicContact CB-CD2 4.14Å; N274-Y279 PolarHBondContact ND2-N 2.97Å; N274-Y279 PolarHBondContact ND2-O 3.44Å; N274-Y279 PolarHBondContact OD1-N 3.23Å; Y279-T283 HydrophobicContact CD1-CG2 4.02Å; Y279-T283 HydrophobicContact CG-CG2 4.37Å; Y279-M287 HydrophobicContact CD1-CE 4.06Å; Y279-M287 HydrophobicContact CD2-CE 3.38Å; Y279-M287 HydrophobicContact CE1-CE 4.02Å; Y279-M287 HydrophobicContact CE2-CE 3.35Å; Y279-M287 HydrophobicContact CG-CE 3.75Å
280	D	67.3	Low	59.1	Low	87 Å²	87	93.9 Å²	93.9	47%	0.465	53%	0.533	S	S	.	.			trans	-69.9	165.7	170.4	72.9	-15.9	0	0	0	110.9	S282 T283 S284	D280-S282 VanDerWaalsContact CG-OG 3.24Å; D280-S282 PolarHBondContact O-N 3.37Å; D280-S282 PolarHBondContact OD2-OG 2.68Å; D280-T283 PolarHBondContact O-N 2.83Å; D280-T283 WeakPolarHBondContact OD1-CB 3.47Å; D280-T283 PolarHBondContact OD1-N 3.19Å; D280-T283 PolarHBondContact OD1-OG1 3.1Å; D280-S284 WeakPolarHBondContact O-CB 3.26Å; D280-S284 PolarHBondContact O-N 3.13Å; D280-S284 PolarHBondContact O-OG 2.97Å
281	S	56.8	Low	59.5	Low	90 Å²	90	87.4 Å²	87.4	63%	0.629	52%	0.517	S	S	*	.	H	α-helix	trans	-61.7	-33.6	-173.1	-162.2	0	0	0	0	112.2	L285	S281-L285 WeakPolarHBondContact O-CB 3.37Å; S281-L285 WeakPolarHBondContact O-CD1 3.3Å; S281-L285 WeakPolarHBondContact O-CG 3.47Å; S281-L285 PolarHBondContact O-N 3.37Å; S281-L285 VanDerWaalsContact O-N 3.11Å
282	S	59.8	Low	59.2	Low	78 Å²	78	95.4 Å²	95.4	55%	0.545	54%	0.54	S	S	.	.	H	α-helix	trans	-62	-52.4	175.5	-0.8	0	0	0	0	112	D280 S284 L285 W286	D280-S282 VanDerWaalsContact CG-OG 3.24Å; D280-S282 PolarHBondContact O-N 3.37Å; D280-S282 PolarHBondContact OD2-OG 2.68Å; S282-S284 VanDerWaalsContact C-N 3.32Å; S282-S284 PolarHBondContact O-N 3.42Å; S282-L285 PolarHBondContact O-N 2.91Å; S282-W286 PolarHBondContact O-N 2.64Å
283	T	68.4	Low	58.6	Low	57 Å²	57	97.7 Å²	97.7	35%	0.35	54%	0.542	S	S	.	.	H	α-helix	trans	-68.9	-34	-179.5	-54.8	0	0	0	0	111.3	Y279 D280 W286 M287	Y279-T283 HydrophobicContact CD1-CG2 4.02Å; Y279-T283 HydrophobicContact CG-CG2 4.37Å; D280-T283 PolarHBondContact O-N 2.83Å; D280-T283 WeakPolarHBondContact OD1-CB 3.47Å; D280-T283 PolarHBondContact OD1-N 3.19Å; D280-T283 PolarHBondContact OD1-OG1 3.1Å; T283-W286 PolarHBondContact O-N 3.4Å; T283-M287 HydrophobicContact CG2-CE 4.42Å; T283-M287 WeakPolarHBondContact O-CG 3.32Å; T283-M287 PolarHBondContact O-N 3.02Å
284	S	72.3	Confident	58.2	Low	17 Å²	17	103.4 Å²	103.4	12%	0.119	57%	0.57	C	S	.	*	H	α-helix	trans	-64.3	-38.8	175.8	-54.9	0	0	0	0	112.5	D280 S282 Q288	D280-S284 WeakPolarHBondContact O-CB 3.26Å; D280-S284 PolarHBondContact O-N 3.13Å; D280-S284 PolarHBondContact O-OG 2.97Å; S282-S284 VanDerWaalsContact C-N 3.32Å; S282-S284 PolarHBondContact O-N 3.42Å; S284-Q288 WeakPolarHBondContact O-CG 3.43Å; S284-Q288 PolarHBondContact O-N 3.15Å
285	L	69.8	Low	56.8	Low	79 Å²	79	110.2 Å²	110.2	41%	0.414	60%	0.601	S	S	.	*	H	α-helix	trans	-74.3	-35.2	176.7	-78.6	164.6	0	0	0	112.8	S281 S282 Q288 K290	S281-L285 WeakPolarHBondContact O-CB 3.37Å; S281-L285 WeakPolarHBondContact O-CD1 3.3Å; S281-L285 WeakPolarHBondContact O-CG 3.47Å; S281-L285 PolarHBondContact O-N 3.37Å; S281-L285 VanDerWaalsContact O-N 3.11Å; S282-L285 PolarHBondContact O-N 2.91Å; L285-Q288 PolarHBondContact O-N 3.18Å; L285-K290 CarbonylContact O-C 3.6Å; L285-K290 PolarHBondContact O-N 3.06Å
286	W	63.7	Low	56	Low	189 Å²	189	112.1 Å²	112.1	72%	0.716	61%	0.605	S	S	*	*	H	α-helix	trans	-65.5	-45.2	173.9	-175	85.8	0	0	0	111.8	S282 T283 Q288 G289	S282-W286 PolarHBondContact O-N 2.64Å; T283-W286 PolarHBondContact O-N 3.4Å; W286-Q288 PolarHBondContact O-N 3.33Å; W286-G289 PolarHBondContact O-N 2.86Å
287	M	60	Low	55	Low	73 Å²	73	112.4 Å²	112.4	36%	0.36	61%	0.607	S	S	.	*	H	α-helix	trans	-67.6	-18	176.5	-72.1	-151.5	-75.7	0	0	113.9	V273 Y279 T283 G289	V273-M287 HydrophobicContact CG1-CB 4Å; V273-M287 HydrophobicContact CG1-CE 4.47Å; Y279-M287 HydrophobicContact CD1-CE 4.06Å; Y279-M287 HydrophobicContact CD2-CE 3.38Å; Y279-M287 HydrophobicContact CE1-CE 4.02Å; Y279-M287 HydrophobicContact CE2-CE 3.35Å; Y279-M287 HydrophobicContact CG-CE 3.75Å; T283-M287 HydrophobicContact CG2-CE 4.42Å; T283-M287 WeakPolarHBondContact O-CG 3.32Å; T283-M287 PolarHBondContact O-N 3.02Å; M287-G289 VanDerWaalsContact C-N 3.28Å
288	Q	65.6	Low	53.9	Low	62 Å²	62	114.3 Å²	114.3	29%	0.29	62%	0.617	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86	5.9	170.1	-77	172.9	25.6	0	0	113.7	T271 V273 S284 L285 W286 K290	T271-Q288 PolarHBondContact OG1-NE2 3.04Å; V273-Q288 HydrophobicContact CG2-CG 4Å; S284-Q288 WeakPolarHBondContact O-CG 3.43Å; S284-Q288 PolarHBondContact O-N 3.15Å; L285-Q288 PolarHBondContact O-N 3.18Å; W286-Q288 PolarHBondContact O-N 3.33Å; Q288-K290 PolarHBondContact O-N 3.2Å
289	G	54.5	Low	52.9	Low	70 Å²	70	116.8 Å²	116.8	72%	0.722	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	72	15	179.8	0	0	0	0	0	114.1	W286 M287	W286-G289 PolarHBondContact O-N 2.86Å; M287-G289 VanDerWaalsContact C-N 3.28Å
290	K	60.2	Low	51.6	Low	151 Å²	151	117.3 Å²	117.3	66%	0.657	64%	0.636	S	S	*	*			trans	-108	48.9	178.7	-65.5	-176.1	-179.9	177.9	0	111.3	L285 Q288 R292	L285-K290 CarbonylContact O-C 3.6Å; L285-K290 PolarHBondContact O-N 3.06Å; Q288-K290 PolarHBondContact O-N 3.2Å; K290-R292 PolarHBondContact O-N 3.14Å
291	G	48.3	Very low	50.2	Low	55 Å²	55	117 Å²	117	57%	0.567	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-68.3	119.8	171.5	0	0	0	0	0	110.3
292	R	40.5	Very low	49.5	Very low	238 Å²	238	115.7 Å²	115.7	90%	0.898	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-91.1	128.7	174.4	-151.7	175.8	-150.4	-109.6	3.7	109.9	K290	K290-R292 PolarHBondContact O-N 3.14Å
293	L	37.8	Very low	48.5	Very low	159 Å²	159	119.9 Å²	119.9	83%	0.832	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-59.9	145.5	173.1	-80.5	142.7	0	0	0	111.7
294	L	44.4	Very low	47.1	Very low	175 Å²	175	122.2 Å²	122.2	92%	0.916	66%	0.657	S	S	*	*			trans	-34.2	126.4	173.8	-64.6	159.1	0	0	0	114.4
295	Q	34.8	Very low	45.6	Very low	175 Å²	175	126.7 Å²	126.7	82%	0.818	68%	0.676	S	S	*	*			trans	-154.9	114.6	148.8	-150.9	163.8	26.8	0	0	110.4
296	D	35.3	Very low	44.6	Very low	156 Å²	156	129.8 Å²	129.8	83%	0.834	69%	0.688	S	S	*	*			trans	17.7	119.1	168.5	-62.9	-26.3	0	0	0	120.8	A298	D296-A298 PolarHBondContact O-N 2.94Å; D296-A298 VanDerWaalsContact O-N 3.13Å
297	D	35.5	Very low	43.8	Very low	158 Å²	158	128.5 Å²	128.5	85%	0.845	69%	0.688	S	S	*	*			trans	-65.6	99.1	171.1	-82.6	-36.1	0	0	0	112.1
298	A	35.5	Very low	43.4	Very low	100 Å²	100	128.7 Å²	128.7	83%	0.826	70%	0.696	S	S	*	*			trans	-86.4	104.7	146.9	0	0	0	0	0	108.2	D296	D296-A298 PolarHBondContact O-N 2.94Å; D296-A298 VanDerWaalsContact O-N 3.13Å
299	K	33.6	Very low	42.9	Very low	168 Å²	168	132.4 Å²	132.4	73%	0.73	71%	0.714	S	S	*	*			trans	-74.4	157.7	168.5	-86.9	-177.8	-177.2	175	0	110.9
300	P	40.1	Very low	43.3	Very low	126 Å²	126	136.3 Å²	136.3	82%	0.818	71%	0.707	S	S	*	*			trans	-75.8	128.2	-162.7	30.5	-33.2	0	0	0	112.6
301	V	38.1	Very low	43.5	Very low	80 Å²	80	131.3 Å²	131.3	49%	0.485	69%	0.689	S	S	.	*			trans	-101.4	-7.2	176	-178.8	0	0	0	0	112.1	E303 T304 E305	V301-E303 PolarHBondContact O-N 2.99Å; V301-T304 PolarHBondContact O-N 3.37Å; V301-T304 VanDerWaalsContact O-N 3.13Å; V301-E305 HydrophobicContact CG1-CG 3.83Å; V301-E305 VanDerWaalsContact CG1-OE1 3.3Å; V301-E305 WeakPolarHBondContact CG1-OE1 3.48Å; V301-E305 PolarHBondContact O-N 2.76Å
302	A	41.1	Very low	44.3	Very low	63 Å²	63	131.2 Å²	131.2	52%	0.521	68%	0.684	S	S	.	*	H	α-helix	trans	-62.6	-33.3	-166.5	0	0	0	0	0	116
303	E	38.9	Very low	45.8	Very low	167 Å²	167	121.6 Å²	121.6	78%	0.78	66%	0.659	S	S	*	*	H	α-helix	trans	-79.5	-17.4	179.8	-69.4	-175.2	-178.7	0	0	113.7	V301	V301-E303 PolarHBondContact O-N 2.99Å
304	T	39.2	Very low	47.5	Very low	106 Å²	106	119.4 Å²	119.4	65%	0.65	64%	0.639	S	S	*	*	H	α-helix	trans	-89.2	-31.8	178.4	-47.5	0	0	0	0	110.9	V301 S308	V301-T304 PolarHBondContact O-N 3.37Å; V301-T304 VanDerWaalsContact O-N 3.13Å; T304-S308 WeakPolarHBondContact O-CB 3.36Å; T304-S308 PolarHBondContact O-N 2.98Å
305	E	41.7	Very low	49.1	Very low	110 Å²	110	112.3 Å²	112.3	51%	0.514	60%	0.603	S	S	.	*	H	α-helix	trans	-66.8	-45.2	176.2	-82.2	170.3	178.7	0	0	112.5	V301 K307 S308 E309	V301-E305 HydrophobicContact CG1-CG 3.83Å; V301-E305 VanDerWaalsContact CG1-OE1 3.3Å; V301-E305 WeakPolarHBondContact CG1-OE1 3.48Å; V301-E305 PolarHBondContact O-N 2.76Å; E305-K307 PolarHBondContact O-N 2.85Å; E305-S308 PolarHBondContact O-N 3.34Å; E305-S308 VanDerWaalsContact O-N 3.17Å; E305-E309 WeakPolarHBondContact O-CB 3.47Å; E305-E309 WeakPolarHBondContact O-CG 3.12Å; E305-E309 PolarHBondContact O-N 2.89Å
306	E	47.9	Very low	51.2	Low	144 Å²	144	110.2 Å²	110.2	67%	0.673	59%	0.594	S	S	*	*	H	α-helix	trans	-61.9	-38.5	-179.6	-77.9	-175.1	162.2	0	0	113.5	Y310	E306-Y310 WeakPolarHBondContact O-CB 3.22Å; E306-Y310 PolarHBondContact O-N 2.69Å; E306-Y310 VanDerWaalsContact O-N 3.09Å
307	K	47.5	Very low	53.5	Low	163 Å²	163	104.9 Å²	104.9	71%	0.709	56%	0.563	S	S	*	*	H	α-helix	trans	-72.3	-35.3	176.4	-76.5	177.4	-179.5	166.8	0	112.3	E305 V311	E305-K307 PolarHBondContact O-N 2.85Å; K307-V311 WeakPolarHBondContact O-CB 3.44Å; K307-V311 WeakPolarHBondContact O-CG2 3.47Å; K307-V311 PolarHBondContact O-N 3.05Å
308	S	51	Low	55.8	Low	76 Å²	76	98 Å²	98	53%	0.531	53%	0.526	S	S	.	.	H	α-helix	trans	-69.5	-40.4	175.9	-176	0	0	0	0	111.7	T304 E305 V311 A312	T304-S308 WeakPolarHBondContact O-CB 3.36Å; T304-S308 PolarHBondContact O-N 2.98Å; E305-S308 PolarHBondContact O-N 3.34Å; E305-S308 VanDerWaalsContact O-N 3.17Å; S308-V311 PolarHBondContact O-N 3.46Å; S308-A312 WeakPolarHBondContact O-CB 3.44Å; S308-A312 PolarHBondContact O-N 2.96Å
309	E	55.8	Low	58.1	Low	141 Å²	141	95.2 Å²	95.2	66%	0.659	50%	0.497	S	S	*	.	H	α-helix	trans	-67.1	-41.4	176.2	-77	-173.6	161.1	0	0	112.4	E305 V311 A312 G313	E305-E309 WeakPolarHBondContact O-CB 3.47Å; E305-E309 WeakPolarHBondContact O-CG 3.12Å; E305-E309 PolarHBondContact O-N 2.89Å; E309-V311 VanDerWaalsContact C-N 3.34Å; E309-V311 PolarHBondContact O-N 2.51Å; E309-A312 PolarHBondContact O-N 3.49Å; E309-G313 PolarHBondContact O-N 2.81Å
310	Y	62.1	Low	60.6	Low	151 Å²	151	92.7 Å²	92.7	59%	0.592	48%	0.483	S	S	*	.	H	α-helix	trans	-60.8	-42.4	174.6	-179.2	-95.7	0	0	0	112.4	E306 R314	E306-Y310 WeakPolarHBondContact O-CB 3.22Å; E306-Y310 PolarHBondContact O-N 2.69Å; E306-Y310 VanDerWaalsContact O-N 3.09Å; Y310-R314 PolarHBondContact O-N 2.95Å; Y310-R314 VanDerWaalsContact O-N 3.12Å
311	V	64.1	Low	62.7	Low	46 Å²	46	92.2 Å²	92.2	28%	0.279	47%	0.465	S	S	.	.	H	α-helix	trans	-66.6	-42.3	177.4	150.1	0	0	0	0	112.2	K307 S308 E309 T315 Y338 L342	K307-V311 WeakPolarHBondContact O-CB 3.44Å; K307-V311 WeakPolarHBondContact O-CG2 3.47Å; K307-V311 PolarHBondContact O-N 3.05Å; S308-V311 PolarHBondContact O-N 3.46Å; E309-V311 VanDerWaalsContact C-N 3.34Å; E309-V311 PolarHBondContact O-N 2.51Å; V311-T315 PolarHBondContact O-N 2.91Å; V311-T315 VanDerWaalsContact O-N 3.17Å; V311-T315 PolarHBondContact O-OG1 3.43Å; V311-Y338 PolarHBondContact O-OH 3.44Å; V311-Y338 VanDerWaalsContact O-OH 3.13Å; V311-L342 HydrophobicContact CB-CD2 4.04Å; V311-L342 HydrophobicContact CG1-CD2 3.28Å; V311-L342 HydrophobicContact CG2-CD2 3.89Å
312	A	66.2	Low	65	Low	54 Å²	54	88.7 Å²	88.7	45%	0.446	44%	0.443	S	S	.	.	H	α-helix	trans	-66.2	-44	176	0	0	0	0	0	111.4	S308 E309 R314 T315 E316	S308-A312 WeakPolarHBondContact O-CB 3.44Å; S308-A312 PolarHBondContact O-N 2.96Å; E309-A312 PolarHBondContact O-N 3.49Å; A312-R314 PolarHBondContact O-N 3.36Å; A312-T315 WeakPolarHBondContact O-CB 3.28Å; A312-T315 PolarHBondContact O-N 3.15Å; A312-T315 VanDerWaalsContact O-N 3.12Å; A312-E316 PolarHBondContact O-N 3.5Å
313	G	72.1	Confident	67	Low	36 Å²	36	93.7 Å²	93.7	37%	0.371	45%	0.449	S	S	.	.	H	α-helix	trans	-61.4	-40.8	177.7	0	0	0	0	0	113.4	E309 E316 E317	E309-G313 PolarHBondContact O-N 2.81Å; G313-E316 PolarHBondContact O-N 2.82Å; G313-E317 WeakPolarHBondContact O-CB 3.49Å; G313-E317 PolarHBondContact O-N 3.46Å
314	R	73.1	Confident	69.2	Low	112 Å²	112	92 Å²	92	42%	0.423	44%	0.441	S	S	.	.	H	α-helix	trans	-67.4	-35.3	172.7	-81.8	-167.7	82.9	127.4	1	113.1	Y310 A312 E316 E317 F318 Y338	Y310-R314 PolarHBondContact O-N 2.95Å; Y310-R314 VanDerWaalsContact O-N 3.12Å; A312-R314 PolarHBondContact O-N 3.36Å; R314-E316 VanDerWaalsContact C-N 3.33Å; R314-E317 WeakPolarHBondContact O-CB 3.49Å; R314-E317 PolarHBondContact O-N 3.13Å; R314-F318 WeakPolarHBondContact O-CD2 3.44Å; R314-F318 PolarHBondContact O-N 2.66Å; R314-Y338 HydrophobicContact CB-CE1 4.29Å; R314-Y338 HydrophobicContact CB-CE2 4.4Å; R314-Y338 WeakPolarHBondContact CB-OH 3.33Å
315	T	78.2	Confident	71.2	Confident	27 Å²	27	92.3 Å²	92.3	17%	0.166	44%	0.435	C	S	.	.	H	α-helix	trans	-66.2	-38.7	174.8	-54.7	0	0	0	0	111	V311 A312 N319 F335	V311-T315 PolarHBondContact O-N 2.91Å; V311-T315 VanDerWaalsContact O-N 3.17Å; V311-T315 PolarHBondContact O-OG1 3.43Å; A312-T315 WeakPolarHBondContact O-CB 3.28Å; A312-T315 PolarHBondContact O-N 3.15Å; A312-T315 VanDerWaalsContact O-N 3.12Å; T315-N319 PolarHBondContact O-N 2.87Å; T315-N319 VanDerWaalsContact O-N 3.09Å; T315-N319 PolarHBondContact O-ND2 3.05Å; T315-F335 HydrophobicContact CG2-CE2 4.14Å; T315-F335 HydrophobicContact CG2-CZ 4.36Å
316	E	79.1	Confident	73.1	Confident	131 Å²	131	89.6 Å²	89.6	61%	0.612	43%	0.427	S	S	*	.	H	α-helix	trans	-66	-41.1	173.9	-171.7	176.9	-175.1	0	0	111.7	A312 G313 R314 N319 R320	A312-E316 PolarHBondContact O-N 3.5Å; G313-E316 PolarHBondContact O-N 2.82Å; R314-E316 VanDerWaalsContact C-N 3.33Å; E316-N319 CarbonylContact O-C 3.59Å; E316-N319 PolarHBondContact O-N 2.87Å; E316-R320 WeakPolarHBondContact O-CB 3.43Å; E316-R320 PolarHBondContact O-N 3.37Å
317	E	83.2	Confident	74.7	Confident	43 Å²	43	86.4 Å²	86.4	20%	0.201	43%	0.425	C	S	.	.	H	α-helix	trans	-58.5	-48.9	174.8	-176.5	63.9	-140.6	0	0	112	G313 R314 N319 R320 R321	G313-E317 WeakPolarHBondContact O-CB 3.49Å; G313-E317 PolarHBondContact O-N 3.46Å; R314-E317 WeakPolarHBondContact O-CB 3.49Å; R314-E317 PolarHBondContact O-N 3.13Å; E317-N319 VanDerWaalsContact C-N 3.34Å; E317-N319 PolarHBondContact O-N 2.88Å; E317-R320 PolarHBondContact O-N 3Å; E317-R320 IonicContact OE1-CZ 2.77Å; E317-R320 IonicContact OE1-NE 3.56Å; E317-R320 IonicContact OE1-NH2 3.86Å; E317-R320 PolarHBondContact OE1-NH2 2.85Å; E317-R320 IonicContact OE2-CZ 2.69Å; E317-R320 IonicContact OE2-NE 3.45Å; E317-R320 IonicContact OE2-NH1 2.77Å; E317-R320 IonicContact OE2-NH2 3.31Å; E317-R320 PolarHBondContact OE2-NH2 3.38Å; E317-R321 WeakPolarHBondContact O-CG 3.49Å; E317-R321 PolarHBondContact O-N 3.19Å; E317-R321 IonicContact OE1-CZ 3.46Å; E317-R321 IonicContact OE1-NE 3.15Å; E317-R321 PolarHBondContact OE1-NE 2.82Å; E317-R321 IonicContact OE1-NH1 3.69Å; E317-R321 IonicContact OE1-NH2 3.7Å; E317-R321 PolarHBondContact OE1-NH2 2.94Å
318	F	83.4	Confident	76.5	Confident	15 Å²	15	81.3 Å²	81.3	7%	0.066	41%	0.406	C	S	.	.	H	α-helix	trans	-60.5	-44.6	175.7	-82	-67.1	0	0	0	111.4	R314 R320 R321 L322 L331 E334 F335 Y338	R314-F318 WeakPolarHBondContact O-CD2 3.44Å; R314-F318 PolarHBondContact O-N 2.66Å; F318-R320 VanDerWaalsContact C-N 3.31Å; F318-R320 PolarHBondContact O-N 2.94Å; F318-R321 PolarHBondContact O-N 2.9Å; F318-L322 VanDerWaalsContact O-CB 3.25Å; F318-L322 WeakPolarHBondContact O-CB 3.33Å; F318-L322 WeakPolarHBondContact O-CG 3.4Å; F318-L322 PolarHBondContact O-N 3.39Å; F318-L331 HydrophobicContact CD1-CD1 3.8Å; F318-L331 HydrophobicContact CE1-CD1 3.95Å; F318-E334 HydrophobicContact CE1-CB 4.2Å; F318-F335 HydrophobicContact CB-CB 4.45Å; F318-F335 HydrophobicContact CB-CD2 3.37Å; F318-F335 HydrophobicContact CB-CE2 3.74Å; F318-F335 HydrophobicContact CB-CG 4.02Å; F318-F335 HydrophobicContact CD1-CB 4.13Å; F318-F335 HydrophobicContact CD1-CD2 4.28Å; F318-F335 AromaticContact CD2-CD2 3.9Å; F318-F335 HydrophobicContact CD2-CD2 3.9Å; F318-F335 HydrophobicContact CD2-CE2 4.48Å; F318-F335 HydrophobicContact CG-CB 4.33Å; F318-F335 AromaticContact CG-CD2 3.62Å; F318-F335 HydrophobicContact CG-CD2 3.62Å; F318-F335 HydrophobicContact CG-CE2 4.34Å; F318-F335 HydrophobicContact CG-CG 4.3Å; F318-Y338 AromaticContact CD2-CD1 3.8Å; F318-Y338 HydrophobicContact CD2-CD1 3.8Å; F318-Y338 HydrophobicContact CD2-CE1 4.15Å; F318-Y338 HydrophobicContact CD2-CG 4.17Å; F318-Y338 AromaticContact CE2-CD1 3.77Å; F318-Y338 HydrophobicContact CE2-CD1 3.77Å; F318-Y338 HydrophobicContact CE2-CD2 4.04Å; F318-Y338 HydrophobicContact CE2-CE1 4.24Å; F318-Y338 HydrophobicContact CE2-CE2 4.49Å; F318-Y338 AromaticContact CE2-CG 3.66Å; F318-Y338 HydrophobicContact CE2-CG 3.66Å; F318-Y338 HydrophobicContact CZ-CG 4.5Å
319	N	83.5	Confident	78	Confident	41 Å²	41	80 Å²	80	22%	0.219	39%	0.394	C	S	.	.	H	α-helix	trans	-64.1	-34.5	176.1	-78	-58.1	0	0	0	112.6	T315 E316 E317 R323	T315-N319 PolarHBondContact O-N 2.87Å; T315-N319 VanDerWaalsContact O-N 3.09Å; T315-N319 PolarHBondContact O-ND2 3.05Å; E316-N319 CarbonylContact O-C 3.59Å; E316-N319 PolarHBondContact O-N 2.87Å; E317-N319 VanDerWaalsContact C-N 3.34Å; E317-N319 PolarHBondContact O-N 2.88Å; N319-R323 VanDerWaalsContact O-CG 3.27Å; N319-R323 WeakPolarHBondContact O-CG 3.43Å; N319-R323 PolarHBondContact O-N 2.84Å; N319-R323 VanDerWaalsContact O-N 3.1Å; N319-R323 PolarHBondContact O-NE 3.12Å
320	R	85.6	Confident	79.4	Confident	115 Å²	115	77.8 Å²	77.8	43%	0.434	38%	0.384	S	S	.	.	H	α-helix	trans	-66.7	-52.5	174.7	-176	-179.8	71.4	-160.9	4.5	110.8	E316 E317 F318 L322 R323 E324	E316-R320 WeakPolarHBondContact O-CB 3.43Å; E316-R320 PolarHBondContact O-N 3.37Å; E317-R320 PolarHBondContact O-N 3Å; E317-R320 IonicContact OE1-CZ 2.77Å; E317-R320 IonicContact OE1-NE 3.56Å; E317-R320 IonicContact OE1-NH2 3.86Å; E317-R320 PolarHBondContact OE1-NH2 2.85Å; E317-R320 IonicContact OE2-CZ 2.69Å; E317-R320 IonicContact OE2-NE 3.45Å; E317-R320 IonicContact OE2-NH1 2.77Å; E317-R320 IonicContact OE2-NH2 3.31Å; E317-R320 PolarHBondContact OE2-NH2 3.38Å; F318-R320 VanDerWaalsContact C-N 3.31Å; F318-R320 PolarHBondContact O-N 2.94Å; R320-L322 VanDerWaalsContact C-N 3.31Å; R320-L322 PolarHBondContact O-N 3.5Å; R320-R323 WeakPolarHBondContact O-CB 3.1Å; R320-R323 PolarHBondContact O-N 2.85Å; R320-R323 VanDerWaalsContact O-N 3.08Å; R320-E324 VanDerWaalsContact CG-OE1 3.28Å; R320-E324 WeakPolarHBondContact CG-OE1 3.42Å; R320-E324 WeakPolarHBondContact O-CG 3.49Å; R320-E324 PolarHBondContact O-N 3.17Å
321	R	85	Confident	80.4	Confident	116 Å²	116	71.2 Å²	71.2	44%	0.438	36%	0.359	S	S	.	.	H	α-helix	trans	-61.5	-37.9	178.8	-69.3	-172.7	177.1	128.6	7.8	112.5	E317 F318 R323 E324 Q325 L331	E317-R321 WeakPolarHBondContact O-CG 3.49Å; E317-R321 PolarHBondContact O-N 3.19Å; E317-R321 IonicContact OE1-CZ 3.46Å; E317-R321 IonicContact OE1-NE 3.15Å; E317-R321 PolarHBondContact OE1-NE 2.82Å; E317-R321 IonicContact OE1-NH1 3.69Å; E317-R321 IonicContact OE1-NH2 3.7Å; E317-R321 PolarHBondContact OE1-NH2 2.94Å; F318-R321 PolarHBondContact O-N 2.9Å; R321-R323 VanDerWaalsContact C-N 3.33Å; R321-R323 PolarHBondContact O-N 3.18Å; R321-E324 PolarHBondContact O-N 2.64Å; R321-Q325 PolarHBondContact O-N 3.4Å; R321-L331 HydrophobicContact CB-CD1 4.4Å; R321-L331 HydrophobicContact CB-CD2 3.52Å
322	L	85.9	Confident	81.5	Confident	5 Å²	5	69.3 Å²	69.3	3%	0.026	35%	0.347	C	S	.	.	H	α-helix	trans	-70.6	-26.2	175.9	-72	171.3	0	0	0	113.2	F318 R320 P326 L331 W332 F335	F318-L322 VanDerWaalsContact O-CB 3.25Å; F318-L322 WeakPolarHBondContact O-CB 3.33Å; F318-L322 WeakPolarHBondContact O-CG 3.4Å; F318-L322 PolarHBondContact O-N 3.39Å; R320-L322 VanDerWaalsContact C-N 3.31Å; R320-L322 PolarHBondContact O-N 3.5Å; L322-P326 VanDerWaalsContact O-CA 3.31Å; L322-P326 WeakPolarHBondContact O-CA 3.42Å; L322-P326 WeakPolarHBondContact O-CG 3.31Å; L322-L331 HydrophobicContact CD2-CB 4.04Å; L322-L331 HydrophobicContact CD2-CD2 3.6Å; L322-L331 HydrophobicContact CD2-CG 3.62Å; L322-L331 HydrophobicContact CG-CD2 3.85Å; L322-L331 HydrophobicContact CG-CG 3.99Å; L322-W332 HydrophobicContact CB-CH2 4.37Å; L322-W332 HydrophobicContact CB-CZ2 4.31Å; L322-W332 HydrophobicContact CD1-CD2 4.15Å; L322-W332 HydrophobicContact CD1-CE3 3.73Å; L322-W332 HydrophobicContact CD1-CH2 4.22Å; L322-W332 HydrophobicContact CD1-CZ3 3.79Å; L322-W332 HydrophobicContact CD2-CB 4.44Å; L322-W332 HydrophobicContact CD2-CD2 3.48Å; L322-W332 VanDerWaalsContact CD2-CD2 3.48Å; L322-W332 HydrophobicContact CD2-CE3 3.97Å; L322-W332 HydrophobicContact CD2-CG 3.69Å; L322-W332 HydrophobicContact CD2-CH2 4.48Å; L322-W332 HydrophobicContact CD2-CZ2 4.06Å; L322-W332 HydrophobicContact CD2-CZ3 4.46Å; L322-W332 HydrophobicContact CG-CD2 4.39Å; L322-W332 HydrophobicContact CG-CE3 4.44Å; L322-F335 HydrophobicContact CD1-CB 4.02Å; L322-F335 HydrophobicContact CD1-CD1 3.59Å; L322-F335 HydrophobicContact CD1-CE1 4.27Å; L322-F335 HydrophobicContact CD1-CG 3.93Å
323	R	82.7	Confident	82.3	Confident	169 Å²	169	67.4 Å²	67.4	64%	0.638	33%	0.329	S	S	*	.	H	α-helix	trans	-73.1	-38	169.5	-77.2	-177.3	-62.8	-121.5	2.8	111.7	N319 R320 R321	N319-R323 VanDerWaalsContact O-CG 3.27Å; N319-R323 WeakPolarHBondContact O-CG 3.43Å; N319-R323 PolarHBondContact O-N 2.84Å; N319-R323 VanDerWaalsContact O-N 3.1Å; N319-R323 PolarHBondContact O-NE 3.12Å; R320-R323 WeakPolarHBondContact O-CB 3.1Å; R320-R323 PolarHBondContact O-N 2.85Å; R320-R323 VanDerWaalsContact O-N 3.08Å; R321-R323 VanDerWaalsContact C-N 3.33Å; R321-R323 PolarHBondContact O-N 3.18Å
324	E	85.4	Confident	82.8	Confident	130 Å²	130	69.8 Å²	69.8	61%	0.607	33%	0.331	S	S	*	.	H	α-helix	trans	-75.9	-35.2	180	-70	168.8	-174.6	0	0	112.3	R320 R321	R320-E324 VanDerWaalsContact CG-OE1 3.28Å; R320-E324 WeakPolarHBondContact CG-OE1 3.42Å; R320-E324 WeakPolarHBondContact O-CG 3.49Å; R320-E324 PolarHBondContact O-N 3.17Å; R321-E324 PolarHBondContact O-N 2.64Å
325	Q	82.3	Confident	83.4	Confident	114 Å²	114	64.8 Å²	64.8	53%	0.533	31%	0.312	S	S	.	.			trans	-131.8	69.7	-178.8	-62.9	-179.5	-16.1	0	0	111.7	R321 A327 D328	R321-Q325 PolarHBondContact O-N 3.4Å; Q325-A327 PolarHBondContact O-N 3.45Å; Q325-A327 VanDerWaalsContact O-N 3.17Å; Q325-D328 HydrophobicContact CB-CB 4.25Å; Q325-D328 PolarHBondContact O-N 3.21Å; Q325-D328 VanDerWaalsContact O-N 3.16Å
326	P	81.8	Confident	83.6	Confident	53 Å²	53	63.7 Å²	63.7	34%	0.344	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-21.2	-178.1	-18.3	31	0	0	0	114	L322 W332 T383 N384	L322-P326 VanDerWaalsContact O-CA 3.31Å; L322-P326 WeakPolarHBondContact O-CA 3.42Å; L322-P326 WeakPolarHBondContact O-CG 3.31Å; P326-W332 PolarHBondContact O-NE1 2.84Å; P326-T383 HydrophobicContact CB-CG2 3.66Å; P326-T383 WeakPolarHBondContact O-CG2 3.26Å; P326-N384 PolarHBondContact O-ND2 3.45Å
327	A	81.1	Confident	83.7	Confident	76 Å²	76	64 Å²	64	63%	0.628	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-9.3	179	0	0	0	0	0	113.9	Q325 T329 N384	Q325-A327 PolarHBondContact O-N 3.45Å; Q325-A327 VanDerWaalsContact O-N 3.17Å; A327-T329 PolarHBondContact O-N 3.18Å; A327-N384 WeakPolarHBondContact CA-OD1 3.47Å
328	D	84.9	Confident	83.6	Confident	57 Å²	57	62.6 Å²	62.6	31%	0.305	29%	0.293	S	S	.	.			trans	-76.5	95.7	179	-173.3	-12.2	0	0	0	111	Q325 Q330 L331 W332	Q325-D328 HydrophobicContact CB-CB 4.25Å; Q325-D328 PolarHBondContact O-N 3.21Å; Q325-D328 VanDerWaalsContact O-N 3.16Å; D328-Q330 VanDerWaalsContact C-N 3.27Å; D328-Q330 PolarHBondContact O-N 3.36Å; D328-Q330 WeakPolarHBondContact OD1-CB 3.45Å; D328-Q330 PolarHBondContact OD1-N 3.03Å; D328-L331 HydrophobicContact CB-CB 3.96Å; D328-L331 PolarHBondContact O-N 3.05Å; D328-L331 PolarHBondContact OD1-N 3.21Å; D328-W332 PolarHBondContact O-N 3.21Å
329	T	83.2	Confident	83.4	Confident	48 Å²	48	62.1 Å²	62.1	29%	0.294	29%	0.292	S	S	.	.	H	α-helix	trans	-64.9	-27.5	-179.6	62.6	0	0	0	0	113.7	A327 I333 N384 C387 L390	A327-T329 PolarHBondContact O-N 3.18Å; T329-I333 WeakPolarHBondContact O-CG1 3.47Å; T329-I333 PolarHBondContact O-N 3.43Å; T329-N384 HydrophobicContact CG2-CB 4.32Å; T329-C387 HydrophobicContact CG2-CB 3.88Å; T329-C387 VanDerWaalsContact CG2-SG 3.56Å; T329-L390 HydrophobicContact CG2-CD1 3.82Å
330	Q	83.8	Confident	82.9	Confident	95 Å²	95	63.5 Å²	63.5	44%	0.444	30%	0.299	S	S	.	.	H	α-helix	trans	-76	-41	-178.5	-179.6	58.6	27.3	0	0	110.5	D328 W332 I333 E334	D328-Q330 VanDerWaalsContact C-N 3.27Å; D328-Q330 PolarHBondContact O-N 3.36Å; D328-Q330 WeakPolarHBondContact OD1-CB 3.45Å; D328-Q330 PolarHBondContact OD1-N 3.03Å; Q330-W332 VanDerWaalsContact C-N 3.29Å; Q330-W332 PolarHBondContact O-N 3.47Å; Q330-I333 PolarHBondContact O-N 3.48Å; Q330-I333 VanDerWaalsContact O-N 3.15Å; Q330-E334 PolarHBondContact NE2-OE1 3.13Å; Q330-E334 VanDerWaalsContact NE2-OE1 3.11Å; Q330-E334 WeakPolarHBondContact O-CG 3.25Å; Q330-E334 PolarHBondContact O-N 3.49Å
331	L	84.8	Confident	82.1	Confident	12 Å²	12	63.8 Å²	63.8	6%	0.063	31%	0.305	C	S	.	.	H	α-helix	trans	-60.5	-37.3	174.4	-174.7	67.1	0	0	0	112.4	F318 R321 L322 D328 F335	F318-L331 HydrophobicContact CD1-CD1 3.8Å; F318-L331 HydrophobicContact CE1-CD1 3.95Å; R321-L331 HydrophobicContact CB-CD1 4.4Å; R321-L331 HydrophobicContact CB-CD2 3.52Å; L322-L331 HydrophobicContact CD2-CB 4.04Å; L322-L331 HydrophobicContact CD2-CD2 3.6Å; L322-L331 HydrophobicContact CD2-CG 3.62Å; L322-L331 HydrophobicContact CG-CD2 3.85Å; L322-L331 HydrophobicContact CG-CG 3.99Å; D328-L331 HydrophobicContact CB-CB 3.96Å; D328-L331 PolarHBondContact O-N 3.05Å; D328-L331 PolarHBondContact OD1-N 3.21Å; L331-F335 WeakPolarHBondContact O-CB 3.27Å; L331-F335 PolarHBondContact O-N 2.82Å
332	W	86.4	Confident	81.4	Confident	6 Å²	6	59.4 Å²	59.4	2%	0.023	29%	0.29	C	S	.	.	H	α-helix	trans	-63	-44.2	173.2	-78.2	111	0	0	0	112.3	L322 P326 D328 Q330 F335 I336 I376 R379 A380 L390	L322-W332 HydrophobicContact CB-CH2 4.37Å; L322-W332 HydrophobicContact CB-CZ2 4.31Å; L322-W332 HydrophobicContact CD1-CD2 4.15Å; L322-W332 HydrophobicContact CD1-CE3 3.73Å; L322-W332 HydrophobicContact CD1-CH2 4.22Å; L322-W332 HydrophobicContact CD1-CZ3 3.79Å; L322-W332 HydrophobicContact CD2-CB 4.44Å; L322-W332 HydrophobicContact CD2-CD2 3.48Å; L322-W332 VanDerWaalsContact CD2-CD2 3.48Å; L322-W332 HydrophobicContact CD2-CE3 3.97Å; L322-W332 HydrophobicContact CD2-CG 3.69Å; L322-W332 HydrophobicContact CD2-CH2 4.48Å; L322-W332 HydrophobicContact CD2-CZ2 4.06Å; L322-W332 HydrophobicContact CD2-CZ3 4.46Å; L322-W332 HydrophobicContact CG-CD2 4.39Å; L322-W332 HydrophobicContact CG-CE3 4.44Å; P326-W332 PolarHBondContact O-NE1 2.84Å; D328-W332 PolarHBondContact O-N 3.21Å; Q330-W332 VanDerWaalsContact C-N 3.29Å; Q330-W332 PolarHBondContact O-N 3.47Å; W332-F335 PolarHBondContact O-N 2.91Å; W332-I336 WeakPolarHBondContact O-CG1 3.2Å; W332-I336 PolarHBondContact O-N 2.88Å; W332-I376 HydrophobicContact CE3-CG2 4.07Å; W332-I376 HydrophobicContact CZ3-CG2 4.17Å; W332-R379 HydrophobicContact CH2-CG 4.42Å; W332-A380 HydrophobicContact CB-CB 3.99Å; W332-A380 HydrophobicContact CD2-CB 3.5Å; W332-A380 HydrophobicContact CE3-CB 3.62Å; W332-A380 HydrophobicContact CG-CB 3.68Å; W332-A380 HydrophobicContact CZ3-CB 4.32Å; W332-L390 HydrophobicContact CB-CD2 3.7Å
333	I	83.3	Confident	80.3	Confident	14 Å²	14	60.4 Å²	60.4	7%	0.072	30%	0.298	C	S	.	.	H	α-helix	trans	-65.3	-42.7	178.4	-65.8	170.8	0	0	0	110.6	T329 Q330 F335 I336 R337 A389 L390 E393	T329-I333 WeakPolarHBondContact O-CG1 3.47Å; T329-I333 PolarHBondContact O-N 3.43Å; Q330-I333 PolarHBondContact O-N 3.48Å; Q330-I333 VanDerWaalsContact O-N 3.15Å; I333-F335 VanDerWaalsContact C-N 3.3Å; I333-F335 PolarHBondContact O-N 3.02Å; I333-I336 PolarHBondContact O-N 3.44Å; I333-R337 WeakPolarHBondContact O-CG 3.25Å; I333-R337 PolarHBondContact O-N 3.03Å; I333-A389 HydrophobicContact CD1-CB 4.18Å; I333-L390 HydrophobicContact CD1-CD2 4.38Å; I333-L390 HydrophobicContact CG1-CD2 3.72Å; I333-E393 HydrophobicContact CG1-CG 4.29Å
334	E	83.3	Confident	79.3	Confident	87 Å²	87	55.7 Å²	55.7	41%	0.407	30%	0.295	S	S	.	.	H	α-helix	trans	-61	-40	175.4	-73.7	174.6	-165.8	0	0	111.8	F318 Q330 I336 R337 Y338	F318-E334 HydrophobicContact CE1-CB 4.2Å; Q330-E334 PolarHBondContact NE2-OE1 3.13Å; Q330-E334 VanDerWaalsContact NE2-OE1 3.11Å; Q330-E334 WeakPolarHBondContact O-CG 3.25Å; Q330-E334 PolarHBondContact O-N 3.49Å; E334-I336 PolarHBondContact O-N 3.35Å; E334-R337 PolarHBondContact O-N 3.17Å; E334-Y338 VanDerWaalsContact O-CB 3.32Å; E334-Y338 WeakPolarHBondContact O-CB 3.5Å; E334-Y338 PolarHBondContact O-N 3.01Å
335	F	84.3	Confident	77.9	Confident	6 Å²	6	52.8 Å²	52.8	3%	0.026	29%	0.293	C	S	.	.	H	α-helix	trans	-67.2	-35.8	177	-175.2	-131.5	0	0	0	113.2	T315 F318 L322 L331 W332 I333 Y338 Q339 I376	T315-F335 HydrophobicContact CG2-CE2 4.14Å; T315-F335 HydrophobicContact CG2-CZ 4.36Å; F318-F335 HydrophobicContact CB-CB 4.45Å; F318-F335 HydrophobicContact CB-CD2 3.37Å; F318-F335 HydrophobicContact CB-CE2 3.74Å; F318-F335 HydrophobicContact CB-CG 4.02Å; F318-F335 HydrophobicContact CD1-CB 4.13Å; F318-F335 HydrophobicContact CD1-CD2 4.28Å; F318-F335 AromaticContact CD2-CD2 3.9Å; F318-F335 HydrophobicContact CD2-CD2 3.9Å; F318-F335 HydrophobicContact CD2-CE2 4.48Å; F318-F335 HydrophobicContact CG-CB 4.33Å; F318-F335 AromaticContact CG-CD2 3.62Å; F318-F335 HydrophobicContact CG-CD2 3.62Å; F318-F335 HydrophobicContact CG-CE2 4.34Å; F318-F335 HydrophobicContact CG-CG 4.3Å; L322-F335 HydrophobicContact CD1-CB 4.02Å; L322-F335 HydrophobicContact CD1-CD1 3.59Å; L322-F335 HydrophobicContact CD1-CE1 4.27Å; L322-F335 HydrophobicContact CD1-CG 3.93Å; L331-F335 WeakPolarHBondContact O-CB 3.27Å; L331-F335 PolarHBondContact O-N 2.82Å; W332-F335 PolarHBondContact O-N 2.91Å; I333-F335 VanDerWaalsContact C-N 3.3Å; I333-F335 PolarHBondContact O-N 3.02Å; F335-Y338 HydrophobicContact CD2-CD1 4.37Å; F335-Q339 PolarHBondContact O-N 2.64Å; F335-Q339 PolarHBondContact O-NE2 2.92Å; F335-I376 HydrophobicContact CD1-CD1 4.06Å; F335-I376 HydrophobicContact CD1-CG1 4.34Å; F335-I376 HydrophobicContact CD1-CG2 3.51Å; F335-I376 HydrophobicContact CE1-CD1 3.56Å; F335-I376 HydrophobicContact CE1-CG1 3.84Å; F335-I376 HydrophobicContact CE1-CG2 3.87Å; F335-I376 HydrophobicContact CZ-CD1 4.04Å
336	I	83.1	Confident	76.6	Confident	5 Å²	5	51 Å²	51	3%	0.026	30%	0.297	C	S	.	.	H	α-helix	trans	-63.5	-46.9	172.3	-69.6	166.3	0	0	0	110.3	W332 I333 E334 Q339 K373 I376 A377 I397	W332-I336 WeakPolarHBondContact O-CG1 3.2Å; W332-I336 PolarHBondContact O-N 2.88Å; I333-I336 PolarHBondContact O-N 3.44Å; E334-I336 PolarHBondContact O-N 3.35Å; I336-Q339 WeakPolarHBondContact O-CB 3.48Å; I336-Q339 PolarHBondContact O-N 3.07Å; I336-K373 HydrophobicContact CG2-CG 4.39Å; I336-K373 VanDerWaalsContact O-CE 3.28Å; I336-K373 WeakPolarHBondContact O-CE 3.36Å; I336-I376 HydrophobicContact CG1-CB 4.45Å; I336-I376 HydrophobicContact CG1-CG2 3.8Å; I336-A377 HydrophobicContact CD1-CB 3.97Å; I336-I397 HydrophobicContact CG2-CD1 3.94Å
337	R	80.4	Confident	75.1	Confident	138 Å²	138	54.2 Å²	54.2	52%	0.521	31%	0.306	S	S	.	.	H	α-helix	trans	-65.7	-37.9	178.6	-71.1	-179.9	-178.9	-176.8	2.2	112.5	I333 E334 Q339 D340	I333-R337 WeakPolarHBondContact O-CG 3.25Å; I333-R337 PolarHBondContact O-N 3.03Å; E334-R337 PolarHBondContact O-N 3.17Å; R337-Q339 PolarHBondContact O-N 2.78Å; R337-Q339 VanDerWaalsContact O-N 3.14Å; R337-D340 WeakPolarHBondContact O-CB 3.31Å; R337-D340 PolarHBondContact O-N 3.14Å
338	Y	80.7	Confident	73.5	Confident	12 Å²	12	53.4 Å²	53.4	5%	0.047	31%	0.305	C	S	.	.	H	α-helix	trans	-57	-29.5	176.2	-179.9	-115.9	0	0	0	112.3	V311 R314 F318 E334 F335 D340 E341 L342	V311-Y338 PolarHBondContact O-OH 3.44Å; V311-Y338 VanDerWaalsContact O-OH 3.13Å; R314-Y338 HydrophobicContact CB-CE1 4.29Å; R314-Y338 HydrophobicContact CB-CE2 4.4Å; R314-Y338 WeakPolarHBondContact CB-OH 3.33Å; F318-Y338 AromaticContact CD2-CD1 3.8Å; F318-Y338 HydrophobicContact CD2-CD1 3.8Å; F318-Y338 HydrophobicContact CD2-CE1 4.15Å; F318-Y338 HydrophobicContact CD2-CG 4.17Å; F318-Y338 AromaticContact CE2-CD1 3.77Å; F318-Y338 HydrophobicContact CE2-CD1 3.77Å; F318-Y338 HydrophobicContact CE2-CD2 4.04Å; F318-Y338 HydrophobicContact CE2-CE1 4.24Å; F318-Y338 HydrophobicContact CE2-CE2 4.49Å; F318-Y338 AromaticContact CE2-CG 3.66Å; F318-Y338 HydrophobicContact CE2-CG 3.66Å; F318-Y338 HydrophobicContact CZ-CG 4.5Å; E334-Y338 VanDerWaalsContact O-CB 3.32Å; E334-Y338 WeakPolarHBondContact O-CB 3.5Å; E334-Y338 PolarHBondContact O-N 3.01Å; F335-Y338 HydrophobicContact CD2-CD1 4.37Å; Y338-D340 PolarHBondContact O-N 3.24Å; Y338-E341 HydrophobicContact CD2-CB 4.49Å; Y338-E341 PolarHBondContact O-N 3Å; Y338-L342 HydrophobicContact CD1-CD1 3.84Å; Y338-L342 HydrophobicContact CD1-CG 3.98Å; Y338-L342 HydrophobicContact CE1-CD1 3.53Å; Y338-L342 HydrophobicContact CE1-CD2 3.72Å; Y338-L342 HydrophobicContact CE1-CG 3.63Å; Y338-L342 HydrophobicContact CE2-CD2 4.05Å; Y338-L342 HydrophobicContact CE2-CG 4.26Å; Y338-L342 HydrophobicContact CG-CG 4.43Å; Y338-L342 VanDerWaalsContact CZ-CD2 3.42Å; Y338-L342 WeakPolarHBondContact O-CG 3.37Å; Y338-L342 PolarHBondContact O-N 3.04Å; Y338-L342 VanDerWaalsContact OH-CD2 3.29Å; Y338-L342 WeakPolarHBondContact OH-CD2 3.5Å
339	Q	80	Confident	71.4	Confident	6 Å²	6	53.6 Å²	53.6	3%	0.028	32%	0.321	C	S	.	.	H	α-helix	trans	-63.1	-28.2	174.7	-57.2	-49.6	-63	0	0	113.3	F335 I336 R337 S343 K372 K373 I376	F335-Q339 PolarHBondContact O-N 2.64Å; F335-Q339 PolarHBondContact O-NE2 2.92Å; I336-Q339 WeakPolarHBondContact O-CB 3.48Å; I336-Q339 PolarHBondContact O-N 3.07Å; R337-Q339 PolarHBondContact O-N 2.78Å; R337-Q339 VanDerWaalsContact O-N 3.14Å; Q339-S343 PolarHBondContact O-N 3.39Å; Q339-S343 VanDerWaalsContact O-N 3.08Å; Q339-K372 VanDerWaalsContact OE1-CE 3.24Å; Q339-K373 HydrophobicContact CB-CD 4.46Å; Q339-K373 HydrophobicContact CB-CG 3.88Å; Q339-K373 HydrophobicContact CG-CG 4.11Å; Q339-I376 HydrophobicContact CG-CD1 3.88Å
340	D	71.9	Confident	69.4	Low	69 Å²	69	59 Å²	59	37%	0.369	35%	0.348	S	S	.	.	H	α-helix	trans	-69.3	-43.4	173.4	-70.1	-43.1	0	0	0	111.4	R337 Y338 L342 S343 A344 K373	R337-D340 WeakPolarHBondContact O-CB 3.31Å; R337-D340 PolarHBondContact O-N 3.14Å; Y338-D340 PolarHBondContact O-N 3.24Å; D340-L342 VanDerWaalsContact C-N 3.32Å; D340-L342 PolarHBondContact O-N 3.49Å; D340-S343 PolarHBondContact O-N 3.3Å; D340-S343 PolarHBondContact O-OG 3.15Å; D340-A344 PolarHBondContact O-N 3.31Å; D340-K373 VanDerWaalsContact OD1-CE 3.27Å; D340-K373 WeakPolarHBondContact OD1-CE 2.96Å; D340-K373 IonicContact OD1-NZ 2.82Å; D340-K373 PolarHBondContact OD1-NZ 3.14Å; D340-K373 IonicContact OD2-NZ 2.65Å; D340-K373 PolarHBondContact OD2-NZ 3Å
341	E	70.7	Confident	67.5	Low	122 Å²	122	60.3 Å²	60.3	57%	0.57	35%	0.354	S	S	*	.	H	α-helix	trans	-63.2	-40.9	177.2	-63	178.8	-177.8	0	0	111.2	Y338 S343 A344 A345	Y338-E341 HydrophobicContact CD2-CB 4.49Å; Y338-E341 PolarHBondContact O-N 3Å; E341-S343 VanDerWaalsContact C-N 3.32Å; E341-S343 PolarHBondContact O-N 3.31Å; E341-A344 PolarHBondContact O-N 3.02Å; E341-A345 WeakPolarHBondContact O-CB 3.47Å; E341-A345 PolarHBondContact O-N 3.36Å
342	L	68.6	Low	65.4	Low	23 Å²	23	66.7 Å²	66.7	12%	0.12	38%	0.384	C	S	.	.	H	α-helix	trans	-59.8	-42.4	173.1	-71.8	-174.1	0	0	0	112.3	V311 Y338 D340 A345 A346	V311-L342 HydrophobicContact CB-CD2 4.04Å; V311-L342 HydrophobicContact CG1-CD2 3.28Å; V311-L342 HydrophobicContact CG2-CD2 3.89Å; Y338-L342 HydrophobicContact CD1-CD1 3.84Å; Y338-L342 HydrophobicContact CD1-CG 3.98Å; Y338-L342 HydrophobicContact CE1-CD1 3.53Å; Y338-L342 HydrophobicContact CE1-CD2 3.72Å; Y338-L342 HydrophobicContact CE1-CG 3.63Å; Y338-L342 HydrophobicContact CE2-CD2 4.05Å; Y338-L342 HydrophobicContact CE2-CG 4.26Å; Y338-L342 HydrophobicContact CG-CG 4.43Å; Y338-L342 VanDerWaalsContact CZ-CD2 3.42Å; Y338-L342 WeakPolarHBondContact O-CG 3.37Å; Y338-L342 PolarHBondContact O-N 3.04Å; Y338-L342 VanDerWaalsContact OH-CD2 3.29Å; Y338-L342 WeakPolarHBondContact OH-CD2 3.5Å; D340-L342 VanDerWaalsContact C-N 3.32Å; D340-L342 PolarHBondContact O-N 3.49Å; L342-A345 PolarHBondContact O-N 2.99Å; L342-A346 WeakPolarHBondContact O-CB 3.42Å; L342-A346 PolarHBondContact O-N 3.36Å
343	S	63.4	Low	63.2	Low	27 Å²	27	74.1 Å²	74.1	19%	0.189	42%	0.419	C	S	.	.	H	α-helix	trans	-68.4	-40.3	177.6	74.4	0	0	0	0	112.3	Q339 D340 E341 A345 A346 F347	Q339-S343 PolarHBondContact O-N 3.39Å; Q339-S343 VanDerWaalsContact O-N 3.08Å; D340-S343 PolarHBondContact O-N 3.3Å; D340-S343 PolarHBondContact O-OG 3.15Å; E341-S343 VanDerWaalsContact C-N 3.32Å; E341-S343 PolarHBondContact O-N 3.31Å; S343-A345 VanDerWaalsContact C-N 3.29Å; S343-A345 PolarHBondContact O-N 2.96Å; S343-A346 PolarHBondContact O-N 3.29Å; S343-F347 WeakPolarHBondContact O-CB 3.31Å; S343-F347 VanDerWaalsContact O-CD2 3.27Å; S343-F347 WeakPolarHBondContact O-CD2 3.38Å; S343-F347 PolarHBondContact O-N 2.91Å
344	A	61.3	Low	60.9	Low	69 Å²	69	78.9 Å²	78.9	57%	0.57	44%	0.44	S	S	*	.	H	α-helix	trans	-64.8	-35.4	176.4	0	0	0	0	0	111.8	D340 E341 G348	D340-A344 PolarHBondContact O-N 3.31Å; E341-A344 PolarHBondContact O-N 3.02Å; A344-G348 WeakPolarHBondContact O-CA 3.3Å; A344-G348 PolarHBondContact O-N 3.06Å; A344-G348 VanDerWaalsContact O-N 3.16Å
345	A	57.4	Low	59	Low	70 Å²	70	76 Å²	76	58%	0.579	44%	0.435	S	S	*	.	H	α-helix	trans	-75.1	-39.3	175.8	0	0	0	0	0	113.2	E341 L342 S343	E341-A345 WeakPolarHBondContact O-CB 3.47Å; E341-A345 PolarHBondContact O-N 3.36Å; L342-A345 PolarHBondContact O-N 2.99Å; S343-A345 VanDerWaalsContact C-N 3.29Å; S343-A345 PolarHBondContact O-N 2.96Å
346	A	54.8	Low	56.8	Low	75 Å²	75	79.7 Å²	79.7	62%	0.62	46%	0.461	S	S	*	.	H	α-helix	trans	-77.1	-31.8	-178.1	0	0	0	0	0	113.7	L342 S343	L342-A346 WeakPolarHBondContact O-CB 3.42Å; L342-A346 PolarHBondContact O-N 3.36Å; S343-A346 PolarHBondContact O-N 3.29Å
347	F	49.8	Very low	54.9	Low	121 Å²	121	82.7 Å²	82.7	53%	0.531	48%	0.477	S	S	.	.	H	α-helix	trans	-108	-2.3	-176.6	-62.7	-73.6	0	0	0	114	S343 G349 I369	S343-F347 WeakPolarHBondContact O-CB 3.31Å; S343-F347 VanDerWaalsContact O-CD2 3.27Å; S343-F347 WeakPolarHBondContact O-CD2 3.38Å; S343-F347 PolarHBondContact O-N 2.91Å; F347-G349 VanDerWaalsContact C-N 3.32Å; F347-G349 PolarHBondContact O-N 2.79Å; F347-I369 HydrophobicContact CD2-CD1 4.48Å; F347-I369 HydrophobicContact CE2-CD1 4.09Å
348	G	46.3	Very low	53.3	Low	59 Å²	59	78.9 Å²	78.9	61%	0.608	47%	0.467	S	S	*	.	S	Bend	trans	-83.8	1.8	178.7	0	0	0	0	0	115.5	A344	A344-G348 WeakPolarHBondContact O-CA 3.3Å; A344-G348 PolarHBondContact O-N 3.06Å; A344-G348 VanDerWaalsContact O-N 3.16Å
349	G	41.3	Very low	51.7	Low	61 Å²	61	80.9 Å²	80.9	63%	0.629	49%	0.486	S	S	*	.	S	Bend	trans	-99.9	-32.5	-172.3	0	0	0	0	0	116.3	F347	F347-G349 VanDerWaalsContact C-N 3.32Å; F347-G349 PolarHBondContact O-N 2.79Å
350	D	42.7	Very low	50.1	Low	162 Å²	162	87.1 Å²	87.1	87%	0.866	52%	0.515	S	S	*	.			trans	-126.8	80.3	-171.8	-75	-29.2	0	0	0	110.8
351	E	43.9	Very low	49.1	Very low	122 Å²	122	90.2 Å²	90.2	57%	0.57	52%	0.521	S	S	*	.			trans	-116.3	80.2	170.1	-70.7	-157.6	127.9	0	0	110.1	R362	E351-R362 IonicContact OE1-CZ 3.05Å; E351-R362 VanDerWaalsContact OE1-CZ 3.31Å; E351-R362 IonicContact OE1-NH1 3.51Å; E351-R362 PolarHBondContact OE1-NH1 3.31Å; E351-R362 IonicContact OE1-NH2 2.96Å; E351-R362 PolarHBondContact OE1-NH2 3.38Å
352	E	40.6	Very low	48.4	Very low	147 Å²	147	90.4 Å²	90.4	69%	0.687	52%	0.517	S	S	*	.	S	Bend	trans	-167.4	126	149.7	-106.8	159.4	-150.6	0	0	109.8
353	Q	39.4	Very low	48	Very low	162 Å²	162	96.5 Å²	96.5	76%	0.757	54%	0.543	S	S	*	.	S	Bend	trans	96.4	67	171.6	-56.6	147.2	0.1	0	0	118.4
354	Q	35.1	Very low	47.8	Very low	113 Å²	113	98.5 Å²	98.5	53%	0.528	56%	0.557	S	S	.	*			trans	-168.9	108.1	140.8	-108.1	153.1	36	0	0	112.6	L358	Q354-L358 WeakPolarHBondContact O-CB 3.45Å; Q354-L358 WeakPolarHBondContact O-CD1 3.47Å; Q354-L358 WeakPolarHBondContact O-CG 3.31Å
355	G	43.9	Very low	48.3	Very low	28 Å²	28	96.6 Å²	96.6	29%	0.289	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	166.6	-178.8	0	0	0	0	0	115.2	D357	G355-D357 PolarHBondContact O-N 3.12Å
356	S	37.5	Very low	49	Very low	83 Å²	83	98.8 Å²	98.8	58%	0.58	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	-56.2	175.7	-167.7	0	0	0	0	117	L358 A359	S356-L358 PolarHBondContact O-N 2.99Å; S356-A359 PolarHBondContact O-N 3.48Å; S356-A359 VanDerWaalsContact O-N 3.15Å
357	D	43.3	Very low	50.2	Low	67 Å²	67	101.3 Å²	101.3	36%	0.358	53%	0.526	S	S	.	.	H	α-helix	trans	-65.7	-20	178	-66.2	4.7	0	0	0	111.9	R129 G355 R361	R129-D357 IonicContact NH1-OD1 3.72Å; G355-D357 PolarHBondContact O-N 3.12Å; D357-R361 WeakPolarHBondContact O-CB 3.39Å; D357-R361 VanDerWaalsContact O-CG 3.22Å; D357-R361 WeakPolarHBondContact O-CG 3.22Å; D357-R361 PolarHBondContact O-N 3.36Å
358	L	47.2	Very low	51.6	Low	58 Å²	58	98 Å²	98	30%	0.304	52%	0.522	S	S	.	.	H	α-helix	trans	-67.1	-33.7	172.2	-95.2	176.4	0	0	0	112.8	Q354 S356 R362	Q354-L358 WeakPolarHBondContact O-CB 3.45Å; Q354-L358 WeakPolarHBondContact O-CD1 3.47Å; Q354-L358 WeakPolarHBondContact O-CG 3.31Å; S356-L358 PolarHBondContact O-N 2.99Å; L358-R362 WeakPolarHBondContact O-CB 3.24Å; L358-R362 WeakPolarHBondContact O-CG 3.28Å; L358-R362 PolarHBondContact O-N 3.31Å
359	A	45.6	Very low	53.3	Low	54 Å²	54	96.4 Å²	96.4	45%	0.446	50%	0.499	S	S	.	.	H	α-helix	trans	-70.4	-38.8	177.9	0	0	0	0	0	110.5	S356 K363	S356-A359 PolarHBondContact O-N 3.48Å; S356-A359 VanDerWaalsContact O-N 3.15Å; A359-K363 VanDerWaalsContact O-CB 3.31Å; A359-K363 WeakPolarHBondContact O-CB 3.45Å; A359-K363 WeakPolarHBondContact O-CG 3.36Å; A359-K363 PolarHBondContact O-N 3.35Å
360	E	46.6	Very low	55.2	Low	138 Å²	138	93.9 Å²	93.9	65%	0.645	47%	0.471	S	S	*	.	H	α-helix	trans	-71.4	-41.6	173.1	-72.2	-173	165	0	0	112.1	K363 S364	E360-K363 CarbonylContact O-C 3.58Å; E360-K363 PolarHBondContact O-N 3.41Å; E360-S364 WeakPolarHBondContact O-CB 3.4Å; E360-S364 PolarHBondContact O-N 2.82Å; E360-S364 PolarHBondContact O-OG 2.98Å
361	R	51.5	Low	57.2	Low	133 Å²	133	90.9 Å²	90.9	50%	0.502	45%	0.452	S	S	.	.	H	α-helix	trans	-65.6	-36.5	174.6	-77.6	178.6	-178.6	167.4	3.7	113	D357 S364 S365	D357-R361 WeakPolarHBondContact O-CB 3.39Å; D357-R361 VanDerWaalsContact O-CG 3.22Å; D357-R361 WeakPolarHBondContact O-CG 3.22Å; D357-R361 PolarHBondContact O-N 3.36Å; R361-S364 VanDerWaalsContact CA-OG 3.27Å; R361-S364 WeakPolarHBondContact CA-OG 3.47Å; R361-S364 PolarHBondContact O-OG 3.24Å; R361-S365 WeakPolarHBondContact O-CB 3.47Å; R361-S365 PolarHBondContact O-N 2.98Å; R361-S365 PolarHBondContact O-OG 2.77Å; R361-S365 VanDerWaalsContact O-OG 3.06Å
362	R	55.6	Low	59.1	Low	126 Å²	126	90 Å²	90	48%	0.475	45%	0.446	S	S	.	.	H	α-helix	trans	-69	-40.4	172.1	-75.7	172.4	-158.1	-152	-5.2	111.2	E351 L358 S365 Y366	E351-R362 IonicContact OE1-CZ 3.05Å; E351-R362 VanDerWaalsContact OE1-CZ 3.31Å; E351-R362 IonicContact OE1-NH1 3.51Å; E351-R362 PolarHBondContact OE1-NH1 3.31Å; E351-R362 IonicContact OE1-NH2 2.96Å; E351-R362 PolarHBondContact OE1-NH2 3.38Å; L358-R362 WeakPolarHBondContact O-CB 3.24Å; L358-R362 WeakPolarHBondContact O-CG 3.28Å; L358-R362 PolarHBondContact O-N 3.31Å; R362-S365 WeakPolarHBondContact CA-OG 3.35Å; R362-S365 PolarHBondContact O-OG 2.68Å; R362-S365 VanDerWaalsContact O-OG 3.14Å; R362-Y366 WeakPolarHBondContact O-CB 3.18Å; R362-Y366 PolarHBondContact O-N 3.03Å
363	K	60.3	Low	61.3	Low	152 Å²	152	83.7 Å²	83.7	66%	0.661	42%	0.416	S	S	*	.	H	α-helix	trans	-65.9	-40.3	173.5	-76.8	172.4	-177.8	-176.8	0	111.3	A359 E360 R367	A359-K363 VanDerWaalsContact O-CB 3.31Å; A359-K363 WeakPolarHBondContact O-CB 3.45Å; A359-K363 WeakPolarHBondContact O-CG 3.36Å; A359-K363 PolarHBondContact O-N 3.35Å; E360-K363 CarbonylContact O-C 3.58Å; E360-K363 PolarHBondContact O-N 3.41Å; K363-R367 WeakPolarHBondContact O-CB 3.48Å; K363-R367 PolarHBondContact O-N 3.4Å
364	S	60.7	Low	63.5	Low	69 Å²	69	77 Å²	77	48%	0.483	39%	0.386	S	S	.	.	H	α-helix	trans	-74.1	-36.5	178.6	69.4	0	0	0	0	112.1	E360 R361 A368	E360-S364 WeakPolarHBondContact O-CB 3.4Å; E360-S364 PolarHBondContact O-N 2.82Å; E360-S364 PolarHBondContact O-OG 2.98Å; R361-S364 VanDerWaalsContact CA-OG 3.27Å; R361-S364 WeakPolarHBondContact CA-OG 3.47Å; R361-S364 PolarHBondContact O-OG 3.24Å; S364-A368 VanDerWaalsContact O-CB 3.28Å; S364-A368 WeakPolarHBondContact O-CB 3.17Å; S364-A368 PolarHBondContact O-N 2.91Å
365	S	70.7	Confident	66	Low	29 Å²	29	75.6 Å²	75.6	20%	0.203	39%	0.388	C	S	.	.	H	α-helix	trans	-69.8	-42.9	174	68.9	0	0	0	0	111.3	R361 R362 A368 I369	R361-S365 WeakPolarHBondContact O-CB 3.47Å; R361-S365 PolarHBondContact O-N 2.98Å; R361-S365 PolarHBondContact O-OG 2.77Å; R361-S365 VanDerWaalsContact O-OG 3.06Å; R362-S365 WeakPolarHBondContact CA-OG 3.35Å; R362-S365 PolarHBondContact O-OG 2.68Å; R362-S365 VanDerWaalsContact O-OG 3.14Å; S365-A368 PolarHBondContact O-N 2.78Å; S365-I369 VanDerWaalsContact O-CD1 3.32Å; S365-I369 WeakPolarHBondContact O-CD1 3.48Å; S365-I369 VanDerWaalsContact O-CG1 3.23Å; S365-I369 WeakPolarHBondContact O-CG1 3.47Å; S365-I369 PolarHBondContact O-N 2.9Å
366	Y	73	Confident	67.9	Low	115 Å²	115	74.9 Å²	74.9	45%	0.451	38%	0.378	S	S	.	.	H	α-helix	trans	-61	-45	172.7	-177.7	-109.1	0	0	0	111.7	R362 A368 I369 L370 D400	R362-Y366 WeakPolarHBondContact O-CB 3.18Å; R362-Y366 PolarHBondContact O-N 3.03Å; Y366-A368 PolarHBondContact O-N 3.48Å; Y366-I369 WeakPolarHBondContact O-CB 3.44Å; Y366-I369 PolarHBondContact O-N 3.3Å; Y366-L370 HydrophobicContact CD1-CD1 3.82Å; Y366-L370 HydrophobicContact CD1-CG 4.43Å; Y366-L370 HydrophobicContact CE1-CD1 3.4Å; Y366-L370 HydrophobicContact CE1-CG 4.11Å; Y366-L370 WeakPolarHBondContact O-CG 3.37Å; Y366-L370 PolarHBondContact O-N 2.89Å; Y366-D400 PolarHBondContact OH-OD2 3.38Å
367	R	79.6	Confident	70.2	Confident	128 Å²	128	71 Å²	71	48%	0.483	35%	0.35	S	S	.	.	H	α-helix	trans	-60.9	-43	174.1	-169.4	179	-176.9	114.2	2.8	111.8	K363 I369 L370 E371 L401	K363-R367 WeakPolarHBondContact O-CB 3.48Å; K363-R367 PolarHBondContact O-N 3.4Å; R367-I369 VanDerWaalsContact C-N 3.32Å; R367-I369 PolarHBondContact O-N 3.43Å; R367-L370 PolarHBondContact O-N 3.11Å; R367-E371 IonicContact NE-OE1 3.89Å; R367-E371 PolarHBondContact NE-OE1 3.41Å; R367-E371 WeakPolarHBondContact O-CB 3.48Å; R367-E371 WeakPolarHBondContact O-CG 3.32Å; R367-E371 PolarHBondContact O-N 3.23Å; R367-L401 HydrophobicContact CG-CD2 3.67Å
368	A	79.6	Confident	72.2	Confident	52 Å²	52	70 Å²	70	43%	0.43	35%	0.345	S	S	.	.	H	α-helix	trans	-63.6	-36.3	175.8	0	0	0	0	0	112.6	S364 S365 Y366 E371 K372	S364-A368 VanDerWaalsContact O-CB 3.28Å; S364-A368 WeakPolarHBondContact O-CB 3.17Å; S364-A368 PolarHBondContact O-N 2.91Å; S365-A368 PolarHBondContact O-N 2.78Å; Y366-A368 PolarHBondContact O-N 3.48Å; A368-E371 PolarHBondContact O-N 3.02Å; A368-K372 WeakPolarHBondContact O-CB 3.39Å; A368-K372 PolarHBondContact O-N 3.18Å
369	I	80.8	Confident	74	Confident	25 Å²	25	72.5 Å²	72.5	13%	0.128	35%	0.351	C	S	.	.	H	α-helix	trans	-65.4	-45.1	173.4	-67.4	154.3	0	0	0	110.4	F347 S365 Y366 R367 E371 K372 K373	F347-I369 HydrophobicContact CD2-CD1 4.48Å; F347-I369 HydrophobicContact CE2-CD1 4.09Å; S365-I369 VanDerWaalsContact O-CD1 3.32Å; S365-I369 WeakPolarHBondContact O-CD1 3.48Å; S365-I369 VanDerWaalsContact O-CG1 3.23Å; S365-I369 WeakPolarHBondContact O-CG1 3.47Å; S365-I369 PolarHBondContact O-N 2.9Å; Y366-I369 WeakPolarHBondContact O-CB 3.44Å; Y366-I369 PolarHBondContact O-N 3.3Å; R367-I369 VanDerWaalsContact C-N 3.32Å; R367-I369 PolarHBondContact O-N 3.43Å; I369-E371 VanDerWaalsContact C-N 3.34Å; I369-E371 PolarHBondContact O-N 3.48Å; I369-K372 PolarHBondContact O-N 3.08Å; I369-K373 HydrophobicContact CG2-CD 4.19Å; I369-K373 WeakPolarHBondContact O-CB 3.38Å; I369-K373 WeakPolarHBondContact O-CG 3.38Å; I369-K373 PolarHBondContact O-N 2.98Å
370	L	80.8	Confident	75.9	Confident	9 Å²	9	70 Å²	70	5%	0.047	33%	0.329	C	S	.	.	H	α-helix	trans	-62.5	-40.9	176	-70.2	175.2	0	0	0	111.7	Y366 R367 K373 L374 I397 D400 L401	Y366-L370 HydrophobicContact CD1-CD1 3.82Å; Y366-L370 HydrophobicContact CD1-CG 4.43Å; Y366-L370 HydrophobicContact CE1-CD1 3.4Å; Y366-L370 HydrophobicContact CE1-CG 4.11Å; Y366-L370 WeakPolarHBondContact O-CG 3.37Å; Y366-L370 PolarHBondContact O-N 2.89Å; R367-L370 PolarHBondContact O-N 3.11Å; L370-K373 HydrophobicContact CD2-CD 4.49Å; L370-K373 WeakPolarHBondContact O-CB 3.19Å; L370-K373 PolarHBondContact O-N 3.05Å; L370-L374 WeakPolarHBondContact O-CB 3.47Å; L370-L374 PolarHBondContact O-N 3.38Å; L370-I397 HydrophobicContact CB-CG2 4.37Å; L370-I397 HydrophobicContact CD2-CG2 4.18Å; L370-I397 WeakPolarHBondContact O-CG2 3.38Å; L370-D400 HydrophobicContact CD1-CB 3.68Å; L370-L401 HydrophobicContact CB-CD1 3.84Å; L370-L401 HydrophobicContact CB-CD2 3.93Å; L370-L401 HydrophobicContact CB-CG 3.96Å; L370-L401 HydrophobicContact CD1-CD2 4.3Å; L370-L401 HydrophobicContact CD1-CG 4.38Å
371	E	85.1	Confident	77.8	Confident	99 Å²	99	63.9 Å²	63.9	46%	0.463	30%	0.302	S	S	.	.	H	α-helix	trans	-63.3	-41	175.6	-74.7	171.2	-173.8	0	0	111.6	R367 A368 I369 L374 S375 L401	R367-E371 IonicContact NE-OE1 3.89Å; R367-E371 PolarHBondContact NE-OE1 3.41Å; R367-E371 WeakPolarHBondContact O-CB 3.48Å; R367-E371 WeakPolarHBondContact O-CG 3.32Å; R367-E371 PolarHBondContact O-N 3.23Å; A368-E371 PolarHBondContact O-N 3.02Å; I369-E371 VanDerWaalsContact C-N 3.34Å; I369-E371 PolarHBondContact O-N 3.48Å; E371-L374 PolarHBondContact O-N 3.06Å; E371-S375 PolarHBondContact O-N 3.19Å; E371-L401 HydrophobicContact CG-CD1 4.24Å; E371-L401 HydrophobicContact CG-CD2 4.17Å
372	K	84.6	Confident	79.5	Confident	103 Å²	103	64.9 Å²	64.9	45%	0.448	31%	0.312	S	S	.	.	H	α-helix	trans	-63.3	-44.5	173.8	-171.5	-176.6	-177.1	-166.5	0	111.7	Q339 A368 I369 L374 S375 I376	Q339-K372 VanDerWaalsContact OE1-CE 3.24Å; A368-K372 WeakPolarHBondContact O-CB 3.39Å; A368-K372 PolarHBondContact O-N 3.18Å; I369-K372 PolarHBondContact O-N 3.08Å; K372-L374 VanDerWaalsContact C-N 3.32Å; K372-S375 PolarHBondContact O-N 3.15Å; K372-I376 HydrophobicContact CG-CD1 4.37Å; K372-I376 WeakPolarHBondContact O-CG1 3.44Å; K372-I376 PolarHBondContact O-N 3.39Å; K372-I376 VanDerWaalsContact O-N 3.1Å
373	K	86.3	Confident	80.8	Confident	15 Å²	15	61.8 Å²	61.8	7%	0.065	31%	0.307	C	S	.	.	H	α-helix	trans	-62.4	-40.4	175.3	-75.8	173.6	155.6	-163.4	0	112	I336 Q339 D340 I369 L370 I376 A377 I397	I336-K373 HydrophobicContact CG2-CG 4.39Å; I336-K373 VanDerWaalsContact O-CE 3.28Å; I336-K373 WeakPolarHBondContact O-CE 3.36Å; Q339-K373 HydrophobicContact CB-CD 4.46Å; Q339-K373 HydrophobicContact CB-CG 3.88Å; Q339-K373 HydrophobicContact CG-CG 4.11Å; D340-K373 VanDerWaalsContact OD1-CE 3.27Å; D340-K373 WeakPolarHBondContact OD1-CE 2.96Å; D340-K373 IonicContact OD1-NZ 2.82Å; D340-K373 PolarHBondContact OD1-NZ 3.14Å; D340-K373 IonicContact OD2-NZ 2.65Å; D340-K373 PolarHBondContact OD2-NZ 3Å; I369-K373 HydrophobicContact CG2-CD 4.19Å; I369-K373 WeakPolarHBondContact O-CB 3.38Å; I369-K373 WeakPolarHBondContact O-CG 3.38Å; I369-K373 PolarHBondContact O-N 2.98Å; L370-K373 HydrophobicContact CD2-CD 4.49Å; L370-K373 WeakPolarHBondContact O-CB 3.19Å; L370-K373 PolarHBondContact O-N 3.05Å; K373-I376 PolarHBondContact O-N 3.15Å; K373-A377 WeakPolarHBondContact O-CB 3.21Å; K373-A377 PolarHBondContact O-N 3.05Å; K373-I397 HydrophobicContact CB-CD1 3.86Å; K373-I397 HydrophobicContact CB-CG1 4.32Å; K373-I397 HydrophobicContact CB-CG2 4.2Å
374	L	86.6	Confident	81.8	Confident	22 Å²	22	55.6 Å²	55.6	12%	0.115	28%	0.281	C	S	.	.	H	α-helix	trans	-62.1	-45.7	176.7	179.8	55.9	0	0	0	110.6	L370 E371 K372 I376 A377 D378 R394 I397 C398 L401	L370-L374 WeakPolarHBondContact O-CB 3.47Å; L370-L374 PolarHBondContact O-N 3.38Å; E371-L374 PolarHBondContact O-N 3.06Å; K372-L374 VanDerWaalsContact C-N 3.32Å; L374-I376 VanDerWaalsContact C-N 3.29Å; L374-I376 PolarHBondContact O-N 3.25Å; L374-A377 CarbonylContact O-C 3.6Å; L374-A377 PolarHBondContact O-N 3.41Å; L374-A377 VanDerWaalsContact O-N 3.1Å; L374-D378 PolarHBondContact O-N 2.96Å; L374-R394 HydrophobicContact CD1-CG 3.98Å; L374-I397 HydrophobicContact CB-CG2 3.99Å; L374-C398 WeakPolarHBondContact CD1-SG 3.4Å; L374-L401 HydrophobicContact CB-CD1 4.2Å; L374-L401 HydrophobicContact CD2-CD1 3.84Å
375	S	86.3	Confident	82.6	Confident	82 Å²	82	56.1 Å²	56.1	57%	0.573	28%	0.283	S	S	*	.	H	α-helix	trans	-58.6	-40	175.1	176.6	0	0	0	0	112.7	E371 K372 R379	E371-S375 PolarHBondContact O-N 3.19Å; K372-S375 PolarHBondContact O-N 3.15Å; S375-R379 WeakPolarHBondContact O-CB 3.47Å; S375-R379 PolarHBondContact O-N 3.29Å
376	I	85.1	Confident	82.8	Confident	14 Å²	14	60.3 Å²	60.3	7%	0.072	31%	0.308	C	S	.	.	H	α-helix	trans	-66.3	-43.9	175.1	-65.4	164.2	0	0	0	110.6	W332 F335 I336 Q339 K372 K373 L374 R379 A380	W332-I376 HydrophobicContact CE3-CG2 4.07Å; W332-I376 HydrophobicContact CZ3-CG2 4.17Å; F335-I376 HydrophobicContact CD1-CD1 4.06Å; F335-I376 HydrophobicContact CD1-CG1 4.34Å; F335-I376 HydrophobicContact CD1-CG2 3.51Å; F335-I376 HydrophobicContact CE1-CD1 3.56Å; F335-I376 HydrophobicContact CE1-CG1 3.84Å; F335-I376 HydrophobicContact CE1-CG2 3.87Å; F335-I376 HydrophobicContact CZ-CD1 4.04Å; I336-I376 HydrophobicContact CG1-CB 4.45Å; I336-I376 HydrophobicContact CG1-CG2 3.8Å; Q339-I376 HydrophobicContact CG-CD1 3.88Å; K372-I376 HydrophobicContact CG-CD1 4.37Å; K372-I376 WeakPolarHBondContact O-CG1 3.44Å; K372-I376 PolarHBondContact O-N 3.39Å; K372-I376 VanDerWaalsContact O-N 3.1Å; K373-I376 PolarHBondContact O-N 3.15Å; L374-I376 VanDerWaalsContact C-N 3.29Å; L374-I376 PolarHBondContact O-N 3.25Å; I376-R379 PolarHBondContact O-N 3.4Å; I376-A380 WeakPolarHBondContact O-CB 3.35Å; I376-A380 PolarHBondContact O-N 3.15Å
377	A	84.1	Confident	83.2	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.008	29%	0.294	C	S	.	.	H	α-helix	trans	-67.6	-39.8	-179.1	0	0	0	0	0	112.6	I336 K373 L374 A380 V381 R394 I397	I336-A377 HydrophobicContact CD1-CB 3.97Å; K373-A377 WeakPolarHBondContact O-CB 3.21Å; K373-A377 PolarHBondContact O-N 3.05Å; L374-A377 CarbonylContact O-C 3.6Å; L374-A377 PolarHBondContact O-N 3.41Å; L374-A377 VanDerWaalsContact O-N 3.1Å; A377-A380 WeakPolarHBondContact O-CB 3.26Å; A377-A380 PolarHBondContact O-N 2.69Å; A377-V381 WeakPolarHBondContact O-CB 2.97Å; A377-V381 WeakPolarHBondContact O-CG2 3.2Å; A377-V381 PolarHBondContact O-N 3.07Å; A377-R394 HydrophobicContact CB-CB 4.02Å; A377-R394 HydrophobicContact CB-CG 4.2Å; A377-I397 HydrophobicContact CB-CD1 4.02Å
378	D	85.9	Confident	83.2	Confident	47 Å²	47	51.5 Å²	51.5	25%	0.251	28%	0.281	S	S	.	.	H	α-helix	trans	-61.5	-44.9	173.8	-79.5	-36.3	0	0	0	110.6	L374 A380 V381 E382 R394	L374-D378 PolarHBondContact O-N 2.96Å; D378-A380 VanDerWaalsContact C-N 3.31Å; D378-A380 PolarHBondContact O-N 3.07Å; D378-V381 PolarHBondContact O-N 2.83Å; D378-E382 WeakPolarHBondContact O-CB 3.33Å; D378-E382 VanDerWaalsContact O-CG 3.32Å; D378-E382 WeakPolarHBondContact O-CG 3.48Å; D378-E382 PolarHBondContact O-N 3.38Å; D378-R394 WeakPolarHBondContact OD1-CD 3.34Å; D378-R394 IonicContact OD1-NH1 2.65Å; D378-R394 PolarHBondContact OD1-NH1 2.79Å; D378-R394 VanDerWaalsContact OD1-NH1 3.15Å
379	R	86	Confident	83.3	Confident	110 Å²	110	51.2 Å²	51.2	42%	0.415	28%	0.279	S	S	.	.	H	α-helix	trans	-62.9	-37.7	175.6	-156.8	176.2	70.1	168.1	4.1	112.3	W332 S375 I376 T383	W332-R379 HydrophobicContact CH2-CG 4.42Å; S375-R379 WeakPolarHBondContact O-CB 3.47Å; S375-R379 PolarHBondContact O-N 3.29Å; I376-R379 PolarHBondContact O-N 3.4Å; R379-T383 WeakPolarHBondContact O-CB 3.24Å; R379-T383 PolarHBondContact O-N 3.31Å; R379-T383 PolarHBondContact O-OG1 2.89Å
380	A	85.6	Confident	83.4	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-66.1	-41.5	176.2	0	0	0	0	0	111.9	W332 I376 A377 D378 T383 N384 L390	W332-A380 HydrophobicContact CB-CB 3.99Å; W332-A380 HydrophobicContact CD2-CB 3.5Å; W332-A380 HydrophobicContact CE3-CB 3.62Å; W332-A380 HydrophobicContact CG-CB 3.68Å; W332-A380 HydrophobicContact CZ3-CB 4.32Å; I376-A380 WeakPolarHBondContact O-CB 3.35Å; I376-A380 PolarHBondContact O-N 3.15Å; A377-A380 WeakPolarHBondContact O-CB 3.26Å; A377-A380 PolarHBondContact O-N 2.69Å; D378-A380 VanDerWaalsContact C-N 3.31Å; D378-A380 PolarHBondContact O-N 3.07Å; A380-T383 PolarHBondContact O-N 3.42Å; A380-N384 PolarHBondContact O-N 2.91Å; A380-L390 HydrophobicContact CB-CD1 4.14Å; A380-L390 HydrophobicContact CB-CD2 4.1Å
381	V	85.7	Confident	83.4	Confident	11 Å²	11	50.6 Å²	50.6	7%	0.067	28%	0.275	C	S	.	.	H	α-helix	trans	-69.3	-40.9	177.9	159.2	0	0	0	0	111.9	A377 D378 T383 N384 P385 L390 Q391 R394	A377-V381 WeakPolarHBondContact O-CB 2.97Å; A377-V381 WeakPolarHBondContact O-CG2 3.2Å; A377-V381 PolarHBondContact O-N 3.07Å; D378-V381 PolarHBondContact O-N 2.83Å; V381-T383 PolarHBondContact O-N 3.25Å; V381-N384 CarbonylContact O-C 3.51Å; V381-N384 VanDerWaalsContact O-C 3.25Å; V381-N384 PolarHBondContact O-N 2.75Å; V381-P385 WeakPolarHBondContact O-CA 3.37Å; V381-P385 VanDerWaalsContact O-N 3.08Å; V381-L390 HydrophobicContact CG2-CB 4.23Å; V381-Q391 HydrophobicContact CG2-CG 4.33Å; V381-R394 HydrophobicContact CG2-CB 4.41Å
382	E	86.2	Confident	83.3	Confident	153 Å²	153	46.8 Å²	46.8	72%	0.715	26%	0.258	S	S	*	.	H	α-helix	trans	-60.5	-37.5	174.4	-75.6	173.1	-179.2	0	0	111.7	D378	D378-E382 WeakPolarHBondContact O-CB 3.33Å; D378-E382 VanDerWaalsContact O-CG 3.32Å; D378-E382 WeakPolarHBondContact O-CG 3.48Å; D378-E382 PolarHBondContact O-N 3.38Å
383	T	83.6	Confident	83.1	Confident	61 Å²	61	43.6 Å²	43.6	37%	0.374	24%	0.244	S	C	.	.	H	α-helix	trans	-77	-35.3	179.1	-50.4	0	0	0	0	112	P326 R379 A380 V381	P326-T383 HydrophobicContact CB-CG2 3.66Å; P326-T383 WeakPolarHBondContact O-CG2 3.26Å; R379-T383 WeakPolarHBondContact O-CB 3.24Å; R379-T383 PolarHBondContact O-N 3.31Å; R379-T383 PolarHBondContact O-OG1 2.89Å; A380-T383 PolarHBondContact O-N 3.42Å; V381-T383 PolarHBondContact O-N 3.25Å
384	N	82.2	Confident	83	Confident	22 Å²	22	44.7 Å²	44.7	12%	0.118	25%	0.248	C	C	.	.			trans	-130.1	67.9	-175.8	-61.2	-70.1	0	0	0	111.8	P326 A327 T329 A380 V381 T386 C387 L390	P326-N384 PolarHBondContact O-ND2 3.45Å; A327-N384 WeakPolarHBondContact CA-OD1 3.47Å; T329-N384 HydrophobicContact CG2-CB 4.32Å; A380-N384 PolarHBondContact O-N 2.91Å; V381-N384 CarbonylContact O-C 3.51Å; V381-N384 VanDerWaalsContact O-C 3.25Å; V381-N384 PolarHBondContact O-N 2.75Å; N384-T386 VanDerWaalsContact C-N 3.25Å; N384-T386 PolarHBondContact O-N 2.88Å; N384-C387 HydrophobicContact CB-CB 4.17Å; N384-C387 PolarHBondContact O-N 2.98Å; N384-C387 VanDerWaalsContact O-N 3.16Å; N384-L390 HydrophobicContact CB-CD1 3.89Å
385	P	77.1	Confident	82.9	Confident	80 Å²	80	43.8 Å²	43.8	52%	0.519	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-24.9	-169.7	23.9	-34	0	0	0	114.1	V381	V381-P385 WeakPolarHBondContact O-CA 3.37Å; V381-P385 VanDerWaalsContact O-N 3.08Å
386	T	75	Confident	82.7	Confident	117 Å²	117	45.5 Å²	45.5	72%	0.718	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-6.7	-179.7	54.6	0	0	0	0	113.8	N384 V388	N384-T386 VanDerWaalsContact C-N 3.25Å; N384-T386 PolarHBondContact O-N 2.88Å; T386-V388 PolarHBondContact O-N 3.1Å
387	C	81.1	Confident	82.5	Confident	23 Å²	23	45.2 Å²	45.2	16%	0.155	24%	0.236	C	C	.	.			trans	-82.1	105.9	-178.8	-178.3	0	0	0	0	111.7	T329 N384 A389 L390 Q391	T329-C387 HydrophobicContact CG2-CB 3.88Å; T329-C387 VanDerWaalsContact CG2-SG 3.56Å; N384-C387 HydrophobicContact CB-CB 4.17Å; N384-C387 PolarHBondContact O-N 2.98Å; N384-C387 VanDerWaalsContact O-N 3.16Å; C387-A389 VanDerWaalsContact C-N 3.3Å; C387-A389 PolarHBondContact O-N 3.34Å; C387-L390 HydrophobicContact CB-CB 4.36Å; C387-L390 HydrophobicContact CB-CD1 4.05Å; C387-L390 HydrophobicContact CB-CG 4.33Å; C387-L390 PolarHBondContact O-N 3.08Å; C387-Q391 WeakPolarHBondContact O-CG 3.45Å; C387-Q391 PolarHBondContact O-N 3.44Å
388	V	79.9	Confident	82.4	Confident	36 Å²	36	45.2 Å²	45.2	22%	0.218	24%	0.235	C	C	.	.	H	α-helix	trans	-62.4	-35.1	178.8	-178	0	0	0	0	112.2	T386 L390 Q391 L392 L424	T386-V388 PolarHBondContact O-N 3.1Å; V388-L390 PolarHBondContact O-N 2.97Å; V388-Q391 PolarHBondContact O-N 3.46Å; V388-L392 HydrophobicContact CG1-CD1 3.79Å; V388-L392 HydrophobicContact CG1-CG 4.18Å; V388-L392 WeakPolarHBondContact O-CB 3.33Å; V388-L392 WeakPolarHBondContact O-CD1 3.44Å; V388-L392 WeakPolarHBondContact O-CG 3.06Å; V388-L392 PolarHBondContact O-N 3.17Å; V388-L424 HydrophobicContact CG1-CB 4.44Å; V388-L424 HydrophobicContact CG1-CD1 4.04Å; V388-L424 HydrophobicContact CG1-CD2 4.39Å
389	A	81	Confident	82.1	Confident	46 Å²	46	46.2 Å²	46.2	38%	0.38	24%	0.239	S	C	.	.	H	α-helix	trans	-63.5	-42.9	-179	0	0	0	0	0	112.5	I333 C387 L392 E393	I333-A389 HydrophobicContact CD1-CB 4.18Å; C387-A389 VanDerWaalsContact C-N 3.3Å; C387-A389 PolarHBondContact O-N 3.34Å; A389-L392 PolarHBondContact O-N 3.25Å; A389-E393 PolarHBondContact O-N 3.14Å
390	L	82.5	Confident	81.7	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-68	-39.1	177	-70.9	173.4	0	0	0	112.1	T329 W332 I333 A380 V381 N384 C387 V388 L392 E393 R394	T329-L390 HydrophobicContact CG2-CD1 3.82Å; W332-L390 HydrophobicContact CB-CD2 3.7Å; I333-L390 HydrophobicContact CD1-CD2 4.38Å; I333-L390 HydrophobicContact CG1-CD2 3.72Å; A380-L390 HydrophobicContact CB-CD1 4.14Å; A380-L390 HydrophobicContact CB-CD2 4.1Å; V381-L390 HydrophobicContact CG2-CB 4.23Å; N384-L390 HydrophobicContact CB-CD1 3.89Å; C387-L390 HydrophobicContact CB-CB 4.36Å; C387-L390 HydrophobicContact CB-CD1 4.05Å; C387-L390 HydrophobicContact CB-CG 4.33Å; C387-L390 PolarHBondContact O-N 3.08Å; V388-L390 PolarHBondContact O-N 2.97Å; L390-L392 VanDerWaalsContact C-N 3.3Å; L390-L392 PolarHBondContact O-N 2.92Å; L390-E393 PolarHBondContact O-N 3.31Å; L390-R394 WeakPolarHBondContact O-CB 3.46Å; L390-R394 PolarHBondContact O-N 3.37Å
391	Q	81.3	Confident	81.4	Confident	19 Å²	19	46.6 Å²	46.6	9%	0.089	25%	0.249	C	C	.	.	H	α-helix	trans	-61.3	-40.1	174.5	-66.3	-71.5	-1	0	0	112	V381 C387 V388 R394 L395 L414	V381-Q391 HydrophobicContact CG2-CG 4.33Å; C387-Q391 WeakPolarHBondContact O-CG 3.45Å; C387-Q391 PolarHBondContact O-N 3.44Å; V388-Q391 PolarHBondContact O-N 3.46Å; Q391-R394 WeakPolarHBondContact O-CB 3.26Å; Q391-R394 PolarHBondContact O-N 3.4Å; Q391-R394 VanDerWaalsContact OE1-CZ 3.3Å; Q391-L395 WeakPolarHBondContact O-CG 3.4Å; Q391-L395 PolarHBondContact O-N 2.97Å; Q391-L414 HydrophobicContact CB-CD1 3.79Å; Q391-L414 HydrophobicContact CB-CD2 3.91Å; Q391-L414 HydrophobicContact CG-CD1 3.91Å
392	L	83.3	Confident	81.2	Confident	19 Å²	19	49.3 Å²	49.3	10%	0.099	26%	0.258	C	S	.	.	H	α-helix	trans	-68.3	-42.6	177.7	-72.7	168.1	0	0	0	112.5	V388 A389 L390 R394 L395 R396 W411 L414 L424 K427	V388-L392 HydrophobicContact CG1-CD1 3.79Å; V388-L392 HydrophobicContact CG1-CG 4.18Å; V388-L392 WeakPolarHBondContact O-CB 3.33Å; V388-L392 WeakPolarHBondContact O-CD1 3.44Å; V388-L392 WeakPolarHBondContact O-CG 3.06Å; V388-L392 PolarHBondContact O-N 3.17Å; A389-L392 PolarHBondContact O-N 3.25Å; L390-L392 VanDerWaalsContact C-N 3.3Å; L390-L392 PolarHBondContact O-N 2.92Å; L392-R394 VanDerWaalsContact C-N 3.31Å; L392-R394 PolarHBondContact O-N 2.86Å; L392-L395 PolarHBondContact O-N 3.48Å; L392-R396 WeakPolarHBondContact O-CB 3.47Å; L392-R396 PolarHBondContact O-N 3.46Å; L392-W411 HydrophobicContact CD2-CH2 3.53Å; L392-W411 HydrophobicContact CD2-CZ3 3.66Å; L392-L414 HydrophobicContact CD2-CD2 4.36Å; L392-L424 HydrophobicContact CD2-CD1 3.75Å; L392-L424 HydrophobicContact CG-CD1 4.33Å; L392-K427 HydrophobicContact CD1-CD 3.53Å; L392-K427 HydrophobicContact CD2-CB 4.27Å; L392-K427 HydrophobicContact CD2-CD 3.77Å; L392-K427 HydrophobicContact CG-CD 4.23Å
393	E	79.4	Confident	81	Confident	35 Å²	35	48.6 Å²	48.6	16%	0.164	26%	0.255	C	S	.	.	H	α-helix	trans	-63.3	-38.7	174.1	-71.4	-63.6	160.9	0	0	111.4	I333 A389 L390 R396 I397	I333-E393 HydrophobicContact CG1-CG 4.29Å; A389-E393 PolarHBondContact O-N 3.14Å; L390-E393 PolarHBondContact O-N 3.31Å; E393-R396 WeakPolarHBondContact O-CB 3.41Å; E393-R396 PolarHBondContact O-N 3.15Å; E393-I397 WeakPolarHBondContact O-CD1 3.41Å; E393-I397 WeakPolarHBondContact O-CG1 3.27Å; E393-I397 PolarHBondContact O-N 3.47Å; E393-I397 VanDerWaalsContact O-N 3.13Å
394	R	85.1	Confident	80.8	Confident	39 Å²	39	47.9 Å²	47.9	15%	0.147	25%	0.251	C	S	.	.	H	α-helix	trans	-59.3	-51.5	172.1	-176.6	176.3	66.4	151.7	3.9	111.7	L374 A377 D378 V381 L390 Q391 L392 R396 I397 C398	L374-R394 HydrophobicContact CD1-CG 3.98Å; A377-R394 HydrophobicContact CB-CB 4.02Å; A377-R394 HydrophobicContact CB-CG 4.2Å; D378-R394 WeakPolarHBondContact OD1-CD 3.34Å; D378-R394 IonicContact OD1-NH1 2.65Å; D378-R394 PolarHBondContact OD1-NH1 2.79Å; D378-R394 VanDerWaalsContact OD1-NH1 3.15Å; V381-R394 HydrophobicContact CG2-CB 4.41Å; L390-R394 WeakPolarHBondContact O-CB 3.46Å; L390-R394 PolarHBondContact O-N 3.37Å; Q391-R394 WeakPolarHBondContact O-CB 3.26Å; Q391-R394 PolarHBondContact O-N 3.4Å; Q391-R394 VanDerWaalsContact OE1-CZ 3.3Å; L392-R394 VanDerWaalsContact C-N 3.31Å; L392-R394 PolarHBondContact O-N 2.86Å; R394-R396 VanDerWaalsContact C-N 3.25Å; R394-R396 PolarHBondContact O-N 3.49Å; R394-I397 PolarHBondContact O-N 3.46Å; R394-I397 VanDerWaalsContact O-N 3.13Å; R394-C398 PolarHBondContact O-N 3.32Å; R394-C398 PolarHBondContact O-SG 3.2Å
395	L	84.4	Confident	80.8	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.01	27%	0.266	C	S	.	.	H	α-helix	trans	-61.9	-34	-179.8	-71.7	173.9	0	0	0	112.5	Q391 L392 C398 Q399 L407 E410 W411 L414	Q391-L395 WeakPolarHBondContact O-CG 3.4Å; Q391-L395 PolarHBondContact O-N 2.97Å; L392-L395 PolarHBondContact O-N 3.48Å; L395-C398 PolarHBondContact O-N 2.9Å; L395-Q399 PolarHBondContact O-N 3.1Å; L395-Q399 VanDerWaalsContact O-N 3.11Å; L395-L407 HydrophobicContact CD2-CD1 3.99Å; L395-E410 HydrophobicContact CD2-CB 3.84Å; L395-W411 HydrophobicContact CB-CZ2 3.91Å; L395-W411 HydrophobicContact CD1-CD2 3.68Å; L395-W411 HydrophobicContact CD1-CE3 3.89Å; L395-W411 HydrophobicContact CD1-CG 4.15Å; L395-W411 HydrophobicContact CD1-CH2 4.24Å; L395-W411 HydrophobicContact CD1-CZ2 4.04Å; L395-W411 HydrophobicContact CD1-CZ3 4.17Å; L395-L414 HydrophobicContact CD1-CD2 3.52Å
396	R	81.6	Confident	81.2	Confident	118 Å²	118	49 Å²	49	45%	0.445	26%	0.26	S	S	.	.	H	α-helix	trans	-61.8	-45.1	173.4	-175	-176.1	-176.1	140.2	10	111.8	L392 E393 R394 Q399 E1089	L392-R396 WeakPolarHBondContact O-CB 3.47Å; L392-R396 PolarHBondContact O-N 3.46Å; E393-R396 WeakPolarHBondContact O-CB 3.41Å; E393-R396 PolarHBondContact O-N 3.15Å; R394-R396 VanDerWaalsContact C-N 3.25Å; R394-R396 PolarHBondContact O-N 3.49Å; R396-Q399 WeakPolarHBondContact O-CB 3.46Å; R396-Q399 PolarHBondContact O-N 2.9Å; R396-E1089 IonicContact CZ-OE2 3.33Å; R396-E1089 IonicContact NH1-OE2 3.04Å; R396-E1089 PolarHBondContact NH1-OE2 2.82Å; R396-E1089 IonicContact NH2-OE2 3.69Å; R396-E1089 PolarHBondContact NH2-OE2 3.36Å
397	I	81	Confident	81.7	Confident	9 Å²	9	43.4 Å²	43.4	5%	0.046	23%	0.226	C	C	.	.	H	α-helix	trans	-66	-40.8	176.6	-63	156.4	0	0	0	110.7	I336 L370 K373 L374 A377 E393 R394 Q399 L401	I336-I397 HydrophobicContact CG2-CD1 3.94Å; L370-I397 HydrophobicContact CB-CG2 4.37Å; L370-I397 HydrophobicContact CD2-CG2 4.18Å; L370-I397 WeakPolarHBondContact O-CG2 3.38Å; K373-I397 HydrophobicContact CB-CD1 3.86Å; K373-I397 HydrophobicContact CB-CG1 4.32Å; K373-I397 HydrophobicContact CB-CG2 4.2Å; L374-I397 HydrophobicContact CB-CG2 3.99Å; A377-I397 HydrophobicContact CB-CD1 4.02Å; E393-I397 WeakPolarHBondContact O-CD1 3.41Å; E393-I397 WeakPolarHBondContact O-CG1 3.27Å; E393-I397 PolarHBondContact O-N 3.47Å; E393-I397 VanDerWaalsContact O-N 3.13Å; R394-I397 PolarHBondContact O-N 3.46Å; R394-I397 VanDerWaalsContact O-N 3.13Å; I397-Q399 PolarHBondContact O-N 2.95Å; I397-L401 HydrophobicContact CG2-CD1 4.26Å
398	C	82.3	Confident	81.9	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-65.7	-20.4	179.2	-66.9	0	0	0	0	113.8	L374 R394 L395 D400 L401 W402 L407	L374-C398 WeakPolarHBondContact CD1-SG 3.4Å; R394-C398 PolarHBondContact O-N 3.32Å; R394-C398 PolarHBondContact O-SG 3.2Å; L395-C398 PolarHBondContact O-N 2.9Å; C398-D400 PolarHBondContact O-N 3.39Å; C398-L401 PolarHBondContact O-N 3.49Å; C398-W402 HydrophobicContact CB-CD2 3.54Å; C398-W402 HydrophobicContact CB-CE3 3.53Å; C398-W402 HydrophobicContact CB-CG 3.99Å; C398-W402 HydrophobicContact CB-CH2 4.27Å; C398-W402 HydrophobicContact CB-CZ2 4.29Å; C398-W402 HydrophobicContact CB-CZ3 3.87Å; C398-W402 WeakPolarHBondContact O-CB 3.04Å; C398-W402 PolarHBondContact O-N 3.41Å; C398-W402 WeakPolarHBondContact SG-CH2 3.48Å; C398-W402 WeakPolarHBondContact SG-CZ2 3.19Å; C398-L407 HydrophobicContact CB-CD1 4Å
399	Q	80.6	Confident	82.2	Confident	69 Å²	69	48 Å²	48	32%	0.322	25%	0.245	S	C	.	.	H	α-helix	trans	-57.8	-35	-179	-173.7	173.6	-11.4	0	0	113.3	L395 R396 I397 L407 Y435	L395-Q399 PolarHBondContact O-N 3.1Å; L395-Q399 VanDerWaalsContact O-N 3.11Å; R396-Q399 WeakPolarHBondContact O-CB 3.46Å; R396-Q399 PolarHBondContact O-N 2.9Å; I397-Q399 PolarHBondContact O-N 2.95Å; Q399-L407 HydrophobicContact CB-CD2 4.13Å; Q399-L407 HydrophobicContact CG-CD2 4.15Å; Q399-Y435 HydrophobicContact CG-CD2 4.47Å; Q399-Y435 HydrophobicContact CG-CE2 4.17Å
400	D	76.1	Confident	82.5	Confident	94 Å²	94	48 Å²	48	50%	0.503	24%	0.237	S	C	.	.	H	α-helix	trans	-92.6	-16.2	-178.7	-65.3	-26.3	0	0	0	113	Y366 L370 C398	Y366-D400 PolarHBondContact OH-OD2 3.38Å; L370-D400 HydrophobicContact CD1-CB 3.68Å; C398-D400 PolarHBondContact O-N 3.39Å
401	L	79.6	Confident	82.9	Confident	24 Å²	24	48.7 Å²	48.7	13%	0.126	24%	0.239	C	C	.	.	H	α-helix	trans	-103.1	-35.8	-174.2	-68.9	178.5	0	0	0	114	R367 L370 E371 L374 I397 C398	R367-L401 HydrophobicContact CG-CD2 3.67Å; L370-L401 HydrophobicContact CB-CD1 3.84Å; L370-L401 HydrophobicContact CB-CD2 3.93Å; L370-L401 HydrophobicContact CB-CG 3.96Å; L370-L401 HydrophobicContact CD1-CD2 4.3Å; L370-L401 HydrophobicContact CD1-CG 4.38Å; E371-L401 HydrophobicContact CG-CD1 4.24Å; E371-L401 HydrophobicContact CG-CD2 4.17Å; L374-L401 HydrophobicContact CB-CD1 4.2Å; L374-L401 HydrophobicContact CD2-CD1 3.84Å; I397-L401 HydrophobicContact CG2-CD1 4.26Å; C398-L401 PolarHBondContact O-N 3.49Å
402	W	82.3	Confident	83.2	Confident	68 Å²	68	53.8 Å²	53.8	26%	0.258	26%	0.261	S	S	.	.	S	Bend	trans	-96.9	156.2	-171.4	-69.4	-0.4	0	0	0	112.7	C398 T406 L407 E410	C398-W402 HydrophobicContact CB-CD2 3.54Å; C398-W402 HydrophobicContact CB-CE3 3.53Å; C398-W402 HydrophobicContact CB-CG 3.99Å; C398-W402 HydrophobicContact CB-CH2 4.27Å; C398-W402 HydrophobicContact CB-CZ2 4.29Å; C398-W402 HydrophobicContact CB-CZ3 3.87Å; C398-W402 WeakPolarHBondContact O-CB 3.04Å; C398-W402 PolarHBondContact O-N 3.41Å; C398-W402 WeakPolarHBondContact SG-CH2 3.48Å; C398-W402 WeakPolarHBondContact SG-CZ2 3.19Å; W402-T406 HydrophobicContact CE3-CG2 4.31Å; W402-L407 HydrophobicContact CE3-CD1 4.26Å; W402-E410 HydrophobicContact CH2-CG 4.23Å; W402-E410 HydrophobicContact CZ3-CB 4.16Å; W402-E410 HydrophobicContact CZ3-CG 3.63Å
403	E	81.4	Confident	83.5	Confident	138 Å²	138	58.2 Å²	58.2	65%	0.645	28%	0.279	S	S	*	.			trans	-67	145.3	170.7	-69.1	-141.4	167.3	0	0	112.3	S405 T406 L407	E403-S405 PolarHBondContact O-N 2.99Å; E403-S405 VanDerWaalsContact O-N 3.07Å; E403-T406 PolarHBondContact O-N 2.86Å; E403-L407 PolarHBondContact O-N 3.33Å; E403-L407 VanDerWaalsContact O-N 3.17Å
404	P	79.9	Confident	83.9	Confident	45 Å²	45	57 Å²	57	29%	0.292	27%	0.274	S	S	.	.	H	α-helix	trans	-42.1	-46.3	178.1	-34.7	35.5	0	0	0	114.9	A408 Y435	P404-A408 VanDerWaalsContact O-CB 3.3Å; P404-A408 WeakPolarHBondContact O-CB 3.47Å; P404-A408 PolarHBondContact O-N 2.85Å; P404-Y435 HydrophobicContact CB-CE1 3.64Å; P404-Y435 HydrophobicContact CG-CE1 3.72Å
405	S	81.8	Confident	84	Confident	63 Å²	63	55.4 Å²	55.4	44%	0.441	27%	0.269	S	S	.	.	H	α-helix	trans	-71.4	-32.3	-174.6	52.3	0	0	0	0	113.3	E403 K409	E403-S405 PolarHBondContact O-N 2.99Å; E403-S405 VanDerWaalsContact O-N 3.07Å; S405-K409 VanDerWaalsContact O-CG 3.28Å; S405-K409 WeakPolarHBondContact O-CG 3.37Å; S405-K409 PolarHBondContact O-N 2.98Å
406	T	86.1	Confident	84.2	Confident	63 Å²	63	63.3 Å²	63.3	39%	0.387	30%	0.303	S	S	.	.	H	α-helix	trans	-76.4	-45.6	-179.7	-57	0	0	0	0	109.9	W402 E403 A408 K409 E410	W402-T406 HydrophobicContact CE3-CG2 4.31Å; E403-T406 PolarHBondContact O-N 2.86Å; T406-A408 VanDerWaalsContact C-N 3.34Å; T406-A408 PolarHBondContact O-N 2.88Å; T406-K409 WeakPolarHBondContact O-CB 3.36Å; T406-K409 PolarHBondContact O-N 2.9Å; T406-K409 VanDerWaalsContact O-N 3.11Å; T406-E410 PolarHBondContact O-N 3.35Å; T406-E410 VanDerWaalsContact O-N 3.1Å
407	L	85.6	Confident	84.4	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-58.5	-45.4	174.9	-176.5	63.4	0	0	0	111.7	L395 C398 Q399 W402 E403 K409 E410 W411 F431	L395-L407 HydrophobicContact CD2-CD1 3.99Å; C398-L407 HydrophobicContact CB-CD1 4Å; Q399-L407 HydrophobicContact CB-CD2 4.13Å; Q399-L407 HydrophobicContact CG-CD2 4.15Å; W402-L407 HydrophobicContact CE3-CD1 4.26Å; E403-L407 PolarHBondContact O-N 3.33Å; E403-L407 VanDerWaalsContact O-N 3.17Å; L407-K409 VanDerWaalsContact C-N 3.26Å; L407-K409 PolarHBondContact O-N 2.96Å; L407-E410 PolarHBondContact O-N 2.75Å; L407-W411 VanDerWaalsContact O-CD1 3.28Å; L407-W411 PolarHBondContact O-N 3.43Å; L407-F431 HydrophobicContact CD2-CE2 3.44Å; L407-F431 VanDerWaalsContact CD2-CE2 3.44Å; L407-F431 HydrophobicContact CD2-CZ 3.63Å; L407-F431 HydrophobicContact CG-CE2 4Å; L407-F431 HydrophobicContact CG-CZ 3.78Å
408	A	84.3	Confident	84.6	Confident	25 Å²	25	64.1 Å²	64.1	21%	0.207	31%	0.314	C	S	.	.	H	α-helix	trans	-61.6	-32	177	0	0	0	0	0	113.3	P404 T406 K412	P404-A408 VanDerWaalsContact O-CB 3.3Å; P404-A408 WeakPolarHBondContact O-CB 3.47Å; P404-A408 PolarHBondContact O-N 2.85Å; T406-A408 VanDerWaalsContact C-N 3.34Å; T406-A408 PolarHBondContact O-N 2.88Å; A408-K412 VanDerWaalsContact O-CG 3.3Å; A408-K412 WeakPolarHBondContact O-CG 3.46Å; A408-K412 PolarHBondContact O-N 3.28Å
409	K	87.6	Confident	84.9	Confident	131 Å²	131	64.6 Å²	64.6	57%	0.57	32%	0.318	S	S	*	.	H	α-helix	trans	-69.9	-44.5	174.8	-74.1	169.5	-175	177	0	111.4	S405 T406 L407 K412 K413	S405-K409 VanDerWaalsContact O-CG 3.28Å; S405-K409 WeakPolarHBondContact O-CG 3.37Å; S405-K409 PolarHBondContact O-N 2.98Å; T406-K409 WeakPolarHBondContact O-CB 3.36Å; T406-K409 PolarHBondContact O-N 2.9Å; T406-K409 VanDerWaalsContact O-N 3.11Å; L407-K409 VanDerWaalsContact C-N 3.26Å; L407-K409 PolarHBondContact O-N 2.96Å; K409-K412 PolarHBondContact O-N 3.24Å; K409-K413 WeakPolarHBondContact O-CG 3.35Å; K409-K413 PolarHBondContact O-N 3.49Å
410	E	87.2	Confident	85.2	Confident	45 Å²	45	62.4 Å²	62.4	21%	0.21	31%	0.308	C	S	.	.	H	α-helix	trans	-66.1	-39.2	178.6	-66.6	-53.9	130.9	0	0	112.3	L395 W402 T406 L407 K412 K413 L414	L395-E410 HydrophobicContact CD2-CB 3.84Å; W402-E410 HydrophobicContact CH2-CG 4.23Å; W402-E410 HydrophobicContact CZ3-CB 4.16Å; W402-E410 HydrophobicContact CZ3-CG 3.63Å; T406-E410 PolarHBondContact O-N 3.35Å; T406-E410 VanDerWaalsContact O-N 3.1Å; L407-E410 PolarHBondContact O-N 2.75Å; E410-K412 PolarHBondContact O-N 3.38Å; E410-K413 WeakPolarHBondContact O-CB 3.43Å; E410-K413 PolarHBondContact O-N 3.02Å; E410-K413 WeakPolarHBondContact OE1-CE 3.46Å; E410-K413 IonicContact OE1-NZ 2.76Å; E410-K413 PolarHBondContact OE1-NZ 3Å; E410-K413 IonicContact OE2-NZ 2.88Å; E410-L414 PolarHBondContact O-N 3.05Å
411	W	89.6	Confident	85.8	Confident	16 Å²	16	59 Å²	59	6%	0.061	29%	0.292	C	S	.	.	H	α-helix	trans	-58.1	-46.9	170.9	-87.5	106.6	0	0	0	112.6	L392 L395 L407 K413 L414 V415 L424 K427 Y428 F431	L392-W411 HydrophobicContact CD2-CH2 3.53Å; L392-W411 HydrophobicContact CD2-CZ3 3.66Å; L395-W411 HydrophobicContact CB-CZ2 3.91Å; L395-W411 HydrophobicContact CD1-CD2 3.68Å; L395-W411 HydrophobicContact CD1-CE3 3.89Å; L395-W411 HydrophobicContact CD1-CG 4.15Å; L395-W411 HydrophobicContact CD1-CH2 4.24Å; L395-W411 HydrophobicContact CD1-CZ2 4.04Å; L395-W411 HydrophobicContact CD1-CZ3 4.17Å; L407-W411 VanDerWaalsContact O-CD1 3.28Å; L407-W411 PolarHBondContact O-N 3.43Å; W411-K413 VanDerWaalsContact C-N 3.32Å; W411-K413 PolarHBondContact O-N 3.3Å; W411-L414 PolarHBondContact O-N 3.11Å; W411-V415 WeakPolarHBondContact O-CG2 3.21Å; W411-V415 PolarHBondContact O-N 3.19Å; W411-L424 HydrophobicContact CZ3-CD1 4.38Å; W411-K427 HydrophobicContact CH2-CB 4.2Å; W411-K427 HydrophobicContact CZ3-CB 4.3Å; W411-Y428 HydrophobicContact CB-CD2 3.73Å; W411-Y428 HydrophobicContact CB-CE2 3.78Å; W411-Y428 HydrophobicContact CD2-CD2 4.15Å; W411-Y428 AromaticContact CE3-CD2 3.9Å; W411-Y428 HydrophobicContact CE3-CD2 3.9Å; W411-Y428 HydrophobicContact CE3-CG 4.42Å; W411-Y428 HydrophobicContact CG-CD2 4.13Å; W411-F431 AromaticContact CD1-CD1 3.58Å; W411-F431 AromaticContact CD1-CE1 3.46Å; W411-F431 VanDerWaalsContact CD1-CE1 3.46Å; W411-F431 AromaticContact CD1-CG 4Å; W411-F431 AromaticContact CD1-CZ 3.79Å; W411-F431 HydrophobicContact CD2-CD1 4.2Å; W411-F431 HydrophobicContact CD2-CG 4.38Å; W411-F431 AromaticContact CE2-CG 3.9Å; W411-F431 AromaticContact CG-CD1 3.88Å; W411-F431 HydrophobicContact CG-CD1 3.88Å; W411-F431 HydrophobicContact CG-CE1 4.04Å; W411-F431 HydrophobicContact CG-CG 4.45Å; W411-F431 HydrophobicContact CZ2-CB 4.21Å; W411-F431 HydrophobicContact CZ2-CG 4.37Å; W411-F431 AromaticContact NE1-CD1 3.72Å; W411-F431 AromaticContact NE1-CD2 3.71Å; W411-F431 AromaticContact NE1-CE1 3.89Å; W411-F431 AromaticContact NE1-CE2 3.89Å; W411-F431 AromaticContact NE1-CG 3.63Å; W411-F431 AromaticContact NE1-CZ 3.98Å
412	K	88.6	Confident	86.2	Confident	127 Å²	127	58 Å²	58	55%	0.552	29%	0.286	S	S	*	.	H	α-helix	trans	-61.6	-39.5	177	-75.5	175.1	-178.4	179.4	0	112	A408 K409 E410 F416	A408-K412 VanDerWaalsContact O-CG 3.3Å; A408-K412 WeakPolarHBondContact O-CG 3.46Å; A408-K412 PolarHBondContact O-N 3.28Å; K409-K412 PolarHBondContact O-N 3.24Å; E410-K412 PolarHBondContact O-N 3.38Å; K412-F416 VanDerWaalsContact O-CB 3.26Å; K412-F416 WeakPolarHBondContact O-CB 3.37Å; K412-F416 PolarHBondContact O-N 2.98Å
413	K	89.3	Confident	86.4	Confident	111 Å²	111	58.2 Å²	58.2	48%	0.483	30%	0.297	S	S	.	.	H	α-helix	trans	-62.2	-46.4	174.5	-71.6	173.6	-176.3	176.3	0	111.3	K409 E410 W411 V415 F416 L417	K409-K413 WeakPolarHBondContact O-CG 3.35Å; K409-K413 PolarHBondContact O-N 3.49Å; E410-K413 WeakPolarHBondContact O-CB 3.43Å; E410-K413 PolarHBondContact O-N 3.02Å; E410-K413 WeakPolarHBondContact OE1-CE 3.46Å; E410-K413 IonicContact OE1-NZ 2.76Å; E410-K413 PolarHBondContact OE1-NZ 3Å; E410-K413 IonicContact OE2-NZ 2.88Å; W411-K413 VanDerWaalsContact C-N 3.32Å; W411-K413 PolarHBondContact O-N 3.3Å; K413-V415 PolarHBondContact O-N 3.42Å; K413-F416 WeakPolarHBondContact O-CB 3.39Å; K413-F416 PolarHBondContact O-N 2.98Å; K413-L417 WeakPolarHBondContact O-CG 3.32Å; K413-L417 PolarHBondContact O-N 3.04Å
414	L	87.6	Confident	86.7	Confident	9 Å²	9	51.8 Å²	51.8	5%	0.047	27%	0.267	C	S	.	.	H	α-helix	trans	-63.1	-44.7	-178.3	-175.5	63.4	0	0	0	112	Q391 L392 L395 E410 W411 F416 L417 H418 L424	Q391-L414 HydrophobicContact CB-CD1 3.79Å; Q391-L414 HydrophobicContact CB-CD2 3.91Å; Q391-L414 HydrophobicContact CG-CD1 3.91Å; L392-L414 HydrophobicContact CD2-CD2 4.36Å; L395-L414 HydrophobicContact CD1-CD2 3.52Å; E410-L414 PolarHBondContact O-N 3.05Å; W411-L414 PolarHBondContact O-N 3.11Å; L414-F416 VanDerWaalsContact C-N 3.32Å; L414-F416 PolarHBondContact O-N 3.1Å; L414-L417 PolarHBondContact O-N 3.44Å; L414-H418 PolarHBondContact O-N 3.31Å; L414-L424 HydrophobicContact CD2-CD1 3.74Å; L414-L424 HydrophobicContact CG-CD1 4.08Å; L414-L424 HydrophobicContact CG-CD2 4.13Å
415	V	88.3	Confident	87.3	Confident	6 Å²	6	50.4 Å²	50.4	4%	0.036	26%	0.256	C	S	.	.	H	α-helix	trans	-65.4	-36.8	176.8	173	0	0	0	0	111.6	W411 K413 L417 H418 P419 L424 W425 Y428	W411-V415 WeakPolarHBondContact O-CG2 3.21Å; W411-V415 PolarHBondContact O-N 3.19Å; K413-V415 PolarHBondContact O-N 3.42Å; V415-L417 VanDerWaalsContact C-N 3.32Å; V415-L417 PolarHBondContact O-N 3.21Å; V415-H418 CarbonylContact O-C 3.59Å; V415-H418 PolarHBondContact O-N 3.24Å; V415-P419 WeakPolarHBondContact O-CA 3.41Å; V415-L424 HydrophobicContact CG2-CG 4.3Å; V415-W425 HydrophobicContact CG1-CD2 3.62Å; V415-W425 HydrophobicContact CG1-CE3 3.63Å; V415-W425 HydrophobicContact CG1-CH2 3.22Å; V415-W425 HydrophobicContact CG1-CZ2 3.18Å; V415-W425 HydrophobicContact CG1-CZ3 3.45Å; V415-W425 VanDerWaalsContact CG1-CZ3 3.45Å; V415-Y428 HydrophobicContact CG2-CD1 4.05Å; V415-Y428 HydrophobicContact CG2-CD2 4.24Å; V415-Y428 HydrophobicContact CG2-CG 3.72Å
416	F	87.8	Confident	87.7	Confident	169 Å²	169	50.2 Å²	50.2	74%	0.741	25%	0.246	S	C	*	.	H	α-helix	trans	-65.3	-33	174.4	179.2	-96.4	0	0	0	113.1	K412 K413 L414	K412-F416 VanDerWaalsContact O-CB 3.26Å; K412-F416 WeakPolarHBondContact O-CB 3.37Å; K412-F416 PolarHBondContact O-N 2.98Å; K413-F416 WeakPolarHBondContact O-CB 3.39Å; K413-F416 PolarHBondContact O-N 2.98Å; L414-F416 VanDerWaalsContact C-N 3.32Å; L414-F416 PolarHBondContact O-N 3.1Å
417	L	86.3	Confident	87.8	Confident	102 Å²	102	51.8 Å²	51.8	53%	0.534	25%	0.247	S	C	.	.	H	α-helix	trans	-74.8	-27.1	176.6	-70.2	170.4	0	0	0	113.2	K413 L414 V415 P419 H466	K413-L417 WeakPolarHBondContact O-CG 3.32Å; K413-L417 PolarHBondContact O-N 3.04Å; L414-L417 PolarHBondContact O-N 3.44Å; V415-L417 VanDerWaalsContact C-N 3.32Å; V415-L417 PolarHBondContact O-N 3.21Å; L417-P419 VanDerWaalsContact C-CD 3.45Å; L417-H466 PolarHBondContact O-NE2 3.19Å
418	H	84.8	Confident	88	Confident	41 Å²	41	53 Å²	53	19%	0.19	25%	0.252	C	S	.	.			trans	-130.8	61.3	-178.1	-60.6	-66.5	0	0	0	112.1	L414 V415 N420 S421 L424	L414-H418 PolarHBondContact O-N 3.31Å; V415-H418 CarbonylContact O-C 3.59Å; V415-H418 PolarHBondContact O-N 3.24Å; H418-N420 PolarHBondContact O-N 3.41Å; H418-S421 PolarHBondContact O-N 3.19Å; H418-L424 HydrophobicContact CB-CD2 3.67Å
419	P	88	Confident	88.4	Confident	10 Å²	10	51.8 Å²	51.8	7%	0.065	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-22.2	-174	26.8	-34.6	0	0	0	113.5	V415 L417 W425 T454 L455 M463 H466	V415-P419 WeakPolarHBondContact O-CA 3.41Å; L417-P419 VanDerWaalsContact C-CD 3.45Å; P419-W425 PolarHBondContact O-NE1 2.89Å; P419-T454 HydrophobicContact CB-CG2 3.65Å; P419-L455 WeakPolarHBondContact O-CD2 3.16Å; P419-M463 HydrophobicContact CB-SD 4.4Å; P419-M463 HydrophobicContact CG-SD 4.42Å; P419-H466 HydrophobicContact CG-CB 4.26Å
420	N	88.1	Confident	88.5	Confident	24 Å²	24	46.9 Å²	46.9	13%	0.128	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-6.4	179.8	64.5	-22.2	0	0	0	114.2	H418 A422 V458 H466 P467 L469	H418-N420 PolarHBondContact O-N 3.41Å; N420-A422 PolarHBondContact O-N 3.31Å; N420-V458 HydrophobicContact CB-CG1 3.85Å; N420-V458 HydrophobicContact CB-CG2 4.39Å; N420-H466 HydrophobicContact CB-CB 4.08Å; N420-P467 PolarHBondContact ND2-O 3.05Å; N420-P467 VanDerWaalsContact ND2-O 3.13Å; N420-L469 WeakPolarHBondContact O-CD1 3.45Å
421	S	87.6	Confident	88.6	Confident	22 Å²	22	45.4 Å²	45.4	15%	0.154	22%	0.215	C	C	.	.			trans	-91.7	97.3	-178.3	-174.6	0	0	0	0	111.8	H418 L424 W425	H418-S421 PolarHBondContact O-N 3.19Å; S421-L424 WeakPolarHBondContact O-CB 3.24Å; S421-L424 PolarHBondContact O-N 3.24Å; S421-W425 VanDerWaalsContact O-CD1 3.26Å; S421-W425 PolarHBondContact O-N 3.21Å
422	A	87.4	Confident	88.6	Confident	2 Å²	2	45.5 Å²	45.5	2%	0.017	22%	0.217	C	C	.	.	H	α-helix	trans	-61.2	-38.5	175.4	0	0	0	0	0	114.4	N420 L424 W425 R426 L455 D475 I479	N420-A422 PolarHBondContact O-N 3.31Å; A422-L424 VanDerWaalsContact C-N 3.27Å; A422-L424 PolarHBondContact O-N 2.8Å; A422-W425 WeakPolarHBondContact O-CB 3.46Å; A422-W425 PolarHBondContact O-N 2.95Å; A422-W425 VanDerWaalsContact O-N 3.17Å; A422-R426 WeakPolarHBondContact O-CG 3.49Å; A422-R426 PolarHBondContact O-N 3.34Å; A422-L455 HydrophobicContact CB-CD1 4.32Å; A422-D475 HydrophobicContact CB-CB 3.47Å; A422-D475 VanDerWaalsContact CB-CB 3.47Å; A422-D475 VanDerWaalsContact CB-CG 3.49Å; A422-D475 WeakPolarHBondContact CB-OD2 3.39Å; A422-I479 HydrophobicContact CB-CD1 4.36Å
423	P	86.6	Confident	88.7	Confident	74 Å²	74	39.5 Å²	39.5	48%	0.481	19%	0.191	S	C	.	.	H	α-helix	trans	-60.1	-35	174.7	-26.1	35.6	0	0	0	113.5	R426 K427	P423-R426 PolarHBondContact O-N 3.35Å; P423-K427 PolarHBondContact O-N 2.97Å
424	L	88.9	Confident	88.7	Confident	2 Å²	2	34.5 Å²	34.5	1%	0.01	17%	0.17	C	C	.	.	H	α-helix	trans	-67.2	-44.6	174.7	175.5	61.8	0	0	0	111.2	V388 L392 W411 L414 V415 H418 S421 A422 R426 K427 Y428	V388-L424 HydrophobicContact CG1-CB 4.44Å; V388-L424 HydrophobicContact CG1-CD1 4.04Å; V388-L424 HydrophobicContact CG1-CD2 4.39Å; L392-L424 HydrophobicContact CD2-CD1 3.75Å; L392-L424 HydrophobicContact CG-CD1 4.33Å; W411-L424 HydrophobicContact CZ3-CD1 4.38Å; L414-L424 HydrophobicContact CD2-CD1 3.74Å; L414-L424 HydrophobicContact CG-CD1 4.08Å; L414-L424 HydrophobicContact CG-CD2 4.13Å; V415-L424 HydrophobicContact CG2-CG 4.3Å; H418-L424 HydrophobicContact CB-CD2 3.67Å; S421-L424 WeakPolarHBondContact O-CB 3.24Å; S421-L424 PolarHBondContact O-N 3.24Å; A422-L424 VanDerWaalsContact C-N 3.27Å; A422-L424 PolarHBondContact O-N 2.8Å; L424-R426 VanDerWaalsContact C-N 3.33Å; L424-R426 PolarHBondContact O-N 2.65Å; L424-K427 PolarHBondContact O-N 3.43Å; L424-Y428 PolarHBondContact O-N 3.01Å
425	W	91.9	Very high	88.6	Confident	16 Å²	16	35.8 Å²	35.8	6%	0.061	17%	0.174	C	C	.	.	H	α-helix	trans	-57.8	-44	173.8	-81.4	109.9	0	0	0	112.3	V415 P419 S421 A422 K427 Y428 L429 C451 T454	V415-W425 HydrophobicContact CG1-CD2 3.62Å; V415-W425 HydrophobicContact CG1-CE3 3.63Å; V415-W425 HydrophobicContact CG1-CH2 3.22Å; V415-W425 HydrophobicContact CG1-CZ2 3.18Å; V415-W425 HydrophobicContact CG1-CZ3 3.45Å; V415-W425 VanDerWaalsContact CG1-CZ3 3.45Å; P419-W425 PolarHBondContact O-NE1 2.89Å; S421-W425 VanDerWaalsContact O-CD1 3.26Å; S421-W425 PolarHBondContact O-N 3.21Å; A422-W425 WeakPolarHBondContact O-CB 3.46Å; A422-W425 PolarHBondContact O-N 2.95Å; A422-W425 VanDerWaalsContact O-N 3.17Å; W425-K427 VanDerWaalsContact C-N 3.31Å; W425-K427 PolarHBondContact O-N 3.1Å; W425-Y428 AromaticContact CE3-CD1 3.91Å; W425-Y428 HydrophobicContact CE3-CD1 3.91Å; W425-Y428 AromaticContact CZ3-CD1 3.96Å; W425-Y428 HydrophobicContact CZ3-CD1 3.96Å; W425-Y428 HydrophobicContact CZ3-CE1 4.16Å; W425-Y428 PolarHBondContact O-N 3.47Å; W425-L429 WeakPolarHBondContact O-CB 3.3Å; W425-L429 VanDerWaalsContact O-CG 3.22Å; W425-L429 WeakPolarHBondContact O-CG 3.44Å; W425-L429 PolarHBondContact O-N 3.29Å; W425-C451 WeakPolarHBondContact CB-SG 3.03Å; W425-C451 HydrophobicContact CD2-CB 3.83Å; W425-C451 HydrophobicContact CE3-CB 3.41Å; W425-C451 VanDerWaalsContact CE3-CB 3.41Å; W425-C451 HydrophobicContact CG-CB 4.42Å; W425-C451 HydrophobicContact CH2-CB 4.31Å; W425-C451 HydrophobicContact CZ3-CB 3.67Å; W425-T454 HydrophobicContact CZ2-CG2 4Å
426	R	89.7	Confident	88.5	Confident	60 Å²	60	38.2 Å²	38.2	23%	0.226	19%	0.185	C	C	.	.	H	α-helix	trans	-57.6	-42.5	176.4	-68.9	-180	-169.7	-154	2.4	112	A422 P423 L424 L429 L430 D475 D478 I479	A422-R426 WeakPolarHBondContact O-CG 3.49Å; A422-R426 PolarHBondContact O-N 3.34Å; P423-R426 PolarHBondContact O-N 3.35Å; L424-R426 VanDerWaalsContact C-N 3.33Å; L424-R426 PolarHBondContact O-N 2.65Å; R426-L429 PolarHBondContact O-N 3.09Å; R426-L430 WeakPolarHBondContact O-CB 3.32Å; R426-L430 PolarHBondContact O-N 2.93Å; R426-D475 IonicContact CZ-OD1 2.82Å; R426-D475 IonicContact NE-OD1 3.98Å; R426-D475 IonicContact NH2-OD1 2.84Å; R426-D475 PolarHBondContact NH2-OD1 3.25Å; R426-D478 IonicContact CZ-OD2 3.9Å; R426-D478 IonicContact NH1-OD2 2.93Å; R426-D478 IonicContact NH2-OD2 2.81Å; R426-D478 PolarHBondContact NH2-OD2 2.85Å; R426-I479 HydrophobicContact CG-CD1 4.23Å; R426-I479 HydrophobicContact CG-CG1 3.99Å
427	K	88.1	Confident	88.5	Confident	96 Å²	96	33.6 Å²	33.6	42%	0.417	17%	0.173	S	C	.	.	H	α-helix	trans	-67.3	-40.4	175.9	-71.1	-176.5	177.5	-170.7	0	112.6	L392 W411 P423 L424 W425 L430 F431	L392-K427 HydrophobicContact CD1-CD 3.53Å; L392-K427 HydrophobicContact CD2-CB 4.27Å; L392-K427 HydrophobicContact CD2-CD 3.77Å; L392-K427 HydrophobicContact CG-CD 4.23Å; W411-K427 HydrophobicContact CH2-CB 4.2Å; W411-K427 HydrophobicContact CZ3-CB 4.3Å; P423-K427 PolarHBondContact O-N 2.97Å; L424-K427 PolarHBondContact O-N 3.43Å; W425-K427 VanDerWaalsContact C-N 3.31Å; W425-K427 PolarHBondContact O-N 3.1Å; K427-L430 PolarHBondContact O-N 2.68Å; K427-F431 PolarHBondContact O-N 3.12Å
428	Y	91.3	Very high	88.5	Confident	24 Å²	24	30.6 Å²	30.6	9%	0.094	16%	0.161	C	C	.	.	H	α-helix	trans	-63.1	-45.3	174.8	173.3	-117.5	0	0	0	112	W411 V415 L424 W425 L430 F431 T432 A447	W411-Y428 HydrophobicContact CB-CD2 3.73Å; W411-Y428 HydrophobicContact CB-CE2 3.78Å; W411-Y428 HydrophobicContact CD2-CD2 4.15Å; W411-Y428 AromaticContact CE3-CD2 3.9Å; W411-Y428 HydrophobicContact CE3-CD2 3.9Å; W411-Y428 HydrophobicContact CE3-CG 4.42Å; W411-Y428 HydrophobicContact CG-CD2 4.13Å; V415-Y428 HydrophobicContact CG2-CD1 4.05Å; V415-Y428 HydrophobicContact CG2-CD2 4.24Å; V415-Y428 HydrophobicContact CG2-CG 3.72Å; L424-Y428 PolarHBondContact O-N 3.01Å; W425-Y428 AromaticContact CE3-CD1 3.91Å; W425-Y428 HydrophobicContact CE3-CD1 3.91Å; W425-Y428 AromaticContact CZ3-CD1 3.96Å; W425-Y428 HydrophobicContact CZ3-CD1 3.96Å; W425-Y428 HydrophobicContact CZ3-CE1 4.16Å; W425-Y428 PolarHBondContact O-N 3.47Å; Y428-L430 PolarHBondContact O-N 2.79Å; Y428-F431 HydrophobicContact CD2-CD1 4.43Å; Y428-F431 WeakPolarHBondContact O-CB 3.47Å; Y428-F431 PolarHBondContact O-N 3.14Å; Y428-T432 HydrophobicContact CD2-CG2 4.16Å; Y428-T432 HydrophobicContact CE1-CG2 4.16Å; Y428-T432 HydrophobicContact CE2-CG2 3.63Å; Y428-T432 WeakPolarHBondContact O-CG2 3.37Å; Y428-T432 PolarHBondContact O-N 3.48Å; Y428-T432 PolarHBondContact O-OG1 3.22Å; Y428-A447 HydrophobicContact CE1-CB 4.39Å
429	L	92.1	Very high	88.9	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-61.1	-45.4	177.3	-70	164.4	0	0	0	110.8	W425 R426 F431 T432 Q433 A447 Y448 C451 I479	W425-L429 WeakPolarHBondContact O-CB 3.3Å; W425-L429 VanDerWaalsContact O-CG 3.22Å; W425-L429 WeakPolarHBondContact O-CG 3.44Å; W425-L429 PolarHBondContact O-N 3.29Å; R426-L429 PolarHBondContact O-N 3.09Å; L429-F431 VanDerWaalsContact C-N 3.33Å; L429-F431 PolarHBondContact O-N 2.94Å; L429-T432 WeakPolarHBondContact CA-OG1 3.42Å; L429-T432 PolarHBondContact O-N 3.37Å; L429-T432 PolarHBondContact O-OG1 2.91Å; L429-Q433 WeakPolarHBondContact O-CB 3.35Å; L429-Q433 WeakPolarHBondContact O-CG 3.25Å; L429-Q433 PolarHBondContact O-N 3.48Å; L429-A447 HydrophobicContact CD2-CB 4.05Å; L429-Y448 HydrophobicContact CB-CE1 4.36Å; L429-Y448 HydrophobicContact CD1-CD1 3.77Å; L429-Y448 HydrophobicContact CD1-CE1 3.62Å; L429-Y448 HydrophobicContact CD2-CD1 3.86Å; L429-Y448 HydrophobicContact CD2-CD2 4.07Å; L429-Y448 HydrophobicContact CD2-CE1 4.05Å; L429-Y448 HydrophobicContact CD2-CE2 4.23Å; L429-Y448 HydrophobicContact CD2-CG 3.86Å; L429-Y448 HydrophobicContact CG-CD1 4.38Å; L429-Y448 HydrophobicContact CG-CE1 4.22Å; L429-C451 HydrophobicContact CD1-CB 4.32Å; L429-I479 HydrophobicContact CD1-CG2 3.87Å
430	L	89.4	Confident	89.3	Confident	28 Å²	28	28.6 Å²	28.6	15%	0.147	15%	0.151	C	C	.	.	H	α-helix	trans	-58.5	-42.9	174.1	-180	58.9	0	0	0	112.3	R426 K427 Y428 Q433 S434 M669 H1093	R426-L430 WeakPolarHBondContact O-CB 3.32Å; R426-L430 PolarHBondContact O-N 2.93Å; K427-L430 PolarHBondContact O-N 2.68Å; Y428-L430 PolarHBondContact O-N 2.79Å; L430-Q433 PolarHBondContact O-N 3.28Å; L430-S434 VanDerWaalsContact O-CB 3.3Å; L430-S434 WeakPolarHBondContact O-CB 3.26Å; L430-S434 PolarHBondContact O-N 3.43Å; L430-S434 PolarHBondContact O-OG 3.44Å; L430-M669 HydrophobicContact CD1-CE 3.67Å; L430-M669 HydrophobicContact CD1-CG 4.46Å; L430-M669 HydrophobicContact CD1-SD 3.63Å; L430-H1093 HydrophobicContact CD1-CB 4.28Å
431	F	89.6	Confident	89.6	Confident	14 Å²	14	27.8 Å²	27.8	6%	0.061	15%	0.147	C	C	.	.	H	α-helix	trans	-60.4	-48.3	174.4	166.2	-102.5	0	0	0	111.6	L407 W411 K427 Y428 L429 Q433 S434 Y435	L407-F431 HydrophobicContact CD2-CE2 3.44Å; L407-F431 VanDerWaalsContact CD2-CE2 3.44Å; L407-F431 HydrophobicContact CD2-CZ 3.63Å; L407-F431 HydrophobicContact CG-CE2 4Å; L407-F431 HydrophobicContact CG-CZ 3.78Å; W411-F431 AromaticContact CD1-CD1 3.58Å; W411-F431 AromaticContact CD1-CE1 3.46Å; W411-F431 VanDerWaalsContact CD1-CE1 3.46Å; W411-F431 AromaticContact CD1-CG 4Å; W411-F431 AromaticContact CD1-CZ 3.79Å; W411-F431 HydrophobicContact CD2-CD1 4.2Å; W411-F431 HydrophobicContact CD2-CG 4.38Å; W411-F431 AromaticContact CE2-CG 3.9Å; W411-F431 AromaticContact CG-CD1 3.88Å; W411-F431 HydrophobicContact CG-CD1 3.88Å; W411-F431 HydrophobicContact CG-CE1 4.04Å; W411-F431 HydrophobicContact CG-CG 4.45Å; W411-F431 HydrophobicContact CZ2-CB 4.21Å; W411-F431 HydrophobicContact CZ2-CG 4.37Å; W411-F431 AromaticContact NE1-CD1 3.72Å; W411-F431 AromaticContact NE1-CD2 3.71Å; W411-F431 AromaticContact NE1-CE1 3.89Å; W411-F431 AromaticContact NE1-CE2 3.89Å; W411-F431 AromaticContact NE1-CG 3.63Å; W411-F431 AromaticContact NE1-CZ 3.98Å; K427-F431 PolarHBondContact O-N 3.12Å; Y428-F431 HydrophobicContact CD2-CD1 4.43Å; Y428-F431 WeakPolarHBondContact O-CB 3.47Å; Y428-F431 PolarHBondContact O-N 3.14Å; L429-F431 VanDerWaalsContact C-N 3.33Å; L429-F431 PolarHBondContact O-N 2.94Å; F431-Q433 VanDerWaalsContact C-N 3.25Å; F431-Q433 PolarHBondContact O-N 3.39Å; F431-S434 PolarHBondContact O-N 3.39Å; F431-Y435 HydrophobicContact CE2-CD2 4.16Å; F431-Y435 HydrophobicContact CE2-CG 4.03Å; F431-Y435 HydrophobicContact CZ-CD1 4.49Å; F431-Y435 HydrophobicContact CZ-CG 4.39Å; F431-Y435 WeakPolarHBondContact O-CB 3.37Å; F431-Y435 PolarHBondContact O-N 3.39Å; F431-Y435 VanDerWaalsContact O-N 3.15Å
432	T	90	Very high	90	Very high	19 Å²	19	30.1 Å²	30.1	12%	0.117	16%	0.16	C	C	.	.	H	α-helix	trans	-63.6	-31.5	179	57.7	0	0	0	0	113.1	Y428 L429 V444	Y428-T432 HydrophobicContact CD2-CG2 4.16Å; Y428-T432 HydrophobicContact CE1-CG2 4.16Å; Y428-T432 HydrophobicContact CE2-CG2 3.63Å; Y428-T432 WeakPolarHBondContact O-CG2 3.37Å; Y428-T432 PolarHBondContact O-N 3.48Å; Y428-T432 PolarHBondContact O-OG1 3.22Å; L429-T432 WeakPolarHBondContact CA-OG1 3.42Å; L429-T432 PolarHBondContact O-N 3.37Å; L429-T432 PolarHBondContact O-OG1 2.91Å; T432-V444 WeakPolarHBondContact O-CG2 3.36Å
433	Q	91	Very high	90.3	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-72.4	-43	174.6	-80.2	176.7	-28	0	0	112.4	L429 L430 F431 F439 V444 Y448 F486 P1126 W1127	L429-Q433 WeakPolarHBondContact O-CB 3.35Å; L429-Q433 WeakPolarHBondContact O-CG 3.25Å; L429-Q433 PolarHBondContact O-N 3.48Å; L430-Q433 PolarHBondContact O-N 3.28Å; F431-Q433 VanDerWaalsContact C-N 3.25Å; F431-Q433 PolarHBondContact O-N 3.39Å; Q433-F439 VanDerWaalsContact O-CD2 3.27Å; Q433-F439 WeakPolarHBondContact O-CD2 3.31Å; Q433-V444 HydrophobicContact CG-CG1 3.5Å; Q433-V444 HydrophobicContact CG-CG2 4.37Å; Q433-Y448 VanDerWaalsContact NE2-CE2 3.28Å; Q433-Y448 PolarHBondContact NE2-OH 3.13Å; Q433-Y448 PolarHBondContact OE1-OH 3.36Å; Q433-F486 HydrophobicContact CG-CD2 4.09Å; Q433-F486 HydrophobicContact CG-CE2 4.09Å; Q433-P1126 WeakPolarHBondContact O-CD 3.31Å; Q433-P1126 WeakPolarHBondContact O-CG 3.3Å; Q433-W1127 HydrophobicContact CB-CD2 4.44Å; Q433-W1127 HydrophobicContact CB-CE3 3.83Å; Q433-W1127 HydrophobicContact CB-CZ3 3.85Å; Q433-W1127 VanDerWaalsContact O-CE3 3.25Å
434	S	87.9	Confident	90.7	Very high	5 Å²	5	32.8 Å²	32.8	4%	0.035	16%	0.164	C	C	.	.	H	α-helix	trans	-84.2	-23.9	-167.3	-52.1	0	0	0	0	113.8	L430 F431 F436 H1093 Q1123 N1124	L430-S434 VanDerWaalsContact O-CB 3.3Å; L430-S434 WeakPolarHBondContact O-CB 3.26Å; L430-S434 PolarHBondContact O-N 3.43Å; L430-S434 PolarHBondContact O-OG 3.44Å; F431-S434 PolarHBondContact O-N 3.39Å; S434-F436 PolarHBondContact O-N 2.98Å; S434-F436 VanDerWaalsContact O-N 3.1Å; S434-H1093 VanDerWaalsContact CB-CE1 3.47Å; S434-H1093 WeakPolarHBondContact CB-CE1 3.48Å; S434-H1093 PolarHBondContact OG-CE1 2.95Å; S434-H1093 PolarHBondContact OG-ND1 3.48Å; S434-H1093 VanDerWaalsContact OG-ND1 3.07Å; S434-Q1123 CarbonylContact O-C 3.25Å; S434-N1124 WeakPolarHBondContact CB-O 3.39Å; S434-N1124 PolarHBondContact OG-O 3.16Å
435	Y	85.9	Confident	91	Very high	36 Å²	36	33.5 Å²	33.5	14%	0.141	17%	0.168	C	C	.	.			trans	-84.9	91.6	-170.7	-158.1	-109.5	0	0	0	112.7	Q399 P404 F431 S437 S438 F439	Q399-Y435 HydrophobicContact CG-CD2 4.47Å; Q399-Y435 HydrophobicContact CG-CE2 4.17Å; P404-Y435 HydrophobicContact CB-CE1 3.64Å; P404-Y435 HydrophobicContact CG-CE1 3.72Å; F431-Y435 HydrophobicContact CE2-CD2 4.16Å; F431-Y435 HydrophobicContact CE2-CG 4.03Å; F431-Y435 HydrophobicContact CZ-CD1 4.49Å; F431-Y435 HydrophobicContact CZ-CG 4.39Å; F431-Y435 WeakPolarHBondContact O-CB 3.37Å; F431-Y435 PolarHBondContact O-N 3.39Å; F431-Y435 VanDerWaalsContact O-N 3.15Å; Y435-S437 VanDerWaalsContact C-N 3.27Å; Y435-S437 VanDerWaalsContact CD1-OG 3.31Å; Y435-S437 WeakPolarHBondContact CD1-OG 3.47Å; Y435-S437 WeakPolarHBondContact CE1-OG 3.5Å; Y435-S437 PolarHBondContact O-N 3.26Å; Y435-S438 PolarHBondContact O-N 3.45Å; Y435-S438 VanDerWaalsContact O-N 3.13Å; Y435-S438 PolarHBondContact O-OG 3.44Å; Y435-F439 WeakPolarHBondContact O-CB 3.47Å; Y435-F439 PolarHBondContact O-N 2.96Å
436	F	87.3	Confident	91.1	Very high	58 Å²	58	35.6 Å²	35.6	25%	0.254	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.4	-38.2	-172.1	179.3	-89.8	0	0	0	115.8	S434 S438 L1122 P1126 L1149 K1153	S434-F436 PolarHBondContact O-N 2.98Å; S434-F436 VanDerWaalsContact O-N 3.1Å; F436-S438 PolarHBondContact O-N 3.04Å; F436-L1122 HydrophobicContact CD2-CB 4.06Å; F436-L1122 WeakPolarHBondContact CD2-O 3.23Å; F436-L1122 HydrophobicContact CE2-CB 4.17Å; F436-L1122 HydrophobicContact CE2-CD1 4.45Å; F436-P1126 HydrophobicContact CD2-CB 3.88Å; F436-L1149 HydrophobicContact CE2-CD1 4Å; F436-L1149 HydrophobicContact CE2-CD2 4.43Å; F436-L1149 HydrophobicContact CZ-CD1 3.64Å; F436-K1153 PolarHBondContact O-NZ 3Å
437	S	86.9	Confident	91.4	Very high	72 Å²	72	33.1 Å²	33.1	50%	0.503	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-28.6	-174.8	59.2	0	0	0	0	113.7	Y435	Y435-S437 VanDerWaalsContact C-N 3.27Å; Y435-S437 VanDerWaalsContact CD1-OG 3.31Å; Y435-S437 WeakPolarHBondContact CD1-OG 3.47Å; Y435-S437 WeakPolarHBondContact CE1-OG 3.5Å; Y435-S437 PolarHBondContact O-N 3.26Å
438	S	86.3	Confident	91.8	Very high	38 Å²	38	28.5 Å²	28.5	27%	0.266	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.1	-12.3	178.5	68.6	0	0	0	0	113.4	Y435 F436	Y435-S438 PolarHBondContact O-N 3.45Å; Y435-S438 VanDerWaalsContact O-N 3.13Å; Y435-S438 PolarHBondContact O-OG 3.44Å; F436-S438 PolarHBondContact O-N 3.04Å
439	F	93.5	Very high	91.9	Very high	5 Å²	5	27.5 Å²	27.5	2%	0.022	15%	0.154	C	C	.	.			trans	-60.9	131.7	-178.2	176.2	-101	0	0	0	112.7	Q433 Y435 V441 V444 F486 P1126 W1127 K1153	Q433-F439 VanDerWaalsContact O-CD2 3.27Å; Q433-F439 WeakPolarHBondContact O-CD2 3.31Å; Y435-F439 WeakPolarHBondContact O-CB 3.47Å; Y435-F439 PolarHBondContact O-N 2.96Å; F439-V441 HydrophobicContact CZ-CG2 4.14Å; F439-V444 HydrophobicContact CD2-CG2 3.75Å; F439-V444 HydrophobicContact CE2-CG2 3.77Å; F439-F486 AromaticContact CE2-CE2 3.88Å; F439-F486 HydrophobicContact CE2-CE2 3.88Å; F439-F486 HydrophobicContact CE2-CZ 4.07Å; F439-F486 HydrophobicContact CZ-CE2 4.19Å; F439-F486 HydrophobicContact CZ-CZ 4.32Å; F439-P1126 HydrophobicContact CB-CG 4.09Å; F439-P1126 HydrophobicContact CD1-CB 3.71Å; F439-P1126 HydrophobicContact CD1-CG 3.85Å; F439-P1126 HydrophobicContact CD2-CG 4.04Å; F439-P1126 HydrophobicContact CE1-CB 4.1Å; F439-P1126 HydrophobicContact CE1-CG 4.32Å; F439-P1126 HydrophobicContact CG-CB 4.09Å; F439-P1126 HydrophobicContact CG-CG 3.69Å; F439-W1127 HydrophobicContact CE1-CB 4.3Å; F439-W1127 HydrophobicContact CE2-CB 3.74Å; F439-W1127 HydrophobicContact CZ-CB 3.41Å; F439-W1127 VanDerWaalsContact CZ-CB 3.41Å; F439-K1153 HydrophobicContact CD1-CB 4.14Å; F439-K1153 HydrophobicContact CD1-CD 4.19Å; F439-K1153 HydrophobicContact CD1-CG 4.29Å; F439-K1153 HydrophobicContact CE1-CB 4.02Å
440	S	95.3	Very high	92.1	Very high	5 Å²	5	33.8 Å²	33.8	4%	0.035	18%	0.181	C	C	.	.			trans	-152	152	158.3	80.2	0	0	0	0	108.2	T442 K443 V444 E1154	S440-T442 VanDerWaalsContact C-N 3.34Å; S440-T442 PolarHBondContact O-N 3.43Å; S440-T442 PolarHBondContact OG-OG1 3.27Å; S440-K443 PolarHBondContact O-N 2.71Å; S440-K443 WeakPolarHBondContact OG-CB 3.44Å; S440-K443 WeakPolarHBondContact OG-CD 3.41Å; S440-K443 VanDerWaalsContact OG-CG 3.25Å; S440-K443 WeakPolarHBondContact OG-CG 3.48Å; S440-K443 PolarHBondContact OG-N 3.04Å; S440-V444 WeakPolarHBondContact O-CG2 3.46Å; S440-V444 PolarHBondContact O-N 3.12Å; S440-E1154 VanDerWaalsContact CB-OE2 3.25Å; S440-E1154 WeakPolarHBondContact CB-OE2 3.43Å; S440-E1154 PolarHBondContact OG-OE2 3.43Å
441	V	95.8	Very high	92.4	Very high	6 Å²	6	32.5 Å²	32.5	4%	0.036	17%	0.174	C	C	.	.	H	α-helix	trans	-60.3	-44	-175.8	174.8	0	0	0	0	111.6	F439 K443 V444 N445 F486 L487 K1153 E1154 L1155	F439-V441 HydrophobicContact CZ-CG2 4.14Å; V441-K443 PolarHBondContact O-N 2.94Å; V441-V444 PolarHBondContact O-N 3.48Å; V441-N445 WeakPolarHBondContact O-CB 3.38Å; V441-N445 PolarHBondContact O-N 2.92Å; V441-F486 HydrophobicContact CG1-CE1 4.1Å; V441-F486 HydrophobicContact CG1-CZ 4.25Å; V441-F486 HydrophobicContact CG2-CZ 4.42Å; V441-L487 HydrophobicContact CG1-CD2 4.4Å; V441-K1153 PolarHBondContact N-O 3.24Å; V441-E1154 HydrophobicContact CB-CB 4.07Å; V441-E1154 HydrophobicContact CG2-CB 4.38Å; V441-E1154 VanDerWaalsContact CG2-O 3.26Å; V441-E1154 WeakPolarHBondContact CG2-O 3.44Å; V441-E1154 PolarHBondContact N-OE2 3.21Å; V441-L1155 HydrophobicContact CG2-CD2 4Å
442	T	94.3	Very high	92.6	Very high	71 Å²	71	31.8 Å²	31.8	44%	0.436	17%	0.171	S	C	.	.	H	α-helix	trans	-60.6	-43.5	179.9	55.4	0	0	0	0	112.7	S440 N445 S446 E1154	S440-T442 VanDerWaalsContact C-N 3.34Å; S440-T442 PolarHBondContact O-N 3.43Å; S440-T442 PolarHBondContact OG-OG1 3.27Å; T442-N445 PolarHBondContact O-N 2.86Å; T442-S446 VanDerWaalsContact O-CB 3.31Å; T442-S446 WeakPolarHBondContact O-CB 3.46Å; T442-S446 PolarHBondContact O-N 3.21Å; T442-S446 PolarHBondContact O-OG 3.07Å; T442-E1154 VanDerWaalsContact CB-OE2 3.27Å; T442-E1154 WeakPolarHBondContact CB-OE2 3.34Å; T442-E1154 WeakPolarHBondContact CG2-OE2 3.43Å; T442-E1154 PolarHBondContact N-OE2 2.82Å; T442-E1154 VanDerWaalsContact OG1-CD 3.3Å; T442-E1154 PolarHBondContact OG1-OE1 2.92Å; T442-E1154 PolarHBondContact OG1-OE2 3.31Å
443	K	94	Very high	92.9	Very high	131 Å²	131	33.5 Å²	33.5	57%	0.57	18%	0.184	S	C	*	.	H	α-helix	trans	-64.3	-43.7	179.1	-74.2	172.1	-168.7	159.5	0	111.7	S440 V441 A447	S440-K443 PolarHBondContact O-N 2.71Å; S440-K443 WeakPolarHBondContact OG-CB 3.44Å; S440-K443 WeakPolarHBondContact OG-CD 3.41Å; S440-K443 VanDerWaalsContact OG-CG 3.25Å; S440-K443 WeakPolarHBondContact OG-CG 3.48Å; S440-K443 PolarHBondContact OG-N 3.04Å; V441-K443 PolarHBondContact O-N 2.94Å; K443-A447 PolarHBondContact O-N 3.3Å
444	V	95.1	Very high	93	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.006	19%	0.192	C	C	.	.	H	α-helix	trans	-68.8	-45.6	178.8	173.7	0	0	0	0	110.6	T432 Q433 F439 S440 V441 S446 A447 Y448 F486	T432-V444 WeakPolarHBondContact O-CG2 3.36Å; Q433-V444 HydrophobicContact CG-CG1 3.5Å; Q433-V444 HydrophobicContact CG-CG2 4.37Å; F439-V444 HydrophobicContact CD2-CG2 3.75Å; F439-V444 HydrophobicContact CE2-CG2 3.77Å; S440-V444 WeakPolarHBondContact O-CG2 3.46Å; S440-V444 PolarHBondContact O-N 3.12Å; V441-V444 PolarHBondContact O-N 3.48Å; V444-S446 VanDerWaalsContact C-N 3.27Å; V444-S446 PolarHBondContact O-N 3.16Å; V444-A447 WeakPolarHBondContact O-CA 3.41Å; V444-A447 WeakPolarHBondContact O-CB 3.17Å; V444-A447 PolarHBondContact O-N 3.33Å; V444-Y448 HydrophobicContact CG1-CD2 3.9Å; V444-Y448 HydrophobicContact CG1-CE2 3.69Å; V444-Y448 WeakPolarHBondContact O-CD2 3.32Å; V444-Y448 PolarHBondContact O-N 2.9Å; V444-F486 HydrophobicContact CB-CE1 3.91Å; V444-F486 HydrophobicContact CB-CE2 4.25Å; V444-F486 HydrophobicContact CB-CZ 3.56Å; V444-F486 HydrophobicContact CG1-CD1 4.09Å; V444-F486 HydrophobicContact CG1-CD2 4.26Å; V444-F486 HydrophobicContact CG1-CE1 3.59Å; V444-F486 HydrophobicContact CG1-CE2 3.74Å; V444-F486 HydrophobicContact CG1-CG 4.41Å; V444-F486 HydrophobicContact CG1-CZ 3.4Å; V444-F486 HydrophobicContact CG2-CZ 4.29Å
445	N	95.3	Very high	93.2	Very high	18 Å²	18	34.5 Å²	34.5	10%	0.096	19%	0.19	C	C	.	.	H	α-helix	trans	-59.2	-41.3	176.6	-166.3	47.5	0	0	0	111.4	V441 T442 A447 Y448 G449 Q483 L487	V441-N445 WeakPolarHBondContact O-CB 3.38Å; V441-N445 PolarHBondContact O-N 2.92Å; T442-N445 PolarHBondContact O-N 2.86Å; N445-A447 VanDerWaalsContact C-N 3.3Å; N445-A447 PolarHBondContact O-N 2.79Å; N445-Y448 WeakPolarHBondContact O-CB 3.49Å; N445-Y448 PolarHBondContact O-N 3.34Å; N445-G449 PolarHBondContact O-N 3.15Å; N445-Q483 PolarHBondContact OD1-NE2 2.81Å; N445-L487 HydrophobicContact CB-CD2 4.49Å
446	S	94.8	Very high	93.5	Very high	60 Å²	60	33 Å²	33	42%	0.42	18%	0.184	S	C	.	.	H	α-helix	trans	-63	-33.6	173.2	-62.4	0	0	0	0	113.1	T442 V444 K450	T442-S446 VanDerWaalsContact O-CB 3.31Å; T442-S446 WeakPolarHBondContact O-CB 3.46Å; T442-S446 PolarHBondContact O-N 3.21Å; T442-S446 PolarHBondContact O-OG 3.07Å; V444-S446 VanDerWaalsContact C-N 3.27Å; V444-S446 PolarHBondContact O-N 3.16Å; S446-K450 WeakPolarHBondContact O-CB 3.38Å; S446-K450 WeakPolarHBondContact O-CD 3.27Å; S446-K450 VanDerWaalsContact O-CG 3.24Å; S446-K450 WeakPolarHBondContact O-CG 3.09Å; S446-K450 PolarHBondContact O-N 3.28Å
447	A	94.9	Very high	93.7	Very high	7 Å²	7	31.3 Å²	31.3	6%	0.058	18%	0.182	C	C	.	.	H	α-helix	trans	-69.8	-38.3	176	0	0	0	0	0	111.7	Y428 L429 K443 V444 N445 K450 C451	Y428-A447 HydrophobicContact CE1-CB 4.39Å; L429-A447 HydrophobicContact CD2-CB 4.05Å; K443-A447 PolarHBondContact O-N 3.3Å; V444-A447 WeakPolarHBondContact O-CA 3.41Å; V444-A447 WeakPolarHBondContact O-CB 3.17Å; V444-A447 PolarHBondContact O-N 3.33Å; N445-A447 VanDerWaalsContact C-N 3.3Å; N445-A447 PolarHBondContact O-N 2.79Å; A447-K450 PolarHBondContact O-N 2.7Å; A447-C451 WeakPolarHBondContact O-CB 3.43Å; A447-C451 PolarHBondContact O-N 2.73Å
448	Y	96.3	Very high	93.9	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-60.6	-50.4	170.7	-83.9	-75.5	0	0	0	111.9	L429 Q433 V444 N445 K450 C451 L452 I479 Q482 Q483 F486	L429-Y448 HydrophobicContact CB-CE1 4.36Å; L429-Y448 HydrophobicContact CD1-CD1 3.77Å; L429-Y448 HydrophobicContact CD1-CE1 3.62Å; L429-Y448 HydrophobicContact CD2-CD1 3.86Å; L429-Y448 HydrophobicContact CD2-CD2 4.07Å; L429-Y448 HydrophobicContact CD2-CE1 4.05Å; L429-Y448 HydrophobicContact CD2-CE2 4.23Å; L429-Y448 HydrophobicContact CD2-CG 3.86Å; L429-Y448 HydrophobicContact CG-CD1 4.38Å; L429-Y448 HydrophobicContact CG-CE1 4.22Å; Q433-Y448 VanDerWaalsContact NE2-CE2 3.28Å; Q433-Y448 PolarHBondContact NE2-OH 3.13Å; Q433-Y448 PolarHBondContact OE1-OH 3.36Å; V444-Y448 HydrophobicContact CG1-CD2 3.9Å; V444-Y448 HydrophobicContact CG1-CE2 3.69Å; V444-Y448 WeakPolarHBondContact O-CD2 3.32Å; V444-Y448 PolarHBondContact O-N 2.9Å; N445-Y448 WeakPolarHBondContact O-CB 3.49Å; N445-Y448 PolarHBondContact O-N 3.34Å; Y448-K450 VanDerWaalsContact C-N 3.34Å; Y448-K450 PolarHBondContact O-N 3.48Å; Y448-C451 VanDerWaalsContact O-CB 3.31Å; Y448-C451 WeakPolarHBondContact O-CB 3.36Å; Y448-C451 PolarHBondContact O-N 3.07Å; Y448-C451 VanDerWaalsContact O-N 3.08Å; Y448-L452 PolarHBondContact O-N 2.82Å; Y448-I479 HydrophobicContact CD1-CG2 3.75Å; Y448-I479 HydrophobicContact CE1-CG2 4.01Å; Y448-Q482 HydrophobicContact CE1-CB 4.25Å; Y448-Q482 HydrophobicContact CE1-CG 4.4Å; Y448-Q482 VanDerWaalsContact OH-CD 3.27Å; Y448-Q482 WeakPolarHBondContact OH-CG 3.48Å; Y448-Q482 PolarHBondContact OH-NE2 3.25Å; Y448-Q483 HydrophobicContact CD1-CB 3.66Å; Y448-Q483 HydrophobicContact CD1-CG 4.18Å; Y448-Q483 HydrophobicContact CD2-CB 4.24Å; Y448-Q483 HydrophobicContact CD2-CG 4.07Å; Y448-Q483 HydrophobicContact CE1-CB 4.07Å; Y448-Q483 HydrophobicContact CG-CB 3.77Å; Y448-Q483 HydrophobicContact CG-CG 3.75Å; Y448-F486 HydrophobicContact CE2-CB 4.36Å; Y448-F486 HydrophobicContact CE2-CD1 4.25Å; Y448-F486 HydrophobicContact CE2-CG 4.26Å
449	G	95.4	Very high	94.1	Very high	2 Å²	2	28.4 Å²	28.4	2%	0.021	15%	0.154	C	C	.	.	H	α-helix	trans	-56.1	-47	176.8	0	0	0	0	0	112.2	N445 C451 L452 S453	N445-G449 PolarHBondContact O-N 3.15Å; G449-C451 VanDerWaalsContact C-N 3.31Å; G449-C451 PolarHBondContact O-N 2.66Å; G449-L452 PolarHBondContact O-N 2.93Å; G449-S453 WeakPolarHBondContact O-CB 3.46Å; G449-S453 PolarHBondContact O-N 3.18Å; G449-S453 PolarHBondContact O-OG 2.84Å
450	K	94.7	Very high	93.8	Very high	133 Å²	133	30.8 Å²	30.8	58%	0.578	17%	0.167	S	C	*	.	H	α-helix	trans	-60.7	-38.4	175.8	-73.8	168.5	-173	171.3	0	113	S446 A447 Y448 S453 T454	S446-K450 WeakPolarHBondContact O-CB 3.38Å; S446-K450 WeakPolarHBondContact O-CD 3.27Å; S446-K450 VanDerWaalsContact O-CG 3.24Å; S446-K450 WeakPolarHBondContact O-CG 3.09Å; S446-K450 PolarHBondContact O-N 3.28Å; A447-K450 PolarHBondContact O-N 2.7Å; Y448-K450 VanDerWaalsContact C-N 3.34Å; Y448-K450 PolarHBondContact O-N 3.48Å; K450-S453 PolarHBondContact O-OG 2.9Å; K450-S453 VanDerWaalsContact O-OG 3.1Å; K450-T454 VanDerWaalsContact O-CB 3.25Å; K450-T454 WeakPolarHBondContact O-CB 3.48Å; K450-T454 PolarHBondContact O-N 3.43Å; K450-T454 VanDerWaalsContact O-N 3.09Å; K450-T454 PolarHBondContact O-OG1 3.19Å
451	C	95.4	Very high	93.3	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-62.6	-54.5	176.4	175.2	0	0	0	0	110.8	W425 L429 A447 Y448 G449 S453 T454 L455	W425-C451 WeakPolarHBondContact CB-SG 3.03Å; W425-C451 HydrophobicContact CD2-CB 3.83Å; W425-C451 HydrophobicContact CE3-CB 3.41Å; W425-C451 VanDerWaalsContact CE3-CB 3.41Å; W425-C451 HydrophobicContact CG-CB 4.42Å; W425-C451 HydrophobicContact CH2-CB 4.31Å; W425-C451 HydrophobicContact CZ3-CB 3.67Å; L429-C451 HydrophobicContact CD1-CB 4.32Å; A447-C451 WeakPolarHBondContact O-CB 3.43Å; A447-C451 PolarHBondContact O-N 2.73Å; Y448-C451 VanDerWaalsContact O-CB 3.31Å; Y448-C451 WeakPolarHBondContact O-CB 3.36Å; Y448-C451 PolarHBondContact O-N 3.07Å; Y448-C451 VanDerWaalsContact O-N 3.08Å; G449-C451 VanDerWaalsContact C-N 3.31Å; G449-C451 PolarHBondContact O-N 2.66Å; C451-S453 PolarHBondContact O-N 3.02Å; C451-T454 PolarHBondContact O-N 3.18Å; C451-L455 WeakPolarHBondContact O-CG 3.37Å; C451-L455 PolarHBondContact O-N 3.07Å
452	L	95.6	Very high	92.8	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.5	-40.7	-177.2	-67.7	171.5	0	0	0	112	Y448 G449 T454 L455 S456 M476 I479 F480 I633	Y448-L452 PolarHBondContact O-N 2.82Å; G449-L452 PolarHBondContact O-N 2.93Å; L452-T454 VanDerWaalsContact C-N 3.33Å; L452-T454 PolarHBondContact O-N 3.2Å; L452-L455 PolarHBondContact O-N 3.39Å; L452-S456 VanDerWaalsContact O-CB 3.28Å; L452-S456 WeakPolarHBondContact O-CB 3.09Å; L452-S456 PolarHBondContact O-N 3.22Å; L452-S456 PolarHBondContact O-OG 3.23Å; L452-M476 HydrophobicContact CD2-CB 4.3Å; L452-M476 WeakPolarHBondContact CD2-O 3.4Å; L452-I479 HydrophobicContact CD2-CB 4.04Å; L452-I479 HydrophobicContact CD2-CG2 3.75Å; L452-I479 HydrophobicContact CG-CG2 4.09Å; L452-F480 HydrophobicContact CD1-CB 4.31Å; L452-F480 HydrophobicContact CD1-CD2 4.35Å; L452-F480 HydrophobicContact CD2-CB 4.46Å; L452-I633 HydrophobicContact CB-CG2 4.04Å; L452-I633 HydrophobicContact CD2-CG2 3.94Å; L452-I633 HydrophobicContact CG-CG2 4.43Å
453	S	94.7	Very high	92.2	Very high	55 Å²	55	35.9 Å²	35.9	39%	0.385	21%	0.207	S	C	.	.	H	α-helix	trans	-63.7	-38.7	175	72.8	0	0	0	0	112.2	G449 K450 C451 A457	G449-S453 WeakPolarHBondContact O-CB 3.46Å; G449-S453 PolarHBondContact O-N 3.18Å; G449-S453 PolarHBondContact O-OG 2.84Å; K450-S453 PolarHBondContact O-OG 2.9Å; K450-S453 VanDerWaalsContact O-OG 3.1Å; C451-S453 PolarHBondContact O-N 3.02Å; S453-A457 WeakPolarHBondContact O-CB 3.4Å; S453-A457 PolarHBondContact O-N 2.75Å
454	T	93.4	Very high	91.3	Very high	27 Å²	27	36.3 Å²	36.3	17%	0.166	22%	0.22	C	C	.	.	H	α-helix	trans	-69.8	-46.8	178.9	-59	0	0	0	0	111.1	P419 W425 K450 C451 L452 S456 A457 V458 M463	P419-T454 HydrophobicContact CB-CG2 3.65Å; W425-T454 HydrophobicContact CZ2-CG2 4Å; K450-T454 VanDerWaalsContact O-CB 3.25Å; K450-T454 WeakPolarHBondContact O-CB 3.48Å; K450-T454 PolarHBondContact O-N 3.43Å; K450-T454 VanDerWaalsContact O-N 3.09Å; K450-T454 PolarHBondContact O-OG1 3.19Å; C451-T454 PolarHBondContact O-N 3.18Å; L452-T454 VanDerWaalsContact C-N 3.33Å; L452-T454 PolarHBondContact O-N 3.2Å; T454-S456 VanDerWaalsContact C-N 3.3Å; T454-S456 PolarHBondContact O-N 3.1Å; T454-A457 PolarHBondContact O-N 2.96Å; T454-V458 WeakPolarHBondContact O-CG2 3.29Å; T454-V458 PolarHBondContact O-N 3.18Å; T454-M463 HydrophobicContact CG2-CE 3.93Å; T454-M463 HydrophobicContact CG2-SD 4.17Å
455	L	92.4	Very high	90.5	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.2	-35.8	176.9	-68.8	174.2	0	0	0	111.9	P419 A422 C451 L452 V458 R459 I472 M476 I479	P419-L455 WeakPolarHBondContact O-CD2 3.16Å; A422-L455 HydrophobicContact CB-CD1 4.32Å; C451-L455 WeakPolarHBondContact O-CG 3.37Å; C451-L455 PolarHBondContact O-N 3.07Å; L452-L455 PolarHBondContact O-N 3.39Å; L455-V458 PolarHBondContact O-N 2.97Å; L455-R459 PolarHBondContact O-N 3.04Å; L455-I472 HydrophobicContact CB-CD1 4.49Å; L455-I472 HydrophobicContact CD2-CD1 4.11Å; L455-I472 HydrophobicContact CD2-CG1 4.37Å; L455-M476 HydrophobicContact CB-CG 3.72Å; L455-M476 HydrophobicContact CB-SD 3.72Å; L455-M476 HydrophobicContact CD1-CG 3.98Å; L455-I479 HydrophobicContact CD1-CD1 3.82Å
456	S	92.7	Very high	89.8	Confident	3 Å²	3	42.2 Å²	42.2	2%	0.021	26%	0.257	C	S	.	.	H	α-helix	trans	-63.4	-43.7	172.7	-62.4	0	0	0	0	111.7	L452 T454 V458 R459 D460	L452-S456 VanDerWaalsContact O-CB 3.28Å; L452-S456 WeakPolarHBondContact O-CB 3.09Å; L452-S456 PolarHBondContact O-N 3.22Å; L452-S456 PolarHBondContact O-OG 3.23Å; T454-S456 VanDerWaalsContact C-N 3.3Å; T454-S456 PolarHBondContact O-N 3.1Å; S456-V458 VanDerWaalsContact C-N 3.32Å; S456-V458 PolarHBondContact O-N 3.36Å; S456-R459 PolarHBondContact O-N 3.3Å; S456-D460 WeakPolarHBondContact O-CB 3.33Å; S456-D460 PolarHBondContact O-N 2.78Å
457	A	91.5	Very high	89.2	Confident	24 Å²	24	44 Å²	44	20%	0.198	27%	0.268	C	S	.	.	H	α-helix	trans	-64.7	-34.5	175.9	0	0	0	0	0	113.2	S453 T454 G461 S462 M463	S453-A457 WeakPolarHBondContact O-CB 3.4Å; S453-A457 PolarHBondContact O-N 2.75Å; T454-A457 PolarHBondContact O-N 2.96Å; A457-G461 PolarHBondContact O-N 2.92Å; A457-S462 WeakPolarHBondContact O-CB 3.48Å; A457-S462 PolarHBondContact O-N 3.31Å; A457-M463 HydrophobicContact CB-CE 4.42Å; A457-M463 HydrophobicContact CB-CG 4.25Å; A457-M463 PolarHBondContact O-N 3.49Å
458	V	90.5	Very high	88.7	Confident	2 Å²	2	46 Å²	46	1%	0.012	28%	0.284	C	S	.	.	H	α-helix	trans	-65	-46.5	172	168.7	0	0	0	0	110.6	N420 T454 L455 S456 G461 M463 A468 I472	N420-V458 HydrophobicContact CB-CG1 3.85Å; N420-V458 HydrophobicContact CB-CG2 4.39Å; T454-V458 WeakPolarHBondContact O-CG2 3.29Å; T454-V458 PolarHBondContact O-N 3.18Å; L455-V458 PolarHBondContact O-N 2.97Å; S456-V458 VanDerWaalsContact C-N 3.32Å; S456-V458 PolarHBondContact O-N 3.36Å; V458-G461 PolarHBondContact O-N 2.73Å; V458-G461 VanDerWaalsContact O-N 3.16Å; V458-M463 HydrophobicContact CG2-CB 4.17Å; V458-M463 HydrophobicContact CG2-CG 4.32Å; V458-M463 HydrophobicContact CG2-SD 3.66Å; V458-A468 HydrophobicContact CG1-CB 4.09Å; V458-I472 HydrophobicContact CB-CD1 4.31Å; V458-I472 HydrophobicContact CG1-CD1 3.85Å
459	R	89.9	Confident	88.2	Confident	46 Å²	46	49.9 Å²	49.9	17%	0.174	31%	0.305	C	S	.	.	H	α-helix	trans	-64.2	-41.4	178.5	177.1	174.2	164.2	-128.7	16.4	112.9	L455 S456 G461 I472 E473 C634 T636	L455-R459 PolarHBondContact O-N 3.04Å; S456-R459 PolarHBondContact O-N 3.3Å; R459-G461 PolarHBondContact O-N 2.96Å; R459-G461 VanDerWaalsContact O-N 3.11Å; R459-I472 HydrophobicContact CB-CG2 4.33Å; R459-I472 HydrophobicContact CG-CG2 4.38Å; R459-E473 IonicContact CZ-OE1 2.66Å; R459-E473 IonicContact CZ-OE2 2.85Å; R459-E473 VanDerWaalsContact NE-CD 3.32Å; R459-E473 VanDerWaalsContact NE-CG 3.34Å; R459-E473 IonicContact NE-OE1 3.68Å; R459-E473 PolarHBondContact NE-OE1 3.23Å; R459-E473 IonicContact NH2-OE1 3.91Å; R459-E473 PolarHBondContact NH2-OE1 2.79Å; R459-E473 IonicContact NH2-OE2 2.94Å; R459-E473 PolarHBondContact NH2-OE2 3.27Å; R459-E473 VanDerWaalsContact NH2-OE2 3.14Å; R459-C634 VanDerWaalsContact CZ-O 3.24Å; R459-C634 PolarHBondContact NH1-O 3.25Å; R459-C634 PolarHBondContact NH2-O 3.39Å; R459-T636 VanDerWaalsContact NH2-CG2 3.31Å; R459-T636 PolarHBondContact NH2-OG1 3.4Å
460	D	87.7	Confident	87.6	Confident	56 Å²	56	55.9 Å²	55.9	30%	0.299	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-5.8	177.8	-67.9	-15.7	0	0	0	112.7	S456 S462 T519	S456-D460 WeakPolarHBondContact O-CB 3.33Å; S456-D460 PolarHBondContact O-N 2.78Å; D460-S462 PolarHBondContact O-N 2.78Å; D460-T519 PolarHBondContact OD1-OG1 2.96Å; D460-T519 WeakPolarHBondContact OD2-CA 3.3Å; D460-T519 WeakPolarHBondContact OD2-CB 3.16Å; D460-T519 PolarHBondContact OD2-N 3.23Å; D460-T519 PolarHBondContact OD2-OG1 2.96Å
461	G	85	Confident	87	Confident	49 Å²	49	51.3 Å²	51.3	51%	0.505	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	71	12.4	-175.7	0	0	0	0	0	113.6	A457 V458 R459 M463	A457-G461 PolarHBondContact O-N 2.92Å; V458-G461 PolarHBondContact O-N 2.73Å; V458-G461 VanDerWaalsContact O-N 3.16Å; R459-G461 PolarHBondContact O-N 2.96Å; R459-G461 VanDerWaalsContact O-N 3.11Å; G461-M463 VanDerWaalsContact C-N 3.27Å; G461-M463 PolarHBondContact O-N 3.27Å
462	S	84.6	Confident	86.7	Confident	76 Å²	76	51.9 Å²	51.9	53%	0.531	34%	0.337	S	S	.	.			trans	-69.1	-29	176.6	-64	0	0	0	0	111.5	A457 D460 V464	A457-S462 WeakPolarHBondContact O-CB 3.48Å; A457-S462 PolarHBondContact O-N 3.31Å; D460-S462 PolarHBondContact O-N 2.78Å; S462-V464 PolarHBondContact O-N 2.85Å
463	M	82.5	Confident	86.4	Confident	64 Å²	64	53.6 Å²	53.6	32%	0.315	35%	0.345	S	S	.	.			trans	-91.2	87.9	172.5	-69.2	-165.7	168.3	0	0	111.6	P419 T454 A457 V458 G461 S465 H466	P419-M463 HydrophobicContact CB-SD 4.4Å; P419-M463 HydrophobicContact CG-SD 4.42Å; T454-M463 HydrophobicContact CG2-CE 3.93Å; T454-M463 HydrophobicContact CG2-SD 4.17Å; A457-M463 HydrophobicContact CB-CE 4.42Å; A457-M463 HydrophobicContact CB-CG 4.25Å; A457-M463 PolarHBondContact O-N 3.49Å; V458-M463 HydrophobicContact CG2-CB 4.17Å; V458-M463 HydrophobicContact CG2-CG 4.32Å; V458-M463 HydrophobicContact CG2-SD 3.66Å; G461-M463 VanDerWaalsContact C-N 3.27Å; G461-M463 PolarHBondContact O-N 3.27Å; M463-S465 PolarHBondContact O-N 3.01Å; M463-H466 PolarHBondContact O-N 3.06Å
464	V	74.8	Confident	86.2	Confident	139 Å²	139	55.6 Å²	55.6	84%	0.842	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-25.5	-177.6	-174.4	0	0	0	0	113.3	S462	S462-V464 PolarHBondContact O-N 2.85Å
465	S	77.4	Confident	86	Confident	93 Å²	93	56.1 Å²	56.1	65%	0.65	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-22.1	-177.6	49.1	0	0	0	0	114.5	M463	M463-S465 PolarHBondContact O-N 3.01Å
466	H	81.1	Confident	86	Confident	50 Å²	50	56.1 Å²	56.1	23%	0.231	35%	0.35	C	S	.	.	S	Bend	trans	-138.1	103.2	-173.4	-60.1	84.1	0	0	0	110	L417 P419 N420 M463	L417-H466 PolarHBondContact O-NE2 3.19Å; P419-H466 HydrophobicContact CG-CB 4.26Å; N420-H466 HydrophobicContact CB-CB 4.08Å; M463-H466 PolarHBondContact O-N 3.06Å
467	P	82.7	Confident	86	Confident	98 Å²	98	56 Å²	56	64%	0.636	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-68.2	152.9	179.6	28.5	-34.1	0	0	0	111.5	N420	N420-P467 PolarHBondContact ND2-O 3.05Å; N420-P467 VanDerWaalsContact ND2-O 3.13Å
468	A	84.2	Confident	85.9	Confident	49 Å²	49	55.5 Å²	55.5	41%	0.405	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-64	134.4	175.3	0	0	0	0	0	111.3	V458 I472	V458-A468 HydrophobicContact CG1-CB 4.09Å; A468-I472 HydrophobicContact CB-CD1 4.32Å; A468-I472 HydrophobicContact CB-CG2 4.43Å
469	L	84.9	Confident	86	Confident	82 Å²	82	55.4 Å²	55.4	43%	0.429	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-83.9	153.6	174.5	-61.6	177.8	0	0	0	110.5	N420 I472	N420-L469 WeakPolarHBondContact O-CD1 3.45Å; L469-I472 WeakPolarHBondContact O-CB 3.15Å; L469-I472 PolarHBondContact O-N 3Å
470	P	83.5	Confident	86.2	Confident	127 Å²	127	53.2 Å²	53.2	83%	0.825	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	139.8	172.9	-22.7	33.2	0	0	0	111.4	I472	P470-I472 VanDerWaalsContact C-N 3.35Å
471	G	83.4	Confident	86.5	Confident	37 Å²	37	50.9 Å²	50.9	38%	0.381	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.1	5.4	178.3	0	0	0	0	0	115.7	E473 E474 D475	G471-E473 PolarHBondContact O-N 3.24Å; G471-E473 VanDerWaalsContact O-N 3.13Å; G471-E474 WeakPolarHBondContact O-CB 3.49Å; G471-E474 PolarHBondContact O-N 3.39Å; G471-D475 PolarHBondContact O-N 2.95Å
472	I	88.1	Confident	86.8	Confident	13 Å²	13	49 Å²	49	7%	0.067	30%	0.3	C	S	.	.	H	α-helix	trans	-55.5	-33.6	-178.3	-163.2	166	0	0	0	113.8	L455 V458 R459 A468 L469 P470 D475 M476	L455-I472 HydrophobicContact CB-CD1 4.49Å; L455-I472 HydrophobicContact CD2-CD1 4.11Å; L455-I472 HydrophobicContact CD2-CG1 4.37Å; V458-I472 HydrophobicContact CB-CD1 4.31Å; V458-I472 HydrophobicContact CG1-CD1 3.85Å; R459-I472 HydrophobicContact CB-CG2 4.33Å; R459-I472 HydrophobicContact CG-CG2 4.38Å; A468-I472 HydrophobicContact CB-CD1 4.32Å; A468-I472 HydrophobicContact CB-CG2 4.43Å; L469-I472 WeakPolarHBondContact O-CB 3.15Å; L469-I472 PolarHBondContact O-N 3Å; P470-I472 VanDerWaalsContact C-N 3.35Å; I472-D475 PolarHBondContact O-N 3.2Å; I472-M476 WeakPolarHBondContact O-CB 3.31Å; I472-M476 VanDerWaalsContact O-CG 3.24Å; I472-M476 WeakPolarHBondContact O-CG 3.08Å; I472-M476 PolarHBondContact O-N 3.03Å
473	E	89.6	Confident	87.3	Confident	36 Å²	36	45.3 Å²	45.3	17%	0.168	27%	0.274	C	S	.	.	H	α-helix	trans	-67.1	-40.5	176.1	-69.2	-172.3	-152.2	0	0	112.8	R459 G471 D475 M476 L477 T636 L640	R459-E473 IonicContact CZ-OE1 2.66Å; R459-E473 IonicContact CZ-OE2 2.85Å; R459-E473 VanDerWaalsContact NE-CD 3.32Å; R459-E473 VanDerWaalsContact NE-CG 3.34Å; R459-E473 IonicContact NE-OE1 3.68Å; R459-E473 PolarHBondContact NE-OE1 3.23Å; R459-E473 IonicContact NH2-OE1 3.91Å; R459-E473 PolarHBondContact NH2-OE1 2.79Å; R459-E473 IonicContact NH2-OE2 2.94Å; R459-E473 PolarHBondContact NH2-OE2 3.27Å; R459-E473 VanDerWaalsContact NH2-OE2 3.14Å; G471-E473 PolarHBondContact O-N 3.24Å; G471-E473 VanDerWaalsContact O-N 3.13Å; E473-D475 VanDerWaalsContact C-N 3.34Å; E473-M476 HydrophobicContact CB-CE 4.47Å; E473-M476 HydrophobicContact CG-CE 4.14Å; E473-M476 PolarHBondContact O-N 3.22Å; E473-L477 WeakPolarHBondContact O-CB 3.13Å; E473-L477 PolarHBondContact O-N 3.39Å; E473-T636 PolarHBondContact OE1-OG1 3.17Å; E473-T636 PolarHBondContact OE2-N 2.68Å; E473-T636 PolarHBondContact OE2-OG1 2.65Å; E473-L640 HydrophobicContact CB-CD1 3.59Å
474	E	89.4	Confident	87.9	Confident	96 Å²	96	42.3 Å²	42.3	45%	0.449	26%	0.259	S	S	.	.	H	α-helix	trans	-66.3	-42.8	176.9	-41.9	-166.7	162.8	0	0	110	G471 L477 D478 L640	G471-E474 WeakPolarHBondContact O-CB 3.49Å; G471-E474 PolarHBondContact O-N 3.39Å; E474-L477 PolarHBondContact O-N 3.47Å; E474-D478 PolarHBondContact O-N 2.95Å; E474-L640 HydrophobicContact CB-CD2 4.34Å; E474-L640 HydrophobicContact CG-CD1 4.04Å; E474-L640 HydrophobicContact CG-CD2 3.83Å
475	D	89.6	Confident	88.7	Confident	38 Å²	38	36.1 Å²	36.1	20%	0.203	22%	0.221	C	C	.	.	H	α-helix	trans	-62.2	-42.7	176.1	-84.2	-37	0	0	0	112.9	A422 R426 G471 I472 E473 D478 I479	A422-D475 HydrophobicContact CB-CB 3.47Å; A422-D475 VanDerWaalsContact CB-CB 3.47Å; A422-D475 VanDerWaalsContact CB-CG 3.49Å; A422-D475 WeakPolarHBondContact CB-OD2 3.39Å; R426-D475 IonicContact CZ-OD1 2.82Å; R426-D475 IonicContact NE-OD1 3.98Å; R426-D475 IonicContact NH2-OD1 2.84Å; R426-D475 PolarHBondContact NH2-OD1 3.25Å; G471-D475 PolarHBondContact O-N 2.95Å; I472-D475 PolarHBondContact O-N 3.2Å; E473-D475 VanDerWaalsContact C-N 3.34Å; D475-D478 PolarHBondContact O-N 3.45Å; D475-I479 WeakPolarHBondContact O-CD1 3.17Å; D475-I479 VanDerWaalsContact O-CG1 3.27Å; D475-I479 WeakPolarHBondContact O-CG1 3.22Å; D475-I479 PolarHBondContact O-N 3.42Å
476	M	92.9	Very high	89.5	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-64.1	-41.7	175	-75.6	-173.9	-57.9	0	0	111.4	L452 L455 I472 E473 D478 I479 F480 I633	L452-M476 HydrophobicContact CD2-CB 4.3Å; L452-M476 WeakPolarHBondContact CD2-O 3.4Å; L455-M476 HydrophobicContact CB-CG 3.72Å; L455-M476 HydrophobicContact CB-SD 3.72Å; L455-M476 HydrophobicContact CD1-CG 3.98Å; I472-M476 WeakPolarHBondContact O-CB 3.31Å; I472-M476 VanDerWaalsContact O-CG 3.24Å; I472-M476 WeakPolarHBondContact O-CG 3.08Å; I472-M476 PolarHBondContact O-N 3.03Å; E473-M476 HydrophobicContact CB-CE 4.47Å; E473-M476 HydrophobicContact CG-CE 4.14Å; E473-M476 PolarHBondContact O-N 3.22Å; M476-D478 VanDerWaalsContact C-N 3.35Å; M476-I479 PolarHBondContact O-N 3.01Å; M476-F480 VanDerWaalsContact O-CB 3.29Å; M476-F480 WeakPolarHBondContact O-CB 3.46Å; M476-F480 PolarHBondContact O-N 3.42Å; M476-I633 HydrophobicContact CB-CD1 3.81Å; M476-I633 HydrophobicContact CB-CG2 4.4Å; M476-I633 HydrophobicContact SD-CG2 4.3Å
477	L	92.5	Very high	90.2	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-63.6	-40.2	176.5	177.6	59.4	0	0	0	111.9	E473 E474 F480 T481 L635 L640 R643 F644	E473-L477 WeakPolarHBondContact O-CB 3.13Å; E473-L477 PolarHBondContact O-N 3.39Å; E474-L477 PolarHBondContact O-N 3.47Å; L477-F480 PolarHBondContact O-N 3.45Å; L477-T481 WeakPolarHBondContact O-CB 3.44Å; L477-T481 PolarHBondContact O-N 2.72Å; L477-T481 PolarHBondContact O-OG1 3.25Å; L477-L635 HydrophobicContact CB-CD2 4.45Å; L477-L635 HydrophobicContact CD1-CD1 4.39Å; L477-L640 HydrophobicContact CD2-CB 4.37Å; L477-L640 HydrophobicContact CD2-CD2 4.44Å; L477-L640 WeakPolarHBondContact CD2-O 3.29Å; L477-R643 HydrophobicContact CD2-CB 4.17Å; L477-R643 HydrophobicContact CD2-CG 4.05Å; L477-F644 HydrophobicContact CD1-CB 3.79Å; L477-F644 HydrophobicContact CD1-CD2 3.92Å; L477-F644 HydrophobicContact CD1-CG 4.31Å; L477-F644 HydrophobicContact CD2-CB 4.3Å
478	D	89.4	Confident	90.7	Very high	15 Å²	15	24.9 Å²	24.9	8%	0.08	15%	0.15	C	C	.	.	H	α-helix	trans	-63.2	-45.6	174.9	-81.2	-7.4	0	0	0	111.6	R426 E474 D475 M476 T481 Q482 R643 Y665	R426-D478 IonicContact CZ-OD2 3.9Å; R426-D478 IonicContact NH1-OD2 2.93Å; R426-D478 IonicContact NH2-OD2 2.81Å; R426-D478 PolarHBondContact NH2-OD2 2.85Å; E474-D478 PolarHBondContact O-N 2.95Å; D475-D478 PolarHBondContact O-N 3.45Å; M476-D478 VanDerWaalsContact C-N 3.35Å; D478-T481 PolarHBondContact O-N 3.02Å; D478-Q482 WeakPolarHBondContact O-CB 3.09Å; D478-Q482 PolarHBondContact O-N 2.91Å; D478-R643 IonicContact OD1-CZ 3.02Å; D478-R643 IonicContact OD1-NH2 2.71Å; D478-R643 PolarHBondContact OD1-NH2 3.16Å; D478-R643 IonicContact OD2-NH2 2.62Å; D478-Y665 HydrophobicContact CB-CD2 3.97Å; D478-Y665 HydrophobicContact CB-CE2 3.68Å; D478-Y665 VanDerWaalsContact CG-CD2 3.46Å; D478-Y665 WeakPolarHBondContact OD2-CD2 3.41Å
479	I	92.8	Very high	91.1	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-64.8	-42	177.5	-69.3	162.1	0	0	0	110.9	A422 R426 L429 Y448 L452 L455 D475 M476 Q482 Q483	A422-I479 HydrophobicContact CB-CD1 4.36Å; R426-I479 HydrophobicContact CG-CD1 4.23Å; R426-I479 HydrophobicContact CG-CG1 3.99Å; L429-I479 HydrophobicContact CD1-CG2 3.87Å; Y448-I479 HydrophobicContact CD1-CG2 3.75Å; Y448-I479 HydrophobicContact CE1-CG2 4.01Å; L452-I479 HydrophobicContact CD2-CB 4.04Å; L452-I479 HydrophobicContact CD2-CG2 3.75Å; L452-I479 HydrophobicContact CG-CG2 4.09Å; L455-I479 HydrophobicContact CD1-CD1 3.82Å; D475-I479 WeakPolarHBondContact O-CD1 3.17Å; D475-I479 VanDerWaalsContact O-CG1 3.27Å; D475-I479 WeakPolarHBondContact O-CG1 3.22Å; D475-I479 PolarHBondContact O-N 3.42Å; M476-I479 PolarHBondContact O-N 3.01Å; I479-Q482 WeakPolarHBondContact O-CB 3.18Å; I479-Q482 PolarHBondContact O-N 3.46Å; I479-Q483 PolarHBondContact O-N 3.27Å
480	F	95.1	Very high	91.5	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-60.1	-45.3	174.4	174.2	-88.5	0	0	0	111.4	L452 M476 L477 Q482 Q483 C484 L499 F500 M503 I633 F644	L452-F480 HydrophobicContact CD1-CB 4.31Å; L452-F480 HydrophobicContact CD1-CD2 4.35Å; L452-F480 HydrophobicContact CD2-CB 4.46Å; M476-F480 VanDerWaalsContact O-CB 3.29Å; M476-F480 WeakPolarHBondContact O-CB 3.46Å; M476-F480 PolarHBondContact O-N 3.42Å; L477-F480 PolarHBondContact O-N 3.45Å; F480-Q482 VanDerWaalsContact C-N 3.3Å; F480-Q482 PolarHBondContact O-N 2.78Å; F480-Q483 WeakPolarHBondContact O-CB 3.39Å; F480-Q483 PolarHBondContact O-N 3.07Å; F480-C484 VanDerWaalsContact CE1-SG 3.53Å; F480-C484 PolarHBondContact O-N 3.48Å; F480-C484 PolarHBondContact O-SG 2.83Å; F480-L499 HydrophobicContact CE2-CB 4.06Å; F480-L499 HydrophobicContact CE2-CD2 4.28Å; F480-L499 HydrophobicContact CZ-CB 3.93Å; F480-F500 HydrophobicContact CE1-CD1 4.07Å; F480-F500 AromaticContact CE1-CE1 3.92Å; F480-F500 HydrophobicContact CE1-CE1 3.92Å; F480-M503 HydrophobicContact CD2-CG 4.24Å; F480-M503 HydrophobicContact CE1-CG 4.21Å; F480-M503 HydrophobicContact CE2-CG 3.41Å; F480-M503 VanDerWaalsContact CE2-CG 3.41Å; F480-M503 HydrophobicContact CE2-SD 4.37Å; F480-M503 HydrophobicContact CZ-CB 4.08Å; F480-M503 HydrophobicContact CZ-CG 3.4Å; F480-M503 VanDerWaalsContact CZ-CG 3.4Å; F480-I633 HydrophobicContact CB-CD1 4.15Å; F480-F644 HydrophobicContact CD1-CE2 4.46Å; F480-F644 HydrophobicContact CE1-CD2 4.32Å; F480-F644 AromaticContact CE1-CE2 3.77Å; F480-F644 HydrophobicContact CE1-CE2 3.77Å; F480-F644 HydrophobicContact CZ-CE2 4.4Å
481	T	92.2	Very high	92	Very high	6 Å²	6	12.8 Å²	12.8	4%	0.037	7%	0.072	C	C	.	.	H	α-helix	trans	-63.4	-39.4	176.6	-56	0	0	0	0	110.7	L477 D478 C484 H485	L477-T481 WeakPolarHBondContact O-CB 3.44Å; L477-T481 PolarHBondContact O-N 2.72Å; L477-T481 PolarHBondContact O-OG1 3.25Å; D478-T481 PolarHBondContact O-N 3.02Å; T481-C484 PolarHBondContact O-N 3.43Å; T481-H485 PolarHBondContact O-CD2 3.5Å; T481-H485 PolarHBondContact O-N 2.81Å
482	Q	91.9	Very high	92.5	Very high	9 Å²	9	11.7 Å²	11.7	4%	0.042	6%	0.057	C	C	.	.	H	α-helix	trans	-62.6	-41.6	174.6	-162.8	-175.5	-18.8	0	0	112.3	Y448 D478 I479 F480 H485 F486 Y665	Y448-Q482 HydrophobicContact CE1-CB 4.25Å; Y448-Q482 HydrophobicContact CE1-CG 4.4Å; Y448-Q482 VanDerWaalsContact OH-CD 3.27Å; Y448-Q482 WeakPolarHBondContact OH-CG 3.48Å; Y448-Q482 PolarHBondContact OH-NE2 3.25Å; D478-Q482 WeakPolarHBondContact O-CB 3.09Å; D478-Q482 PolarHBondContact O-N 2.91Å; I479-Q482 WeakPolarHBondContact O-CB 3.18Å; I479-Q482 PolarHBondContact O-N 3.46Å; F480-Q482 VanDerWaalsContact C-N 3.3Å; F480-Q482 PolarHBondContact O-N 2.78Å; Q482-H485 PolarHBondContact O-N 2.9Å; Q482-F486 WeakPolarHBondContact O-CB 3.2Å; Q482-F486 PolarHBondContact O-N 3.06Å; Q482-Y665 WeakPolarHBondContact CB-OH 3.44Å; Q482-Y665 PolarHBondContact OE1-OH 2.86Å; Q482-Y665 VanDerWaalsContact OE1-OH 3.14Å
483	Q	95.2	Very high	92.7	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-61.6	-46.3	175.2	-175.9	-176.6	16.9	0	0	111.4	N445 Y448 I479 F480 H485 F486 L487 L499 S631	N445-Q483 PolarHBondContact OD1-NE2 2.81Å; Y448-Q483 HydrophobicContact CD1-CB 3.66Å; Y448-Q483 HydrophobicContact CD1-CG 4.18Å; Y448-Q483 HydrophobicContact CD2-CB 4.24Å; Y448-Q483 HydrophobicContact CD2-CG 4.07Å; Y448-Q483 HydrophobicContact CE1-CB 4.07Å; Y448-Q483 HydrophobicContact CG-CB 3.77Å; Y448-Q483 HydrophobicContact CG-CG 3.75Å; I479-Q483 PolarHBondContact O-N 3.27Å; F480-Q483 WeakPolarHBondContact O-CB 3.39Å; F480-Q483 PolarHBondContact O-N 3.07Å; Q483-H485 VanDerWaalsContact C-N 3.32Å; Q483-H485 PolarHBondContact O-N 3.32Å; Q483-F486 WeakPolarHBondContact O-CB 3.34Å; Q483-F486 PolarHBondContact O-N 3.18Å; Q483-F486 VanDerWaalsContact O-N 3.16Å; Q483-L487 HydrophobicContact CG-CD1 4.41Å; Q483-L487 PolarHBondContact O-N 3.3Å; Q483-L499 HydrophobicContact CG-CD1 4.28Å; Q483-S631 PolarHBondContact NE2-OG 3.35Å; Q483-S631 PolarHBondContact OE1-OG 3.3Å
484	C	94.9	Very high	92.8	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-60	-44	177.6	-66.2	0	0	0	0	111.3	F480 T481 L487 R488 F500 F651	F480-C484 VanDerWaalsContact CE1-SG 3.53Å; F480-C484 PolarHBondContact O-N 3.48Å; F480-C484 PolarHBondContact O-SG 2.83Å; T481-C484 PolarHBondContact O-N 3.43Å; C484-L487 PolarHBondContact O-N 3.21Å; C484-R488 PolarHBondContact O-N 3.03Å; C484-F500 HydrophobicContact CB-CD2 4.46Å; C484-F500 HydrophobicContact CB-CE2 3.6Å; C484-F500 HydrophobicContact CB-CZ 3.84Å; C484-F651 HydrophobicContact CB-CE2 4.22Å; C484-F651 WeakPolarHBondContact O-CE2 3.38Å
485	H	92.3	Very high	93.1	Very high	10 Å²	10	6.3 Å²	6.3	5%	0.046	3%	0.031	C	C	.	.	H	α-helix	trans	-65.5	-40.6	174.2	-78.4	-69.3	0	0	0	112.4	T481 Q482 Q483 L487 R488 Q489 F651 L670	T481-H485 PolarHBondContact O-CD2 3.5Å; T481-H485 PolarHBondContact O-N 2.81Å; Q482-H485 PolarHBondContact O-N 2.9Å; Q483-H485 VanDerWaalsContact C-N 3.32Å; Q483-H485 PolarHBondContact O-N 3.32Å; H485-L487 VanDerWaalsContact C-N 3.35Å; H485-L487 PolarHBondContact O-N 3.02Å; H485-R488 PolarHBondContact ND1-NE 3.35Å; H485-R488 CarbonylContact O-C 3.59Å; H485-R488 WeakPolarHBondContact O-CB 3.34Å; H485-R488 PolarHBondContact O-N 3.33Å; H485-Q489 WeakPolarHBondContact O-CB 3.32Å; H485-Q489 WeakPolarHBondContact O-CG 3.12Å; H485-Q489 PolarHBondContact O-N 3.19Å; H485-F651 AromaticContact CE1-CD2 3.73Å; H485-F651 AromaticContact ND1-CD2 3.81Å; H485-L670 HydrophobicContact CB-CD2 3.41Å; H485-L670 VanDerWaalsContact CB-CD2 3.41Å
486	F	94.3	Very high	93.3	Very high	1 Å²	1	4.5 Å²	4.5	0%	0.004	2%	0.021	C	C	.	.	H	α-helix	trans	-57.6	-45.6	175.6	165.2	-101.6	0	0	0	112.4	Q433 F439 V441 V444 Y448 Q482 Q483 Q489 S490 W1127	Q433-F486 HydrophobicContact CG-CD2 4.09Å; Q433-F486 HydrophobicContact CG-CE2 4.09Å; F439-F486 AromaticContact CE2-CE2 3.88Å; F439-F486 HydrophobicContact CE2-CE2 3.88Å; F439-F486 HydrophobicContact CE2-CZ 4.07Å; F439-F486 HydrophobicContact CZ-CE2 4.19Å; F439-F486 HydrophobicContact CZ-CZ 4.32Å; V441-F486 HydrophobicContact CG1-CE1 4.1Å; V441-F486 HydrophobicContact CG1-CZ 4.25Å; V441-F486 HydrophobicContact CG2-CZ 4.42Å; V444-F486 HydrophobicContact CB-CE1 3.91Å; V444-F486 HydrophobicContact CB-CE2 4.25Å; V444-F486 HydrophobicContact CB-CZ 3.56Å; V444-F486 HydrophobicContact CG1-CD1 4.09Å; V444-F486 HydrophobicContact CG1-CD2 4.26Å; V444-F486 HydrophobicContact CG1-CE1 3.59Å; V444-F486 HydrophobicContact CG1-CE2 3.74Å; V444-F486 HydrophobicContact CG1-CG 4.41Å; V444-F486 HydrophobicContact CG1-CZ 3.4Å; V444-F486 HydrophobicContact CG2-CZ 4.29Å; Y448-F486 HydrophobicContact CE2-CB 4.36Å; Y448-F486 HydrophobicContact CE2-CD1 4.25Å; Y448-F486 HydrophobicContact CE2-CG 4.26Å; Q482-F486 WeakPolarHBondContact O-CB 3.2Å; Q482-F486 PolarHBondContact O-N 3.06Å; Q483-F486 WeakPolarHBondContact O-CB 3.34Å; Q483-F486 PolarHBondContact O-N 3.18Å; Q483-F486 VanDerWaalsContact O-N 3.16Å; F486-Q489 PolarHBondContact O-N 2.91Å; F486-S490 PolarHBondContact O-N 2.95Å; F486-S490 PolarHBondContact O-OG 2.98Å; F486-W1127 HydrophobicContact CD2-CB 4Å; F486-W1127 AromaticContact CD2-CD1 3.94Å; F486-W1127 AromaticContact CD2-CG 3.99Å; F486-W1127 HydrophobicContact CD2-CG 3.99Å; F486-W1127 HydrophobicContact CE2-CB 3.52Å; F486-W1127 AromaticContact CE2-CG 3.99Å; F486-W1127 HydrophobicContact CE2-CG 3.99Å
487	L	95	Very high	93.4	Very high	2 Å²	2	4.5 Å²	4.5	1%	0.01	2%	0.021	C	C	.	.	H	α-helix	trans	-62.7	-43.1	175.7	-71.9	171.5	0	0	0	111.4	V441 N445 Q483 C484 H485 Q489 S490 G491 H492 K495 A496 L499	V441-L487 HydrophobicContact CG1-CD2 4.4Å; N445-L487 HydrophobicContact CB-CD2 4.49Å; Q483-L487 HydrophobicContact CG-CD1 4.41Å; Q483-L487 PolarHBondContact O-N 3.3Å; C484-L487 PolarHBondContact O-N 3.21Å; H485-L487 VanDerWaalsContact C-N 3.35Å; H485-L487 PolarHBondContact O-N 3.02Å; L487-Q489 PolarHBondContact O-N 3.37Å; L487-S490 WeakPolarHBondContact CA-OG 3.36Å; L487-S490 PolarHBondContact O-N 3.43Å; L487-S490 PolarHBondContact O-OG 3.23Å; L487-G491 PolarHBondContact O-N 2.89Å; L487-G491 VanDerWaalsContact O-N 3.1Å; L487-H492 HydrophobicContact CB-CB 4.37Å; L487-H492 HydrophobicContact CD2-CB 4.11Å; L487-H492 PolarHBondContact O-N 3.11Å; L487-K495 HydrophobicContact CD1-CB 4.09Å; L487-A496 HydrophobicContact CB-CB 3.96Å; L487-L499 HydrophobicContact CD1-CD1 3.56Å
488	R	92.9	Very high	93.6	Very high	2 Å²	2	4.5 Å²	4.5	1%	0.008	2%	0.021	C	C	.	.	H	α-helix	trans	-59.6	-44	172.2	-177.1	-164.9	62.4	92.4	12.8	112.2	C484 H485 S490 G491 F651 E672 I697 N698 M703	C484-R488 PolarHBondContact O-N 3.03Å; H485-R488 PolarHBondContact ND1-NE 3.35Å; H485-R488 CarbonylContact O-C 3.59Å; H485-R488 WeakPolarHBondContact O-CB 3.34Å; H485-R488 PolarHBondContact O-N 3.33Å; R488-S490 VanDerWaalsContact C-N 3.3Å; R488-S490 PolarHBondContact O-N 3.2Å; R488-G491 PolarHBondContact O-N 3.5Å; R488-G491 VanDerWaalsContact O-N 3.08Å; R488-F651 HydrophobicContact CB-CE2 3.65Å; R488-F651 HydrophobicContact CB-CZ 3.81Å; R488-F651 HydrophobicContact CG-CE2 4.1Å; R488-F651 HydrophobicContact CG-CZ 4.19Å; R488-E672 IonicContact CZ-OE2 3.46Å; R488-E672 IonicContact NH1-OE2 3.77Å; R488-E672 PolarHBondContact NH1-OE2 2.91Å; R488-E672 IonicContact NH2-OE2 3.56Å; R488-E672 PolarHBondContact NH2-OE2 3.32Å; R488-I697 VanDerWaalsContact CZ-CG2 3.48Å; R488-N698 PolarHBondContact NH1-O 2.94Å; R488-M703 HydrophobicContact CG-CE 4.42Å; R488-M703 WeakPolarHBondContact O-CE 3.26Å
489	Q	92.5	Very high	93.9	Very high	4 Å²	4	3.8 Å²	3.8	2%	0.019	2%	0.018	C	C	.	.	H	α-helix	trans	-65.9	-32.3	-179.3	-70.5	-175.1	-47.8	0	0	113	H485 F486 L487 G491 M669 E672 M703 W1127 K1129	H485-Q489 WeakPolarHBondContact O-CB 3.32Å; H485-Q489 WeakPolarHBondContact O-CG 3.12Å; H485-Q489 PolarHBondContact O-N 3.19Å; F486-Q489 PolarHBondContact O-N 2.91Å; L487-Q489 PolarHBondContact O-N 3.37Å; Q489-G491 VanDerWaalsContact C-N 3.29Å; Q489-M669 PolarHBondContact NE2-O 3.41Å; Q489-E672 VanDerWaalsContact CD-OE1 3.25Å; Q489-E672 WeakPolarHBondContact CG-OE1 3.19Å; Q489-E672 PolarHBondContact NE2-OE1 3.13Å; Q489-M703 HydrophobicContact CG-CE 4.47Å; Q489-W1127 CarbonylContact C-O 3.58Å; Q489-K1129 VanDerWaalsContact O-CB 3.24Å; Q489-K1129 WeakPolarHBondContact O-CB 3.41Å; Q489-K1129 PolarHBondContact O-N 3.31Å
490	S	94.4	Very high	94.1	Very high	0 Å²	0	3.9 Å²	3.9	0%	0	2%	0.018	C	C	.	.	H	α-helix	trans	-83.5	-4.6	173.7	52	0	0	0	0	113.6	F486 L487 R488 W1127 R1156	F486-S490 PolarHBondContact O-N 2.95Å; F486-S490 PolarHBondContact O-OG 2.98Å; L487-S490 WeakPolarHBondContact CA-OG 3.36Å; L487-S490 PolarHBondContact O-N 3.43Å; L487-S490 PolarHBondContact O-OG 3.23Å; R488-S490 VanDerWaalsContact C-N 3.3Å; R488-S490 PolarHBondContact O-N 3.2Å; S490-W1127 WeakPolarHBondContact CA-O 3.27Å; S490-W1127 PolarHBondContact N-O 3.46Å; S490-R1156 PolarHBondContact O-N 3.43Å
491	G	92.6	Very high	94.1	Very high	0 Å²	0	3.9 Å²	3.9	0%	0	2%	0.018	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.6	-5.3	176.8	0	0	0	0	0	115.4	L487 R488 Q489 C493 R1156	L487-G491 PolarHBondContact O-N 2.89Å; L487-G491 VanDerWaalsContact O-N 3.1Å; R488-G491 PolarHBondContact O-N 3.5Å; R488-G491 VanDerWaalsContact O-N 3.08Å; Q489-G491 VanDerWaalsContact C-N 3.29Å; G491-C493 PolarHBondContact O-N 3.37Å; G491-R1156 WeakPolarHBondContact O-CG 3.36Å
492	H	94.1	Very high	94.2	Very high	14 Å²	14	3.6 Å²	3.6	7%	0.065	2%	0.016	C	C	.	.			trans	-77.5	58.4	177.9	-68	-82.6	0	0	0	112	L487 E494 K495 A496 E1154	L487-H492 HydrophobicContact CB-CB 4.37Å; L487-H492 HydrophobicContact CD2-CB 4.11Å; L487-H492 PolarHBondContact O-N 3.11Å; H492-E494 PolarHBondContact O-N 3.18Å; H492-K495 HydrophobicContact CB-CB 4.45Å; H492-K495 HydrophobicContact CB-CD 4.4Å; H492-K495 HydrophobicContact CB-CG 4.47Å; H492-K495 PolarHBondContact O-N 3.36Å; H492-A496 PolarHBondContact O-N 3.46Å; H492-E1154 PolarHBondContact NE2-O 2.93Å
493	C	92.4	Very high	94.4	Very high	0 Å²	0	3.2 Å²	3.2	0%	0	1%	0.014	C	C	.	.	H	α-helix	trans	-65.9	-37	-175	-69.3	0	0	0	0	112.6	G491 K495 A496 I497 W600 V700	G491-C493 PolarHBondContact O-N 3.37Å; C493-K495 VanDerWaalsContact C-N 3.31Å; C493-K495 PolarHBondContact O-N 2.95Å; C493-A496 WeakPolarHBondContact O-CB 3.39Å; C493-A496 PolarHBondContact O-N 3.44Å; C493-A496 VanDerWaalsContact O-N 3.14Å; C493-I497 WeakPolarHBondContact O-CG1 3.47Å; C493-I497 PolarHBondContact O-N 2.89Å; C493-W600 HydrophobicContact CB-CB 4.12Å; C493-V700 HydrophobicContact CB-CG1 3.75Å
494	E	92.9	Very high	94.4	Very high	0 Å²	0	3.2 Å²	3.2	0%	0	2%	0.015	C	C	.	.	H	α-helix	trans	-55.9	-42.4	176.5	53.4	-81.6	-174.5	0	0	112.4	H492 S498 W600 V623 R1156 R1158	H492-E494 PolarHBondContact O-N 3.18Å; E494-S498 WeakPolarHBondContact O-CB 3.5Å; E494-S498 PolarHBondContact O-N 3.25Å; E494-S498 PolarHBondContact O-OG 3.25Å; E494-W600 WeakPolarHBondContact CA-O 3.36Å; E494-W600 PolarHBondContact N-O 2.9Å; E494-V623 HydrophobicContact CB-CG2 4.21Å; E494-V623 HydrophobicContact CG-CG2 4.27Å; E494-R1156 IonicContact OE1-CZ 2.94Å; E494-R1156 IonicContact OE1-NE 3.16Å; E494-R1156 PolarHBondContact OE1-NE 2.79Å; E494-R1156 IonicContact OE1-NH2 3.54Å; E494-R1158 IonicContact OE2-CZ 3.65Å; E494-R1158 IonicContact OE2-NH2 2.87Å; E494-R1158 PolarHBondContact OE2-NH2 3.08Å
495	K	94.5	Very high	94.3	Very high	31 Å²	31	3.2 Å²	3.2	14%	0.135	2%	0.015	C	C	.	.	H	α-helix	trans	-68.6	-42.6	176.2	-63	-169.8	-179.7	-155.2	0	111	L487 H492 C493 S498 L499 V623 D627	L487-K495 HydrophobicContact CD1-CB 4.09Å; H492-K495 HydrophobicContact CB-CB 4.45Å; H492-K495 HydrophobicContact CB-CD 4.4Å; H492-K495 HydrophobicContact CB-CG 4.47Å; H492-K495 PolarHBondContact O-N 3.36Å; C493-K495 VanDerWaalsContact C-N 3.31Å; C493-K495 PolarHBondContact O-N 2.95Å; K495-S498 PolarHBondContact O-N 3.47Å; K495-L499 WeakPolarHBondContact O-CG 3.39Å; K495-L499 PolarHBondContact O-N 3.17Å; K495-V623 HydrophobicContact CG-CG1 4.39Å; K495-V623 HydrophobicContact CG-CG2 4.03Å; K495-D627 IonicContact NZ-OD1 2.79Å; K495-D627 PolarHBondContact NZ-OD1 3.5Å; K495-D627 IonicContact NZ-OD2 2.68Å
496	A	95.4	Very high	94.3	Very high	0 Å²	0	2.8 Å²	2.8	0%	0	1%	0.012	C	C	.	.	H	α-helix	trans	-63.8	-41.9	177.5	0	0	0	0	0	112.4	L487 H492 C493 L499 F500 F651	L487-A496 HydrophobicContact CB-CB 3.96Å; H492-A496 PolarHBondContact O-N 3.46Å; C493-A496 WeakPolarHBondContact O-CB 3.39Å; C493-A496 PolarHBondContact O-N 3.44Å; C493-A496 VanDerWaalsContact O-N 3.14Å; A496-L499 WeakPolarHBondContact O-CB 3.42Å; A496-L499 PolarHBondContact O-N 2.77Å; A496-F500 WeakPolarHBondContact O-CD2 3.41Å; A496-F500 PolarHBondContact O-N 3.42Å; A496-F651 HydrophobicContact CB-CE1 4.27Å; A496-F651 HydrophobicContact CB-CE2 4.42Å; A496-F651 HydrophobicContact CB-CZ 3.59Å
497	I	94.6	Very high	94.2	Very high	0 Å²	0	3.6 Å²	3.6	0%	0	2%	0.019	C	C	.	.	H	α-helix	trans	-66.6	-41.6	175.3	-66.1	-63.2	0	0	0	111.1	C493 L499 F500 Q501 W600 L601 F648 F651 L652 V700 F722	C493-I497 WeakPolarHBondContact O-CG1 3.47Å; C493-I497 PolarHBondContact O-N 2.89Å; I497-L499 VanDerWaalsContact C-N 3.29Å; I497-L499 PolarHBondContact O-N 2.89Å; I497-F500 CarbonylContact O-C 3.47Å; I497-F500 PolarHBondContact O-N 3.27Å; I497-Q501 HydrophobicContact CG2-CG 4.15Å; I497-Q501 WeakPolarHBondContact O-CG 3.3Å; I497-Q501 PolarHBondContact O-N 2.94Å; I497-W600 HydrophobicContact CD1-CE3 3.93Å; I497-W600 HydrophobicContact CD1-CZ3 3.67Å; I497-W600 HydrophobicContact CG1-CE3 3.72Å; I497-W600 HydrophobicContact CG1-CZ3 3.84Å; I497-W600 HydrophobicContact CG2-CZ3 4.5Å; I497-L601 HydrophobicContact CG2-CD2 4.1Å; I497-F648 HydrophobicContact CD1-CE2 4.15Å; I497-F651 HydrophobicContact CD1-CD1 4.34Å; I497-F651 HydrophobicContact CD1-CE1 3.83Å; I497-L652 HydrophobicContact CD1-CD2 3.79Å; I497-V700 HydrophobicContact CD1-CG2 4.41Å; I497-F722 HydrophobicContact CG2-CZ 4.33Å
498	S	95.4	Very high	93.9	Very high	0 Å²	0	4.7 Å²	4.7	0%	0	2%	0.023	C	C	.	.	H	α-helix	trans	-59.6	-39.8	175.8	-63.5	0	0	0	0	111.9	E494 K495 F500 Q501 A502 V623	E494-S498 WeakPolarHBondContact O-CB 3.5Å; E494-S498 PolarHBondContact O-N 3.25Å; E494-S498 PolarHBondContact O-OG 3.25Å; K495-S498 PolarHBondContact O-N 3.47Å; S498-F500 PolarHBondContact O-N 3.4Å; S498-Q501 PolarHBondContact O-N 2.99Å; S498-A502 WeakPolarHBondContact O-CB 3.43Å; S498-A502 PolarHBondContact O-N 3.45Å; S498-V623 WeakPolarHBondContact OG-CB 3.34Å; S498-V623 WeakPolarHBondContact OG-CG2 3.33Å
499	L	96.7	Very high	93.9	Very high	1 Å²	1	5.2 Å²	5.2	1%	0.005	3%	0.025	C	C	.	.	H	α-helix	trans	-58.9	-45.1	171.8	-76.6	172.5	0	0	0	112	F480 Q483 L487 K495 A496 I497 M503 I628	F480-L499 HydrophobicContact CE2-CB 4.06Å; F480-L499 HydrophobicContact CE2-CD2 4.28Å; F480-L499 HydrophobicContact CZ-CB 3.93Å; Q483-L499 HydrophobicContact CG-CD1 4.28Å; L487-L499 HydrophobicContact CD1-CD1 3.56Å; K495-L499 WeakPolarHBondContact O-CG 3.39Å; K495-L499 PolarHBondContact O-N 3.17Å; A496-L499 WeakPolarHBondContact O-CB 3.42Å; A496-L499 PolarHBondContact O-N 2.77Å; I497-L499 VanDerWaalsContact C-N 3.29Å; I497-L499 PolarHBondContact O-N 2.89Å; L499-M503 VanDerWaalsContact O-CB 3.26Å; L499-M503 WeakPolarHBondContact O-CB 3.47Å; L499-M503 WeakPolarHBondContact O-CG 3.33Å; L499-M503 PolarHBondContact O-N 2.82Å; L499-I628 HydrophobicContact CD2-CB 3.9Å; L499-I628 HydrophobicContact CD2-CG2 3.87Å; L499-I628 HydrophobicContact CG-CG2 4.12Å
500	F	96.3	Very high	93.8	Very high	1 Å²	1	6.4 Å²	6.4	0%	0.004	3%	0.03	C	C	.	.	H	α-helix	trans	-65.9	-46	176.6	-78.9	-67.7	0	0	0	112.6	F480 C484 A496 I497 S498 A502 M503 I504 F644 F648 F651	F480-F500 HydrophobicContact CE1-CD1 4.07Å; F480-F500 AromaticContact CE1-CE1 3.92Å; F480-F500 HydrophobicContact CE1-CE1 3.92Å; C484-F500 HydrophobicContact CB-CD2 4.46Å; C484-F500 HydrophobicContact CB-CE2 3.6Å; C484-F500 HydrophobicContact CB-CZ 3.84Å; A496-F500 WeakPolarHBondContact O-CD2 3.41Å; A496-F500 PolarHBondContact O-N 3.42Å; I497-F500 CarbonylContact O-C 3.47Å; I497-F500 PolarHBondContact O-N 3.27Å; S498-F500 PolarHBondContact O-N 3.4Å; F500-A502 PolarHBondContact O-N 2.92Å; F500-M503 PolarHBondContact O-N 2.8Å; F500-I504 VanDerWaalsContact O-CG1 3.22Å; F500-I504 WeakPolarHBondContact O-CG1 3.39Å; F500-I504 PolarHBondContact O-N 3.42Å; F500-F644 AromaticContact CD1-CE2 3.63Å; F500-F644 HydrophobicContact CD1-CE2 3.63Å; F500-F644 HydrophobicContact CD1-CZ 4Å; F500-F644 HydrophobicContact CE1-CD2 4.49Å; F500-F644 AromaticContact CE1-CE2 3.96Å; F500-F644 HydrophobicContact CE1-CE2 3.96Å; F500-F648 HydrophobicContact CB-CD2 3.55Å; F500-F648 HydrophobicContact CB-CE2 3.5Å; F500-F648 VanDerWaalsContact CB-CE2 3.5Å; F500-F648 HydrophobicContact CB-CG 4.33Å; F500-F648 HydrophobicContact CB-CZ 4.25Å; F500-F648 HydrophobicContact CD1-CB 3.72Å; F500-F648 AromaticContact CD1-CD2 3.48Å; F500-F648 HydrophobicContact CD1-CD2 3.48Å; F500-F648 VanDerWaalsContact CD1-CD2 3.48Å; F500-F648 HydrophobicContact CD1-CE2 4.32Å; F500-F648 AromaticContact CD1-CG 3.87Å; F500-F648 HydrophobicContact CD1-CG 3.87Å; F500-F648 AromaticContact CD2-CD2 3.51Å; F500-F648 HydrophobicContact CD2-CD2 3.51Å; F500-F648 AromaticContact CD2-CE2 3.86Å; F500-F648 HydrophobicContact CD2-CE2 3.86Å; F500-F648 HydrophobicContact CE1-CB 3.74Å; F500-F648 AromaticContact CE1-CD2 3.98Å; F500-F648 HydrophobicContact CE1-CD2 3.98Å; F500-F648 HydrophobicContact CE1-CG 4.3Å; F500-F648 AromaticContact CE2-CD2 4Å; F500-F648 HydrophobicContact CE2-CD2 4Å; F500-F648 HydrophobicContact CG-CB 4.38Å; F500-F648 AromaticContact CG-CD2 3.23Å; F500-F648 HydrophobicContact CG-CD2 3.23Å; F500-F648 AromaticContact CG-CE2 3.67Å; F500-F648 HydrophobicContact CG-CE2 3.67Å; F500-F648 HydrophobicContact CG-CG 4.06Å; F500-F648 HydrophobicContact CZ-CB 4.42Å; F500-F648 HydrophobicContact CZ-CD2 4.22Å; F500-F651 HydrophobicContact CD2-CD1 4.02Å; F500-F651 HydrophobicContact CD2-CE1 4.08Å; F500-F651 HydrophobicContact CE2-CB 4.12Å; F500-F651 AromaticContact CE2-CD1 3.48Å; F500-F651 HydrophobicContact CE2-CD1 3.48Å; F500-F651 VanDerWaalsContact CE2-CD1 3.48Å; F500-F651 AromaticContact CE2-CD2 3.95Å; F500-F651 HydrophobicContact CE2-CD2 3.95Å; F500-F651 AromaticContact CE2-CE1 3.74Å; F500-F651 HydrophobicContact CE2-CE1 3.74Å; F500-F651 HydrophobicContact CE2-CE2 4.2Å; F500-F651 AromaticContact CE2-CG 3.6Å; F500-F651 HydrophobicContact CE2-CG 3.6Å; F500-F651 HydrophobicContact CE2-CZ 4.12Å; F500-F651 HydrophobicContact CZ-CB 4.16Å; F500-F651 HydrophobicContact CZ-CD1 4.35Å; F500-F651 HydrophobicContact CZ-CD2 4.4Å; F500-F651 HydrophobicContact CZ-CG 4.08Å
501	Q	95.3	Very high	93.6	Very high	1 Å²	1	6.7 Å²	6.7	1%	0.005	3%	0.032	C	C	.	.	H	α-helix	trans	-57.2	-50.9	176.2	-72.3	-178.6	-74.1	0	0	110.5	I497 S498 M503 I504 D505 V537 E539 F722	I497-Q501 HydrophobicContact CG2-CG 4.15Å; I497-Q501 WeakPolarHBondContact O-CG 3.3Å; I497-Q501 PolarHBondContact O-N 2.94Å; S498-Q501 PolarHBondContact O-N 2.99Å; Q501-M503 PolarHBondContact O-N 3.17Å; Q501-I504 PolarHBondContact O-N 3.02Å; Q501-D505 PolarHBondContact O-N 3.45Å; Q501-V537 PolarHBondContact NE2-O 3.38Å; Q501-E539 PolarHBondContact NE2-OE1 3.17Å; Q501-F722 HydrophobicContact CG-CE2 4.32Å; Q501-F722 HydrophobicContact CG-CZ 4.12Å
502	A	95.6	Very high	93.4	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-59	-45	178.3	0	0	0	0	0	111.8	S498 F500 I504 D505 F506 F526 W530 I628 L632	S498-A502 WeakPolarHBondContact O-CB 3.43Å; S498-A502 PolarHBondContact O-N 3.45Å; F500-A502 PolarHBondContact O-N 2.92Å; A502-I504 VanDerWaalsContact C-N 3.35Å; A502-I504 PolarHBondContact O-N 3.39Å; A502-D505 PolarHBondContact O-N 2.79Å; A502-F506 WeakPolarHBondContact O-CB 3.47Å; A502-F506 PolarHBondContact O-N 3.08Å; A502-F526 HydrophobicContact CB-CE1 3.99Å; A502-F526 HydrophobicContact CB-CZ 4.17Å; A502-W530 HydrophobicContact CB-CE3 4.23Å; A502-W530 HydrophobicContact CB-CH2 4.09Å; A502-W530 HydrophobicContact CB-CZ3 3.63Å; A502-I628 HydrophobicContact CB-CD1 3.57Å; A502-L632 HydrophobicContact CB-CD2 3.8Å
503	M	95.4	Very high	93	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-65.8	-33.6	177.3	-84.2	-63.4	-66.1	0	0	113.5	F480 L499 F500 Q501 S507 L632 I633 L635 F644	F480-M503 HydrophobicContact CD2-CG 4.24Å; F480-M503 HydrophobicContact CE1-CG 4.21Å; F480-M503 HydrophobicContact CE2-CG 3.41Å; F480-M503 VanDerWaalsContact CE2-CG 3.41Å; F480-M503 HydrophobicContact CE2-SD 4.37Å; F480-M503 HydrophobicContact CZ-CB 4.08Å; F480-M503 HydrophobicContact CZ-CG 3.4Å; F480-M503 VanDerWaalsContact CZ-CG 3.4Å; L499-M503 VanDerWaalsContact O-CB 3.26Å; L499-M503 WeakPolarHBondContact O-CB 3.47Å; L499-M503 WeakPolarHBondContact O-CG 3.33Å; L499-M503 PolarHBondContact O-N 2.82Å; F500-M503 PolarHBondContact O-N 2.8Å; Q501-M503 PolarHBondContact O-N 3.17Å; M503-S507 WeakPolarHBondContact O-CB 3.28Å; M503-S507 PolarHBondContact O-N 2.94Å; M503-S507 PolarHBondContact O-OG 3.36Å; M503-L632 HydrophobicContact CG-CD2 4Å; M503-L632 HydrophobicContact SD-CB 4.44Å; M503-L632 HydrophobicContact SD-CD2 3.88Å; M503-I633 HydrophobicContact CE-CD1 4.28Å; M503-I633 HydrophobicContact CE-CG1 3.4Å; M503-I633 WeakPolarHBondContact CE-O 3.5Å; M503-I633 HydrophobicContact SD-CG1 4.07Å; M503-I633 PolarHBondContact SD-N 3.21Å; M503-I633 VanDerWaalsContact SD-N 3.42Å; M503-L635 HydrophobicContact CE-CD1 4.33Å; M503-F644 HydrophobicContact CB-CE1 4.43Å; M503-F644 HydrophobicContact CB-CE2 3.83Å; M503-F644 HydrophobicContact CB-CZ 3.52Å
504	I	94.6	Very high	92.7	Very high	1 Å²	1	14.3 Å²	14.3	1%	0.005	8%	0.08	C	C	.	.	H	α-helix	trans	-67.5	-49.1	175	-68.8	163.1	0	0	0	109.9	F500 Q501 A502 F506 S507 Y508 F509 V537 F644 L645 F648 V726 L730	F500-I504 VanDerWaalsContact O-CG1 3.22Å; F500-I504 WeakPolarHBondContact O-CG1 3.39Å; F500-I504 PolarHBondContact O-N 3.42Å; Q501-I504 PolarHBondContact O-N 3.02Å; A502-I504 VanDerWaalsContact C-N 3.35Å; A502-I504 PolarHBondContact O-N 3.39Å; I504-F506 VanDerWaalsContact C-N 3.33Å; I504-F506 PolarHBondContact O-N 3.47Å; I504-S507 PolarHBondContact O-N 2.89Å; I504-Y508 HydrophobicContact CG2-CD2 4.04Å; I504-Y508 PolarHBondContact O-N 3.5Å; I504-F509 HydrophobicContact CG2-CE2 4.21Å; I504-V537 HydrophobicContact CB-CG1 4.41Å; I504-V537 HydrophobicContact CD1-CG1 4.47Å; I504-V537 HydrophobicContact CG2-CB 4.28Å; I504-V537 HydrophobicContact CG2-CG1 3.77Å; I504-V537 HydrophobicContact CG2-CG2 4.12Å; I504-F644 HydrophobicContact CG1-CE1 3.64Å; I504-F644 HydrophobicContact CG1-CZ 3.87Å; I504-L645 HydrophobicContact CG1-CD2 4.4Å; I504-F648 HydrophobicContact CD1-CD1 4.11Å; I504-F648 HydrophobicContact CD1-CE1 3.96Å; I504-V726 HydrophobicContact CD1-CG1 4.4Å; I504-L730 HydrophobicContact CG2-CD1 4.48Å; I504-L730 HydrophobicContact CG2-CD2 3.82Å; I504-L730 HydrophobicContact CG2-CG 4.46Å
505	D	93.3	Very high	92.3	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-58.2	-46.4	174.7	-91.5	-53.5	0	0	0	111.6	Q501 A502 S507 F509 F526 F529 V537 G544 W545	Q501-D505 PolarHBondContact O-N 3.45Å; A502-D505 PolarHBondContact O-N 2.79Å; D505-S507 VanDerWaalsContact C-N 3.32Å; D505-S507 PolarHBondContact O-N 2.91Å; D505-F509 CarbonylContact O-C 3.57Å; D505-F509 VanDerWaalsContact O-C 3.32Å; D505-F509 WeakPolarHBondContact O-CA 3.45Å; D505-F509 WeakPolarHBondContact O-CB 3.44Å; D505-F509 PolarHBondContact O-N 2.96Å; D505-F526 HydrophobicContact CB-CE2 3.91Å; D505-F526 HydrophobicContact CB-CZ 4.12Å; D505-F529 HydrophobicContact CB-CE1 4.38Å; D505-V537 VanDerWaalsContact CG-CG2 3.42Å; D505-V537 VanDerWaalsContact OD1-CG2 3.3Å; D505-V537 WeakPolarHBondContact OD1-CG2 3.48Å; D505-V537 VanDerWaalsContact OD2-CG2 3.32Å; D505-V537 WeakPolarHBondContact OD2-CG2 3.38Å; D505-V537 PolarHBondContact OD2-N 3.25Å; D505-G544 WeakPolarHBondContact OD1-CA 3.48Å; D505-W545 PolarHBondContact OD1-N 3.19Å
506	F	92.9	Very high	91.8	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-65.8	-31.1	179.5	-169.4	-102.1	0	0	0	112.9	A502 I504 K510 Q522 V523 F526 W545 L632 I633 C634	A502-F506 WeakPolarHBondContact O-CB 3.47Å; A502-F506 PolarHBondContact O-N 3.08Å; I504-F506 VanDerWaalsContact C-N 3.33Å; I504-F506 PolarHBondContact O-N 3.47Å; F506-K510 WeakPolarHBondContact O-CE 3.22Å; F506-Q522 HydrophobicContact CE2-CB 3.79Å; F506-Q522 HydrophobicContact CZ-CB 3.79Å; F506-V523 HydrophobicContact CE2-CG2 4.19Å; F506-V523 HydrophobicContact CZ-CG2 4.21Å; F506-F526 HydrophobicContact CD2-CB 4.31Å; F506-F526 HydrophobicContact CD2-CD2 4.38Å; F506-F526 HydrophobicContact CD2-CG 4.15Å; F506-W545 AromaticContact CD2-CZ3 3.97Å; F506-W545 HydrophobicContact CD2-CZ3 3.97Å; F506-W545 HydrophobicContact CE2-CZ3 4.3Å; F506-L632 HydrophobicContact CD2-CD1 4.4Å; F506-I633 WeakPolarHBondContact CE1-O 3.33Å; F506-C634 VanDerWaalsContact CE1-SG 3.52Å
507	S	91.3	Very high	91.5	Very high	19 Å²	19	30.8 Å²	30.8	13%	0.133	15%	0.154	C	C	.	.	H	α-helix	trans	-88.8	-48.2	-178.2	-61.3	0	0	0	0	113.1	M503 I504 D505	M503-S507 WeakPolarHBondContact O-CB 3.28Å; M503-S507 PolarHBondContact O-N 2.94Å; M503-S507 PolarHBondContact O-OG 3.36Å; I504-S507 PolarHBondContact O-N 2.89Å; D505-S507 VanDerWaalsContact C-N 3.32Å; D505-S507 PolarHBondContact O-N 2.91Å
508	Y	90	Very high	91.3	Very high	25 Å²	25	32.4 Å²	32.4	10%	0.098	17%	0.165	C	C	.	.	H	α-helix	trans	-99	-31.6	-170.7	-65.6	-81	0	0	0	113.4	I504 Q641 L645 L730 F733 L734	I504-Y508 HydrophobicContact CG2-CD2 4.04Å; I504-Y508 PolarHBondContact O-N 3.5Å; Y508-Q641 WeakPolarHBondContact OH-CB 3.21Å; Y508-Q641 PolarHBondContact OH-O 3.22Å; Y508-L645 HydrophobicContact CE2-CD1 4.24Å; Y508-L645 HydrophobicContact CE2-CD2 3.96Å; Y508-L645 HydrophobicContact CE2-CG 4.14Å; Y508-L645 WeakPolarHBondContact OH-CD1 3.48Å; Y508-L645 WeakPolarHBondContact OH-CG 3.45Å; Y508-L730 HydrophobicContact CD1-CD2 4.26Å; Y508-L730 HydrophobicContact CD2-CD2 3.72Å; Y508-L730 HydrophobicContact CE2-CD2 4.21Å; Y508-L730 HydrophobicContact CG-CD2 3.73Å; Y508-F733 HydrophobicContact CD1-CB 4.44Å; Y508-L734 HydrophobicContact CE1-CD2 3.81Å
509	F	91.4	Very high	91.1	Very high	12 Å²	12	32.6 Å²	32.6	5%	0.053	17%	0.166	C	C	.	.	S	Bend	trans	-104.4	26.3	-175.7	-59.3	-88.5	0	0	0	112.2	I504 D505 V537 K546 M729 L730 F733	I504-F509 HydrophobicContact CG2-CE2 4.21Å; D505-F509 CarbonylContact O-C 3.57Å; D505-F509 VanDerWaalsContact O-C 3.32Å; D505-F509 WeakPolarHBondContact O-CA 3.45Å; D505-F509 WeakPolarHBondContact O-CB 3.44Å; D505-F509 PolarHBondContact O-N 2.96Å; F509-V537 HydrophobicContact CD2-CG2 3.93Å; F509-V537 HydrophobicContact CE2-CG2 3.73Å; F509-K546 WeakPolarHBondContact O-CA 3.38Å; F509-K546 WeakPolarHBondContact O-CB 3.42Å; F509-K546 PolarHBondContact O-N 3.24Å; F509-M729 HydrophobicContact CE1-CE 4.2Å; F509-M729 HydrophobicContact CE2-CE 4.5Å; F509-M729 HydrophobicContact CZ-CB 3.88Å; F509-M729 HydrophobicContact CZ-CE 4.04Å; F509-M729 WeakPolarHBondContact CZ-O 3.34Å; F509-L730 HydrophobicContact CE2-CD2 4.06Å; F509-L730 HydrophobicContact CZ-CD2 4.49Å; F509-F733 HydrophobicContact CD1-CE2 4.07Å; F509-F733 HydrophobicContact CD1-CZ 4.22Å; F509-F733 HydrophobicContact CE1-CD2 4.07Å; F509-F733 AromaticContact CE1-CE2 3.41Å; F509-F733 HydrophobicContact CE1-CE2 3.41Å; F509-F733 VanDerWaalsContact CE1-CE2 3.41Å; F509-F733 AromaticContact CE1-CZ 4Å; F509-F733 HydrophobicContact CE1-CZ 4Å; F509-F733 HydrophobicContact CZ-CD2 4.18Å; F509-F733 AromaticContact CZ-CE2 3.97Å; F509-F733 HydrophobicContact CZ-CE2 3.97Å
510	K	90.4	Very high	90.9	Very high	30 Å²	30	39.9 Å²	39.9	13%	0.13	20%	0.198	C	C	.	.			trans	-70.1	126.8	179.5	-171.3	173.2	-57.2	-171.1	0	112.7	F506 K515 W545	F506-K510 WeakPolarHBondContact O-CE 3.22Å; K510-K515 HydrophobicContact CD-CG 3.96Å; K510-K515 HydrophobicContact CG-CG 4.17Å; K510-W545 HydrophobicContact CB-CE3 4.49Å; K510-W545 HydrophobicContact CB-CZ3 4.38Å; K510-W545 HydrophobicContact CG-CE3 4.47Å; K510-W545 HydrophobicContact CG-CZ3 3.92Å
511	P	90.6	Very high	90.7	Very high	5 Å²	5	44.1 Å²	44.1	3%	0.032	22%	0.217	C	C	.	.			trans	-64.8	144.5	173.8	-7.1	15.1	0	0	0	112.5	S513 V514 W545 K546 M549	P511-S513 VanDerWaalsContact C-N 3.27Å; P511-S513 PolarHBondContact O-N 3.03Å; P511-V514 HydrophobicContact CB-CG2 4.1Å; P511-V514 HydrophobicContact CG-CG2 4.03Å; P511-V514 PolarHBondContact O-N 3.49Å; P511-W545 VanDerWaalsContact CD-CD2 3.41Å; P511-W545 HydrophobicContact CG-CD2 3.91Å; P511-W545 HydrophobicContact CG-CE3 4.31Å; P511-W545 HydrophobicContact CG-CG 4.3Å; P511-W545 HydrophobicContact CG-CZ2 4.26Å; P511-K546 HydrophobicContact CB-CB 4.46Å; P511-K546 HydrophobicContact CB-CG 4.48Å; P511-K546 HydrophobicContact CG-CB 4.43Å; P511-M549 HydrophobicContact CB-CE 4.5Å; P511-M549 HydrophobicContact CB-SD 3.59Å; P511-M549 VanDerWaalsContact CB-SD 3.59Å; P511-M549 HydrophobicContact CG-CB 4.16Å; P511-M549 HydrophobicContact CG-CE 3.78Å; P511-M549 HydrophobicContact CG-CG 4.46Å; P511-M549 HydrophobicContact CG-SD 3.47Å; P511-M549 WeakPolarHBondContact CG-SD 3.33Å
512	D	87.9	Confident	90.6	Very high	91 Å²	91	44.5 Å²	44.5	49%	0.487	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-25.5	-175.7	-64.5	-54.5	0	0	0	113.4	V514 K515 K546	D512-V514 VanDerWaalsContact C-N 3.32Å; D512-V514 PolarHBondContact O-N 3.25Å; D512-K515 VanDerWaalsContact OD1-CE 3.27Å; D512-K515 WeakPolarHBondContact OD1-CE 3.46Å; D512-K515 IonicContact OD1-NZ 3.85Å; D512-K515 PolarHBondContact OD1-NZ 3.15Å; D512-K546 IonicContact OD2-NZ 3.31Å; D512-K546 PolarHBondContact OD2-NZ 2.89Å
513	S	85.6	Confident	90.5	Very high	79 Å²	79	45.3 Å²	45.3	55%	0.552	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	-33.2	176.3	49	0	0	0	0	113	P511	P511-S513 VanDerWaalsContact C-N 3.27Å; P511-S513 PolarHBondContact O-N 3.03Å
514	V	87.5	Confident	90.3	Very high	5 Å²	5	49 Å²	49	3%	0.03	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-15.5	-172	-154.9	0	0	0	0	112.3	P511 D512 K516 L517 Q522 F525 W545 M549	P511-V514 HydrophobicContact CB-CG2 4.1Å; P511-V514 HydrophobicContact CG-CG2 4.03Å; P511-V514 PolarHBondContact O-N 3.49Å; D512-V514 VanDerWaalsContact C-N 3.32Å; D512-V514 PolarHBondContact O-N 3.25Å; V514-K516 PolarHBondContact O-N 2.69Å; V514-L517 HydrophobicContact CG1-CB 4.49Å; V514-L517 HydrophobicContact CG1-CD1 3.73Å; V514-L517 HydrophobicContact CG1-CG 4.33Å; V514-L517 WeakPolarHBondContact O-CB 3.5Å; V514-L517 PolarHBondContact O-N 3.28Å; V514-Q522 HydrophobicContact CG1-CB 4.13Å; V514-Q522 HydrophobicContact CG1-CG 3.7Å; V514-Q522 WeakPolarHBondContact O-CG 3.26Å; V514-F525 HydrophobicContact CG1-CB 4.3Å; V514-F525 HydrophobicContact CG1-CD2 3.94Å; V514-F525 HydrophobicContact CG1-CG 4.39Å; V514-W545 HydrophobicContact CB-CH2 4.45Å; V514-W545 HydrophobicContact CG1-CH2 4.23Å; V514-W545 HydrophobicContact CG2-CH2 4.43Å; V514-W545 HydrophobicContact CG2-CZ2 4.35Å; V514-M549 HydrophobicContact CG2-CE 3.94Å; V514-M549 HydrophobicContact CG2-SD 4.09Å
515	K	83.9	Confident	90.2	Very high	115 Å²	115	53.8 Å²	53.8	50%	0.5	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-27.2	-174.8	-77	-179.2	178.2	173.2	0	115.2	K510 D512	K510-K515 HydrophobicContact CD-CG 3.96Å; K510-K515 HydrophobicContact CG-CG 4.17Å; D512-K515 VanDerWaalsContact OD1-CE 3.27Å; D512-K515 WeakPolarHBondContact OD1-CE 3.46Å; D512-K515 IonicContact OD1-NZ 3.85Å; D512-K515 PolarHBondContact OD1-NZ 3.15Å
516	K	84.5	Confident	90.2	Very high	203 Å²	203	53.8 Å²	53.8	88%	0.883	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-7.5	-177.6	-64	-178.4	-178.9	177.7	0	113.7	V514	V514-K516 PolarHBondContact O-N 2.69Å
517	L	89.1	Confident	90.3	Very high	59 Å²	59	57.1 Å²	57.1	31%	0.309	28%	0.281	S	S	.	.	S	Bend	trans	-80.7	164.8	-178.5	-56.8	-173.6	0	0	0	110.9	V514 Q521 Q522 F525	V514-L517 HydrophobicContact CG1-CB 4.49Å; V514-L517 HydrophobicContact CG1-CD1 3.73Å; V514-L517 HydrophobicContact CG1-CG 4.33Å; V514-L517 WeakPolarHBondContact O-CB 3.5Å; V514-L517 PolarHBondContact O-N 3.28Å; L517-Q521 HydrophobicContact CB-CB 3.87Å; L517-Q521 HydrophobicContact CD1-CB 4.23Å; L517-Q522 HydrophobicContact CB-CG 4.19Å; L517-Q522 PolarHBondContact O-NE2 2.97Å; L517-F525 HydrophobicContact CD1-CD2 3.84Å; L517-F525 HydrophobicContact CD1-CE2 3.5Å
518	S	90.1	Very high	90.3	Very high	33 Å²	33	59.7 Å²	59.7	23%	0.231	30%	0.296	C	S	.	.			trans	-65.3	158.2	171.6	67.4	0	0	0	0	111.1	K520 Q521 Q522	S518-K520 PolarHBondContact O-N 2.89Å; S518-Q521 PolarHBondContact O-N 3.22Å; S518-Q521 VanDerWaalsContact O-N 3.13Å; S518-Q521 WeakPolarHBondContact OG-CG 3.1Å; S518-Q521 PolarHBondContact OG-N 3.43Å; S518-Q521 PolarHBondContact OG-OE1 3.31Å; S518-Q522 WeakPolarHBondContact O-CG 3.48Å; S518-Q522 PolarHBondContact O-N 3.2Å
519	T	91.2	Very high	90.4	Very high	5 Å²	5	58.8 Å²	58.8	3%	0.031	29%	0.292	C	S	.	.	H	α-helix	trans	-55.5	-41.6	177.8	-59	0	0	0	0	110.6	D460 Q521 Q522 V523 C634	D460-T519 PolarHBondContact OD1-OG1 2.96Å; D460-T519 WeakPolarHBondContact OD2-CA 3.3Å; D460-T519 WeakPolarHBondContact OD2-CB 3.16Å; D460-T519 PolarHBondContact OD2-N 3.23Å; D460-T519 PolarHBondContact OD2-OG1 2.96Å; T519-Q521 PolarHBondContact O-N 3.37Å; T519-Q522 WeakPolarHBondContact O-CB 3.36Å; T519-Q522 PolarHBondContact O-N 3.03Å; T519-V523 HydrophobicContact CG2-CG2 4.49Å; T519-V523 VanDerWaalsContact O-CG2 3.31Å; T519-V523 WeakPolarHBondContact O-CG2 3.22Å; T519-V523 PolarHBondContact O-N 3.18Å; T519-C634 PolarHBondContact OG1-SG 3.19Å; T519-C634 VanDerWaalsContact OG1-SG 3.37Å
520	K	91.4	Very high	90.4	Very high	153 Å²	153	58.3 Å²	58.3	67%	0.665	29%	0.29	S	S	*	.	H	α-helix	trans	-58.3	-50.3	175.7	-176	178.2	177.6	179.5	0	112.3	S518 Q522 V523 D524	S518-K520 PolarHBondContact O-N 2.89Å; K520-Q522 VanDerWaalsContact C-N 3.28Å; K520-Q522 PolarHBondContact O-N 3.44Å; K520-V523 WeakPolarHBondContact O-CB 3.31Å; K520-V523 PolarHBondContact O-N 3.48Å; K520-V523 VanDerWaalsContact O-N 3.14Å; K520-D524 VanDerWaalsContact O-CG 3.23Å; K520-D524 PolarHBondContact O-N 3.47Å
521	Q	91.9	Very high	90.4	Very high	90 Å²	90	61.6 Å²	61.6	42%	0.421	31%	0.309	S	S	.	.	H	α-helix	trans	-62.4	-38.1	178.3	-71.7	172.5	-35.9	0	0	111.6	L517 S518 T519 V523 D524 F525	L517-Q521 HydrophobicContact CB-CB 3.87Å; L517-Q521 HydrophobicContact CD1-CB 4.23Å; S518-Q521 PolarHBondContact O-N 3.22Å; S518-Q521 VanDerWaalsContact O-N 3.13Å; S518-Q521 WeakPolarHBondContact OG-CG 3.1Å; S518-Q521 PolarHBondContact OG-N 3.43Å; S518-Q521 PolarHBondContact OG-OE1 3.31Å; T519-Q521 PolarHBondContact O-N 3.37Å; Q521-V523 VanDerWaalsContact C-N 3.31Å; Q521-V523 PolarHBondContact O-N 3.25Å; Q521-D524 PolarHBondContact O-N 3.23Å; Q521-F525 WeakPolarHBondContact O-CD2 3.41Å; Q521-F525 PolarHBondContact O-N 3Å; Q521-F525 VanDerWaalsContact O-N 3.12Å
522	Q	93.1	Very high	90.2	Very high	9 Å²	9	63.5 Å²	63.5	4%	0.042	32%	0.322	C	S	.	.	H	α-helix	trans	-61.4	-40.8	175.2	-68.4	174.9	41	0	0	111.9	F506 V514 L517 S518 T519 K520 F525 F526 C634	F506-Q522 HydrophobicContact CE2-CB 3.79Å; F506-Q522 HydrophobicContact CZ-CB 3.79Å; V514-Q522 HydrophobicContact CG1-CB 4.13Å; V514-Q522 HydrophobicContact CG1-CG 3.7Å; V514-Q522 WeakPolarHBondContact O-CG 3.26Å; L517-Q522 HydrophobicContact CB-CG 4.19Å; L517-Q522 PolarHBondContact O-NE2 2.97Å; S518-Q522 WeakPolarHBondContact O-CG 3.48Å; S518-Q522 PolarHBondContact O-N 3.2Å; T519-Q522 WeakPolarHBondContact O-CB 3.36Å; T519-Q522 PolarHBondContact O-N 3.03Å; K520-Q522 VanDerWaalsContact C-N 3.28Å; K520-Q522 PolarHBondContact O-N 3.44Å; Q522-F525 PolarHBondContact O-N 3.47Å; Q522-F526 WeakPolarHBondContact O-CB 3.39Å; Q522-F526 PolarHBondContact O-N 3.04Å; Q522-C634 PolarHBondContact OE1-SG 3.34Å
523	V	93.8	Very high	89.9	Confident	17 Å²	17	60.3 Å²	60.3	10%	0.103	31%	0.311	C	S	.	.	H	α-helix	trans	-64.6	-44.5	176.1	171.5	0	0	0	0	110.9	F506 T519 K520 Q521 F525 F526 E527 F625 L632	F506-V523 HydrophobicContact CE2-CG2 4.19Å; F506-V523 HydrophobicContact CZ-CG2 4.21Å; T519-V523 HydrophobicContact CG2-CG2 4.49Å; T519-V523 VanDerWaalsContact O-CG2 3.31Å; T519-V523 WeakPolarHBondContact O-CG2 3.22Å; T519-V523 PolarHBondContact O-N 3.18Å; K520-V523 WeakPolarHBondContact O-CB 3.31Å; K520-V523 PolarHBondContact O-N 3.48Å; K520-V523 VanDerWaalsContact O-N 3.14Å; Q521-V523 VanDerWaalsContact C-N 3.31Å; Q521-V523 PolarHBondContact O-N 3.25Å; V523-F525 VanDerWaalsContact C-N 3.31Å; V523-F525 PolarHBondContact O-N 3.03Å; V523-F526 WeakPolarHBondContact O-CA 3.33Å; V523-F526 WeakPolarHBondContact O-CB 3.14Å; V523-F526 PolarHBondContact O-N 2.78Å; V523-E527 PolarHBondContact O-N 2.72Å; V523-F625 HydrophobicContact CG1-CE1 4.03Å; V523-F625 HydrophobicContact CG1-CZ 3.72Å; V523-L632 HydrophobicContact CG1-CD1 4.4Å; V523-L632 HydrophobicContact CG2-CB 3.83Å; V523-L632 HydrophobicContact CG2-CD1 4.16Å
524	D	92.7	Very high	89.9	Confident	79 Å²	79	60.2 Å²	60.2	42%	0.422	30%	0.302	S	S	.	.	H	α-helix	trans	-59.9	-39.3	178.1	-57.9	-20.3	0	0	0	111.8	K520 Q521	K520-D524 VanDerWaalsContact O-CG 3.23Å; K520-D524 PolarHBondContact O-N 3.47Å; Q521-D524 PolarHBondContact O-N 3.23Å
525	F	91.9	Very high	89.8	Confident	100 Å²	100	61.1 Å²	61.1	44%	0.439	31%	0.309	S	S	.	.	H	α-helix	trans	-70.8	-31.7	173.4	-79.5	-71.4	0	0	0	112.8	V514 L517 Q521 Q522 V523 T528 W545	V514-F525 HydrophobicContact CG1-CB 4.3Å; V514-F525 HydrophobicContact CG1-CD2 3.94Å; V514-F525 HydrophobicContact CG1-CG 4.39Å; L517-F525 HydrophobicContact CD1-CD2 3.84Å; L517-F525 HydrophobicContact CD1-CE2 3.5Å; Q521-F525 WeakPolarHBondContact O-CD2 3.41Å; Q521-F525 PolarHBondContact O-N 3Å; Q521-F525 VanDerWaalsContact O-N 3.12Å; Q522-F525 PolarHBondContact O-N 3.47Å; V523-F525 VanDerWaalsContact C-N 3.31Å; V523-F525 PolarHBondContact O-N 3.03Å; F525-T528 PolarHBondContact O-OG1 3.33Å; F525-W545 HydrophobicContact CB-CZ2 3.97Å
526	F	94	Very high	90.2	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-72.7	-31.4	-179.6	-177.3	-106.1	0	0	0	112.4	A502 D505 F506 Q522 V523 T528 F529 W530 W545 F625 I628 L632	A502-F526 HydrophobicContact CB-CE1 3.99Å; A502-F526 HydrophobicContact CB-CZ 4.17Å; D505-F526 HydrophobicContact CB-CE2 3.91Å; D505-F526 HydrophobicContact CB-CZ 4.12Å; F506-F526 HydrophobicContact CD2-CB 4.31Å; F506-F526 HydrophobicContact CD2-CD2 4.38Å; F506-F526 HydrophobicContact CD2-CG 4.15Å; Q522-F526 WeakPolarHBondContact O-CB 3.39Å; Q522-F526 PolarHBondContact O-N 3.04Å; V523-F526 WeakPolarHBondContact O-CA 3.33Å; V523-F526 WeakPolarHBondContact O-CB 3.14Å; V523-F526 PolarHBondContact O-N 2.78Å; F526-T528 VanDerWaalsContact C-N 3.29Å; F526-T528 PolarHBondContact O-N 3.49Å; F526-F529 AromaticContact CD2-CD1 3.95Å; F526-F529 HydrophobicContact CD2-CD1 3.95Å; F526-F529 AromaticContact CE2-CD1 3.45Å; F526-F529 HydrophobicContact CE2-CD1 3.45Å; F526-F529 VanDerWaalsContact CE2-CD1 3.45Å; F526-F529 AromaticContact CE2-CE1 3.87Å; F526-F529 HydrophobicContact CE2-CE1 3.87Å; F526-F529 HydrophobicContact CZ-CD1 4.03Å; F526-F529 HydrophobicContact CZ-CE1 4.3Å; F526-F529 WeakPolarHBondContact O-CB 3.47Å; F526-F529 PolarHBondContact O-N 3.01Å; F526-W530 HydrophobicContact CE1-CE3 4.14Å; F526-W530 HydrophobicContact CZ-CE3 4.16Å; F526-W530 PolarHBondContact O-N 3.3Å; F526-W545 HydrophobicContact CB-CH2 3.94Å; F526-W545 HydrophobicContact CB-CZ2 3.88Å; F526-W545 HydrophobicContact CB-CZ3 4.36Å; F526-W545 HydrophobicContact CD2-CB 4.43Å; F526-W545 AromaticContact CD2-CD2 3.57Å; F526-W545 HydrophobicContact CD2-CD2 3.57Å; F526-W545 AromaticContact CD2-CE2 3.89Å; F526-W545 AromaticContact CD2-CE3 3.65Å; F526-W545 HydrophobicContact CD2-CE3 3.65Å; F526-W545 AromaticContact CD2-CG 3.92Å; F526-W545 HydrophobicContact CD2-CG 3.92Å; F526-W545 HydrophobicContact CD2-CH2 4.37Å; F526-W545 HydrophobicContact CD2-CZ2 4.3Å; F526-W545 HydrophobicContact CD2-CZ3 4.06Å; F526-W545 HydrophobicContact CE2-CB 4.3Å; F526-W545 HydrophobicContact CE2-CD2 4.26Å; F526-W545 HydrophobicContact CE2-CE3 4.31Å; F526-W545 HydrophobicContact CE2-CG 4.27Å; F526-F625 AromaticContact CD1-CE2 3.69Å; F526-F625 HydrophobicContact CD1-CE2 3.69Å; F526-F625 HydrophobicContact CD1-CZ 4.25Å; F526-F625 HydrophobicContact CE1-CE2 4.13Å; F526-I628 HydrophobicContact CE1-CD1 4.45Å; F526-L632 HydrophobicContact CD1-CD1 3.48Å; F526-L632 VanDerWaalsContact CD1-CD1 3.48Å; F526-L632 HydrophobicContact CE1-CD1 3.8Å; F526-L632 HydrophobicContact CG-CD1 4.47Å
527	E	94.4	Very high	90.5	Very high	71 Å²	71	46.2 Å²	46.2	33%	0.332	24%	0.244	S	C	.	.	H	α-helix	trans	-49.9	-48.4	173.6	-175.7	166.9	-172.6	0	0	111.9	V523 F529 W530 D531 F625	V523-E527 PolarHBondContact O-N 2.72Å; E527-F529 PolarHBondContact O-N 3.33Å; E527-F529 VanDerWaalsContact O-N 3.14Å; E527-W530 PolarHBondContact O-N 3.48Å; E527-D531 PolarHBondContact O-N 3.42Å; E527-F625 HydrophobicContact CB-CD1 3.71Å; E527-F625 HydrophobicContact CB-CD2 4.44Å; E527-F625 HydrophobicContact CB-CE1 3.43Å; E527-F625 VanDerWaalsContact CB-CE1 3.43Å; E527-F625 HydrophobicContact CB-CE2 4.23Å; E527-F625 HydrophobicContact CB-CG 4.19Å; E527-F625 HydrophobicContact CB-CZ 3.7Å; E527-F625 HydrophobicContact CG-CB 4.38Å; E527-F625 HydrophobicContact CG-CD1 3.37Å; E527-F625 HydrophobicContact CG-CE1 3.65Å; E527-F625 HydrophobicContact CG-CG 3.83Å; E527-F625 HydrophobicContact CG-CZ 4.32Å
528	T	91.7	Very high	90.4	Very high	73 Å²	73	43.5 Å²	43.5	45%	0.448	23%	0.231	S	C	.	.	H	α-helix	trans	-59.3	-31.2	179.2	67.1	0	0	0	0	113.8	F525 F526 S532	F525-T528 PolarHBondContact O-OG1 3.33Å; F526-T528 VanDerWaalsContact C-N 3.29Å; F526-T528 PolarHBondContact O-N 3.49Å; T528-S532 WeakPolarHBondContact O-CB 3.34Å; T528-S532 PolarHBondContact O-N 3.31Å
529	F	91.5	Very high	90.4	Very high	5 Å²	5	44 Å²	44	2%	0.022	23%	0.229	C	C	.	.	H	α-helix	trans	-75.6	-43.4	174.6	165.2	-106.8	0	0	0	110.9	D505 F526 E527 D531 S532 E534 W545 W548	D505-F529 HydrophobicContact CB-CE1 4.38Å; F526-F529 AromaticContact CD2-CD1 3.95Å; F526-F529 HydrophobicContact CD2-CD1 3.95Å; F526-F529 AromaticContact CE2-CD1 3.45Å; F526-F529 HydrophobicContact CE2-CD1 3.45Å; F526-F529 VanDerWaalsContact CE2-CD1 3.45Å; F526-F529 AromaticContact CE2-CE1 3.87Å; F526-F529 HydrophobicContact CE2-CE1 3.87Å; F526-F529 HydrophobicContact CZ-CD1 4.03Å; F526-F529 HydrophobicContact CZ-CE1 4.3Å; F526-F529 WeakPolarHBondContact O-CB 3.47Å; F526-F529 PolarHBondContact O-N 3.01Å; E527-F529 PolarHBondContact O-N 3.33Å; E527-F529 VanDerWaalsContact O-N 3.14Å; F529-D531 VanDerWaalsContact C-N 3.33Å; F529-D531 PolarHBondContact O-N 3.18Å; F529-S532 WeakPolarHBondContact O-CB 3.44Å; F529-S532 PolarHBondContact O-N 3.28Å; F529-S532 PolarHBondContact O-OG 2.91Å; F529-E534 HydrophobicContact CE2-CB 4.21Å; F529-W545 VanDerWaalsContact CB-CD1 3.44Å; F529-W545 HydrophobicContact CB-CG 4.34Å; F529-W545 HydrophobicContact CD1-CB 3.97Å; F529-W545 HydrophobicContact CD1-CG 4.15Å; F529-W545 HydrophobicContact CE1-CB 4.05Å; F529-W545 HydrophobicContact CG-CB 4.21Å; F529-W545 AromaticContact CG-CD1 3.58Å; F529-W545 HydrophobicContact CG-CG 4.14Å; F529-W545 HydrophobicContact CZ-CB 4.37Å; F529-W548 HydrophobicContact CB-CD2 4.32Å; F529-W548 HydrophobicContact CB-CE3 3.83Å; F529-W548 HydrophobicContact CB-CH2 4.27Å; F529-W548 HydrophobicContact CB-CZ3 3.82Å; F529-W548 HydrophobicContact CD2-CB 3.81Å; F529-W548 AromaticContact CD2-CD2 3.68Å; F529-W548 HydrophobicContact CD2-CD2 3.68Å; F529-W548 AromaticContact CD2-CE3 3.89Å; F529-W548 HydrophobicContact CD2-CE3 3.89Å; F529-W548 AromaticContact CD2-CG 3.66Å; F529-W548 HydrophobicContact CD2-CG 3.66Å; F529-W548 HydrophobicContact CE2-CB 3.91Å; F529-W548 HydrophobicContact CE2-CG 4.12Å; F529-W548 HydrophobicContact CG-CD2 4.48Å; F529-W548 HydrophobicContact CG-CE3 4.3Å
530	W	90.9	Very high	90.1	Very high	3 Å²	3	46.9 Å²	46.9	1%	0.011	25%	0.247	C	C	.	.	H	α-helix	trans	-61.7	-42	-179.9	-170.6	-96	0	0	0	112.8	A502 F526 E527 S532 R536 V623 F625 I628	A502-W530 HydrophobicContact CB-CE3 4.23Å; A502-W530 HydrophobicContact CB-CH2 4.09Å; A502-W530 HydrophobicContact CB-CZ3 3.63Å; F526-W530 HydrophobicContact CE1-CE3 4.14Å; F526-W530 HydrophobicContact CZ-CE3 4.16Å; F526-W530 PolarHBondContact O-N 3.3Å; E527-W530 PolarHBondContact O-N 3.48Å; W530-S532 VanDerWaalsContact C-N 3.31Å; W530-R536 VanDerWaalsContact CH2-CZ 3.5Å; W530-R536 HydrophobicContact CZ3-CG 4.38Å; W530-R536 VanDerWaalsContact NE1-NH2 3.12Å; W530-V623 PolarHBondContact NE1-O 2.9Å; W530-F625 HydrophobicContact CB-CD2 3.65Å; W530-F625 HydrophobicContact CB-CE2 4.19Å; W530-F625 AromaticContact CD1-CD2 3.77Å; W530-F625 HydrophobicContact CD2-CD2 4.42Å; W530-F625 HydrophobicContact CG-CB 4.42Å; W530-F625 AromaticContact CG-CD2 3.67Å; W530-F625 HydrophobicContact CG-CD2 3.67Å; W530-F625 HydrophobicContact CG-CE2 4.48Å; W530-I628 HydrophobicContact CD2-CD1 3.43Å; W530-I628 VanDerWaalsContact CD2-CD1 3.43Å; W530-I628 HydrophobicContact CE3-CD1 3.65Å; W530-I628 HydrophobicContact CG-CD1 4.07Å; W530-I628 HydrophobicContact CH2-CD1 3.7Å; W530-I628 HydrophobicContact CZ2-CD1 3.46Å; W530-I628 VanDerWaalsContact CZ2-CD1 3.46Å; W530-I628 HydrophobicContact CZ2-CG1 4.19Å; W530-I628 HydrophobicContact CZ2-CG2 4.44Å; W530-I628 HydrophobicContact CZ3-CD1 3.79Å
531	D	90.1	Very high	89.6	Confident	99 Å²	99	42.3 Å²	42.3	53%	0.529	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-13.4	-178.6	-65.6	-15.5	0	0	0	113	E527 F529 G533	E527-D531 PolarHBondContact O-N 3.42Å; F529-D531 VanDerWaalsContact C-N 3.33Å; F529-D531 PolarHBondContact O-N 3.18Å; D531-G533 PolarHBondContact O-N 3.47Å; D531-G533 VanDerWaalsContact O-N 3.12Å
532	S	87	Confident	89.5	Confident	45 Å²	45	38.8 Å²	38.8	32%	0.315	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-12.4	179.9	72.3	0	0	0	0	114.4	T528 F529 W530 E534	T528-S532 WeakPolarHBondContact O-CB 3.34Å; T528-S532 PolarHBondContact O-N 3.31Å; F529-S532 WeakPolarHBondContact O-CB 3.44Å; F529-S532 PolarHBondContact O-N 3.28Å; F529-S532 PolarHBondContact O-OG 2.91Å; W530-S532 VanDerWaalsContact C-N 3.31Å; S532-E534 PolarHBondContact O-N 3.46Å; S532-E534 WeakPolarHBondContact OG-CB 2.79Å; S532-E534 VanDerWaalsContact OG-CG 3.31Å; S532-E534 WeakPolarHBondContact OG-CG 3.47Å; S532-E534 PolarHBondContact OG-N 3.38Å
533	G	81.1	Confident	89.2	Confident	23 Å²	23	44.5 Å²	44.5	24%	0.237	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.6	12.5	-177.1	0	0	0	0	0	114	D531 R604 K607	D531-G533 PolarHBondContact O-N 3.47Å; D531-G533 VanDerWaalsContact O-N 3.12Å; G533-R604 VanDerWaalsContact CA-NH2 3.32Å; G533-K607 PolarHBondContact O-NZ 3.27Å
534	E	85.3	Confident	89	Confident	78 Å²	78	43.8 Å²	43.8	36%	0.364	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-72.1	156.8	176.7	-75.1	-78.7	-178.3	0	0	112.4	F529 S532 R536 R604	F529-E534 HydrophobicContact CE2-CB 4.21Å; S532-E534 PolarHBondContact O-N 3.46Å; S532-E534 WeakPolarHBondContact OG-CB 2.79Å; S532-E534 VanDerWaalsContact OG-CG 3.31Å; S532-E534 WeakPolarHBondContact OG-CG 3.47Å; S532-E534 PolarHBondContact OG-N 3.38Å; E534-R536 PolarHBondContact O-N 2.91Å; E534-R604 PolarHBondContact O-NH2 3.3Å
535	A	87.1	Confident	88.9	Confident	23 Å²	23	40 Å²	40	19%	0.19	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-68.2	126.2	-179.2	0	0	0	0	0	111	E539 V540 A542	A535-E539 WeakPolarHBondContact CA-OE2 3.28Å; A535-E539 HydrophobicContact CB-CB 4.29Å; A535-V540 WeakPolarHBondContact CB-O 3.43Å; A535-A542 HydrophobicContact CB-CB 4.07Å; A535-A542 WeakPolarHBondContact O-CB 3.33Å
536	R	90.6	Very high	88.8	Confident	5 Å²	5	39 Å²	39	2%	0.019	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-92	163.1	-175.4	-58.2	169.9	179.5	168.4	-0.7	111.4	W530 E534 G538 E539 A542	W530-R536 VanDerWaalsContact CH2-CZ 3.5Å; W530-R536 HydrophobicContact CZ3-CG 4.38Å; W530-R536 VanDerWaalsContact NE1-NH2 3.12Å; E534-R536 PolarHBondContact O-N 2.91Å; R536-G538 PolarHBondContact O-N 3.48Å; R536-E539 PolarHBondContact N-OE2 3.02Å; R536-E539 VanDerWaalsContact O-CB 3.26Å; R536-E539 WeakPolarHBondContact O-CB 3.45Å; R536-E539 PolarHBondContact O-N 3.01Å; R536-A542 WeakPolarHBondContact O-CB 3.44Å
537	V	91.3	Very high	88.6	Confident	0 Å²	0	41 Å²	41	0%	0	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51	128	179.6	170.1	0	0	0	0	112	Q501 I504 D505 F509 V726 M729	Q501-V537 PolarHBondContact NE2-O 3.38Å; I504-V537 HydrophobicContact CB-CG1 4.41Å; I504-V537 HydrophobicContact CD1-CG1 4.47Å; I504-V537 HydrophobicContact CG2-CB 4.28Å; I504-V537 HydrophobicContact CG2-CG1 3.77Å; I504-V537 HydrophobicContact CG2-CG2 4.12Å; D505-V537 VanDerWaalsContact CG-CG2 3.42Å; D505-V537 VanDerWaalsContact OD1-CG2 3.3Å; D505-V537 WeakPolarHBondContact OD1-CG2 3.48Å; D505-V537 VanDerWaalsContact OD2-CG2 3.32Å; D505-V537 WeakPolarHBondContact OD2-CG2 3.38Å; D505-V537 PolarHBondContact OD2-N 3.25Å; F509-V537 HydrophobicContact CD2-CG2 3.93Å; F509-V537 HydrophobicContact CE2-CG2 3.73Å; V537-V726 HydrophobicContact CG1-CB 4.41Å; V537-V726 HydrophobicContact CG1-CG1 4.21Å; V537-V726 HydrophobicContact CG1-CG2 4Å; V537-M729 HydrophobicContact CB-CE 4.5Å; V537-M729 HydrophobicContact CB-SD 4.36Å; V537-M729 HydrophobicContact CG1-SD 4.29Å; V537-M729 HydrophobicContact CG2-CE 3.73Å; V537-M729 HydrophobicContact CG2-SD 4.18Å
538	G	88.4	Confident	88.3	Confident	2 Å²	2	39 Å²	39	2%	0.021	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.9	-17.9	-176.4	0	0	0	0	0	114.8	R536 F722 N725 V726	R536-G538 PolarHBondContact O-N 3.48Å; G538-F722 WeakPolarHBondContact O-CA 3.39Å; G538-F722 WeakPolarHBondContact O-CD2 3.13Å; G538-N725 WeakPolarHBondContact O-CB 3.46Å; G538-N725 PolarHBondContact O-ND2 3.39Å; G538-V726 VanDerWaalsContact CA-CG2 3.5Å
539	E	89.1	Confident	88.1	Confident	43 Å²	43	36.6 Å²	36.6	20%	0.201	21%	0.212	C	C	.	.	S	Bend	trans	-81.8	159.3	174	-61.4	169.1	-169.2	0	0	111.2	Q501 A535 R536 A542	Q501-E539 PolarHBondContact NE2-OE1 3.17Å; A535-E539 WeakPolarHBondContact CA-OE2 3.28Å; A535-E539 HydrophobicContact CB-CB 4.29Å; R536-E539 PolarHBondContact N-OE2 3.02Å; R536-E539 VanDerWaalsContact O-CB 3.26Å; R536-E539 WeakPolarHBondContact O-CB 3.45Å; R536-E539 PolarHBondContact O-N 3.01Å; E539-A542 WeakPolarHBondContact O-CB 3.08Å; E539-A542 PolarHBondContact O-N 2.67Å
540	V	84.6	Confident	87.9	Confident	66 Å²	66	38.5 Å²	38.5	40%	0.4	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	135.3	177.3	-177.7	0	0	0	0	109.1	A535 A542	A535-V540 WeakPolarHBondContact CB-O 3.43Å; V540-A542 VanDerWaalsContact C-N 3.28Å; V540-A542 PolarHBondContact O-N 3.19Å
541	G	81.9	Confident	87.5	Confident	57 Å²	57	39.8 Å²	39.8	59%	0.588	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.1	2.5	180	0	0	0	0	0	115.7
542	A	88.4	Confident	87.2	Confident	17 Å²	17	40 Å²	40	14%	0.14	23%	0.228	C	C	.	.			trans	-64.2	132.8	-179.8	0	0	0	0	0	113.1	A535 R536 E539 V540 M729	A535-A542 HydrophobicContact CB-CB 4.07Å; A535-A542 WeakPolarHBondContact O-CB 3.33Å; R536-A542 WeakPolarHBondContact O-CB 3.44Å; E539-A542 WeakPolarHBondContact O-CB 3.08Å; E539-A542 PolarHBondContact O-N 2.67Å; V540-A542 VanDerWaalsContact C-N 3.28Å; V540-A542 PolarHBondContact O-N 3.19Å; A542-M729 HydrophobicContact CB-CE 3.81Å; A542-M729 HydrophobicContact CB-SD 3.68Å; A542-M729 WeakPolarHBondContact O-CE 3.45Å
543	R	86.6	Confident	86.9	Confident	128 Å²	128	44.6 Å²	44.6	48%	0.483	24%	0.244	S	C	.	.			trans	-118.6	-14.3	-179.5	-60	179.8	-179	-178.2	-0.4	113.7	A547	R543-A547 HydrophobicContact CB-CB 3.79Å; R543-A547 WeakPolarHBondContact O-CB 3.4Å
544	G	89.5	Confident	86.9	Confident	2 Å²	2	53.2 Å²	53.2	2%	0.021	27%	0.27	C	S	.	.			trans	81	164	-179.4	0	0	0	0	0	114.9	D505 K546 A547 W548	D505-G544 WeakPolarHBondContact OD1-CA 3.48Å; G544-K546 PolarHBondContact O-N 3.05Å; G544-A547 PolarHBondContact O-N 3.33Å; G544-W548 PolarHBondContact O-N 3.32Å
545	W	91.9	Very high	86	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-55.7	-44.9	-169.5	179.2	33.9	0	0	0	114.8	D505 F506 K510 P511 V514 F525 F526 F529 A547 W548 M549	D505-W545 PolarHBondContact OD1-N 3.19Å; F506-W545 AromaticContact CD2-CZ3 3.97Å; F506-W545 HydrophobicContact CD2-CZ3 3.97Å; F506-W545 HydrophobicContact CE2-CZ3 4.3Å; K510-W545 HydrophobicContact CB-CE3 4.49Å; K510-W545 HydrophobicContact CB-CZ3 4.38Å; K510-W545 HydrophobicContact CG-CE3 4.47Å; K510-W545 HydrophobicContact CG-CZ3 3.92Å; P511-W545 VanDerWaalsContact CD-CD2 3.41Å; P511-W545 HydrophobicContact CG-CD2 3.91Å; P511-W545 HydrophobicContact CG-CE3 4.31Å; P511-W545 HydrophobicContact CG-CG 4.3Å; P511-W545 HydrophobicContact CG-CZ2 4.26Å; V514-W545 HydrophobicContact CB-CH2 4.45Å; V514-W545 HydrophobicContact CG1-CH2 4.23Å; V514-W545 HydrophobicContact CG2-CH2 4.43Å; V514-W545 HydrophobicContact CG2-CZ2 4.35Å; F525-W545 HydrophobicContact CB-CZ2 3.97Å; F526-W545 HydrophobicContact CB-CH2 3.94Å; F526-W545 HydrophobicContact CB-CZ2 3.88Å; F526-W545 HydrophobicContact CB-CZ3 4.36Å; F526-W545 HydrophobicContact CD2-CB 4.43Å; F526-W545 AromaticContact CD2-CD2 3.57Å; F526-W545 HydrophobicContact CD2-CD2 3.57Å; F526-W545 AromaticContact CD2-CE2 3.89Å; F526-W545 AromaticContact CD2-CE3 3.65Å; F526-W545 HydrophobicContact CD2-CE3 3.65Å; F526-W545 AromaticContact CD2-CG 3.92Å; F526-W545 HydrophobicContact CD2-CG 3.92Å; F526-W545 HydrophobicContact CD2-CH2 4.37Å; F526-W545 HydrophobicContact CD2-CZ2 4.3Å; F526-W545 HydrophobicContact CD2-CZ3 4.06Å; F526-W545 HydrophobicContact CE2-CB 4.3Å; F526-W545 HydrophobicContact CE2-CD2 4.26Å; F526-W545 HydrophobicContact CE2-CE3 4.31Å; F526-W545 HydrophobicContact CE2-CG 4.27Å; F529-W545 VanDerWaalsContact CB-CD1 3.44Å; F529-W545 HydrophobicContact CB-CG 4.34Å; F529-W545 HydrophobicContact CD1-CB 3.97Å; F529-W545 HydrophobicContact CD1-CG 4.15Å; F529-W545 HydrophobicContact CE1-CB 4.05Å; F529-W545 HydrophobicContact CG-CB 4.21Å; F529-W545 AromaticContact CG-CD1 3.58Å; F529-W545 HydrophobicContact CG-CG 4.14Å; F529-W545 HydrophobicContact CZ-CB 4.37Å; W545-A547 PolarHBondContact O-N 2.94Å; W545-W548 PolarHBondContact O-N 2.94Å; W545-M549 HydrophobicContact CZ2-CE 4.07Å; W545-M549 PolarHBondContact O-N 3Å
546	K	89.9	Confident	84.5	Confident	80 Å²	80	53 Å²	53	35%	0.348	29%	0.291	S	S	.	.	H	α-helix	trans	-60.6	-41.6	179.1	175.1	171	174.7	170.8	0	113	F509 P511 D512 G544 T550	F509-K546 WeakPolarHBondContact O-CA 3.38Å; F509-K546 WeakPolarHBondContact O-CB 3.42Å; F509-K546 PolarHBondContact O-N 3.24Å; P511-K546 HydrophobicContact CB-CB 4.46Å; P511-K546 HydrophobicContact CB-CG 4.48Å; P511-K546 HydrophobicContact CG-CB 4.43Å; D512-K546 IonicContact OD2-NZ 3.31Å; D512-K546 PolarHBondContact OD2-NZ 2.89Å; G544-K546 PolarHBondContact O-N 3.05Å; K546-T550 WeakPolarHBondContact O-CB 3.47Å; K546-T550 PolarHBondContact O-N 3.07Å; K546-T550 VanDerWaalsContact O-N 3.12Å; K546-T550 PolarHBondContact O-OG1 3.05Å
547	A	88.6	Confident	82.4	Confident	41 Å²	41	64.9 Å²	64.9	34%	0.339	34%	0.336	S	S	.	.	H	α-helix	trans	-67.3	-42.6	-180	0	0	0	0	0	110.7	R543 G544 W545 T550 Q551	R543-A547 HydrophobicContact CB-CB 3.79Å; R543-A547 WeakPolarHBondContact O-CB 3.4Å; G544-A547 PolarHBondContact O-N 3.33Å; W545-A547 PolarHBondContact O-N 2.94Å; A547-T550 PolarHBondContact O-N 3.22Å; A547-Q551 WeakPolarHBondContact O-CB 3.4Å; A547-Q551 PolarHBondContact O-N 3.33Å
548	W	90	Very high	80.4	Confident	30 Å²	30	68 Å²	68	11%	0.114	36%	0.355	C	S	.	.	H	α-helix	trans	-60.5	-48.6	175.1	175.2	85.5	0	0	0	112.5	F529 G544 W545 T550 Q551 Q552	F529-W548 HydrophobicContact CB-CD2 4.32Å; F529-W548 HydrophobicContact CB-CE3 3.83Å; F529-W548 HydrophobicContact CB-CH2 4.27Å; F529-W548 HydrophobicContact CB-CZ3 3.82Å; F529-W548 HydrophobicContact CD2-CB 3.81Å; F529-W548 AromaticContact CD2-CD2 3.68Å; F529-W548 HydrophobicContact CD2-CD2 3.68Å; F529-W548 AromaticContact CD2-CE3 3.89Å; F529-W548 HydrophobicContact CD2-CE3 3.89Å; F529-W548 AromaticContact CD2-CG 3.66Å; F529-W548 HydrophobicContact CD2-CG 3.66Å; F529-W548 HydrophobicContact CE2-CB 3.91Å; F529-W548 HydrophobicContact CE2-CG 4.12Å; F529-W548 HydrophobicContact CG-CD2 4.48Å; F529-W548 HydrophobicContact CG-CE3 4.3Å; G544-W548 PolarHBondContact O-N 3.32Å; W545-W548 PolarHBondContact O-N 2.94Å; W548-T550 VanDerWaalsContact C-N 3.32Å; W548-T550 PolarHBondContact O-N 3.48Å; W548-Q551 WeakPolarHBondContact O-CA 3.33Å; W548-Q551 WeakPolarHBondContact O-CB 3.29Å; W548-Q551 PolarHBondContact O-N 3.13Å; W548-Q552 HydrophobicContact CD2-CG 3.96Å; W548-Q552 HydrophobicContact CE3-CG 4.38Å; W548-Q552 HydrophobicContact CG-CG 4.5Å; W548-Q552 HydrophobicContact CH2-CG 4.2Å; W548-Q552 HydrophobicContact CZ2-CG 3.76Å; W548-Q552 HydrophobicContact CZ3-CG 4.48Å; W548-Q552 WeakPolarHBondContact O-CG 3.49Å; W548-Q552 PolarHBondContact O-N 3.41Å
549	M	86.9	Confident	78.3	Confident	21 Å²	21	76.4 Å²	76.4	10%	0.103	39%	0.394	C	S	.	.	H	α-helix	trans	-61.2	-42.5	179.9	-174.1	177.4	-77.2	0	0	111.4	P511 V514 W545 Q551 Q552 E553	P511-M549 HydrophobicContact CB-CE 4.5Å; P511-M549 HydrophobicContact CB-SD 3.59Å; P511-M549 VanDerWaalsContact CB-SD 3.59Å; P511-M549 HydrophobicContact CG-CB 4.16Å; P511-M549 HydrophobicContact CG-CE 3.78Å; P511-M549 HydrophobicContact CG-CG 4.46Å; P511-M549 HydrophobicContact CG-SD 3.47Å; P511-M549 WeakPolarHBondContact CG-SD 3.33Å; V514-M549 HydrophobicContact CG2-CE 3.94Å; V514-M549 HydrophobicContact CG2-SD 4.09Å; W545-M549 HydrophobicContact CZ2-CE 4.07Å; W545-M549 PolarHBondContact O-N 3Å; M549-Q551 PolarHBondContact O-N 3.5Å; M549-Q552 PolarHBondContact O-N 3.06Å; M549-E553 WeakPolarHBondContact O-CG 3.5Å; M549-E553 PolarHBondContact O-N 3.39Å
550	T	86.4	Confident	76.2	Confident	45 Å²	45	79.7 Å²	79.7	28%	0.276	42%	0.418	S	S	.	.	H	α-helix	trans	-62.1	-33.4	175.8	-52.8	0	0	0	0	111.9	K546 A547 W548 R554	K546-T550 WeakPolarHBondContact O-CB 3.47Å; K546-T550 PolarHBondContact O-N 3.07Å; K546-T550 VanDerWaalsContact O-N 3.12Å; K546-T550 PolarHBondContact O-OG1 3.05Å; A547-T550 PolarHBondContact O-N 3.22Å; W548-T550 VanDerWaalsContact C-N 3.32Å; W548-T550 PolarHBondContact O-N 3.48Å; T550-R554 WeakPolarHBondContact O-CD 3.46Å; T550-R554 WeakPolarHBondContact O-CG 3.09Å; T550-R554 PolarHBondContact O-N 3.16Å
551	Q	83.9	Confident	74	Confident	31 Å²	31	80.3 Å²	80.3	15%	0.145	42%	0.424	C	S	.	.	H	α-helix	trans	-73.7	-42.4	178	-176.2	-175.6	-37.6	0	0	111.8	A547 W548 M549 R554 G555 G556 V558	A547-Q551 WeakPolarHBondContact O-CB 3.4Å; A547-Q551 PolarHBondContact O-N 3.33Å; W548-Q551 WeakPolarHBondContact O-CA 3.33Å; W548-Q551 WeakPolarHBondContact O-CB 3.29Å; W548-Q551 PolarHBondContact O-N 3.13Å; M549-Q551 PolarHBondContact O-N 3.5Å; Q551-R554 PolarHBondContact O-N 2.99Å; Q551-R554 VanDerWaalsContact O-N 3.15Å; Q551-G555 PolarHBondContact O-N 2.96Å; Q551-G556 PolarHBondContact NE2-O 3.45Å; Q551-G556 VanDerWaalsContact NE2-O 3.15Å; Q551-G556 PolarHBondContact O-N 2.77Å; Q551-V558 HydrophobicContact CG-CG2 4.31Å
552	Q	82.4	Confident	71.9	Confident	103 Å²	103	82.6 Å²	82.6	48%	0.481	44%	0.437	S	S	.	.	H	α-helix	trans	-61.5	-43.3	175.4	-69.5	-60.5	-31.4	0	0	111.5	W548 M549 R554 G555	W548-Q552 HydrophobicContact CD2-CG 3.96Å; W548-Q552 HydrophobicContact CE3-CG 4.38Å; W548-Q552 HydrophobicContact CG-CG 4.5Å; W548-Q552 HydrophobicContact CH2-CG 4.2Å; W548-Q552 HydrophobicContact CZ2-CG 3.76Å; W548-Q552 HydrophobicContact CZ3-CG 4.48Å; W548-Q552 WeakPolarHBondContact O-CG 3.49Å; W548-Q552 PolarHBondContact O-N 3.41Å; M549-Q552 PolarHBondContact O-N 3.06Å; Q552-R554 PolarHBondContact O-N 3Å; Q552-G555 PolarHBondContact O-N 3.03Å
553	E	81.9	Confident	69.6	Low	141 Å²	141	88 Å²	88	66%	0.659	46%	0.459	S	S	*	.	H	α-helix	trans	-60.8	-28.6	175.1	-72.9	175	176	0	0	113.2	M549 G555	M549-E553 WeakPolarHBondContact O-CG 3.5Å; M549-E553 PolarHBondContact O-N 3.39Å; E553-G555 VanDerWaalsContact C-N 3.35Å
554	R	79.4	Confident	67.3	Low	204 Å²	204	91 Å²	91	77%	0.77	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-1.9	178.3	-70.1	173.2	-175.1	-168.7	2.8	113.5	T550 Q551 Q552 G556	T550-R554 WeakPolarHBondContact O-CD 3.46Å; T550-R554 WeakPolarHBondContact O-CG 3.09Å; T550-R554 PolarHBondContact O-N 3.16Å; Q551-R554 PolarHBondContact O-N 2.99Å; Q551-R554 VanDerWaalsContact O-N 3.15Å; Q552-R554 PolarHBondContact O-N 3Å; R554-G556 VanDerWaalsContact C-N 3.27Å; R554-G556 PolarHBondContact O-N 3.5Å
555	G	67.1	Low	65	Low	63 Å²	63	96.7 Å²	96.7	65%	0.649	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	24.9	179.3	0	0	0	0	0	114.6	Q551 Q552 E553	Q551-G555 PolarHBondContact O-N 2.96Å; Q552-G555 PolarHBondContact O-N 3.03Å; E553-G555 VanDerWaalsContact C-N 3.35Å
556	G	55.1	Low	62.4	Low	34 Å²	34	105.1 Å²	105.1	35%	0.351	54%	0.544	S	S	.	.	P	Polyproline II helix	trans	-98.1	121.9	-172.7	0	0	0	0	0	114.1	Q551 R554	Q551-G556 PolarHBondContact NE2-O 3.45Å; Q551-G556 VanDerWaalsContact NE2-O 3.15Å; Q551-G556 PolarHBondContact O-N 2.77Å; R554-G556 VanDerWaalsContact C-N 3.27Å; R554-G556 PolarHBondContact O-N 3.5Å
557	W	48	Very low	59.9	Low	255 Å²	255	110.1 Å²	110.1	97%	0.966	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-74.5	123.8	160.5	-60.7	87	0	0	0	108.7
558	V	48.8	Very low	57.6	Low	65 Å²	65	114.3 Å²	114.3	39%	0.394	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-96.4	117.2	168.4	167.5	0	0	0	0	107	Q551	Q551-V558 HydrophobicContact CG-CG2 4.31Å
559	Q	43.6	Very low	55	Low	179 Å²	179	121.3 Å²	121.3	84%	0.836	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-65.2	128.2	156.4	-78.2	-172.3	-18.3	0	0	106.9
560	P	45.2	Very low	52.8	Low	111 Å²	111	127 Å²	127	72%	0.721	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-51.2	141	170.5	-20.8	30.7	0	0	0	108.7	A562	P560-A562 PolarHBondContact O-N 3.3Å
561	P	39	Very low	50.6	Low	80 Å²	80	133.3 Å²	133.3	52%	0.519	67%	0.668	S	S	.	*	P	Polyproline II helix	trans	-55.6	130.4	167.2	-2.1	14.1	0	0	0	107	E563	P561-E563 HydrophobicContact CB-CG 4.31Å; P561-E563 PolarHBondContact O-N 2.62Å
562	A	37.9	Very low	48.6	Very low	104 Å²	104	138.9 Å²	138.9	86%	0.86	69%	0.694	S	S	*	*			trans	-66.7	85.7	164.9	0	0	0	0	0	106.7	P560 E564	P560-A562 PolarHBondContact O-N 3.3Å; A562-E564 PolarHBondContact O-N 3.22Å
563	E	38.7	Very low	46.7	Very low	130 Å²	130	139.5 Å²	139.5	61%	0.607	70%	0.701	S	S	*	*			trans	-78.6	115.4	162.8	-67.7	-174.7	-175.9	0	0	105.3	P561 E565	P561-E563 HydrophobicContact CB-CG 4.31Å; P561-E563 PolarHBondContact O-N 2.62Å; E563-E565 PolarHBondContact O-N 3.12Å
564	E	39.1	Very low	44.9	Very low	193 Å²	193	140.1 Å²	140.1	90%	0.902	70%	0.704	S	S	*	*			trans	-58.6	89.5	159.8	-67.6	174	177.5	0	0	105.6	A562 E566	A562-E564 PolarHBondContact O-N 3.22Å; E564-E566 PolarHBondContact O-N 2.86Å; E564-E566 VanDerWaalsContact O-N 3.07Å
565	E	41	Very low	43.8	Very low	121 Å²	121	135.5 Å²	135.5	57%	0.565	69%	0.691	S	S	*	*			trans	-61.7	111.5	164.1	-68.5	-162.8	142.8	0	0	105.2	E563 E567	E563-E565 PolarHBondContact O-N 3.12Å; E565-E567 VanDerWaalsContact C-N 3.32Å; E565-E567 PolarHBondContact O-N 3.23Å
566	E	38	Very low	43.2	Very low	177 Å²	177	139.9 Å²	139.9	83%	0.827	69%	0.694	S	S	*	*			trans	-53.3	109.7	159	-72.2	-179.4	172.8	0	0	104.9	E564 E568	E564-E566 PolarHBondContact O-N 2.86Å; E564-E566 VanDerWaalsContact O-N 3.07Å; E566-E568 PolarHBondContact O-N 3.45Å
567	E	37.6	Very low	43.6	Very low	184 Å²	184	139.3 Å²	139.3	86%	0.86	68%	0.684	S	S	*	*			trans	-57.7	80.1	164.5	-69.4	176	171.3	0	0	106.3	E565 E569	E565-E567 VanDerWaalsContact C-N 3.32Å; E565-E567 PolarHBondContact O-N 3.23Å; E567-E569 PolarHBondContact O-N 3.18Å
568	E	38.7	Very low	44.3	Very low	130 Å²	130	135.5 Å²	135.5	61%	0.607	67%	0.674	S	S	*	*			trans	-63.4	98.4	148.3	-78.8	-165.2	-164.2	0	0	102.7	E566 E570 K717	E566-E568 PolarHBondContact O-N 3.45Å; E568-E570 PolarHBondContact O-N 2.77Å; E568-K717 IonicContact OE2-NZ 3.73Å; E568-K717 PolarHBondContact OE2-NZ 3.34Å; E568-K717 VanDerWaalsContact OE2-NZ 3.16Å
569	E	37	Very low	45.2	Very low	176 Å²	176	135.5 Å²	135.5	82%	0.822	67%	0.672	S	S	*	*			trans	-40.3	103.7	158.6	-72.4	176.6	171	0	0	105.3	E567 E571	E567-E569 PolarHBondContact O-N 3.18Å; E569-E571 VanDerWaalsContact C-N 3.25Å; E569-E571 PolarHBondContact O-N 2.73Å
570	E	40.3	Very low	46.5	Very low	141 Å²	141	133.4 Å²	133.4	66%	0.659	66%	0.656	S	S	*	*			trans	-60.5	108	164.5	-68.4	-171.2	162.2	0	0	101.8	E568 E572	E568-E570 PolarHBondContact O-N 2.77Å; E570-E572 HydrophobicContact CB-CG 4.42Å; E570-E572 PolarHBondContact O-N 2.94Å
571	E	38.9	Very low	47.9	Very low	177 Å²	177	133 Å²	133	83%	0.827	66%	0.656	S	S	*	*			trans	-57.4	75.7	146.4	-71.1	178.6	170.4	0	0	103.9	E569 D573	E569-E571 VanDerWaalsContact C-N 3.25Å; E569-E571 PolarHBondContact O-N 2.73Å; E571-D573 PolarHBondContact O-N 3.35Å
572	E	42	Very low	49.9	Very low	149 Å²	149	132 Å²	132	70%	0.696	64%	0.644	S	S	*	*			trans	-50.5	100.8	142.3	-79.3	-176.5	163.1	0	0	101.2	E570 E574	E570-E572 HydrophobicContact CB-CG 4.42Å; E570-E572 PolarHBondContact O-N 2.94Å; E572-E574 PolarHBondContact O-N 3.19Å
573	D	42.6	Very low	52.2	Low	115 Å²	115	130.9 Å²	130.9	62%	0.615	63%	0.628	S	S	*	*			trans	-52.8	94.6	161.1	-77.9	-41.9	0	0	0	102.7	E571 E575 W712	E571-D573 PolarHBondContact O-N 3.35Å; D573-E575 PolarHBondContact O-N 3.01Å; D573-W712 WeakPolarHBondContact OD2-CH2 3.36Å
574	E	44.9	Very low	54.6	Low	154 Å²	154	129.1 Å²	129.1	72%	0.72	62%	0.616	S	S	*	*			trans	-45.4	139.5	-177.6	-81.6	178.9	156.8	0	0	107	E572 E576	E572-E574 PolarHBondContact O-N 3.19Å; E574-E576 PolarHBondContact O-N 3.04Å
575	E	57	Low	56.9	Low	108 Å²	108	120.1 Å²	120.1	51%	0.505	58%	0.575	S	S	.	*			trans	-63.4	49.2	-175.7	-59.9	-166.7	141.4	0	0	112.4	D573 V577 R595	D573-E575 PolarHBondContact O-N 3.01Å; E575-V577 PolarHBondContact O-N 2.64Å; E575-R595 IonicContact OE1-CZ 2.99Å; E575-R595 IonicContact OE1-NE 3.63Å; E575-R595 PolarHBondContact OE1-NE 3.14Å; E575-R595 IonicContact OE1-NH2 2.91Å; E575-R595 IonicContact OE2-CZ 3.18Å; E575-R595 IonicContact OE2-NE 3.48Å; E575-R595 IonicContact OE2-NH2 2.75Å; E575-R595 PolarHBondContact OE2-NH2 3.43Å
576	E	53.6	Low	59.2	Low	154 Å²	154	116.9 Å²	116.9	72%	0.72	56%	0.564	S	S	*	*			trans	-78.3	116.3	176.8	-76.3	-165.7	150.8	0	0	108.8	E574 K578	E574-E576 PolarHBondContact O-N 3.04Å; E576-K578 VanDerWaalsContact C-N 3.34Å; E576-K578 PolarHBondContact O-N 3.21Å
577	V	63.3	Low	61.6	Low	22 Å²	22	108.6 Å²	108.6	13%	0.133	53%	0.525	C	S	.	.			trans	-51.4	102	161.1	176.8	0	0	0	0	107.6	E575 D579 R580 V587 V591	E575-V577 PolarHBondContact O-N 2.64Å; V577-D579 PolarHBondContact O-N 3.17Å; V577-R580 HydrophobicContact CB-CG 4.02Å; V577-R580 HydrophobicContact CG1-CB 4.43Å; V577-R580 HydrophobicContact CG1-CG 3.67Å; V577-V587 HydrophobicContact CB-CG1 4.5Å; V577-V587 HydrophobicContact CG1-CG1 3.64Å; V577-V587 HydrophobicContact CG1-CG2 4.26Å; V577-V587 HydrophobicContact CG2-CG1 4Å; V577-V591 HydrophobicContact CG2-CG2 4.19Å
578	K	62	Low	64.2	Low	176 Å²	176	99.8 Å²	99.8	77%	0.765	48%	0.484	S	S	*	.	S	Bend	trans	-58	-28.1	-170.9	-64	-174.4	-180	-171.4	0	113.2	E576	E576-K578 VanDerWaalsContact C-N 3.34Å; E576-K578 PolarHBondContact O-N 3.21Å
579	D	68.3	Low	66.7	Low	64 Å²	64	94.4 Å²	94.4	34%	0.342	46%	0.459	S	S	.	.			trans	-153.5	96	-179.7	-176.2	4.3	0	0	0	111	V577 S581 Q582	V577-D579 PolarHBondContact O-N 3.17Å; D579-S581 PolarHBondContact O-N 2.76Å; D579-S581 VanDerWaalsContact OD1-CB 3.3Å; D579-S581 WeakPolarHBondContact OD1-CB 3.18Å; D579-S581 PolarHBondContact OD1-N 3.43Å; D579-S581 PolarHBondContact OD1-OG 2.87Å; D579-S581 PolarHBondContact OD2-OG 3.23Å; D579-Q582 HydrophobicContact CB-CG 4.04Å; D579-Q582 PolarHBondContact O-N 2.97Å; D579-Q582 PolarHBondContact OD2-NE2 2.77Å
580	R	71.5	Confident	69	Low	135 Å²	135	88.6 Å²	88.6	51%	0.509	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-8.2	177.6	-64.6	-179.9	178.6	165.5	-5.8	113.7	V577 Q582 D1170	V577-R580 HydrophobicContact CB-CG 4.02Å; V577-R580 HydrophobicContact CG1-CB 4.43Å; V577-R580 HydrophobicContact CG1-CG 3.67Å; R580-Q582 VanDerWaalsContact C-N 3.29Å; R580-D1170 VanDerWaalsContact CZ-O 3.3Å; R580-D1170 PolarHBondContact NE-OXT 3.01Å; R580-D1170 PolarHBondContact NH1-O 3.37Å; R580-D1170 PolarHBondContact NH1-OXT 3.34Å; R580-D1170 VanDerWaalsContact NH2-C 3.33Å; R580-D1170 PolarHBondContact NH2-O 3.14Å; R580-D1170 PolarHBondContact NH2-OXT 3.2Å
581	S	74	Confident	71.3	Confident	102 Å²	102	82.8 Å²	82.8	71%	0.713	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-7.2	176.9	78	0	0	0	0	113.8	D579	D579-S581 PolarHBondContact O-N 2.76Å; D579-S581 VanDerWaalsContact OD1-CB 3.3Å; D579-S581 WeakPolarHBondContact OD1-CB 3.18Å; D579-S581 PolarHBondContact OD1-N 3.43Å; D579-S581 PolarHBondContact OD1-OG 2.87Å; D579-S581 PolarHBondContact OD2-OG 3.23Å
582	Q	82.5	Confident	73.7	Confident	59 Å²	59	74.4 Å²	74.4	28%	0.276	37%	0.367	S	S	.	.	S	Bend	trans	-73.3	157.8	179.3	-67.2	-171.9	18.1	0	0	112.6	D579 R580 V587	D579-Q582 HydrophobicContact CB-CG 4.04Å; D579-Q582 PolarHBondContact O-N 2.97Å; D579-Q582 PolarHBondContact OD2-NE2 2.77Å; R580-Q582 VanDerWaalsContact C-N 3.29Å; Q582-V587 HydrophobicContact CB-CG2 3.98Å
583	P	86.3	Confident	75.9	Confident	81 Å²	81	68.4 Å²	68.4	53%	0.526	34%	0.342	S	S	.	.			trans	-56.2	141.8	173.7	-23.2	33.7	0	0	0	111.8	G585 T586 V587	P583-G585 VanDerWaalsContact C-N 3.27Å; P583-G585 PolarHBondContact O-N 3.29Å; P583-G585 VanDerWaalsContact O-N 3.13Å; P583-T586 WeakPolarHBondContact O-CA 3.35Å; P583-T586 WeakPolarHBondContact O-CB 3.38Å; P583-T586 PolarHBondContact O-N 3.27Å; P583-V587 PolarHBondContact O-N 2.94Å; P583-V587 VanDerWaalsContact O-N 3.16Å
584	R	88.8	Confident	77.9	Confident	93 Å²	93	65.8 Å²	65.8	35%	0.351	33%	0.332	S	S	.	.	H	α-helix	trans	-46.2	-47.1	-178.4	-175.1	-178.9	173.3	137.4	3.8	113.3	T586 V587 W588 L1143 L1161 L1164 D1165 L1168	R584-T586 VanDerWaalsContact C-N 3.3Å; R584-T586 PolarHBondContact O-N 2.87Å; R584-V587 PolarHBondContact O-N 3.43Å; R584-W588 WeakPolarHBondContact O-CB 3.36Å; R584-W588 PolarHBondContact O-N 3.06Å; R584-L1143 HydrophobicContact CB-CD2 4.48Å; R584-L1143 HydrophobicContact CG-CD2 3.81Å; R584-L1161 PolarHBondContact NH2-O 3.02Å; R584-L1164 HydrophobicContact CG-CD2 3.62Å; R584-D1165 IonicContact CZ-OD1 3.87Å; R584-D1165 IonicContact CZ-OD2 4Å; R584-D1165 IonicContact NH1-OD1 3.08Å; R584-D1165 PolarHBondContact NH1-OD1 3.41Å; R584-D1165 IonicContact NH1-OD2 2.65Å; R584-D1165 IonicContact NH2-OD1 2.82Å; R584-D1165 PolarHBondContact NH2-OD1 3.19Å; R584-D1165 IonicContact NH2-OD2 3.14Å; R584-D1165 PolarHBondContact NH2-OD2 3.46Å; R584-L1168 HydrophobicContact CG-CD1 4.26Å
585	G	87.6	Confident	79.9	Confident	4 Å²	4	59.4 Å²	59.4	4%	0.041	30%	0.302	C	S	.	.	H	α-helix	trans	-65.4	-29.1	178.9	0	0	0	0	0	114.1	P583 L589	P583-G585 VanDerWaalsContact C-N 3.27Å; P583-G585 PolarHBondContact O-N 3.29Å; P583-G585 VanDerWaalsContact O-N 3.13Å; G585-L589 WeakPolarHBondContact O-CB 3.37Å; G585-L589 VanDerWaalsContact O-CG 3.22Å; G585-L589 WeakPolarHBondContact O-CG 3.35Å; G585-L589 PolarHBondContact O-N 2.85Å
586	T	88.4	Confident	81.3	Confident	54 Å²	54	54.4 Å²	54.4	33%	0.331	28%	0.278	S	S	.	.	H	α-helix	trans	-72.7	-46.2	175.2	-50.4	0	0	0	0	110.8	P583 R584 W588 L589 E590	P583-T586 WeakPolarHBondContact O-CA 3.35Å; P583-T586 WeakPolarHBondContact O-CB 3.38Å; P583-T586 PolarHBondContact O-N 3.27Å; R584-T586 VanDerWaalsContact C-N 3.3Å; R584-T586 PolarHBondContact O-N 2.87Å; T586-W588 VanDerWaalsContact C-N 3.33Å; T586-W588 PolarHBondContact O-N 3.14Å; T586-L589 PolarHBondContact O-N 3.35Å; T586-E590 WeakPolarHBondContact O-CG 3.28Å; T586-E590 PolarHBondContact O-N 3.47Å
587	V	88.9	Confident	82.8	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.012	25%	0.253	C	S	.	.	H	α-helix	trans	-58.1	-47.4	175.1	178.7	0	0	0	0	110.6	V577 Q582 P583 R584 L589 E590 V591 L1164 L1168	V577-V587 HydrophobicContact CB-CG1 4.5Å; V577-V587 HydrophobicContact CG1-CG1 3.64Å; V577-V587 HydrophobicContact CG1-CG2 4.26Å; V577-V587 HydrophobicContact CG2-CG1 4Å; Q582-V587 HydrophobicContact CB-CG2 3.98Å; P583-V587 PolarHBondContact O-N 2.94Å; P583-V587 VanDerWaalsContact O-N 3.16Å; R584-V587 PolarHBondContact O-N 3.43Å; V587-L589 PolarHBondContact O-N 3.22Å; V587-E590 PolarHBondContact O-N 3.45Å; V587-E590 VanDerWaalsContact O-N 3.15Å; V587-V591 HydrophobicContact CG1-CG2 4.38Å; V587-V591 WeakPolarHBondContact O-CG2 3.36Å; V587-V591 PolarHBondContact O-N 2.73Å; V587-L1164 HydrophobicContact CB-CD1 4.38Å; V587-L1164 HydrophobicContact CG1-CD1 3.85Å; V587-L1168 HydrophobicContact CG1-CD2 4.16Å; V587-L1168 HydrophobicContact CG2-CD2 4.38Å
588	W	91.8	Very high	83.7	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-55.9	-49.6	176.1	-176.4	81.8	0	0	0	112.1	R584 T586 E590 V591 E592 M1133 V1136 L1143 V1147 M1150 L1157 L1159 L1164	R584-W588 WeakPolarHBondContact O-CB 3.36Å; R584-W588 PolarHBondContact O-N 3.06Å; T586-W588 VanDerWaalsContact C-N 3.33Å; T586-W588 PolarHBondContact O-N 3.14Å; W588-E590 VanDerWaalsContact C-N 3.28Å; W588-E590 PolarHBondContact O-N 2.95Å; W588-V591 PolarHBondContact O-N 3.31Å; W588-E592 HydrophobicContact CD2-CB 4.44Å; W588-E592 HydrophobicContact CH2-CB 4.39Å; W588-E592 HydrophobicContact CH2-CG 3.91Å; W588-E592 HydrophobicContact CZ2-CB 4.24Å; W588-E592 HydrophobicContact CZ2-CG 3.9Å; W588-E592 HydrophobicContact CZ3-CG 4.45Å; W588-E592 WeakPolarHBondContact O-CB 3.36Å; W588-E592 PolarHBondContact O-N 3.27Å; W588-M1133 HydrophobicContact CH2-CE 4.45Å; W588-M1133 HydrophobicContact CH2-SD 3.49Å; W588-M1133 WeakPolarHBondContact CH2-SD 3.04Å; W588-M1133 HydrophobicContact CZ3-CE 4.16Å; W588-M1133 HydrophobicContact CZ3-SD 3.43Å; W588-M1133 WeakPolarHBondContact CZ3-SD 3.42Å; W588-V1136 HydrophobicContact CE3-CG1 4.02Å; W588-V1136 HydrophobicContact CE3-CG2 4.41Å; W588-V1136 HydrophobicContact CZ3-CB 4.43Å; W588-V1136 HydrophobicContact CZ3-CG1 4.33Å; W588-V1136 HydrophobicContact CZ3-CG2 4.03Å; W588-L1143 HydrophobicContact CB-CD1 4.5Å; W588-L1143 HydrophobicContact CD2-CD1 4.11Å; W588-L1143 HydrophobicContact CE3-CD1 4.09Å; W588-L1143 HydrophobicContact CG-CD1 4.27Å; W588-V1147 HydrophobicContact CH2-CG2 4.5Å; W588-V1147 HydrophobicContact CZ2-CG2 4.05Å; W588-M1150 HydrophobicContact CH2-CE 3.56Å; W588-M1150 HydrophobicContact CH2-SD 4.42Å; W588-M1150 HydrophobicContact CZ2-CE 4.05Å; W588-M1150 HydrophobicContact CZ3-CE 4.38Å; W588-L1157 HydrophobicContact CH2-CD2 4.43Å; W588-L1157 HydrophobicContact CZ2-CD2 3.86Å; W588-L1159 HydrophobicContact CG-CD2 4.42Å; W588-L1159 PolarHBondContact NE1-O 3.32Å; W588-L1164 HydrophobicContact CB-CD1 4.41Å; W588-L1164 HydrophobicContact CB-CD2 3.8Å; W588-L1164 HydrophobicContact CG-CD2 4.25Å
589	L	90	Very high	84.9	Confident	16 Å²	16	43.2 Å²	43.2	8%	0.084	24%	0.238	C	C	.	.	H	α-helix	trans	-59.5	-38.4	177.8	-78.1	171.3	0	0	0	112.6	G585 T586 V587 S593 T705 M1133 V1136 Q1137	G585-L589 WeakPolarHBondContact O-CB 3.37Å; G585-L589 VanDerWaalsContact O-CG 3.22Å; G585-L589 WeakPolarHBondContact O-CG 3.35Å; G585-L589 PolarHBondContact O-N 2.85Å; T586-L589 PolarHBondContact O-N 3.35Å; V587-L589 PolarHBondContact O-N 3.22Å; L589-S593 WeakPolarHBondContact O-CB 3.4Å; L589-S593 PolarHBondContact O-N 2.99Å; L589-S593 PolarHBondContact O-OG 2.92Å; L589-T705 HydrophobicContact CD1-CG2 4.3Å; L589-T705 HydrophobicContact CD2-CG2 4.07Å; L589-M1133 HydrophobicContact CD2-CB 4.04Å; L589-M1133 HydrophobicContact CD2-CE 3.53Å; L589-M1133 HydrophobicContact CD2-SD 3.81Å; L589-V1136 HydrophobicContact CD1-CB 4.34Å; L589-V1136 HydrophobicContact CD1-CG1 3.89Å; L589-V1136 HydrophobicContact CD2-CB 4.18Å; L589-V1136 HydrophobicContact CD2-CG1 4.14Å; L589-V1136 HydrophobicContact CG-CB 4.32Å; L589-V1136 HydrophobicContact CG-CG1 3.77Å; L589-Q1137 HydrophobicContact CD1-CB 3.81Å; L589-Q1137 HydrophobicContact CD1-CG 4.43Å
590	E	86.9	Confident	85.9	Confident	55 Å²	55	40.3 Å²	40.3	26%	0.257	22%	0.223	S	C	.	.	H	α-helix	trans	-67.5	-48	-179.8	-69.4	-147.6	119.8	0	0	112.3	T586 V587 W588 S594 K711	T586-E590 WeakPolarHBondContact O-CG 3.28Å; T586-E590 PolarHBondContact O-N 3.47Å; V587-E590 PolarHBondContact O-N 3.45Å; V587-E590 VanDerWaalsContact O-N 3.15Å; W588-E590 VanDerWaalsContact C-N 3.28Å; W588-E590 PolarHBondContact O-N 2.95Å; E590-S594 VanDerWaalsContact O-CB 3.32Å; E590-S594 WeakPolarHBondContact O-CB 3.48Å; E590-S594 PolarHBondContact O-N 3.22Å; E590-K711 IonicContact OE1-NZ 2.9Å; E590-K711 PolarHBondContact OE1-NZ 2.91Å
591	V	87.9	Confident	86.8	Confident	19 Å²	19	34.9 Å²	34.9	12%	0.115	20%	0.204	C	C	.	.	H	α-helix	trans	-69.7	-46.9	-179.9	178.7	0	0	0	0	110.4	V577 V587 W588 S593 S594 R595 L1159	V577-V591 HydrophobicContact CG2-CG2 4.19Å; V587-V591 HydrophobicContact CG1-CG2 4.38Å; V587-V591 WeakPolarHBondContact O-CG2 3.36Å; V587-V591 PolarHBondContact O-N 2.73Å; W588-V591 PolarHBondContact O-N 3.31Å; V591-S593 VanDerWaalsContact C-N 3.32Å; V591-S593 PolarHBondContact O-N 3.03Å; V591-S594 WeakPolarHBondContact O-CB 3.41Å; V591-S594 PolarHBondContact O-N 3.4Å; V591-R595 HydrophobicContact CG1-CG 4.34Å; V591-R595 PolarHBondContact O-N 2.89Å; V591-L1159 HydrophobicContact CB-CD2 3.74Å; V591-L1159 HydrophobicContact CG1-CD1 4.34Å; V591-L1159 HydrophobicContact CG1-CD2 3.73Å; V591-L1159 HydrophobicContact CG1-CG 4.44Å; V591-L1159 HydrophobicContact CG2-CD2 4.48Å
592	E	90.4	Very high	87.5	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-56	-46	176.3	-180	64.6	-153.1	0	0	111.3	W588 S594 E596 K1129 M1133 R1158 L1159	W588-E592 HydrophobicContact CD2-CB 4.44Å; W588-E592 HydrophobicContact CH2-CB 4.39Å; W588-E592 HydrophobicContact CH2-CG 3.91Å; W588-E592 HydrophobicContact CZ2-CB 4.24Å; W588-E592 HydrophobicContact CZ2-CG 3.9Å; W588-E592 HydrophobicContact CZ3-CG 4.45Å; W588-E592 WeakPolarHBondContact O-CB 3.36Å; W588-E592 PolarHBondContact O-N 3.27Å; E592-S594 VanDerWaalsContact C-N 3.34Å; E592-S594 PolarHBondContact O-N 3.3Å; E592-E596 WeakPolarHBondContact O-CB 3.25Å; E592-E596 PolarHBondContact O-N 3.36Å; E592-K1129 WeakPolarHBondContact OE1-CE 3.4Å; E592-K1129 IonicContact OE1-NZ 3.76Å; E592-K1129 PolarHBondContact OE1-NZ 2.99Å; E592-M1133 HydrophobicContact CB-CE 4.16Å; E592-M1133 HydrophobicContact CG-CE 3.7Å; E592-M1133 HydrophobicContact CG-SD 4.14Å; E592-R1158 PolarHBondContact OE1-N 3.11Å; E592-R1158 VanDerWaalsContact OE1-N 3.13Å; E592-R1158 WeakPolarHBondContact OE2-CA 3.48Å; E592-R1158 PolarHBondContact OE2-N 3.19Å; E592-L1159 PolarHBondContact OE2-N 3.32Å
593	S	87.4	Confident	87.9	Confident	24 Å²	24	29.7 Å²	29.7	17%	0.168	17%	0.167	C	C	.	.	H	α-helix	trans	-68.6	-32.3	177.3	-57.8	0	0	0	0	112.7	L589 V591 A597	L589-S593 WeakPolarHBondContact O-CB 3.4Å; L589-S593 PolarHBondContact O-N 2.99Å; L589-S593 PolarHBondContact O-OG 2.92Å; V591-S593 VanDerWaalsContact C-N 3.32Å; V591-S593 PolarHBondContact O-N 3.03Å; S593-A597 PolarHBondContact O-N 2.97Å
594	S	84.8	Confident	87.8	Confident	59 Å²	59	28.8 Å²	28.8	41%	0.413	15%	0.154	S	C	.	.	H	α-helix	trans	-69.1	-49.7	177.6	-163.8	0	0	0	0	110.9	E590 V591 E592 E596 A597 A598	E590-S594 VanDerWaalsContact O-CB 3.32Å; E590-S594 WeakPolarHBondContact O-CB 3.48Å; E590-S594 PolarHBondContact O-N 3.22Å; V591-S594 WeakPolarHBondContact O-CB 3.41Å; V591-S594 PolarHBondContact O-N 3.4Å; E592-S594 VanDerWaalsContact C-N 3.34Å; E592-S594 PolarHBondContact O-N 3.3Å; S594-E596 VanDerWaalsContact C-N 3.28Å; S594-E596 PolarHBondContact O-N 2.94Å; S594-A597 WeakPolarHBondContact O-CB 3.33Å; S594-A597 PolarHBondContact O-N 3.28Å; S594-A597 VanDerWaalsContact O-N 3.08Å; S594-A598 PolarHBondContact O-N 2.76Å
595	R	86.8	Confident	87.4	Confident	20 Å²	20	25.8 Å²	25.8	8%	0.075	15%	0.146	C	C	.	.	H	α-helix	trans	-62	-36.4	176.4	-71.3	-176.2	172.2	176.4	2.8	111.9	E575 V591 A597 A598 H599 R1158 E1163	E575-R595 IonicContact OE1-CZ 2.99Å; E575-R595 IonicContact OE1-NE 3.63Å; E575-R595 PolarHBondContact OE1-NE 3.14Å; E575-R595 IonicContact OE1-NH2 2.91Å; E575-R595 IonicContact OE2-CZ 3.18Å; E575-R595 IonicContact OE2-NE 3.48Å; E575-R595 IonicContact OE2-NH2 2.75Å; E575-R595 PolarHBondContact OE2-NH2 3.43Å; V591-R595 HydrophobicContact CG1-CG 4.34Å; V591-R595 PolarHBondContact O-N 2.89Å; R595-A597 VanDerWaalsContact C-N 3.33Å; R595-A597 PolarHBondContact O-N 3.32Å; R595-A598 PolarHBondContact O-N 3.23Å; R595-H599 VanDerWaalsContact O-CB 3.31Å; R595-H599 WeakPolarHBondContact O-CB 3.47Å; R595-H599 PolarHBondContact O-N 2.86Å; R595-R1158 VanDerWaalsContact C-CD 3.49Å; R595-R1158 HydrophobicContact CB-CB 3.9Å; R595-R1158 PolarHBondContact NH1-O 3.5Å; R595-E1163 IonicContact CZ-OE1 2.58Å; R595-E1163 IonicContact NH1-OE1 2.83Å; R595-E1163 PolarHBondContact NH1-OE1 3.2Å; R595-E1163 IonicContact NH1-OE2 2.65Å; R595-E1163 PolarHBondContact NH1-OE2 3.25Å; R595-E1163 IonicContact NH2-OE1 3.44Å; R595-E1163 PolarHBondContact NH2-OE1 3.01Å
596	E	87.1	Confident	87	Confident	3 Å²	3	28 Å²	28	1%	0.014	16%	0.157	C	C	.	.	H	α-helix	trans	-64.5	-38.3	174.2	-161	-174.2	121.7	0	0	112.6	E592 S594 A598 G701 M703 K1129	E592-E596 WeakPolarHBondContact O-CB 3.25Å; E592-E596 PolarHBondContact O-N 3.36Å; S594-E596 VanDerWaalsContact C-N 3.28Å; S594-E596 PolarHBondContact O-N 2.94Å; E596-A598 VanDerWaalsContact C-N 3.35Å; E596-G701 VanDerWaalsContact O-CA 3.26Å; E596-G701 WeakPolarHBondContact O-CA 3.32Å; E596-M703 WeakPolarHBondContact OE1-CB 3.23Å; E596-M703 PolarHBondContact OE1-N 3.13Å; E596-M703 VanDerWaalsContact OE1-N 3.15Å; E596-K1129 IonicContact OE2-NZ 3.97Å; E596-K1129 PolarHBondContact OE2-NZ 3.43Å
597	A	83.6	Confident	86.3	Confident	22 Å²	22	32.7 Å²	32.7	18%	0.182	17%	0.173	C	C	.	.	H	α-helix	trans	-70.6	-29.5	177.2	0	0	0	0	0	113.2	S593 S594 R595 W600 G701	S593-A597 PolarHBondContact O-N 2.97Å; S594-A597 WeakPolarHBondContact O-CB 3.33Å; S594-A597 PolarHBondContact O-N 3.28Å; S594-A597 VanDerWaalsContact O-N 3.08Å; R595-A597 VanDerWaalsContact C-N 3.33Å; R595-A597 PolarHBondContact O-N 3.32Å; A597-W600 VanDerWaalsContact O-CD1 3.27Å; A597-G701 WeakPolarHBondContact CA-O 3.41Å; A597-G701 WeakPolarHBondContact CB-O 3.45Å; A597-G701 PolarHBondContact N-O 3.13Å
598	A	83.9	Confident	85.6	Confident	43 Å²	43	37.3 Å²	37.3	36%	0.355	21%	0.211	S	C	.	.	H	α-helix	trans	-86.9	-49.3	179.1	0	0	0	0	0	112.5	S594 R595 E596 W600	S594-A598 PolarHBondContact O-N 2.76Å; R595-A598 PolarHBondContact O-N 3.23Å; E596-A598 VanDerWaalsContact C-N 3.35Å; A598-W600 PolarHBondContact O-N 3.29Å
599	H	86.4	Confident	84.8	Confident	52 Å²	52	44.9 Å²	44.9	24%	0.241	24%	0.244	C	C	.	.			trans	-98.3	37.9	-165.1	-60.5	166.5	0	0	0	113.9	R595 R1158	R595-H599 VanDerWaalsContact O-CB 3.31Å; R595-H599 WeakPolarHBondContact O-CB 3.47Å; R595-H599 PolarHBondContact O-N 2.86Å; H599-R1158 VanDerWaalsContact O-CZ 3.27Å; H599-R1158 PolarHBondContact O-NH1 2.75Å; H599-R1158 PolarHBondContact O-NH2 3.4Å
600	W	88.3	Confident	84.1	Confident	4 Å²	4	47.2 Å²	47.2	2%	0.015	27%	0.272	C	S	.	.			trans	-83.2	-14.7	-179.5	64.8	-84.4	0	0	0	114.4	C493 E494 I497 A597 A598 L652 V700 L715 F722	C493-W600 HydrophobicContact CB-CB 4.12Å; E494-W600 WeakPolarHBondContact CA-O 3.36Å; E494-W600 PolarHBondContact N-O 2.9Å; I497-W600 HydrophobicContact CD1-CE3 3.93Å; I497-W600 HydrophobicContact CD1-CZ3 3.67Å; I497-W600 HydrophobicContact CG1-CE3 3.72Å; I497-W600 HydrophobicContact CG1-CZ3 3.84Å; I497-W600 HydrophobicContact CG2-CZ3 4.5Å; A597-W600 VanDerWaalsContact O-CD1 3.27Å; A598-W600 PolarHBondContact O-N 3.29Å; W600-L652 HydrophobicContact CH2-CD2 4.45Å; W600-L652 HydrophobicContact CZ3-CD2 4.05Å; W600-V700 HydrophobicContact CB-CG1 3.63Å; W600-V700 HydrophobicContact CD2-CG1 3.97Å; W600-V700 HydrophobicContact CE3-CG1 3.7Å; W600-V700 HydrophobicContact CG-CG1 3.96Å; W600-L715 HydrophobicContact CH2-CD1 4.2Å; W600-L715 HydrophobicContact CH2-CD2 4.36Å; W600-L715 HydrophobicContact CZ2-CB 4.09Å; W600-L715 HydrophobicContact CZ2-CD1 4.35Å; W600-L715 HydrophobicContact CZ2-CD2 4.15Å; W600-L715 HydrophobicContact CZ2-CG 4.44Å; W600-F722 HydrophobicContact CH2-CD1 4.16Å
601	L	90.1	Very high	84	Confident	21 Å²	21	48.1 Å²	48.1	11%	0.11	28%	0.276	C	S	.	.	S	Bend	trans	-85.8	144.5	171.9	-72.4	170.8	0	0	0	110.9	I497 R621 Q718 F722	I497-L601 HydrophobicContact CG2-CD2 4.1Å; L601-R621 PolarHBondContact O-NH2 3.1Å; L601-Q718 HydrophobicContact CD1-CG 4.01Å; L601-F722 HydrophobicContact CD2-CD2 4.01Å; L601-F722 HydrophobicContact CD2-CE2 4.1Å; L601-F722 HydrophobicContact CD2-CG 4.35Å
602	P	90.6	Very high	83.8	Confident	12 Å²	12	49.6 Å²	49.6	8%	0.078	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-59	140.2	172.4	27.5	-34.5	0	0	0	110.1	R621 V623	P602-R621 WeakPolarHBondContact CA-O 3.38Å; P602-V623 HydrophobicContact CB-CG2 4.12Å
603	W	89.8	Confident	83.3	Confident	39 Å²	39	55.2 Å²	55.2	15%	0.148	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-78.3	141.8	178.1	-175.7	94.3	0	0	0	110.3	P605 S612 C616 R621 Q622	W603-P605 HydrophobicContact CH2-CB 3.86Å; W603-P605 HydrophobicContact CZ3-CB 4.07Å; W603-P605 HydrophobicContact CZ3-CG 4.4Å; W603-S612 WeakPolarHBondContact CH2-O 3.36Å; W603-C616 HydrophobicContact CD2-CB 3.88Å; W603-C616 VanDerWaalsContact CD2-SG 3.5Å; W603-C616 HydrophobicContact CE3-CB 3.62Å; W603-C616 VanDerWaalsContact CE3-SG 3.58Å; W603-C616 HydrophobicContact CH2-CB 3.83Å; W603-C616 HydrophobicContact CZ2-CB 4.08Å; W603-C616 HydrophobicContact CZ3-CB 3.6Å; W603-R621 HydrophobicContact CB-CB 3.61Å; W603-R621 PolarHBondContact N-O 2.8Å; W603-Q622 HydrophobicContact CE3-CG 4.16Å
604	R	83.3	Confident	83.1	Confident	63 Å²	63	62.9 Å²	62.9	24%	0.238	35%	0.347	C	S	.	.			trans	-138.8	141	177.7	-62.7	-69.4	-90	176.8	-9.8	109.3	G533 E534 D606	G533-R604 VanDerWaalsContact CA-NH2 3.32Å; E534-R604 PolarHBondContact O-NH2 3.3Å; R604-D606 PolarHBondContact O-N 2.96Å
605	P	82.4	Confident	83.2	Confident	30 Å²	30	64.3 Å²	64.3	20%	0.195	35%	0.35	C	S	.	.			trans	-68.3	130.9	178.9	26.7	-32.8	0	0	0	110.7	W603 K607 Q611 E613	W603-P605 HydrophobicContact CH2-CB 3.86Å; W603-P605 HydrophobicContact CZ3-CB 4.07Å; W603-P605 HydrophobicContact CZ3-CG 4.4Å; P605-K607 PolarHBondContact O-N 3Å; P605-Q611 HydrophobicContact CB-CB 4.21Å; P605-Q611 WeakPolarHBondContact CB-O 3.36Å; P605-E613 HydrophobicContact CG-CG 4.16Å
606	D	77.4	Confident	83.1	Confident	51 Å²	51	64 Å²	64	27%	0.273	35%	0.35	S	S	.	.			trans	-79.5	102.5	172	-172.8	-11	0	0	0	110.6	R604 A608 K609 G610 Q611	R604-D606 PolarHBondContact O-N 2.96Å; D606-A608 PolarHBondContact O-N 3.47Å; D606-A608 WeakPolarHBondContact OD1-CA 3.41Å; D606-A608 VanDerWaalsContact OD1-CB 3.26Å; D606-A608 WeakPolarHBondContact OD1-CB 3.43Å; D606-A608 PolarHBondContact OD1-N 2.85Å; D606-K609 HydrophobicContact CB-CB 4.11Å; D606-K609 HydrophobicContact CB-CD 4.26Å; D606-K609 HydrophobicContact CB-CG 4.32Å; D606-K609 CarbonylContact O-C 3.32Å; D606-K609 PolarHBondContact O-N 3.36Å; D606-K609 VanDerWaalsContact O-N 3.14Å; D606-K609 PolarHBondContact OD1-N 2.98Å; D606-K609 WeakPolarHBondContact OD2-CD 3.46Å; D606-K609 VanDerWaalsContact OD2-CE 3.23Å; D606-K609 WeakPolarHBondContact OD2-CE 3.45Å; D606-K609 VanDerWaalsContact OD2-CG 3.27Å; D606-K609 WeakPolarHBondContact OD2-CG 3.39Å; D606-K609 IonicContact OD2-NZ 3.69Å; D606-G610 PolarHBondContact O-N 2.93Å; D606-G610 VanDerWaalsContact O-N 3.15Å; D606-Q611 PolarHBondContact O-N 3.48Å
607	K	74.4	Confident	82.9	Confident	151 Å²	151	73.2 Å²	73.2	66%	0.657	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-27	177.7	-65.1	177.7	-178.2	169.4	0	112.5	G533 P605 G610	G533-K607 PolarHBondContact O-NZ 3.27Å; P605-K607 PolarHBondContact O-N 3Å; K607-G610 PolarHBondContact O-N 3.45Å
608	A	73.6	Confident	83.1	Confident	99 Å²	99	73.6 Å²	73.6	82%	0.818	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-33	177.2	0	0	0	0	0	111.5	D606 G610	D606-A608 PolarHBondContact O-N 3.47Å; D606-A608 WeakPolarHBondContact OD1-CA 3.41Å; D606-A608 VanDerWaalsContact OD1-CB 3.26Å; D606-A608 WeakPolarHBondContact OD1-CB 3.43Å; D606-A608 PolarHBondContact OD1-N 2.85Å; A608-G610 VanDerWaalsContact C-N 3.33Å
609	K	75.6	Confident	83.3	Confident	160 Å²	160	76 Å²	76	70%	0.696	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	0.5	174.5	-65.2	177.7	-171.6	177.2	0	113.8	D606 Q611	D606-K609 HydrophobicContact CB-CB 4.11Å; D606-K609 HydrophobicContact CB-CD 4.26Å; D606-K609 HydrophobicContact CB-CG 4.32Å; D606-K609 CarbonylContact O-C 3.32Å; D606-K609 PolarHBondContact O-N 3.36Å; D606-K609 VanDerWaalsContact O-N 3.14Å; D606-K609 PolarHBondContact OD1-N 2.98Å; D606-K609 WeakPolarHBondContact OD2-CD 3.46Å; D606-K609 VanDerWaalsContact OD2-CE 3.23Å; D606-K609 WeakPolarHBondContact OD2-CE 3.45Å; D606-K609 VanDerWaalsContact OD2-CG 3.27Å; D606-K609 WeakPolarHBondContact OD2-CG 3.39Å; D606-K609 IonicContact OD2-NZ 3.69Å; K609-Q611 VanDerWaalsContact C-N 3.29Å; K609-Q611 HydrophobicContact CB-CG 4.3Å; K609-Q611 PolarHBondContact O-N 3.41Å
610	G	76.6	Confident	83.3	Confident	64 Å²	64	77.6 Å²	77.6	66%	0.66	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.6	18.4	-180	0	0	0	0	0	114.3	D606 K607 A608	D606-G610 PolarHBondContact O-N 2.93Å; D606-G610 VanDerWaalsContact O-N 3.15Å; K607-G610 PolarHBondContact O-N 3.45Å; A608-G610 VanDerWaalsContact C-N 3.33Å
611	Q	84.8	Confident	83.4	Confident	75 Å²	75	79.1 Å²	79.1	35%	0.35	42%	0.42	S	S	.	.			trans	-73	147.6	177.5	-67.9	177.3	-22.6	0	0	111.1	P605 D606 K609	P605-Q611 HydrophobicContact CB-CB 4.21Å; P605-Q611 WeakPolarHBondContact CB-O 3.36Å; D606-Q611 PolarHBondContact O-N 3.48Å; K609-Q611 VanDerWaalsContact C-N 3.29Å; K609-Q611 HydrophobicContact CB-CG 4.3Å; K609-Q611 PolarHBondContact O-N 3.41Å
612	S	83.5	Confident	83.4	Confident	49 Å²	49	80.6 Å²	80.6	34%	0.343	43%	0.427	S	S	.	.			trans	-117.1	168.3	175.1	71.8	0	0	0	0	110.4	W603 E614 D615	W603-S612 WeakPolarHBondContact CH2-O 3.36Å; S612-E614 PolarHBondContact O-N 3.23Å; S612-E614 VanDerWaalsContact O-N 3.11Å; S612-E614 PolarHBondContact OG-N 3.22Å; S612-D615 PolarHBondContact N-OD2 3.37Å; S612-D615 PolarHBondContact O-N 3.32Å; S612-D615 PolarHBondContact OG-OD2 3.32Å
613	E	80	Confident	83.5	Confident	119 Å²	119	80.5 Å²	80.5	56%	0.556	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-61.8	-17.9	176.5	-64.6	-180	169.3	0	0	113	P605 D615 Q622	P605-E613 HydrophobicContact CG-CG 4.16Å; E613-D615 VanDerWaalsContact C-N 3.3Å; E613-Q622 PolarHBondContact O-NE2 2.85Å
614	E	82.3	Confident	83.6	Confident	185 Å²	185	83.7 Å²	83.7	86%	0.864	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-76.8	-17.3	177.1	-59.1	-177.5	176.1	0	0	112.7	S612 C616	S612-E614 PolarHBondContact O-N 3.23Å; S612-E614 VanDerWaalsContact O-N 3.11Å; S612-E614 PolarHBondContact OG-N 3.22Å; E614-C616 PolarHBondContact O-N 2.95Å
615	D	86.2	Confident	84	Confident	89 Å²	89	81.3 Å²	81.3	48%	0.476	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-84.8	8.2	-177.5	-59.5	-59.3	0	0	0	113.4	S612 E613 E617	S612-D615 PolarHBondContact N-OD2 3.37Å; S612-D615 PolarHBondContact O-N 3.32Å; S612-D615 PolarHBondContact OG-OD2 3.32Å; E613-D615 VanDerWaalsContact C-N 3.3Å; D615-E617 PolarHBondContact O-N 3.4Å
616	C	84.5	Confident	84.5	Confident	13 Å²	13	86.1 Å²	86.1	9%	0.088	46%	0.461	C	S	.	.			trans	-83.7	111.7	-179.8	-171.9	0	0	0	0	111.4	W603 E614 D618 Q622	W603-C616 HydrophobicContact CD2-CB 3.88Å; W603-C616 VanDerWaalsContact CD2-SG 3.5Å; W603-C616 HydrophobicContact CE3-CB 3.62Å; W603-C616 VanDerWaalsContact CE3-SG 3.58Å; W603-C616 HydrophobicContact CH2-CB 3.83Å; W603-C616 HydrophobicContact CZ2-CB 4.08Å; W603-C616 HydrophobicContact CZ3-CB 3.6Å; E614-C616 PolarHBondContact O-N 2.95Å; C616-D618 PolarHBondContact O-N 2.96Å; C616-D618 PolarHBondContact SG-O 3.04Å; C616-Q622 HydrophobicContact CB-CG 4.27Å
617	E	83.2	Confident	85.1	Confident	196 Å²	196	85.3 Å²	85.3	92%	0.916	46%	0.457	S	S	*	.	S	Bend	trans	-61.3	-30.3	178.9	-62.3	177.7	170.9	0	0	113.3	D615	D615-E617 PolarHBondContact O-N 3.4Å
618	D	87.7	Confident	86	Confident	31 Å²	31	78.1 Å²	78.1	17%	0.166	43%	0.425	C	S	.	.			trans	-123.6	92.2	-177.9	-176.4	-17.1	0	0	0	110.3	C616 D620 R621 R1156	C616-D618 PolarHBondContact O-N 2.96Å; C616-D618 PolarHBondContact SG-O 3.04Å; D618-D620 PolarHBondContact O-N 3.26Å; D618-D620 PolarHBondContact OD1-N 3.1Å; D618-R621 HydrophobicContact CB-CG 4Å; D618-R621 WeakPolarHBondContact O-CB 3.5Å; D618-R621 PolarHBondContact O-N 3.36Å; D618-R1156 IonicContact OD1-CZ 3.62Å; D618-R1156 IonicContact OD1-NH1 2.66Å; D618-R1156 PolarHBondContact OD1-NH1 3.49Å; D618-R1156 IonicContact OD1-NH2 3.53Å; D618-R1156 PolarHBondContact OD1-NH2 2.93Å; D618-R1156 IonicContact OD2-CZ 3.67Å; D618-R1156 VanDerWaalsContact OD2-CZ 3.31Å; D618-R1156 IonicContact OD2-NH1 3.6Å; D618-R1156 PolarHBondContact OD2-NH1 3.43Å; D618-R1156 IonicContact OD2-NH2 2.8Å; D618-R1156 PolarHBondContact OD2-NH2 3.33Å
619	P	87.8	Confident	86.9	Confident	93 Å²	93	73.7 Å²	73.7	60%	0.604	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-58.8	-28.7	-175.2	-26.6	35	0	0	0	114.2	R621 Q622	P619-R621 PolarHBondContact O-N 2.97Å; P619-R621 VanDerWaalsContact O-N 3.16Å; P619-Q622 WeakPolarHBondContact O-CB 3.49Å; P619-Q622 PolarHBondContact O-N 3.33Å
620	D	86.9	Confident	87.8	Confident	85 Å²	85	69 Å²	69	46%	0.455	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-66.4	-16.4	178.1	-77.5	-36.3	0	0	0	112.3	D618 Q622	D618-D620 PolarHBondContact O-N 3.26Å; D618-D620 PolarHBondContact OD1-N 3.1Å; D620-Q622 VanDerWaalsContact C-N 3.27Å
621	R	89.9	Confident	88.7	Confident	37 Å²	37	66 Å²	66	14%	0.14	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-75.5	-13.6	171.3	-63	-177.9	63.3	-159.2	-4.7	113.4	L601 P602 W603 D618 P619 V623	L601-R621 PolarHBondContact O-NH2 3.1Å; P602-R621 WeakPolarHBondContact CA-O 3.38Å; W603-R621 HydrophobicContact CB-CB 3.61Å; W603-R621 PolarHBondContact N-O 2.8Å; D618-R621 HydrophobicContact CB-CG 4Å; D618-R621 WeakPolarHBondContact O-CB 3.5Å; D618-R621 PolarHBondContact O-N 3.36Å; P619-R621 PolarHBondContact O-N 2.97Å; P619-R621 VanDerWaalsContact O-N 3.16Å; R621-V623 PolarHBondContact O-N 2.79Å
622	Q	90.4	Very high	89.2	Confident	51 Å²	51	62.6 Å²	62.6	24%	0.238	33%	0.328	C	S	.	.			trans	-85.7	109.6	174	-60.5	-172.4	0.2	0	0	109.8	W603 E613 C616 P619 D620	W603-Q622 HydrophobicContact CE3-CG 4.16Å; E613-Q622 PolarHBondContact O-NE2 2.85Å; C616-Q622 HydrophobicContact CB-CG 4.27Å; P619-Q622 WeakPolarHBondContact O-CB 3.49Å; P619-Q622 PolarHBondContact O-N 3.33Å; D620-Q622 VanDerWaalsContact C-N 3.27Å
623	V	92.4	Very high	89.7	Confident	10 Å²	10	60.3 Å²	60.3	6%	0.061	31%	0.312	C	S	.	.			trans	-96	114.6	-178.7	-174.8	0	0	0	0	110.3	E494 K495 S498 W530 P602 R621 D627 I628	E494-V623 HydrophobicContact CB-CG2 4.21Å; E494-V623 HydrophobicContact CG-CG2 4.27Å; K495-V623 HydrophobicContact CG-CG1 4.39Å; K495-V623 HydrophobicContact CG-CG2 4.03Å; S498-V623 WeakPolarHBondContact OG-CB 3.34Å; S498-V623 WeakPolarHBondContact OG-CG2 3.33Å; W530-V623 PolarHBondContact NE1-O 2.9Å; P602-V623 HydrophobicContact CB-CG2 4.12Å; R621-V623 PolarHBondContact O-N 2.79Å; V623-D627 HydrophobicContact CG1-CB 3.92Å; V623-I628 HydrophobicContact CG1-CG2 4.03Å
624	L	91.9	Very high	90.2	Very high	107 Å²	107	55.1 Å²	55.1	56%	0.56	29%	0.288	S	S	*	.			trans	-82.9	163.4	179.8	-59.6	180	0	0	0	111.4	D626 D627	L624-D626 VanDerWaalsContact C-N 3.27Å; L624-D626 PolarHBondContact O-N 3.17Å; L624-D627 PolarHBondContact N-OD2 3.45Å; L624-D627 WeakPolarHBondContact O-CB 3.47Å; L624-D627 PolarHBondContact O-N 3.17Å
625	F	93.2	Very high	90.6	Very high	12 Å²	12	46.9 Å²	46.9	5%	0.053	25%	0.25	C	S	.	.	H	α-helix	trans	-62.4	-36	177.2	-170.2	-109.4	0	0	0	112.6	V523 F526 E527 W530 D627 I628 G629 L632	V523-F625 HydrophobicContact CG1-CE1 4.03Å; V523-F625 HydrophobicContact CG1-CZ 3.72Å; F526-F625 AromaticContact CD1-CE2 3.69Å; F526-F625 HydrophobicContact CD1-CE2 3.69Å; F526-F625 HydrophobicContact CD1-CZ 4.25Å; F526-F625 HydrophobicContact CE1-CE2 4.13Å; E527-F625 HydrophobicContact CB-CD1 3.71Å; E527-F625 HydrophobicContact CB-CD2 4.44Å; E527-F625 HydrophobicContact CB-CE1 3.43Å; E527-F625 VanDerWaalsContact CB-CE1 3.43Å; E527-F625 HydrophobicContact CB-CE2 4.23Å; E527-F625 HydrophobicContact CB-CG 4.19Å; E527-F625 HydrophobicContact CB-CZ 3.7Å; E527-F625 HydrophobicContact CG-CB 4.38Å; E527-F625 HydrophobicContact CG-CD1 3.37Å; E527-F625 HydrophobicContact CG-CE1 3.65Å; E527-F625 HydrophobicContact CG-CG 3.83Å; E527-F625 HydrophobicContact CG-CZ 4.32Å; W530-F625 HydrophobicContact CB-CD2 3.65Å; W530-F625 HydrophobicContact CB-CE2 4.19Å; W530-F625 AromaticContact CD1-CD2 3.77Å; W530-F625 HydrophobicContact CD2-CD2 4.42Å; W530-F625 HydrophobicContact CG-CB 4.42Å; W530-F625 AromaticContact CG-CD2 3.67Å; W530-F625 HydrophobicContact CG-CD2 3.67Å; W530-F625 HydrophobicContact CG-CE2 4.48Å; F625-D627 PolarHBondContact O-N 3.31Å; F625-D627 VanDerWaalsContact O-N 3.14Å; F625-I628 HydrophobicContact CD2-CD1 3.77Å; F625-I628 HydrophobicContact CD2-CG1 3.85Å; F625-I628 HydrophobicContact CE2-CD1 4.01Å; F625-I628 HydrophobicContact CE2-CG1 4.27Å; F625-I628 HydrophobicContact CG-CG1 4.5Å; F625-I628 VanDerWaalsContact O-CG1 3.24Å; F625-I628 WeakPolarHBondContact O-CG1 3.45Å; F625-I628 PolarHBondContact O-N 3.45Å; F625-G629 PolarHBondContact O-N 3.35Å; F625-L632 HydrophobicContact CE2-CD1 4.3Å; F625-L632 HydrophobicContact CZ-CD1 4.37Å
626	D	92.2	Very high	90.6	Very high	131 Å²	131	47.3 Å²	47.3	70%	0.701	26%	0.257	S	S	*	.	H	α-helix	trans	-58.4	-28.1	177.9	-78.2	-22.9	0	0	0	113.3	L624 I628	L624-D626 VanDerWaalsContact C-N 3.27Å; L624-D626 PolarHBondContact O-N 3.17Å; D626-I628 VanDerWaalsContact C-N 3.3Å; D626-I628 PolarHBondContact O-N 3.26Å
627	D	90.7	Very high	90.7	Very high	35 Å²	35	48.7 Å²	48.7	19%	0.187	27%	0.266	C	S	.	.	H	α-helix	trans	-71	-25.2	175.9	-71.3	-62.1	0	0	0	112.7	K495 V623 L624 F625	K495-D627 IonicContact NZ-OD1 2.79Å; K495-D627 PolarHBondContact NZ-OD1 3.5Å; K495-D627 IonicContact NZ-OD2 2.68Å; V623-D627 HydrophobicContact CG1-CB 3.92Å; L624-D627 PolarHBondContact N-OD2 3.45Å; L624-D627 WeakPolarHBondContact O-CB 3.47Å; L624-D627 PolarHBondContact O-N 3.17Å; F625-D627 PolarHBondContact O-N 3.31Å; F625-D627 VanDerWaalsContact O-N 3.14Å
628	I	93.3	Very high	90.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-115.8	-38	-170.3	60.9	149.8	0	0	0	114.4	L499 A502 F526 W530 V623 F625 D626 S631	L499-I628 HydrophobicContact CD2-CB 3.9Å; L499-I628 HydrophobicContact CD2-CG2 3.87Å; L499-I628 HydrophobicContact CG-CG2 4.12Å; A502-I628 HydrophobicContact CB-CD1 3.57Å; F526-I628 HydrophobicContact CE1-CD1 4.45Å; W530-I628 HydrophobicContact CD2-CD1 3.43Å; W530-I628 VanDerWaalsContact CD2-CD1 3.43Å; W530-I628 HydrophobicContact CE3-CD1 3.65Å; W530-I628 HydrophobicContact CG-CD1 4.07Å; W530-I628 HydrophobicContact CH2-CD1 3.7Å; W530-I628 HydrophobicContact CZ2-CD1 3.46Å; W530-I628 VanDerWaalsContact CZ2-CD1 3.46Å; W530-I628 HydrophobicContact CZ2-CG1 4.19Å; W530-I628 HydrophobicContact CZ2-CG2 4.44Å; W530-I628 HydrophobicContact CZ3-CD1 3.79Å; V623-I628 HydrophobicContact CG1-CG2 4.03Å; F625-I628 HydrophobicContact CD2-CD1 3.77Å; F625-I628 HydrophobicContact CD2-CG1 3.85Å; F625-I628 HydrophobicContact CE2-CD1 4.01Å; F625-I628 HydrophobicContact CE2-CG1 4.27Å; F625-I628 HydrophobicContact CG-CG1 4.5Å; F625-I628 VanDerWaalsContact O-CG1 3.24Å; F625-I628 WeakPolarHBondContact O-CG1 3.45Å; F625-I628 PolarHBondContact O-N 3.45Å; D626-I628 VanDerWaalsContact C-N 3.3Å; D626-I628 PolarHBondContact O-N 3.26Å; I628-S631 WeakPolarHBondContact O-CB 3.36Å; I628-S631 PolarHBondContact O-N 2.97Å
629	G	92.4	Very high	90.6	Very high	5 Å²	5	45.3 Å²	45.3	5%	0.052	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-54.9	-48.6	-167.7	0	0	0	0	0	113.9	F625 S631 L632	F625-G629 PolarHBondContact O-N 3.35Å; G629-S631 PolarHBondContact O-N 3.44Å; G629-L632 PolarHBondContact O-N 2.88Å
630	P	93.8	Very high	90.6	Very high	61 Å²	61	41.4 Å²	41.4	40%	0.396	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-60.7	-17.6	177.9	-26.3	36	0	0	0	115
631	S	95.6	Very high	90.7	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.014	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-99.7	-3.6	-174.1	-47.3	0	0	0	0	113.2	Q483 I628 G629	Q483-S631 PolarHBondContact NE2-OG 3.35Å; Q483-S631 PolarHBondContact OE1-OG 3.3Å; I628-S631 WeakPolarHBondContact O-CB 3.36Å; I628-S631 PolarHBondContact O-N 2.97Å; G629-S631 PolarHBondContact O-N 3.44Å
632	L	95.4	Very high	90.6	Very high	4 Å²	4	38.1 Å²	38.1	2%	0.021	21%	0.213	C	C	.	.			trans	-73.8	127.4	179.3	-62.6	179.1	0	0	0	110.9	A502 M503 F506 V523 F526 F625 G629	A502-L632 HydrophobicContact CB-CD2 3.8Å; M503-L632 HydrophobicContact CG-CD2 4Å; M503-L632 HydrophobicContact SD-CB 4.44Å; M503-L632 HydrophobicContact SD-CD2 3.88Å; F506-L632 HydrophobicContact CD2-CD1 4.4Å; V523-L632 HydrophobicContact CG1-CD1 4.4Å; V523-L632 HydrophobicContact CG2-CB 3.83Å; V523-L632 HydrophobicContact CG2-CD1 4.16Å; F526-L632 HydrophobicContact CD1-CD1 3.48Å; F526-L632 VanDerWaalsContact CD1-CD1 3.48Å; F526-L632 HydrophobicContact CE1-CD1 3.8Å; F526-L632 HydrophobicContact CG-CD1 4.47Å; F625-L632 HydrophobicContact CE2-CD1 4.3Å; F625-L632 HydrophobicContact CZ-CD1 4.37Å; G629-L632 PolarHBondContact O-N 2.88Å
633	I	94.1	Very high	90.4	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.207	C	C	.	.			trans	-122.8	148.9	-179.4	63.8	175.6	0	0	0	110.9	L452 M476 F480 M503 F506 L635	L452-I633 HydrophobicContact CB-CG2 4.04Å; L452-I633 HydrophobicContact CD2-CG2 3.94Å; L452-I633 HydrophobicContact CG-CG2 4.43Å; M476-I633 HydrophobicContact CB-CD1 3.81Å; M476-I633 HydrophobicContact CB-CG2 4.4Å; M476-I633 HydrophobicContact SD-CG2 4.3Å; F480-I633 HydrophobicContact CB-CD1 4.15Å; M503-I633 HydrophobicContact CE-CD1 4.28Å; M503-I633 HydrophobicContact CE-CG1 3.4Å; M503-I633 WeakPolarHBondContact CE-O 3.5Å; M503-I633 HydrophobicContact SD-CG1 4.07Å; M503-I633 PolarHBondContact SD-N 3.21Å; M503-I633 VanDerWaalsContact SD-N 3.42Å; F506-I633 WeakPolarHBondContact CE1-O 3.33Å; I633-L635 HydrophobicContact CD1-CD2 4.12Å; I633-L635 HydrophobicContact CG1-CD2 4.48Å
634	C	90.8	Very high	90.4	Very high	10 Å²	10	36.5 Å²	36.5	7%	0.068	20%	0.204	C	C	.	.			trans	-85.1	133.9	173.4	-72.7	0	0	0	0	110.7	R459 F506 T519 Q522	R459-C634 VanDerWaalsContact CZ-O 3.24Å; R459-C634 PolarHBondContact NH1-O 3.25Å; R459-C634 PolarHBondContact NH2-O 3.39Å; F506-C634 VanDerWaalsContact CE1-SG 3.52Å; T519-C634 PolarHBondContact OG1-SG 3.19Å; T519-C634 VanDerWaalsContact OG1-SG 3.37Å; Q522-C634 PolarHBondContact OE1-SG 3.34Å
635	L	89.9	Confident	90.3	Very high	12 Å²	12	31.7 Å²	31.7	6%	0.063	18%	0.179	C	C	.	.			trans	-116.7	117.9	171.6	-61.2	176.1	0	0	0	109.6	L477 M503 I633 Q641 F644	L477-L635 HydrophobicContact CB-CD2 4.45Å; L477-L635 HydrophobicContact CD1-CD1 4.39Å; M503-L635 HydrophobicContact CE-CD1 4.33Å; I633-L635 HydrophobicContact CD1-CD2 4.12Å; I633-L635 HydrophobicContact CG1-CD2 4.48Å; L635-Q641 HydrophobicContact CB-CG 4.04Å; L635-Q641 PolarHBondContact O-NE2 3.33Å; L635-F644 HydrophobicContact CD1-CB 3.93Å; L635-F644 HydrophobicContact CD1-CG 4.22Å
636	T	85.7	Confident	90	Very high	99 Å²	99	31.3 Å²	31.3	61%	0.607	18%	0.177	S	C	*	.			trans	-98	-30.3	-179	49.4	0	0	0	0	112.5	R459 E473	R459-T636 VanDerWaalsContact NH2-CG2 3.31Å; R459-T636 PolarHBondContact NH2-OG1 3.4Å; E473-T636 PolarHBondContact OE1-OG1 3.17Å; E473-T636 PolarHBondContact OE2-N 2.68Å; E473-T636 PolarHBondContact OE2-OG1 2.65Å
637	S	86.8	Confident	89.8	Confident	41 Å²	41	25.8 Å²	25.8	29%	0.287	15%	0.149	S	C	.	.			trans	-75.2	129	179.8	176.3	0	0	0	0	112	E639 L640 Q641	S637-E639 VanDerWaalsContact C-N 3.25Å; S637-E639 PolarHBondContact O-N 3.31Å; S637-E639 PolarHBondContact OG-N 2.68Å; S637-L640 PolarHBondContact O-N 3.14Å; S637-Q641 WeakPolarHBondContact O-CG 3.44Å; S637-Q641 PolarHBondContact O-N 3.33Å
638	P	85.5	Confident	89.8	Confident	75 Å²	75	24.3 Å²	24.3	49%	0.487	14%	0.141	S	C	.	.	H	α-helix	trans	-63.8	-30.7	175.7	26.3	-33.6	0	0	0	112.5	Q641 L642 H738	P638-Q641 WeakPolarHBondContact O-CB 3.44Å; P638-Q641 PolarHBondContact O-N 3.23Å; P638-L642 PolarHBondContact O-N 3.39Å; P638-H738 PolarHBondContact O-CE1 3.13Å; P638-H738 VanDerWaalsContact O-CE1 3.23Å
639	E	83.9	Confident	89.6	Confident	82 Å²	82	24.4 Å²	24.4	38%	0.383	14%	0.142	S	C	.	.	H	α-helix	trans	-68	-41.6	176.3	-180	57.4	-155.9	0	0	111.3	S637 Q641 L642 R643	S637-E639 VanDerWaalsContact C-N 3.25Å; S637-E639 PolarHBondContact O-N 3.31Å; S637-E639 PolarHBondContact OG-N 2.68Å; E639-Q641 VanDerWaalsContact C-N 3.32Å; E639-Q641 PolarHBondContact O-N 2.82Å; E639-L642 PolarHBondContact O-N 3.22Å; E639-R643 PolarHBondContact O-N 3.42Å
640	L	87.4	Confident	89.2	Confident	10 Å²	10	25 Å²	25	5%	0.052	15%	0.146	C	C	.	.	H	α-helix	trans	-69.1	-32.7	176.1	-63.2	-179.5	0	0	0	112.3	E473 E474 L477 S637 R643 F644	E473-L640 HydrophobicContact CB-CD1 3.59Å; E474-L640 HydrophobicContact CB-CD2 4.34Å; E474-L640 HydrophobicContact CG-CD1 4.04Å; E474-L640 HydrophobicContact CG-CD2 3.83Å; L477-L640 HydrophobicContact CD2-CB 4.37Å; L477-L640 HydrophobicContact CD2-CD2 4.44Å; L477-L640 WeakPolarHBondContact CD2-O 3.29Å; S637-L640 PolarHBondContact O-N 3.14Å; L640-R643 PolarHBondContact O-N 2.92Å; L640-F644 WeakPolarHBondContact O-CB 3.44Å; L640-F644 PolarHBondContact O-N 2.75Å
641	Q	90.1	Very high	88.9	Confident	41 Å²	41	22.2 Å²	22.2	19%	0.192	13%	0.128	C	C	.	.	H	α-helix	trans	-63.7	-42.3	170.8	-73.4	176.7	3.3	0	0	111.7	Y508 L635 S637 P638 E639 F644 L645	Y508-Q641 WeakPolarHBondContact OH-CB 3.21Å; Y508-Q641 PolarHBondContact OH-O 3.22Å; L635-Q641 HydrophobicContact CB-CG 4.04Å; L635-Q641 PolarHBondContact O-NE2 3.33Å; S637-Q641 WeakPolarHBondContact O-CG 3.44Å; S637-Q641 PolarHBondContact O-N 3.33Å; P638-Q641 WeakPolarHBondContact O-CB 3.44Å; P638-Q641 PolarHBondContact O-N 3.23Å; E639-Q641 VanDerWaalsContact C-N 3.32Å; E639-Q641 PolarHBondContact O-N 2.82Å; Q641-F644 WeakPolarHBondContact O-CB 3.27Å; Q641-F644 PolarHBondContact O-N 2.85Å; Q641-L645 PolarHBondContact O-N 3.11Å; Q641-L645 VanDerWaalsContact O-N 3.1Å
642	L	87.3	Confident	88.5	Confident	12 Å²	12	22.2 Å²	22.2	6%	0.063	13%	0.128	C	C	.	.	H	α-helix	trans	-63.4	-48.3	172.6	179	63.3	0	0	0	111.2	P638 E639 F644 L645 L646 H738 V741	P638-L642 PolarHBondContact O-N 3.39Å; E639-L642 PolarHBondContact O-N 3.22Å; L642-F644 VanDerWaalsContact C-N 3.26Å; L642-F644 PolarHBondContact O-N 3.19Å; L642-L645 PolarHBondContact O-N 3.16Å; L642-L645 VanDerWaalsContact O-N 3.12Å; L642-L646 HydrophobicContact CD1-CD1 4.44Å; L642-L646 HydrophobicContact CD1-CG 4.19Å; L642-L646 HydrophobicContact CG-CD1 4.14Å; L642-L646 HydrophobicContact CG-CG 4.27Å; L642-L646 WeakPolarHBondContact O-CB 3.21Å; L642-L646 WeakPolarHBondContact O-CG 3.47Å; L642-L646 PolarHBondContact O-N 3.13Å; L642-H738 HydrophobicContact CD1-CB 4.05Å; L642-V741 HydrophobicContact CD1-CG1 4.39Å
643	R	86.4	Confident	87.8	Confident	27 Å²	27	23.2 Å²	23.2	10%	0.102	14%	0.139	C	C	.	.	H	α-helix	trans	-56.2	-41	176.6	-177.3	174.9	168.4	173.6	-4.1	111.6	L477 D478 E639 L640 L646 S647	L477-R643 HydrophobicContact CD2-CB 4.17Å; L477-R643 HydrophobicContact CD2-CG 4.05Å; D478-R643 IonicContact OD1-CZ 3.02Å; D478-R643 IonicContact OD1-NH2 2.71Å; D478-R643 PolarHBondContact OD1-NH2 3.16Å; D478-R643 IonicContact OD2-NH2 2.62Å; E639-R643 PolarHBondContact O-N 3.42Å; L640-R643 PolarHBondContact O-N 2.92Å; R643-L646 PolarHBondContact O-N 3.11Å; R643-S647 WeakPolarHBondContact O-CB 3.34Å; R643-S647 PolarHBondContact O-N 3.41Å; R643-S647 PolarHBondContact O-OG 3.17Å; R643-S647 VanDerWaalsContact O-OG 3.1Å
644	F	91.1	Very high	87.3	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-59.1	-50.3	173.7	164.1	-106.7	0	0	0	112.4	L477 F480 F500 M503 I504 L635 L640 Q641 L642 L646 S647 F648	L477-F644 HydrophobicContact CD1-CB 3.79Å; L477-F644 HydrophobicContact CD1-CD2 3.92Å; L477-F644 HydrophobicContact CD1-CG 4.31Å; L477-F644 HydrophobicContact CD2-CB 4.3Å; F480-F644 HydrophobicContact CD1-CE2 4.46Å; F480-F644 HydrophobicContact CE1-CD2 4.32Å; F480-F644 AromaticContact CE1-CE2 3.77Å; F480-F644 HydrophobicContact CE1-CE2 3.77Å; F480-F644 HydrophobicContact CZ-CE2 4.4Å; F500-F644 AromaticContact CD1-CE2 3.63Å; F500-F644 HydrophobicContact CD1-CE2 3.63Å; F500-F644 HydrophobicContact CD1-CZ 4Å; F500-F644 HydrophobicContact CE1-CD2 4.49Å; F500-F644 AromaticContact CE1-CE2 3.96Å; F500-F644 HydrophobicContact CE1-CE2 3.96Å; M503-F644 HydrophobicContact CB-CE1 4.43Å; M503-F644 HydrophobicContact CB-CE2 3.83Å; M503-F644 HydrophobicContact CB-CZ 3.52Å; I504-F644 HydrophobicContact CG1-CE1 3.64Å; I504-F644 HydrophobicContact CG1-CZ 3.87Å; L635-F644 HydrophobicContact CD1-CB 3.93Å; L635-F644 HydrophobicContact CD1-CG 4.22Å; L640-F644 WeakPolarHBondContact O-CB 3.44Å; L640-F644 PolarHBondContact O-N 2.75Å; Q641-F644 WeakPolarHBondContact O-CB 3.27Å; Q641-F644 PolarHBondContact O-N 2.85Å; L642-F644 VanDerWaalsContact C-N 3.26Å; L642-F644 PolarHBondContact O-N 3.19Å; F644-L646 VanDerWaalsContact C-N 3.3Å; F644-L646 PolarHBondContact O-N 3.22Å; F644-S647 WeakPolarHBondContact O-CB 3.34Å; F644-S647 PolarHBondContact O-N 3.12Å; F644-F648 PolarHBondContact O-N 3.41Å
645	L	90.5	Very high	86.4	Confident	6 Å²	6	23.6 Å²	23.6	3%	0.031	14%	0.141	C	C	.	.	H	α-helix	trans	-61.9	-39.3	177.1	-70.5	-179.6	0	0	0	112.1	I504 Y508 Q641 L642 F648 L649 L730 L734 L742	I504-L645 HydrophobicContact CG1-CD2 4.4Å; Y508-L645 HydrophobicContact CE2-CD1 4.24Å; Y508-L645 HydrophobicContact CE2-CD2 3.96Å; Y508-L645 HydrophobicContact CE2-CG 4.14Å; Y508-L645 WeakPolarHBondContact OH-CD1 3.48Å; Y508-L645 WeakPolarHBondContact OH-CG 3.45Å; Q641-L645 PolarHBondContact O-N 3.11Å; Q641-L645 VanDerWaalsContact O-N 3.1Å; L642-L645 PolarHBondContact O-N 3.16Å; L642-L645 VanDerWaalsContact O-N 3.12Å; L645-F648 WeakPolarHBondContact O-CB 3.43Å; L645-F648 PolarHBondContact O-N 3.17Å; L645-L649 WeakPolarHBondContact O-CG 3.24Å; L645-L649 PolarHBondContact O-N 3.32Å; L645-L730 HydrophobicContact CD1-CD1 4.26Å; L645-L730 HydrophobicContact CD2-CD1 3.74Å; L645-L734 HydrophobicContact CD1-CD1 4.31Å; L645-L734 HydrophobicContact CD1-CD2 3.85Å; L645-L742 HydrophobicContact CD1-CD1 4.49Å
646	L	87.1	Confident	85.4	Confident	4 Å²	4	23.1 Å²	23.1	2%	0.021	14%	0.139	C	C	.	.	H	α-helix	trans	-64.8	-41.3	176	-73.9	-171	0	0	0	112	L642 R643 F644 F648 L649 A650 V656 V741	L642-L646 HydrophobicContact CD1-CD1 4.44Å; L642-L646 HydrophobicContact CD1-CG 4.19Å; L642-L646 HydrophobicContact CG-CD1 4.14Å; L642-L646 HydrophobicContact CG-CG 4.27Å; L642-L646 WeakPolarHBondContact O-CB 3.21Å; L642-L646 WeakPolarHBondContact O-CG 3.47Å; L642-L646 PolarHBondContact O-N 3.13Å; R643-L646 PolarHBondContact O-N 3.11Å; F644-L646 VanDerWaalsContact C-N 3.3Å; F644-L646 PolarHBondContact O-N 3.22Å; L646-F648 VanDerWaalsContact C-N 3.33Å; L646-L649 HydrophobicContact CD2-CD1 4.49Å; L646-L649 PolarHBondContact O-N 3.19Å; L646-A650 WeakPolarHBondContact O-CB 3.44Å; L646-A650 PolarHBondContact O-N 3.18Å; L646-V656 HydrophobicContact CB-CG1 3.91Å; L646-V656 HydrophobicContact CD1-CG1 3.99Å; L646-V656 HydrophobicContact CD2-CG1 3.69Å; L646-V656 HydrophobicContact CD2-CG2 4.41Å; L646-V656 HydrophobicContact CG-CG1 4.05Å; L646-V741 HydrophobicContact CD1-CG1 4.34Å; L646-V741 HydrophobicContact CD2-CG1 3.81Å
647	S	87.4	Confident	84.2	Confident	16 Å²	16	20.6 Å²	20.6	11%	0.112	12%	0.121	C	C	.	.	H	α-helix	trans	-61.1	-41.4	172	-68	0	0	0	0	111.6	R643 F644 A650 F651	R643-S647 WeakPolarHBondContact O-CB 3.34Å; R643-S647 PolarHBondContact O-N 3.41Å; R643-S647 PolarHBondContact O-OG 3.17Å; R643-S647 VanDerWaalsContact O-OG 3.1Å; F644-S647 WeakPolarHBondContact O-CB 3.34Å; F644-S647 PolarHBondContact O-N 3.12Å; S647-A650 PolarHBondContact O-N 3.34Å; S647-F651 VanDerWaalsContact O-CB 3.25Å; S647-F651 WeakPolarHBondContact O-CB 3.38Å; S647-F651 PolarHBondContact O-N 3.28Å
648	F	91.2	Very high	82.6	Confident	4 Å²	4	21.4 Å²	21.4	2%	0.018	12%	0.12	C	C	.	.	H	α-helix	trans	-63.2	-44.9	175.4	177.7	-128.2	0	0	0	112.4	I497 F500 I504 F644 L645 L646 F651 L652 F722 V726	I497-F648 HydrophobicContact CD1-CE2 4.15Å; F500-F648 HydrophobicContact CB-CD2 3.55Å; F500-F648 HydrophobicContact CB-CE2 3.5Å; F500-F648 VanDerWaalsContact CB-CE2 3.5Å; F500-F648 HydrophobicContact CB-CG 4.33Å; F500-F648 HydrophobicContact CB-CZ 4.25Å; F500-F648 HydrophobicContact CD1-CB 3.72Å; F500-F648 AromaticContact CD1-CD2 3.48Å; F500-F648 HydrophobicContact CD1-CD2 3.48Å; F500-F648 VanDerWaalsContact CD1-CD2 3.48Å; F500-F648 HydrophobicContact CD1-CE2 4.32Å; F500-F648 AromaticContact CD1-CG 3.87Å; F500-F648 HydrophobicContact CD1-CG 3.87Å; F500-F648 AromaticContact CD2-CD2 3.51Å; F500-F648 HydrophobicContact CD2-CD2 3.51Å; F500-F648 AromaticContact CD2-CE2 3.86Å; F500-F648 HydrophobicContact CD2-CE2 3.86Å; F500-F648 HydrophobicContact CE1-CB 3.74Å; F500-F648 AromaticContact CE1-CD2 3.98Å; F500-F648 HydrophobicContact CE1-CD2 3.98Å; F500-F648 HydrophobicContact CE1-CG 4.3Å; F500-F648 AromaticContact CE2-CD2 4Å; F500-F648 HydrophobicContact CE2-CD2 4Å; F500-F648 HydrophobicContact CG-CB 4.38Å; F500-F648 AromaticContact CG-CD2 3.23Å; F500-F648 HydrophobicContact CG-CD2 3.23Å; F500-F648 AromaticContact CG-CE2 3.67Å; F500-F648 HydrophobicContact CG-CE2 3.67Å; F500-F648 HydrophobicContact CG-CG 4.06Å; F500-F648 HydrophobicContact CZ-CB 4.42Å; F500-F648 HydrophobicContact CZ-CD2 4.22Å; I504-F648 HydrophobicContact CD1-CD1 4.11Å; I504-F648 HydrophobicContact CD1-CE1 3.96Å; F644-F648 PolarHBondContact O-N 3.41Å; L645-F648 WeakPolarHBondContact O-CB 3.43Å; L645-F648 PolarHBondContact O-N 3.17Å; L646-F648 VanDerWaalsContact C-N 3.33Å; F648-F651 WeakPolarHBondContact O-CB 3.47Å; F648-F651 PolarHBondContact O-N 3.4Å; F648-L652 HydrophobicContact CD1-CD1 4.35Å; F648-L652 HydrophobicContact CD2-CD1 4.31Å; F648-L652 HydrophobicContact CD2-CG 4.35Å; F648-L652 HydrophobicContact CE1-CD1 3.88Å; F648-L652 HydrophobicContact CE2-CD1 3.85Å; F648-L652 HydrophobicContact CE2-CD2 4.36Å; F648-L652 HydrophobicContact CE2-CG 4.06Å; F648-L652 HydrophobicContact CZ-CD1 3.64Å; F648-L652 HydrophobicContact CZ-CG 4.36Å; F648-L652 WeakPolarHBondContact O-CG 3.37Å; F648-L652 PolarHBondContact O-N 2.93Å; F648-F722 AromaticContact CZ-CE1 3.94Å; F648-F722 HydrophobicContact CZ-CE1 3.94Å; F648-F722 HydrophobicContact CZ-CZ 4.34Å; F648-V726 HydrophobicContact CE1-CG1 4.49Å
649	L	88.4	Confident	80.7	Confident	2 Å²	2	20.9 Å²	20.9	1%	0.01	12%	0.115	C	C	.	.	H	α-helix	trans	-62.2	-45	175.3	-72.9	-176	0	0	0	111.9	L645 L646 F651 L652 G653 F654 V656 L723 F727 L742	L645-L649 WeakPolarHBondContact O-CG 3.24Å; L645-L649 PolarHBondContact O-N 3.32Å; L646-L649 HydrophobicContact CD2-CD1 4.49Å; L646-L649 PolarHBondContact O-N 3.19Å; L649-F651 VanDerWaalsContact C-N 3.31Å; L649-F651 PolarHBondContact O-N 3.01Å; L649-L652 PolarHBondContact O-N 2.67Å; L649-G653 PolarHBondContact O-N 3.01Å; L649-F654 HydrophobicContact CB-CB 3.97Å; L649-F654 HydrophobicContact CB-CG 4.38Å; L649-F654 HydrophobicContact CD2-CD1 4.36Å; L649-F654 HydrophobicContact CD2-CD2 4.45Å; L649-F654 HydrophobicContact CD2-CG 4.24Å; L649-F654 VanDerWaalsContact O-CB 3.31Å; L649-F654 WeakPolarHBondContact O-CB 3.39Å; L649-F654 PolarHBondContact O-N 2.84Å; L649-V656 HydrophobicContact CB-CG2 3.99Å; L649-L723 HydrophobicContact CD2-CD2 4.31Å; L649-F727 HydrophobicContact CD1-CE1 4.46Å; L649-F727 HydrophobicContact CD1-CZ 4.05Å; L649-F727 HydrophobicContact CD2-CE1 3.87Å; L649-F727 HydrophobicContact CD2-CZ 3.8Å; L649-L742 HydrophobicContact CD1-CD2 3.6Å
650	A	85	Confident	78.7	Confident	18 Å²	18	20.3 Å²	20.3	15%	0.149	11%	0.114	C	C	.	.	H	α-helix	trans	-62.1	-39.3	176	0	0	0	0	0	111.9	L646 S647 L652 G653 V656 F658	L646-A650 WeakPolarHBondContact O-CB 3.44Å; L646-A650 PolarHBondContact O-N 3.18Å; S647-A650 PolarHBondContact O-N 3.34Å; A650-L652 VanDerWaalsContact C-N 3.31Å; A650-L652 PolarHBondContact O-N 3.34Å; A650-G653 PolarHBondContact O-N 2.97Å; A650-V656 HydrophobicContact CB-CG2 4.18Å; A650-F658 HydrophobicContact CB-CZ 3.87Å
651	F	87.9	Confident	76.5	Confident	1 Å²	1	20.1 Å²	20.1	0%	0.004	11%	0.114	C	C	.	.	H	α-helix	trans	-58.8	-40.7	174.4	178.8	-96.8	0	0	0	112	C484 H485 R488 A496 I497 F500 S647 F648 L649 G653 V700	C484-F651 HydrophobicContact CB-CE2 4.22Å; C484-F651 WeakPolarHBondContact O-CE2 3.38Å; H485-F651 AromaticContact CE1-CD2 3.73Å; H485-F651 AromaticContact ND1-CD2 3.81Å; R488-F651 HydrophobicContact CB-CE2 3.65Å; R488-F651 HydrophobicContact CB-CZ 3.81Å; R488-F651 HydrophobicContact CG-CE2 4.1Å; R488-F651 HydrophobicContact CG-CZ 4.19Å; A496-F651 HydrophobicContact CB-CE1 4.27Å; A496-F651 HydrophobicContact CB-CE2 4.42Å; A496-F651 HydrophobicContact CB-CZ 3.59Å; I497-F651 HydrophobicContact CD1-CD1 4.34Å; I497-F651 HydrophobicContact CD1-CE1 3.83Å; F500-F651 HydrophobicContact CD2-CD1 4.02Å; F500-F651 HydrophobicContact CD2-CE1 4.08Å; F500-F651 HydrophobicContact CE2-CB 4.12Å; F500-F651 AromaticContact CE2-CD1 3.48Å; F500-F651 HydrophobicContact CE2-CD1 3.48Å; F500-F651 VanDerWaalsContact CE2-CD1 3.48Å; F500-F651 AromaticContact CE2-CD2 3.95Å; F500-F651 HydrophobicContact CE2-CD2 3.95Å; F500-F651 AromaticContact CE2-CE1 3.74Å; F500-F651 HydrophobicContact CE2-CE1 3.74Å; F500-F651 HydrophobicContact CE2-CE2 4.2Å; F500-F651 AromaticContact CE2-CG 3.6Å; F500-F651 HydrophobicContact CE2-CG 3.6Å; F500-F651 HydrophobicContact CE2-CZ 4.12Å; F500-F651 HydrophobicContact CZ-CB 4.16Å; F500-F651 HydrophobicContact CZ-CD1 4.35Å; F500-F651 HydrophobicContact CZ-CD2 4.4Å; F500-F651 HydrophobicContact CZ-CG 4.08Å; S647-F651 VanDerWaalsContact O-CB 3.25Å; S647-F651 WeakPolarHBondContact O-CB 3.38Å; S647-F651 PolarHBondContact O-N 3.28Å; F648-F651 WeakPolarHBondContact O-CB 3.47Å; F648-F651 PolarHBondContact O-N 3.4Å; L649-F651 VanDerWaalsContact C-N 3.31Å; L649-F651 PolarHBondContact O-N 3.01Å; F651-G653 PolarHBondContact O-N 3.1Å; F651-V700 HydrophobicContact CD1-CG2 3.41Å; F651-V700 VanDerWaalsContact CD1-CG2 3.41Å; F651-V700 HydrophobicContact CE1-CG2 3.06Å; F651-V700 HydrophobicContact CE2-CG2 4.43Å; F651-V700 HydrophobicContact CG-CG2 4.24Å; F651-V700 HydrophobicContact CZ-CG2 3.63Å
652	L	87	Confident	74	Confident	2 Å²	2	21.8 Å²	21.8	1%	0.01	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-6	174.5	-68	178.1	0	0	0	114.4	I497 W600 F648 L649 A650 F654 V700 L715 L723	I497-L652 HydrophobicContact CD1-CD2 3.79Å; W600-L652 HydrophobicContact CH2-CD2 4.45Å; W600-L652 HydrophobicContact CZ3-CD2 4.05Å; F648-L652 HydrophobicContact CD1-CD1 4.35Å; F648-L652 HydrophobicContact CD2-CD1 4.31Å; F648-L652 HydrophobicContact CD2-CG 4.35Å; F648-L652 HydrophobicContact CE1-CD1 3.88Å; F648-L652 HydrophobicContact CE2-CD1 3.85Å; F648-L652 HydrophobicContact CE2-CD2 4.36Å; F648-L652 HydrophobicContact CE2-CG 4.06Å; F648-L652 HydrophobicContact CZ-CD1 3.64Å; F648-L652 HydrophobicContact CZ-CG 4.36Å; F648-L652 WeakPolarHBondContact O-CG 3.37Å; F648-L652 PolarHBondContact O-N 2.93Å; L649-L652 PolarHBondContact O-N 2.67Å; A650-L652 VanDerWaalsContact C-N 3.31Å; A650-L652 PolarHBondContact O-N 3.34Å; L652-F654 HydrophobicContact CB-CD2 4.12Å; L652-F654 HydrophobicContact CB-CE2 4.43Å; L652-V700 HydrophobicContact CD2-CG2 4.11Å; L652-L715 HydrophobicContact CB-CD1 4.17Å; L652-L715 HydrophobicContact CD1-CD1 4.23Å; L652-L715 HydrophobicContact CD2-CD1 4.05Å; L652-L715 HydrophobicContact CD2-CD2 4.12Å; L652-L715 HydrophobicContact CG-CD1 4.39Å; L652-L723 HydrophobicContact CD1-CD1 4.11Å; L652-L723 HydrophobicContact CD1-CD2 3.54Å; L652-L723 HydrophobicContact CD1-CG 4.05Å
653	G	81.2	Confident	71.7	Confident	26 Å²	26	24.1 Å²	24.1	27%	0.268	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.9	15.7	178.9	0	0	0	0	0	115.8	L649 A650 F651	L649-G653 PolarHBondContact O-N 3.01Å; A650-G653 PolarHBondContact O-N 2.97Å; F651-G653 PolarHBondContact O-N 3.1Å
654	F	82.1	Confident	69.9	Low	7 Å²	7	26.3 Å²	26.3	3%	0.031	17%	0.173	C	C	.	.			trans	-77	139.5	174.9	-76.6	-118.1	0	0	0	110.2	L649 L652 V656 L723 W746 Y749	L649-F654 HydrophobicContact CB-CB 3.97Å; L649-F654 HydrophobicContact CB-CG 4.38Å; L649-F654 HydrophobicContact CD2-CD1 4.36Å; L649-F654 HydrophobicContact CD2-CD2 4.45Å; L649-F654 HydrophobicContact CD2-CG 4.24Å; L649-F654 VanDerWaalsContact O-CB 3.31Å; L649-F654 WeakPolarHBondContact O-CB 3.39Å; L649-F654 PolarHBondContact O-N 2.84Å; L652-F654 HydrophobicContact CB-CD2 4.12Å; L652-F654 HydrophobicContact CB-CE2 4.43Å; F654-V656 PolarHBondContact O-N 3.32Å; F654-L723 HydrophobicContact CD2-CD1 4.27Å; F654-L723 HydrophobicContact CE1-CD1 4.28Å; F654-L723 HydrophobicContact CE2-CD1 3.17Å; F654-L723 HydrophobicContact CZ-CD1 3.19Å; F654-W746 HydrophobicContact CE1-CE3 4.06Å; F654-Y749 VanDerWaalsContact CD1-CB 3.46Å; F654-Y749 HydrophobicContact CD1-CD1 4.36Å; F654-Y749 AromaticContact CD1-CD2 3.92Å; F654-Y749 HydrophobicContact CD1-CD2 3.92Å; F654-Y749 AromaticContact CD1-CG 3.68Å; F654-Y749 HydrophobicContact CD1-CG 3.68Å; F654-Y749 AromaticContact CD2-CD2 3.94Å; F654-Y749 HydrophobicContact CD2-CD2 3.94Å; F654-Y749 HydrophobicContact CD2-CE2 4.07Å; F654-Y749 HydrophobicContact CD2-CG 4.43Å; F654-Y749 VanDerWaalsContact CE1-CB 3.43Å; F654-Y749 AromaticContact CE1-CD1 3.55Å; F654-Y749 HydrophobicContact CE1-CD1 3.55Å; F654-Y749 AromaticContact CE1-CD2 3.84Å; F654-Y749 HydrophobicContact CE1-CD2 3.84Å; F654-Y749 HydrophobicContact CE1-CE1 4.19Å; F654-Y749 HydrophobicContact CE1-CE2 4.42Å; F654-Y749 AromaticContact CE1-CG 3.33Å; F654-Y749 HydrophobicContact CE1-CG 3.33Å; F654-Y749 HydrophobicContact CE2-CD1 4.29Å; F654-Y749 AromaticContact CE2-CD2 3.81Å; F654-Y749 HydrophobicContact CE2-CD2 3.81Å; F654-Y749 HydrophobicContact CE2-CE1 4.19Å; F654-Y749 AromaticContact CE2-CE2 3.67Å; F654-Y749 HydrophobicContact CE2-CE2 3.67Å; F654-Y749 HydrophobicContact CE2-CG 4.09Å; F654-Y749 AromaticContact CE2-CZ 3.85Å; F654-Y749 AromaticContact CG-CD2 3.94Å; F654-Y749 HydrophobicContact CG-CD2 3.94Å; F654-Y749 HydrophobicContact CG-CG 4.2Å; F654-Y749 AromaticContact CZ-CD1 3.47Å; F654-Y749 HydrophobicContact CZ-CD1 3.47Å; F654-Y749 VanDerWaalsContact CZ-CD1 3.47Å; F654-Y749 AromaticContact CZ-CD2 3.74Å; F654-Y749 HydrophobicContact CZ-CD2 3.74Å; F654-Y749 AromaticContact CZ-CE1 3.61Å; F654-Y749 HydrophobicContact CZ-CE1 3.61Å; F654-Y749 AromaticContact CZ-CE2 3.85Å; F654-Y749 HydrophobicContact CZ-CE2 3.85Å; F654-Y749 AromaticContact CZ-CG 3.52Å; F654-Y749 HydrophobicContact CZ-CG 3.52Å; F654-Y749 AromaticContact CZ-CZ 3.77Å
655	P	73.2	Confident	68	Low	10 Å²	10	28.5 Å²	28.5	7%	0.065	18%	0.182	C	C	.	.			trans	-69.9	115.5	170.1	29.4	-33	0	0	0	109.1	L748 L752	P655-L748 HydrophobicContact CB-CB 4.34Å; P655-L748 HydrophobicContact CG-CB 3.5Å; P655-L748 VanDerWaalsContact CG-CB 3.5Å; P655-L752 HydrophobicContact CG-CD1 4.34Å
656	V	69.1	Low	66.4	Low	3 Å²	3	30.6 Å²	30.6	2%	0.018	19%	0.191	C	C	.	.			trans	-115.2	129.6	179	176.2	0	0	0	0	109.2	L646 L649 A650 F654 F658 L693	L646-V656 HydrophobicContact CB-CG1 3.91Å; L646-V656 HydrophobicContact CD1-CG1 3.99Å; L646-V656 HydrophobicContact CD2-CG1 3.69Å; L646-V656 HydrophobicContact CD2-CG2 4.41Å; L646-V656 HydrophobicContact CG-CG1 4.05Å; L649-V656 HydrophobicContact CB-CG2 3.99Å; A650-V656 HydrophobicContact CB-CG2 4.18Å; F654-V656 PolarHBondContact O-N 3.32Å; V656-F658 HydrophobicContact CB-CE2 4.18Å; V656-F658 HydrophobicContact CB-CZ 4.17Å; V656-F658 HydrophobicContact CG1-CE1 4.3Å; V656-F658 HydrophobicContact CG1-CZ 4.3Å; V656-F658 VanDerWaalsContact O-CD2 3.3Å; V656-F658 WeakPolarHBondContact O-CD2 3.47Å; V656-F658 PolarHBondContact O-N 3.39Å; V656-F658 VanDerWaalsContact O-N 3.15Å; V656-L693 WeakPolarHBondContact O-CD2 3.45Å
657	D	59.5	Low	65.2	Low	46 Å²	46	31.7 Å²	31.7	25%	0.246	20%	0.199	C	C	.	.			trans	-80.4	91.8	176.1	-160.6	-9.2	0	0	0	111	V659 L660 L693	D657-V659 PolarHBondContact O-N 3.25Å; D657-V659 VanDerWaalsContact O-N 3.15Å; D657-V659 WeakPolarHBondContact OD1-CB 3.5Å; D657-V659 VanDerWaalsContact OD1-CG2 3.22Å; D657-V659 WeakPolarHBondContact OD1-CG2 3.27Å; D657-V659 PolarHBondContact OD1-N 3.11Å; D657-L660 HydrophobicContact CB-CD1 4.45Å; D657-L660 PolarHBondContact O-N 3.29Å; D657-L693 HydrophobicContact CB-CD2 4.5Å
658	F	52.6	Low	64.2	Low	58 Å²	58	31.6 Å²	31.6	25%	0.254	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-67.6	-4.3	174.2	-61.3	-79.2	0	0	0	112.9	A650 V656 L660 S661 T695	A650-F658 HydrophobicContact CB-CZ 3.87Å; V656-F658 HydrophobicContact CB-CE2 4.18Å; V656-F658 HydrophobicContact CB-CZ 4.17Å; V656-F658 HydrophobicContact CG1-CE1 4.3Å; V656-F658 HydrophobicContact CG1-CZ 4.3Å; V656-F658 VanDerWaalsContact O-CD2 3.3Å; V656-F658 WeakPolarHBondContact O-CD2 3.47Å; V656-F658 PolarHBondContact O-N 3.39Å; V656-F658 VanDerWaalsContact O-N 3.15Å; F658-L660 PolarHBondContact O-N 3.09Å; F658-S661 PolarHBondContact O-N 3.3Å; F658-T695 HydrophobicContact CE2-CG2 3.79Å; F658-T695 HydrophobicContact CZ-CG2 4.44Å
659	V	45.7	Very low	63.6	Low	64 Å²	64	32.2 Å²	32.2	39%	0.388	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-67.7	-19	167.5	-176.3	0	0	0	0	110.7	D657 Q922 L926	D657-V659 PolarHBondContact O-N 3.25Å; D657-V659 VanDerWaalsContact O-N 3.15Å; D657-V659 WeakPolarHBondContact OD1-CB 3.5Å; D657-V659 VanDerWaalsContact OD1-CG2 3.22Å; D657-V659 WeakPolarHBondContact OD1-CG2 3.27Å; D657-V659 PolarHBondContact OD1-N 3.11Å; V659-Q922 PolarHBondContact O-NE2 2.73Å; V659-L926 HydrophobicContact CG1-CD2 4.09Å
660	L	42.9	Very low	63.2	Low	69 Å²	69	32.3 Å²	32.3	36%	0.361	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-91	-10.6	177.7	-61.2	177.1	0	0	0	114.2	D657 F658 L926	D657-L660 HydrophobicContact CB-CD1 4.45Å; D657-L660 PolarHBondContact O-N 3.29Å; F658-L660 PolarHBondContact O-N 3.09Å; L660-L926 HydrophobicContact CD2-CD1 3.94Å
661	S	41.9	Very low	63	Low	7 Å²	7	31.7 Å²	31.7	5%	0.049	20%	0.196	C	C	.	.	S	Bend	trans	-125.7	117.6	177.4	-169.1	0	0	0	0	108.7	F658 A663	F658-S661 PolarHBondContact O-N 3.3Å; S661-A663 PolarHBondContact O-N 3.14Å; S661-A663 VanDerWaalsContact O-N 3.17Å
662	A	37	Very low	62.7	Low	75 Å²	75	31.6 Å²	31.6	62%	0.62	20%	0.196	S	C	*	.	S	Bend	trans	-57.2	123.7	-176.9	0	0	0	0	0	111
663	A	39.2	Very low	62.2	Low	61 Å²	61	32.6 Å²	32.6	50%	0.504	20%	0.201	S	C	.	.			trans	85	108	177.8	0	0	0	0	0	117.3	S661 Y665	S661-A663 PolarHBondContact O-N 3.14Å; S661-A663 VanDerWaalsContact O-N 3.17Å; A663-Y665 PolarHBondContact O-N 2.87Å; A663-Y665 VanDerWaalsContact O-N 3.16Å
664	P	48.1	Very low	62.1	Low	73 Å²	73	33.2 Å²	33.2	47%	0.474	20%	0.198	S	C	.	.			trans	-72.1	106.4	160.1	27.6	-28.9	0	0	0	109.8	Q666	P664-Q666 VanDerWaalsContact C-N 3.34Å; P664-Q666 PolarHBondContact O-N 3.35Å
665	Y	50.3	Low	61.6	Low	47 Å²	47	33.6 Å²	33.6	18%	0.184	20%	0.201	C	C	.	.			trans	-66.4	93.4	160.6	-176.5	-97.2	0	0	0	108.2	D478 Q482 A663 P667 L670	D478-Y665 HydrophobicContact CB-CD2 3.97Å; D478-Y665 HydrophobicContact CB-CE2 3.68Å; D478-Y665 VanDerWaalsContact CG-CD2 3.46Å; D478-Y665 WeakPolarHBondContact OD2-CD2 3.41Å; Q482-Y665 WeakPolarHBondContact CB-OH 3.44Å; Q482-Y665 PolarHBondContact OE1-OH 2.86Å; Q482-Y665 VanDerWaalsContact OE1-OH 3.14Å; A663-Y665 PolarHBondContact O-N 2.87Å; A663-Y665 VanDerWaalsContact O-N 3.16Å; Y665-P667 VanDerWaalsContact C-CD 3.46Å; Y665-P667 HydrophobicContact CD1-CG 3.78Å; Y665-P667 HydrophobicContact CD2-CG 4.24Å; Y665-P667 VanDerWaalsContact CE1-CD 3.41Å; Y665-P667 HydrophobicContact CE1-CG 3.25Å; Y665-P667 HydrophobicContact CE2-CG 3.77Å; Y665-P667 HydrophobicContact CG-CG 4.24Å; Y665-P667 WeakPolarHBondContact OH-CG 3.44Å; Y665-L670 HydrophobicContact CD1-CD1 4.27Å; Y665-L670 HydrophobicContact CE1-CD1 4.17Å
666	Q	57.2	Low	61.7	Low	49 Å²	49	33.9 Å²	33.9	23%	0.229	20%	0.202	C	C	.	.			trans	-122.6	79.4	165.6	-70.7	-163.8	-34.5	0	0	110.4	P664 S668 T695	P664-Q666 VanDerWaalsContact C-N 3.34Å; P664-Q666 PolarHBondContact O-N 3.35Å; Q666-S668 PolarHBondContact O-N 3.05Å; Q666-T695 PolarHBondContact NE2-O 3.5Å
667	P	63.3	Low	61.9	Low	28 Å²	28	34.2 Å²	34.2	18%	0.182	20%	0.204	C	C	.	.			trans	-55.2	132	158.2	-15.8	27.2	0	0	0	108.4	Y665 M669 L670	Y665-P667 VanDerWaalsContact C-CD 3.46Å; Y665-P667 HydrophobicContact CD1-CG 3.78Å; Y665-P667 HydrophobicContact CD2-CG 4.24Å; Y665-P667 VanDerWaalsContact CE1-CD 3.41Å; Y665-P667 HydrophobicContact CE1-CG 3.25Å; Y665-P667 HydrophobicContact CE2-CG 3.77Å; Y665-P667 HydrophobicContact CG-CG 4.24Å; Y665-P667 WeakPolarHBondContact OH-CG 3.44Å; P667-M669 HydrophobicContact CB-CB 4.23Å; P667-M669 HydrophobicContact CB-CG 4.45Å; P667-M669 HydrophobicContact CB-SD 4.41Å; P667-M669 PolarHBondContact O-N 3.08Å; P667-L670 HydrophobicContact CG-CD1 4.38Å; P667-L670 HydrophobicContact CG-CG 4.44Å; P667-L670 PolarHBondContact O-N 3.23Å
668	S	66.3	Low	62.1	Low	13 Å²	13	36.3 Å²	36.3	9%	0.091	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-49.8	-25	173	54.6	0	0	0	0	113.3	Q666 L670 L671 V1036 I1090	Q666-S668 PolarHBondContact O-N 3.05Å; S668-L670 PolarHBondContact O-N 3.45Å; S668-L671 PolarHBondContact O-N 2.83Å; S668-V1036 VanDerWaalsContact CB-CG1 3.5Å; S668-I1090 VanDerWaalsContact CB-CG2 3.5Å; S668-I1090 WeakPolarHBondContact CB-O 3.2Å; S668-I1090 WeakPolarHBondContact OG-CG2 3.45Å; S668-I1090 PolarHBondContact OG-O 2.87Å
669	M	76.9	Confident	62.4	Low	17 Å²	17	35.5 Å²	35.5	8%	0.084	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-57.7	-25.1	175.6	-59.4	167	58.9	0	0	114.7	L430 Q489 P667 H1093 P1095 W1127	L430-M669 HydrophobicContact CD1-CE 3.67Å; L430-M669 HydrophobicContact CD1-CG 4.46Å; L430-M669 HydrophobicContact CD1-SD 3.63Å; Q489-M669 PolarHBondContact NE2-O 3.41Å; P667-M669 HydrophobicContact CB-CB 4.23Å; P667-M669 HydrophobicContact CB-CG 4.45Å; P667-M669 HydrophobicContact CB-SD 4.41Å; P667-M669 PolarHBondContact O-N 3.08Å; M669-H1093 VanDerWaalsContact CA-O 3.28Å; M669-H1093 WeakPolarHBondContact CA-O 3.4Å; M669-H1093 HydrophobicContact CG-CB 3.97Å; M669-P1095 WeakPolarHBondContact O-CD 3.39Å; M669-P1095 WeakPolarHBondContact O-CG 3.47Å; M669-W1127 HydrophobicContact CE-CZ2 4.3Å
670	L	80.3	Confident	62.7	Low	5 Å²	5	34.6 Å²	34.6	3%	0.026	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-88.4	-16.3	-178.5	-56.8	-174.4	0	0	0	113.1	H485 Y665 P667 S668 E672 I697	H485-L670 HydrophobicContact CB-CD2 3.41Å; H485-L670 VanDerWaalsContact CB-CD2 3.41Å; Y665-L670 HydrophobicContact CD1-CD1 4.27Å; Y665-L670 HydrophobicContact CE1-CD1 4.17Å; P667-L670 HydrophobicContact CG-CD1 4.38Å; P667-L670 HydrophobicContact CG-CG 4.44Å; P667-L670 PolarHBondContact O-N 3.23Å; S668-L670 PolarHBondContact O-N 3.45Å; L670-E672 PolarHBondContact O-N 3.07Å; L670-I697 HydrophobicContact CB-CD1 3.8Å; L670-I697 HydrophobicContact CB-CG1 4.06Å; L670-I697 HydrophobicContact CD1-CD1 4.02Å
671	L	81.9	Confident	63	Low	4 Å²	4	32 Å²	32	2%	0.021	21%	0.207	C	C	.	.			trans	-75.1	115	-175.4	-64.6	179.6	0	0	0	110.4	S668 L676 T695 V1036 V1037 L1040 P1095 L1096	S668-L671 PolarHBondContact O-N 2.83Å; L671-L676 HydrophobicContact CD1-CD2 4.44Å; L671-L676 HydrophobicContact CD2-CD2 3.95Å; L671-T695 WeakPolarHBondContact CD2-O 3.48Å; L671-V1036 HydrophobicContact CD1-CG1 3.83Å; L671-V1037 HydrophobicContact CD1-CG2 4.18Å; L671-L1040 HydrophobicContact CD1-CD1 4.13Å; L671-P1095 WeakPolarHBondContact O-CD 3.32Å; L671-L1096 HydrophobicContact CB-CB 4.26Å; L671-L1096 HydrophobicContact CB-CD2 4.46Å; L671-L1096 WeakPolarHBondContact O-CB 3.48Å; L671-L1096 PolarHBondContact O-N 2.98Å
672	E	80.2	Confident	63.4	Low	0 Å²	0	34.3 Å²	34.3	0%	0	22%	0.223	C	C	.	.			trans	-134.3	-19.3	-175.2	-72.3	179	147.8	0	0	113.9	R488 Q489 L670 G696 P1095 R1099	R488-E672 IonicContact CZ-OE2 3.46Å; R488-E672 IonicContact NH1-OE2 3.77Å; R488-E672 PolarHBondContact NH1-OE2 2.91Å; R488-E672 IonicContact NH2-OE2 3.56Å; R488-E672 PolarHBondContact NH2-OE2 3.32Å; Q489-E672 VanDerWaalsContact CD-OE1 3.25Å; Q489-E672 WeakPolarHBondContact CG-OE1 3.19Å; Q489-E672 PolarHBondContact NE2-OE1 3.13Å; L670-E672 PolarHBondContact O-N 3.07Å; E672-G696 PolarHBondContact N-O 3.45Å; E672-P1095 HydrophobicContact CG-CB 3.77Å; E672-P1095 HydrophobicContact CG-CG 4.05Å; E672-R1099 PolarHBondContact O-NH1 3.26Å; E672-R1099 VanDerWaalsContact O-NH1 3.13Å
673	N	77.9	Confident	64.1	Low	23 Å²	23	37.3 Å²	37.3	12%	0.123	23%	0.228	C	C	.	.			trans	-107.9	128.7	-169.4	-173.6	-7.1	0	0	0	111.4	S675 G696 N698 R710	N673-S675 PolarHBondContact ND2-OG 3.05Å; N673-S675 PolarHBondContact O-N 3.48Å; N673-S675 VanDerWaalsContact O-N 3.16Å; N673-S675 VanDerWaalsContact OD1-CB 3.29Å; N673-S675 WeakPolarHBondContact OD1-CB 3.49Å; N673-S675 PolarHBondContact OD1-N 3.43Å; N673-S675 PolarHBondContact OD1-OG 2.88Å; N673-G696 WeakPolarHBondContact CB-O 3.19Å; N673-G696 PolarHBondContact N-O 3.23Å; N673-N698 WeakPolarHBondContact CB-OD1 3.34Å; N673-N698 VanDerWaalsContact CG-OD1 3.26Å; N673-N698 PolarHBondContact ND2-OD1 3.21Å; N673-N698 VanDerWaalsContact ND2-OD1 3.12Å; N673-R710 PolarHBondContact ND2-NH2 2.92Å
674	L	78.6	Confident	64.8	Low	38 Å²	38	42 Å²	42	20%	0.199	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-16.7	173.6	-82.2	177.9	0	0	0	113.9	L676 L677 T678 L706 L1096 M1100	L674-L676 PolarHBondContact O-N 2.86Å; L674-L677 PolarHBondContact O-N 3.36Å; L674-T678 HydrophobicContact CB-CG2 3.99Å; L674-T678 HydrophobicContact CD2-CG2 4.46Å; L674-T678 WeakPolarHBondContact O-CB 3.46Å; L674-T678 WeakPolarHBondContact O-CG2 3.05Å; L674-T678 PolarHBondContact O-N 3.15Å; L674-T678 PolarHBondContact O-OG1 2.98Å; L674-L706 HydrophobicContact CD1-CD1 3.95Å; L674-L706 HydrophobicContact CD1-CD2 4.03Å; L674-L706 HydrophobicContact CD1-CG 3.58Å; L674-L706 HydrophobicContact CD2-CD1 4.44Å; L674-L706 HydrophobicContact CG-CD1 3.66Å; L674-L706 HydrophobicContact CG-CD2 4.41Å; L674-L706 HydrophobicContact CG-CG 3.9Å; L674-L1096 HydrophobicContact CD2-CD1 3.97Å; L674-L1096 HydrophobicContact CG-CD1 4.13Å; L674-M1100 HydrophobicContact CD2-CG 3.75Å; L674-M1100 HydrophobicContact CD2-SD 3.96Å
675	S	72.3	Confident	65.6	Low	15 Å²	15	41.6 Å²	41.6	11%	0.105	23%	0.229	C	C	.	.	H	α-helix	trans	-58.6	-33.1	-175.1	81.4	0	0	0	0	112.4	N673 L677 T678 Q679 E694	N673-S675 PolarHBondContact ND2-OG 3.05Å; N673-S675 PolarHBondContact O-N 3.48Å; N673-S675 VanDerWaalsContact O-N 3.16Å; N673-S675 VanDerWaalsContact OD1-CB 3.29Å; N673-S675 WeakPolarHBondContact OD1-CB 3.49Å; N673-S675 PolarHBondContact OD1-N 3.43Å; N673-S675 PolarHBondContact OD1-OG 2.88Å; S675-L677 PolarHBondContact O-N 2.6Å; S675-T678 WeakPolarHBondContact CA-OG1 2.87Å; S675-Q679 WeakPolarHBondContact O-CB 3.34Å; S675-Q679 WeakPolarHBondContact O-CG 3.25Å; S675-Q679 PolarHBondContact O-N 3.26Å; S675-E694 VanDerWaalsContact C-OE2 3.3Å; S675-E694 WeakPolarHBondContact CB-OE2 3.35Å; S675-E694 PolarHBondContact OG-OE2 3.16Å
676	L	73.8	Confident	66.1	Low	17 Å²	17	43.7 Å²	43.7	9%	0.089	25%	0.248	C	C	.	.	H	α-helix	trans	-54.2	-35.1	171.3	-172.2	72.5	0	0	0	113.3	L671 L674 E694 A1002	L671-L676 HydrophobicContact CD1-CD2 4.44Å; L671-L676 HydrophobicContact CD2-CD2 3.95Å; L674-L676 PolarHBondContact O-N 2.86Å; L676-E694 VanDerWaalsContact CD1-O 3.32Å; L676-E694 WeakPolarHBondContact CD1-O 3.29Å; L676-A1002 HydrophobicContact CD1-CB 3.26Å; L676-A1002 HydrophobicContact CD2-CB 4.44Å; L676-A1002 HydrophobicContact CG-CB 3.72Å
677	L	74.4	Confident	66.6	Low	10 Å²	10	44.6 Å²	44.6	5%	0.052	25%	0.254	C	S	.	.	H	α-helix	trans	-104.4	-28	-171.2	-60.2	177.4	0	0	0	113.1	L674 S675 L1040 F1041 V1044 L1096 M1100	L674-L677 PolarHBondContact O-N 3.36Å; S675-L677 PolarHBondContact O-N 2.6Å; L677-L1040 HydrophobicContact CD1-CB 4.11Å; L677-L1040 HydrophobicContact CD2-CB 3.97Å; L677-F1041 HydrophobicContact CD2-CD1 4.22Å; L677-F1041 HydrophobicContact CD2-CD2 3.86Å; L677-F1041 HydrophobicContact CD2-CE1 4.03Å; L677-F1041 HydrophobicContact CD2-CE2 3.61Å; L677-F1041 HydrophobicContact CD2-CG 4.16Å; L677-F1041 HydrophobicContact CD2-CZ 3.71Å; L677-V1044 HydrophobicContact CB-CG2 4.01Å; L677-V1044 HydrophobicContact CD1-CG2 3.88Å; L677-V1044 HydrophobicContact CD2-CG2 4.36Å; L677-V1044 HydrophobicContact CG-CG2 4.3Å; L677-L1096 HydrophobicContact CD1-CD2 3.9Å; L677-L1096 HydrophobicContact CD1-CG 4.45Å; L677-L1096 HydrophobicContact CG-CD2 4.41Å; L677-M1100 HydrophobicContact CD1-CE 3.87Å; L677-M1100 HydrophobicContact CD1-SD 3.48Å; L677-M1100 WeakPolarHBondContact CD1-SD 3.2Å
678	T	63.7	Low	66.7	Low	89 Å²	89	43.7 Å²	43.7	55%	0.546	25%	0.248	S	C	.	.	H	α-helix	trans	-97.7	-18.1	-170.8	53.4	0	0	0	0	113.6	L674 S675 G680	L674-T678 HydrophobicContact CB-CG2 3.99Å; L674-T678 HydrophobicContact CD2-CG2 4.46Å; L674-T678 WeakPolarHBondContact O-CB 3.46Å; L674-T678 WeakPolarHBondContact O-CG2 3.05Å; L674-T678 PolarHBondContact O-N 3.15Å; L674-T678 PolarHBondContact O-OG1 2.98Å; S675-T678 WeakPolarHBondContact CA-OG1 2.87Å; T678-G680 PolarHBondContact O-N 3.15Å
679	Q	58.5	Low	66.3	Low	42 Å²	42	44.4 Å²	44.4	20%	0.196	25%	0.253	C	S	.	.			trans	-76.7	77.8	173.9	-68.3	-164.6	23.3	0	0	110.9	S675 E694 R759	S675-Q679 WeakPolarHBondContact O-CB 3.34Å; S675-Q679 WeakPolarHBondContact O-CG 3.25Å; S675-Q679 PolarHBondContact O-N 3.26Å; Q679-E694 PolarHBondContact NE2-OE1 3.25Å; Q679-E694 PolarHBondContact NE2-OE2 3.18Å; Q679-E694 PolarHBondContact OE1-OE1 3.49Å; Q679-R759 VanDerWaalsContact CD-NH1 3.33Å
680	G	51.2	Low	65.1	Low	44 Å²	44	46 Å²	46	45%	0.454	26%	0.26	S	S	.	.			trans	-62.3	137.7	162.5	0	0	0	0	0	110.2	T678 S682 Q1010	T678-G680 PolarHBondContact O-N 3.15Å; G680-S682 PolarHBondContact O-N 3.18Å; G680-S682 VanDerWaalsContact O-N 3.14Å; G680-Q1010 VanDerWaalsContact CA-NE2 3.28Å
681	A	49.9	Very low	63.7	Low	15 Å²	15	48.2 Å²	48.2	12%	0.124	27%	0.272	C	S	.	.			trans	-43.7	122.6	166.5	0	0	0	0	0	110.1	L683	A681-L683 PolarHBondContact O-N 2.75Å
682	S	50.7	Low	62.3	Low	55 Å²	55	48.6 Å²	48.6	39%	0.385	28%	0.275	S	S	.	.			trans	-53.9	115.6	176.1	156	0	0	0	0	109	G680 Q684 R685	G680-S682 PolarHBondContact O-N 3.18Å; G680-S682 VanDerWaalsContact O-N 3.14Å; S682-Q684 PolarHBondContact O-N 2.86Å; S682-Q684 PolarHBondContact OG-N 3.28Å; S682-R685 CarbonylContact O-C 3.57Å; S682-R685 PolarHBondContact O-N 2.94Å
683	L	51.7	Low	61.1	Low	139 Å²	139	52.7 Å²	52.7	73%	0.728	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-20.8	176.6	-69.4	172	0	0	0	112.7	A681 R685	A681-L683 PolarHBondContact O-N 2.75Å; L683-R685 VanDerWaalsContact C-N 3.34Å
684	Q	53.8	Low	60.3	Low	159 Å²	159	54 Å²	54	74%	0.743	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-14.6	178	-59.6	-176.4	-8.1	0	0	114.2	S682	S682-Q684 PolarHBondContact O-N 2.86Å; S682-Q684 PolarHBondContact OG-N 3.28Å
685	R	64.4	Low	59.5	Low	64 Å²	64	53.3 Å²	53.3	24%	0.242	30%	0.299	C	S	.	.			trans	-146	72.1	-177.2	-63	-175.3	-162.8	-178.6	1.1	110.7	S682 L683 S689 E843	S682-R685 CarbonylContact O-C 3.57Å; S682-R685 PolarHBondContact O-N 2.94Å; L683-R685 VanDerWaalsContact C-N 3.34Å; R685-S689 WeakPolarHBondContact O-CA 3.28Å; R685-S689 WeakPolarHBondContact O-CB 3.43Å; R685-S689 PolarHBondContact O-N 2.96Å; R685-E843 WeakPolarHBondContact CA-OE1 3.3Å; R685-E843 WeakPolarHBondContact CB-OE2 3.25Å
686	P	61.7	Low	59.2	Low	91 Å²	91	52.7 Å²	52.7	59%	0.591	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-22	-170.8	30.1	-36	0	0	0	115.4	E843	P686-E843 WeakPolarHBondContact CD-OE1 3.43Å
687	L	66.3	Low	59.4	Low	68 Å²	68	53 Å²	53	36%	0.356	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-30.7	179	-60.2	177.8	0	0	0	111.8	Q839 V842 E843	L687-Q839 HydrophobicContact CB-CB 3.94Å; L687-Q839 HydrophobicContact CB-CG 4.06Å; L687-V842 HydrophobicContact CD1-CB 3.98Å; L687-V842 HydrophobicContact CD1-CG1 3.67Å; L687-E843 WeakPolarHBondContact CA-OE1 3.44Å; L687-E843 HydrophobicContact CB-CG 4.18Å; L687-E843 WeakPolarHBondContact CB-OE1 3.27Å; L687-E843 HydrophobicContact CD1-CG 4.36Å; L687-E843 HydrophobicContact CG-CG 4.43Å; L687-E843 PolarHBondContact N-OE1 3.4Å
688	T	67.1	Low	59.6	Low	9 Å²	9	52.9 Å²	52.9	6%	0.055	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.9	12.3	-177.2	77.5	0	0	0	0	112.6	F690 L836 Q839 L840 E843	T688-F690 PolarHBondContact O-N 3.29Å; T688-L836 HydrophobicContact CG2-CD1 4.25Å; T688-Q839 HydrophobicContact CG2-CB 3.53Å; T688-L840 HydrophobicContact CG2-CD2 3.57Å; T688-L840 HydrophobicContact CG2-CG 3.84Å; T688-E843 PolarHBondContact N-OE1 3.07Å; T688-E843 VanDerWaalsContact OG1-CD 3.32Å; T688-E843 PolarHBondContact OG1-OE1 2.65Å; T688-E843 PolarHBondContact OG1-OE2 2.82Å
689	S	56.3	Low	60.4	Low	29 Å²	29	49.2 Å²	49.2	20%	0.203	27%	0.273	C	S	.	.			trans	-51	107.6	174.1	50.5	0	0	0	0	106.8	R685 N691	R685-S689 WeakPolarHBondContact O-CA 3.28Å; R685-S689 WeakPolarHBondContact O-CB 3.43Å; R685-S689 PolarHBondContact O-N 2.96Å; S689-N691 PolarHBondContact O-N 2.83Å
690	F	51.4	Low	61.6	Low	51 Å²	51	47.3 Å²	47.3	22%	0.224	26%	0.264	C	S	.	.			trans	-65.3	107.8	176.4	-153.2	-107.4	0	0	0	104.6	T688 P692 L748 K751 L755 H798	T688-F690 PolarHBondContact O-N 3.29Å; F690-P692 HydrophobicContact CD1-CB 4.25Å; F690-P692 HydrophobicContact CE1-CB 4.4Å; F690-P692 WeakPolarHBondContact O-CD 3.43Å; F690-L748 HydrophobicContact CZ-CD2 4.23Å; F690-K751 HydrophobicContact CE2-CD 4.26Å; F690-K751 VanDerWaalsContact CE2-CE 3.47Å; F690-K751 HydrophobicContact CZ-CD 4.14Å; F690-L755 HydrophobicContact CB-CD1 4.03Å; F690-L755 HydrophobicContact CD1-CD1 3.33Å; F690-L755 HydrophobicContact CE1-CD1 3.91Å; F690-L755 HydrophobicContact CG-CD1 3.74Å; F690-H798 AromaticContact CD2-CE1 3.96Å
691	N	50.9	Low	62.9	Low	50 Å²	50	45.3 Å²	45.3	27%	0.267	24%	0.244	S	C	.	.			trans	-80.7	95.8	155.6	-79.2	-33.6	0	0	0	103.6	S689 L693 P1003	S689-N691 PolarHBondContact O-N 2.83Å; N691-L693 PolarHBondContact O-N 3.25Å; N691-P1003 HydrophobicContact CB-CG 4.3Å; N691-P1003 WeakPolarHBondContact ND2-CB 3.49Å
692	P	53.3	Low	64.2	Low	13 Å²	13	45.1 Å²	45.1	8%	0.084	24%	0.241	C	C	.	.			trans	-49	135.3	160.7	24	-31.7	0	0	0	106.4	F690 E694 L752	F690-P692 HydrophobicContact CD1-CB 4.25Å; F690-P692 HydrophobicContact CE1-CB 4.4Å; F690-P692 WeakPolarHBondContact O-CD 3.43Å; P692-E694 HydrophobicContact CB-CG 3.85Å; P692-E694 HydrophobicContact CG-CG 3.74Å; P692-E694 WeakPolarHBondContact CG-OE1 2.92Å; P692-E694 PolarHBondContact O-N 2.89Å; P692-L752 HydrophobicContact CB-CD1 4.47Å
693	L	55.4	Low	65.5	Low	85 Å²	85	42.7 Å²	42.7	45%	0.445	22%	0.223	S	C	.	.			trans	-65.5	80.1	169.5	-93	79.5	0	0	0	106.8	V656 D657 N691	V656-L693 WeakPolarHBondContact O-CD2 3.45Å; D657-L693 HydrophobicContact CB-CD2 4.5Å; N691-L693 PolarHBondContact O-N 3.25Å
694	E	60.4	Low	66.6	Low	50 Å²	50	37.1 Å²	37.1	23%	0.234	20%	0.195	C	C	.	.			trans	-85.8	116.8	175.9	-71.4	-170.4	171.7	0	0	107.2	S675 L676 Q679 P692 G696	S675-E694 VanDerWaalsContact C-OE2 3.3Å; S675-E694 WeakPolarHBondContact CB-OE2 3.35Å; S675-E694 PolarHBondContact OG-OE2 3.16Å; L676-E694 VanDerWaalsContact CD1-O 3.32Å; L676-E694 WeakPolarHBondContact CD1-O 3.29Å; Q679-E694 PolarHBondContact NE2-OE1 3.25Å; Q679-E694 PolarHBondContact NE2-OE2 3.18Å; Q679-E694 PolarHBondContact OE1-OE1 3.49Å; P692-E694 HydrophobicContact CB-CG 3.85Å; P692-E694 HydrophobicContact CG-CG 3.74Å; P692-E694 WeakPolarHBondContact CG-OE1 2.92Å; P692-E694 PolarHBondContact O-N 2.89Å; E694-G696 PolarHBondContact O-N 2.89Å
695	T	61.8	Low	67.9	Low	25 Å²	25	30.3 Å²	30.3	15%	0.153	16%	0.164	C	C	.	.			trans	-73.6	-7.2	179.8	52.2	0	0	0	0	112	F658 Q666 L671 I697	F658-T695 HydrophobicContact CE2-CG2 3.79Å; F658-T695 HydrophobicContact CZ-CG2 4.44Å; Q666-T695 PolarHBondContact NE2-O 3.5Å; L671-T695 WeakPolarHBondContact CD2-O 3.48Å; T695-I697 PolarHBondContact O-N 3.39Å
696	G	67.1	Low	68.7	Low	1 Å²	1	28.2 Å²	28.2	1%	0.01	16%	0.157	C	C	.	.	S	Bend	trans	71.5	11.8	-171	0	0	0	0	0	113.5	E672 N673 E694	E672-G696 PolarHBondContact N-O 3.45Å; N673-G696 WeakPolarHBondContact CB-O 3.19Å; N673-G696 PolarHBondContact N-O 3.23Å; E694-G696 PolarHBondContact O-N 2.89Å
697	I	76.7	Confident	69.2	Low	24 Å²	24	29.6 Å²	29.6	12%	0.123	16%	0.156	C	C	.	.			trans	-105.9	141.7	179.4	-49.7	177.2	0	0	0	108.6	R488 L670 T695	R488-I697 VanDerWaalsContact CZ-CG2 3.48Å; L670-I697 HydrophobicContact CB-CD1 3.8Å; L670-I697 HydrophobicContact CB-CG1 4.06Å; L670-I697 HydrophobicContact CD1-CD1 4.02Å; T695-I697 PolarHBondContact O-N 3.39Å
698	N	78.6	Confident	69.1	Low	8 Å²	8	27.9 Å²	27.9	4%	0.043	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-77.6	139.3	172.2	-76.9	-32.1	0	0	0	111.1	R488 N673 R710	R488-N698 PolarHBondContact NH1-O 2.94Å; N673-N698 WeakPolarHBondContact CB-OD1 3.34Å; N673-N698 VanDerWaalsContact CG-OD1 3.26Å; N673-N698 PolarHBondContact ND2-OD1 3.21Å; N673-N698 VanDerWaalsContact ND2-OD1 3.12Å; N698-R710 PolarHBondContact OD1-NH2 3.4Å
699	P	80.7	Confident	68.7	Low	12 Å²	12	33 Å²	33	8%	0.078	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-65.5	162.3	169.3	27.1	-30.2	0	0	0	110.7	H702	P699-H702 HydrophobicContact CG-CB 3.92Å; P699-H702 PolarHBondContact O-N 3.12Å
700	V	84.4	Confident	69	Low	1 Å²	1	35.8 Å²	35.8	1%	0.006	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53	136.6	173.1	-178.1	0	0	0	0	111.3	C493 I497 W600 F651 L652 H702	C493-V700 HydrophobicContact CB-CG1 3.75Å; I497-V700 HydrophobicContact CD1-CG2 4.41Å; W600-V700 HydrophobicContact CB-CG1 3.63Å; W600-V700 HydrophobicContact CD2-CG1 3.97Å; W600-V700 HydrophobicContact CE3-CG1 3.7Å; W600-V700 HydrophobicContact CG-CG1 3.96Å; F651-V700 HydrophobicContact CD1-CG2 3.41Å; F651-V700 VanDerWaalsContact CD1-CG2 3.41Å; F651-V700 HydrophobicContact CE1-CG2 3.06Å; F651-V700 HydrophobicContact CE2-CG2 4.43Å; F651-V700 HydrophobicContact CG-CG2 4.24Å; F651-V700 HydrophobicContact CZ-CG2 3.63Å; L652-V700 HydrophobicContact CD2-CG2 4.11Å; V700-H702 PolarHBondContact O-CD2 2.81Å; V700-H702 PolarHBondContact O-N 3.13Å
701	G	78.4	Confident	69.2	Low	3 Å²	3	38.3 Å²	38.3	3%	0.031	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	4.3	179.6	0	0	0	0	0	114.9	E596 A597	E596-G701 VanDerWaalsContact O-CA 3.26Å; E596-G701 WeakPolarHBondContact O-CA 3.32Å; A597-G701 WeakPolarHBondContact CA-O 3.41Å; A597-G701 WeakPolarHBondContact CB-O 3.45Å; A597-G701 PolarHBondContact N-O 3.13Å
702	H	77.4	Confident	69.5	Low	11 Å²	11	41.8 Å²	41.8	5%	0.051	21%	0.212	C	C	.	.			trans	-123.3	33.9	-179.1	-63.6	-93.1	0	0	0	112.3	P699 V700 T704 R710 W712 G714	P699-H702 HydrophobicContact CG-CB 3.92Å; P699-H702 PolarHBondContact O-N 3.12Å; V700-H702 PolarHBondContact O-CD2 2.81Å; V700-H702 PolarHBondContact O-N 3.13Å; H702-T704 PolarHBondContact O-N 2.73Å; H702-R710 HydrophobicContact CB-CG 4.42Å; H702-W712 PolarHBondContact CE1-O 2.8Å; H702-G714 PolarHBondContact NE2-O 3.38Å; H702-G714 VanDerWaalsContact NE2-O 3.07Å
703	M	77.6	Confident	69.6	Low	3 Å²	3	42 Å²	42	2%	0.015	21%	0.213	C	C	.	.			trans	-75.3	73	171.1	-162.5	70	64.9	0	0	110.4	R488 Q489 E596	R488-M703 HydrophobicContact CG-CE 4.42Å; R488-M703 WeakPolarHBondContact O-CE 3.26Å; Q489-M703 HydrophobicContact CG-CE 4.47Å; E596-M703 WeakPolarHBondContact OE1-CB 3.23Å; E596-M703 PolarHBondContact OE1-N 3.13Å; E596-M703 VanDerWaalsContact OE1-N 3.15Å
704	T	74.9	Confident	70	Confident	23 Å²	23	38.9 Å²	38.9	14%	0.141	20%	0.201	C	C	.	.			trans	-91	173.2	178.5	64.1	0	0	0	0	111.7	H702 R1099	H702-T704 PolarHBondContact O-N 2.73Å; T704-R1099 PolarHBondContact O-NH2 3.39Å
705	T	81.3	Confident	70.5	Confident	15 Å²	15	37 Å²	37	9%	0.092	19%	0.193	C	C	.	.			trans	-59	160.4	167.6	71.7	0	0	0	0	111.7	L589 Q707 G708 M1133 D1134 Q1137	L589-T705 HydrophobicContact CD1-CG2 4.3Å; L589-T705 HydrophobicContact CD2-CG2 4.07Å; T705-Q707 PolarHBondContact O-N 3.29Å; T705-G708 PolarHBondContact O-N 3.39Å; T705-G708 PolarHBondContact OG1-N 3.32Å; T705-G708 VanDerWaalsContact OG1-N 3.12Å; T705-M1133 HydrophobicContact CG2-CB 4.07Å; T705-D1134 WeakPolarHBondContact CA-OD1 3.38Å; T705-D1134 WeakPolarHBondContact CB-OD1 3.5Å; T705-Q1137 HydrophobicContact CG2-CB 4.1Å; T705-Q1137 PolarHBondContact OG1-OE1 3.01Å
706	L	81.7	Confident	71.1	Confident	20 Å²	20	37 Å²	37	11%	0.105	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-33.7	-172.7	-168.7	71.6	0	0	0	112	L674 L1096 R1099 M1100 H1103 D1134	L674-L706 HydrophobicContact CD1-CD1 3.95Å; L674-L706 HydrophobicContact CD1-CD2 4.03Å; L674-L706 HydrophobicContact CD1-CG 3.58Å; L674-L706 HydrophobicContact CD2-CD1 4.44Å; L674-L706 HydrophobicContact CG-CD1 3.66Å; L674-L706 HydrophobicContact CG-CD2 4.41Å; L674-L706 HydrophobicContact CG-CG 3.9Å; L706-L1096 HydrophobicContact CD1-CD1 3.99Å; L706-R1099 HydrophobicContact CD1-CB 3.8Å; L706-R1099 HydrophobicContact CD2-CB 4.03Å; L706-R1099 HydrophobicContact CG-CB 4.35Å; L706-M1100 HydrophobicContact CD2-CG 4.45Å; L706-H1103 HydrophobicContact CD2-CB 3.96Å; L706-D1134 PolarHBondContact N-OD1 3.05Å
707	Q	71.8	Confident	71.6	Confident	121 Å²	121	44.3 Å²	44.3	57%	0.565	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-7	175.4	-71.2	-172.3	-17.9	0	0	113.6	T705 T709 H1103	T705-Q707 PolarHBondContact O-N 3.29Å; Q707-T709 PolarHBondContact O-N 2.96Å; Q707-H1103 VanDerWaalsContact CG-NE2 3.33Å; Q707-H1103 WeakPolarHBondContact CG-NE2 3.39Å; Q707-H1103 PolarHBondContact NE2-CE1 3.33Å; Q707-H1103 PolarHBondContact NE2-NE2 3.41Å; Q707-H1103 PolarHBondContact OE1-CE1 3.42Å
708	G	63.9	Low	71.8	Confident	31 Å²	31	47.6 Å²	47.6	32%	0.32	24%	0.244	S	C	.	.			trans	-60.4	126.2	179.1	0	0	0	0	0	111.1	T705	T705-G708 PolarHBondContact O-N 3.39Å; T705-G708 PolarHBondContact OG1-N 3.32Å; T705-G708 VanDerWaalsContact OG1-N 3.12Å
709	T	57.7	Low	72.1	Confident	117 Å²	117	47.2 Å²	47.2	72%	0.718	24%	0.242	S	C	*	.			trans	-79.1	130.2	169.7	48.1	0	0	0	0	109.3	Q707 K711	Q707-T709 PolarHBondContact O-N 2.96Å; T709-K711 PolarHBondContact O-N 3.36Å
710	R	63.3	Low	72.2	Confident	88 Å²	88	49.4 Å²	49.4	33%	0.332	25%	0.251	S	S	.	.			trans	-54.7	110.7	170.2	-67.7	-172.6	-170.2	167.6	3.9	109.2	N673 N698 H702 W712	N673-R710 PolarHBondContact ND2-NH2 2.92Å; N698-R710 PolarHBondContact OD1-NH2 3.4Å; H702-R710 HydrophobicContact CB-CG 4.42Å; R710-W712 VanDerWaalsContact C-N 3.31Å
711	K	55.6	Low	72.4	Confident	104 Å²	104	54.7 Å²	54.7	45%	0.452	27%	0.274	S	S	.	.	S	Bend	trans	-66.7	-37.9	179.1	-68.3	-176.8	176.4	-178.6	0	110.1	E590 T709	E590-K711 IonicContact OE1-NZ 2.9Å; E590-K711 PolarHBondContact OE1-NZ 2.91Å; T709-K711 PolarHBondContact O-N 3.36Å
712	W	56.7	Low	72.9	Confident	122 Å²	122	55 Å²	55	46%	0.462	27%	0.274	S	S	.	.	S	Bend	trans	-105.7	147	-177.1	-65.6	93.1	0	0	0	113.3	D573 H702 R710	D573-W712 WeakPolarHBondContact OD2-CH2 3.36Å; H702-W712 PolarHBondContact CE1-O 2.8Å; R710-W712 VanDerWaalsContact C-N 3.31Å
713	L	56.3	Low	73.5	Confident	18 Å²	18	54.5 Å²	54.5	9%	0.094	27%	0.272	C	S	.	.	S	Bend	trans	-100.7	113.2	178.1	179.3	61.8	0	0	0	109	K753 H756	L713-K753 HydrophobicContact CD1-CG 4.4Å; L713-K753 HydrophobicContact CD2-CB 3.8Å; L713-K753 HydrophobicContact CD2-CG 4.07Å; L713-K753 WeakPolarHBondContact CD2-O 3.5Å; L713-K753 HydrophobicContact CG-CB 4.25Å; L713-K753 HydrophobicContact CG-CG 3.99Å; L713-H756 HydrophobicContact CD1-CB 3.5Å
714	G	63	Low	74.1	Confident	20 Å²	20	57.2 Å²	57.2	21%	0.206	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.9	-155.1	-178.3	0	0	0	0	0	112.6	H702 G716 Y749	H702-G714 PolarHBondContact NE2-O 3.38Å; H702-G714 VanDerWaalsContact NE2-O 3.07Å; G714-G716 VanDerWaalsContact C-N 3.32Å; G714-Y749 WeakPolarHBondContact CA-OH 3.46Å
715	L	70.6	Confident	74.9	Confident	10 Å²	10	57.9 Å²	57.9	5%	0.052	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	14.9	-176.9	-58.1	168.8	0	0	0	113.4	W600 L652 G719 L723 Y749	W600-L715 HydrophobicContact CH2-CD1 4.2Å; W600-L715 HydrophobicContact CH2-CD2 4.36Å; W600-L715 HydrophobicContact CZ2-CB 4.09Å; W600-L715 HydrophobicContact CZ2-CD1 4.35Å; W600-L715 HydrophobicContact CZ2-CD2 4.15Å; W600-L715 HydrophobicContact CZ2-CG 4.44Å; L652-L715 HydrophobicContact CB-CD1 4.17Å; L652-L715 HydrophobicContact CD1-CD1 4.23Å; L652-L715 HydrophobicContact CD2-CD1 4.05Å; L652-L715 HydrophobicContact CD2-CD2 4.12Å; L652-L715 HydrophobicContact CG-CD1 4.39Å; L715-G719 WeakPolarHBondContact O-CA 3.28Å; L715-G719 PolarHBondContact O-N 3.4Å; L715-L723 HydrophobicContact CD1-CD1 3.58Å; L715-L723 HydrophobicContact CD1-CG 4.17Å; L715-Y749 PolarHBondContact N-OH 3.26Å
716	G	74.9	Confident	75.4	Confident	24 Å²	24	57.3 Å²	57.3	25%	0.247	29%	0.288	C	S	.	.	H	α-helix	trans	67.3	-174	-172.4	0	0	0	0	0	113.5	G714 E720	G714-G716 VanDerWaalsContact C-N 3.32Å; G716-E720 WeakPolarHBondContact O-CG 3.06Å; G716-E720 PolarHBondContact O-N 2.89Å
717	K	78.9	Confident	75.8	Confident	156 Å²	156	58 Å²	58	68%	0.678	29%	0.29	S	S	*	.	H	α-helix	trans	-63	-45.2	177.8	-72	-174	178.8	-175.5	0	111.5	E568 G719 E720 K721	E568-K717 IonicContact OE2-NZ 3.73Å; E568-K717 PolarHBondContact OE2-NZ 3.34Å; E568-K717 VanDerWaalsContact OE2-NZ 3.16Å; K717-G719 PolarHBondContact O-N 2.94Å; K717-E720 PolarHBondContact O-N 3.36Å; K717-K721 PolarHBondContact O-N 3.48Å
718	Q	80.9	Confident	76.6	Confident	93 Å²	93	55.4 Å²	55.4	44%	0.435	29%	0.285	S	S	.	.	H	α-helix	trans	-59.3	-45.3	-178.5	-166.5	-174.5	31.2	0	0	111.6	L601 E720 K721 F722	L601-Q718 HydrophobicContact CD1-CG 4.01Å; Q718-E720 PolarHBondContact O-N 2.69Å; Q718-K721 PolarHBondContact O-N 3.29Å; Q718-F722 WeakPolarHBondContact O-CB 3.44Å; Q718-F722 PolarHBondContact O-N 3.36Å
719	G	83.1	Confident	77.9	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-70.2	-29.7	176.7	0	0	0	0	0	114.7	L715 K717 L723	L715-G719 WeakPolarHBondContact O-CA 3.28Å; L715-G719 PolarHBondContact O-N 3.4Å; K717-G719 PolarHBondContact O-N 2.94Å; G719-L723 WeakPolarHBondContact O-CB 3.32Å; G719-L723 PolarHBondContact O-N 2.65Å
720	E	84	Confident	79.5	Confident	58 Å²	58	49.6 Å²	49.6	27%	0.271	24%	0.242	S	C	.	.	H	α-helix	trans	-68.4	-39.8	171.1	-73.9	-175.3	-178.5	0	0	112	G716 K717 Q718 T724 K753	G716-E720 WeakPolarHBondContact O-CG 3.06Å; G716-E720 PolarHBondContact O-N 2.89Å; K717-E720 PolarHBondContact O-N 3.36Å; Q718-E720 PolarHBondContact O-N 2.69Å; E720-T724 WeakPolarHBondContact O-CB 3.39Å; E720-T724 PolarHBondContact O-N 2.58Å; E720-T724 PolarHBondContact O-OG1 3.25Å; E720-K753 IonicContact OE1-NZ 3.88Å; E720-K753 PolarHBondContact OE1-NZ 2.93Å; E720-K753 IonicContact OE2-NZ 3.21Å
721	K	87.8	Confident	80.6	Confident	112 Å²	112	49.5 Å²	49.5	49%	0.487	25%	0.245	S	C	.	.	H	α-helix	trans	-60.9	-50.3	172.6	-172.3	177.8	179.5	-177.6	0	110	K717 Q718 L723 T724 N725	K717-K721 PolarHBondContact O-N 3.48Å; Q718-K721 PolarHBondContact O-N 3.29Å; K721-L723 PolarHBondContact O-N 3.08Å; K721-T724 PolarHBondContact O-N 2.87Å; K721-N725 VanDerWaalsContact O-CG 3.27Å; K721-N725 PolarHBondContact O-N 3.4Å
722	F	90.4	Very high	82.1	Confident	9 Å²	9	49.2 Å²	49.2	4%	0.039	25%	0.254	C	S	.	.	H	α-helix	trans	-53	-52.2	176.1	174	-95.6	0	0	0	112	I497 Q501 G538 W600 L601 F648 Q718 T724 N725 V726	I497-F722 HydrophobicContact CG2-CZ 4.33Å; Q501-F722 HydrophobicContact CG-CE2 4.32Å; Q501-F722 HydrophobicContact CG-CZ 4.12Å; G538-F722 WeakPolarHBondContact O-CA 3.39Å; G538-F722 WeakPolarHBondContact O-CD2 3.13Å; W600-F722 HydrophobicContact CH2-CD1 4.16Å; L601-F722 HydrophobicContact CD2-CD2 4.01Å; L601-F722 HydrophobicContact CD2-CE2 4.1Å; L601-F722 HydrophobicContact CD2-CG 4.35Å; F648-F722 AromaticContact CZ-CE1 3.94Å; F648-F722 HydrophobicContact CZ-CE1 3.94Å; F648-F722 HydrophobicContact CZ-CZ 4.34Å; Q718-F722 WeakPolarHBondContact O-CB 3.44Å; Q718-F722 PolarHBondContact O-N 3.36Å; F722-T724 PolarHBondContact O-N 3.12Å; F722-N725 WeakPolarHBondContact O-CB 3.44Å; F722-N725 PolarHBondContact O-N 3.1Å; F722-V726 HydrophobicContact CD1-CG2 4.23Å; F722-V726 HydrophobicContact CE1-CG2 3.83Å; F722-V726 HydrophobicContact CE2-CG2 4.39Å; F722-V726 HydrophobicContact CZ-CG2 3.92Å; F722-V726 WeakPolarHBondContact O-CG2 3.4Å; F722-V726 PolarHBondContact O-N 3.32Å
723	L	89.6	Confident	83.4	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-67.4	-35.7	-179.1	-86.3	179.8	0	0	0	114.1	L649 L652 F654 L715 G719 K721 N725 V726 F727 W746	L649-L723 HydrophobicContact CD2-CD2 4.31Å; L652-L723 HydrophobicContact CD1-CD1 4.11Å; L652-L723 HydrophobicContact CD1-CD2 3.54Å; L652-L723 HydrophobicContact CD1-CG 4.05Å; F654-L723 HydrophobicContact CD2-CD1 4.27Å; F654-L723 HydrophobicContact CE1-CD1 4.28Å; F654-L723 HydrophobicContact CE2-CD1 3.17Å; F654-L723 HydrophobicContact CZ-CD1 3.19Å; L715-L723 HydrophobicContact CD1-CD1 3.58Å; L715-L723 HydrophobicContact CD1-CG 4.17Å; G719-L723 WeakPolarHBondContact O-CB 3.32Å; G719-L723 PolarHBondContact O-N 2.65Å; K721-L723 PolarHBondContact O-N 3.08Å; L723-N725 VanDerWaalsContact C-N 3.27Å; L723-N725 PolarHBondContact O-N 3.29Å; L723-V726 PolarHBondContact O-N 3Å; L723-F727 WeakPolarHBondContact O-CB 3.35Å; L723-F727 PolarHBondContact O-N 3.1Å; L723-W746 HydrophobicContact CB-CH2 4.1Å; L723-W746 HydrophobicContact CB-CZ3 3.85Å
724	T	89.6	Confident	84.8	Confident	59 Å²	59	48 Å²	48	36%	0.362	25%	0.252	S	S	.	.	H	α-helix	trans	-60.7	-42.8	173.9	-58.2	0	0	0	0	110.1	E720 K721 F722 F727 S728	E720-T724 WeakPolarHBondContact O-CB 3.39Å; E720-T724 PolarHBondContact O-N 2.58Å; E720-T724 PolarHBondContact O-OG1 3.25Å; K721-T724 PolarHBondContact O-N 2.87Å; F722-T724 PolarHBondContact O-N 3.12Å; T724-F727 PolarHBondContact O-N 3.23Å; T724-S728 WeakPolarHBondContact O-CB 3.45Å; T724-S728 PolarHBondContact O-N 2.83Å; T724-S728 PolarHBondContact O-OG 2.83Å
725	N	91.6	Very high	85.9	Confident	38 Å²	38	49.4 Å²	49.4	20%	0.203	26%	0.257	C	S	.	.	H	α-helix	trans	-62.5	-49.9	175.5	-66.3	-14.2	0	0	0	111	G538 K721 F722 L723 F727 S728 M729	G538-N725 WeakPolarHBondContact O-CB 3.46Å; G538-N725 PolarHBondContact O-ND2 3.39Å; K721-N725 VanDerWaalsContact O-CG 3.27Å; K721-N725 PolarHBondContact O-N 3.4Å; F722-N725 WeakPolarHBondContact O-CB 3.44Å; F722-N725 PolarHBondContact O-N 3.1Å; L723-N725 VanDerWaalsContact C-N 3.27Å; L723-N725 PolarHBondContact O-N 3.29Å; N725-F727 VanDerWaalsContact C-N 3.3Å; N725-F727 PolarHBondContact O-N 2.99Å; N725-S728 PolarHBondContact O-N 3.17Å; N725-S728 PolarHBondContact O-OG 3.43Å; N725-M729 WeakPolarHBondContact O-CG 3.47Å; N725-M729 PolarHBondContact O-N 2.85Å
726	V	92.3	Very high	86.6	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.012	28%	0.278	C	S	.	.	H	α-helix	trans	-53	-48.4	176.6	175.5	0	0	0	0	111.2	I504 V537 G538 F648 F722 L723 M729 L730	I504-V726 HydrophobicContact CD1-CG1 4.4Å; V537-V726 HydrophobicContact CG1-CB 4.41Å; V537-V726 HydrophobicContact CG1-CG1 4.21Å; V537-V726 HydrophobicContact CG1-CG2 4Å; G538-V726 VanDerWaalsContact CA-CG2 3.5Å; F648-V726 HydrophobicContact CE1-CG1 4.49Å; F722-V726 HydrophobicContact CD1-CG2 4.23Å; F722-V726 HydrophobicContact CE1-CG2 3.83Å; F722-V726 HydrophobicContact CE2-CG2 4.39Å; F722-V726 HydrophobicContact CZ-CG2 3.92Å; F722-V726 WeakPolarHBondContact O-CG2 3.4Å; F722-V726 PolarHBondContact O-N 3.32Å; L723-V726 PolarHBondContact O-N 3Å; V726-M729 PolarHBondContact O-N 3.43Å; V726-L730 HydrophobicContact CG1-CD1 3.71Å; V726-L730 HydrophobicContact CG1-CG 4.39Å; V726-L730 WeakPolarHBondContact O-CB 3.31Å; V726-L730 WeakPolarHBondContact O-CG 3.36Å; V726-L730 PolarHBondContact O-N 2.8Å
727	F	89.6	Confident	87	Confident	36 Å²	36	55.3 Å²	55.3	16%	0.158	29%	0.292	C	S	.	.	H	α-helix	trans	-66	-42.4	-179	-80.8	11.9	0	0	0	112.6	L649 L723 T724 N725 M729 L730 Q731 L742 W746	L649-F727 HydrophobicContact CD1-CE1 4.46Å; L649-F727 HydrophobicContact CD1-CZ 4.05Å; L649-F727 HydrophobicContact CD2-CE1 3.87Å; L649-F727 HydrophobicContact CD2-CZ 3.8Å; L723-F727 WeakPolarHBondContact O-CB 3.35Å; L723-F727 PolarHBondContact O-N 3.1Å; T724-F727 PolarHBondContact O-N 3.23Å; N725-F727 VanDerWaalsContact C-N 3.3Å; N725-F727 PolarHBondContact O-N 2.99Å; F727-M729 VanDerWaalsContact C-N 3.29Å; F727-M729 PolarHBondContact O-N 2.91Å; F727-L730 PolarHBondContact O-N 2.66Å; F727-Q731 WeakPolarHBondContact O-CB 3.38Å; F727-Q731 PolarHBondContact O-N 3.23Å; F727-L742 HydrophobicContact CE1-CD1 4.49Å; F727-L742 HydrophobicContact CE1-CD2 4.39Å; F727-L742 HydrophobicContact CE2-CB 4.4Å; F727-L742 HydrophobicContact CZ-CB 4.31Å; F727-L742 HydrophobicContact CZ-CD2 4.32Å; F727-W746 HydrophobicContact CD2-CD2 4.24Å; F727-W746 AromaticContact CD2-CE3 3.39Å; F727-W746 HydrophobicContact CD2-CE3 3.39Å; F727-W746 AromaticContact CD2-CZ3 3.54Å; F727-W746 HydrophobicContact CD2-CZ3 3.54Å; F727-W746 HydrophobicContact CE2-CB 4.24Å; F727-W746 HydrophobicContact CE2-CD2 4.01Å; F727-W746 AromaticContact CE2-CE3 3.1Å; F727-W746 HydrophobicContact CE2-CE3 3.1Å; F727-W746 AromaticContact CE2-CZ3 3.65Å; F727-W746 HydrophobicContact CE2-CZ3 3.65Å; F727-W746 HydrophobicContact CG-CE3 4.44Å; F727-W746 HydrophobicContact CG-CZ3 4.22Å; F727-W746 AromaticContact CZ-CE3 3.92Å; F727-W746 HydrophobicContact CZ-CE3 3.92Å; F727-W746 HydrophobicContact CZ-CZ3 4.33Å
728	S	89.2	Confident	87.2	Confident	65 Å²	65	48.7 Å²	48.7	46%	0.455	26%	0.264	S	S	.	.	H	α-helix	trans	-60.7	-38.8	176.9	74.5	0	0	0	0	112.3	T724 N725	T724-S728 WeakPolarHBondContact O-CB 3.45Å; T724-S728 PolarHBondContact O-N 2.83Å; T724-S728 PolarHBondContact O-OG 2.83Å; N725-S728 PolarHBondContact O-N 3.17Å; N725-S728 PolarHBondContact O-OG 3.43Å
729	M	91.5	Very high	87.5	Confident	25 Å²	25	47.4 Å²	47.4	12%	0.123	26%	0.255	C	S	.	.	H	α-helix	trans	-71.5	-38.1	178.4	-70.8	-176	74.9	0	0	112.2	F509 V537 A542 N725 V726 F727 P732 F733	F509-M729 HydrophobicContact CE1-CE 4.2Å; F509-M729 HydrophobicContact CE2-CE 4.5Å; F509-M729 HydrophobicContact CZ-CB 3.88Å; F509-M729 HydrophobicContact CZ-CE 4.04Å; F509-M729 WeakPolarHBondContact CZ-O 3.34Å; V537-M729 HydrophobicContact CB-CE 4.5Å; V537-M729 HydrophobicContact CB-SD 4.36Å; V537-M729 HydrophobicContact CG1-SD 4.29Å; V537-M729 HydrophobicContact CG2-CE 3.73Å; V537-M729 HydrophobicContact CG2-SD 4.18Å; A542-M729 HydrophobicContact CB-CE 3.81Å; A542-M729 HydrophobicContact CB-SD 3.68Å; A542-M729 WeakPolarHBondContact O-CE 3.45Å; N725-M729 WeakPolarHBondContact O-CG 3.47Å; N725-M729 PolarHBondContact O-N 2.85Å; V726-M729 PolarHBondContact O-N 3.43Å; F727-M729 VanDerWaalsContact C-N 3.29Å; F727-M729 PolarHBondContact O-N 2.91Å; M729-P732 WeakPolarHBondContact O-CD 3.42Å; M729-F733 WeakPolarHBondContact O-CD2 3.38Å
730	L	90.5	Very high	87.6	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-79.5	-28.4	-177.6	-72.5	176.8	0	0	0	113.8	I504 Y508 F509 L645 V726 F727 P732 F733 L734	I504-L730 HydrophobicContact CG2-CD1 4.48Å; I504-L730 HydrophobicContact CG2-CD2 3.82Å; I504-L730 HydrophobicContact CG2-CG 4.46Å; Y508-L730 HydrophobicContact CD1-CD2 4.26Å; Y508-L730 HydrophobicContact CD2-CD2 3.72Å; Y508-L730 HydrophobicContact CE2-CD2 4.21Å; Y508-L730 HydrophobicContact CG-CD2 3.73Å; F509-L730 HydrophobicContact CE2-CD2 4.06Å; F509-L730 HydrophobicContact CZ-CD2 4.49Å; L645-L730 HydrophobicContact CD1-CD1 4.26Å; L645-L730 HydrophobicContact CD2-CD1 3.74Å; V726-L730 HydrophobicContact CG1-CD1 3.71Å; V726-L730 HydrophobicContact CG1-CG 4.39Å; V726-L730 WeakPolarHBondContact O-CB 3.31Å; V726-L730 WeakPolarHBondContact O-CG 3.36Å; V726-L730 PolarHBondContact O-N 2.8Å; F727-L730 PolarHBondContact O-N 2.66Å; L730-P732 VanDerWaalsContact C-N 3.34Å; L730-F733 PolarHBondContact O-N 2.7Å; L730-L734 HydrophobicContact CB-CD1 3.94Å; L730-L734 HydrophobicContact CB-CG 4.42Å; L730-L734 WeakPolarHBondContact O-CG 3.27Å; L730-L734 PolarHBondContact O-N 3.05Å
731	Q	86.4	Confident	87.5	Confident	87 Å²	87	47.7 Å²	47.7	41%	0.407	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.6	-42.5	-174.2	-172.3	173.1	14.3	0	0	114.8	F727 F733	F727-Q731 WeakPolarHBondContact O-CB 3.38Å; F727-Q731 PolarHBondContact O-N 3.23Å; Q731-F733 VanDerWaalsContact C-N 3.31Å; Q731-F733 PolarHBondContact O-N 3.05Å
732	P	86.5	Confident	87.5	Confident	98 Å²	98	42.9 Å²	42.9	64%	0.636	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-25.9	179.9	-20.2	34.2	0	0	0	114.3	M729 L730	M729-P732 WeakPolarHBondContact O-CD 3.42Å; L730-P732 VanDerWaalsContact C-N 3.34Å
733	F	84.5	Confident	87.4	Confident	108 Å²	108	43 Å²	43	47%	0.474	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-18.2	-173.9	-62.6	-82.2	0	0	0	113.1	Y508 F509 M729 L730 Q731	Y508-F733 HydrophobicContact CD1-CB 4.44Å; F509-F733 HydrophobicContact CD1-CE2 4.07Å; F509-F733 HydrophobicContact CD1-CZ 4.22Å; F509-F733 HydrophobicContact CE1-CD2 4.07Å; F509-F733 AromaticContact CE1-CE2 3.41Å; F509-F733 HydrophobicContact CE1-CE2 3.41Å; F509-F733 VanDerWaalsContact CE1-CE2 3.41Å; F509-F733 AromaticContact CE1-CZ 4Å; F509-F733 HydrophobicContact CE1-CZ 4Å; F509-F733 HydrophobicContact CZ-CD2 4.18Å; F509-F733 AromaticContact CZ-CE2 3.97Å; F509-F733 HydrophobicContact CZ-CE2 3.97Å; M729-F733 WeakPolarHBondContact O-CD2 3.38Å; L730-F733 PolarHBondContact O-N 2.7Å; Q731-F733 VanDerWaalsContact C-N 3.31Å; Q731-F733 PolarHBondContact O-N 3.05Å
734	L	86.5	Confident	87.2	Confident	5 Å²	5	44 Å²	44	3%	0.026	25%	0.251	C	S	.	.	S	Bend	trans	-84.6	137.9	-174	-69.3	172.5	0	0	0	112.4	Y508 L645 L730 H738 R739 L742	Y508-L734 HydrophobicContact CE1-CD2 3.81Å; L645-L734 HydrophobicContact CD1-CD1 4.31Å; L645-L734 HydrophobicContact CD1-CD2 3.85Å; L730-L734 HydrophobicContact CB-CD1 3.94Å; L730-L734 HydrophobicContact CB-CG 4.42Å; L730-L734 WeakPolarHBondContact O-CG 3.27Å; L730-L734 PolarHBondContact O-N 3.05Å; L734-H738 HydrophobicContact CB-CB 4.31Å; L734-H738 HydrophobicContact CD2-CB 4.27Å; L734-R739 HydrophobicContact CB-CG 3.81Å; L734-R739 PolarHBondContact O-NE 3.42Å; L734-R739 PolarHBondContact O-NH2 3.36Å; L734-L742 HydrophobicContact CD1-CD1 3.25Å; L734-L742 HydrophobicContact CD1-CG 4.47Å
735	P	86.3	Confident	87	Confident	51 Å²	51	41.4 Å²	41.4	33%	0.331	24%	0.235	S	C	.	.			trans	-56.1	149.4	166.7	-24.9	34	0	0	0	112	P737 H738 R739	P735-P737 VanDerWaalsContact C-CD 3.44Å; P735-P737 HydrophobicContact CB-CG 4.1Å; P735-H738 PolarHBondContact O-N 3.43Å; P735-R739 PolarHBondContact O-N 3.49Å; P735-R739 VanDerWaalsContact O-N 3.08Å
736	P	84.8	Confident	86.8	Confident	75 Å²	75	40.8 Å²	40.8	49%	0.487	23%	0.23	S	C	.	.	H	α-helix	trans	-47.9	-43.9	175.4	-26.9	34.4	0	0	0	115.7	H738 R739 A740	P736-H738 VanDerWaalsContact C-N 3.34Å; P736-H738 PolarHBondContact O-N 3.26Å; P736-R739 PolarHBondContact O-N 3.02Å; P736-A740 PolarHBondContact O-N 2.95Å; P736-A740 VanDerWaalsContact O-N 3.09Å
737	P	82.3	Confident	86.6	Confident	83 Å²	83	40.8 Å²	40.8	54%	0.539	23%	0.23	S	C	.	.	H	α-helix	trans	-63.4	-38.3	177.8	23.5	-34.1	0	0	0	112.7	P735 A740 V741	P735-P737 VanDerWaalsContact C-CD 3.44Å; P735-P737 HydrophobicContact CB-CG 4.1Å; P737-A740 WeakPolarHBondContact O-CB 3.48Å; P737-A740 PolarHBondContact O-N 3.38Å; P737-V741 WeakPolarHBondContact O-CG2 3.37Å; P737-V741 PolarHBondContact O-N 3.01Å; P737-V741 VanDerWaalsContact O-N 3.09Å
738	H	84.6	Confident	86.3	Confident	17 Å²	17	40.1 Å²	40.1	8%	0.079	23%	0.227	C	C	.	.	H	α-helix	trans	-67.6	-39.4	178.8	-62.8	-171.8	0	0	0	111	P638 L642 L734 P735 P736 A740 V741 L742	P638-H738 PolarHBondContact O-CE1 3.13Å; P638-H738 VanDerWaalsContact O-CE1 3.23Å; L642-H738 HydrophobicContact CD1-CB 4.05Å; L734-H738 HydrophobicContact CB-CB 4.31Å; L734-H738 HydrophobicContact CD2-CB 4.27Å; P735-H738 PolarHBondContact O-N 3.43Å; P736-H738 VanDerWaalsContact C-N 3.34Å; P736-H738 PolarHBondContact O-N 3.26Å; H738-A740 VanDerWaalsContact C-N 3.32Å; H738-A740 PolarHBondContact O-N 3.36Å; H738-V741 PolarHBondContact O-N 2.99Å; H738-L742 WeakPolarHBondContact O-CG 3.27Å; H738-L742 PolarHBondContact O-N 3.22Å
739	R	87.2	Confident	86.2	Confident	65 Å²	65	37.3 Å²	37.3	25%	0.245	21%	0.207	C	C	.	.	H	α-helix	trans	-59.9	-41.4	173.7	-69.5	-177.1	-116.7	167.7	-13	112.3	L734 P735 P736 L742 S743 D785	L734-R739 HydrophobicContact CB-CG 3.81Å; L734-R739 PolarHBondContact O-NE 3.42Å; L734-R739 PolarHBondContact O-NH2 3.36Å; P735-R739 PolarHBondContact O-N 3.49Å; P735-R739 VanDerWaalsContact O-N 3.08Å; P736-R739 PolarHBondContact O-N 3.02Å; R739-L742 PolarHBondContact O-N 3.48Å; R739-S743 WeakPolarHBondContact O-CB 3.37Å; R739-S743 PolarHBondContact O-N 3.39Å; R739-S743 PolarHBondContact O-OG 2.9Å; R739-D785 IonicContact CZ-OD2 3.68Å; R739-D785 IonicContact NH1-OD2 3.02Å; R739-D785 PolarHBondContact NH1-OD2 3.31Å
740	A	84.1	Confident	85.9	Confident	36 Å²	36	36.2 Å²	36.2	30%	0.298	20%	0.202	S	C	.	.	H	α-helix	trans	-62.2	-42.4	175.7	0	0	0	0	0	111.9	P736 P737 H738 S743 L744	P736-A740 PolarHBondContact O-N 2.95Å; P736-A740 VanDerWaalsContact O-N 3.09Å; P737-A740 WeakPolarHBondContact O-CB 3.48Å; P737-A740 PolarHBondContact O-N 3.38Å; H738-A740 VanDerWaalsContact C-N 3.32Å; H738-A740 PolarHBondContact O-N 3.36Å; A740-S743 PolarHBondContact O-N 3.31Å; A740-L744 WeakPolarHBondContact O-CB 3.47Å; A740-L744 PolarHBondContact O-N 2.93Å
741	V	83.2	Confident	85.7	Confident	28 Å²	28	36.2 Å²	36.2	17%	0.17	20%	0.202	C	C	.	.	H	α-helix	trans	-62.9	-46.5	176.4	174.4	0	0	0	0	111.4	L642 L646 P737 H738 S743 L744 S745	L642-V741 HydrophobicContact CD1-CG1 4.39Å; L646-V741 HydrophobicContact CD1-CG1 4.34Å; L646-V741 HydrophobicContact CD2-CG1 3.81Å; P737-V741 WeakPolarHBondContact O-CG2 3.37Å; P737-V741 PolarHBondContact O-N 3.01Å; P737-V741 VanDerWaalsContact O-N 3.09Å; H738-V741 PolarHBondContact O-N 2.99Å; V741-S743 VanDerWaalsContact C-N 3.35Å; V741-S743 PolarHBondContact O-N 3.16Å; V741-L744 WeakPolarHBondContact O-CB 3.14Å; V741-L744 PolarHBondContact O-N 3.21Å; V741-L744 VanDerWaalsContact O-N 3.16Å; V741-S745 PolarHBondContact O-N 2.63Å; V741-S745 PolarHBondContact O-OG 2.93Å
742	L	86.4	Confident	85.4	Confident	11 Å²	11	34.1 Å²	34.1	6%	0.058	19%	0.193	C	C	.	.	H	α-helix	trans	-62.9	-41	177.1	-65.4	-177.1	0	0	0	112.4	L645 L649 F727 L734 H738 R739 L744 S745 W746	L645-L742 HydrophobicContact CD1-CD1 4.49Å; L649-L742 HydrophobicContact CD1-CD2 3.6Å; F727-L742 HydrophobicContact CE1-CD1 4.49Å; F727-L742 HydrophobicContact CE1-CD2 4.39Å; F727-L742 HydrophobicContact CE2-CB 4.4Å; F727-L742 HydrophobicContact CZ-CB 4.31Å; F727-L742 HydrophobicContact CZ-CD2 4.32Å; L734-L742 HydrophobicContact CD1-CD1 3.25Å; L734-L742 HydrophobicContact CD1-CG 4.47Å; H738-L742 WeakPolarHBondContact O-CG 3.27Å; H738-L742 PolarHBondContact O-N 3.22Å; R739-L742 PolarHBondContact O-N 3.48Å; L742-L744 VanDerWaalsContact C-N 3.26Å; L742-L744 PolarHBondContact O-N 3.32Å; L742-S745 PolarHBondContact O-N 3Å; L742-W746 PolarHBondContact O-N 3.1Å
743	S	88.1	Confident	85.2	Confident	11 Å²	11	29.5 Å²	29.5	8%	0.077	16%	0.163	C	C	.	.	H	α-helix	trans	-60.2	-38.7	175.4	-59.4	0	0	0	0	111.4	R739 A740 V741 M747 N786	R739-S743 WeakPolarHBondContact O-CB 3.37Å; R739-S743 PolarHBondContact O-N 3.39Å; R739-S743 PolarHBondContact O-OG 2.9Å; A740-S743 PolarHBondContact O-N 3.31Å; V741-S743 VanDerWaalsContact C-N 3.35Å; V741-S743 PolarHBondContact O-N 3.16Å; S743-M747 PolarHBondContact O-N 2.9Å; S743-N786 PolarHBondContact OG-ND2 3.2Å; S743-N786 VanDerWaalsContact OG-ND2 3.1Å
744	L	85.9	Confident	85.2	Confident	24 Å²	24	24.4 Å²	24.4	13%	0.126	14%	0.14	C	C	.	.	H	α-helix	trans	-67.3	-47.7	175.6	179.6	61.4	0	0	0	111.6	A740 V741 L742 W746 M747 L748 V791 L792 E795	A740-L744 WeakPolarHBondContact O-CB 3.47Å; A740-L744 PolarHBondContact O-N 2.93Å; V741-L744 WeakPolarHBondContact O-CB 3.14Å; V741-L744 PolarHBondContact O-N 3.21Å; V741-L744 VanDerWaalsContact O-N 3.16Å; L742-L744 VanDerWaalsContact C-N 3.26Å; L742-L744 PolarHBondContact O-N 3.32Å; L744-W746 VanDerWaalsContact C-N 3.25Å; L744-W746 PolarHBondContact O-N 3.45Å; L744-M747 WeakPolarHBondContact O-CB 3.34Å; L744-M747 PolarHBondContact O-N 2.88Å; L744-M747 VanDerWaalsContact O-N 3.14Å; L744-L748 HydrophobicContact CD1-CD1 4.3Å; L744-L748 HydrophobicContact CD1-CG 4.19Å; L744-L748 HydrophobicContact CG-CD1 4.06Å; L744-L748 HydrophobicContact CG-CG 4.39Å; L744-L748 VanDerWaalsContact O-CG 3.32Å; L744-L748 WeakPolarHBondContact O-CG 3.32Å; L744-L748 PolarHBondContact O-N 3.37Å; L744-V791 HydrophobicContact CD1-CG1 3.81Å; L744-V791 HydrophobicContact CD2-CG1 3.86Å; L744-V791 HydrophobicContact CG-CG1 4.47Å; L744-L792 HydrophobicContact CB-CD2 4.12Å; L744-L792 HydrophobicContact CD1-CD2 4.15Å; L744-E795 HydrophobicContact CD1-CG 3.93Å
745	S	85.3	Confident	84.8	Confident	4 Å²	4	25.4 Å²	25.4	3%	0.028	15%	0.146	C	C	.	.	H	α-helix	trans	-56.6	-40	176.1	-65.8	0	0	0	0	112	V741 L742 L748 Y749	V741-S745 PolarHBondContact O-N 2.63Å; V741-S745 PolarHBondContact O-OG 2.93Å; L742-S745 PolarHBondContact O-N 3Å; S745-L748 PolarHBondContact O-N 2.93Å; S745-Y749 WeakPolarHBondContact O-CB 3.43Å; S745-Y749 PolarHBondContact O-N 3.3Å
746	W	88.3	Confident	84.3	Confident	25 Å²	25	25.9 Å²	25.9	10%	0.095	14%	0.143	C	C	.	.	H	α-helix	trans	-65.5	-44.5	175.2	-163.9	-78.2	0	0	0	112.8	F654 L723 F727 L742 L744 L748 Y749 E750 L780	F654-W746 HydrophobicContact CE1-CE3 4.06Å; L723-W746 HydrophobicContact CB-CH2 4.1Å; L723-W746 HydrophobicContact CB-CZ3 3.85Å; F727-W746 HydrophobicContact CD2-CD2 4.24Å; F727-W746 AromaticContact CD2-CE3 3.39Å; F727-W746 HydrophobicContact CD2-CE3 3.39Å; F727-W746 AromaticContact CD2-CZ3 3.54Å; F727-W746 HydrophobicContact CD2-CZ3 3.54Å; F727-W746 HydrophobicContact CE2-CB 4.24Å; F727-W746 HydrophobicContact CE2-CD2 4.01Å; F727-W746 AromaticContact CE2-CE3 3.1Å; F727-W746 HydrophobicContact CE2-CE3 3.1Å; F727-W746 AromaticContact CE2-CZ3 3.65Å; F727-W746 HydrophobicContact CE2-CZ3 3.65Å; F727-W746 HydrophobicContact CG-CE3 4.44Å; F727-W746 HydrophobicContact CG-CZ3 4.22Å; F727-W746 AromaticContact CZ-CE3 3.92Å; F727-W746 HydrophobicContact CZ-CE3 3.92Å; F727-W746 HydrophobicContact CZ-CZ3 4.33Å; L742-W746 PolarHBondContact O-N 3.1Å; L744-W746 VanDerWaalsContact C-N 3.25Å; L744-W746 PolarHBondContact O-N 3.45Å; W746-L748 VanDerWaalsContact C-N 3.32Å; W746-L748 PolarHBondContact O-N 3.48Å; W746-Y749 WeakPolarHBondContact O-CB 3.46Å; W746-Y749 PolarHBondContact O-N 3.21Å; W746-E750 PolarHBondContact O-N 3.35Å; W746-L780 HydrophobicContact CB-CD1 4.14Å; W746-L780 HydrophobicContact CG-CD1 4.24Å
747	M	87.4	Confident	84	Confident	1 Å²	1	22.3 Å²	22.3	1%	0.005	12%	0.12	C	C	.	.	H	α-helix	trans	-60.1	-43	176.3	-174.7	71.1	73.8	0	0	111.7	S743 L744 Y749 E750 K751 A777 L780 L792 E795	S743-M747 PolarHBondContact O-N 2.9Å; L744-M747 WeakPolarHBondContact O-CB 3.34Å; L744-M747 PolarHBondContact O-N 2.88Å; L744-M747 VanDerWaalsContact O-N 3.14Å; M747-Y749 VanDerWaalsContact C-N 3.34Å; M747-E750 PolarHBondContact O-N 2.91Å; M747-K751 PolarHBondContact O-N 3.32Å; M747-K751 VanDerWaalsContact O-N 3.08Å; M747-A777 HydrophobicContact CE-CB 3.61Å; M747-A777 HydrophobicContact SD-CB 3.42Å; M747-A777 WeakPolarHBondContact SD-CB 3.4Å; M747-L780 HydrophobicContact CE-CD1 4.35Å; M747-L792 HydrophobicContact CB-CD2 4.25Å; M747-E795 HydrophobicContact CG-CB 3.62Å
748	L	84.5	Confident	83.7	Confident	22 Å²	22	21.2 Å²	21.2	12%	0.115	11%	0.109	C	C	.	.	H	α-helix	trans	-66.3	-37.4	178	-67.7	173.7	0	0	0	111.6	P655 F690 L744 S745 W746 K751 L752 E795	P655-L748 HydrophobicContact CB-CB 4.34Å; P655-L748 HydrophobicContact CG-CB 3.5Å; P655-L748 VanDerWaalsContact CG-CB 3.5Å; F690-L748 HydrophobicContact CZ-CD2 4.23Å; L744-L748 HydrophobicContact CD1-CD1 4.3Å; L744-L748 HydrophobicContact CD1-CG 4.19Å; L744-L748 HydrophobicContact CG-CD1 4.06Å; L744-L748 HydrophobicContact CG-CG 4.39Å; L744-L748 VanDerWaalsContact O-CG 3.32Å; L744-L748 WeakPolarHBondContact O-CG 3.32Å; L744-L748 PolarHBondContact O-N 3.37Å; S745-L748 PolarHBondContact O-N 2.93Å; W746-L748 VanDerWaalsContact C-N 3.32Å; W746-L748 PolarHBondContact O-N 3.48Å; L748-K751 PolarHBondContact O-N 3.44Å; L748-L752 WeakPolarHBondContact O-CB 3.45Å; L748-L752 PolarHBondContact O-N 2.88Å; L748-E795 HydrophobicContact CD2-CG 3.95Å
749	Y	85.3	Confident	83.3	Confident	6 Å²	6	27.2 Å²	27.2	2%	0.024	13%	0.132	C	C	.	.	H	α-helix	trans	-62.7	-46.5	173.3	-179.5	-107.8	0	0	0	112.4	F654 G714 L715 S745 W746 M747 K751 L752 K753	F654-Y749 VanDerWaalsContact CD1-CB 3.46Å; F654-Y749 HydrophobicContact CD1-CD1 4.36Å; F654-Y749 AromaticContact CD1-CD2 3.92Å; F654-Y749 HydrophobicContact CD1-CD2 3.92Å; F654-Y749 AromaticContact CD1-CG 3.68Å; F654-Y749 HydrophobicContact CD1-CG 3.68Å; F654-Y749 AromaticContact CD2-CD2 3.94Å; F654-Y749 HydrophobicContact CD2-CD2 3.94Å; F654-Y749 HydrophobicContact CD2-CE2 4.07Å; F654-Y749 HydrophobicContact CD2-CG 4.43Å; F654-Y749 VanDerWaalsContact CE1-CB 3.43Å; F654-Y749 AromaticContact CE1-CD1 3.55Å; F654-Y749 HydrophobicContact CE1-CD1 3.55Å; F654-Y749 AromaticContact CE1-CD2 3.84Å; F654-Y749 HydrophobicContact CE1-CD2 3.84Å; F654-Y749 HydrophobicContact CE1-CE1 4.19Å; F654-Y749 HydrophobicContact CE1-CE2 4.42Å; F654-Y749 AromaticContact CE1-CG 3.33Å; F654-Y749 HydrophobicContact CE1-CG 3.33Å; F654-Y749 HydrophobicContact CE2-CD1 4.29Å; F654-Y749 AromaticContact CE2-CD2 3.81Å; F654-Y749 HydrophobicContact CE2-CD2 3.81Å; F654-Y749 HydrophobicContact CE2-CE1 4.19Å; F654-Y749 AromaticContact CE2-CE2 3.67Å; F654-Y749 HydrophobicContact CE2-CE2 3.67Å; F654-Y749 HydrophobicContact CE2-CG 4.09Å; F654-Y749 AromaticContact CE2-CZ 3.85Å; F654-Y749 AromaticContact CG-CD2 3.94Å; F654-Y749 HydrophobicContact CG-CD2 3.94Å; F654-Y749 HydrophobicContact CG-CG 4.2Å; F654-Y749 AromaticContact CZ-CD1 3.47Å; F654-Y749 HydrophobicContact CZ-CD1 3.47Å; F654-Y749 VanDerWaalsContact CZ-CD1 3.47Å; F654-Y749 AromaticContact CZ-CD2 3.74Å; F654-Y749 HydrophobicContact CZ-CD2 3.74Å; F654-Y749 AromaticContact CZ-CE1 3.61Å; F654-Y749 HydrophobicContact CZ-CE1 3.61Å; F654-Y749 AromaticContact CZ-CE2 3.85Å; F654-Y749 HydrophobicContact CZ-CE2 3.85Å; F654-Y749 AromaticContact CZ-CG 3.52Å; F654-Y749 HydrophobicContact CZ-CG 3.52Å; F654-Y749 AromaticContact CZ-CZ 3.77Å; G714-Y749 WeakPolarHBondContact CA-OH 3.46Å; L715-Y749 PolarHBondContact N-OH 3.26Å; S745-Y749 WeakPolarHBondContact O-CB 3.43Å; S745-Y749 PolarHBondContact O-N 3.3Å; W746-Y749 WeakPolarHBondContact O-CB 3.46Å; W746-Y749 PolarHBondContact O-N 3.21Å; M747-Y749 VanDerWaalsContact C-N 3.34Å; Y749-K751 PolarHBondContact O-N 3.06Å; Y749-L752 WeakPolarHBondContact O-CB 3.46Å; Y749-L752 PolarHBondContact O-N 3.39Å; Y749-L752 VanDerWaalsContact O-N 3.12Å; Y749-K753 HydrophobicContact CD1-CD 4.35Å; Y749-K753 HydrophobicContact CE1-CD 3.85Å; Y749-K753 HydrophobicContact CE1-CG 4.37Å; Y749-K753 PolarHBondContact O-N 2.91Å
750	E	86.9	Confident	82.5	Confident	2 Å²	2	27.3 Å²	27.3	1%	0.009	14%	0.142	C	C	.	.	H	α-helix	trans	-57.3	-40.2	175	-75	-58	151.9	0	0	112.5	W746 M747 K753 V754 S773 V776	W746-E750 PolarHBondContact O-N 3.35Å; M747-E750 PolarHBondContact O-N 2.91Å; E750-K753 WeakPolarHBondContact O-CB 3.33Å; E750-K753 PolarHBondContact O-N 3.21Å; E750-K753 VanDerWaalsContact OE1-CE 3.32Å; E750-K753 WeakPolarHBondContact OE1-CE 3.28Å; E750-K753 IonicContact OE1-NZ 2.74Å; E750-K753 PolarHBondContact OE1-NZ 2.83Å; E750-K753 WeakPolarHBondContact OE2-CE 3.44Å; E750-K753 IonicContact OE2-NZ 3.47Å; E750-K753 PolarHBondContact OE2-NZ 2.97Å; E750-V754 PolarHBondContact O-N 3.47Å; E750-S773 PolarHBondContact O-OG 2.89Å; E750-S773 VanDerWaalsContact OE2-CA 3.28Å; E750-S773 WeakPolarHBondContact OE2-CA 3.41Å; E750-S773 VanDerWaalsContact OE2-CB 3.22Å; E750-S773 WeakPolarHBondContact OE2-CB 3.11Å; E750-S773 PolarHBondContact OE2-OG 2.68Å; E750-V776 HydrophobicContact CG-CB 4.23Å; E750-V776 HydrophobicContact CG-CG1 3.78Å
751	K	84.5	Confident	82	Confident	2 Å²	2	28.3 Å²	28.3	1%	0.009	16%	0.155	C	C	.	.	H	α-helix	trans	-68.9	-39.5	176.1	-176.6	176.3	170.1	-164.6	0	112.6	F690 M747 L748 Y749 K753 V754 L755 E795 H798 L799	F690-K751 HydrophobicContact CE2-CD 4.26Å; F690-K751 VanDerWaalsContact CE2-CE 3.47Å; F690-K751 HydrophobicContact CZ-CD 4.14Å; M747-K751 PolarHBondContact O-N 3.32Å; M747-K751 VanDerWaalsContact O-N 3.08Å; L748-K751 PolarHBondContact O-N 3.44Å; Y749-K751 PolarHBondContact O-N 3.06Å; K751-K753 VanDerWaalsContact C-N 3.26Å; K751-K753 PolarHBondContact O-N 3.4Å; K751-V754 PolarHBondContact O-N 3.02Å; K751-L755 HydrophobicContact CG-CD1 4.31Å; K751-L755 WeakPolarHBondContact O-CG 3.15Å; K751-L755 PolarHBondContact O-N 2.91Å; K751-E795 IonicContact NZ-OE2 3.86Å; K751-E795 PolarHBondContact NZ-OE2 3.33Å; K751-H798 WeakPolarHBondContact CE-ND1 3.48Å; K751-H798 PolarHBondContact NZ-CE1 2.95Å; K751-H798 PolarHBondContact NZ-ND1 2.77Å; K751-L799 HydrophobicContact CB-CD1 4.25Å; K751-L799 HydrophobicContact CG-CD1 4.38Å
752	L	81.1	Confident	81.8	Confident	42 Å²	42	30.5 Å²	30.5	22%	0.22	17%	0.166	C	C	.	.	H	α-helix	trans	-58.3	-41.6	173.6	-173.5	151.3	0	0	0	110.7	P655 P692 L748 Y749 V754 L755 H756	P655-L752 HydrophobicContact CG-CD1 4.34Å; P692-L752 HydrophobicContact CB-CD1 4.47Å; L748-L752 WeakPolarHBondContact O-CB 3.45Å; L748-L752 PolarHBondContact O-N 2.88Å; Y749-L752 WeakPolarHBondContact O-CB 3.46Å; Y749-L752 PolarHBondContact O-N 3.39Å; Y749-L752 VanDerWaalsContact O-N 3.12Å; L752-V754 PolarHBondContact O-N 2.86Å; L752-L755 PolarHBondContact O-N 3.1Å; L752-H756 PolarHBondContact O-N 2.86Å
753	K	82.3	Confident	81.7	Confident	2 Å²	2	37.5 Å²	37.5	1%	0.009	20%	0.196	C	C	.	.	H	α-helix	trans	-57.6	-46.9	174.3	-69.2	-169.8	-72.4	-175.4	0	112.5	L713 E720 Y749 E750 K751 H756 C757 Q769	L713-K753 HydrophobicContact CD1-CG 4.4Å; L713-K753 HydrophobicContact CD2-CB 3.8Å; L713-K753 HydrophobicContact CD2-CG 4.07Å; L713-K753 WeakPolarHBondContact CD2-O 3.5Å; L713-K753 HydrophobicContact CG-CB 4.25Å; L713-K753 HydrophobicContact CG-CG 3.99Å; E720-K753 IonicContact OE1-NZ 3.88Å; E720-K753 PolarHBondContact OE1-NZ 2.93Å; E720-K753 IonicContact OE2-NZ 3.21Å; Y749-K753 HydrophobicContact CD1-CD 4.35Å; Y749-K753 HydrophobicContact CE1-CD 3.85Å; Y749-K753 HydrophobicContact CE1-CG 4.37Å; Y749-K753 PolarHBondContact O-N 2.91Å; E750-K753 WeakPolarHBondContact O-CB 3.33Å; E750-K753 PolarHBondContact O-N 3.21Å; E750-K753 VanDerWaalsContact OE1-CE 3.32Å; E750-K753 WeakPolarHBondContact OE1-CE 3.28Å; E750-K753 IonicContact OE1-NZ 2.74Å; E750-K753 PolarHBondContact OE1-NZ 2.83Å; E750-K753 WeakPolarHBondContact OE2-CE 3.44Å; E750-K753 IonicContact OE2-NZ 3.47Å; E750-K753 PolarHBondContact OE2-NZ 2.97Å; K751-K753 VanDerWaalsContact C-N 3.26Å; K751-K753 PolarHBondContact O-N 3.4Å; K753-H756 PolarHBondContact O-N 3.4Å; K753-C757 PolarHBondContact O-N 3.22Å; K753-C757 VanDerWaalsContact O-N 3.11Å; K753-C757 PolarHBondContact O-SG 2.56Å; K753-Q769 HydrophobicContact CB-CG 4.08Å
754	V	84.3	Confident	81.5	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.6	-43.5	177.1	170.7	0	0	0	0	112	E750 K751 L752 H756 C757 L758 L766 Q769 L799 V802 L803	E750-V754 PolarHBondContact O-N 3.47Å; K751-V754 PolarHBondContact O-N 3.02Å; L752-V754 PolarHBondContact O-N 2.86Å; V754-H756 VanDerWaalsContact C-N 3.33Å; V754-H756 PolarHBondContact O-N 3.11Å; V754-C757 PolarHBondContact O-N 3.13Å; V754-L758 HydrophobicContact CG1-CD1 4.27Å; V754-L758 WeakPolarHBondContact O-CG 3.36Å; V754-L758 PolarHBondContact O-N 3.46Å; V754-L766 HydrophobicContact CG1-CD1 3.93Å; V754-Q769 HydrophobicContact CG2-CG 4.11Å; V754-L799 HydrophobicContact CB-CD1 4.08Å; V754-L799 HydrophobicContact CG1-CD1 4.36Å; V754-L799 HydrophobicContact CG2-CD1 3.8Å; V754-V802 HydrophobicContact CG1-CG1 3.86Å; V754-L803 HydrophobicContact CG1-CD2 3.52Å; V754-L803 HydrophobicContact CG1-CG 4.03Å; V754-L803 HydrophobicContact CG2-CD2 4.28Å
755	L	78.6	Confident	81.3	Confident	26 Å²	26	48.5 Å²	48.5	14%	0.136	24%	0.24	C	C	.	.	H	α-helix	trans	-62.7	-39.4	178.8	-73.1	171.8	0	0	0	112.3	F690 K751 L752 L758 R759 V802	F690-L755 HydrophobicContact CB-CD1 4.03Å; F690-L755 HydrophobicContact CD1-CD1 3.33Å; F690-L755 HydrophobicContact CE1-CD1 3.91Å; F690-L755 HydrophobicContact CG-CD1 3.74Å; K751-L755 HydrophobicContact CG-CD1 4.31Å; K751-L755 WeakPolarHBondContact O-CG 3.15Å; K751-L755 PolarHBondContact O-N 2.91Å; L752-L755 PolarHBondContact O-N 3.1Å; L755-L758 HydrophobicContact CD2-CD1 4.31Å; L755-L758 WeakPolarHBondContact O-CB 3.49Å; L755-L758 PolarHBondContact O-N 2.92Å; L755-R759 WeakPolarHBondContact O-CG 3.47Å; L755-R759 PolarHBondContact O-N 3.27Å; L755-V802 HydrophobicContact CD2-CG1 3.74Å; L755-V802 HydrophobicContact CD2-CG2 4.36Å; L755-V802 HydrophobicContact CG-CG1 4.44Å
756	H	75.2	Confident	81.3	Confident	61 Å²	61	49.8 Å²	49.8	28%	0.282	25%	0.246	S	C	.	.	H	α-helix	trans	-65.7	-43.4	175.2	-172	90.3	0	0	0	111.8	L713 L752 K753 V754 L758 R759 S760	L713-H756 HydrophobicContact CD1-CB 3.5Å; L752-H756 PolarHBondContact O-N 2.86Å; K753-H756 PolarHBondContact O-N 3.4Å; V754-H756 VanDerWaalsContact C-N 3.33Å; V754-H756 PolarHBondContact O-N 3.11Å; H756-L758 PolarHBondContact O-N 2.71Å; H756-R759 PolarHBondContact O-N 2.96Å; H756-R759 VanDerWaalsContact O-N 3.09Å; H756-S760 PolarHBondContact O-N 3.19Å
757	C	77.8	Confident	81.2	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-59.5	-35.7	174.7	-67.7	0	0	0	0	112.3	K753 V754 G761 L766	K753-C757 PolarHBondContact O-N 3.22Å; K753-C757 VanDerWaalsContact O-N 3.11Å; K753-C757 PolarHBondContact O-SG 2.56Å; V754-C757 PolarHBondContact O-N 3.13Å; C757-G761 PolarHBondContact O-N 3.22Å; C757-L766 HydrophobicContact CB-CB 4.17Å; C757-L766 HydrophobicContact CB-CD1 3.93Å
758	L	77.6	Confident	81.2	Confident	60 Å²	60	60.5 Å²	60.5	31%	0.314	30%	0.3	S	S	.	.	H	α-helix	trans	-63.9	-44.6	173.2	-77.7	165.8	0	0	0	112.1	V754 L755 H756 S760 G761 L766 V802	V754-L758 HydrophobicContact CG1-CD1 4.27Å; V754-L758 WeakPolarHBondContact O-CG 3.36Å; V754-L758 PolarHBondContact O-N 3.46Å; L755-L758 HydrophobicContact CD2-CD1 4.31Å; L755-L758 WeakPolarHBondContact O-CB 3.49Å; L755-L758 PolarHBondContact O-N 2.92Å; H756-L758 PolarHBondContact O-N 2.71Å; L758-S760 VanDerWaalsContact C-N 3.34Å; L758-G761 PolarHBondContact O-N 3.45Å; L758-L766 HydrophobicContact CD2-CD1 4.04Å; L758-L766 HydrophobicContact CD2-CD2 3.44Å; L758-L766 VanDerWaalsContact CD2-CD2 3.44Å; L758-L766 HydrophobicContact CD2-CG 4.39Å; L758-L766 HydrophobicContact CG-CD1 3.76Å; L758-L766 HydrophobicContact CG-CD2 4.11Å; L758-V802 HydrophobicContact CD1-CG1 3.2Å
759	R	74.5	Confident	81.3	Confident	144 Å²	144	61.1 Å²	61.1	54%	0.543	30%	0.302	S	S	.	.	H	α-helix	trans	-65.4	-36.2	178	-68.8	175.4	-175.3	177.9	-1.2	112.3	Q679 L755 H756 G761	Q679-R759 VanDerWaalsContact CD-NH1 3.33Å; L755-R759 WeakPolarHBondContact O-CG 3.47Å; L755-R759 PolarHBondContact O-N 3.27Å; H756-R759 PolarHBondContact O-N 2.96Å; H756-R759 VanDerWaalsContact O-N 3.09Å; R759-G761 PolarHBondContact O-N 3.41Å
760	S	71.6	Confident	81.5	Confident	67 Å²	67	61 Å²	61	47%	0.469	30%	0.303	S	S	.	.	H	α-helix	trans	-68.3	-17.9	176.8	170.1	0	0	0	0	113.6	H756 L758 N762	H756-S760 PolarHBondContact O-N 3.19Å; L758-S760 VanDerWaalsContact C-N 3.34Å; S760-N762 PolarHBondContact O-N 2.98Å
761	G	73.4	Confident	81.6	Confident	56 Å²	56	68 Å²	68	58%	0.577	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	-2.7	179.6	0	0	0	0	0	115.1	C757 L758 R759 K763	C757-G761 PolarHBondContact O-N 3.22Å; L758-G761 PolarHBondContact O-N 3.45Å; R759-G761 PolarHBondContact O-N 3.41Å; G761-K763 PolarHBondContact O-N 3.37Å; G761-K763 VanDerWaalsContact O-N 3.11Å
762	N	79.2	Confident	81.8	Confident	74 Å²	74	69.5 Å²	69.5	40%	0.396	34%	0.344	S	S	.	.			trans	-78.2	96.1	179.8	-171	-24.9	0	0	0	112	S760 K764 R765 L766	S760-N762 PolarHBondContact O-N 2.98Å; N762-K764 VanDerWaalsContact C-N 3.32Å; N762-K764 PolarHBondContact O-N 2.64Å; N762-K764 PolarHBondContact OD1-N 3.03Å; N762-K764 VanDerWaalsContact OD1-N 3.17Å; N762-R765 HydrophobicContact CB-CB 4.12Å; N762-R765 PolarHBondContact O-N 2.88Å; N762-R765 PolarHBondContact OD1-N 3.2Å; N762-L766 WeakPolarHBondContact O-CB 3.37Å; N762-L766 PolarHBondContact O-N 2.97Å
763	K	84.6	Confident	82.3	Confident	159 Å²	159	67.5 Å²	67.5	69%	0.691	33%	0.333	S	S	*	.	H	α-helix	trans	-61.1	-32.5	-178.6	-65.5	-179.1	-179.3	175.6	0	114.2	G761 R767	G761-K763 PolarHBondContact O-N 3.37Å; G761-K763 VanDerWaalsContact O-N 3.11Å; K763-R767 WeakPolarHBondContact O-CG 3.48Å; K763-R767 PolarHBondContact O-N 3.26Å
764	K	84	Confident	82.8	Confident	181 Å²	181	69.5 Å²	69.5	79%	0.787	34%	0.342	S	S	*	.	H	α-helix	trans	-68.8	-51.3	179.7	-71	-176.5	179.7	180	0	110.1	N762 L766 R767 A768	N762-K764 VanDerWaalsContact C-N 3.32Å; N762-K764 PolarHBondContact O-N 2.64Å; N762-K764 PolarHBondContact OD1-N 3.03Å; N762-K764 VanDerWaalsContact OD1-N 3.17Å; K764-L766 VanDerWaalsContact C-N 3.32Å; K764-L766 PolarHBondContact O-N 3.23Å; K764-R767 PolarHBondContact O-N 3.2Å; K764-A768 PolarHBondContact O-N 2.87Å; K764-A768 VanDerWaalsContact O-N 3.12Å
765	R	81	Confident	83.1	Confident	85 Å²	85	77.7 Å²	77.7	32%	0.321	37%	0.373	S	S	.	.	H	α-helix	trans	-59.1	-42.5	176.7	-169.1	178.9	180	177.6	4.6	111.6	N762 R767 A768 Q769	N762-R765 HydrophobicContact CB-CB 4.12Å; N762-R765 PolarHBondContact O-N 2.88Å; N762-R765 PolarHBondContact OD1-N 3.2Å; R765-R767 VanDerWaalsContact C-N 3.35Å; R765-R767 PolarHBondContact O-N 3.36Å; R765-A768 PolarHBondContact O-N 3.47Å; R765-Q769 VanDerWaalsContact O-CB 3.25Å; R765-Q769 WeakPolarHBondContact O-CB 3.46Å; R765-Q769 PolarHBondContact O-N 3.5Å
766	L	85.4	Confident	83.7	Confident	30 Å²	30	77.5 Å²	77.5	16%	0.157	37%	0.373	C	S	.	.	H	α-helix	trans	-58.6	-42.3	175.8	178.3	63.5	0	0	0	113.1	V754 C757 L758 N762 K764 G770 L803	V754-L766 HydrophobicContact CG1-CD1 3.93Å; C757-L766 HydrophobicContact CB-CB 4.17Å; C757-L766 HydrophobicContact CB-CD1 3.93Å; L758-L766 HydrophobicContact CD2-CD1 4.04Å; L758-L766 HydrophobicContact CD2-CD2 3.44Å; L758-L766 VanDerWaalsContact CD2-CD2 3.44Å; L758-L766 HydrophobicContact CD2-CG 4.39Å; L758-L766 HydrophobicContact CG-CD1 3.76Å; L758-L766 HydrophobicContact CG-CD2 4.11Å; N762-L766 WeakPolarHBondContact O-CB 3.37Å; N762-L766 PolarHBondContact O-N 2.97Å; K764-L766 VanDerWaalsContact C-N 3.32Å; K764-L766 PolarHBondContact O-N 3.23Å; L766-G770 PolarHBondContact O-N 3Å; L766-L803 HydrophobicContact CD1-CD2 4.04Å
767	R	86.2	Confident	84.4	Confident	187 Å²	187	74.6 Å²	74.6	71%	0.706	36%	0.359	S	S	*	.	H	α-helix	trans	-67.7	-43.3	178.7	-73.6	174.3	179.9	-175.5	-0	111.8	K763 K764 R765 K771	K763-R767 WeakPolarHBondContact O-CG 3.48Å; K763-R767 PolarHBondContact O-N 3.26Å; K764-R767 PolarHBondContact O-N 3.2Å; R765-R767 VanDerWaalsContact C-N 3.35Å; R765-R767 PolarHBondContact O-N 3.36Å; R767-K771 WeakPolarHBondContact O-CG 3.46Å; R767-K771 PolarHBondContact O-N 3.24Å; R767-K771 VanDerWaalsContact O-N 3.1Å
768	A	86.9	Confident	85.1	Confident	65 Å²	65	79.5 Å²	79.5	54%	0.537	38%	0.381	S	S	.	.	H	α-helix	trans	-63.7	-50.9	176.9	0	0	0	0	0	111	K764 R765 G770 K771 S772	K764-A768 PolarHBondContact O-N 2.87Å; K764-A768 VanDerWaalsContact O-N 3.12Å; R765-A768 PolarHBondContact O-N 3.47Å; A768-G770 PolarHBondContact O-N 3.02Å; A768-K771 PolarHBondContact O-N 3.19Å; A768-S772 PolarHBondContact O-N 3.3Å
769	Q	87.1	Confident	85.7	Confident	34 Å²	34	84.3 Å²	84.3	16%	0.159	40%	0.395	C	S	.	.	H	α-helix	trans	-59.3	-47.5	177.3	-172.7	59.8	40	0	0	111.4	K753 V754 R765 K771 S772 S773	K753-Q769 HydrophobicContact CB-CG 4.08Å; V754-Q769 HydrophobicContact CG2-CG 4.11Å; R765-Q769 VanDerWaalsContact O-CB 3.25Å; R765-Q769 WeakPolarHBondContact O-CB 3.46Å; R765-Q769 PolarHBondContact O-N 3.5Å; Q769-K771 VanDerWaalsContact C-N 3.31Å; Q769-K771 PolarHBondContact O-N 2.88Å; Q769-S772 PolarHBondContact O-N 3.08Å; Q769-S772 VanDerWaalsContact O-N 3.08Å; Q769-S773 PolarHBondContact NE2-OG 2.91Å; Q769-S773 VanDerWaalsContact NE2-OG 3.07Å; Q769-S773 WeakPolarHBondContact O-CB 3.49Å; Q769-S773 PolarHBondContact O-N 3.12Å; Q769-S773 PolarHBondContact O-OG 3.46Å; Q769-S773 VanDerWaalsContact O-OG 3.13Å
770	G	88.6	Confident	86.4	Confident	3 Å²	3	78.3 Å²	78.3	3%	0.031	37%	0.373	C	S	.	.	H	α-helix	trans	-59.6	-38.3	178.6	0	0	0	0	0	113.2	L766 A768 K774	L766-G770 PolarHBondContact O-N 3Å; A768-G770 PolarHBondContact O-N 3.02Å; G770-K774 WeakPolarHBondContact O-CB 3.27Å; G770-K774 WeakPolarHBondContact O-CG 3.46Å; G770-K774 PolarHBondContact O-N 3Å; G770-K774 VanDerWaalsContact O-N 3.13Å
771	K	90.4	Very high	87.3	Confident	151 Å²	151	75.7 Å²	75.7	66%	0.657	35%	0.354	S	S	*	.	H	α-helix	trans	-64.9	-44.6	172.9	-73.9	176	-178.4	-175.9	0	111.5	R767 A768 Q769 R775	R767-K771 WeakPolarHBondContact O-CG 3.46Å; R767-K771 PolarHBondContact O-N 3.24Å; R767-K771 VanDerWaalsContact O-N 3.1Å; A768-K771 PolarHBondContact O-N 3.19Å; Q769-K771 VanDerWaalsContact C-N 3.31Å; Q769-K771 PolarHBondContact O-N 2.88Å; K771-R775 WeakPolarHBondContact O-CG 3.49Å; K771-R775 PolarHBondContact O-N 2.96Å
772	S	88.8	Confident	88.1	Confident	33 Å²	33	80.1 Å²	80.1	23%	0.231	36%	0.357	C	S	.	.	H	α-helix	trans	-63.5	-51.9	179.6	-153.4	0	0	0	0	111.9	A768 Q769 K774 R775 V776	A768-S772 PolarHBondContact O-N 3.3Å; Q769-S772 PolarHBondContact O-N 3.08Å; Q769-S772 VanDerWaalsContact O-N 3.08Å; S772-K774 VanDerWaalsContact C-N 3.29Å; S772-K774 PolarHBondContact O-N 3.36Å; S772-R775 WeakPolarHBondContact O-CB 3.39Å; S772-R775 PolarHBondContact O-N 3.39Å; S772-R775 PolarHBondContact OG-NH2 3.03Å; S772-V776 PolarHBondContact O-N 2.98Å; S772-V776 VanDerWaalsContact O-N 3.15Å
773	S	90.6	Very high	88.4	Confident	0 Å²	0	78.7 Å²	78.7	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-58.7	-36.7	179.2	-61.5	0	0	0	0	112.9	E750 Q769 A777	E750-S773 PolarHBondContact O-OG 2.89Å; E750-S773 VanDerWaalsContact OE2-CA 3.28Å; E750-S773 WeakPolarHBondContact OE2-CA 3.41Å; E750-S773 VanDerWaalsContact OE2-CB 3.22Å; E750-S773 WeakPolarHBondContact OE2-CB 3.11Å; E750-S773 PolarHBondContact OE2-OG 2.68Å; Q769-S773 PolarHBondContact NE2-OG 2.91Å; Q769-S773 VanDerWaalsContact NE2-OG 3.07Å; Q769-S773 WeakPolarHBondContact O-CB 3.49Å; Q769-S773 PolarHBondContact O-N 3.12Å; Q769-S773 PolarHBondContact O-OG 3.46Å; Q769-S773 VanDerWaalsContact O-OG 3.13Å; S773-A777 VanDerWaalsContact O-CB 3.3Å; S773-A777 WeakPolarHBondContact O-CB 3.49Å; S773-A777 PolarHBondContact O-N 2.91Å
774	K	92.7	Very high	88.2	Confident	43 Å²	43	75.8 Å²	75.8	19%	0.187	35%	0.346	C	S	.	.	H	α-helix	trans	-65.3	-39.9	172.7	-74.9	176.2	-171	-143.6	0	113.4	G770 S772 V776 A777 K778 E800 L803 N805	G770-K774 WeakPolarHBondContact O-CB 3.27Å; G770-K774 WeakPolarHBondContact O-CG 3.46Å; G770-K774 PolarHBondContact O-N 3Å; G770-K774 VanDerWaalsContact O-N 3.13Å; S772-K774 VanDerWaalsContact C-N 3.29Å; S772-K774 PolarHBondContact O-N 3.36Å; K774-V776 VanDerWaalsContact C-N 3.31Å; K774-A777 PolarHBondContact O-N 2.98Å; K774-K778 WeakPolarHBondContact O-CB 3.48Å; K774-K778 VanDerWaalsContact O-CG 3.28Å; K774-K778 WeakPolarHBondContact O-CG 3.35Å; K774-K778 PolarHBondContact O-N 3.06Å; K774-E800 VanDerWaalsContact CD-OE1 3.25Å; K774-E800 WeakPolarHBondContact CD-OE1 3.4Å; K774-E800 VanDerWaalsContact CE-CD 3.44Å; K774-E800 WeakPolarHBondContact CE-OE1 3.48Å; K774-E800 WeakPolarHBondContact CE-OE2 3.47Å; K774-E800 IonicContact NZ-OE1 3.35Å; K774-E800 PolarHBondContact NZ-OE1 3.14Å; K774-E800 IonicContact NZ-OE2 3.87Å; K774-E800 PolarHBondContact NZ-OE2 2.83Å; K774-L803 HydrophobicContact CD-CD1 4.28Å; K774-L803 HydrophobicContact CG-CD1 4.17Å; K774-N805 PolarHBondContact NZ-ND2 3.26Å
775	R	91.9	Very high	88	Confident	172 Å²	172	70.5 Å²	70.5	65%	0.649	33%	0.326	S	S	*	.	H	α-helix	trans	-61.2	-45.7	178.3	-72.7	-175.4	-63.8	176.1	1.7	110.2	K771 S772 R779	K771-R775 WeakPolarHBondContact O-CG 3.49Å; K771-R775 PolarHBondContact O-N 2.96Å; S772-R775 WeakPolarHBondContact O-CB 3.39Å; S772-R775 PolarHBondContact O-N 3.39Å; S772-R775 PolarHBondContact OG-NH2 3.03Å; R775-R779 PolarHBondContact O-N 3.17Å
776	V	89.6	Confident	88.1	Confident	22 Å²	22	66.6 Å²	66.6	13%	0.133	31%	0.311	C	S	.	.	H	α-helix	trans	-61.8	-51.9	176.3	172.4	0	0	0	0	111.1	E750 S772 K774 K778 R779 L780	E750-V776 HydrophobicContact CG-CB 4.23Å; E750-V776 HydrophobicContact CG-CG1 3.78Å; S772-V776 PolarHBondContact O-N 2.98Å; S772-V776 VanDerWaalsContact O-N 3.15Å; K774-V776 VanDerWaalsContact C-N 3.31Å; V776-K778 VanDerWaalsContact C-N 3.31Å; V776-K778 PolarHBondContact O-N 3.16Å; V776-R779 WeakPolarHBondContact O-CA 3.49Å; V776-R779 VanDerWaalsContact O-CB 3.3Å; V776-R779 WeakPolarHBondContact O-CB 3.45Å; V776-R779 PolarHBondContact O-N 2.99Å; V776-L780 HydrophobicContact CG1-CD1 4.33Å; V776-L780 PolarHBondContact O-N 3.49Å
777	A	91.1	Very high	88	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-57	-43.1	179.3	0	0	0	0	0	112.7	M747 S773 K774 R779 L780 L781 Y796 L799	M747-A777 HydrophobicContact CE-CB 3.61Å; M747-A777 HydrophobicContact SD-CB 3.42Å; M747-A777 WeakPolarHBondContact SD-CB 3.4Å; S773-A777 VanDerWaalsContact O-CB 3.3Å; S773-A777 WeakPolarHBondContact O-CB 3.49Å; S773-A777 PolarHBondContact O-N 2.91Å; K774-A777 PolarHBondContact O-N 2.98Å; A777-R779 VanDerWaalsContact C-N 3.34Å; A777-R779 PolarHBondContact O-N 3.42Å; A777-L780 PolarHBondContact O-N 3.3Å; A777-L781 WeakPolarHBondContact O-CG 3.46Å; A777-L781 PolarHBondContact O-N 2.96Å; A777-Y796 HydrophobicContact CB-CD2 3.44Å; A777-Y796 VanDerWaalsContact CB-CD2 3.44Å; A777-Y796 HydrophobicContact CB-CE2 3.9Å; A777-Y796 HydrophobicContact CB-CG 4.39Å; A777-L799 HydrophobicContact CB-CD2 4.24Å
778	K	91.6	Very high	87.9	Confident	103 Å²	103	68 Å²	68	45%	0.448	33%	0.329	S	S	.	.	H	α-helix	trans	-66.6	-33.1	175.3	-72.8	178.7	-178.1	-174.4	0	112.7	K774 V776 K782 Y796	K774-K778 WeakPolarHBondContact O-CB 3.48Å; K774-K778 VanDerWaalsContact O-CG 3.28Å; K774-K778 WeakPolarHBondContact O-CG 3.35Å; K774-K778 PolarHBondContact O-N 3.06Å; V776-K778 VanDerWaalsContact C-N 3.31Å; V776-K778 PolarHBondContact O-N 3.16Å; K778-K782 WeakPolarHBondContact O-CG 3.4Å; K778-K782 PolarHBondContact O-N 3.21Å; K778-Y796 WeakPolarHBondContact CE-OH 3.43Å; K778-Y796 HydrophobicContact CG-CE2 4.28Å
779	R	91.3	Very high	87.9	Confident	161 Å²	161	66.2 Å²	66.2	61%	0.608	31%	0.313	S	S	*	.	H	α-helix	trans	-63.7	-51	174.5	-173.7	-171.2	-64	170.6	-3	109.8	R775 V776 A777 L781 K782	R775-R779 PolarHBondContact O-N 3.17Å; V776-R779 WeakPolarHBondContact O-CA 3.49Å; V776-R779 VanDerWaalsContact O-CB 3.3Å; V776-R779 WeakPolarHBondContact O-CB 3.45Å; V776-R779 PolarHBondContact O-N 2.99Å; A777-R779 VanDerWaalsContact C-N 3.34Å; A777-R779 PolarHBondContact O-N 3.42Å; R779-L781 PolarHBondContact O-N 3.43Å; R779-K782 WeakPolarHBondContact O-CB 3.41Å; R779-K782 PolarHBondContact O-N 2.99Å; R779-K782 VanDerWaalsContact O-N 3.1Å
780	L	89.1	Confident	87.9	Confident	18 Å²	18	65.2 Å²	65.2	9%	0.094	31%	0.308	C	S	.	.	H	α-helix	trans	-58.2	-44.6	178.2	-65.5	174.1	0	0	0	112	W746 M747 V776 A777 K782 E783 N786	W746-L780 HydrophobicContact CB-CD1 4.14Å; W746-L780 HydrophobicContact CG-CD1 4.24Å; M747-L780 HydrophobicContact CE-CD1 4.35Å; V776-L780 HydrophobicContact CG1-CD1 4.33Å; V776-L780 PolarHBondContact O-N 3.49Å; A777-L780 PolarHBondContact O-N 3.3Å; L780-K782 VanDerWaalsContact C-N 3.28Å; L780-K782 PolarHBondContact O-N 3.46Å; L780-E783 WeakPolarHBondContact O-CB 3.37Å; L780-E783 PolarHBondContact O-N 2.91Å; L780-N786 WeakPolarHBondContact O-CB 3.43Å; L780-N786 PolarHBondContact O-ND2 3.25Å
781	L	89.7	Confident	87.7	Confident	12 Å²	12	67.6 Å²	67.6	6%	0.063	32%	0.322	C	S	.	.	H	α-helix	trans	-67.6	-22.7	178.3	-72.4	174.3	0	0	0	114.3	A777 R779 E783 R787 L792 W793 Y796	A777-L781 WeakPolarHBondContact O-CG 3.46Å; A777-L781 PolarHBondContact O-N 2.96Å; R779-L781 PolarHBondContact O-N 3.43Å; L781-E783 VanDerWaalsContact C-N 3.33Å; L781-R787 WeakPolarHBondContact O-CG 3.16Å; L781-L792 HydrophobicContact CD2-CB 3.67Å; L781-W793 HydrophobicContact CD1-CD2 4.31Å; L781-W793 HydrophobicContact CD1-CE3 4.32Å; L781-W793 HydrophobicContact CD1-CZ3 4.48Å; L781-W793 HydrophobicContact CD2-CD2 4.11Å; L781-W793 HydrophobicContact CD2-CG 4.05Å; L781-Y796 HydrophobicContact CD1-CD1 3.65Å; L781-Y796 HydrophobicContact CD1-CE1 4.39Å; L781-Y796 HydrophobicContact CD1-CG 3.75Å
782	K	89.7	Confident	87.6	Confident	149 Å²	149	60.5 Å²	60.5	65%	0.648	29%	0.291	S	S	*	.	H	α-helix	trans	-78.4	-20	178.8	-80.2	173.4	180	-171.8	0	112.8	K778 R779 L780 R787	K778-K782 WeakPolarHBondContact O-CG 3.4Å; K778-K782 PolarHBondContact O-N 3.21Å; R779-K782 WeakPolarHBondContact O-CB 3.41Å; R779-K782 PolarHBondContact O-N 2.99Å; R779-K782 VanDerWaalsContact O-N 3.1Å; L780-K782 VanDerWaalsContact C-N 3.28Å; L780-K782 PolarHBondContact O-N 3.46Å; K782-R787 PolarHBondContact O-NE 2.92Å; K782-R787 PolarHBondContact O-NH2 3.32Å
783	E	85.7	Confident	87.7	Confident	44 Å²	44	61.1 Å²	61.1	21%	0.206	29%	0.289	C	S	.	.	S	Bend	trans	-61.6	139.1	177.8	-66	176.4	176.7	0	0	110.8	L780 L781 D785 N786 R787	L780-E783 WeakPolarHBondContact O-CB 3.37Å; L780-E783 PolarHBondContact O-N 2.91Å; L781-E783 VanDerWaalsContact C-N 3.33Å; E783-D785 VanDerWaalsContact C-N 3.26Å; E783-D785 PolarHBondContact O-N 3.06Å; E783-N786 HydrophobicContact CB-CB 4.27Å; E783-N786 PolarHBondContact O-N 2.96Å; E783-N786 PolarHBondContact OE2-ND2 3.14Å; E783-R787 WeakPolarHBondContact O-CG 3.42Å; E783-R787 PolarHBondContact O-N 3.44Å; E783-R787 VanDerWaalsContact O-N 3.13Å
784	P	81	Confident	87.6	Confident	99 Å²	99	63.4 Å²	63.4	64%	0.643	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-38.9	-172.2	23.8	-33.7	0	0	0	112.6	N786	P784-N786 VanDerWaalsContact C-N 3.27Å; P784-N786 PolarHBondContact O-N 3.32Å
785	D	79.1	Confident	87.4	Confident	70 Å²	70	62.1 Å²	62.1	37%	0.374	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-27.3	-179.3	-59.9	-19.2	0	0	0	112.5	R739 E783	R739-D785 IonicContact CZ-OD2 3.68Å; R739-D785 IonicContact NH1-OD2 3.02Å; R739-D785 PolarHBondContact NH1-OD2 3.31Å; E783-D785 VanDerWaalsContact C-N 3.26Å; E783-D785 PolarHBondContact O-N 3.06Å
786	N	83.1	Confident	87.4	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.011	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-14.6	-170.9	-74.2	-29	0	0	0	113.5	S743 L780 E783 P784 S788 S789 L792	S743-N786 PolarHBondContact OG-ND2 3.2Å; S743-N786 VanDerWaalsContact OG-ND2 3.1Å; L780-N786 WeakPolarHBondContact O-CB 3.43Å; L780-N786 PolarHBondContact O-ND2 3.25Å; E783-N786 HydrophobicContact CB-CB 4.27Å; E783-N786 PolarHBondContact O-N 2.96Å; E783-N786 PolarHBondContact OE2-ND2 3.14Å; P784-N786 VanDerWaalsContact C-N 3.27Å; P784-N786 PolarHBondContact O-N 3.32Å; N786-S788 VanDerWaalsContact C-N 3.26Å; N786-S788 PolarHBondContact O-N 2.91Å; N786-S789 WeakPolarHBondContact O-CB 3.46Å; N786-S789 PolarHBondContact O-N 2.97Å; N786-L792 HydrophobicContact CB-CD1 3.59Å; N786-L792 VanDerWaalsContact OD1-CD1 3.27Å; N786-L792 WeakPolarHBondContact OD1-CD1 3.22Å
787	R	83.8	Confident	87.5	Confident	153 Å²	153	53.6 Å²	53.6	58%	0.577	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-39.1	-176.4	-81.1	173.4	-167.8	-173	4	113.3	L781 K782 E783 W793 M819	L781-R787 WeakPolarHBondContact O-CG 3.16Å; K782-R787 PolarHBondContact O-NE 2.92Å; K782-R787 PolarHBondContact O-NH2 3.32Å; E783-R787 WeakPolarHBondContact O-CG 3.42Å; E783-R787 PolarHBondContact O-N 3.44Å; E783-R787 VanDerWaalsContact O-N 3.13Å; R787-W793 PolarHBondContact O-NE1 2.93Å; R787-M819 WeakPolarHBondContact O-CE 3.25Å
788	S	84.4	Confident	87.3	Confident	93 Å²	93	53.9 Å²	53.9	65%	0.65	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	2.7	179.2	52.2	0	0	0	0	114.2	N786 L790	N786-S788 VanDerWaalsContact C-N 3.26Å; N786-S788 PolarHBondContact O-N 2.91Å; S788-L790 PolarHBondContact O-N 2.88Å; S788-L790 VanDerWaalsContact O-N 3.12Å
789	S	86.3	Confident	87.2	Confident	28 Å²	28	49 Å²	49	20%	0.196	24%	0.238	C	C	.	.			trans	-78.5	97.3	-174.4	-179	0	0	0	0	112.1	N786 V791 L792 W793	N786-S789 WeakPolarHBondContact O-CB 3.46Å; N786-S789 PolarHBondContact O-N 2.97Å; S789-V791 PolarHBondContact O-N 2.93Å; S789-V791 VanDerWaalsContact O-N 3.14Å; S789-L792 PolarHBondContact O-N 3.1Å; S789-L792 VanDerWaalsContact O-N 3.14Å; S789-W793 PolarHBondContact O-N 2.79Å
790	L	87.1	Confident	87.2	Confident	14 Å²	14	41.7 Å²	41.7	7%	0.073	21%	0.21	C	C	.	.	H	α-helix	trans	-57.4	-28.9	178.8	-63.8	179.7	0	0	0	113.1	S788 W793 R794 A816 A829 L830	S788-L790 PolarHBondContact O-N 2.88Å; S788-L790 VanDerWaalsContact O-N 3.12Å; L790-W793 PolarHBondContact O-N 3.28Å; L790-R794 WeakPolarHBondContact O-CB 3.47Å; L790-R794 PolarHBondContact O-N 3.38Å; L790-A816 VanDerWaalsContact CD2-O 3.3Å; L790-A816 WeakPolarHBondContact CD2-O 3.49Å; L790-A829 HydrophobicContact CB-CB 3.93Å; L790-A829 HydrophobicContact CD1-CB 4.27Å; L790-L830 HydrophobicContact CD1-CB 4.04Å; L790-L830 HydrophobicContact CD1-CD1 4.47Å
791	V	85.8	Confident	87.2	Confident	53 Å²	53	41.4 Å²	41.4	32%	0.321	21%	0.208	S	C	.	.	H	α-helix	trans	-66.6	-42.8	178.8	-172.4	0	0	0	0	111.1	L744 S789 R794 E795 A829	L744-V791 HydrophobicContact CD1-CG1 3.81Å; L744-V791 HydrophobicContact CD2-CG1 3.86Å; L744-V791 HydrophobicContact CG-CG1 4.47Å; S789-V791 PolarHBondContact O-N 2.93Å; S789-V791 VanDerWaalsContact O-N 3.14Å; V791-R794 WeakPolarHBondContact O-CB 3.38Å; V791-R794 PolarHBondContact O-N 3.16Å; V791-E795 PolarHBondContact O-N 3.41Å; V791-A829 HydrophobicContact CG2-CB 4.09Å
792	L	87.4	Confident	87	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-70.1	-38.8	176.7	-67.6	176.1	0	0	0	112	L744 M747 L781 N786 S789 R794 E795 Y796	L744-L792 HydrophobicContact CB-CD2 4.12Å; L744-L792 HydrophobicContact CD1-CD2 4.15Å; M747-L792 HydrophobicContact CB-CD2 4.25Å; L781-L792 HydrophobicContact CD2-CB 3.67Å; N786-L792 HydrophobicContact CB-CD1 3.59Å; N786-L792 VanDerWaalsContact OD1-CD1 3.27Å; N786-L792 WeakPolarHBondContact OD1-CD1 3.22Å; S789-L792 PolarHBondContact O-N 3.1Å; S789-L792 VanDerWaalsContact O-N 3.14Å; L792-R794 VanDerWaalsContact C-N 3.34Å; L792-R794 PolarHBondContact O-N 2.98Å; L792-E795 PolarHBondContact O-N 3.1Å; L792-Y796 WeakPolarHBondContact O-CB 3.5Å; L792-Y796 PolarHBondContact O-N 3.15Å
793	W	90.6	Very high	86.9	Confident	47 Å²	47	35.7 Å²	35.7	18%	0.178	19%	0.185	C	C	.	.	H	α-helix	trans	-62.5	-40.1	174.8	-78.4	99	0	0	0	112.2	L781 R787 S789 L790 Y796 A797 V812 T815 A816 M819	L781-W793 HydrophobicContact CD1-CD2 4.31Å; L781-W793 HydrophobicContact CD1-CE3 4.32Å; L781-W793 HydrophobicContact CD1-CZ3 4.48Å; L781-W793 HydrophobicContact CD2-CD2 4.11Å; L781-W793 HydrophobicContact CD2-CG 4.05Å; R787-W793 PolarHBondContact O-NE1 2.93Å; S789-W793 PolarHBondContact O-N 2.79Å; L790-W793 PolarHBondContact O-N 3.28Å; W793-Y796 PolarHBondContact O-N 3.03Å; W793-A797 VanDerWaalsContact O-CB 3.32Å; W793-A797 WeakPolarHBondContact O-CB 3.37Å; W793-A797 PolarHBondContact O-N 3.18Å; W793-V812 HydrophobicContact CE3-CG1 3.73Å; W793-V812 HydrophobicContact CZ3-CG1 4.06Å; W793-T815 HydrophobicContact CZ3-CG2 4.46Å; W793-A816 HydrophobicContact CB-CB 3.72Å; W793-A816 HydrophobicContact CG-CB 4.21Å; W793-M819 HydrophobicContact CZ2-CE 4.45Å; W793-M819 HydrophobicContact CZ2-SD 4.14Å
794	R	89.4	Confident	86.9	Confident	48 Å²	48	36.1 Å²	36.1	18%	0.181	20%	0.2	C	C	.	.	H	α-helix	trans	-56.6	-50.5	172.9	175.6	-165.7	-177.4	-175	13.1	111.2	L790 V791 L792 A797 H798 E832 L833 L836	L790-R794 WeakPolarHBondContact O-CB 3.47Å; L790-R794 PolarHBondContact O-N 3.38Å; V791-R794 WeakPolarHBondContact O-CB 3.38Å; V791-R794 PolarHBondContact O-N 3.16Å; L792-R794 VanDerWaalsContact C-N 3.34Å; L792-R794 PolarHBondContact O-N 2.98Å; R794-A797 PolarHBondContact O-N 3.17Å; R794-H798 WeakPolarHBondContact O-CB 3.43Å; R794-H798 PolarHBondContact O-N 3.47Å; R794-E832 IonicContact CZ-OE2 3.67Å; R794-E832 PolarHBondContact NE-O 2.85Å; R794-E832 IonicContact NH1-OE2 2.7Å; R794-E832 PolarHBondContact NH1-OE2 3.45Å; R794-E832 PolarHBondContact NH2-O 3.06Å; R794-E832 IonicContact NH2-OE2 2.85Å; R794-E832 PolarHBondContact NH2-OE2 3.15Å; R794-L833 HydrophobicContact CB-CB 4.32Å; R794-L833 HydrophobicContact CB-CD1 4.1Å; R794-L833 HydrophobicContact CB-CG 4.21Å; R794-L836 HydrophobicContact CG-CD2 3.6Å
795	E	88.3	Confident	87.3	Confident	15 Å²	15	34.3 Å²	34.3	7%	0.07	19%	0.186	C	C	.	.	H	α-helix	trans	-68.2	-37.7	-177.7	-68.4	-50.6	133.4	0	0	112.6	L744 M747 L748 K751 V791 L792 H798 L799	L744-E795 HydrophobicContact CD1-CG 3.93Å; M747-E795 HydrophobicContact CG-CB 3.62Å; L748-E795 HydrophobicContact CD2-CG 3.95Å; K751-E795 IonicContact NZ-OE2 3.86Å; K751-E795 PolarHBondContact NZ-OE2 3.33Å; V791-E795 PolarHBondContact O-N 3.41Å; L792-E795 PolarHBondContact O-N 3.1Å; E795-H798 PolarHBondContact O-N 2.95Å; E795-L799 WeakPolarHBondContact O-CB 3.3Å; E795-L799 PolarHBondContact O-N 3.44Å
796	Y	91.8	Very high	87.8	Confident	15 Å²	15	33.2 Å²	33.2	6%	0.059	18%	0.179	C	C	.	.	H	α-helix	trans	-66.3	-42.1	174.4	177.7	-115.8	0	0	0	112.7	A777 K778 L781 L792 W793 H798 L799 E800 V812	A777-Y796 HydrophobicContact CB-CD2 3.44Å; A777-Y796 VanDerWaalsContact CB-CD2 3.44Å; A777-Y796 HydrophobicContact CB-CE2 3.9Å; A777-Y796 HydrophobicContact CB-CG 4.39Å; K778-Y796 WeakPolarHBondContact CE-OH 3.43Å; K778-Y796 HydrophobicContact CG-CE2 4.28Å; L781-Y796 HydrophobicContact CD1-CD1 3.65Å; L781-Y796 HydrophobicContact CD1-CE1 4.39Å; L781-Y796 HydrophobicContact CD1-CG 3.75Å; L792-Y796 WeakPolarHBondContact O-CB 3.5Å; L792-Y796 PolarHBondContact O-N 3.15Å; W793-Y796 PolarHBondContact O-N 3.03Å; Y796-H798 VanDerWaalsContact C-N 3.29Å; Y796-H798 PolarHBondContact O-N 3.46Å; Y796-L799 HydrophobicContact CD2-CD2 4.4Å; Y796-L799 WeakPolarHBondContact O-CB 3.38Å; Y796-L799 PolarHBondContact O-N 3.01Å; Y796-E800 HydrophobicContact CE1-CG 4.42Å; Y796-E800 HydrophobicContact CE2-CG 4.24Å; Y796-E800 PolarHBondContact O-N 3.23Å; Y796-E800 PolarHBondContact OH-OE1 3.5Å; Y796-V812 HydrophobicContact CD1-CG1 3.63Å; Y796-V812 HydrophobicContact CD1-CG2 4.15Å; Y796-V812 HydrophobicContact CE1-CG1 4.07Å; Y796-V812 HydrophobicContact CE1-CG2 3.73Å
797	A	91.4	Very high	88	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.1	-40.9	174.7	0	0	0	0	0	111.3	W793 R794 E800 W801 V812 F813	W793-A797 VanDerWaalsContact O-CB 3.32Å; W793-A797 WeakPolarHBondContact O-CB 3.37Å; W793-A797 PolarHBondContact O-N 3.18Å; R794-A797 PolarHBondContact O-N 3.17Å; A797-E800 PolarHBondContact O-N 3.44Å; A797-W801 PolarHBondContact O-N 3.3Å; A797-V812 HydrophobicContact CB-CB 4.11Å; A797-V812 HydrophobicContact CB-CG1 3.66Å; A797-F813 HydrophobicContact CB-CD1 3.61Å; A797-F813 HydrophobicContact CB-CD2 3.8Å; A797-F813 HydrophobicContact CB-CE1 3.41Å; A797-F813 VanDerWaalsContact CB-CE1 3.41Å; A797-F813 HydrophobicContact CB-CE2 3.6Å; A797-F813 HydrophobicContact CB-CG 3.79Å; A797-F813 HydrophobicContact CB-CZ 3.4Å; A797-F813 VanDerWaalsContact CB-CZ 3.4Å
798	H	87.9	Confident	88.3	Confident	7 Å²	7	35.3 Å²	35.3	3%	0.032	20%	0.199	C	C	.	.	H	α-helix	trans	-67.3	-38.5	175.3	-167.6	-178.9	0	0	0	112.2	F690 K751 R794 E795 Y796 E800 W801 V802 L836	F690-H798 AromaticContact CD2-CE1 3.96Å; K751-H798 WeakPolarHBondContact CE-ND1 3.48Å; K751-H798 PolarHBondContact NZ-CE1 2.95Å; K751-H798 PolarHBondContact NZ-ND1 2.77Å; R794-H798 WeakPolarHBondContact O-CB 3.43Å; R794-H798 PolarHBondContact O-N 3.47Å; E795-H798 PolarHBondContact O-N 2.95Å; Y796-H798 VanDerWaalsContact C-N 3.29Å; Y796-H798 PolarHBondContact O-N 3.46Å; H798-E800 VanDerWaalsContact C-N 3.33Å; H798-E800 PolarHBondContact O-N 3.16Å; H798-W801 WeakPolarHBondContact O-CB 3.38Å; H798-W801 PolarHBondContact O-N 2.98Å; H798-V802 WeakPolarHBondContact O-CB 3.28Å; H798-V802 VanDerWaalsContact O-CG2 3.28Å; H798-V802 WeakPolarHBondContact O-CG2 3.3Å; H798-V802 PolarHBondContact O-N 3.37Å; H798-L836 HydrophobicContact CB-CD2 3.91Å
799	L	89.4	Confident	88.7	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-57.3	-46.1	173.4	-179.7	66.8	0	0	0	111.5	K751 V754 A777 E795 Y796 W801 V802 L803	K751-L799 HydrophobicContact CB-CD1 4.25Å; K751-L799 HydrophobicContact CG-CD1 4.38Å; V754-L799 HydrophobicContact CB-CD1 4.08Å; V754-L799 HydrophobicContact CG1-CD1 4.36Å; V754-L799 HydrophobicContact CG2-CD1 3.8Å; A777-L799 HydrophobicContact CB-CD2 4.24Å; E795-L799 WeakPolarHBondContact O-CB 3.3Å; E795-L799 PolarHBondContact O-N 3.44Å; Y796-L799 HydrophobicContact CD2-CD2 4.4Å; Y796-L799 WeakPolarHBondContact O-CB 3.38Å; Y796-L799 PolarHBondContact O-N 3.01Å; L799-W801 VanDerWaalsContact C-N 3.32Å; L799-W801 PolarHBondContact O-N 3.33Å; L799-V802 PolarHBondContact O-N 3.08Å; L799-L803 HydrophobicContact CG-CD1 4.31Å; L799-L803 WeakPolarHBondContact O-CG 3.42Å; L799-L803 PolarHBondContact O-N 2.88Å; L799-L803 VanDerWaalsContact O-N 3.09Å
800	E	90.8	Very high	88.9	Confident	6 Å²	6	33.1 Å²	33.1	3%	0.028	17%	0.172	C	C	.	.	H	α-helix	trans	-62	-40	176.4	-76.7	-67.5	177.5	0	0	112.5	K774 Y796 A797 H798 L803 G804 N805 A809	K774-E800 VanDerWaalsContact CD-OE1 3.25Å; K774-E800 WeakPolarHBondContact CD-OE1 3.4Å; K774-E800 VanDerWaalsContact CE-CD 3.44Å; K774-E800 WeakPolarHBondContact CE-OE1 3.48Å; K774-E800 WeakPolarHBondContact CE-OE2 3.47Å; K774-E800 IonicContact NZ-OE1 3.35Å; K774-E800 PolarHBondContact NZ-OE1 3.14Å; K774-E800 IonicContact NZ-OE2 3.87Å; K774-E800 PolarHBondContact NZ-OE2 2.83Å; Y796-E800 HydrophobicContact CE1-CG 4.42Å; Y796-E800 HydrophobicContact CE2-CG 4.24Å; Y796-E800 PolarHBondContact O-N 3.23Å; Y796-E800 PolarHBondContact OH-OE1 3.5Å; A797-E800 PolarHBondContact O-N 3.44Å; H798-E800 VanDerWaalsContact C-N 3.33Å; H798-E800 PolarHBondContact O-N 3.16Å; E800-L803 PolarHBondContact O-N 2.76Å; E800-G804 PolarHBondContact O-N 2.81Å; E800-N805 PolarHBondContact O-N 3.23Å; E800-N805 WeakPolarHBondContact OE2-CB 3.42Å; E800-N805 PolarHBondContact OE2-ND2 3.44Å; E800-A809 HydrophobicContact CB-CB 3.88Å
801	W	89.4	Confident	89.1	Confident	13 Å²	13	38.1 Å²	38.1	5%	0.049	19%	0.194	C	C	.	.	H	α-helix	trans	-63.8	-45	176	-168.2	-79.5	0	0	0	112.2	A797 H798 L799 L803 G804 L806 A809 R810 F813 L840 E841 N844	A797-W801 PolarHBondContact O-N 3.3Å; H798-W801 WeakPolarHBondContact O-CB 3.38Å; H798-W801 PolarHBondContact O-N 2.98Å; L799-W801 VanDerWaalsContact C-N 3.32Å; L799-W801 PolarHBondContact O-N 3.33Å; W801-L803 VanDerWaalsContact C-N 3.27Å; W801-L803 PolarHBondContact O-N 3.06Å; W801-G804 PolarHBondContact O-N 3.05Å; W801-L806 HydrophobicContact CD2-CD2 3.61Å; W801-L806 HydrophobicContact CE3-CD2 3.9Å; W801-L806 HydrophobicContact CG-CD2 4.13Å; W801-L806 HydrophobicContact CH2-CD2 4.14Å; W801-L806 HydrophobicContact CZ2-CD2 3.88Å; W801-L806 HydrophobicContact CZ3-CD2 4.15Å; W801-A809 HydrophobicContact CB-CB 4.03Å; W801-A809 HydrophobicContact CE3-CB 3.83Å; W801-R810 HydrophobicContact CZ3-CG 4.28Å; W801-F813 HydrophobicContact CE3-CE2 4.48Å; W801-L840 HydrophobicContact CB-CD1 4.37Å; W801-L840 HydrophobicContact CD2-CB 4.13Å; W801-L840 HydrophobicContact CD2-CD1 4.03Å; W801-L840 HydrophobicContact CD2-CD2 4.35Å; W801-L840 HydrophobicContact CD2-CG 4.4Å; W801-L840 HydrophobicContact CE3-CB 4.48Å; W801-L840 HydrophobicContact CE3-CD1 4.39Å; W801-L840 HydrophobicContact CG-CD1 4.01Å; W801-L840 HydrophobicContact CG-CD2 4.08Å; W801-L840 HydrophobicContact CH2-CB 4.12Å; W801-L840 HydrophobicContact CZ2-CB 3.7Å; W801-L840 WeakPolarHBondContact CZ2-O 3.25Å; W801-L840 HydrophobicContact CZ3-CB 4.49Å; W801-E841 HydrophobicContact CH2-CG 4.35Å; W801-N844 HydrophobicContact CH2-CB 4.38Å; W801-N844 HydrophobicContact CZ2-CB 3.87Å
802	V	85.6	Confident	89.4	Confident	5 Å²	5	36.3 Å²	36.3	3%	0.03	18%	0.183	C	C	.	.	H	α-helix	trans	-63.3	-34.2	179.5	167.6	0	0	0	0	111.6	V754 L755 L758 H798 L799 G804	V754-V802 HydrophobicContact CG1-CG1 3.86Å; L755-V802 HydrophobicContact CD2-CG1 3.74Å; L755-V802 HydrophobicContact CD2-CG2 4.36Å; L755-V802 HydrophobicContact CG-CG1 4.44Å; L758-V802 HydrophobicContact CD1-CG1 3.2Å; H798-V802 WeakPolarHBondContact O-CB 3.28Å; H798-V802 VanDerWaalsContact O-CG2 3.28Å; H798-V802 WeakPolarHBondContact O-CG2 3.3Å; H798-V802 PolarHBondContact O-N 3.37Å; L799-V802 PolarHBondContact O-N 3.08Å; V802-G804 PolarHBondContact O-N 3.42Å
803	L	87.4	Confident	89.6	Confident	36 Å²	36	36.3 Å²	36.3	19%	0.188	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-7.8	174.2	-69.9	170.6	0	0	0	113.9	V754 L766 K774 L799 E800 W801	V754-L803 HydrophobicContact CG1-CD2 3.52Å; V754-L803 HydrophobicContact CG1-CG 4.03Å; V754-L803 HydrophobicContact CG2-CD2 4.28Å; L766-L803 HydrophobicContact CD1-CD2 4.04Å; K774-L803 HydrophobicContact CD-CD1 4.28Å; K774-L803 HydrophobicContact CG-CD1 4.17Å; L799-L803 HydrophobicContact CG-CD1 4.31Å; L799-L803 WeakPolarHBondContact O-CG 3.42Å; L799-L803 PolarHBondContact O-N 2.88Å; L799-L803 VanDerWaalsContact O-N 3.09Å; E800-L803 PolarHBondContact O-N 2.76Å; W801-L803 VanDerWaalsContact C-N 3.27Å; W801-L803 PolarHBondContact O-N 3.06Å
804	G	85.9	Confident	89.5	Confident	52 Å²	52	36.1 Å²	36.1	54%	0.536	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.1	9.1	178.7	0	0	0	0	0	115.2	E800 W801 V802 L806	E800-G804 PolarHBondContact O-N 2.81Å; W801-G804 PolarHBondContact O-N 3.05Å; V802-G804 PolarHBondContact O-N 3.42Å; G804-L806 VanDerWaalsContact C-N 3.33Å; G804-L806 PolarHBondContact O-N 3.15Å; G804-L806 VanDerWaalsContact O-N 3.16Å
805	N	89	Confident	89.5	Confident	62 Å²	62	37 Å²	37	33%	0.332	20%	0.199	S	C	.	.			trans	-90.2	67.7	178.6	-50.2	-54.7	0	0	0	110.4	K774 E800 D807 E808 A809	K774-N805 PolarHBondContact NZ-ND2 3.26Å; E800-N805 PolarHBondContact O-N 3.23Å; E800-N805 WeakPolarHBondContact OE2-CB 3.42Å; E800-N805 PolarHBondContact OE2-ND2 3.44Å; N805-D807 PolarHBondContact O-N 2.85Å; N805-E808 HydrophobicContact CB-CB 4.2Å; N805-E808 PolarHBondContact O-N 3.48Å; N805-A809 WeakPolarHBondContact O-CB 3.46Å; N805-A809 PolarHBondContact O-N 2.93Å
806	L	88.9	Confident	89.5	Confident	47 Å²	47	36.3 Å²	36.3	25%	0.246	20%	0.196	C	C	.	.	H	α-helix	trans	-58.3	-43.1	-170.1	-58.9	-179.1	0	0	0	113.3	W801 G804 A809 R810	W801-L806 HydrophobicContact CD2-CD2 3.61Å; W801-L806 HydrophobicContact CE3-CD2 3.9Å; W801-L806 HydrophobicContact CG-CD2 4.13Å; W801-L806 HydrophobicContact CH2-CD2 4.14Å; W801-L806 HydrophobicContact CZ2-CD2 3.88Å; W801-L806 HydrophobicContact CZ3-CD2 4.15Å; G804-L806 VanDerWaalsContact C-N 3.33Å; G804-L806 PolarHBondContact O-N 3.15Å; G804-L806 VanDerWaalsContact O-N 3.16Å; L806-A809 PolarHBondContact O-N 3.31Å; L806-R810 WeakPolarHBondContact O-CG 3.32Å; L806-R810 PolarHBondContact O-N 3.5Å
807	D	88.5	Confident	89.3	Confident	107 Å²	107	37.2 Å²	37.2	57%	0.572	20%	0.203	S	C	*	.	H	α-helix	trans	-68.5	-38.5	-177.6	-61.6	-35.9	0	0	0	112.4	N805 R810 K811	N805-D807 PolarHBondContact O-N 2.85Å; D807-R810 PolarHBondContact O-N 3.38Å; D807-R810 IonicContact OD1-NH1 3.77Å; D807-R810 PolarHBondContact OD1-NH1 3.47Å; D807-K811 WeakPolarHBondContact O-CG 3.3Å; D807-K811 PolarHBondContact O-N 3.25Å
808	E	90.2	Very high	89	Confident	91 Å²	91	39.8 Å²	39.8	43%	0.425	22%	0.224	S	C	.	.	H	α-helix	trans	-67.5	-42.4	173.8	-66.2	-55.8	127.1	0	0	111	N805 R810 K811 V812	N805-E808 HydrophobicContact CB-CB 4.2Å; N805-E808 PolarHBondContact O-N 3.48Å; E808-R810 VanDerWaalsContact C-N 3.33Å; E808-R810 PolarHBondContact O-N 3.05Å; E808-K811 WeakPolarHBondContact O-CB 3.49Å; E808-K811 PolarHBondContact O-N 3.31Å; E808-K811 IonicContact OE1-NZ 3.71Å; E808-K811 PolarHBondContact OE1-NZ 2.88Å; E808-V812 VanDerWaalsContact O-CG2 3.28Å; E808-V812 WeakPolarHBondContact O-CG2 3.41Å; E808-V812 PolarHBondContact O-N 2.98Å
809	A	91.4	Very high	88.8	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-58.2	-44.4	174.9	0	0	0	0	0	111.8	E800 W801 N805 L806 K811 V812 F813	E800-A809 HydrophobicContact CB-CB 3.88Å; W801-A809 HydrophobicContact CB-CB 4.03Å; W801-A809 HydrophobicContact CE3-CB 3.83Å; N805-A809 WeakPolarHBondContact O-CB 3.46Å; N805-A809 PolarHBondContact O-N 2.93Å; L806-A809 PolarHBondContact O-N 3.31Å; A809-K811 PolarHBondContact O-N 3.42Å; A809-V812 PolarHBondContact O-N 3.09Å; A809-F813 WeakPolarHBondContact O-CD2 3.26Å; A809-F813 PolarHBondContact O-N 3.41Å
810	R	91.2	Very high	88	Confident	76 Å²	76	43.4 Å²	43.4	29%	0.287	24%	0.243	S	C	.	.	H	α-helix	trans	-61.6	-40.6	175.1	-72.9	173.3	-178.4	139.5	-2.4	112.7	W801 L806 D807 E808 F813 S814 E841	W801-R810 HydrophobicContact CZ3-CG 4.28Å; L806-R810 WeakPolarHBondContact O-CG 3.32Å; L806-R810 PolarHBondContact O-N 3.5Å; D807-R810 PolarHBondContact O-N 3.38Å; D807-R810 IonicContact OD1-NH1 3.77Å; D807-R810 PolarHBondContact OD1-NH1 3.47Å; E808-R810 VanDerWaalsContact C-N 3.33Å; E808-R810 PolarHBondContact O-N 3.05Å; R810-F813 PolarHBondContact O-N 2.96Å; R810-S814 WeakPolarHBondContact O-CB 3.44Å; R810-S814 PolarHBondContact O-N 3.36Å; R810-E841 IonicContact CZ-OE1 2.62Å; R810-E841 IonicContact CZ-OE2 2.75Å; R810-E841 IonicContact NE-OE1 3.17Å; R810-E841 PolarHBondContact NE-OE1 3.36Å; R810-E841 IonicContact NE-OE2 3.94Å; R810-E841 IonicContact NH2-OE1 3.43Å; R810-E841 IonicContact NH2-OE2 2.68Å; R810-E841 PolarHBondContact NH2-OE2 2.92Å
811	K	91.4	Very high	86.9	Confident	119 Å²	119	44.3 Å²	44.3	52%	0.517	25%	0.254	S	S	.	.	H	α-helix	trans	-62.3	-43.5	174.2	-71	170.9	-170.2	171.9	0	111.5	D807 E808 A809 S814 T815	D807-K811 WeakPolarHBondContact O-CG 3.3Å; D807-K811 PolarHBondContact O-N 3.25Å; E808-K811 WeakPolarHBondContact O-CB 3.49Å; E808-K811 PolarHBondContact O-N 3.31Å; E808-K811 IonicContact OE1-NZ 3.71Å; E808-K811 PolarHBondContact OE1-NZ 2.88Å; A809-K811 PolarHBondContact O-N 3.42Å; K811-S814 PolarHBondContact O-N 2.9Å; K811-T815 WeakPolarHBondContact O-CB 3.2Å; K811-T815 PolarHBondContact O-N 3.1Å; K811-T815 PolarHBondContact O-OG1 3.17Å
812	V	91.4	Very high	85.6	Confident	15 Å²	15	49.8 Å²	49.8	9%	0.091	29%	0.289	C	S	.	.	H	α-helix	trans	-63.3	-46.6	177.3	177.5	0	0	0	0	110.3	W793 Y796 A797 E808 A809 S814 T815 A816	W793-V812 HydrophobicContact CE3-CG1 3.73Å; W793-V812 HydrophobicContact CZ3-CG1 4.06Å; Y796-V812 HydrophobicContact CD1-CG1 3.63Å; Y796-V812 HydrophobicContact CD1-CG2 4.15Å; Y796-V812 HydrophobicContact CE1-CG1 4.07Å; Y796-V812 HydrophobicContact CE1-CG2 3.73Å; A797-V812 HydrophobicContact CB-CB 4.11Å; A797-V812 HydrophobicContact CB-CG1 3.66Å; E808-V812 VanDerWaalsContact O-CG2 3.28Å; E808-V812 WeakPolarHBondContact O-CG2 3.41Å; E808-V812 PolarHBondContact O-N 2.98Å; A809-V812 PolarHBondContact O-N 3.09Å; V812-S814 PolarHBondContact O-N 3.17Å; V812-T815 PolarHBondContact O-N 3.47Å; V812-A816 WeakPolarHBondContact O-CB 3.46Å; V812-A816 PolarHBondContact O-N 2.87Å
813	F	90.8	Very high	85	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-58.9	-47.5	174.7	-79	-60.4	0	0	0	112	A797 W801 A809 R810 T815 A816 T817 L833 W837 L840	A797-F813 HydrophobicContact CB-CD1 3.61Å; A797-F813 HydrophobicContact CB-CD2 3.8Å; A797-F813 HydrophobicContact CB-CE1 3.41Å; A797-F813 VanDerWaalsContact CB-CE1 3.41Å; A797-F813 HydrophobicContact CB-CE2 3.6Å; A797-F813 HydrophobicContact CB-CG 3.79Å; A797-F813 HydrophobicContact CB-CZ 3.4Å; A797-F813 VanDerWaalsContact CB-CZ 3.4Å; W801-F813 HydrophobicContact CE3-CE2 4.48Å; A809-F813 WeakPolarHBondContact O-CD2 3.26Å; A809-F813 PolarHBondContact O-N 3.41Å; R810-F813 PolarHBondContact O-N 2.96Å; F813-T815 VanDerWaalsContact C-N 3.28Å; F813-T815 PolarHBondContact O-N 3.08Å; F813-A816 PolarHBondContact O-N 3.41Å; F813-T817 WeakPolarHBondContact O-CG2 3.48Å; F813-T817 PolarHBondContact O-N 3.03Å; F813-T817 PolarHBondContact O-OG1 3.16Å; F813-T817 VanDerWaalsContact O-OG1 3.13Å; F813-L833 HydrophobicContact CD1-CD2 3.97Å; F813-L833 HydrophobicContact CD1-CG 4.21Å; F813-L833 HydrophobicContact CE1-CG 4.45Å; F813-W837 HydrophobicContact CB-CD2 3.65Å; F813-W837 HydrophobicContact CB-CE3 3.78Å; F813-W837 HydrophobicContact CB-CG 4.06Å; F813-W837 HydrophobicContact CB-CH2 4.37Å; F813-W837 HydrophobicContact CB-CZ2 4.27Å; F813-W837 HydrophobicContact CB-CZ3 4.14Å; F813-W837 HydrophobicContact CD1-CB 3.89Å; F813-W837 HydrophobicContact CD1-CD2 4.46Å; F813-W837 HydrophobicContact CD1-CG 4.11Å; F813-W837 HydrophobicContact CD2-CB 4.31Å; F813-W837 AromaticContact CD2-CD1 3.73Å; F813-W837 HydrophobicContact CD2-CD2 4.31Å; F813-W837 AromaticContact CD2-CG 3.88Å; F813-W837 HydrophobicContact CD2-CG 3.88Å; F813-W837 HydrophobicContact CE1-CB 3.99Å; F813-W837 HydrophobicContact CE2-CB 4.42Å; F813-W837 HydrophobicContact CE2-CG 4.34Å; F813-W837 HydrophobicContact CG-CB 4.07Å; F813-W837 AromaticContact CG-CD2 3.93Å; F813-W837 HydrophobicContact CG-CD2 3.93Å; F813-W837 HydrophobicContact CG-CE3 4.37Å; F813-W837 AromaticContact CG-CG 3.77Å; F813-W837 HydrophobicContact CG-CG 3.77Å; F813-W837 HydrophobicContact CZ-CB 4.27Å; F813-L840 HydrophobicContact CE2-CD1 3.94Å; F813-L840 HydrophobicContact CZ-CD1 3.82Å
814	S	88.5	Confident	84.5	Confident	43 Å²	43	56.4 Å²	56.4	30%	0.301	31%	0.313	S	S	.	.	H	α-helix	trans	-59.6	-39.8	177.8	-173.7	0	0	0	0	112.2	R810 K811 V812 T817 A818	R810-S814 WeakPolarHBondContact O-CB 3.44Å; R810-S814 PolarHBondContact O-N 3.36Å; K811-S814 PolarHBondContact O-N 2.9Å; V812-S814 PolarHBondContact O-N 3.17Å; S814-T817 WeakPolarHBondContact CA-OG1 3.32Å; S814-T817 PolarHBondContact O-OG1 2.94Å; S814-A818 WeakPolarHBondContact O-CB 3.42Å; S814-A818 PolarHBondContact O-N 3.06Å
815	T	89.8	Confident	84.2	Confident	67 Å²	67	54.4 Å²	54.4	41%	0.411	29%	0.29	S	S	.	.	H	α-helix	trans	-65.2	-47.1	177.3	-55.4	0	0	0	0	110.3	W793 K811 V812 F813 T817 A818 M819	W793-T815 HydrophobicContact CZ3-CG2 4.46Å; K811-T815 WeakPolarHBondContact O-CB 3.2Å; K811-T815 PolarHBondContact O-N 3.1Å; K811-T815 PolarHBondContact O-OG1 3.17Å; V812-T815 PolarHBondContact O-N 3.47Å; F813-T815 VanDerWaalsContact C-N 3.28Å; F813-T815 PolarHBondContact O-N 3.08Å; T815-T817 PolarHBondContact O-N 3.42Å; T815-A818 PolarHBondContact O-N 3.21Å; T815-M819 HydrophobicContact CG2-SD 4.21Å; T815-M819 VanDerWaalsContact O-CG 3.29Å; T815-M819 WeakPolarHBondContact O-CG 3.36Å; T815-M819 PolarHBondContact O-N 3.44Å
816	A	89.6	Confident	83.5	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-64.2	-40.1	178.8	0	0	0	0	0	112.6	L790 W793 V812 F813 M819 G820 L833	L790-A816 VanDerWaalsContact CD2-O 3.3Å; L790-A816 WeakPolarHBondContact CD2-O 3.49Å; W793-A816 HydrophobicContact CB-CB 3.72Å; W793-A816 HydrophobicContact CG-CB 4.21Å; V812-A816 WeakPolarHBondContact O-CB 3.46Å; V812-A816 PolarHBondContact O-N 2.87Å; F813-A816 PolarHBondContact O-N 3.41Å; A816-M819 PolarHBondContact O-N 2.9Å; A816-G820 PolarHBondContact O-N 3.45Å; A816-L833 HydrophobicContact CB-CD1 3.55Å
817	T	86.7	Confident	83.2	Confident	34 Å²	34	51.7 Å²	51.7	21%	0.209	29%	0.286	C	S	.	.	H	α-helix	trans	-66.1	-37.6	174.7	52	0	0	0	0	112.3	F813 S814 T815 M819 G820 G821 L830 L833 W837	F813-T817 WeakPolarHBondContact O-CG2 3.48Å; F813-T817 PolarHBondContact O-N 3.03Å; F813-T817 PolarHBondContact O-OG1 3.16Å; F813-T817 VanDerWaalsContact O-OG1 3.13Å; S814-T817 WeakPolarHBondContact CA-OG1 3.32Å; S814-T817 PolarHBondContact O-OG1 2.94Å; T815-T817 PolarHBondContact O-N 3.42Å; T817-M819 VanDerWaalsContact C-N 3.31Å; T817-M819 PolarHBondContact O-N 2.83Å; T817-G820 PolarHBondContact O-N 3.26Å; T817-G821 PolarHBondContact O-N 3.24Å; T817-L830 HydrophobicContact CG2-CD1 4.31Å; T817-L833 HydrophobicContact CG2-CD2 3.56Å; T817-W837 HydrophobicContact CG2-CE3 4.16Å; T817-W837 HydrophobicContact CG2-CZ3 3.98Å
818	A	84.9	Confident	82.9	Confident	54 Å²	54	47.9 Å²	47.9	45%	0.446	27%	0.268	S	S	.	.	H	α-helix	trans	-65.6	-36.4	176.1	0	0	0	0	0	111.5	S814 T815 G821	S814-A818 WeakPolarHBondContact O-CB 3.42Å; S814-A818 PolarHBondContact O-N 3.06Å; T815-A818 PolarHBondContact O-N 3.21Å; A818-G821 PolarHBondContact O-N 2.91Å
819	M	83.4	Confident	82.5	Confident	82 Å²	82	44.9 Å²	44.9	40%	0.404	26%	0.258	S	S	.	.	H	α-helix	trans	-69.1	-34.5	173	-67.3	166.2	55	0	0	113.1	R787 W793 T815 A816 T817 G821	R787-M819 WeakPolarHBondContact O-CE 3.25Å; W793-M819 HydrophobicContact CZ2-CE 4.45Å; W793-M819 HydrophobicContact CZ2-SD 4.14Å; T815-M819 HydrophobicContact CG2-SD 4.21Å; T815-M819 VanDerWaalsContact O-CG 3.29Å; T815-M819 WeakPolarHBondContact O-CG 3.36Å; T815-M819 PolarHBondContact O-N 3.44Å; A816-M819 PolarHBondContact O-N 2.9Å; T817-M819 VanDerWaalsContact C-N 3.31Å; T817-M819 PolarHBondContact O-N 2.83Å; M819-G821 VanDerWaalsContact C-N 3.25Å; M819-G821 PolarHBondContact O-N 3.26Å
820	G	72.8	Confident	82.2	Confident	2 Å²	2	45.1 Å²	45.1	2%	0.021	26%	0.259	C	S	.	.	H	α-helix	trans	-67.5	-23.2	175.4	0	0	0	0	0	114	A816 T817 R823	A816-G820 PolarHBondContact O-N 3.45Å; T817-G820 PolarHBondContact O-N 3.26Å; G820-R823 WeakPolarHBondContact O-CB 3.39Å; G820-R823 WeakPolarHBondContact O-CG 3.41Å
821	G	68.3	Low	82	Confident	26 Å²	26	41.5 Å²	41.5	27%	0.268	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	56.6	-158.3	164.9	0	0	0	0	0	116.4	T817 A818 M819 R823	T817-G821 PolarHBondContact O-N 3.24Å; A818-G821 PolarHBondContact O-N 2.91Å; M819-G821 VanDerWaalsContact C-N 3.25Å; M819-G821 PolarHBondContact O-N 3.26Å; G821-R823 PolarHBondContact O-N 2.88Å
822	T	62.8	Low	81.6	Confident	128 Å²	128	36.9 Å²	36.9	79%	0.785	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-60.9	2.6	-177.5	52.9	0	0	0	0	115.2	G824	T822-G824 PolarHBondContact O-N 3.28Å
823	R	71.3	Confident	81.5	Confident	172 Å²	172	36.1 Å²	36.1	65%	0.649	22%	0.222	S	C	*	.	G	3₁₀ helix	trans	-63.2	-24.1	176	-60.8	-178.7	179.5	-174.8	-1	111.9	G820 G821 L825 G826	G820-R823 WeakPolarHBondContact O-CB 3.39Å; G820-R823 WeakPolarHBondContact O-CG 3.41Å; G821-R823 PolarHBondContact O-N 2.88Å; R823-L825 PolarHBondContact O-N 3.44Å; R823-G826 WeakPolarHBondContact O-CA 3.3Å; R823-G826 PolarHBondContact O-N 3.4Å
824	G	77.3	Confident	81.4	Confident	8 Å²	8	36.3 Å²	36.3	8%	0.082	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	49.3	-133.4	172.4	0	0	0	0	0	112.7	T822 G826	T822-G824 PolarHBondContact O-N 3.28Å; G824-G826 PolarHBondContact O-N 3.48Å
825	L	80.5	Confident	81.3	Confident	9 Å²	9	35 Å²	35	5%	0.047	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-70.1	-6.3	177.4	-60.6	175.4	0	0	0	114.7	R823 L867 A868 Y892 V895 L931	R823-L825 PolarHBondContact O-N 3.44Å; L825-L867 HydrophobicContact CD2-CD2 3.98Å; L825-L867 HydrophobicContact CD2-CG 3.78Å; L825-A868 HydrophobicContact CD1-CB 4.23Å; L825-Y892 HydrophobicContact CD1-CD1 3.88Å; L825-Y892 HydrophobicContact CD1-CE1 4.17Å; L825-Y892 HydrophobicContact CD1-CG 4.23Å; L825-Y892 HydrophobicContact CD2-CD1 3.69Å; L825-Y892 HydrophobicContact CD2-CE1 3.16Å; L825-Y892 HydrophobicContact CG-CD1 4.47Å; L825-Y892 HydrophobicContact CG-CE1 4.32Å; L825-V895 HydrophobicContact CB-CB 4.39Å; L825-V895 HydrophobicContact CB-CG1 3.99Å; L825-V895 HydrophobicContact CB-CG2 4.23Å; L825-V895 HydrophobicContact CD1-CB 4.24Å; L825-V895 HydrophobicContact CD1-CG2 3.99Å; L825-L931 HydrophobicContact CB-CD1 4.15Å; L825-L931 HydrophobicContact CD2-CD1 3.94Å; L825-L931 HydrophobicContact CG-CD1 4.45Å
826	G	74.1	Confident	81.2	Confident	39 Å²	39	32.2 Å²	32.2	40%	0.402	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-79.1	-16.8	179.6	0	0	0	0	0	114.3	R823 G824	R823-G826 WeakPolarHBondContact O-CA 3.3Å; R823-G826 PolarHBondContact O-N 3.4Å; G824-G826 PolarHBondContact O-N 3.48Å
827	S	83.1	Confident	81.2	Confident	13 Å²	13	33.4 Å²	33.4	9%	0.091	20%	0.199	C	C	.	.			trans	-102.2	120.4	-177.7	-178.7	0	0	0	0	112.6	A829 L830 C831	S827-A829 PolarHBondContact O-N 2.92Å; S827-L830 PolarHBondContact O-N 3.19Å; S827-C831 PolarHBondContact O-N 3.33Å; S827-C831 VanDerWaalsContact O-N 3.12Å; S827-C831 PolarHBondContact O-SG 2.91Å; S827-C831 VanDerWaalsContact O-SG 3.39Å
828	P	81.4	Confident	81.3	Confident	28 Å²	28	31.8 Å²	31.8	18%	0.182	19%	0.189	C	C	.	.	H	α-helix	trans	-58.6	-48.5	178.6	-19.8	28.2	0	0	0	112.7	L830 C831 E832 R927	P828-L830 VanDerWaalsContact C-N 3.31Å; P828-L830 PolarHBondContact O-N 2.94Å; P828-C831 PolarHBondContact O-N 3.43Å; P828-E832 PolarHBondContact O-N 3.02Å; P828-R927 HydrophobicContact CB-CB 4.28Å; P828-R927 HydrophobicContact CG-CB 3.79Å; P828-R927 HydrophobicContact CG-CG 4.02Å
829	A	81.4	Confident	81.4	Confident	27 Å²	27	31 Å²	31	22%	0.223	18%	0.177	C	C	.	.	H	α-helix	trans	-67.1	-32.2	-175.7	0	0	0	0	0	112.5	L790 V791 S827 L833	L790-A829 HydrophobicContact CB-CB 3.93Å; L790-A829 HydrophobicContact CD1-CB 4.27Å; V791-A829 HydrophobicContact CG2-CB 4.09Å; S827-A829 PolarHBondContact O-N 2.92Å; A829-L833 WeakPolarHBondContact O-CB 3.44Å; A829-L833 PolarHBondContact O-N 2.84Å; A829-L833 VanDerWaalsContact O-N 3.07Å
830	L	86.3	Confident	81.6	Confident	5 Å²	5	27.2 Å²	27.2	3%	0.026	16%	0.158	C	C	.	.	H	α-helix	trans	-71.5	-42.4	174.5	-174.3	59.5	0	0	0	111.5	L790 T817 S827 P828 L833 C834 L867	L790-L830 HydrophobicContact CD1-CB 4.04Å; L790-L830 HydrophobicContact CD1-CD1 4.47Å; T817-L830 HydrophobicContact CG2-CD1 4.31Å; S827-L830 PolarHBondContact O-N 3.19Å; P828-L830 VanDerWaalsContact C-N 3.31Å; P828-L830 PolarHBondContact O-N 2.94Å; L830-L833 PolarHBondContact O-N 3.2Å; L830-C834 WeakPolarHBondContact O-CB 3.32Å; L830-C834 PolarHBondContact O-N 2.99Å; L830-C834 PolarHBondContact O-SG 2.86Å; L830-L867 HydrophobicContact CD2-CD1 3.85Å; L830-L867 HydrophobicContact CG-CD1 3.78Å
831	C	86.3	Confident	82.3	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.007	16%	0.159	C	C	.	.	H	α-helix	trans	-59.4	-47	173.8	-70	0	0	0	0	111.4	S827 P828 L833 C834 L835 C934	S827-C831 PolarHBondContact O-N 3.33Å; S827-C831 VanDerWaalsContact O-N 3.12Å; S827-C831 PolarHBondContact O-SG 2.91Å; S827-C831 VanDerWaalsContact O-SG 3.39Å; P828-C831 PolarHBondContact O-N 3.43Å; C831-L833 VanDerWaalsContact C-N 3.33Å; C831-L833 PolarHBondContact O-N 2.99Å; C831-C834 PolarHBondContact O-N 2.87Å; C831-L835 VanDerWaalsContact O-CB 3.23Å; C831-L835 WeakPolarHBondContact O-CB 3.29Å; C831-L835 PolarHBondContact O-N 3.27Å; C831-C934 PolarHBondContact O-SG 2.91Å
832	E	83.6	Confident	83.1	Confident	21 Å²	21	27.5 Å²	27.5	10%	0.098	15%	0.153	C	C	.	.	H	α-helix	trans	-62.7	-36.5	177.1	-79	-68.5	148.1	0	0	113.4	R794 P828 L836 R929 G930	R794-E832 IonicContact CZ-OE2 3.67Å; R794-E832 PolarHBondContact NE-O 2.85Å; R794-E832 IonicContact NH1-OE2 2.7Å; R794-E832 PolarHBondContact NH1-OE2 3.45Å; R794-E832 PolarHBondContact NH2-O 3.06Å; R794-E832 IonicContact NH2-OE2 2.85Å; R794-E832 PolarHBondContact NH2-OE2 3.15Å; P828-E832 PolarHBondContact O-N 3.02Å; E832-L836 PolarHBondContact O-N 2.94Å; E832-L836 VanDerWaalsContact O-N 3.11Å; E832-R929 WeakPolarHBondContact OE1-CG 3.28Å; E832-R929 IonicContact OE1-NE 3.12Å; E832-G930 WeakPolarHBondContact OE1-CA 3.21Å; E832-G930 PolarHBondContact OE1-N 3.01Å
833	L	88.3	Confident	84.1	Confident	0 Å²	0	22 Å²	22	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-67.3	-49.3	175.5	-177	151.9	0	0	0	111.6	R794 F813 A816 T817 A829 L830 C831 L835 L836 W837	R794-L833 HydrophobicContact CB-CB 4.32Å; R794-L833 HydrophobicContact CB-CD1 4.1Å; R794-L833 HydrophobicContact CB-CG 4.21Å; F813-L833 HydrophobicContact CD1-CD2 3.97Å; F813-L833 HydrophobicContact CD1-CG 4.21Å; F813-L833 HydrophobicContact CE1-CG 4.45Å; A816-L833 HydrophobicContact CB-CD1 3.55Å; T817-L833 HydrophobicContact CG2-CD2 3.56Å; A829-L833 WeakPolarHBondContact O-CB 3.44Å; A829-L833 PolarHBondContact O-N 2.84Å; A829-L833 VanDerWaalsContact O-N 3.07Å; L830-L833 PolarHBondContact O-N 3.2Å; C831-L833 VanDerWaalsContact C-N 3.33Å; C831-L833 PolarHBondContact O-N 2.99Å; L833-L835 VanDerWaalsContact C-N 3.33Å; L833-L835 PolarHBondContact O-N 3.37Å; L833-L836 PolarHBondContact O-N 3.26Å; L833-W837 PolarHBondContact O-N 2.75Å
834	C	88.4	Confident	84.7	Confident	4 Å²	4	15.6 Å²	15.6	3%	0.027	10%	0.097	C	C	.	.	H	α-helix	trans	-66.1	-35	178.2	-73.3	0	0	0	0	112.4	L830 C831 W837 S838 V863 L867	L830-C834 WeakPolarHBondContact O-CB 3.32Å; L830-C834 PolarHBondContact O-N 2.99Å; L830-C834 PolarHBondContact O-SG 2.86Å; C831-C834 PolarHBondContact O-N 2.87Å; C834-W837 PolarHBondContact O-N 2.67Å; C834-S838 WeakPolarHBondContact O-CB 3.33Å; C834-S838 PolarHBondContact O-N 3Å; C834-S838 PolarHBondContact O-OG 3.4Å; C834-V863 HydrophobicContact CB-CG1 4.06Å; C834-L867 HydrophobicContact CB-CD2 3.78Å
835	L	87.3	Confident	84.6	Confident	14 Å²	14	18.4 Å²	18.4	7%	0.073	12%	0.115	C	C	.	.	H	α-helix	trans	-59.7	-51.1	172.6	-179.8	56.4	0	0	0	110.6	C831 L833 W837 S838 Q839 G933 L937	C831-L835 VanDerWaalsContact O-CB 3.23Å; C831-L835 WeakPolarHBondContact O-CB 3.29Å; C831-L835 PolarHBondContact O-N 3.27Å; L833-L835 VanDerWaalsContact C-N 3.33Å; L833-L835 PolarHBondContact O-N 3.37Å; L835-W837 PolarHBondContact O-N 2.83Å; L835-S838 PolarHBondContact O-N 3.35Å; L835-S838 PolarHBondContact O-OG 3.38Å; L835-Q839 HydrophobicContact CD1-CG 4.19Å; L835-Q839 WeakPolarHBondContact O-CB 3.42Å; L835-Q839 WeakPolarHBondContact O-CG 3.18Å; L835-Q839 PolarHBondContact O-N 3.4Å; L835-G933 VanDerWaalsContact CD1-C 3.48Å; L835-G933 WeakPolarHBondContact CD1-O 3.29Å; L835-L937 HydrophobicContact CD1-CB 4.39Å; L835-L937 HydrophobicContact CD1-CD2 4.01Å
836	L	86.8	Confident	84.1	Confident	10 Å²	10	21.9 Å²	21.9	5%	0.052	15%	0.146	C	C	.	.	H	α-helix	trans	-62.4	-45.1	179.1	-179.9	62.9	0	0	0	111.8	T688 R794 H798 E832 L833 S838 Q839 L840	T688-L836 HydrophobicContact CG2-CD1 4.25Å; R794-L836 HydrophobicContact CG-CD2 3.6Å; H798-L836 HydrophobicContact CB-CD2 3.91Å; E832-L836 PolarHBondContact O-N 2.94Å; E832-L836 VanDerWaalsContact O-N 3.11Å; L833-L836 PolarHBondContact O-N 3.26Å; L836-S838 PolarHBondContact O-N 3.36Å; L836-Q839 PolarHBondContact O-N 3.11Å; L836-L840 HydrophobicContact CD1-CD1 4.31Å; L836-L840 HydrophobicContact CD1-CG 4.28Å; L836-L840 HydrophobicContact CG-CD1 4.06Å; L836-L840 HydrophobicContact CG-CG 4.47Å; L836-L840 VanDerWaalsContact O-CG 3.27Å; L836-L840 WeakPolarHBondContact O-CG 3.47Å; L836-L840 PolarHBondContact O-N 3.09Å
837	W	90.6	Very high	83.7	Confident	25 Å²	25	25.8 Å²	25.8	10%	0.095	15%	0.152	C	C	.	.	H	α-helix	trans	-61.2	-46.4	179.5	-176.2	15.5	0	0	0	111.8	F813 T817 L833 C834 L835 Q839 L840 E841 V863	F813-W837 HydrophobicContact CB-CD2 3.65Å; F813-W837 HydrophobicContact CB-CE3 3.78Å; F813-W837 HydrophobicContact CB-CG 4.06Å; F813-W837 HydrophobicContact CB-CH2 4.37Å; F813-W837 HydrophobicContact CB-CZ2 4.27Å; F813-W837 HydrophobicContact CB-CZ3 4.14Å; F813-W837 HydrophobicContact CD1-CB 3.89Å; F813-W837 HydrophobicContact CD1-CD2 4.46Å; F813-W837 HydrophobicContact CD1-CG 4.11Å; F813-W837 HydrophobicContact CD2-CB 4.31Å; F813-W837 AromaticContact CD2-CD1 3.73Å; F813-W837 HydrophobicContact CD2-CD2 4.31Å; F813-W837 AromaticContact CD2-CG 3.88Å; F813-W837 HydrophobicContact CD2-CG 3.88Å; F813-W837 HydrophobicContact CE1-CB 3.99Å; F813-W837 HydrophobicContact CE2-CB 4.42Å; F813-W837 HydrophobicContact CE2-CG 4.34Å; F813-W837 HydrophobicContact CG-CB 4.07Å; F813-W837 AromaticContact CG-CD2 3.93Å; F813-W837 HydrophobicContact CG-CD2 3.93Å; F813-W837 HydrophobicContact CG-CE3 4.37Å; F813-W837 AromaticContact CG-CG 3.77Å; F813-W837 HydrophobicContact CG-CG 3.77Å; F813-W837 HydrophobicContact CZ-CB 4.27Å; T817-W837 HydrophobicContact CG2-CE3 4.16Å; T817-W837 HydrophobicContact CG2-CZ3 3.98Å; L833-W837 PolarHBondContact O-N 2.75Å; C834-W837 PolarHBondContact O-N 2.67Å; L835-W837 PolarHBondContact O-N 2.83Å; W837-Q839 PolarHBondContact O-N 2.89Å; W837-L840 PolarHBondContact O-N 3.14Å; W837-E841 PolarHBondContact NE1-OE1 3.33Å; W837-E841 PolarHBondContact O-N 3.31Å; W837-E841 VanDerWaalsContact O-N 3.08Å; W837-V863 HydrophobicContact CD2-CG1 4.19Å; W837-V863 HydrophobicContact CD2-CG2 3.76Å; W837-V863 HydrophobicContact CE3-CB 4.32Å; W837-V863 HydrophobicContact CE3-CG1 3.63Å; W837-V863 HydrophobicContact CE3-CG2 3.62Å; W837-V863 HydrophobicContact CH2-CG2 3.84Å; W837-V863 HydrophobicContact CZ2-CG2 3.94Å; W837-V863 HydrophobicContact CZ3-CG1 4.13Å; W837-V863 HydrophobicContact CZ3-CG2 3.67Å
838	S	89.2	Confident	82.6	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.1	-40.1	177.9	55.6	0	0	0	0	112.5	C834 L835 L836 L840 E841 V842 L937	C834-S838 WeakPolarHBondContact O-CB 3.33Å; C834-S838 PolarHBondContact O-N 3Å; C834-S838 PolarHBondContact O-OG 3.4Å; L835-S838 PolarHBondContact O-N 3.35Å; L835-S838 PolarHBondContact O-OG 3.38Å; L836-S838 PolarHBondContact O-N 3.36Å; S838-L840 PolarHBondContact O-N 3.27Å; S838-E841 PolarHBondContact O-N 3.46Å; S838-V842 VanDerWaalsContact O-CG2 3.3Å; S838-V842 WeakPolarHBondContact O-CG2 3.39Å; S838-V842 PolarHBondContact O-N 3.21Å; S838-V842 VanDerWaalsContact O-N 3.08Å; S838-L937 VanDerWaalsContact OG-CD2 3.31Å; S838-L937 WeakPolarHBondContact OG-CD2 3.41Å
839	Q	87.2	Confident	80.9	Confident	38 Å²	38	37.7 Å²	37.7	18%	0.178	22%	0.215	C	C	.	.	H	α-helix	trans	-60.2	-43.4	173.6	-71.5	169.7	-23.6	0	0	112.2	L687 T688 L835 L836 W837 V842 E843 L937	L687-Q839 HydrophobicContact CB-CB 3.94Å; L687-Q839 HydrophobicContact CB-CG 4.06Å; T688-Q839 HydrophobicContact CG2-CB 3.53Å; L835-Q839 HydrophobicContact CD1-CG 4.19Å; L835-Q839 WeakPolarHBondContact O-CB 3.42Å; L835-Q839 WeakPolarHBondContact O-CG 3.18Å; L835-Q839 PolarHBondContact O-N 3.4Å; L836-Q839 PolarHBondContact O-N 3.11Å; W837-Q839 PolarHBondContact O-N 2.89Å; Q839-V842 PolarHBondContact O-N 3.47Å; Q839-E843 WeakPolarHBondContact O-CG 3.31Å; Q839-E843 PolarHBondContact O-N 2.74Å; Q839-E843 VanDerWaalsContact O-N 3.08Å; Q839-L937 HydrophobicContact CG-CD2 3.8Å
840	L	87.3	Confident	79.3	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-63.3	-42	178.5	-71.3	170.1	0	0	0	112.2	T688 W801 F813 L836 W837 S838 E843 N844	T688-L840 HydrophobicContact CG2-CD2 3.57Å; T688-L840 HydrophobicContact CG2-CG 3.84Å; W801-L840 HydrophobicContact CB-CD1 4.37Å; W801-L840 HydrophobicContact CD2-CB 4.13Å; W801-L840 HydrophobicContact CD2-CD1 4.03Å; W801-L840 HydrophobicContact CD2-CD2 4.35Å; W801-L840 HydrophobicContact CD2-CG 4.4Å; W801-L840 HydrophobicContact CE3-CB 4.48Å; W801-L840 HydrophobicContact CE3-CD1 4.39Å; W801-L840 HydrophobicContact CG-CD1 4.01Å; W801-L840 HydrophobicContact CG-CD2 4.08Å; W801-L840 HydrophobicContact CH2-CB 4.12Å; W801-L840 HydrophobicContact CZ2-CB 3.7Å; W801-L840 WeakPolarHBondContact CZ2-O 3.25Å; W801-L840 HydrophobicContact CZ3-CB 4.49Å; F813-L840 HydrophobicContact CE2-CD1 3.94Å; F813-L840 HydrophobicContact CZ-CD1 3.82Å; L836-L840 HydrophobicContact CD1-CD1 4.31Å; L836-L840 HydrophobicContact CD1-CG 4.28Å; L836-L840 HydrophobicContact CG-CD1 4.06Å; L836-L840 HydrophobicContact CG-CG 4.47Å; L836-L840 VanDerWaalsContact O-CG 3.27Å; L836-L840 WeakPolarHBondContact O-CG 3.47Å; L836-L840 PolarHBondContact O-N 3.09Å; W837-L840 PolarHBondContact O-N 3.14Å; S838-L840 PolarHBondContact O-N 3.27Å; L840-E843 PolarHBondContact O-N 2.89Å; L840-N844 WeakPolarHBondContact O-CB 3.48Å; L840-N844 PolarHBondContact O-N 3.24Å
841	E	87.9	Confident	77.3	Confident	12 Å²	12	43.2 Å²	43.2	6%	0.056	28%	0.276	C	S	.	.	H	α-helix	trans	-68.7	-34.2	177.6	-65.8	-68.6	175.9	0	0	112.4	W801 R810 W837 S838 N844 S845 P859 A860	W801-E841 HydrophobicContact CH2-CG 4.35Å; R810-E841 IonicContact CZ-OE1 2.62Å; R810-E841 IonicContact CZ-OE2 2.75Å; R810-E841 IonicContact NE-OE1 3.17Å; R810-E841 PolarHBondContact NE-OE1 3.36Å; R810-E841 IonicContact NE-OE2 3.94Å; R810-E841 IonicContact NH2-OE1 3.43Å; R810-E841 IonicContact NH2-OE2 2.68Å; R810-E841 PolarHBondContact NH2-OE2 2.92Å; W837-E841 PolarHBondContact NE1-OE1 3.33Å; W837-E841 PolarHBondContact O-N 3.31Å; W837-E841 VanDerWaalsContact O-N 3.08Å; S838-E841 PolarHBondContact O-N 3.46Å; E841-N844 PolarHBondContact O-N 3.39Å; E841-S845 PolarHBondContact O-N 3.34Å; E841-S845 PolarHBondContact O-OG 3.49Å; E841-P859 HydrophobicContact CB-CB 4.4Å; E841-P859 HydrophobicContact CG-CB 4.3Å; E841-A860 HydrophobicContact CB-CB 4.29Å
842	V	84.9	Confident	75.5	Confident	23 Å²	23	50.6 Å²	50.6	14%	0.139	32%	0.321	C	S	.	.	H	α-helix	trans	-63.8	-45.3	173.3	172.6	0	0	0	0	110.7	L687 S838 Q839 N844 S845 A846 A860 L941	L687-V842 HydrophobicContact CD1-CB 3.98Å; L687-V842 HydrophobicContact CD1-CG1 3.67Å; S838-V842 VanDerWaalsContact O-CG2 3.3Å; S838-V842 WeakPolarHBondContact O-CG2 3.39Å; S838-V842 PolarHBondContact O-N 3.21Å; S838-V842 VanDerWaalsContact O-N 3.08Å; Q839-V842 PolarHBondContact O-N 3.47Å; V842-N844 VanDerWaalsContact C-N 3.32Å; V842-N844 PolarHBondContact O-N 3.04Å; V842-S845 PolarHBondContact O-N 3.22Å; V842-S845 PolarHBondContact O-OG 3.11Å; V842-A846 PolarHBondContact O-N 2.99Å; V842-A846 VanDerWaalsContact O-N 3.15Å; V842-A860 HydrophobicContact CG2-CB 3.63Å; V842-L941 HydrophobicContact CG2-CD1 3.88Å; V842-L941 HydrophobicContact CG2-CD2 3.88Å; V842-L941 HydrophobicContact CG2-CG 4.48Å
843	E	83.6	Confident	74.2	Confident	13 Å²	13	52.7 Å²	52.7	6%	0.061	34%	0.342	C	S	.	.	H	α-helix	trans	-68.2	-31.3	178.1	-70.4	-176.8	162.5	0	0	113.4	R685 P686 L687 T688 Q839 L840	R685-E843 WeakPolarHBondContact CA-OE1 3.3Å; R685-E843 WeakPolarHBondContact CB-OE2 3.25Å; P686-E843 WeakPolarHBondContact CD-OE1 3.43Å; L687-E843 WeakPolarHBondContact CA-OE1 3.44Å; L687-E843 HydrophobicContact CB-CG 4.18Å; L687-E843 WeakPolarHBondContact CB-OE1 3.27Å; L687-E843 HydrophobicContact CD1-CG 4.36Å; L687-E843 HydrophobicContact CG-CG 4.43Å; L687-E843 PolarHBondContact N-OE1 3.4Å; T688-E843 PolarHBondContact N-OE1 3.07Å; T688-E843 VanDerWaalsContact OG1-CD 3.32Å; T688-E843 PolarHBondContact OG1-OE1 2.65Å; T688-E843 PolarHBondContact OG1-OE2 2.82Å; Q839-E843 WeakPolarHBondContact O-CG 3.31Å; Q839-E843 PolarHBondContact O-N 2.74Å; Q839-E843 VanDerWaalsContact O-N 3.08Å; L840-E843 PolarHBondContact O-N 2.89Å
844	N	83.3	Confident	73.1	Confident	37 Å²	37	57.2 Å²	57.2	20%	0.198	37%	0.366	C	S	.	.	H	α-helix	trans	-72.4	-42.5	177	-170.1	63.3	0	0	0	112	W801 L840 E841 V842 A846 K847	W801-N844 HydrophobicContact CH2-CB 4.38Å; W801-N844 HydrophobicContact CZ2-CB 3.87Å; L840-N844 WeakPolarHBondContact O-CB 3.48Å; L840-N844 PolarHBondContact O-N 3.24Å; E841-N844 PolarHBondContact O-N 3.39Å; V842-N844 VanDerWaalsContact C-N 3.32Å; V842-N844 PolarHBondContact O-N 3.04Å; N844-A846 VanDerWaalsContact C-N 3.26Å; N844-A846 PolarHBondContact O-N 3.44Å; N844-K847 PolarHBondContact O-N 3.46Å
845	S	76.2	Confident	72.2	Confident	66 Å²	66	59.7 Å²	59.7	46%	0.462	38%	0.381	S	S	.	.	H	α-helix	trans	-65.2	-30	176.3	56.3	0	0	0	0	112.6	E841 V842 K847 E848	E841-S845 PolarHBondContact O-N 3.34Å; E841-S845 PolarHBondContact O-OG 3.49Å; V842-S845 PolarHBondContact O-N 3.22Å; V842-S845 PolarHBondContact O-OG 3.11Å; S845-K847 PolarHBondContact O-N 2.86Å; S845-E848 PolarHBondContact O-N 3.34Å
846	A	69.5	Low	71.2	Confident	83 Å²	83	60.3 Å²	60.3	69%	0.686	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-14.6	175.3	0	0	0	0	0	115	V842 N844	V842-A846 PolarHBondContact O-N 2.99Å; V842-A846 VanDerWaalsContact O-N 3.15Å; N844-A846 VanDerWaalsContact C-N 3.26Å; N844-A846 PolarHBondContact O-N 3.44Å
847	K	65.9	Low	70.5	Confident	121 Å²	121	63.6 Å²	63.6	53%	0.526	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-16.5	178.9	-68.1	174.7	-172.5	167.1	0	113.7	N844 S845 P849	N844-K847 PolarHBondContact O-N 3.46Å; S845-K847 PolarHBondContact O-N 2.86Å; K847-P849 VanDerWaalsContact O-CD 3.31Å; K847-P849 WeakPolarHBondContact O-CD 3.44Å
848	E	59.5	Low	70	Confident	153 Å²	153	63.3 Å²	63.3	72%	0.715	41%	0.408	S	S	*	.	S	Bend	trans	-89.5	111.9	179.1	-67	-169.4	169.2	0	0	109.9	S845 G850	S845-E848 PolarHBondContact O-N 3.34Å; E848-G850 PolarHBondContact O-N 3.04Å
849	P	44.7	Very low	69.8	Low	137 Å²	137	66.6 Å²	66.6	89%	0.89	43%	0.429	S	S	*	.	S	Bend	trans	-77.7	90.7	-179	30.8	-32.7	0	0	0	110.1	K847	K847-P849 VanDerWaalsContact O-CD 3.31Å; K847-P849 WeakPolarHBondContact O-CD 3.44Å
850	G	48.9	Very low	69.7	Low	78 Å²	78	64.9 Å²	64.9	80%	0.804	42%	0.421	S	S	*	.	S	Bend	trans	140.9	91.7	167.3	0	0	0	0	0	114.4	E848	E848-G850 PolarHBondContact O-N 3.04Å
851	G	44.7	Very low	69.6	Low	70 Å²	70	64.9 Å²	64.9	72%	0.722	42%	0.421	S	S	*	.			trans	157	112.7	164.9	0	0	0	0	0	111.7	A853	G851-A853 PolarHBondContact O-N 2.81Å
852	V	48.1	Very low	69.5	Low	156 Å²	156	64.8 Å²	64.8	95%	0.945	42%	0.423	S	S	*	.			trans	-65.7	93.6	158.4	179.6	0	0	0	0	105.3	D854	V852-D854 PolarHBondContact O-N 2.96Å
853	A	55.8	Low	69.6	Low	66 Å²	66	64.1 Å²	64.1	55%	0.545	42%	0.418	S	S	.	.			trans	-62.1	126.7	177.9	0	0	0	0	0	108.5	G851 V855	G851-A853 PolarHBondContact O-N 2.81Å; A853-V855 PolarHBondContact O-N 3.47Å
854	D	65.1	Low	69.8	Low	94 Å²	94	63.5 Å²	63.5	50%	0.503	42%	0.416	S	S	.	.			trans	-56.1	127.7	171.7	-174.6	-24	0	0	0	108.2	V852 T856 T857 S858	V852-D854 PolarHBondContact O-N 2.96Å; D854-T856 PolarHBondContact O-N 2.62Å; D854-T856 PolarHBondContact OD1-N 2.81Å; D854-T856 PolarHBondContact OD1-OG1 3.31Å; D854-T856 PolarHBondContact OD2-OG1 3.36Å; D854-T857 HydrophobicContact CB-CG2 4.21Å; D854-T857 WeakPolarHBondContact O-CA 3.44Å; D854-T857 PolarHBondContact O-N 3.32Å; D854-T857 PolarHBondContact O-OG1 3.5Å; D854-S858 PolarHBondContact O-N 3.27Å
855	V	69.2	Low	70	Confident	56 Å²	56	61.7 Å²	61.7	34%	0.339	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-51.2	-31.5	-178.7	178	0	0	0	0	111.1	A853 T857 S858 V861 I885 T942	A853-V855 PolarHBondContact O-N 3.47Å; V855-T857 VanDerWaalsContact C-N 3.29Å; V855-T857 PolarHBondContact O-N 3.09Å; V855-S858 PolarHBondContact O-N 3.39Å; V855-V861 HydrophobicContact CG1-CG1 4.31Å; V855-V861 HydrophobicContact CG1-CG2 4.2Å; V855-I885 HydrophobicContact CG1-CD1 4.46Å; V855-T942 HydrophobicContact CG1-CG2 4.03Å
856	T	66.1	Low	70.4	Confident	28 Å²	28	61.3 Å²	61.3	17%	0.172	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-74.5	-15.6	179.6	62.8	0	0	0	0	114.6	D854 L880 I885	D854-T856 PolarHBondContact O-N 2.62Å; D854-T856 PolarHBondContact OD1-N 2.81Å; D854-T856 PolarHBondContact OD1-OG1 3.31Å; D854-T856 PolarHBondContact OD2-OG1 3.36Å; T856-L880 WeakPolarHBondContact CB-O 3.29Å; T856-L880 WeakPolarHBondContact CG2-O 3.22Å; T856-L880 PolarHBondContact O-N 3.25Å; T856-I885 HydrophobicContact CG2-CD1 4.39Å
857	T	72	Confident	71.2	Confident	79 Å²	79	57.8 Å²	57.8	49%	0.485	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-104.1	-8.1	178.2	64.2	0	0	0	0	113.1	D854 V855 P859	D854-T857 HydrophobicContact CB-CG2 4.21Å; D854-T857 WeakPolarHBondContact O-CA 3.44Å; D854-T857 PolarHBondContact O-N 3.32Å; D854-T857 PolarHBondContact O-OG1 3.5Å; V855-T857 VanDerWaalsContact C-N 3.29Å; V855-T857 PolarHBondContact O-N 3.09Å; T857-P859 WeakPolarHBondContact O-CD 3.26Å
858	S	81.4	Confident	72.1	Confident	19 Å²	19	52.7 Å²	52.7	13%	0.133	34%	0.344	C	S	.	.			trans	-67.1	120.2	-178.5	177.6	0	0	0	0	111.7	D854 V855 A860 V861 A862	D854-S858 PolarHBondContact O-N 3.27Å; V855-S858 PolarHBondContact O-N 3.39Å; S858-A860 PolarHBondContact O-N 3.4Å; S858-V861 PolarHBondContact O-N 3.03Å; S858-A862 PolarHBondContact O-N 2.68Å; S858-A862 VanDerWaalsContact O-N 3.1Å
859	P	83.8	Confident	73.1	Confident	69 Å²	69	49.3 Å²	49.3	45%	0.448	33%	0.328	S	S	.	.	H	α-helix	trans	-57.5	-36.3	177.4	-25.3	34.6	0	0	0	112.9	E841 T857 A862 V863	E841-P859 HydrophobicContact CB-CB 4.4Å; E841-P859 HydrophobicContact CG-CB 4.3Å; T857-P859 WeakPolarHBondContact O-CD 3.26Å; P859-A862 PolarHBondContact O-N 3.13Å; P859-V863 WeakPolarHBondContact O-CG2 3.37Å; P859-V863 PolarHBondContact O-N 3.03Å; P859-V863 VanDerWaalsContact O-N 3.08Å
860	A	85.6	Confident	74.4	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.008	30%	0.297	C	S	.	.	H	α-helix	trans	-65.1	-41.8	178.8	0	0	0	0	0	112.5	E841 V842 S858 A862 V863 L864 L941	E841-A860 HydrophobicContact CB-CB 4.29Å; V842-A860 HydrophobicContact CG2-CB 3.63Å; S858-A860 PolarHBondContact O-N 3.4Å; A860-A862 VanDerWaalsContact C-N 3.3Å; A860-A862 PolarHBondContact O-N 3.03Å; A860-V863 PolarHBondContact O-N 3.43Å; A860-L864 WeakPolarHBondContact O-CG 3.34Å; A860-L864 PolarHBondContact O-N 3.08Å; A860-L941 HydrophobicContact CB-CD1 3.89Å
861	V	85.7	Confident	75.2	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.006	28%	0.279	C	S	.	.	H	α-helix	trans	-68.1	-34.7	176.9	-178.4	0	0	0	0	110.4	V855 S858 L864 T865 L880 I885 F938 L941 T942	V855-V861 HydrophobicContact CG1-CG1 4.31Å; V855-V861 HydrophobicContact CG1-CG2 4.2Å; S858-V861 PolarHBondContact O-N 3.03Å; V861-L864 PolarHBondContact O-N 3.27Å; V861-T865 VanDerWaalsContact O-CB 3.28Å; V861-T865 WeakPolarHBondContact O-CB 3.36Å; V861-T865 PolarHBondContact O-N 3.13Å; V861-T865 PolarHBondContact O-OG1 3.04Å; V861-L880 HydrophobicContact CB-CD1 4.12Å; V861-L880 HydrophobicContact CG1-CD1 3.73Å; V861-I885 HydrophobicContact CG1-CD1 4.41Å; V861-F938 HydrophobicContact CG1-CE2 4.31Å; V861-L941 HydrophobicContact CG2-CB 3.83Å; V861-L941 HydrophobicContact CG2-CD1 4.04Å; V861-T942 HydrophobicContact CG1-CG2 3.96Å; V861-T942 HydrophobicContact CG2-CG2 4.48Å
862	A	85.4	Confident	75.6	Confident	11 Å²	11	44 Å²	44	9%	0.091	27%	0.272	C	S	.	.	H	α-helix	trans	-65.3	-43.6	177.6	0	0	0	0	0	112.2	S858 P859 A860 T865 R866 L880	S858-A862 PolarHBondContact O-N 2.68Å; S858-A862 VanDerWaalsContact O-N 3.1Å; P859-A862 PolarHBondContact O-N 3.13Å; A860-A862 VanDerWaalsContact C-N 3.3Å; A860-A862 PolarHBondContact O-N 3.03Å; A862-T865 PolarHBondContact O-N 2.95Å; A862-R866 WeakPolarHBondContact O-CB 3.2Å; A862-R866 VanDerWaalsContact O-CG 3.26Å; A862-R866 WeakPolarHBondContact O-CG 3.4Å; A862-R866 PolarHBondContact O-N 3.44Å; A862-L880 HydrophobicContact CB-CD1 4Å; A862-L880 HydrophobicContact CB-CD2 4.21Å; A862-L880 HydrophobicContact CB-CG 4.3Å
863	V	86.7	Confident	75.6	Confident	8 Å²	8	39.7 Å²	39.7	5%	0.048	25%	0.249	C	C	.	.	H	α-helix	trans	-61.2	-47.9	176.3	172.9	0	0	0	0	111.2	C834 W837 P859 A860 R866 L867	C834-V863 HydrophobicContact CB-CG1 4.06Å; W837-V863 HydrophobicContact CD2-CG1 4.19Å; W837-V863 HydrophobicContact CD2-CG2 3.76Å; W837-V863 HydrophobicContact CE3-CB 4.32Å; W837-V863 HydrophobicContact CE3-CG1 3.63Å; W837-V863 HydrophobicContact CE3-CG2 3.62Å; W837-V863 HydrophobicContact CH2-CG2 3.84Å; W837-V863 HydrophobicContact CZ2-CG2 3.94Å; W837-V863 HydrophobicContact CZ3-CG1 4.13Å; W837-V863 HydrophobicContact CZ3-CG2 3.67Å; P859-V863 WeakPolarHBondContact O-CG2 3.37Å; P859-V863 PolarHBondContact O-N 3.03Å; P859-V863 VanDerWaalsContact O-N 3.08Å; A860-V863 PolarHBondContact O-N 3.43Å; V863-R866 PolarHBondContact O-N 3.33Å; V863-L867 PolarHBondContact O-N 3.2Å
864	L	87.8	Confident	75.1	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-67.1	-37.7	-179.8	-66.3	171	0	0	0	112.3	A860 V861 L867 A868 Y892 C934 L937 F938 L941	A860-L864 WeakPolarHBondContact O-CG 3.34Å; A860-L864 PolarHBondContact O-N 3.08Å; V861-L864 PolarHBondContact O-N 3.27Å; L864-L867 PolarHBondContact O-N 3.13Å; L864-A868 PolarHBondContact O-N 3.29Å; L864-Y892 PolarHBondContact O-OH 3.24Å; L864-C934 HydrophobicContact CD2-CB 3.94Å; L864-L937 HydrophobicContact CD1-CB 4.4Å; L864-L937 HydrophobicContact CD1-CD2 4.3Å; L864-L937 HydrophobicContact CD1-CG 4.15Å; L864-F938 HydrophobicContact CB-CB 4.48Å; L864-F938 HydrophobicContact CB-CD2 3.84Å; L864-F938 HydrophobicContact CD1-CB 4Å; L864-F938 HydrophobicContact CD1-CD2 4.42Å; L864-L941 HydrophobicContact CD1-CD1 4.4Å
865	T	87.2	Confident	74	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-65.5	-44.2	176.9	-55.3	0	0	0	0	111	V861 A862 L867 A868 E869 L880 A888	V861-T865 VanDerWaalsContact O-CB 3.28Å; V861-T865 WeakPolarHBondContact O-CB 3.36Å; V861-T865 PolarHBondContact O-N 3.13Å; V861-T865 PolarHBondContact O-OG1 3.04Å; A862-T865 PolarHBondContact O-N 2.95Å; T865-L867 VanDerWaalsContact C-N 3.34Å; T865-L867 PolarHBondContact O-N 3.32Å; T865-A868 PolarHBondContact O-N 3.22Å; T865-E869 WeakPolarHBondContact O-CG 3.25Å; T865-E869 PolarHBondContact O-N 3.02Å; T865-L880 HydrophobicContact CG2-CD2 4.34Å; T865-A888 HydrophobicContact CG2-CB 3.98Å
866	R	84.6	Confident	72.8	Confident	58 Å²	58	41.9 Å²	41.9	22%	0.219	27%	0.27	C	S	.	.	H	α-helix	trans	-63.8	-37.6	176.8	-71	173.8	-161.5	164.8	0.3	112.8	A862 V863 A868 E869 G870 T871 S875	A862-R866 WeakPolarHBondContact O-CB 3.2Å; A862-R866 VanDerWaalsContact O-CG 3.26Å; A862-R866 WeakPolarHBondContact O-CG 3.4Å; A862-R866 PolarHBondContact O-N 3.44Å; V863-R866 PolarHBondContact O-N 3.33Å; R866-A868 VanDerWaalsContact C-N 3.3Å; R866-A868 PolarHBondContact O-N 2.89Å; R866-E869 PolarHBondContact O-N 3.15Å; R866-G870 PolarHBondContact O-N 3.31Å; R866-T871 PolarHBondContact O-N 3.05Å; R866-S875 PolarHBondContact NH2-O 3.34Å
867	L	86.4	Confident	72	Confident	9 Å²	9	45.3 Å²	45.3	5%	0.047	30%	0.295	C	S	.	.	H	α-helix	trans	-58.8	-43.4	175	176.8	64.6	0	0	0	111.4	L825 L830 C834 V863 L864 T865 C934	L825-L867 HydrophobicContact CD2-CD2 3.98Å; L825-L867 HydrophobicContact CD2-CG 3.78Å; L830-L867 HydrophobicContact CD2-CD1 3.85Å; L830-L867 HydrophobicContact CG-CD1 3.78Å; C834-L867 HydrophobicContact CB-CD2 3.78Å; V863-L867 PolarHBondContact O-N 3.2Å; L864-L867 PolarHBondContact O-N 3.13Å; T865-L867 VanDerWaalsContact C-N 3.34Å; T865-L867 PolarHBondContact O-N 3.32Å; L867-C934 HydrophobicContact CD2-CB 4.42Å
868	A	84.5	Confident	71.2	Confident	13 Å²	13	47.7 Å²	47.7	11%	0.107	30%	0.301	C	S	.	.	H	α-helix	trans	-71.8	-32.7	177.7	0	0	0	0	0	113.4	L825 L864 T865 R866 A888 S891 Y892	L825-A868 HydrophobicContact CD1-CB 4.23Å; L864-A868 PolarHBondContact O-N 3.29Å; T865-A868 PolarHBondContact O-N 3.22Å; R866-A868 VanDerWaalsContact C-N 3.3Å; R866-A868 PolarHBondContact O-N 2.89Å; A868-A888 HydrophobicContact CB-CB 3.6Å; A868-S891 PolarHBondContact O-OG 2.78Å; A868-Y892 HydrophobicContact CB-CD2 3.98Å; A868-Y892 HydrophobicContact CB-CE2 3.62Å
869	E	82.2	Confident	70.3	Confident	82 Å²	82	52.1 Å²	52.1	38%	0.383	33%	0.327	S	S	.	.	H	α-helix	trans	-79	-17.5	176.9	-69.7	-179.6	162	0	0	113.5	T865 R866 T871 S884	T865-E869 WeakPolarHBondContact O-CG 3.25Å; T865-E869 PolarHBondContact O-N 3.02Å; R866-E869 PolarHBondContact O-N 3.15Å; E869-T871 VanDerWaalsContact C-N 3.27Å; E869-T871 HydrophobicContact CB-CG2 4.19Å; E869-T871 PolarHBondContact O-N 3.22Å; E869-S884 WeakPolarHBondContact OE1-CB 3.28Å
870	G	72.2	Confident	69.9	Low	23 Å²	23	49.9 Å²	49.9	24%	0.237	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.7	20.6	-179.5	0	0	0	0	0	114	R866	R866-G870 PolarHBondContact O-N 3.31Å
871	T	64.4	Low	69.6	Low	68 Å²	68	53.6 Å²	53.6	42%	0.417	33%	0.334	S	S	.	.			trans	-96	133.4	-174.9	54.4	0	0	0	0	111.7	R866 E869	R866-T871 PolarHBondContact O-N 3.05Å; E869-T871 VanDerWaalsContact C-N 3.27Å; E869-T871 HydrophobicContact CB-CG2 4.19Å; E869-T871 PolarHBondContact O-N 3.22Å
872	S	53.9	Low	69.3	Low	84 Å²	84	57.8 Å²	57.8	59%	0.587	36%	0.361	S	S	*	.			trans	-95.8	14.9	-175.5	52.8	0	0	0	0	114.5	S874	S872-S874 PolarHBondContact O-N 2.84Å
873	S	47.2	Very low	69.2	Low	64 Å²	64	61.4 Å²	61.4	45%	0.448	38%	0.382	S	S	.	.			trans	-72.6	125.2	-171.3	46.8	0	0	0	0	113.1	S875	S873-S875 VanDerWaalsContact C-N 3.32Å; S873-S875 PolarHBondContact O-N 3.17Å
874	S	45.6	Very low	69	Low	105 Å²	105	61.7 Å²	61.7	73%	0.734	38%	0.384	S	S	*	.			trans	-81.8	14.8	-169.1	49.3	0	0	0	0	115.8	S872 S876	S872-S874 PolarHBondContact O-N 2.84Å; S874-S876 PolarHBondContact O-N 3.39Å
875	S	42.8	Very low	68.9	Low	38 Å²	38	62.4 Å²	62.4	27%	0.266	39%	0.388	S	S	.	.			trans	-87.7	111	-178.2	58.5	0	0	0	0	111.7	R866 S873 S877	R866-S875 PolarHBondContact NH2-O 3.34Å; S873-S875 VanDerWaalsContact C-N 3.32Å; S873-S875 PolarHBondContact O-N 3.17Å; S875-S877 PolarHBondContact O-N 3.04Å; S875-S877 VanDerWaalsContact O-N 3.09Å
876	S	43.9	Very low	68.8	Low	119 Å²	119	67 Å²	67	83%	0.832	41%	0.412	S	S	*	.	S	Bend	trans	-68.5	6.4	176	47.8	0	0	0	0	114.8	S874	S874-S876 PolarHBondContact O-N 3.39Å
877	S	48.3	Very low	68.9	Low	100 Å²	100	70.8 Å²	70.8	70%	0.699	43%	0.43	S	S	*	.			trans	-145.8	64.2	-169	58.3	0	0	0	0	112.3	S875	S875-S877 PolarHBondContact O-N 3.04Å; S875-S877 VanDerWaalsContact O-N 3.09Å
878	Q	55.9	Low	68.9	Low	130 Å²	130	70.3 Å²	70.3	61%	0.607	43%	0.428	S	S	*	.			trans	-128	119.9	166.3	-73.6	-172.8	-7.7	0	0	109.3	L880	Q878-L880 PolarHBondContact O-N 3.23Å
879	T	61.6	Low	69.2	Low	111 Å²	111	72.8 Å²	72.8	68%	0.681	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-56.9	125.3	165.7	47.5	0	0	0	0	109
880	L	75.1	Confident	69.5	Low	22 Å²	22	77.6 Å²	77.6	12%	0.115	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-71.8	139.5	180	-62.7	167.9	0	0	0	110.6	T856 V861 A862 T865 Q878 I885	T856-L880 WeakPolarHBondContact CB-O 3.29Å; T856-L880 WeakPolarHBondContact CG2-O 3.22Å; T856-L880 PolarHBondContact O-N 3.25Å; V861-L880 HydrophobicContact CB-CD1 4.12Å; V861-L880 HydrophobicContact CG1-CD1 3.73Å; A862-L880 HydrophobicContact CB-CD1 4Å; A862-L880 HydrophobicContact CB-CD2 4.21Å; A862-L880 HydrophobicContact CB-CG 4.3Å; T865-L880 HydrophobicContact CG2-CD2 4.34Å; Q878-L880 PolarHBondContact O-N 3.23Å; L880-I885 HydrophobicContact CB-CD1 4.44Å
881	T	80.5	Confident	70.3	Confident	79 Å²	79	78 Å²	78	49%	0.485	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-79.6	144.2	170.7	67.5	0	0	0	0	110.4	V883 S884 I885	T881-V883 PolarHBondContact O-N 3.28Å; T881-V883 VanDerWaalsContact O-N 3.08Å; T881-S884 PolarHBondContact N-OG 3.09Å; T881-S884 PolarHBondContact O-N 3.09Å; T881-S884 VanDerWaalsContact O-N 3.11Å; T881-S884 PolarHBondContact O-OG 3.42Å; T881-S884 PolarHBondContact OG1-N 3.13Å; T881-S884 VanDerWaalsContact OG1-N 3.14Å; T881-S884 PolarHBondContact OG1-OG 2.92Å; T881-I885 PolarHBondContact O-N 3.36Å
882	P	78.9	Confident	71.5	Confident	90 Å²	90	74.8 Å²	74.8	58%	0.584	43%	0.428	S	S	*	.	H	α-helix	trans	-56.3	-26.9	172.4	-28	35.9	0	0	0	113.5	L886	P882-L886 WeakPolarHBondContact O-CG 3.18Å; P882-L886 PolarHBondContact O-N 3.44Å
883	V	82.8	Confident	73.1	Confident	87 Å²	87	74 Å²	74	53%	0.527	42%	0.418	S	S	.	.	H	α-helix	trans	-70	-40	177.7	-179.7	0	0	0	0	112.1	T881 I885 L886 K887	T881-V883 PolarHBondContact O-N 3.28Å; T881-V883 VanDerWaalsContact O-N 3.08Å; V883-I885 VanDerWaalsContact C-N 3.34Å; V883-L886 PolarHBondContact O-N 3.45Å; V883-K887 HydrophobicContact CG1-CD 4.43Å; V883-K887 WeakPolarHBondContact O-CG 3.37Å; V883-K887 PolarHBondContact O-N 3.17Å
884	S	83.7	Confident	75.1	Confident	13 Å²	13	77.3 Å²	77.3	9%	0.091	43%	0.426	C	S	.	.	H	α-helix	trans	-64.2	-40	175.9	46.6	0	0	0	0	111.5	E869 T881 L886 K887 A888	E869-S884 WeakPolarHBondContact OE1-CB 3.28Å; T881-S884 PolarHBondContact N-OG 3.09Å; T881-S884 PolarHBondContact O-N 3.09Å; T881-S884 VanDerWaalsContact O-N 3.11Å; T881-S884 PolarHBondContact O-OG 3.42Å; T881-S884 PolarHBondContact OG1-N 3.13Å; T881-S884 VanDerWaalsContact OG1-N 3.14Å; T881-S884 PolarHBondContact OG1-OG 2.92Å; S884-L886 PolarHBondContact O-N 3.12Å; S884-K887 PolarHBondContact O-N 2.86Å; S884-A888 WeakPolarHBondContact O-CB 3.35Å; S884-A888 PolarHBondContact O-N 3.37Å
885	I	85.1	Confident	77	Confident	16 Å²	16	73.8 Å²	73.8	8%	0.082	40%	0.4	C	S	.	.	H	α-helix	trans	-60.7	-43.3	175.6	-61.8	175.1	0	0	0	111.2	V855 T856 V861 L880 T881 V883 R889 F938 T942	V855-I885 HydrophobicContact CG1-CD1 4.46Å; T856-I885 HydrophobicContact CG2-CD1 4.39Å; V861-I885 HydrophobicContact CG1-CD1 4.41Å; L880-I885 HydrophobicContact CB-CD1 4.44Å; T881-I885 PolarHBondContact O-N 3.36Å; V883-I885 VanDerWaalsContact C-N 3.34Å; I885-R889 PolarHBondContact O-N 3.17Å; I885-F938 HydrophobicContact CG2-CE2 4.41Å; I885-F938 HydrophobicContact CG2-CZ 3.75Å; I885-T942 HydrophobicContact CG2-CG2 3.93Å
886	L	85.3	Confident	79.1	Confident	96 Å²	96	72 Å²	72	50%	0.503	39%	0.387	S	S	.	.	H	α-helix	trans	-67.4	-38.1	177.4	-71.7	174.6	0	0	0	112.9	P882 V883 S884 R889 R890	P882-L886 WeakPolarHBondContact O-CG 3.18Å; P882-L886 PolarHBondContact O-N 3.44Å; V883-L886 PolarHBondContact O-N 3.45Å; S884-L886 PolarHBondContact O-N 3.12Å; L886-R889 PolarHBondContact O-N 2.9Å; L886-R890 PolarHBondContact O-N 3.46Å
887	K	86.5	Confident	81.1	Confident	137 Å²	137	68.9 Å²	68.9	60%	0.596	37%	0.366	S	S	*	.	H	α-helix	trans	-65.3	-46.1	175.1	-75	179.9	178.4	-178.3	0	111.5	V883 S884 R889 R890 S891	V883-K887 HydrophobicContact CG1-CD 4.43Å; V883-K887 WeakPolarHBondContact O-CG 3.37Å; V883-K887 PolarHBondContact O-N 3.17Å; S884-K887 PolarHBondContact O-N 2.86Å; K887-R889 VanDerWaalsContact C-N 3.31Å; K887-R889 PolarHBondContact O-N 3.11Å; K887-R890 PolarHBondContact O-N 3.03Å; K887-S891 PolarHBondContact O-N 3.37Å
888	A	87.1	Confident	82.9	Confident	0 Å²	0	67 Å²	67	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-57.6	-44.3	175.4	0	0	0	0	0	111.5	T865 A868 S884 R890 S891 Y892 F938	T865-A888 HydrophobicContact CG2-CB 3.98Å; A868-A888 HydrophobicContact CB-CB 3.6Å; S884-A888 WeakPolarHBondContact O-CB 3.35Å; S884-A888 PolarHBondContact O-N 3.37Å; A888-R890 PolarHBondContact O-N 2.87Å; A888-S891 WeakPolarHBondContact O-CB 3.45Å; A888-S891 PolarHBondContact O-N 2.91Å; A888-S891 VanDerWaalsContact O-N 3.16Å; A888-Y892 VanDerWaalsContact O-CD2 3.24Å; A888-Y892 WeakPolarHBondContact O-CD2 3.28Å; A888-Y892 PolarHBondContact O-N 3.36Å; A888-F938 HydrophobicContact CB-CE2 4.44Å; A888-F938 HydrophobicContact CB-CZ 3.99Å
889	R	89.9	Confident	84.2	Confident	64 Å²	64	61.5 Å²	61.5	24%	0.242	33%	0.328	C	S	.	.	H	α-helix	trans	-56.2	-48.2	175.9	-169.2	174.8	-68.6	162	7.2	112.5	I885 L886 K887 S891 Y892 D893 Y935 F938 T942	I885-R889 PolarHBondContact O-N 3.17Å; L886-R889 PolarHBondContact O-N 2.9Å; K887-R889 VanDerWaalsContact C-N 3.31Å; K887-R889 PolarHBondContact O-N 3.11Å; R889-S891 VanDerWaalsContact C-N 3.31Å; R889-S891 PolarHBondContact O-N 3.12Å; R889-Y892 PolarHBondContact O-N 3.45Å; R889-D893 WeakPolarHBondContact O-CB 3.44Å; R889-D893 PolarHBondContact O-N 3.17Å; R889-D893 VanDerWaalsContact O-N 3.09Å; R889-Y935 HydrophobicContact CG-CE2 4.35Å; R889-F938 HydrophobicContact CB-CE1 3.94Å; R889-F938 HydrophobicContact CG-CE1 4.45Å; R889-T942 PolarHBondContact NH2-OG1 3.01Å
890	R	89.3	Confident	85	Confident	184 Å²	184	56.6 Å²	56.6	69%	0.694	30%	0.298	S	S	*	.	H	α-helix	trans	-63.3	-38.2	178.2	-71.7	-178.6	-178.4	176.3	0.6	111.9	L886 K887 A888 D893 Q894	L886-R890 PolarHBondContact O-N 3.46Å; K887-R890 PolarHBondContact O-N 3.03Å; A888-R890 PolarHBondContact O-N 2.87Å; R890-D893 PolarHBondContact O-N 2.99Å; R890-Q894 WeakPolarHBondContact O-CB 3.24Å; R890-Q894 VanDerWaalsContact O-CG 3.22Å; R890-Q894 WeakPolarHBondContact O-CG 3.45Å; R890-Q894 PolarHBondContact O-N 3.12Å
891	S	88.3	Confident	85.4	Confident	31 Å²	31	58.1 Å²	58.1	22%	0.217	31%	0.31	C	S	.	.	H	α-helix	trans	-64.4	-46.9	177.3	-177.2	0	0	0	0	111.9	A868 K887 A888 R889 D893 Q894 V895	A868-S891 PolarHBondContact O-OG 2.78Å; K887-S891 PolarHBondContact O-N 3.37Å; A888-S891 WeakPolarHBondContact O-CB 3.45Å; A888-S891 PolarHBondContact O-N 2.91Å; A888-S891 VanDerWaalsContact O-N 3.16Å; R889-S891 VanDerWaalsContact C-N 3.31Å; R889-S891 PolarHBondContact O-N 3.12Å; S891-D893 VanDerWaalsContact C-N 3.33Å; S891-D893 PolarHBondContact O-N 3.37Å; S891-Q894 PolarHBondContact O-N 3.19Å; S891-V895 VanDerWaalsContact O-CG2 3.3Å; S891-V895 WeakPolarHBondContact O-CG2 3.18Å; S891-V895 PolarHBondContact O-N 2.82Å
892	Y	90	Very high	85.3	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-57.2	-45.8	174.7	-83.2	-67.6	0	0	0	112.5	L825 L864 A868 A888 R889 V895 L896 L931 C934 Y935 F938	L825-Y892 HydrophobicContact CD1-CD1 3.88Å; L825-Y892 HydrophobicContact CD1-CE1 4.17Å; L825-Y892 HydrophobicContact CD1-CG 4.23Å; L825-Y892 HydrophobicContact CD2-CD1 3.69Å; L825-Y892 HydrophobicContact CD2-CE1 3.16Å; L825-Y892 HydrophobicContact CG-CD1 4.47Å; L825-Y892 HydrophobicContact CG-CE1 4.32Å; L864-Y892 PolarHBondContact O-OH 3.24Å; A868-Y892 HydrophobicContact CB-CD2 3.98Å; A868-Y892 HydrophobicContact CB-CE2 3.62Å; A888-Y892 VanDerWaalsContact O-CD2 3.24Å; A888-Y892 WeakPolarHBondContact O-CD2 3.28Å; A888-Y892 PolarHBondContact O-N 3.36Å; R889-Y892 PolarHBondContact O-N 3.45Å; Y892-V895 PolarHBondContact O-N 2.92Å; Y892-L896 VanDerWaalsContact O-CB 3.31Å; Y892-L896 WeakPolarHBondContact O-CB 3.08Å; Y892-L896 PolarHBondContact O-N 2.77Å; Y892-L931 HydrophobicContact CD1-CD1 4.05Å; Y892-L931 HydrophobicContact CE1-CD1 4.33Å; Y892-C934 HydrophobicContact CE1-CB 3.84Å; Y892-Y935 HydrophobicContact CD1-CD2 4.35Å; Y892-Y935 HydrophobicContact CD1-CG 4.29Å; Y892-Y935 HydrophobicContact CD2-CD2 4.2Å; Y892-Y935 AromaticContact CG-CD2 3.76Å; Y892-Y935 HydrophobicContact CG-CD2 3.76Å; Y892-Y935 HydrophobicContact CG-CE2 4.45Å; Y892-Y935 HydrophobicContact CG-CG 4.12Å; Y892-F938 HydrophobicContact CD2-CD1 4.22Å; Y892-F938 HydrophobicContact CD2-CG 4.45Å; Y892-F938 HydrophobicContact CE2-CB 4.43Å; Y892-F938 HydrophobicContact CE2-CD1 4.39Å; Y892-F938 HydrophobicContact CE2-CD2 4.45Å; Y892-F938 HydrophobicContact CE2-CG 4.18Å
893	D	87.6	Confident	85	Confident	69 Å²	69	53.2 Å²	53.2	37%	0.369	28%	0.28	S	S	.	.	H	α-helix	trans	-61.7	-47.9	-179.6	-157.9	56.3	0	0	0	111.6	R889 R890 S891 V895 L896 S897 Y935	R889-D893 WeakPolarHBondContact O-CB 3.44Å; R889-D893 PolarHBondContact O-N 3.17Å; R889-D893 VanDerWaalsContact O-N 3.09Å; R890-D893 PolarHBondContact O-N 2.99Å; S891-D893 VanDerWaalsContact C-N 3.33Å; S891-D893 PolarHBondContact O-N 3.37Å; D893-V895 PolarHBondContact O-N 3.4Å; D893-L896 PolarHBondContact O-N 3.33Å; D893-S897 PolarHBondContact O-N 2.92Å; D893-S897 PolarHBondContact O-OG 3.01Å; D893-Y935 PolarHBondContact OD1-OH 3.13Å
894	Q	88.8	Confident	84.4	Confident	133 Å²	133	51 Å²	51	62%	0.621	27%	0.265	S	S	*	.	H	α-helix	trans	-62.4	-41.9	177.7	-73.4	172.2	-8.3	0	0	113.1	R890 S891 S898	R890-Q894 WeakPolarHBondContact O-CB 3.24Å; R890-Q894 VanDerWaalsContact O-CG 3.22Å; R890-Q894 WeakPolarHBondContact O-CG 3.45Å; R890-Q894 PolarHBondContact O-N 3.12Å; S891-Q894 PolarHBondContact O-N 3.19Å; Q894-S898 WeakPolarHBondContact O-CB 3.27Å; Q894-S898 PolarHBondContact O-N 3.2Å; Q894-S898 PolarHBondContact O-OG 3.33Å
895	V	86.8	Confident	83.9	Confident	31 Å²	31	56.1 Å²	56.1	19%	0.188	29%	0.287	C	S	.	.	H	α-helix	trans	-73.1	-36.3	-179.7	178.4	0	0	0	0	111.2	L825 S891 Y892 D893 S898 S899 L931	L825-V895 HydrophobicContact CB-CB 4.39Å; L825-V895 HydrophobicContact CB-CG1 3.99Å; L825-V895 HydrophobicContact CB-CG2 4.23Å; L825-V895 HydrophobicContact CD1-CB 4.24Å; L825-V895 HydrophobicContact CD1-CG2 3.99Å; S891-V895 VanDerWaalsContact O-CG2 3.3Å; S891-V895 WeakPolarHBondContact O-CG2 3.18Å; S891-V895 PolarHBondContact O-N 2.82Å; Y892-V895 PolarHBondContact O-N 2.92Å; D893-V895 PolarHBondContact O-N 3.4Å; V895-S898 WeakPolarHBondContact CA-OG 3.46Å; V895-S898 PolarHBondContact O-OG 2.93Å; V895-S898 VanDerWaalsContact O-OG 3.11Å; V895-S899 VanDerWaalsContact O-CB 3.3Å; V895-S899 WeakPolarHBondContact O-CB 3.49Å; V895-S899 PolarHBondContact O-N 3.35Å; V895-S899 PolarHBondContact O-OG 3.04Å; V895-L931 HydrophobicContact CG1-CD1 4.26Å; V895-L931 HydrophobicContact CG1-CD2 3.87Å
896	L	86.4	Confident	83.1	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-64.6	-49.8	174.6	179.6	61.9	0	0	0	110.9	Y892 D893 S898 S899 L900 L928 L931 V932 Y935 V951	Y892-L896 VanDerWaalsContact O-CB 3.31Å; Y892-L896 WeakPolarHBondContact O-CB 3.08Å; Y892-L896 PolarHBondContact O-N 2.77Å; D893-L896 PolarHBondContact O-N 3.33Å; L896-S898 VanDerWaalsContact C-N 3.34Å; L896-S898 PolarHBondContact O-N 2.87Å; L896-S899 PolarHBondContact O-N 3.29Å; L896-L900 HydrophobicContact CD1-CD1 4.02Å; L896-L900 HydrophobicContact CD1-CG 4.23Å; L896-L900 HydrophobicContact CG-CD1 4Å; L896-L900 VanDerWaalsContact O-CG 3.31Å; L896-L900 WeakPolarHBondContact O-CG 2.93Å; L896-L900 PolarHBondContact O-N 2.8Å; L896-L928 HydrophobicContact CD1-CD1 3.95Å; L896-L931 HydrophobicContact CB-CD2 4.48Å; L896-L931 HydrophobicContact CD1-CD2 4.41Å; L896-V932 HydrophobicContact CD1-CG2 3.67Å; L896-Y935 HydrophobicContact CD2-CD1 3.84Å; L896-Y935 HydrophobicContact CD2-CE1 4.08Å; L896-V951 HydrophobicContact CD2-CG1 4.17Å
897	S	86.2	Confident	82	Confident	54 Å²	54	56.5 Å²	56.5	38%	0.378	29%	0.285	S	S	.	.	H	α-helix	trans	-60.7	-41.8	178.2	-62.9	0	0	0	0	112.5	D893 S901	D893-S897 PolarHBondContact O-N 2.92Å; D893-S897 PolarHBondContact O-OG 3.01Å; S897-S901 PolarHBondContact O-N 2.94Å; S897-S901 PolarHBondContact O-OG 2.93Å
898	S	86.1	Confident	81	Confident	59 Å²	59	55.8 Å²	55.8	41%	0.413	28%	0.284	S	S	.	.	H	α-helix	trans	-69.2	-37.5	178.8	61.1	0	0	0	0	113	Q894 V895 L896 S901 S902	Q894-S898 WeakPolarHBondContact O-CB 3.27Å; Q894-S898 PolarHBondContact O-N 3.2Å; Q894-S898 PolarHBondContact O-OG 3.33Å; V895-S898 WeakPolarHBondContact CA-OG 3.46Å; V895-S898 PolarHBondContact O-OG 2.93Å; V895-S898 VanDerWaalsContact O-OG 3.11Å; L896-S898 VanDerWaalsContact C-N 3.34Å; L896-S898 PolarHBondContact O-N 2.87Å; S898-S901 WeakPolarHBondContact CA-OG 2.9Å; S898-S901 PolarHBondContact O-N 3.1Å; S898-S901 PolarHBondContact O-OG 3.37Å; S898-S902 WeakPolarHBondContact O-CB 3.48Å; S898-S902 PolarHBondContact O-N 3.4Å
899	S	81.8	Confident	79.7	Confident	16 Å²	16	60.8 Å²	60.8	11%	0.112	31%	0.311	C	S	.	.	H	α-helix	trans	-66.7	-40.8	176.8	-57.2	0	0	0	0	111.4	V895 L896 S902 L903	V895-S899 VanDerWaalsContact O-CB 3.3Å; V895-S899 WeakPolarHBondContact O-CB 3.49Å; V895-S899 PolarHBondContact O-N 3.35Å; V895-S899 PolarHBondContact O-OG 3.04Å; L896-S899 PolarHBondContact O-N 3.29Å; S899-S902 PolarHBondContact O-N 3.16Å; S899-L903 PolarHBondContact O-N 3.02Å
900	L	80.1	Confident	78.1	Confident	8 Å²	8	62.5 Å²	62.5	4%	0.042	32%	0.321	C	S	.	.	H	α-helix	trans	-64.2	-45.8	174.2	-68.6	170.9	0	0	0	111.4	L896 S902 L903 D904 L928 R958	L896-L900 HydrophobicContact CD1-CD1 4.02Å; L896-L900 HydrophobicContact CD1-CG 4.23Å; L896-L900 HydrophobicContact CG-CD1 4Å; L896-L900 VanDerWaalsContact O-CG 3.31Å; L896-L900 WeakPolarHBondContact O-CG 2.93Å; L896-L900 PolarHBondContact O-N 2.8Å; L900-S902 VanDerWaalsContact C-N 3.33Å; L900-S902 PolarHBondContact O-N 2.91Å; L900-L903 WeakPolarHBondContact O-CB 3.48Å; L900-L903 PolarHBondContact O-N 2.87Å; L900-D904 PolarHBondContact O-N 3.47Å; L900-L928 HydrophobicContact CD2-CD1 3.92Å; L900-L928 HydrophobicContact CD2-CD2 3.88Å; L900-L928 HydrophobicContact CG-CD1 4.29Å; L900-R958 HydrophobicContact CD1-CG 4.31Å; L900-R958 HydrophobicContact CD2-CB 4.11Å
901	S	82.1	Confident	76.4	Confident	54 Å²	54	59.6 Å²	59.6	38%	0.378	32%	0.315	S	S	.	.	H	α-helix	trans	-66.6	-31.9	178.1	61.4	0	0	0	0	113.9	S897 S898 L903 D904 Q905	S897-S901 PolarHBondContact O-N 2.94Å; S897-S901 PolarHBondContact O-OG 2.93Å; S898-S901 WeakPolarHBondContact CA-OG 2.9Å; S898-S901 PolarHBondContact O-N 3.1Å; S898-S901 PolarHBondContact O-OG 3.37Å; S901-L903 VanDerWaalsContact C-N 3.32Å; S901-D904 PolarHBondContact O-N 3.07Å; S901-Q905 WeakPolarHBondContact O-CG 3.4Å; S901-Q905 PolarHBondContact O-N 3.03Å
902	S	79.9	Confident	74.6	Confident	44 Å²	44	65.8 Å²	65.8	31%	0.308	34%	0.341	S	S	.	.	H	α-helix	trans	-68.1	-35.1	175.5	-179.4	0	0	0	0	111.6	S898 S899 L900 K906	S898-S902 WeakPolarHBondContact O-CB 3.48Å; S898-S902 PolarHBondContact O-N 3.4Å; S899-S902 PolarHBondContact O-N 3.16Å; L900-S902 VanDerWaalsContact C-N 3.33Å; L900-S902 PolarHBondContact O-N 2.91Å; S902-K906 WeakPolarHBondContact O-CG 3.08Å; S902-K906 PolarHBondContact O-N 3.29Å
903	L	71	Confident	72.3	Confident	22 Å²	22	71.6 Å²	71.6	12%	0.115	37%	0.372	C	S	.	.	H	α-helix	trans	-66.7	-42	177.1	-169.6	63.1	0	0	0	110.4	S899 L900 S901 Q905 K906 I907 D924 L962	S899-L903 PolarHBondContact O-N 3.02Å; L900-L903 WeakPolarHBondContact O-CB 3.48Å; L900-L903 PolarHBondContact O-N 2.87Å; S901-L903 VanDerWaalsContact C-N 3.32Å; L903-Q905 PolarHBondContact O-N 3.4Å; L903-K906 PolarHBondContact O-N 3.38Å; L903-I907 HydrophobicContact CD1-CD1 4.14Å; L903-I907 HydrophobicContact CG-CD1 3.98Å; L903-I907 WeakPolarHBondContact O-CD1 3.44Å; L903-I907 WeakPolarHBondContact O-CG1 3.4Å; L903-I907 PolarHBondContact O-N 3.31Å; L903-D924 HydrophobicContact CD1-CB 4.32Å; L903-L962 HydrophobicContact CB-CD1 4.41Å; L903-L962 HydrophobicContact CD2-CD1 3.57Å; L903-L962 HydrophobicContact CG-CD1 3.84Å
904	D	70.8	Confident	70.1	Confident	39 Å²	39	72.1 Å²	72.1	21%	0.209	39%	0.394	C	S	.	.	H	α-helix	trans	-58	-45.6	175.1	-65.7	-21.8	0	0	0	112.3	L900 S901 Q908 L962	L900-D904 PolarHBondContact O-N 3.47Å; S901-D904 PolarHBondContact O-N 3.07Å; D904-Q908 WeakPolarHBondContact O-CG 3.3Å; D904-Q908 PolarHBondContact O-N 2.93Å; D904-Q908 VanDerWaalsContact O-N 3.14Å; D904-L962 WeakPolarHBondContact OD1-CD1 3.22Å; D904-L962 WeakPolarHBondContact OD1-CD2 3.41Å; D904-L962 WeakPolarHBondContact OD1-CG 3.39Å
905	Q	73.5	Confident	67.5	Low	122 Å²	122	73.8 Å²	73.8	57%	0.57	41%	0.407	S	S	*	.	H	α-helix	trans	-68.2	-41.9	-177.9	-72	176.5	2.5	0	0	113.3	S901 L903 I907 Q908 N909	S901-Q905 WeakPolarHBondContact O-CG 3.4Å; S901-Q905 PolarHBondContact O-N 3.03Å; L903-Q905 PolarHBondContact O-N 3.4Å; Q905-I907 VanDerWaalsContact C-N 3.31Å; Q905-I907 PolarHBondContact O-N 3.35Å; Q905-Q908 PolarHBondContact O-N 3.05Å; Q905-N909 VanDerWaalsContact O-CG 3.28Å; Q905-N909 PolarHBondContact O-N 3.5Å; Q905-N909 VanDerWaalsContact O-N 3.16Å; Q905-N909 PolarHBondContact O-ND2 3.02Å
906	K	67.9	Low	65	Low	92 Å²	92	75 Å²	75	40%	0.4	42%	0.421	S	S	.	.	H	α-helix	trans	-63.8	-39	178.7	-74	-178	-179.6	-177.5	0	111.6	S902 L903 N909 H910 D924	S902-K906 WeakPolarHBondContact O-CG 3.08Å; S902-K906 PolarHBondContact O-N 3.29Å; L903-K906 PolarHBondContact O-N 3.38Å; K906-N909 PolarHBondContact O-N 2.96Å; K906-H910 PolarHBondContact O-CD2 2.78Å; K906-H910 PolarHBondContact O-N 2.8Å; K906-H910 VanDerWaalsContact O-N 3.08Å; K906-D924 IonicContact NZ-OD1 2.69Å; K906-D924 IonicContact NZ-OD2 3.7Å; K906-D924 PolarHBondContact NZ-OD2 2.99Å
907	I	62.6	Low	62.7	Low	27 Å²	27	79.7 Å²	79.7	14%	0.138	46%	0.459	C	S	.	.	H	α-helix	trans	-70.2	-39.5	-179.6	-70.7	167.1	0	0	0	111.5	L903 Q905 N909 H910 Q911 L962 L966	L903-I907 HydrophobicContact CD1-CD1 4.14Å; L903-I907 HydrophobicContact CG-CD1 3.98Å; L903-I907 WeakPolarHBondContact O-CD1 3.44Å; L903-I907 WeakPolarHBondContact O-CG1 3.4Å; L903-I907 PolarHBondContact O-N 3.31Å; Q905-I907 VanDerWaalsContact C-N 3.31Å; Q905-I907 PolarHBondContact O-N 3.35Å; I907-N909 VanDerWaalsContact C-N 3.3Å; I907-N909 PolarHBondContact O-N 2.71Å; I907-H910 PolarHBondContact O-N 3.18Å; I907-Q911 PolarHBondContact O-N 3.4Å; I907-L962 HydrophobicContact CB-CD2 4.43Å; I907-L962 HydrophobicContact CD1-CD1 4.34Å; I907-L962 HydrophobicContact CD1-CD2 3.59Å; I907-L962 HydrophobicContact CD1-CG 4.39Å; I907-L962 HydrophobicContact CG2-CD2 4.47Å; I907-L966 HydrophobicContact CD1-CD1 4.23Å; I907-L966 HydrophobicContact CG2-CD1 4.17Å; I907-L966 HydrophobicContact CG2-CD2 3.65Å; I907-L966 HydrophobicContact CG2-CG 3.87Å
908	Q	64.8	Low	60.4	Low	123 Å²	123	86 Å²	86	58%	0.575	48%	0.483	S	S	*	.	H	α-helix	trans	-62.5	-36.5	173.7	-73.4	176.8	1.8	0	0	112.5	D904 Q905 Q911	D904-Q908 WeakPolarHBondContact O-CG 3.3Å; D904-Q908 PolarHBondContact O-N 2.93Å; D904-Q908 VanDerWaalsContact O-N 3.14Å; Q905-Q908 PolarHBondContact O-N 3.05Å; Q908-Q911 PolarHBondContact O-N 2.94Å
909	N	59.9	Low	58	Low	104 Å²	104	90 Å²	90	56%	0.556	50%	0.5	S	S	*	.	H	α-helix	trans	-71.6	-35.4	176.7	-66.7	-15.7	0	0	0	112.4	Q905 K906 I907 Q911 Q912 D913	Q905-N909 VanDerWaalsContact O-CG 3.28Å; Q905-N909 PolarHBondContact O-N 3.5Å; Q905-N909 VanDerWaalsContact O-N 3.16Å; Q905-N909 PolarHBondContact O-ND2 3.02Å; K906-N909 PolarHBondContact O-N 2.96Å; I907-N909 VanDerWaalsContact C-N 3.3Å; I907-N909 PolarHBondContact O-N 2.71Å; N909-Q911 PolarHBondContact O-N 3.21Å; N909-Q912 PolarHBondContact O-N 2.89Å; N909-Q912 VanDerWaalsContact O-N 3.1Å; N909-D913 PolarHBondContact O-N 3.39Å
910	H	57	Low	56.4	Low	101 Å²	101	94 Å²	94	47%	0.468	52%	0.517	S	S	.	.	H	α-helix	trans	-65.7	-22.8	174.9	-85.1	-66.9	0	0	0	114	K906 I907 Q912 A916	K906-H910 PolarHBondContact O-CD2 2.78Å; K906-H910 PolarHBondContact O-N 2.8Å; K906-H910 VanDerWaalsContact O-N 3.08Å; I907-H910 PolarHBondContact O-N 3.18Å; H910-Q912 VanDerWaalsContact C-N 3.28Å; H910-A916 PolarHBondContact CE1-O 3.37Å; H910-A916 PolarHBondContact ND1-O 2.99Å
911	Q	52.8	Low	54.9	Low	122 Å²	122	97.5 Å²	97.5	57%	0.57	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-15.1	173.2	-73.5	-178.2	-16.6	0	0	113.3	I907 Q908 N909 S965	I907-Q911 PolarHBondContact O-N 3.4Å; Q908-Q911 PolarHBondContact O-N 2.94Å; N909-Q911 PolarHBondContact O-N 3.21Å; Q911-S965 PolarHBondContact NE2-O 2.96Å
912	Q	50.3	Low	53.3	Low	162 Å²	162	97.9 Å²	97.9	76%	0.757	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	-28.7	-179.2	-68.9	-174.2	-7.3	0	0	113.7	N909 H910	N909-Q912 PolarHBondContact O-N 2.89Å; N909-Q912 VanDerWaalsContact O-N 3.1Å; H910-Q912 VanDerWaalsContact C-N 3.28Å
913	D	41.2	Very low	51.8	Low	121 Å²	121	101 Å²	101	65%	0.647	55%	0.545	S	S	*	.			trans	-110.6	97.8	178.6	-84.9	-31.5	0	0	0	111.8	N909 N915	N909-D913 PolarHBondContact O-N 3.39Å; D913-N915 PolarHBondContact O-N 3.49Å
914	G	43	Very low	51.1	Low	81 Å²	81	101.5 Å²	101.5	84%	0.835	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	16.9	-177.7	0	0	0	0	0	116.9
915	N	34.2	Very low	50.6	Low	168 Å²	168	105.7 Å²	105.7	90%	0.898	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141.5	14	-172.2	-96.7	-14.5	0	0	0	116.6	D913	D913-N915 PolarHBondContact O-N 3.49Å
916	A	33.1	Very low	49.8	Very low	57 Å²	57	102.1 Å²	102.1	47%	0.471	55%	0.549	S	S	.	.			trans	-115.2	73.8	175.2	0	0	0	0	0	111.3	H910	H910-A916 PolarHBondContact CE1-O 3.37Å; H910-A916 PolarHBondContact ND1-O 2.99Å
917	A	38	Very low	49.6	Very low	98 Å²	98	101.4 Å²	101.4	81%	0.81	54%	0.544	S	S	*	.			trans	-114.3	59	-179.6	0	0	0	0	0	111.7
918	Q	39.3	Very low	50.1	Low	187 Å²	187	100.7 Å²	100.7	87%	0.874	54%	0.54	S	S	*	.	S	Bend	trans	-143.9	-6.5	168.2	-77.5	-158.8	-35.5	0	0	117.5
919	D	33.7	Very low	50.6	Low	143 Å²	143	101.7 Å²	101.7	77%	0.765	54%	0.539	S	S	*	.	S	Bend	trans	-116.5	105.9	179.1	-78.8	-30.1	0	0	0	114.3
920	E	49	Very low	51.4	Low	99 Å²	99	96.7 Å²	96.7	46%	0.463	51%	0.512	S	S	.	.			trans	58.5	64.6	141.5	-74.7	-77.2	-177.8	0	0	121.6	Q922 E923	E920-Q922 VanDerWaalsContact C-N 3.25Å; E920-E923 WeakPolarHBondContact OE2-CA 3.39Å; E920-E923 WeakPolarHBondContact OE2-CB 3.3Å; E920-E923 PolarHBondContact OE2-N 3.35Å
921	P	48.2	Very low	52.7	Low	81 Å²	81	92 Å²	92	53%	0.526	49%	0.49	S	S	.	.	S	Bend	trans	-80.4	-0.7	152	31.2	-31.9	0	0	0	113.4	K925	P921-K925 VanDerWaalsContact O-CD 3.27Å; P921-K925 WeakPolarHBondContact O-CD 3.15Å; P921-K925 WeakPolarHBondContact O-CE 3.49Å; P921-K925 WeakPolarHBondContact O-CG 3.41Å
922	Q	48.2	Very low	54.3	Low	63 Å²	63	86.7 Å²	86.7	29%	0.294	47%	0.466	S	S	.	.	H	α-helix	trans	-92.1	-46.1	-171.8	-161.5	94.7	-28.6	0	0	112	V659 E920 D924 K925 L926	V659-Q922 PolarHBondContact O-NE2 2.73Å; E920-Q922 VanDerWaalsContact C-N 3.25Å; Q922-D924 VanDerWaalsContact C-N 3.32Å; Q922-D924 PolarHBondContact O-N 3.11Å; Q922-K925 PolarHBondContact O-N 3.07Å; Q922-L926 HydrophobicContact CG-CD1 4.5Å; Q922-L926 WeakPolarHBondContact O-CG 3.27Å; Q922-L926 PolarHBondContact O-N 3.33Å
923	E	50	Low	55.9	Low	110 Å²	110	79.3 Å²	79.3	51%	0.514	43%	0.433	S	S	.	.	H	α-helix	trans	-62.6	-38.9	177.6	-173.7	173.8	-159.2	0	0	111.3	E920 K925 L926 R927	E920-E923 WeakPolarHBondContact OE2-CA 3.39Å; E920-E923 WeakPolarHBondContact OE2-CB 3.3Å; E920-E923 PolarHBondContact OE2-N 3.35Å; E923-K925 PolarHBondContact O-N 3.39Å; E923-L926 PolarHBondContact O-N 3.46Å; E923-R927 VanDerWaalsContact O-CB 3.25Å; E923-R927 WeakPolarHBondContact O-CB 3.42Å; E923-R927 PolarHBondContact O-N 3.34Å
924	D	55.8	Low	58.1	Low	31 Å²	31	73.5 Å²	73.5	17%	0.166	40%	0.402	C	S	.	.	H	α-helix	trans	-67	-35	175.8	-79.7	-24.3	0	0	0	112.5	L903 K906 Q922 R927 L928	L903-D924 HydrophobicContact CD1-CB 4.32Å; K906-D924 IonicContact NZ-OD1 2.69Å; K906-D924 IonicContact NZ-OD2 3.7Å; K906-D924 PolarHBondContact NZ-OD2 2.99Å; Q922-D924 VanDerWaalsContact C-N 3.32Å; Q922-D924 PolarHBondContact O-N 3.11Å; D924-R927 WeakPolarHBondContact O-CB 3.49Å; D924-L928 PolarHBondContact O-N 3.28Å; D924-L928 VanDerWaalsContact O-N 3.11Å
925	K	60	Low	60.4	Low	127 Å²	127	70.2 Å²	70.2	55%	0.552	37%	0.365	S	S	*	.	H	α-helix	trans	-68.5	-43.3	173.1	-73.9	172.3	-171.9	175.1	0	111.8	P921 Q922 E923 R927 L928 R929	P921-K925 VanDerWaalsContact O-CD 3.27Å; P921-K925 WeakPolarHBondContact O-CD 3.15Å; P921-K925 WeakPolarHBondContact O-CE 3.49Å; P921-K925 WeakPolarHBondContact O-CG 3.41Å; Q922-K925 PolarHBondContact O-N 3.07Å; E923-K925 PolarHBondContact O-N 3.39Å; K925-R927 VanDerWaalsContact C-N 3.33Å; K925-L928 PolarHBondContact O-N 3.49Å; K925-R929 PolarHBondContact O-N 3.39Å; K925-R929 VanDerWaalsContact O-N 3.16Å
926	L	55.8	Low	62.9	Low	48 Å²	48	62.3 Å²	62.3	25%	0.251	32%	0.323	S	S	.	.	H	α-helix	trans	-65.7	-36.8	176.2	-70.3	171.2	0	0	0	111.7	V659 L660 Q922 E923 L928 R929	V659-L926 HydrophobicContact CG1-CD2 4.09Å; L660-L926 HydrophobicContact CD2-CD1 3.94Å; Q922-L926 HydrophobicContact CG-CD1 4.5Å; Q922-L926 WeakPolarHBondContact O-CG 3.27Å; Q922-L926 PolarHBondContact O-N 3.33Å; E923-L926 PolarHBondContact O-N 3.46Å; L926-L928 VanDerWaalsContact C-N 3.34Å; L926-R929 PolarHBondContact O-N 2.89Å
927	R	64.6	Low	65.5	Low	77 Å²	77	60.3 Å²	60.3	29%	0.291	30%	0.304	S	S	.	.	H	α-helix	trans	-58.3	-45.4	172.2	-172.3	176.4	173.3	-171.3	-3.9	111.9	P828 E923 D924 K925 L931	P828-R927 HydrophobicContact CB-CB 4.28Å; P828-R927 HydrophobicContact CG-CB 3.79Å; P828-R927 HydrophobicContact CG-CG 4.02Å; E923-R927 VanDerWaalsContact O-CB 3.25Å; E923-R927 WeakPolarHBondContact O-CB 3.42Å; E923-R927 PolarHBondContact O-N 3.34Å; D924-R927 WeakPolarHBondContact O-CB 3.49Å; K925-R927 VanDerWaalsContact C-N 3.33Å; R927-L931 WeakPolarHBondContact O-CB 3.22Å; R927-L931 PolarHBondContact O-N 3.42Å
928	L	72.4	Confident	67.9	Low	12 Å²	12	55.7 Å²	55.7	6%	0.063	27%	0.266	C	S	.	.	H	α-helix	trans	-66.9	-38.1	-178.8	-159.3	72.7	0	0	0	111.7	L896 L900 D924 K925 L926 L931 V932 M959	L896-L928 HydrophobicContact CD1-CD1 3.95Å; L900-L928 HydrophobicContact CD2-CD1 3.92Å; L900-L928 HydrophobicContact CD2-CD2 3.88Å; L900-L928 HydrophobicContact CG-CD1 4.29Å; D924-L928 PolarHBondContact O-N 3.28Å; D924-L928 VanDerWaalsContact O-N 3.11Å; K925-L928 PolarHBondContact O-N 3.49Å; L926-L928 VanDerWaalsContact C-N 3.34Å; L928-L931 PolarHBondContact O-N 3.02Å; L928-V932 HydrophobicContact CD1-CG2 4.34Å; L928-V932 HydrophobicContact CG-CG2 3.99Å; L928-V932 VanDerWaalsContact O-CB 3.29Å; L928-V932 WeakPolarHBondContact O-CB 3.37Å; L928-V932 WeakPolarHBondContact O-CG2 3.16Å; L928-V932 PolarHBondContact O-N 2.98Å; L928-M959 HydrophobicContact CD2-CG 4.23Å; L928-M959 HydrophobicContact CD2-SD 3.93Å
929	R	76.1	Confident	70.2	Confident	143 Å²	143	47.4 Å²	47.4	54%	0.54	23%	0.227	S	C	.	.	H	α-helix	trans	-56.7	-55.8	179.8	-178	-173.2	173.4	-179.8	-1.1	112.6	E832 K925 L926 L931 G933	E832-R929 WeakPolarHBondContact OE1-CG 3.28Å; E832-R929 IonicContact OE1-NE 3.12Å; K925-R929 PolarHBondContact O-N 3.39Å; K925-R929 VanDerWaalsContact O-N 3.16Å; L926-R929 PolarHBondContact O-N 2.89Å; R929-L931 PolarHBondContact O-N 3.46Å; R929-G933 PolarHBondContact O-N 2.92Å
930	G	76.2	Confident	72.8	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-65.8	-39.2	-177.6	0	0	0	0	0	112.4	E832 C934	E832-G930 WeakPolarHBondContact OE1-CA 3.21Å; E832-G930 PolarHBondContact OE1-N 3.01Å; G930-C934 WeakPolarHBondContact O-CB 3.36Å; G930-C934 PolarHBondContact O-N 2.98Å; G930-C934 PolarHBondContact O-SG 3.03Å
931	L	85.4	Confident	74.5	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-65.3	-50.7	178.8	178.6	65.9	0	0	0	112.1	L825 Y892 V895 L896 R927 L928 R929 G933 C934 Y935	L825-L931 HydrophobicContact CB-CD1 4.15Å; L825-L931 HydrophobicContact CD2-CD1 3.94Å; L825-L931 HydrophobicContact CG-CD1 4.45Å; Y892-L931 HydrophobicContact CD1-CD1 4.05Å; Y892-L931 HydrophobicContact CE1-CD1 4.33Å; V895-L931 HydrophobicContact CG1-CD1 4.26Å; V895-L931 HydrophobicContact CG1-CD2 3.87Å; L896-L931 HydrophobicContact CB-CD2 4.48Å; L896-L931 HydrophobicContact CD1-CD2 4.41Å; R927-L931 WeakPolarHBondContact O-CB 3.22Å; R927-L931 PolarHBondContact O-N 3.42Å; L928-L931 PolarHBondContact O-N 3.02Å; R929-L931 PolarHBondContact O-N 3.46Å; L931-G933 VanDerWaalsContact C-N 3.32Å; L931-G933 PolarHBondContact O-N 3.43Å; L931-C934 PolarHBondContact O-N 3.44Å; L931-Y935 PolarHBondContact O-N 3.12Å
932	V	85.7	Confident	76.4	Confident	12 Å²	12	40.7 Å²	40.7	7%	0.073	18%	0.183	C	C	.	.	H	α-helix	trans	-62	-42.3	178.7	172	0	0	0	0	110.2	L896 L928 Y935 A936 V951 Y952 A955	L896-V932 HydrophobicContact CD1-CG2 3.67Å; L928-V932 HydrophobicContact CD1-CG2 4.34Å; L928-V932 HydrophobicContact CG-CG2 3.99Å; L928-V932 VanDerWaalsContact O-CB 3.29Å; L928-V932 WeakPolarHBondContact O-CB 3.37Å; L928-V932 WeakPolarHBondContact O-CG2 3.16Å; L928-V932 PolarHBondContact O-N 2.98Å; V932-Y935 PolarHBondContact O-N 3Å; V932-A936 VanDerWaalsContact O-CB 3.24Å; V932-A936 WeakPolarHBondContact O-CB 3.47Å; V932-A936 PolarHBondContact O-N 3.27Å; V932-V951 HydrophobicContact CG1-CG1 4.32Å; V932-Y952 HydrophobicContact CG1-CD1 3.58Å; V932-Y952 HydrophobicContact CG1-CE1 3.7Å; V932-A955 HydrophobicContact CG1-CB 4.12Å; V932-A955 HydrophobicContact CG2-CB 3.75Å
933	G	83.6	Confident	78.2	Confident	6 Å²	6	41.4 Å²	41.4	6%	0.062	19%	0.191	C	C	.	.	H	α-helix	trans	-60.3	-45.9	175.3	0	0	0	0	0	113	L835 R929 L931 L937	L835-G933 VanDerWaalsContact CD1-C 3.48Å; L835-G933 WeakPolarHBondContact CD1-O 3.29Å; R929-G933 PolarHBondContact O-N 2.92Å; L931-G933 VanDerWaalsContact C-N 3.32Å; L931-G933 PolarHBondContact O-N 3.43Å; G933-L937 WeakPolarHBondContact O-CB 3.44Å; G933-L937 PolarHBondContact O-N 2.9Å
934	C	87.7	Confident	79.9	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61	-47.2	175.5	-73.8	0	0	0	0	112	C831 L864 L867 Y892 G930 L931 F938	C831-C934 PolarHBondContact O-SG 2.91Å; L864-C934 HydrophobicContact CD2-CB 3.94Å; L867-C934 HydrophobicContact CD2-CB 4.42Å; Y892-C934 HydrophobicContact CE1-CB 3.84Å; G930-C934 WeakPolarHBondContact O-CB 3.36Å; G930-C934 PolarHBondContact O-N 2.98Å; G930-C934 PolarHBondContact O-SG 3.03Å; L931-C934 PolarHBondContact O-N 3.44Å; C934-F938 VanDerWaalsContact O-CB 3.26Å; C934-F938 WeakPolarHBondContact O-CB 3.47Å; C934-F938 PolarHBondContact O-N 2.92Å
935	Y	90.9	Very high	81.1	Confident	12 Å²	12	41.6 Å²	41.6	5%	0.047	20%	0.198	C	C	.	.	H	α-helix	trans	-68.4	-43	-176.8	-176.1	-151.6	0	0	0	112.1	R889 Y892 D893 L896 L931 V932 F938 Q939 V951	R889-Y935 HydrophobicContact CG-CE2 4.35Å; Y892-Y935 HydrophobicContact CD1-CD2 4.35Å; Y892-Y935 HydrophobicContact CD1-CG 4.29Å; Y892-Y935 HydrophobicContact CD2-CD2 4.2Å; Y892-Y935 AromaticContact CG-CD2 3.76Å; Y892-Y935 HydrophobicContact CG-CD2 3.76Å; Y892-Y935 HydrophobicContact CG-CE2 4.45Å; Y892-Y935 HydrophobicContact CG-CG 4.12Å; D893-Y935 PolarHBondContact OD1-OH 3.13Å; L896-Y935 HydrophobicContact CD2-CD1 3.84Å; L896-Y935 HydrophobicContact CD2-CE1 4.08Å; L931-Y935 PolarHBondContact O-N 3.12Å; V932-Y935 PolarHBondContact O-N 3Å; Y935-F938 WeakPolarHBondContact O-CB 3.33Å; Y935-F938 PolarHBondContact O-N 3.44Å; Y935-Q939 HydrophobicContact CD2-CG 3.81Å; Y935-Q939 HydrophobicContact CE2-CG 3.55Å; Y935-Q939 WeakPolarHBondContact O-CB 3.42Å; Y935-Q939 WeakPolarHBondContact O-CG 3.49Å; Y935-Q939 PolarHBondContact O-N 3.47Å; Y935-Q939 PolarHBondContact OH-NE2 3.32Å; Y935-V951 HydrophobicContact CD1-CB 4.15Å; Y935-V951 HydrophobicContact CD1-CG1 3.39Å; Y935-V951 HydrophobicContact CD1-CG2 3.55Å; Y935-V951 HydrophobicContact CE1-CB 4.4Å; Y935-V951 HydrophobicContact CE1-CG1 4.05Å; Y935-V951 HydrophobicContact CE1-CG2 3.44Å; Y935-V951 VanDerWaalsContact CE1-CG2 3.44Å; Y935-V951 HydrophobicContact CE2-CG2 4.5Å; Y935-V951 HydrophobicContact CG-CG1 4.03Å; Y935-V951 HydrophobicContact CG-CG2 4.15Å
936	A	87	Confident	82.1	Confident	2 Å²	2	41.5 Å²	41.5	2%	0.017	20%	0.2	C	C	.	.	H	α-helix	trans	-63.9	-42.7	177.3	0	0	0	0	0	111.7	V932 Q939 Y940 A948 V951 Y952	V932-A936 VanDerWaalsContact O-CB 3.24Å; V932-A936 WeakPolarHBondContact O-CB 3.47Å; V932-A936 PolarHBondContact O-N 3.27Å; A936-Q939 PolarHBondContact O-N 3.41Å; A936-Y940 WeakPolarHBondContact O-CB 3.48Å; A936-Y940 PolarHBondContact O-N 3.2Å; A936-A948 HydrophobicContact CB-CB 4.39Å; A936-A948 VanDerWaalsContact O-CB 3.24Å; A936-A948 WeakPolarHBondContact O-CB 3.46Å; A936-V951 HydrophobicContact CB-CB 4.38Å; A936-V951 HydrophobicContact CB-CG1 4.22Å; A936-Y952 HydrophobicContact CB-CD2 3.79Å; A936-Y952 HydrophobicContact CB-CE1 4.06Å; A936-Y952 HydrophobicContact CB-CE2 3.27Å; A936-Y952 HydrophobicContact CB-CG 4.38Å; A936-Y952 VanDerWaalsContact CB-CZ 3.41Å
937	L	86.9	Confident	83.4	Confident	15 Å²	15	40.3 Å²	40.3	8%	0.079	20%	0.197	C	C	.	.	H	α-helix	trans	-64.6	-40.2	174.6	-176.7	60.3	0	0	0	111.7	L835 S838 Q839 L864 G933 Q939 Y940 L941	L835-L937 HydrophobicContact CD1-CB 4.39Å; L835-L937 HydrophobicContact CD1-CD2 4.01Å; S838-L937 VanDerWaalsContact OG-CD2 3.31Å; S838-L937 WeakPolarHBondContact OG-CD2 3.41Å; Q839-L937 HydrophobicContact CG-CD2 3.8Å; L864-L937 HydrophobicContact CD1-CB 4.4Å; L864-L937 HydrophobicContact CD1-CD2 4.3Å; L864-L937 HydrophobicContact CD1-CG 4.15Å; G933-L937 WeakPolarHBondContact O-CB 3.44Å; G933-L937 PolarHBondContact O-N 2.9Å; L937-Q939 PolarHBondContact O-N 3.45Å; L937-Y940 HydrophobicContact CD1-CD1 4.27Å; L937-Y940 WeakPolarHBondContact O-CB 3.16Å; L937-Y940 PolarHBondContact O-N 2.99Å; L937-L941 HydrophobicContact CD1-CD1 4.23Å; L937-L941 HydrophobicContact CD1-CG 4.24Å; L937-L941 HydrophobicContact CG-CD1 4.12Å; L937-L941 WeakPolarHBondContact O-CG 3.46Å; L937-L941 PolarHBondContact O-N 3.5Å
938	F	89.1	Confident	84.3	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61.2	-43.1	174.9	-179	-101	0	0	0	112.1	V861 L864 I885 A888 R889 Y892 C934 Y935 L941 T942	V861-F938 HydrophobicContact CG1-CE2 4.31Å; L864-F938 HydrophobicContact CB-CB 4.48Å; L864-F938 HydrophobicContact CB-CD2 3.84Å; L864-F938 HydrophobicContact CD1-CB 4Å; L864-F938 HydrophobicContact CD1-CD2 4.42Å; I885-F938 HydrophobicContact CG2-CE2 4.41Å; I885-F938 HydrophobicContact CG2-CZ 3.75Å; A888-F938 HydrophobicContact CB-CE2 4.44Å; A888-F938 HydrophobicContact CB-CZ 3.99Å; R889-F938 HydrophobicContact CB-CE1 3.94Å; R889-F938 HydrophobicContact CG-CE1 4.45Å; Y892-F938 HydrophobicContact CD2-CD1 4.22Å; Y892-F938 HydrophobicContact CD2-CG 4.45Å; Y892-F938 HydrophobicContact CE2-CB 4.43Å; Y892-F938 HydrophobicContact CE2-CD1 4.39Å; Y892-F938 HydrophobicContact CE2-CD2 4.45Å; Y892-F938 HydrophobicContact CE2-CG 4.18Å; C934-F938 VanDerWaalsContact O-CB 3.26Å; C934-F938 WeakPolarHBondContact O-CB 3.47Å; C934-F938 PolarHBondContact O-N 2.92Å; Y935-F938 WeakPolarHBondContact O-CB 3.33Å; Y935-F938 PolarHBondContact O-N 3.44Å; F938-L941 PolarHBondContact O-N 3.23Å; F938-T942 HydrophobicContact CD2-CG2 4.14Å; F938-T942 HydrophobicContact CE1-CG2 4.38Å; F938-T942 HydrophobicContact CE2-CG2 3.88Å; F938-T942 HydrophobicContact CZ-CG2 4.03Å; F938-T942 WeakPolarHBondContact O-CB 3.41Å; F938-T942 VanDerWaalsContact O-CG2 3.31Å; F938-T942 WeakPolarHBondContact O-CG2 3.43Å; F938-T942 PolarHBondContact O-N 3.24Å; F938-T942 PolarHBondContact O-OG1 3.42Å
939	Q	88.2	Confident	84.7	Confident	14 Å²	14	38.9 Å²	38.9	7%	0.065	20%	0.196	C	C	.	.	H	α-helix	trans	-67.8	-36.4	175.8	-71.4	-71.3	9	0	0	112.3	Y935 A936 L937 V943 S944 A947 V951	Y935-Q939 HydrophobicContact CD2-CG 3.81Å; Y935-Q939 HydrophobicContact CE2-CG 3.55Å; Y935-Q939 WeakPolarHBondContact O-CB 3.42Å; Y935-Q939 WeakPolarHBondContact O-CG 3.49Å; Y935-Q939 PolarHBondContact O-N 3.47Å; Y935-Q939 PolarHBondContact OH-NE2 3.32Å; A936-Q939 PolarHBondContact O-N 3.41Å; L937-Q939 PolarHBondContact O-N 3.45Å; Q939-V943 WeakPolarHBondContact O-CA 3.19Å; Q939-V943 WeakPolarHBondContact O-CB 3.46Å; Q939-V943 PolarHBondContact O-N 3.2Å; Q939-S944 PolarHBondContact O-N 3.2Å; Q939-A947 HydrophobicContact CB-CB 3.98Å; Q939-V951 HydrophobicContact CG-CG2 3.98Å
940	Y	87.5	Confident	85.1	Confident	116 Å²	116	34.8 Å²	34.8	46%	0.455	19%	0.193	S	C	.	.	H	α-helix	trans	-60.6	-47.6	173.8	175.9	-107.8	0	0	0	111.7	A936 L937 I945	A936-Y940 WeakPolarHBondContact O-CB 3.48Å; A936-Y940 PolarHBondContact O-N 3.2Å; L937-Y940 HydrophobicContact CD1-CD1 4.27Å; L937-Y940 WeakPolarHBondContact O-CB 3.16Å; L937-Y940 PolarHBondContact O-N 2.99Å; Y940-I945 HydrophobicContact CD2-CB 4.09Å; Y940-I945 HydrophobicContact CD2-CG1 4.35Å; Y940-I945 HydrophobicContact CE2-CB 4.15Å; Y940-I945 HydrophobicContact CE2-CG1 4.39Å
941	L	86	Confident	85.5	Confident	38 Å²	38	35 Å²	35	20%	0.199	19%	0.194	C	C	.	.	H	α-helix	trans	-75.9	-29	-176.9	-65.2	174.6	0	0	0	113.7	V842 A860 V861 L864 L937 F938	V842-L941 HydrophobicContact CG2-CD1 3.88Å; V842-L941 HydrophobicContact CG2-CD2 3.88Å; V842-L941 HydrophobicContact CG2-CG 4.48Å; A860-L941 HydrophobicContact CB-CD1 3.89Å; V861-L941 HydrophobicContact CG2-CB 3.83Å; V861-L941 HydrophobicContact CG2-CD1 4.04Å; L864-L941 HydrophobicContact CD1-CD1 4.4Å; L937-L941 HydrophobicContact CD1-CD1 4.23Å; L937-L941 HydrophobicContact CD1-CG 4.24Å; L937-L941 HydrophobicContact CG-CD1 4.12Å; L937-L941 WeakPolarHBondContact O-CG 3.46Å; L937-L941 PolarHBondContact O-N 3.5Å; F938-L941 PolarHBondContact O-N 3.23Å
942	T	86.9	Confident	85.3	Confident	28 Å²	28	40.8 Å²	40.8	17%	0.172	22%	0.217	C	C	.	.	H	α-helix	trans	-103.6	-17.9	-174.8	64.5	0	0	0	0	114.7	V855 V861 I885 R889 F938	V855-T942 HydrophobicContact CG1-CG2 4.03Å; V861-T942 HydrophobicContact CG1-CG2 3.96Å; V861-T942 HydrophobicContact CG2-CG2 4.48Å; I885-T942 HydrophobicContact CG2-CG2 3.93Å; R889-T942 PolarHBondContact NH2-OG1 3.01Å; F938-T942 HydrophobicContact CD2-CG2 4.14Å; F938-T942 HydrophobicContact CE1-CG2 4.38Å; F938-T942 HydrophobicContact CE2-CG2 3.88Å; F938-T942 HydrophobicContact CZ-CG2 4.03Å; F938-T942 WeakPolarHBondContact O-CB 3.41Å; F938-T942 VanDerWaalsContact O-CG2 3.31Å; F938-T942 WeakPolarHBondContact O-CG2 3.43Å; F938-T942 PolarHBondContact O-N 3.24Å; F938-T942 PolarHBondContact O-OG1 3.42Å
943	V	86.5	Confident	85	Confident	77 Å²	77	41.1 Å²	41.1	47%	0.467	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-129.9	-77.3	-178.5	-173.6	0	0	0	0	111.1	Q939 A947	Q939-V943 WeakPolarHBondContact O-CA 3.19Å; Q939-V943 WeakPolarHBondContact O-CB 3.46Å; Q939-V943 PolarHBondContact O-N 3.2Å; V943-A947 HydrophobicContact CB-CB 3.9Å; V943-A947 HydrophobicContact CG1-CB 3.89Å
944	S	84.6	Confident	85	Confident	46 Å²	46	44 Å²	44	32%	0.322	23%	0.232	S	C	.	.			trans	-174.7	168.7	-174.7	70.3	0	0	0	0	111.9	Q939 Q946 A947 A948	Q939-S944 PolarHBondContact O-N 3.2Å; S944-Q946 VanDerWaalsContact C-N 3.27Å; S944-Q946 PolarHBondContact O-N 3.14Å; S944-Q946 PolarHBondContact OG-N 3.14Å; S944-A947 PolarHBondContact O-N 3.37Å; S944-A947 PolarHBondContact OG-N 2.95Å; S944-A948 PolarHBondContact O-N 2.99Å
945	I	80.8	Confident	84.6	Confident	99 Å²	99	44.2 Å²	44.2	51%	0.508	23%	0.233	S	C	.	.	H	α-helix	trans	-60.4	-32.7	170.1	-163.4	165.7	0	0	0	113.6	Y940 A947 A948 I949	Y940-I945 HydrophobicContact CD2-CB 4.09Å; Y940-I945 HydrophobicContact CD2-CG1 4.35Å; Y940-I945 HydrophobicContact CE2-CB 4.15Å; Y940-I945 HydrophobicContact CE2-CG1 4.39Å; I945-A947 VanDerWaalsContact C-N 3.34Å; I945-A948 PolarHBondContact O-N 3.2Å; I945-I949 HydrophobicContact CG1-CD1 4.22Å; I945-I949 VanDerWaalsContact O-CG1 3.3Å; I945-I949 WeakPolarHBondContact O-CG1 3.28Å; I945-I949 PolarHBondContact O-N 2.98Å
946	Q	81.7	Confident	83.8	Confident	126 Å²	126	45.9 Å²	45.9	59%	0.589	24%	0.239	S	C	*	.	H	α-helix	trans	-67.9	-37.6	179.4	-65	-60.4	-28.6	0	0	111.4	S944 I949 A950	S944-Q946 VanDerWaalsContact C-N 3.27Å; S944-Q946 PolarHBondContact O-N 3.14Å; S944-Q946 PolarHBondContact OG-N 3.14Å; Q946-I949 PolarHBondContact O-N 3.02Å; Q946-A950 PolarHBondContact O-N 3.48Å
947	A	84.3	Confident	83.3	Confident	22 Å²	22	51.7 Å²	51.7	18%	0.182	27%	0.266	C	S	.	.	H	α-helix	trans	-65.8	-39.4	175.2	0	0	0	0	0	111.6	Q939 V943 S944 I945 A950 V951	Q939-A947 HydrophobicContact CB-CB 3.98Å; V943-A947 HydrophobicContact CB-CB 3.9Å; V943-A947 HydrophobicContact CG1-CB 3.89Å; S944-A947 PolarHBondContact O-N 3.37Å; S944-A947 PolarHBondContact OG-N 2.95Å; I945-A947 VanDerWaalsContact C-N 3.34Å; A947-A950 PolarHBondContact O-N 2.95Å; A947-V951 WeakPolarHBondContact O-CG2 3.36Å; A947-V951 PolarHBondContact O-N 3.12Å
948	A	83	Confident	82.5	Confident	9 Å²	9	56.2 Å²	56.2	7%	0.074	28%	0.282	C	S	.	.	H	α-helix	trans	-64.9	-42.1	174.5	0	0	0	0	0	112.4	A936 S944 I945 A950 V951 Y952	A936-A948 HydrophobicContact CB-CB 4.39Å; A936-A948 VanDerWaalsContact O-CB 3.24Å; A936-A948 WeakPolarHBondContact O-CB 3.46Å; S944-A948 PolarHBondContact O-N 2.99Å; I945-A948 PolarHBondContact O-N 3.2Å; A948-A950 VanDerWaalsContact C-N 3.33Å; A948-A950 PolarHBondContact O-N 2.69Å; A948-V951 PolarHBondContact O-N 3.09Å; A948-Y952 VanDerWaalsContact O-CD2 3.26Å; A948-Y952 WeakPolarHBondContact O-CD2 3.48Å; A948-Y952 PolarHBondContact O-N 2.7Å
949	I	79.8	Confident	81.4	Confident	50 Å²	50	60.1 Å²	60.1	26%	0.256	30%	0.301	S	S	.	.	H	α-helix	trans	-60	-44.9	175.1	-69.1	165.3	0	0	0	110.3	I945 Q946 V951 Y952 S953 V985	I945-I949 HydrophobicContact CG1-CD1 4.22Å; I945-I949 VanDerWaalsContact O-CG1 3.3Å; I945-I949 WeakPolarHBondContact O-CG1 3.28Å; I945-I949 PolarHBondContact O-N 2.98Å; Q946-I949 PolarHBondContact O-N 3.02Å; I949-V951 VanDerWaalsContact C-N 3.3Å; I949-V951 PolarHBondContact O-N 2.97Å; I949-Y952 PolarHBondContact O-N 2.7Å; I949-Y952 VanDerWaalsContact O-N 3.13Å; I949-S953 PolarHBondContact O-N 2.6Å; I949-S953 PolarHBondContact O-OG 3.14Å; I949-S953 VanDerWaalsContact O-OG 3.07Å; I949-V985 HydrophobicContact CG2-CG1 4.41Å
950	A	85	Confident	80.3	Confident	58 Å²	58	61 Å²	61	48%	0.479	31%	0.305	S	S	.	.	H	α-helix	trans	-58.2	-40.3	179.1	0	0	0	0	0	112.9	Q946 A947 A948 S953 Q954	Q946-A950 PolarHBondContact O-N 3.48Å; A947-A950 PolarHBondContact O-N 2.95Å; A948-A950 VanDerWaalsContact C-N 3.33Å; A948-A950 PolarHBondContact O-N 2.69Å; A950-S953 PolarHBondContact O-N 3.36Å; A950-Q954 WeakPolarHBondContact O-CB 3.48Å; A950-Q954 PolarHBondContact O-N 3.04Å
951	V	84.2	Confident	79.2	Confident	5 Å²	5	60.1 Å²	60.1	3%	0.03	31%	0.305	C	S	.	.	H	α-helix	trans	-62.6	-46.3	175	173.2	0	0	0	0	111.4	L896 V932 Y935 A936 Q939 A947 A948 I949 Q954 A955	L896-V951 HydrophobicContact CD2-CG1 4.17Å; V932-V951 HydrophobicContact CG1-CG1 4.32Å; Y935-V951 HydrophobicContact CD1-CB 4.15Å; Y935-V951 HydrophobicContact CD1-CG1 3.39Å; Y935-V951 HydrophobicContact CD1-CG2 3.55Å; Y935-V951 HydrophobicContact CE1-CB 4.4Å; Y935-V951 HydrophobicContact CE1-CG1 4.05Å; Y935-V951 HydrophobicContact CE1-CG2 3.44Å; Y935-V951 VanDerWaalsContact CE1-CG2 3.44Å; Y935-V951 HydrophobicContact CE2-CG2 4.5Å; Y935-V951 HydrophobicContact CG-CG1 4.03Å; Y935-V951 HydrophobicContact CG-CG2 4.15Å; A936-V951 HydrophobicContact CB-CB 4.38Å; A936-V951 HydrophobicContact CB-CG1 4.22Å; Q939-V951 HydrophobicContact CG-CG2 3.98Å; A947-V951 WeakPolarHBondContact O-CG2 3.36Å; A947-V951 PolarHBondContact O-N 3.12Å; A948-V951 PolarHBondContact O-N 3.09Å; I949-V951 VanDerWaalsContact C-N 3.3Å; I949-V951 PolarHBondContact O-N 2.97Å; V951-Q954 PolarHBondContact O-N 2.7Å; V951-A955 PolarHBondContact O-N 3.24Å; V951-A955 VanDerWaalsContact O-N 3.11Å
952	Y	82	Confident	78	Confident	121 Å²	121	59 Å²	59	48%	0.475	30%	0.3	S	S	.	.	H	α-helix	trans	-64	-41.8	176.9	-76.4	-60	0	0	0	112.1	V932 A936 A948 I949 A955 R956	V932-Y952 HydrophobicContact CG1-CD1 3.58Å; V932-Y952 HydrophobicContact CG1-CE1 3.7Å; A936-Y952 HydrophobicContact CB-CD2 3.79Å; A936-Y952 HydrophobicContact CB-CE1 4.06Å; A936-Y952 HydrophobicContact CB-CE2 3.27Å; A936-Y952 HydrophobicContact CB-CG 4.38Å; A936-Y952 VanDerWaalsContact CB-CZ 3.41Å; A948-Y952 VanDerWaalsContact O-CD2 3.26Å; A948-Y952 WeakPolarHBondContact O-CD2 3.48Å; A948-Y952 PolarHBondContact O-N 2.7Å; I949-Y952 PolarHBondContact O-N 2.7Å; I949-Y952 VanDerWaalsContact O-N 3.13Å; Y952-A955 PolarHBondContact O-N 2.86Å; Y952-R956 VanDerWaalsContact O-CB 3.23Å; Y952-R956 WeakPolarHBondContact O-CB 3.44Å; Y952-R956 PolarHBondContact O-N 3.39Å
953	S	80.1	Confident	76.6	Confident	20 Å²	20	61.8 Å²	61.8	14%	0.14	31%	0.31	C	S	.	.	H	α-helix	trans	-62.3	-44.6	176.7	-60	0	0	0	0	111.4	I949 A950 A955 R956 E957 H989	I949-S953 PolarHBondContact O-N 2.6Å; I949-S953 PolarHBondContact O-OG 3.14Å; I949-S953 VanDerWaalsContact O-OG 3.07Å; A950-S953 PolarHBondContact O-N 3.36Å; S953-A955 PolarHBondContact O-N 3.11Å; S953-R956 PolarHBondContact O-N 2.9Å; S953-E957 WeakPolarHBondContact O-CB 3.41Å; S953-E957 WeakPolarHBondContact O-CG 3.05Å; S953-E957 PolarHBondContact O-N 3.25Å; S953-H989 PolarHBondContact OG-NE2 3.43Å
954	Q	81.9	Confident	75.2	Confident	67 Å²	67	66.4 Å²	66.4	31%	0.313	32%	0.32	S	S	.	.	H	α-helix	trans	-59.8	-46.9	177.3	-177.4	-175.1	15.5	0	0	112.4	A950 V951 R956 R958	A950-Q954 WeakPolarHBondContact O-CB 3.48Å; A950-Q954 PolarHBondContact O-N 3.04Å; V951-Q954 PolarHBondContact O-N 2.7Å; Q954-R956 VanDerWaalsContact C-N 3.31Å; Q954-R956 PolarHBondContact O-N 2.71Å; Q954-R958 WeakPolarHBondContact O-CG 3.11Å; Q954-R958 PolarHBondContact O-N 2.96Å
955	A	79.4	Confident	73.9	Confident	3 Å²	3	66.8 Å²	66.8	3%	0.025	32%	0.322	C	S	.	.	H	α-helix	trans	-64.2	-40	177.7	0	0	0	0	0	111.4	V932 V951 Y952 S953 M959	V932-A955 HydrophobicContact CG1-CB 4.12Å; V932-A955 HydrophobicContact CG2-CB 3.75Å; V951-A955 PolarHBondContact O-N 3.24Å; V951-A955 VanDerWaalsContact O-N 3.11Å; Y952-A955 PolarHBondContact O-N 2.86Å; S953-A955 PolarHBondContact O-N 3.11Å; A955-M959 WeakPolarHBondContact O-CE 3.41Å; A955-M959 WeakPolarHBondContact O-CG 3.22Å; A955-M959 PolarHBondContact O-N 3.08Å; A955-M959 VanDerWaalsContact O-N 3.14Å
956	R	74.3	Confident	72.3	Confident	47 Å²	47	66.4 Å²	66.4	18%	0.177	32%	0.321	C	S	.	.	H	α-helix	trans	-68.2	-52	-178.8	178.1	178.4	163.5	-141.6	-22.8	113.1	Y952 S953 Q954 R958 M959 E960 W992	Y952-R956 VanDerWaalsContact O-CB 3.23Å; Y952-R956 WeakPolarHBondContact O-CB 3.44Å; Y952-R956 PolarHBondContact O-N 3.39Å; S953-R956 PolarHBondContact O-N 2.9Å; Q954-R956 VanDerWaalsContact C-N 3.31Å; Q954-R956 PolarHBondContact O-N 2.71Å; R956-R958 PolarHBondContact O-N 2.55Å; R956-M959 PolarHBondContact O-N 2.91Å; R956-E960 HydrophobicContact CG-CG 4.35Å; R956-E960 WeakPolarHBondContact CG-OE1 3.3Å; R956-E960 IonicContact CZ-OE1 2.77Å; R956-E960 IonicContact NE-OE1 3.14Å; R956-E960 PolarHBondContact NE-OE1 3.24Å; R956-E960 IonicContact NH2-OE1 2.68Å; R956-E960 PolarHBondContact NH2-OE1 2.97Å; R956-E960 WeakPolarHBondContact O-CG 3.42Å; R956-E960 PolarHBondContact O-N 2.77Å; R956-W992 HydrophobicContact CG-CE3 4.4Å; R956-W992 HydrophobicContact CG-CH2 4.07Å; R956-W992 HydrophobicContact CG-CZ2 4.46Å; R956-W992 HydrophobicContact CG-CZ3 4.05Å; R956-W992 VanDerWaalsContact NE-CD2 3.28Å
957	E	76.2	Confident	70.3	Confident	124 Å²	124	63.9 Å²	63.9	58%	0.579	31%	0.314	S	S	*	.	H	α-helix	trans	-55.1	-38	-179.2	-75.3	172.3	-170.9	0	0	111.4	S953 E960 E961	S953-E957 WeakPolarHBondContact O-CB 3.41Å; S953-E957 WeakPolarHBondContact O-CG 3.05Å; S953-E957 PolarHBondContact O-N 3.25Å; E957-E960 PolarHBondContact O-N 3.05Å; E957-E961 WeakPolarHBondContact O-CB 3.23Å; E957-E961 PolarHBondContact O-N 3.47Å
958	R	70.5	Confident	68.2	Low	110 Å²	110	68.6 Å²	68.6	42%	0.415	34%	0.343	S	S	.	.	H	α-helix	trans	-70.4	-42.6	175.6	-66.8	-59.2	-171.6	167.5	6.1	113.3	L900 Q954 R956 E960 E961 L962	L900-R958 HydrophobicContact CD1-CG 4.31Å; L900-R958 HydrophobicContact CD2-CB 4.11Å; Q954-R958 WeakPolarHBondContact O-CG 3.11Å; Q954-R958 PolarHBondContact O-N 2.96Å; R956-R958 PolarHBondContact O-N 2.55Å; R958-E960 VanDerWaalsContact C-N 3.26Å; R958-E960 PolarHBondContact O-N 3.24Å; R958-E961 WeakPolarHBondContact CD-OE2 3.41Å; R958-E961 IonicContact CZ-OE2 2.79Å; R958-E961 IonicContact NE-OE2 3.95Å; R958-E961 IonicContact NH1-OE1 2.68Å; R958-E961 IonicContact NH1-OE2 3.94Å; R958-E961 PolarHBondContact NH1-OE2 2.99Å; R958-E961 PolarHBondContact O-N 2.99Å; R958-L962 WeakPolarHBondContact O-CB 3.46Å; R958-L962 VanDerWaalsContact O-CG 3.29Å; R958-L962 WeakPolarHBondContact O-CG 3.21Å; R958-L962 PolarHBondContact O-N 3.41Å
959	M	67	Low	65.8	Low	82 Å²	82	76.7 Å²	76.7	40%	0.404	38%	0.379	S	S	.	.	H	α-helix	trans	-62.3	-33.7	172.4	-72.3	-174.4	-66	0	0	112.5	L928 A955 R956 H963	L928-M959 HydrophobicContact CD2-CG 4.23Å; L928-M959 HydrophobicContact CD2-SD 3.93Å; A955-M959 WeakPolarHBondContact O-CE 3.41Å; A955-M959 WeakPolarHBondContact O-CG 3.22Å; A955-M959 PolarHBondContact O-N 3.08Å; A955-M959 VanDerWaalsContact O-N 3.14Å; R956-M959 PolarHBondContact O-N 2.91Å; M959-H963 WeakPolarHBondContact O-CB 3.45Å; M959-H963 PolarHBondContact O-N 3.33Å
960	E	64.8	Low	63.6	Low	32 Å²	32	85.6 Å²	85.6	15%	0.15	41%	0.409	C	S	.	.	H	α-helix	trans	-71.4	-41.5	175.8	-74.5	177.9	-168.2	0	0	113	R956 E957 R958 L962 H963 R964 W992	R956-E960 HydrophobicContact CG-CG 4.35Å; R956-E960 WeakPolarHBondContact CG-OE1 3.3Å; R956-E960 IonicContact CZ-OE1 2.77Å; R956-E960 IonicContact NE-OE1 3.14Å; R956-E960 PolarHBondContact NE-OE1 3.24Å; R956-E960 IonicContact NH2-OE1 2.68Å; R956-E960 PolarHBondContact NH2-OE1 2.97Å; R956-E960 WeakPolarHBondContact O-CG 3.42Å; R956-E960 PolarHBondContact O-N 2.77Å; E957-E960 PolarHBondContact O-N 3.05Å; R958-E960 VanDerWaalsContact C-N 3.26Å; R958-E960 PolarHBondContact O-N 3.24Å; E960-L962 VanDerWaalsContact C-N 3.27Å; E960-L962 PolarHBondContact O-N 2.95Å; E960-H963 PolarHBondContact O-N 3.35Å; E960-R964 WeakPolarHBondContact O-CB 3.28Å; E960-R964 WeakPolarHBondContact O-CG 3.47Å; E960-R964 PolarHBondContact O-N 2.93Å; E960-R964 PolarHBondContact O-NE 3.32Å; E960-W992 VanDerWaalsContact CD-NE1 3.27Å; E960-W992 HydrophobicContact CG-CD2 4.49Å; E960-W992 VanDerWaalsContact CG-CE2 3.44Å; E960-W992 HydrophobicContact CG-CH2 4.37Å; E960-W992 HydrophobicContact CG-CZ2 3.36Å; E960-W992 VanDerWaalsContact OE1-CD1 3.24Å; E960-W992 PolarHBondContact OE1-NE1 3Å
961	E	65.1	Low	61	Low	98 Å²	98	91 Å²	91	46%	0.458	43%	0.425	S	S	.	.	H	α-helix	trans	-58.8	-42.5	172.4	-172.2	173.9	-159.6	0	0	110.8	E957 R958 R964 S965	E957-E961 WeakPolarHBondContact O-CB 3.23Å; E957-E961 PolarHBondContact O-N 3.47Å; R958-E961 WeakPolarHBondContact CD-OE2 3.41Å; R958-E961 IonicContact CZ-OE2 2.79Å; R958-E961 IonicContact NE-OE2 3.95Å; R958-E961 IonicContact NH1-OE1 2.68Å; R958-E961 IonicContact NH1-OE2 3.94Å; R958-E961 PolarHBondContact NH1-OE2 2.99Å; R958-E961 PolarHBondContact O-N 2.99Å; E961-R964 PolarHBondContact O-N 3.43Å; E961-S965 PolarHBondContact O-N 2.8Å
962	L	59	Low	58.5	Low	15 Å²	15	96.1 Å²	96.1	8%	0.079	46%	0.458	C	S	.	.	H	α-helix	trans	-65.9	-40.3	174.3	-77	169.6	0	0	0	113.9	L903 D904 I907 R958 E960 S965 L966	L903-L962 HydrophobicContact CB-CD1 4.41Å; L903-L962 HydrophobicContact CD2-CD1 3.57Å; L903-L962 HydrophobicContact CG-CD1 3.84Å; D904-L962 WeakPolarHBondContact OD1-CD1 3.22Å; D904-L962 WeakPolarHBondContact OD1-CD2 3.41Å; D904-L962 WeakPolarHBondContact OD1-CG 3.39Å; I907-L962 HydrophobicContact CB-CD2 4.43Å; I907-L962 HydrophobicContact CD1-CD1 4.34Å; I907-L962 HydrophobicContact CD1-CD2 3.59Å; I907-L962 HydrophobicContact CD1-CG 4.39Å; I907-L962 HydrophobicContact CG2-CD2 4.47Å; R958-L962 WeakPolarHBondContact O-CB 3.46Å; R958-L962 VanDerWaalsContact O-CG 3.29Å; R958-L962 WeakPolarHBondContact O-CG 3.21Å; R958-L962 PolarHBondContact O-N 3.41Å; E960-L962 VanDerWaalsContact C-N 3.27Å; E960-L962 PolarHBondContact O-N 2.95Å; L962-S965 PolarHBondContact O-N 3.42Å; L962-S965 PolarHBondContact O-OG 3.44Å; L962-L966 WeakPolarHBondContact O-CG 3.45Å; L962-L966 PolarHBondContact O-N 3.4Å
963	H	57.9	Low	55.8	Low	86 Å²	86	98.2 Å²	98.2	40%	0.398	48%	0.477	S	S	.	.	H	α-helix	trans	-66.1	-43	177.1	-172.5	53.6	0	0	0	110.9	M959 E960 S965 L966 T967	M959-H963 WeakPolarHBondContact O-CB 3.45Å; M959-H963 PolarHBondContact O-N 3.33Å; E960-H963 PolarHBondContact O-N 3.35Å; H963-S965 VanDerWaalsContact C-N 3.28Å; H963-S965 PolarHBondContact O-N 2.71Å; H963-L966 PolarHBondContact O-N 2.57Å; H963-L966 VanDerWaalsContact O-N 3.13Å; H963-T967 PolarHBondContact O-N 3.18Å; H963-T967 VanDerWaalsContact O-N 3.15Å; H963-T967 PolarHBondContact O-OG1 2.91Å
964	R	58.5	Low	53.5	Low	175 Å²	175	104.7 Å²	104.7	66%	0.66	51%	0.505	S	S	*	.	H	α-helix	trans	-63	-29.8	177.1	-77.4	-174.4	-76.4	-173.7	-3.9	113.8	E960 E961	E960-R964 WeakPolarHBondContact O-CB 3.28Å; E960-R964 WeakPolarHBondContact O-CG 3.47Å; E960-R964 PolarHBondContact O-N 2.93Å; E960-R964 PolarHBondContact O-NE 3.32Å; E961-R964 PolarHBondContact O-N 3.43Å
965	S	56	Low	51	Low	53 Å²	53	109.1 Å²	109.1	37%	0.371	53%	0.531	S	S	.	.	H	α-helix	trans	-79.2	-22.5	175.7	65.8	0	0	0	0	113.5	Q911 E961 L962 H963	Q911-S965 PolarHBondContact NE2-O 2.96Å; E961-S965 PolarHBondContact O-N 2.8Å; L962-S965 PolarHBondContact O-N 3.42Å; L962-S965 PolarHBondContact O-OG 3.44Å; H963-S965 VanDerWaalsContact C-N 3.28Å; H963-S965 PolarHBondContact O-N 2.71Å
966	L	48.5	Very low	48.6	Very low	91 Å²	91	118.6 Å²	118.6	48%	0.476	58%	0.575	S	S	.	*	H	α-helix	trans	-89.5	-24.6	-179.4	-77.7	169.7	0	0	0	114.3	I907 L962 H963	I907-L966 HydrophobicContact CD1-CD1 4.23Å; I907-L966 HydrophobicContact CG2-CD1 4.17Å; I907-L966 HydrophobicContact CG2-CD2 3.65Å; I907-L966 HydrophobicContact CG2-CG 3.87Å; L962-L966 WeakPolarHBondContact O-CG 3.45Å; L962-L966 PolarHBondContact O-N 3.4Å; H963-L966 PolarHBondContact O-N 2.57Å; H963-L966 VanDerWaalsContact O-N 3.13Å
967	T	37.8	Very low	46.4	Very low	73 Å²	73	121 Å²	121	45%	0.448	60%	0.604	S	S	.	*			trans	-116.5	94.7	177.3	49.2	0	0	0	0	110.5	H963 E969	H963-T967 PolarHBondContact O-N 3.18Å; H963-T967 VanDerWaalsContact O-N 3.15Å; H963-T967 PolarHBondContact O-OG1 2.91Å; T967-E969 PolarHBondContact O-N 3.4Å
968	P	40.3	Very low	44.1	Very low	121 Å²	121	121 Å²	121	79%	0.786	61%	0.613	S	S	*	*			trans	-76.1	1.4	-177.4	-13.7	29	0	0	0	115.3
969	E	34.3	Very low	42.1	Very low	179 Å²	179	122.1 Å²	122.1	84%	0.836	63%	0.632	S	S	*	*	S	Bend	trans	-96.1	126.8	-176.3	-73.8	-156.5	159	0	0	113.1	T967	T967-E969 PolarHBondContact O-N 3.4Å
970	R	33.8	Very low	40.1	Very low	238 Å²	238	129.8 Å²	129.8	90%	0.898	66%	0.657	S	S	*	*			trans	76.1	82.2	180	-64.7	-178.9	175.2	173.6	-1.2	115.2	P972	R970-P972 WeakPolarHBondContact O-CD 3.17Å
971	Q	28.5	Very low	38.4	Very low	172 Å²	172	133.9 Å²	133.9	80%	0.804	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-60.9	118.9	143	-72.7	-173.3	-36.4	0	0	108.4
972	P	32	Very low	36.7	Very low	111 Å²	111	134.9 Å²	134.9	72%	0.721	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-72.8	133.3	154.7	29.7	-28.4	0	0	0	107.7	R970 H974	R970-P972 WeakPolarHBondContact O-CD 3.17Å; P972-H974 PolarHBondContact O-N 3.32Å
973	D	26.5	Very low	35.2	Very low	165 Å²	165	145.8 Å²	145.8	88%	0.882	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-46.7	125.2	179.6	-76.1	-44.9	0	0	0	111.5	D975	D973-D975 PolarHBondContact O-N 3.33Å
974	H	31.1	Very low	34.1	Very low	157 Å²	157	145.3 Å²	145.3	73%	0.727	75%	0.747	S	S	*	*			trans	-69.1	104.8	172.6	-87.4	-78	0	0	0	109.2	P972	P972-H974 PolarHBondContact O-N 3.32Å
975	D	29.1	Very low	33	Very low	160 Å²	160	140.1 Å²	140.1	86%	0.856	74%	0.735	S	S	*	*			trans	-171.2	70.5	152.3	-92.8	-23.4	0	0	0	111.2	D973	D973-D975 PolarHBondContact O-N 3.33Å
976	E	29.7	Very low	32.1	Very low	202 Å²	202	142.1 Å²	142.1	94%	0.944	74%	0.738	S	S	*	*			trans	-170.1	26.2	154.8	-115.1	179.9	-169.8	0	0	115.3
977	A	26.8	Very low	31.5	Very low	96 Å²	96	140.8 Å²	140.8	79%	0.793	74%	0.736	S	S	*	*			trans	-104.2	51.8	-176.8	0	0	0	0	0	113.3
978	T	28.8	Very low	31.6	Very low	126 Å²	126	143.6 Å²	143.6	77%	0.773	74%	0.744	S	S	*	*	S	Bend	trans	-142.4	128.3	165.1	-27	0	0	0	0	110.8
979	T	28.2	Very low	31.9	Very low	132 Å²	132	140.7 Å²	140.7	81%	0.81	72%	0.72	S	S	*	*			trans	85	89.2	171.6	65.5	0	0	0	0	118.6
980	R	25.4	Very low	32.4	Very low	244 Å²	244	133.5 Å²	133.5	92%	0.921	69%	0.688	S	S	*	*			trans	-161.2	128	138.5	-105.2	162.3	-167.4	-172.9	6.1	111.2
981	P	28.4	Very low	32.6	Very low	117 Å²	117	125.4 Å²	125.4	76%	0.76	67%	0.668	S	S	*	*			trans	-86.1	131	-172.1	32.4	-32.3	0	0	0	114.2	R983	P981-R983 PolarHBondContact O-N 3.33Å
982	S	29.7	Very low	33.4	Very low	119 Å²	119	120.3 Å²	120.3	83%	0.832	64%	0.641	S	S	*	*	S	Bend	trans	38.8	35.3	139.9	-60.9	0	0	0	0	123.1
983	R	27.3	Very low	33.8	Very low	245 Å²	245	117.5 Å²	117.5	93%	0.925	62%	0.62	S	S	*	*	S	Bend	trans	-119.5	8.4	166.2	-94	-179.9	156	171.9	-5.3	116.1	P981	P981-R983 PolarHBondContact O-N 3.33Å
984	T	34.5	Very low	34.5	Very low	75 Å²	75	110.1 Å²	110.1	46%	0.46	58%	0.582	S	S	.	*			trans	-126.4	32.5	-166.3	-5.4	0	0	0	0	114.4	H986 S987 Q988	T984-H986 VanDerWaalsContact C-N 3.34Å; T984-H986 PolarHBondContact O-N 2.77Å; T984-S987 VanDerWaalsContact CG2-CB 3.5Å; T984-S987 PolarHBondContact O-N 3.09Å; T984-Q988 PolarHBondContact O-N 3.06Å
985	V	35.7	Very low	35	Very low	67 Å²	67	105.6 Å²	105.6	41%	0.406	57%	0.568	S	S	.	*	H	α-helix	trans	-57	-49.2	175	-176.3	0	0	0	0	109.3	I949 S987 Q988 H989	I949-V985 HydrophobicContact CG2-CG1 4.41Å; V985-S987 VanDerWaalsContact C-N 3.35Å; V985-S987 PolarHBondContact O-N 3.11Å; V985-Q988 PolarHBondContact O-N 3.48Å; V985-H989 WeakPolarHBondContact CG1-CE1 3.47Å; V985-H989 WeakPolarHBondContact O-CB 3.32Å; V985-H989 VanDerWaalsContact O-CG 3.26Å; V985-H989 PolarHBondContact O-N 3.05Å; V985-H989 PolarHBondContact O-ND1 2.88Å
986	H	37.7	Very low	35.8	Very low	94 Å²	94	104.3 Å²	104.3	44%	0.435	56%	0.561	S	S	.	*	H	α-helix	trans	-62.7	-30.6	-179.6	-116.3	57.9	0	0	0	115.7	T984	T984-H986 VanDerWaalsContact C-N 3.34Å; T984-H986 PolarHBondContact O-N 2.77Å
987	S	36.7	Very low	36.4	Very low	63 Å²	63	96.6 Å²	96.6	44%	0.441	53%	0.529	S	S	.	.	H	α-helix	trans	-83.1	-36.6	-177.3	-166.8	0	0	0	0	112.6	T984 V985 H989 S991	T984-S987 VanDerWaalsContact CG2-CB 3.5Å; T984-S987 PolarHBondContact O-N 3.09Å; V985-S987 VanDerWaalsContact C-N 3.35Å; V985-S987 PolarHBondContact O-N 3.11Å; S987-H989 VanDerWaalsContact C-N 3.29Å; S987-S991 WeakPolarHBondContact O-CB 3.47Å; S987-S991 PolarHBondContact O-N 2.88Å
988	Q	39.9	Very low	37.5	Very low	133 Å²	133	99.4 Å²	99.4	62%	0.621	52%	0.52	S	S	*	.	H	α-helix	trans	-71.4	-26.6	175.3	-75	174	-28.5	0	0	111.9	T984 V985	T984-Q988 PolarHBondContact O-N 3.06Å; V985-Q988 PolarHBondContact O-N 3.48Å
989	H	44.9	Very low	38.6	Very low	60 Å²	60	93.8 Å²	93.8	28%	0.278	49%	0.486	S	S	.	.	H	α-helix	trans	-73.2	-29.6	-177.6	-77.4	61.2	0	0	0	114.1	S953 V985 S987	S953-H989 PolarHBondContact OG-NE2 3.43Å; V985-H989 WeakPolarHBondContact CG1-CE1 3.47Å; V985-H989 WeakPolarHBondContact O-CB 3.32Å; V985-H989 VanDerWaalsContact O-CG 3.26Å; V985-H989 PolarHBondContact O-N 3.05Å; V985-H989 PolarHBondContact O-ND1 2.88Å; S987-H989 VanDerWaalsContact C-N 3.29Å
990	V	45.1	Very low	39.9	Very low	27 Å²	27	92 Å²	92	16%	0.164	46%	0.464	C	S	.	.	H	α-helix	trans	-95.2	-30.9	178.5	-166.5	0	0	0	0	111.4	W992 L993 A994 Y1008 F1024	V990-W992 PolarHBondContact O-N 3.46Å; V990-W992 VanDerWaalsContact O-N 3.14Å; V990-L993 PolarHBondContact O-N 3.48Å; V990-L993 VanDerWaalsContact O-N 3.15Å; V990-A994 PolarHBondContact O-N 3.27Å; V990-Y1008 HydrophobicContact CB-CD2 3.99Å; V990-Y1008 HydrophobicContact CB-CE2 4.02Å; V990-Y1008 HydrophobicContact CG1-CD2 3.26Å; V990-Y1008 HydrophobicContact CG1-CE2 3.59Å; V990-Y1008 HydrophobicContact CG1-CG 3.87Å; V990-Y1008 HydrophobicContact CG2-CD2 3.76Å; V990-Y1008 HydrophobicContact CG2-CE2 3.97Å; V990-F1024 HydrophobicContact CB-CE2 4.2Å; V990-F1024 HydrophobicContact CB-CZ 4.33Å; V990-F1024 HydrophobicContact CG1-CE1 3.98Å; V990-F1024 HydrophobicContact CG1-CE2 3.7Å; V990-F1024 HydrophobicContact CG1-CZ 3.35Å
991	S	39.1	Very low	41.7	Very low	68 Å²	68	81.7 Å²	81.7	48%	0.476	43%	0.43	S	S	.	.	H	α-helix	trans	-57	-28.3	174.9	-164.4	0	0	0	0	113.3	S987	S987-S991 WeakPolarHBondContact O-CB 3.47Å; S987-S991 PolarHBondContact O-N 2.88Å
992	W	43.6	Very low	43.6	Very low	65 Å²	65	76.5 Å²	76.5	25%	0.246	40%	0.397	C	S	.	.	H	α-helix	trans	-86.3	-31.5	177.1	179.3	82.6	0	0	0	114.2	R956 E960 V990 A994 S995	R956-W992 HydrophobicContact CG-CE3 4.4Å; R956-W992 HydrophobicContact CG-CH2 4.07Å; R956-W992 HydrophobicContact CG-CZ2 4.46Å; R956-W992 HydrophobicContact CG-CZ3 4.05Å; R956-W992 VanDerWaalsContact NE-CD2 3.28Å; E960-W992 VanDerWaalsContact CD-NE1 3.27Å; E960-W992 HydrophobicContact CG-CD2 4.49Å; E960-W992 VanDerWaalsContact CG-CE2 3.44Å; E960-W992 HydrophobicContact CG-CH2 4.37Å; E960-W992 HydrophobicContact CG-CZ2 3.36Å; E960-W992 VanDerWaalsContact OE1-CD1 3.24Å; E960-W992 PolarHBondContact OE1-NE1 3Å; V990-W992 PolarHBondContact O-N 3.46Å; V990-W992 VanDerWaalsContact O-N 3.14Å; W992-A994 PolarHBondContact O-N 3.49Å; W992-A994 VanDerWaalsContact O-N 3.1Å; W992-S995 WeakPolarHBondContact O-CB 3.49Å; W992-S995 PolarHBondContact O-N 3.24Å
993	L	42.3	Very low	45.3	Very low	53 Å²	53	73.4 Å²	73.4	28%	0.277	37%	0.374	S	S	.	.	H	α-helix	trans	-59.8	-21.9	170.3	-70.3	175.4	0	0	0	111.8	V990 L1004	V990-L993 PolarHBondContact O-N 3.48Å; V990-L993 VanDerWaalsContact O-N 3.15Å; L993-L1004 HydrophobicContact CD1-CD1 4.32Å; L993-L1004 HydrophobicContact CD2-CD1 3.8Å; L993-L1004 HydrophobicContact CG-CD1 4.49Å
994	A	40	Very low	47.3	Very low	9 Å²	9	65.1 Å²	65.1	7%	0.074	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-4.5	174.2	0	0	0	0	0	115.2	V990 W992 W1005 F1024 V1028 N1032	V990-A994 PolarHBondContact O-N 3.27Å; W992-A994 PolarHBondContact O-N 3.49Å; W992-A994 VanDerWaalsContact O-N 3.1Å; A994-W1005 HydrophobicContact CB-CH2 4.01Å; A994-F1024 HydrophobicContact CB-CE2 4.1Å; A994-F1024 HydrophobicContact CB-CZ 4.11Å; A994-V1028 HydrophobicContact CB-CB 4.33Å; A994-V1028 HydrophobicContact CB-CG1 4.1Å; A994-V1028 HydrophobicContact CB-CG2 3.32Å; A994-N1032 PolarHBondContact O-ND2 3.2Å
995	S	42.7	Very low	49.2	Very low	63 Å²	63	62 Å²	62	44%	0.441	33%	0.327	S	S	.	.	S	Bend	trans	-93.7	106.2	-179.3	-166.3	0	0	0	0	109.5	W992 S997	W992-S995 WeakPolarHBondContact O-CB 3.49Å; W992-S995 PolarHBondContact O-N 3.24Å; S995-S997 PolarHBondContact O-N 3.36Å
996	D	45.3	Very low	51	Low	133 Å²	133	59.4 Å²	59.4	71%	0.711	31%	0.312	S	S	*	.	S	Bend	trans	47.7	-29.4	169.4	-83.6	-21.1	0	0	0	121.2
997	S	41.9	Very low	52.7	Low	39 Å²	39	58.2 Å²	58.2	27%	0.273	31%	0.311	S	S	.	.	S	Bend	trans	-90.4	-27.7	-167.3	-48.1	0	0	0	0	115	S995	S995-S997 PolarHBondContact O-N 3.36Å
998	W	49.8	Very low	54.6	Low	155 Å²	155	56 Å²	56	59%	0.587	29%	0.294	S	S	*	.			trans	-146.1	44.6	-174	-55.9	94.4	0	0	0	117.2	Y1000 S1001	W998-Y1000 PolarHBondContact O-N 2.75Å; W998-S1001 PolarHBondContact O-N 3.37Å; W998-S1001 PolarHBondContact O-OG 3Å
999	P	51.6	Low	56.3	Low	9 Å²	9	50.2 Å²	50.2	6%	0.058	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-15.9	-177	25.7	-33.1	0	0	0	114.6	W1005	P999-W1005 PolarHBondContact O-NE1 3.26Å; P999-W1005 VanDerWaalsContact O-NE1 3.08Å
1000	Y	56.1	Low	57.6	Low	94 Å²	94	49.8 Å²	49.8	37%	0.369	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-4.6	-172.7	-53.4	-73.5	0	0	0	115	W998 A1002 S1035	W998-Y1000 PolarHBondContact O-N 2.75Å; Y1000-A1002 PolarHBondContact O-N 3.05Å; Y1000-S1035 WeakPolarHBondContact CD1-OG 3.39Å; Y1000-S1035 WeakPolarHBondContact CE1-OG 3.14Å
1001	S	63	Low	58.9	Low	27 Å²	27	50.5 Å²	50.5	19%	0.189	27%	0.269	C	S	.	.			trans	-81.4	87.8	-173.7	62.3	0	0	0	0	113.2	W998 P1003 L1004 W1005	W998-S1001 PolarHBondContact O-N 3.37Å; W998-S1001 PolarHBondContact O-OG 3Å; S1001-P1003 VanDerWaalsContact C-N 3.3Å; S1001-L1004 PolarHBondContact O-N 2.75Å; S1001-L1004 WeakPolarHBondContact OG-CB 3.36Å; S1001-L1004 WeakPolarHBondContact OG-CD1 3.33Å; S1001-L1004 VanDerWaalsContact OG-CG 3.27Å; S1001-L1004 WeakPolarHBondContact OG-CG 3.31Å; S1001-W1005 PolarHBondContact O-N 3.34Å
1002	A	68.3	Low	60.5	Low	8 Å²	8	47.7 Å²	47.7	7%	0.066	25%	0.248	C	C	.	.	H	α-helix	trans	-49.2	-39.5	174.9	0	0	0	0	0	115.1	L676 Y1000 L1004 W1005 S1006 F1041	L676-A1002 HydrophobicContact CD1-CB 3.26Å; L676-A1002 HydrophobicContact CD2-CB 4.44Å; L676-A1002 HydrophobicContact CG-CB 3.72Å; Y1000-A1002 PolarHBondContact O-N 3.05Å; A1002-L1004 VanDerWaalsContact C-N 3.32Å; A1002-L1004 PolarHBondContact O-N 3.49Å; A1002-W1005 PolarHBondContact O-N 2.86Å; A1002-S1006 PolarHBondContact O-N 2.92Å; A1002-F1041 HydrophobicContact CB-CE2 3.77Å; A1002-F1041 HydrophobicContact CB-CZ 3.8Å; A1002-F1041 VanDerWaalsContact O-CZ 3.3Å; A1002-F1041 WeakPolarHBondContact O-CZ 3.28Å
1003	P	65	Low	61.7	Low	55 Å²	55	47.3 Å²	47.3	36%	0.357	25%	0.251	S	S	.	.	H	α-helix	trans	-53.6	-43.3	173.3	-33.8	40.8	0	0	0	114.6	N691 S1001 S1006 V1007	N691-P1003 HydrophobicContact CB-CG 4.3Å; N691-P1003 WeakPolarHBondContact ND2-CB 3.49Å; S1001-P1003 VanDerWaalsContact C-N 3.3Å; P1003-S1006 PolarHBondContact O-N 3.49Å; P1003-S1006 PolarHBondContact O-OG 2.86Å; P1003-V1007 WeakPolarHBondContact O-CG2 3.38Å; P1003-V1007 PolarHBondContact O-N 3.21Å; P1003-V1007 VanDerWaalsContact O-N 3.11Å
1004	L	69.9	Low	62.9	Low	71 Å²	71	52.9 Å²	52.9	37%	0.372	27%	0.268	S	S	.	.	H	α-helix	trans	-68.6	-41.8	-177.3	-62.1	-173.1	0	0	0	111.1	L993 S1001 A1002 S1006 V1007 Y1008	L993-L1004 HydrophobicContact CD1-CD1 4.32Å; L993-L1004 HydrophobicContact CD2-CD1 3.8Å; L993-L1004 HydrophobicContact CG-CD1 4.49Å; S1001-L1004 PolarHBondContact O-N 2.75Å; S1001-L1004 WeakPolarHBondContact OG-CB 3.36Å; S1001-L1004 WeakPolarHBondContact OG-CD1 3.33Å; S1001-L1004 VanDerWaalsContact OG-CG 3.27Å; S1001-L1004 WeakPolarHBondContact OG-CG 3.31Å; A1002-L1004 VanDerWaalsContact C-N 3.32Å; A1002-L1004 PolarHBondContact O-N 3.49Å; L1004-S1006 VanDerWaalsContact C-N 3.33Å; L1004-S1006 PolarHBondContact O-N 3.39Å; L1004-V1007 PolarHBondContact O-N 2.93Å; L1004-Y1008 PolarHBondContact O-N 2.98Å
1005	W	75.1	Confident	64.1	Low	9 Å²	9	58.6 Å²	58.6	3%	0.034	29%	0.289	C	S	.	.	H	α-helix	trans	-62.2	-40.1	175.1	-60.8	113.1	0	0	0	112.1	A994 P999 S1001 A1002 Y1008 I1009 F1024 F1025 V1028 P1038 F1041	A994-W1005 HydrophobicContact CB-CH2 4.01Å; P999-W1005 PolarHBondContact O-NE1 3.26Å; P999-W1005 VanDerWaalsContact O-NE1 3.08Å; S1001-W1005 PolarHBondContact O-N 3.34Å; A1002-W1005 PolarHBondContact O-N 2.86Å; W1005-Y1008 PolarHBondContact O-N 3.49Å; W1005-I1009 WeakPolarHBondContact O-CG1 3.28Å; W1005-I1009 PolarHBondContact O-N 3.5Å; W1005-I1009 VanDerWaalsContact O-N 3.07Å; W1005-F1024 HydrophobicContact CE3-CE1 4.2Å; W1005-F1024 HydrophobicContact CH2-CE1 4.45Å; W1005-F1024 HydrophobicContact CH2-CZ 4.26Å; W1005-F1024 AromaticContact CZ3-CE1 3.5Å; W1005-F1024 HydrophobicContact CZ3-CE1 3.5Å; W1005-F1024 AromaticContact CZ3-CZ 3.68Å; W1005-F1024 HydrophobicContact CZ3-CZ 3.68Å; W1005-F1025 AromaticContact CE3-CE1 3.72Å; W1005-F1025 HydrophobicContact CE3-CE1 3.72Å; W1005-F1025 HydrophobicContact CE3-CZ 4.41Å; W1005-F1025 HydrophobicContact CZ3-CD1 4.41Å; W1005-F1025 AromaticContact CZ3-CE1 3.94Å; W1005-F1025 HydrophobicContact CZ3-CE1 3.94Å; W1005-V1028 HydrophobicContact CH2-CG1 3.62Å; W1005-V1028 HydrophobicContact CH2-CG2 4.27Å; W1005-V1028 HydrophobicContact CZ2-CG1 4.37Å; W1005-V1028 HydrophobicContact CZ3-CG1 4.33Å; W1005-P1038 HydrophobicContact CH2-CB 4.24Å; W1005-P1038 HydrophobicContact CH2-CG 4.27Å; W1005-P1038 HydrophobicContact CZ2-CB 4.16Å; W1005-P1038 HydrophobicContact CZ2-CG 3.78Å; W1005-F1041 HydrophobicContact CB-CB 3.99Å; W1005-F1041 HydrophobicContact CB-CD1 3.57Å; W1005-F1041 HydrophobicContact CB-CD2 3.42Å; W1005-F1041 VanDerWaalsContact CB-CD2 3.42Å; W1005-F1041 HydrophobicContact CB-CE1 3.81Å; W1005-F1041 HydrophobicContact CB-CE2 3.69Å; W1005-F1041 HydrophobicContact CB-CG 3.37Å; W1005-F1041 HydrophobicContact CB-CZ 3.87Å; W1005-F1041 AromaticContact CD1-CD2 3.94Å; W1005-F1041 HydrophobicContact CG-CB 4.44Å; W1005-F1041 AromaticContact CG-CD2 3.77Å; W1005-F1041 HydrophobicContact CG-CD2 3.77Å; W1005-F1041 HydrophobicContact CG-CE2 4.17Å; W1005-F1041 HydrophobicContact CG-CG 4.06Å
1006	S	73.8	Confident	65.1	Low	13 Å²	13	63.3 Å²	63.3	9%	0.091	30%	0.304	C	S	.	.	H	α-helix	trans	-62.2	-45.1	176.9	81.6	0	0	0	0	112.1	A1002 P1003 L1004 Y1008 I1009 Q1010	A1002-S1006 PolarHBondContact O-N 2.92Å; P1003-S1006 PolarHBondContact O-N 3.49Å; P1003-S1006 PolarHBondContact O-OG 2.86Å; L1004-S1006 VanDerWaalsContact C-N 3.33Å; L1004-S1006 PolarHBondContact O-N 3.39Å; S1006-Y1008 VanDerWaalsContact C-N 3.35Å; S1006-Y1008 PolarHBondContact O-N 3.47Å; S1006-I1009 PolarHBondContact O-N 3.13Å; S1006-Q1010 VanDerWaalsContact O-CG 3.3Å; S1006-Q1010 WeakPolarHBondContact O-CG 3.34Å; S1006-Q1010 PolarHBondContact O-N 3.31Å
1007	V	72.1	Confident	66.2	Low	68 Å²	68	59.3 Å²	59.3	41%	0.412	29%	0.286	S	S	.	.	H	α-helix	trans	-64.5	-42.1	178.7	172	0	0	0	0	110.2	P1003 L1004 I1009 Q1010 V1011	P1003-V1007 WeakPolarHBondContact O-CG2 3.38Å; P1003-V1007 PolarHBondContact O-N 3.21Å; P1003-V1007 VanDerWaalsContact O-N 3.11Å; L1004-V1007 PolarHBondContact O-N 2.93Å; V1007-I1009 PolarHBondContact O-N 3.32Å; V1007-Q1010 PolarHBondContact O-N 3.24Å; V1007-V1011 HydrophobicContact CG1-CG2 4.35Å; V1007-V1011 VanDerWaalsContact O-CG2 3.29Å; V1007-V1011 WeakPolarHBondContact O-CG2 3.33Å; V1007-V1011 PolarHBondContact O-N 3Å
1008	Y	76.1	Confident	67.4	Low	18 Å²	18	58.9 Å²	58.9	7%	0.071	29%	0.285	C	S	.	.	H	α-helix	trans	-57.8	-50.4	176.4	176.7	-105.5	0	0	0	112.3	V990 L1004 W1005 S1006 Q1010 V1011 E1012 F1024 F1025	V990-Y1008 HydrophobicContact CB-CD2 3.99Å; V990-Y1008 HydrophobicContact CB-CE2 4.02Å; V990-Y1008 HydrophobicContact CG1-CD2 3.26Å; V990-Y1008 HydrophobicContact CG1-CE2 3.59Å; V990-Y1008 HydrophobicContact CG1-CG 3.87Å; V990-Y1008 HydrophobicContact CG2-CD2 3.76Å; V990-Y1008 HydrophobicContact CG2-CE2 3.97Å; L1004-Y1008 PolarHBondContact O-N 2.98Å; W1005-Y1008 PolarHBondContact O-N 3.49Å; S1006-Y1008 VanDerWaalsContact C-N 3.35Å; S1006-Y1008 PolarHBondContact O-N 3.47Å; Y1008-Q1010 VanDerWaalsContact C-N 3.31Å; Y1008-Q1010 PolarHBondContact O-N 3.48Å; Y1008-V1011 PolarHBondContact O-N 3.41Å; Y1008-E1012 HydrophobicContact CD1-CG 4.37Å; Y1008-E1012 HydrophobicContact CD2-CG 4.07Å; Y1008-E1012 HydrophobicContact CE1-CG 3.83Å; Y1008-E1012 HydrophobicContact CE2-CG 3.52Å; Y1008-E1012 HydrophobicContact CG-CG 4.5Å; Y1008-E1012 PolarHBondContact O-N 3.32Å; Y1008-F1024 AromaticContact CD1-CD1 3.95Å; Y1008-F1024 HydrophobicContact CD1-CD1 3.95Å; Y1008-F1024 AromaticContact CD1-CE1 3.74Å; Y1008-F1024 HydrophobicContact CD1-CE1 3.74Å; Y1008-F1024 HydrophobicContact CD2-CE1 4.5Å; Y1008-F1024 AromaticContact CE1-CD1 3.19Å; Y1008-F1024 HydrophobicContact CE1-CD1 3.19Å; Y1008-F1024 AromaticContact CE1-CE1 3.48Å; Y1008-F1024 HydrophobicContact CE1-CE1 3.48Å; Y1008-F1024 VanDerWaalsContact CE1-CE1 3.48Å; Y1008-F1024 HydrophobicContact CE1-CG 4.07Å; Y1008-F1024 HydrophobicContact CE2-CD1 4.21Å; Y1008-F1024 HydrophobicContact CE2-CE1 4.26Å; Y1008-F1024 HydrophobicContact CG-CE1 4.23Å; Y1008-F1024 AromaticContact CZ-CD1 3.33Å; Y1008-F1024 AromaticContact CZ-CE1 3.74Å; Y1008-F1024 AromaticContact CZ-CG 3.74Å; Y1008-F1024 VanDerWaalsContact OH-CB 3.28Å; Y1008-F1024 WeakPolarHBondContact OH-CB 3.43Å; Y1008-F1024 WeakPolarHBondContact OH-CD1 3.27Å; Y1008-F1024 WeakPolarHBondContact OH-CG 3.09Å; Y1008-F1025 HydrophobicContact CD1-CE2 4.22Å; Y1008-F1025 HydrophobicContact CD1-CZ 4.02Å; Y1008-F1025 AromaticContact CE1-CE2 3.97Å; Y1008-F1025 HydrophobicContact CE1-CE2 3.97Å; Y1008-F1025 HydrophobicContact CE1-CZ 4.18Å
1009	I	75.6	Confident	68.5	Low	10 Å²	10	52 Å²	52	5%	0.051	26%	0.263	C	S	.	.	H	α-helix	trans	-60.4	-43.3	178.2	-68	177.2	0	0	0	110.8	W1005 S1006 V1007 V1011 E1012 N1013 F1025 F1041 A1045	W1005-I1009 WeakPolarHBondContact O-CG1 3.28Å; W1005-I1009 PolarHBondContact O-N 3.5Å; W1005-I1009 VanDerWaalsContact O-N 3.07Å; S1006-I1009 PolarHBondContact O-N 3.13Å; V1007-I1009 PolarHBondContact O-N 3.32Å; I1009-V1011 VanDerWaalsContact C-N 3.29Å; I1009-V1011 PolarHBondContact O-N 3.11Å; I1009-E1012 PolarHBondContact O-N 3.06Å; I1009-N1013 WeakPolarHBondContact CG2-ND2 3.46Å; I1009-N1013 VanDerWaalsContact O-CB 3.23Å; I1009-N1013 WeakPolarHBondContact O-CB 3.31Å; I1009-N1013 PolarHBondContact O-N 2.95Å; I1009-N1013 PolarHBondContact O-ND2 2.79Å; I1009-F1025 HydrophobicContact CD1-CZ 4.23Å; I1009-F1025 HydrophobicContact CG1-CE2 4.29Å; I1009-F1025 HydrophobicContact CG1-CZ 4Å; I1009-F1041 HydrophobicContact CD1-CB 4.04Å; I1009-F1041 HydrophobicContact CD1-CD1 3.63Å; I1009-F1041 HydrophobicContact CD1-CG 4.33Å; I1009-F1041 VanDerWaalsContact CD1-O 3.27Å; I1009-F1041 WeakPolarHBondContact CD1-O 2.97Å; I1009-A1045 HydrophobicContact CD1-CB 3.92Å; I1009-A1045 HydrophobicContact CG1-CB 4.1Å; I1009-A1045 HydrophobicContact CG2-CB 4.37Å
1010	Q	72.8	Confident	69.7	Low	51 Å²	51	56.2 Å²	56.2	24%	0.238	28%	0.277	C	S	.	.	H	α-helix	trans	-60.1	-39.7	177.6	-74.2	-177.5	0	0	0	112.7	G680 S1006 V1007 Y1008 R1014	G680-Q1010 VanDerWaalsContact CA-NE2 3.28Å; S1006-Q1010 VanDerWaalsContact O-CG 3.3Å; S1006-Q1010 WeakPolarHBondContact O-CG 3.34Å; S1006-Q1010 PolarHBondContact O-N 3.31Å; V1007-Q1010 PolarHBondContact O-N 3.24Å; Y1008-Q1010 VanDerWaalsContact C-N 3.31Å; Y1008-Q1010 PolarHBondContact O-N 3.48Å; Q1010-R1014 WeakPolarHBondContact O-CG 3Å
1011	V	72	Confident	70.7	Confident	42 Å²	42	52.4 Å²	52.4	26%	0.255	27%	0.265	S	S	.	.	H	α-helix	trans	-69.3	-50.3	178	171.1	0	0	0	0	110.4	V1007 Y1008 I1009 N1013 R1014 Y1015	V1007-V1011 HydrophobicContact CG1-CG2 4.35Å; V1007-V1011 VanDerWaalsContact O-CG2 3.29Å; V1007-V1011 WeakPolarHBondContact O-CG2 3.33Å; V1007-V1011 PolarHBondContact O-N 3Å; Y1008-V1011 PolarHBondContact O-N 3.41Å; I1009-V1011 VanDerWaalsContact C-N 3.29Å; I1009-V1011 PolarHBondContact O-N 3.11Å; V1011-N1013 VanDerWaalsContact C-N 3.33Å; V1011-N1013 PolarHBondContact O-N 3.49Å; V1011-R1014 WeakPolarHBondContact O-CB 3.38Å; V1011-R1014 PolarHBondContact O-N 3.18Å; V1011-R1014 VanDerWaalsContact O-N 3.08Å; V1011-Y1015 HydrophobicContact CG1-CD2 4.19Å; V1011-Y1015 HydrophobicContact CG1-CE2 3.62Å; V1011-Y1015 WeakPolarHBondContact O-CD2 3.45Å
1012	E	74.3	Confident	71.7	Confident	9 Å²	9	52.2 Å²	52.2	4%	0.042	26%	0.261	C	S	.	.	H	α-helix	trans	-64.5	-35.1	-179.6	-70.9	-64.7	152.1	0	0	112.7	Y1008 I1009 R1014 Y1015 R1020 A1021	Y1008-E1012 HydrophobicContact CD1-CG 4.37Å; Y1008-E1012 HydrophobicContact CD2-CG 4.07Å; Y1008-E1012 HydrophobicContact CE1-CG 3.83Å; Y1008-E1012 HydrophobicContact CE2-CG 3.52Å; Y1008-E1012 HydrophobicContact CG-CG 4.5Å; Y1008-E1012 PolarHBondContact O-N 3.32Å; I1009-E1012 PolarHBondContact O-N 3.06Å; E1012-R1014 PolarHBondContact O-N 3.36Å; E1012-R1014 VanDerWaalsContact O-N 3.11Å; E1012-Y1015 PolarHBondContact O-N 3.1Å; E1012-R1020 IonicContact OE1-CZ 3.02Å; E1012-R1020 IonicContact OE1-NE 3.73Å; E1012-R1020 IonicContact OE1-NH2 3.65Å; E1012-R1020 PolarHBondContact OE1-NH2 3.07Å; E1012-R1020 IonicContact OE2-CZ 2.75Å; E1012-R1020 IonicContact OE2-NE 3.36Å; E1012-R1020 PolarHBondContact OE2-NE 3.46Å; E1012-R1020 IonicContact OE2-NH2 3.6Å; E1012-A1021 HydrophobicContact CB-CB 4.28Å; E1012-A1021 HydrophobicContact CG-CB 4.4Å
1013	N	68.8	Low	72.3	Confident	57 Å²	57	58.6 Å²	58.6	31%	0.305	28%	0.283	S	S	.	.	H	α-helix	trans	-58.9	-24.1	174.5	-78.2	-14.3	0	0	0	112.9	I1009 V1011	I1009-N1013 WeakPolarHBondContact CG2-ND2 3.46Å; I1009-N1013 VanDerWaalsContact O-CB 3.23Å; I1009-N1013 WeakPolarHBondContact O-CB 3.31Å; I1009-N1013 PolarHBondContact O-N 2.95Å; I1009-N1013 PolarHBondContact O-ND2 2.79Å; V1011-N1013 VanDerWaalsContact C-N 3.33Å; V1011-N1013 PolarHBondContact O-N 3.49Å
1014	R	67.9	Low	73	Confident	170 Å²	170	57.1 Å²	57.1	64%	0.642	27%	0.271	S	S	*	.	H	α-helix	trans	-79.6	-23	175.3	-62.7	178	-172.6	-151.1	2.8	113.4	Q1010 V1011 E1012	Q1010-R1014 WeakPolarHBondContact O-CG 3Å; V1011-R1014 WeakPolarHBondContact O-CB 3.38Å; V1011-R1014 PolarHBondContact O-N 3.18Å; V1011-R1014 VanDerWaalsContact O-N 3.08Å; E1012-R1014 PolarHBondContact O-N 3.36Å; E1012-R1014 VanDerWaalsContact O-N 3.11Å
1015	Y	64.6	Low	73.5	Confident	129 Å²	129	54.3 Å²	54.3	51%	0.506	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-2.7	-176.3	-70.2	-72.5	0	0	0	113.7	V1011 E1012 S1017	V1011-Y1015 HydrophobicContact CG1-CD2 4.19Å; V1011-Y1015 HydrophobicContact CG1-CE2 3.62Å; V1011-Y1015 WeakPolarHBondContact O-CD2 3.45Å; E1012-Y1015 PolarHBondContact O-N 3.1Å; Y1015-S1017 PolarHBondContact O-N 3.15Å
1016	H	62.7	Low	73.8	Confident	162 Å²	162	56.7 Å²	56.7	75%	0.75	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	17.3	-179.8	-58.2	-62.2	0	0	0	115.1
1017	S	68.4	Low	74.1	Confident	50 Å²	50	59.2 Å²	59.2	35%	0.35	29%	0.286	S	S	.	.			trans	-104	87.3	-177.7	-172.3	0	0	0	0	110.4	Y1015 G1019 R1020	Y1015-S1017 PolarHBondContact O-N 3.15Å; S1017-G1019 VanDerWaalsContact C-N 3.27Å; S1017-G1019 PolarHBondContact O-N 2.91Å; S1017-R1020 PolarHBondContact O-N 2.81Å
1018	A	68.3	Low	74.3	Confident	30 Å²	30	56.2 Å²	56.2	25%	0.248	27%	0.268	C	S	.	.	H	α-helix	trans	-61.3	-35	-179.2	0	0	0	0	0	112.8	R1020 A1021 R1022	A1018-R1020 VanDerWaalsContact C-N 3.29Å; A1018-R1020 PolarHBondContact O-N 3.14Å; A1018-A1021 PolarHBondContact O-N 3.46Å; A1018-R1022 WeakPolarHBondContact O-CB 3.41Å; A1018-R1022 WeakPolarHBondContact O-CD 3.35Å; A1018-R1022 WeakPolarHBondContact O-CG 3.44Å; A1018-R1022 PolarHBondContact O-N 3.39Å
1019	G	73.4	Confident	74.2	Confident	11 Å²	11	57 Å²	57	11%	0.113	28%	0.275	C	S	.	.	H	α-helix	trans	-61.1	-33.1	-179.7	0	0	0	0	0	113.8	S1017 R1023	S1017-G1019 VanDerWaalsContact C-N 3.27Å; S1017-G1019 PolarHBondContact O-N 2.91Å; G1019-R1023 WeakPolarHBondContact O-CB 3.43Å; G1019-R1023 VanDerWaalsContact O-CG 3.24Å; G1019-R1023 WeakPolarHBondContact O-CG 3.35Å; G1019-R1023 PolarHBondContact O-N 3.15Å
1020	R	75.8	Confident	74	Confident	96 Å²	96	64.8 Å²	64.8	36%	0.362	30%	0.304	S	S	.	.	H	α-helix	trans	-67.6	-53	178.2	-81.4	179.8	47	149.2	2.2	112.5	E1012 S1017 A1018 R1022 R1023 F1024	E1012-R1020 IonicContact OE1-CZ 3.02Å; E1012-R1020 IonicContact OE1-NE 3.73Å; E1012-R1020 IonicContact OE1-NH2 3.65Å; E1012-R1020 PolarHBondContact OE1-NH2 3.07Å; E1012-R1020 IonicContact OE2-CZ 2.75Å; E1012-R1020 IonicContact OE2-NE 3.36Å; E1012-R1020 PolarHBondContact OE2-NE 3.46Å; E1012-R1020 IonicContact OE2-NH2 3.6Å; S1017-R1020 PolarHBondContact O-N 2.81Å; A1018-R1020 VanDerWaalsContact C-N 3.29Å; A1018-R1020 PolarHBondContact O-N 3.14Å; R1020-R1022 VanDerWaalsContact C-N 3.27Å; R1020-R1022 PolarHBondContact O-N 3.3Å; R1020-R1023 PolarHBondContact O-N 3.2Å; R1020-F1024 WeakPolarHBondContact O-CB 3.44Å; R1020-F1024 PolarHBondContact O-N 3.35Å
1021	A	77.4	Confident	73.4	Confident	14 Å²	14	67 Å²	67	12%	0.116	32%	0.317	C	S	.	.	H	α-helix	trans	-59.6	-41.1	177.8	0	0	0	0	0	111.1	E1012 A1018 F1024 F1025	E1012-A1021 HydrophobicContact CB-CB 4.28Å; E1012-A1021 HydrophobicContact CG-CB 4.4Å; A1018-A1021 PolarHBondContact O-N 3.46Å; A1021-F1024 PolarHBondContact O-N 3.5Å; A1021-F1025 WeakPolarHBondContact O-CD2 3.47Å; A1021-F1025 PolarHBondContact O-N 2.97Å
1022	R	83.1	Confident	72.8	Confident	24 Å²	24	65.6 Å²	65.6	9%	0.091	31%	0.308	C	S	.	.	H	α-helix	trans	-59.5	-54.8	175.8	-73.5	169.4	-176.6	173.5	-0.2	112.6	A1018 R1020 F1024 F1025 T1026 E1046 R1049	A1018-R1022 WeakPolarHBondContact O-CB 3.41Å; A1018-R1022 WeakPolarHBondContact O-CD 3.35Å; A1018-R1022 WeakPolarHBondContact O-CG 3.44Å; A1018-R1022 PolarHBondContact O-N 3.39Å; R1020-R1022 VanDerWaalsContact C-N 3.27Å; R1020-R1022 PolarHBondContact O-N 3.3Å; R1022-F1024 VanDerWaalsContact C-N 3.26Å; R1022-F1024 PolarHBondContact O-N 3.21Å; R1022-F1025 PolarHBondContact O-N 3.44Å; R1022-T1026 WeakPolarHBondContact O-CB 3.37Å; R1022-T1026 PolarHBondContact O-N 2.75Å; R1022-T1026 PolarHBondContact O-OG1 3.02Å; R1022-E1046 VanDerWaalsContact CG-OE1 3.24Å; R1022-E1046 WeakPolarHBondContact CG-OE1 3.42Å; R1022-E1046 IonicContact CZ-OE1 3.17Å; R1022-E1046 IonicContact NE-OE1 3.65Å; R1022-E1046 PolarHBondContact NE-OE1 3.08Å; R1022-E1046 IonicContact NE-OE2 3.67Å; R1022-E1046 IonicContact NH2-OE1 2.6Å; R1022-E1046 PolarHBondContact NH2-OE1 3.48Å; R1022-E1046 IonicContact NH2-OE2 2.7Å; R1022-E1046 PolarHBondContact NH2-OE2 2.96Å; R1022-R1049 VanDerWaalsContact NH2-NH2 3.17Å
1023	R	80.6	Confident	72.1	Confident	141 Å²	141	69.6 Å²	69.6	53%	0.532	34%	0.337	S	S	.	.	H	α-helix	trans	-57.7	-42.8	-179.4	-72.7	174.6	-168.4	-165	5.9	111.1	D143 G1019 R1020 T1026 T1027	D143-R1023 IonicContact OD1-CZ 2.79Å; D143-R1023 IonicContact OD1-NE 3.81Å; D143-R1023 IonicContact OD1-NH2 3.83Å; D143-R1023 PolarHBondContact OD1-NH2 3.37Å; G1019-R1023 WeakPolarHBondContact O-CB 3.43Å; G1019-R1023 VanDerWaalsContact O-CG 3.24Å; G1019-R1023 WeakPolarHBondContact O-CG 3.35Å; G1019-R1023 PolarHBondContact O-N 3.15Å; R1020-R1023 PolarHBondContact O-N 3.2Å; R1023-T1026 PolarHBondContact O-N 2.98Å; R1023-T1027 PolarHBondContact O-N 3.27Å; R1023-T1027 PolarHBondContact O-OG1 3.33Å; R1023-T1027 VanDerWaalsContact O-OG1 3.06Å
1024	F	80.6	Confident	71.9	Confident	25 Å²	25	69.8 Å²	69.8	11%	0.11	34%	0.343	C	S	.	.	H	α-helix	trans	-58.7	-57.5	175.8	173.6	-105.7	0	0	0	111.8	V990 A994 W1005 Y1008 R1020 A1021 R1022 T1026 T1027 V1028	V990-F1024 HydrophobicContact CB-CE2 4.2Å; V990-F1024 HydrophobicContact CB-CZ 4.33Å; V990-F1024 HydrophobicContact CG1-CE1 3.98Å; V990-F1024 HydrophobicContact CG1-CE2 3.7Å; V990-F1024 HydrophobicContact CG1-CZ 3.35Å; A994-F1024 HydrophobicContact CB-CE2 4.1Å; A994-F1024 HydrophobicContact CB-CZ 4.11Å; W1005-F1024 HydrophobicContact CE3-CE1 4.2Å; W1005-F1024 HydrophobicContact CH2-CE1 4.45Å; W1005-F1024 HydrophobicContact CH2-CZ 4.26Å; W1005-F1024 AromaticContact CZ3-CE1 3.5Å; W1005-F1024 HydrophobicContact CZ3-CE1 3.5Å; W1005-F1024 AromaticContact CZ3-CZ 3.68Å; W1005-F1024 HydrophobicContact CZ3-CZ 3.68Å; Y1008-F1024 AromaticContact CD1-CD1 3.95Å; Y1008-F1024 HydrophobicContact CD1-CD1 3.95Å; Y1008-F1024 AromaticContact CD1-CE1 3.74Å; Y1008-F1024 HydrophobicContact CD1-CE1 3.74Å; Y1008-F1024 HydrophobicContact CD2-CE1 4.5Å; Y1008-F1024 AromaticContact CE1-CD1 3.19Å; Y1008-F1024 HydrophobicContact CE1-CD1 3.19Å; Y1008-F1024 AromaticContact CE1-CE1 3.48Å; Y1008-F1024 HydrophobicContact CE1-CE1 3.48Å; Y1008-F1024 VanDerWaalsContact CE1-CE1 3.48Å; Y1008-F1024 HydrophobicContact CE1-CG 4.07Å; Y1008-F1024 HydrophobicContact CE2-CD1 4.21Å; Y1008-F1024 HydrophobicContact CE2-CE1 4.26Å; Y1008-F1024 HydrophobicContact CG-CE1 4.23Å; Y1008-F1024 AromaticContact CZ-CD1 3.33Å; Y1008-F1024 AromaticContact CZ-CE1 3.74Å; Y1008-F1024 AromaticContact CZ-CG 3.74Å; Y1008-F1024 VanDerWaalsContact OH-CB 3.28Å; Y1008-F1024 WeakPolarHBondContact OH-CB 3.43Å; Y1008-F1024 WeakPolarHBondContact OH-CD1 3.27Å; Y1008-F1024 WeakPolarHBondContact OH-CG 3.09Å; R1020-F1024 WeakPolarHBondContact O-CB 3.44Å; R1020-F1024 PolarHBondContact O-N 3.35Å; A1021-F1024 PolarHBondContact O-N 3.5Å; R1022-F1024 VanDerWaalsContact C-N 3.26Å; R1022-F1024 PolarHBondContact O-N 3.21Å; F1024-T1026 VanDerWaalsContact C-N 3.27Å; F1024-T1026 PolarHBondContact O-N 3.43Å; F1024-T1027 PolarHBondContact O-N 3.01Å; F1024-T1027 VanDerWaalsContact O-N 3.12Å; F1024-V1028 HydrophobicContact CD2-CG2 4.18Å; F1024-V1028 HydrophobicContact CE1-CG2 4.26Å; F1024-V1028 HydrophobicContact CE2-CG2 3.82Å; F1024-V1028 HydrophobicContact CZ-CG2 3.87Å; F1024-V1028 WeakPolarHBondContact O-CG2 3.46Å; F1024-V1028 PolarHBondContact O-N 3.37Å
1025	F	81.2	Confident	72.2	Confident	11 Å²	11	61.9 Å²	61.9	5%	0.048	31%	0.314	C	S	.	.	H	α-helix	trans	-61.2	-34.7	179.8	-76.7	-63.5	0	0	0	112.8	W1005 Y1008 I1009 A1021 R1022 V1028 T1029 F1041 A1042 A1045	W1005-F1025 AromaticContact CE3-CE1 3.72Å; W1005-F1025 HydrophobicContact CE3-CE1 3.72Å; W1005-F1025 HydrophobicContact CE3-CZ 4.41Å; W1005-F1025 HydrophobicContact CZ3-CD1 4.41Å; W1005-F1025 AromaticContact CZ3-CE1 3.94Å; W1005-F1025 HydrophobicContact CZ3-CE1 3.94Å; Y1008-F1025 HydrophobicContact CD1-CE2 4.22Å; Y1008-F1025 HydrophobicContact CD1-CZ 4.02Å; Y1008-F1025 AromaticContact CE1-CE2 3.97Å; Y1008-F1025 HydrophobicContact CE1-CE2 3.97Å; Y1008-F1025 HydrophobicContact CE1-CZ 4.18Å; I1009-F1025 HydrophobicContact CD1-CZ 4.23Å; I1009-F1025 HydrophobicContact CG1-CE2 4.29Å; I1009-F1025 HydrophobicContact CG1-CZ 4Å; A1021-F1025 WeakPolarHBondContact O-CD2 3.47Å; A1021-F1025 PolarHBondContact O-N 2.97Å; R1022-F1025 PolarHBondContact O-N 3.44Å; F1025-V1028 PolarHBondContact O-N 2.89Å; F1025-T1029 VanDerWaalsContact O-CB 3.31Å; F1025-T1029 WeakPolarHBondContact O-CB 3.18Å; F1025-T1029 WeakPolarHBondContact O-CG2 3.32Å; F1025-T1029 PolarHBondContact O-N 3.38Å; F1025-T1029 PolarHBondContact O-OG1 3.03Å; F1025-F1041 HydrophobicContact CE1-CB 4.04Å; F1025-F1041 HydrophobicContact CZ-CB 4.18Å; F1025-A1042 HydrophobicContact CB-CB 3.75Å; F1025-A1042 HydrophobicContact CD1-CB 3.78Å; F1025-A1042 HydrophobicContact CD2-CB 4.08Å; F1025-A1042 HydrophobicContact CE1-CB 4.39Å; F1025-A1042 HydrophobicContact CG-CB 3.61Å; F1025-A1045 HydrophobicContact CE2-CB 4.04Å
1026	T	81	Confident	73.1	Confident	60 Å²	60	55.9 Å²	55.9	37%	0.368	29%	0.29	S	S	.	.	H	α-helix	trans	-62.6	-45.4	174.2	-59.2	0	0	0	0	111.7	R1022 R1023 F1024 T1029 R1030	R1022-T1026 WeakPolarHBondContact O-CB 3.37Å; R1022-T1026 PolarHBondContact O-N 2.75Å; R1022-T1026 PolarHBondContact O-OG1 3.02Å; R1023-T1026 PolarHBondContact O-N 2.98Å; F1024-T1026 VanDerWaalsContact C-N 3.27Å; F1024-T1026 PolarHBondContact O-N 3.43Å; T1026-T1029 PolarHBondContact O-OG1 3.4Å; T1026-R1030 WeakPolarHBondContact O-CB 3.37Å; T1026-R1030 PolarHBondContact O-N 3.2Å; T1026-R1030 VanDerWaalsContact O-N 3.13Å
1027	T	80.4	Confident	74	Confident	65 Å²	65	48.3 Å²	48.3	40%	0.399	26%	0.256	S	S	.	.	H	α-helix	trans	-60.5	-50.4	175.6	-58.1	0	0	0	0	110.8	R1023 F1024 T1029 R1030 D1031	R1023-T1027 PolarHBondContact O-N 3.27Å; R1023-T1027 PolarHBondContact O-OG1 3.33Å; R1023-T1027 VanDerWaalsContact O-OG1 3.06Å; F1024-T1027 PolarHBondContact O-N 3.01Å; F1024-T1027 VanDerWaalsContact O-N 3.12Å; T1027-T1029 PolarHBondContact O-N 3.17Å; T1027-R1030 PolarHBondContact O-N 3.04Å; T1027-D1031 PolarHBondContact O-N 2.99Å
1028	V	75.2	Confident	74.7	Confident	6 Å²	6	46 Å²	46	4%	0.036	24%	0.24	C	C	.	.	H	α-helix	trans	-61.2	-43.1	-178.4	177.5	0	0	0	0	112.3	A994 W1005 F1024 F1025 R1030 N1032 P1038	A994-V1028 HydrophobicContact CB-CB 4.33Å; A994-V1028 HydrophobicContact CB-CG1 4.1Å; A994-V1028 HydrophobicContact CB-CG2 3.32Å; W1005-V1028 HydrophobicContact CH2-CG1 3.62Å; W1005-V1028 HydrophobicContact CH2-CG2 4.27Å; W1005-V1028 HydrophobicContact CZ2-CG1 4.37Å; W1005-V1028 HydrophobicContact CZ3-CG1 4.33Å; F1024-V1028 HydrophobicContact CD2-CG2 4.18Å; F1024-V1028 HydrophobicContact CE1-CG2 4.26Å; F1024-V1028 HydrophobicContact CE2-CG2 3.82Å; F1024-V1028 HydrophobicContact CZ-CG2 3.87Å; F1024-V1028 WeakPolarHBondContact O-CG2 3.46Å; F1024-V1028 PolarHBondContact O-N 3.37Å; F1025-V1028 PolarHBondContact O-N 2.89Å; V1028-R1030 VanDerWaalsContact C-N 3.34Å; V1028-N1032 VanDerWaalsContact O-CB 3.28Å; V1028-N1032 WeakPolarHBondContact O-CB 3.49Å; V1028-N1032 PolarHBondContact O-N 3.22Å; V1028-N1032 PolarHBondContact O-ND2 3.33Å; V1028-P1038 HydrophobicContact CG1-CB 3.78Å; V1028-P1038 HydrophobicContact CG1-CG 4.1Å
1029	T	75.1	Confident	75.6	Confident	35 Å²	35	46.1 Å²	46.1	22%	0.215	23%	0.234	C	C	.	.	H	α-helix	trans	-79	-17.4	-175.1	55	0	0	0	0	113.7	F1025 T1026 T1027 P1038 R1039	F1025-T1029 VanDerWaalsContact O-CB 3.31Å; F1025-T1029 WeakPolarHBondContact O-CB 3.18Å; F1025-T1029 WeakPolarHBondContact O-CG2 3.32Å; F1025-T1029 PolarHBondContact O-N 3.38Å; F1025-T1029 PolarHBondContact O-OG1 3.03Å; T1026-T1029 PolarHBondContact O-OG1 3.4Å; T1027-T1029 PolarHBondContact O-N 3.17Å; T1029-P1038 HydrophobicContact CG2-CB 4.27Å; T1029-R1039 HydrophobicContact CG2-CB 4.49Å; T1029-R1039 HydrophobicContact CG2-CG 3.61Å; T1029-R1039 PolarHBondContact O-NH2 3.26Å
1030	R	70.8	Confident	76.3	Confident	173 Å²	173	45.6 Å²	45.6	65%	0.653	23%	0.228	S	C	*	.	H	α-helix	trans	-77.4	-44.8	171.2	-173	-177.1	68.4	-177.3	1.1	111.3	T1026 T1027 V1028	T1026-R1030 WeakPolarHBondContact O-CB 3.37Å; T1026-R1030 PolarHBondContact O-N 3.2Å; T1026-R1030 VanDerWaalsContact O-N 3.13Å; T1027-R1030 PolarHBondContact O-N 3.04Å; V1028-R1030 VanDerWaalsContact C-N 3.34Å
1031	D	60.3	Low	76.8	Confident	96 Å²	96	41.1 Å²	41.1	51%	0.513	21%	0.211	S	C	.	.	H	α-helix	trans	-85.2	-30.7	-171.6	-55.1	-16.5	0	0	0	111.3	T1027	T1027-D1031 PolarHBondContact O-N 2.99Å
1032	N	58.2	Low	77.3	Confident	14 Å²	14	40.9 Å²	40.9	8%	0.075	21%	0.21	C	C	.	.			trans	-99.6	91.8	178.3	-66.5	-50.8	0	0	0	112.9	A994 V1028 S1034 R1039	A994-N1032 PolarHBondContact O-ND2 3.2Å; V1028-N1032 VanDerWaalsContact O-CB 3.28Å; V1028-N1032 WeakPolarHBondContact O-CB 3.49Å; V1028-N1032 PolarHBondContact O-N 3.22Å; V1028-N1032 PolarHBondContact O-ND2 3.33Å; N1032-S1034 VanDerWaalsContact C-N 3.35Å; N1032-R1039 PolarHBondContact O-NH2 3.36Å
1033	S	59.7	Low	77.7	Confident	93 Å²	93	39.8 Å²	39.8	65%	0.65	21%	0.206	S	C	*	.			trans	-77.7	-16	174.8	60.9	0	0	0	0	114.1	I1090	S1033-I1090 VanDerWaalsContact O-CD1 3.28Å; S1033-I1090 WeakPolarHBondContact O-CD1 3.23Å
1034	S	64.3	Low	78.1	Confident	61 Å²	61	33.6 Å²	33.6	43%	0.427	18%	0.183	S	C	.	.	S	Bend	trans	-87.2	-13	-168.5	56.8	0	0	0	0	116.2	N1032 I1090	N1032-S1034 VanDerWaalsContact C-N 3.35Å; S1034-I1090 VanDerWaalsContact O-CD1 3.29Å; S1034-I1090 WeakPolarHBondContact O-CD1 3.46Å
1035	S	75.4	Confident	78.3	Confident	4 Å²	4	33 Å²	33	3%	0.028	18%	0.182	C	C	.	.			trans	-130.7	138.1	-176	-175.2	0	0	0	0	113.5	Y1000 V1037 R1039	Y1000-S1035 WeakPolarHBondContact CD1-OG 3.39Å; Y1000-S1035 WeakPolarHBondContact CE1-OG 3.14Å; S1035-V1037 PolarHBondContact OG-N 2.99Å; S1035-R1039 PolarHBondContact O-NH1 3.25Å
1036	V	83.1	Confident	78.6	Confident	2 Å²	2	33 Å²	33	1%	0.012	18%	0.183	C	C	.	.	S	Bend	trans	-83.9	-21.7	173.7	74.4	0	0	0	0	112.5	S668 L671 R1039 L1040 I1090 C1094	S668-V1036 VanDerWaalsContact CB-CG1 3.5Å; L671-V1036 HydrophobicContact CD1-CG1 3.83Å; V1036-R1039 WeakPolarHBondContact O-CB 3.27Å; V1036-R1039 PolarHBondContact O-N 3.39Å; V1036-L1040 HydrophobicContact CG1-CD1 4.17Å; V1036-L1040 HydrophobicContact CG2-CG 4.33Å; V1036-L1040 PolarHBondContact O-N 2.95Å; V1036-I1090 HydrophobicContact CB-CG2 4.12Å; V1036-C1094 HydrophobicContact CG2-CB 4.21Å
1037	V	82.2	Confident	78.9	Confident	4 Å²	4	32.1 Å²	32.1	2%	0.024	18%	0.175	C	C	.	.	H	α-helix	trans	-57.4	-46.9	-172	177.3	0	0	0	0	112.2	L671 S1035 R1039 L1040 F1041	L671-V1037 HydrophobicContact CD1-CG2 4.18Å; S1035-V1037 PolarHBondContact OG-N 2.99Å; V1037-R1039 VanDerWaalsContact C-N 3.27Å; V1037-R1039 PolarHBondContact O-N 3.44Å; V1037-L1040 WeakPolarHBondContact O-CB 3.29Å; V1037-L1040 PolarHBondContact O-N 3.24Å; V1037-L1040 VanDerWaalsContact O-N 3.17Å; V1037-F1041 HydrophobicContact CG1-CD2 3.73Å; V1037-F1041 HydrophobicContact CG1-CE2 3.73Å; V1037-F1041 WeakPolarHBondContact O-CD2 3.39Å; V1037-F1041 PolarHBondContact O-N 3.2Å; V1037-F1041 VanDerWaalsContact O-N 3.09Å
1038	P	82.9	Confident	79	Confident	2 Å²	2	32.4 Å²	32.4	1%	0.013	17%	0.171	C	C	.	.	H	α-helix	trans	-60.4	-34.8	176.9	-23.9	34.6	0	0	0	113.6	W1005 V1028 T1029 F1041 A1042	W1005-P1038 HydrophobicContact CH2-CB 4.24Å; W1005-P1038 HydrophobicContact CH2-CG 4.27Å; W1005-P1038 HydrophobicContact CZ2-CB 4.16Å; W1005-P1038 HydrophobicContact CZ2-CG 3.78Å; V1028-P1038 HydrophobicContact CG1-CB 3.78Å; V1028-P1038 HydrophobicContact CG1-CG 4.1Å; T1029-P1038 HydrophobicContact CG2-CB 4.27Å; P1038-F1041 PolarHBondContact O-N 3.38Å; P1038-A1042 WeakPolarHBondContact O-CB 3.4Å; P1038-A1042 PolarHBondContact O-N 3.15Å
1039	R	87.1	Confident	79.3	Confident	32 Å²	32	33.8 Å²	33.8	12%	0.121	18%	0.176	C	C	.	.	H	α-helix	trans	-68.3	-40.7	177.3	-63.4	-177.9	177.9	86.1	7.2	111.3	T1029 N1032 S1035 V1036 V1037 A1042 I1043 A1085	T1029-R1039 HydrophobicContact CG2-CB 4.49Å; T1029-R1039 HydrophobicContact CG2-CG 3.61Å; T1029-R1039 PolarHBondContact O-NH2 3.26Å; N1032-R1039 PolarHBondContact O-NH2 3.36Å; S1035-R1039 PolarHBondContact O-NH1 3.25Å; V1036-R1039 WeakPolarHBondContact O-CB 3.27Å; V1036-R1039 PolarHBondContact O-N 3.39Å; V1037-R1039 VanDerWaalsContact C-N 3.27Å; V1037-R1039 PolarHBondContact O-N 3.44Å; R1039-A1042 WeakPolarHBondContact O-CB 3.45Å; R1039-A1042 PolarHBondContact O-N 2.99Å; R1039-I1043 WeakPolarHBondContact O-CG1 3.24Å; R1039-I1043 PolarHBondContact O-N 3.32Å; R1039-I1043 VanDerWaalsContact O-N 3.11Å; R1039-A1085 HydrophobicContact CB-CB 4.26Å
1040	L	88.3	Confident	79.8	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-60.6	-46.7	175	-68.1	172.2	0	0	0	111.5	L671 L677 V1036 V1037 A1042 I1043 V1044 L1096 L1097 M1100	L671-L1040 HydrophobicContact CD1-CD1 4.13Å; L677-L1040 HydrophobicContact CD1-CB 4.11Å; L677-L1040 HydrophobicContact CD2-CB 3.97Å; V1036-L1040 HydrophobicContact CG1-CD1 4.17Å; V1036-L1040 HydrophobicContact CG2-CG 4.33Å; V1036-L1040 PolarHBondContact O-N 2.95Å; V1037-L1040 WeakPolarHBondContact O-CB 3.29Å; V1037-L1040 PolarHBondContact O-N 3.24Å; V1037-L1040 VanDerWaalsContact O-N 3.17Å; L1040-A1042 PolarHBondContact O-N 2.99Å; L1040-I1043 WeakPolarHBondContact O-CB 3.45Å; L1040-I1043 PolarHBondContact O-N 3.47Å; L1040-V1044 VanDerWaalsContact O-CG2 3.3Å; L1040-V1044 WeakPolarHBondContact O-CG2 3.46Å; L1040-V1044 PolarHBondContact O-N 3.02Å; L1040-L1096 HydrophobicContact CD1-CD2 4.19Å; L1040-L1097 HydrophobicContact CD2-CB 4.09Å; L1040-L1097 HydrophobicContact CD2-CD1 3.81Å; L1040-M1100 HydrophobicContact CD2-SD 4.13Å
1041	F	86.4	Confident	80.3	Confident	1 Å²	1	30.6 Å²	30.6	0%	0.004	17%	0.166	C	C	.	.	H	α-helix	trans	-67.1	-33.9	178.1	-83.7	-79	0	0	0	112.9	L677 A1002 W1005 I1009 F1025 V1037 P1038 I1043 V1044 A1045	L677-F1041 HydrophobicContact CD2-CD1 4.22Å; L677-F1041 HydrophobicContact CD2-CD2 3.86Å; L677-F1041 HydrophobicContact CD2-CE1 4.03Å; L677-F1041 HydrophobicContact CD2-CE2 3.61Å; L677-F1041 HydrophobicContact CD2-CG 4.16Å; L677-F1041 HydrophobicContact CD2-CZ 3.71Å; A1002-F1041 HydrophobicContact CB-CE2 3.77Å; A1002-F1041 HydrophobicContact CB-CZ 3.8Å; A1002-F1041 VanDerWaalsContact O-CZ 3.3Å; A1002-F1041 WeakPolarHBondContact O-CZ 3.28Å; W1005-F1041 HydrophobicContact CB-CB 3.99Å; W1005-F1041 HydrophobicContact CB-CD1 3.57Å; W1005-F1041 HydrophobicContact CB-CD2 3.42Å; W1005-F1041 VanDerWaalsContact CB-CD2 3.42Å; W1005-F1041 HydrophobicContact CB-CE1 3.81Å; W1005-F1041 HydrophobicContact CB-CE2 3.69Å; W1005-F1041 HydrophobicContact CB-CG 3.37Å; W1005-F1041 HydrophobicContact CB-CZ 3.87Å; W1005-F1041 AromaticContact CD1-CD2 3.94Å; W1005-F1041 HydrophobicContact CG-CB 4.44Å; W1005-F1041 AromaticContact CG-CD2 3.77Å; W1005-F1041 HydrophobicContact CG-CD2 3.77Å; W1005-F1041 HydrophobicContact CG-CE2 4.17Å; W1005-F1041 HydrophobicContact CG-CG 4.06Å; I1009-F1041 HydrophobicContact CD1-CB 4.04Å; I1009-F1041 HydrophobicContact CD1-CD1 3.63Å; I1009-F1041 HydrophobicContact CD1-CG 4.33Å; I1009-F1041 VanDerWaalsContact CD1-O 3.27Å; I1009-F1041 WeakPolarHBondContact CD1-O 2.97Å; F1025-F1041 HydrophobicContact CE1-CB 4.04Å; F1025-F1041 HydrophobicContact CZ-CB 4.18Å; V1037-F1041 HydrophobicContact CG1-CD2 3.73Å; V1037-F1041 HydrophobicContact CG1-CE2 3.73Å; V1037-F1041 WeakPolarHBondContact O-CD2 3.39Å; V1037-F1041 PolarHBondContact O-N 3.2Å; V1037-F1041 VanDerWaalsContact O-N 3.09Å; P1038-F1041 PolarHBondContact O-N 3.38Å; F1041-I1043 VanDerWaalsContact C-N 3.34Å; F1041-I1043 PolarHBondContact O-N 3.36Å; F1041-V1044 PolarHBondContact O-N 2.96Å; F1041-A1045 WeakPolarHBondContact O-CB 3.45Å; F1041-A1045 PolarHBondContact O-N 3.24Å
1042	A	88.3	Confident	81.2	Confident	10 Å²	10	31.1 Å²	31.1	8%	0.083	17%	0.167	C	C	.	.	H	α-helix	trans	-61.1	-42.2	172.1	0	0	0	0	0	112.2	F1025 P1038 R1039 L1040 E1046	F1025-A1042 HydrophobicContact CB-CB 3.75Å; F1025-A1042 HydrophobicContact CD1-CB 3.78Å; F1025-A1042 HydrophobicContact CD2-CB 4.08Å; F1025-A1042 HydrophobicContact CE1-CB 4.39Å; F1025-A1042 HydrophobicContact CG-CB 3.61Å; P1038-A1042 WeakPolarHBondContact O-CB 3.4Å; P1038-A1042 PolarHBondContact O-N 3.15Å; R1039-A1042 WeakPolarHBondContact O-CB 3.45Å; R1039-A1042 PolarHBondContact O-N 2.99Å; L1040-A1042 PolarHBondContact O-N 2.99Å; A1042-E1046 PolarHBondContact O-N 3.39Å
1043	I	90.6	Very high	82.1	Confident	1 Å²	1	32 Å²	32	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-63.7	-48.1	175.8	-68.9	162	0	0	0	110.5	R1039 L1040 F1041 A1045 E1046 Q1047 L1081 F1082 A1085 L1097 M1100	R1039-I1043 WeakPolarHBondContact O-CG1 3.24Å; R1039-I1043 PolarHBondContact O-N 3.32Å; R1039-I1043 VanDerWaalsContact O-N 3.11Å; L1040-I1043 WeakPolarHBondContact O-CB 3.45Å; L1040-I1043 PolarHBondContact O-N 3.47Å; F1041-I1043 VanDerWaalsContact C-N 3.34Å; F1041-I1043 PolarHBondContact O-N 3.36Å; I1043-A1045 VanDerWaalsContact C-N 3.32Å; I1043-A1045 PolarHBondContact O-N 3.35Å; I1043-E1046 PolarHBondContact O-N 3.02Å; I1043-Q1047 HydrophobicContact CG2-CG 4.28Å; I1043-Q1047 WeakPolarHBondContact O-CG 3.3Å; I1043-Q1047 PolarHBondContact O-N 2.85Å; I1043-L1081 HydrophobicContact CG1-CB 3.75Å; I1043-L1081 HydrophobicContact CG1-CD1 4.44Å; I1043-F1082 HydrophobicContact CD1-CD1 3.75Å; I1043-F1082 HydrophobicContact CD1-CE1 3.89Å; I1043-F1082 HydrophobicContact CD1-CG 4.3Å; I1043-F1082 HydrophobicContact CG2-CD2 4.48Å; I1043-F1082 HydrophobicContact CG2-CE1 3.87Å; I1043-F1082 HydrophobicContact CG2-CE2 3.8Å; I1043-F1082 HydrophobicContact CG2-CZ 3.45Å; I1043-F1082 VanDerWaalsContact CG2-CZ 3.45Å; I1043-A1085 HydrophobicContact CD1-CB 4.43Å; I1043-L1097 HydrophobicContact CD1-CD1 3.6Å; I1043-M1100 HydrophobicContact CG2-CE 4.16Å
1044	V	88.3	Confident	83	Confident	11 Å²	11	29.7 Å²	29.7	7%	0.067	15%	0.154	C	C	.	.	H	α-helix	trans	-60.8	-40.2	-179.8	170	0	0	0	0	111.6	L677 L1040 F1041 E1046 Q1047 H1048 M1100	L677-V1044 HydrophobicContact CB-CG2 4.01Å; L677-V1044 HydrophobicContact CD1-CG2 3.88Å; L677-V1044 HydrophobicContact CD2-CG2 4.36Å; L677-V1044 HydrophobicContact CG-CG2 4.3Å; L1040-V1044 VanDerWaalsContact O-CG2 3.3Å; L1040-V1044 WeakPolarHBondContact O-CG2 3.46Å; L1040-V1044 PolarHBondContact O-N 3.02Å; F1041-V1044 PolarHBondContact O-N 2.96Å; V1044-E1046 PolarHBondContact O-N 3.08Å; V1044-Q1047 PolarHBondContact O-N 3.36Å; V1044-H1048 VanDerWaalsContact CG1-CD2 3.45Å; V1044-H1048 WeakPolarHBondContact CG1-CD2 3.29Å; V1044-H1048 PolarHBondContact O-CD2 2.77Å; V1044-H1048 VanDerWaalsContact O-CD2 3.27Å; V1044-H1048 PolarHBondContact O-N 3.08Å; V1044-M1100 HydrophobicContact CG2-CE 3.86Å
1045	A	86.2	Confident	83.8	Confident	11 Å²	11	28.9 Å²	28.9	9%	0.091	15%	0.151	C	C	.	.	H	α-helix	trans	-58.5	-46.6	175.8	0	0	0	0	0	112	I1009 F1025 F1041 I1043 R1049	I1009-A1045 HydrophobicContact CD1-CB 3.92Å; I1009-A1045 HydrophobicContact CG1-CB 4.1Å; I1009-A1045 HydrophobicContact CG2-CB 4.37Å; F1025-A1045 HydrophobicContact CE2-CB 4.04Å; F1041-A1045 WeakPolarHBondContact O-CB 3.45Å; F1041-A1045 PolarHBondContact O-N 3.24Å; I1043-A1045 VanDerWaalsContact C-N 3.32Å; I1043-A1045 PolarHBondContact O-N 3.35Å; A1045-R1049 PolarHBondContact O-N 2.92Å; A1045-R1049 VanDerWaalsContact O-N 3.11Å
1046	E	87.8	Confident	83.6	Confident	13 Å²	13	30.8 Å²	30.8	6%	0.061	17%	0.167	C	C	.	.	H	α-helix	trans	-70.4	-35.2	177.9	-71.8	-63.6	158.7	0	0	112.7	R1022 A1042 I1043 V1044 R1049 K1050 I1078 L1081	R1022-E1046 VanDerWaalsContact CG-OE1 3.24Å; R1022-E1046 WeakPolarHBondContact CG-OE1 3.42Å; R1022-E1046 IonicContact CZ-OE1 3.17Å; R1022-E1046 IonicContact NE-OE1 3.65Å; R1022-E1046 PolarHBondContact NE-OE1 3.08Å; R1022-E1046 IonicContact NE-OE2 3.67Å; R1022-E1046 IonicContact NH2-OE1 2.6Å; R1022-E1046 PolarHBondContact NH2-OE1 3.48Å; R1022-E1046 IonicContact NH2-OE2 2.7Å; R1022-E1046 PolarHBondContact NH2-OE2 2.96Å; A1042-E1046 PolarHBondContact O-N 3.39Å; I1043-E1046 PolarHBondContact O-N 3.02Å; V1044-E1046 PolarHBondContact O-N 3.08Å; E1046-R1049 PolarHBondContact O-N 2.92Å; E1046-R1049 IonicContact OE2-CZ 3.49Å; E1046-R1049 VanDerWaalsContact OE2-CZ 3.26Å; E1046-R1049 IonicContact OE2-NE 2.81Å; E1046-R1049 PolarHBondContact OE2-NE 3.42Å; E1046-R1049 IonicContact OE2-NH2 3.89Å; E1046-R1049 PolarHBondContact OE2-NH2 2.83Å; E1046-K1050 PolarHBondContact O-N 3.19Å; E1046-I1078 HydrophobicContact CB-CD1 4.41Å; E1046-I1078 HydrophobicContact CB-CG1 3.75Å; E1046-L1081 HydrophobicContact CB-CD1 4.3Å; E1046-L1081 HydrophobicContact CG-CD1 3.84Å
1047	Q	87	Confident	83	Confident	41 Å²	41	34.8 Å²	34.8	19%	0.192	19%	0.186	C	C	.	.	H	α-helix	trans	-63.6	-46.4	174	-75.8	-178.4	-21.4	0	0	111.9	I1043 V1044 R1049 K1050 Q1051 I1078	I1043-Q1047 HydrophobicContact CG2-CG 4.28Å; I1043-Q1047 WeakPolarHBondContact O-CG 3.3Å; I1043-Q1047 PolarHBondContact O-N 2.85Å; V1044-Q1047 PolarHBondContact O-N 3.36Å; Q1047-R1049 VanDerWaalsContact C-N 3.28Å; Q1047-R1049 PolarHBondContact O-N 2.94Å; Q1047-K1050 PolarHBondContact O-N 3.46Å; Q1047-Q1051 WeakPolarHBondContact O-CG 3.13Å; Q1047-Q1051 PolarHBondContact O-N 3.18Å; Q1047-I1078 HydrophobicContact CG-CD1 4.18Å; Q1047-I1078 HydrophobicContact CG-CG2 4.12Å
1048	H	82.9	Confident	82.5	Confident	70 Å²	70	42.9 Å²	42.9	32%	0.324	22%	0.216	S	C	.	.	H	α-helix	trans	-59.7	-40.2	174.7	-82	-55.3	0	0	0	112	V1044 Q1051 L1052	V1044-H1048 VanDerWaalsContact CG1-CD2 3.45Å; V1044-H1048 WeakPolarHBondContact CG1-CD2 3.29Å; V1044-H1048 PolarHBondContact O-CD2 2.77Å; V1044-H1048 VanDerWaalsContact O-CD2 3.27Å; V1044-H1048 PolarHBondContact O-N 3.08Å; H1048-Q1051 PolarHBondContact ND1-OE1 3.2Å; H1048-Q1051 WeakPolarHBondContact O-CB 3.33Å; H1048-Q1051 PolarHBondContact O-N 3.46Å; H1048-L1052 WeakPolarHBondContact O-CG 3.49Å; H1048-L1052 PolarHBondContact O-N 3.02Å
1049	R	81.7	Confident	81.7	Confident	35 Å²	35	47 Å²	47	13%	0.132	24%	0.244	C	C	.	.	H	α-helix	trans	-63.4	-44	176.2	-166.2	-178.8	62.1	67.4	20.1	111.6	R1022 A1045 E1046 Q1047 Q1051 L1052 V1053 E1071 L1074	R1022-R1049 VanDerWaalsContact NH2-NH2 3.17Å; A1045-R1049 PolarHBondContact O-N 2.92Å; A1045-R1049 VanDerWaalsContact O-N 3.11Å; E1046-R1049 PolarHBondContact O-N 2.92Å; E1046-R1049 IonicContact OE2-CZ 3.49Å; E1046-R1049 VanDerWaalsContact OE2-CZ 3.26Å; E1046-R1049 IonicContact OE2-NE 2.81Å; E1046-R1049 PolarHBondContact OE2-NE 3.42Å; E1046-R1049 IonicContact OE2-NH2 3.89Å; E1046-R1049 PolarHBondContact OE2-NH2 2.83Å; Q1047-R1049 VanDerWaalsContact C-N 3.28Å; Q1047-R1049 PolarHBondContact O-N 2.94Å; R1049-Q1051 VanDerWaalsContact C-N 3.35Å; R1049-Q1051 PolarHBondContact O-N 3.28Å; R1049-L1052 PolarHBondContact O-N 2.9Å; R1049-V1053 WeakPolarHBondContact O-CG2 3.25Å; R1049-V1053 PolarHBondContact O-N 3.23Å; R1049-E1071 IonicContact CZ-OE2 2.97Å; R1049-E1071 IonicContact NH1-OE1 3.76Å; R1049-E1071 IonicContact NH1-OE2 3.49Å; R1049-E1071 PolarHBondContact NH1-OE2 2.93Å; R1049-L1074 VanDerWaalsContact NH2-CG 3.28Å
1050	K	84.2	Confident	80.2	Confident	29 Å²	29	48.1 Å²	48.1	13%	0.126	26%	0.257	C	S	.	.	H	α-helix	trans	-58.4	-45.8	173.6	172.8	171.1	163.7	55.9	0	111.5	E1046 Q1047 L1052 V1053 D1054 L1074 I1078 F1104 E1108	E1046-K1050 PolarHBondContact O-N 3.19Å; Q1047-K1050 PolarHBondContact O-N 3.46Å; K1050-L1052 VanDerWaalsContact C-N 3.32Å; K1050-L1052 PolarHBondContact O-N 3.19Å; K1050-V1053 PolarHBondContact O-N 3.48Å; K1050-D1054 WeakPolarHBondContact CG-OD2 3.27Å; K1050-D1054 IonicContact NZ-OD1 2.97Å; K1050-D1054 IonicContact NZ-OD2 3.23Å; K1050-D1054 PolarHBondContact NZ-OD2 2.94Å; K1050-D1054 WeakPolarHBondContact O-CB 3.4Å; K1050-D1054 PolarHBondContact O-N 3.45Å; K1050-L1074 HydrophobicContact CB-CD1 4.3Å; K1050-I1078 HydrophobicContact CB-CD1 4.08Å; K1050-I1078 HydrophobicContact CD-CD1 3.86Å; K1050-F1104 HydrophobicContact CD-CE2 4.39Å; K1050-E1108 WeakPolarHBondContact CE-OE1 3.41Å; K1050-E1108 IonicContact NZ-OE1 2.89Å; K1050-E1108 PolarHBondContact NZ-OE1 3.29Å
1051	Q	82.6	Confident	78.6	Confident	113 Å²	113	52.9 Å²	52.9	53%	0.528	29%	0.289	S	S	.	.	H	α-helix	trans	-58.1	-42.7	176.6	-71	171.4	-5.4	0	0	112.4	Q1047 H1048 R1049 A1055	Q1047-Q1051 WeakPolarHBondContact O-CG 3.13Å; Q1047-Q1051 PolarHBondContact O-N 3.18Å; H1048-Q1051 PolarHBondContact ND1-OE1 3.2Å; H1048-Q1051 WeakPolarHBondContact O-CB 3.33Å; H1048-Q1051 PolarHBondContact O-N 3.46Å; R1049-Q1051 VanDerWaalsContact C-N 3.35Å; R1049-Q1051 PolarHBondContact O-N 3.28Å; Q1051-A1055 WeakPolarHBondContact O-CB 3.21Å; Q1051-A1055 PolarHBondContact O-N 2.96Å
1052	L	78.2	Confident	76.9	Confident	106 Å²	106	60.7 Å²	60.7	56%	0.555	33%	0.33	S	S	*	.	H	α-helix	trans	-63.9	-43.2	176.6	-72.2	171.5	0	0	0	112.2	H1048 R1049 K1050 A1055 A1056	H1048-L1052 WeakPolarHBondContact O-CG 3.49Å; H1048-L1052 PolarHBondContact O-N 3.02Å; R1049-L1052 PolarHBondContact O-N 2.9Å; K1050-L1052 VanDerWaalsContact C-N 3.32Å; K1050-L1052 PolarHBondContact O-N 3.19Å; L1052-A1055 PolarHBondContact O-N 3.16Å; L1052-A1056 WeakPolarHBondContact O-CB 3.05Å; L1052-A1056 PolarHBondContact O-N 3.46Å
1053	V	77.9	Confident	74.8	Confident	33 Å²	33	68.1 Å²	68.1	20%	0.2	37%	0.368	C	S	.	.	H	α-helix	trans	-64.4	-48.8	177.1	172.8	0	0	0	0	110.6	R1049 K1050 A1055 A1056 Q1057 L1074	R1049-V1053 WeakPolarHBondContact O-CG2 3.25Å; R1049-V1053 PolarHBondContact O-N 3.23Å; K1050-V1053 PolarHBondContact O-N 3.48Å; V1053-A1055 VanDerWaalsContact C-N 3.26Å; V1053-A1055 PolarHBondContact O-N 3.22Å; V1053-A1056 PolarHBondContact O-N 3.49Å; V1053-Q1057 WeakPolarHBondContact O-CG 3.45Å; V1053-Q1057 PolarHBondContact O-N 2.75Å; V1053-L1074 HydrophobicContact CG2-CD1 4.48Å
1054	D	78.9	Confident	72.6	Confident	44 Å²	44	75.5 Å²	75.5	24%	0.235	40%	0.402	C	S	.	.	H	α-helix	trans	-62.7	-34.6	179.2	-66.4	-11	0	0	0	111.1	K1050 R1058	K1050-D1054 WeakPolarHBondContact CG-OD2 3.27Å; K1050-D1054 IonicContact NZ-OD1 2.97Å; K1050-D1054 IonicContact NZ-OD2 3.23Å; K1050-D1054 PolarHBondContact NZ-OD2 2.94Å; K1050-D1054 WeakPolarHBondContact O-CB 3.4Å; K1050-D1054 PolarHBondContact O-N 3.45Å; D1054-R1058 WeakPolarHBondContact O-CB 3.48Å; D1054-R1058 WeakPolarHBondContact O-CG 3.48Å; D1054-R1058 PolarHBondContact O-N 3.39Å; D1054-R1058 VanDerWaalsContact O-N 3.1Å; D1054-R1058 PolarHBondContact O-NE 3.44Å
1055	A	79.6	Confident	70.3	Confident	44 Å²	44	80.3 Å²	80.3	36%	0.364	44%	0.443	S	S	.	.	H	α-helix	trans	-69.9	-43.4	174.8	0	0	0	0	0	112.1	Q1051 L1052 V1053 Q1057 R1058 S1059	Q1051-A1055 WeakPolarHBondContact O-CB 3.21Å; Q1051-A1055 PolarHBondContact O-N 2.96Å; L1052-A1055 PolarHBondContact O-N 3.16Å; V1053-A1055 VanDerWaalsContact C-N 3.26Å; V1053-A1055 PolarHBondContact O-N 3.22Å; A1055-Q1057 VanDerWaalsContact C-N 3.34Å; A1055-Q1057 PolarHBondContact O-N 2.98Å; A1055-R1058 PolarHBondContact O-N 3.01Å; A1055-S1059 WeakPolarHBondContact O-CB 3.22Å; A1055-S1059 PolarHBondContact O-N 3.43Å; A1055-S1059 PolarHBondContact O-OG 3.26Å
1056	A	72.8	Confident	68.3	Low	45 Å²	45	84.4 Å²	84.4	37%	0.372	46%	0.463	S	S	.	.	H	α-helix	trans	-60.2	-45.1	175.1	0	0	0	0	0	111	L1052 V1053 R1058 S1059 C1060	L1052-A1056 WeakPolarHBondContact O-CB 3.05Å; L1052-A1056 PolarHBondContact O-N 3.46Å; V1053-A1056 PolarHBondContact O-N 3.49Å; A1056-R1058 PolarHBondContact O-N 2.68Å; A1056-S1059 PolarHBondContact O-N 3.39Å; A1056-S1059 PolarHBondContact O-OG 3.12Å; A1056-C1060 PolarHBondContact O-N 3.39Å; A1056-C1060 PolarHBondContact O-SG 3.38Å
1057	Q	70.1	Confident	66.3	Low	86 Å²	86	87.5 Å²	87.5	40%	0.402	49%	0.485	S	S	.	.	H	α-helix	trans	-58.8	-44.4	175.6	-72.4	176.9	-4.6	0	0	112.2	V1053 A1055 C1061	V1053-Q1057 WeakPolarHBondContact O-CG 3.45Å; V1053-Q1057 PolarHBondContact O-N 2.75Å; A1055-Q1057 VanDerWaalsContact C-N 3.34Å; A1055-Q1057 PolarHBondContact O-N 2.98Å; Q1057-C1061 PolarHBondContact O-SG 3.44Å; Q1057-C1061 VanDerWaalsContact O-SG 3.32Å
1058	R	71.8	Confident	64.2	Low	173 Å²	173	89.5 Å²	89.5	65%	0.653	50%	0.496	S	S	*	.	H	α-helix	trans	-67.7	-30.7	177.3	-78	177.9	-84.2	150	-11.4	113.9	D1054 A1055 A1056 C1061	D1054-R1058 WeakPolarHBondContact O-CB 3.48Å; D1054-R1058 WeakPolarHBondContact O-CG 3.48Å; D1054-R1058 PolarHBondContact O-N 3.39Å; D1054-R1058 VanDerWaalsContact O-N 3.1Å; D1054-R1058 PolarHBondContact O-NE 3.44Å; A1055-R1058 PolarHBondContact O-N 3.01Å; A1056-R1058 PolarHBondContact O-N 2.68Å; R1058-C1061 PolarHBondContact O-SG 3.16Å
1059	S	66.2	Low	62.5	Low	88 Å²	88	92.1 Å²	92.1	62%	0.615	51%	0.512	S	S	*	.	H	α-helix	trans	-76.6	-24.9	-180	69.6	0	0	0	0	113.9	A1055 A1056 C1061	A1055-S1059 WeakPolarHBondContact O-CB 3.22Å; A1055-S1059 PolarHBondContact O-N 3.43Å; A1055-S1059 PolarHBondContact O-OG 3.26Å; A1056-S1059 PolarHBondContact O-N 3.39Å; A1056-S1059 PolarHBondContact O-OG 3.12Å; S1059-C1061 VanDerWaalsContact C-N 3.31Å; S1059-C1061 PolarHBondContact O-N 3.34Å
1060	C	55.8	Low	60.8	Low	56 Å²	56	95.3 Å²	95.3	38%	0.378	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	7.6	-176.3	-64.7	0	0	0	0	113.7	A1056 L1062 I1068	A1056-C1060 PolarHBondContact O-N 3.39Å; A1056-C1060 PolarHBondContact O-SG 3.38Å; C1060-L1062 PolarHBondContact O-N 2.89Å; C1060-I1068 HydrophobicContact CB-CD1 4.38Å
1061	C	53.6	Low	59.3	Low	100 Å²	100	96.7 Å²	96.7	68%	0.676	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	0.1	-177.6	-51.2	0	0	0	0	114.5	Q1057 R1058 S1059	Q1057-C1061 PolarHBondContact O-SG 3.44Å; Q1057-C1061 VanDerWaalsContact O-SG 3.32Å; R1058-C1061 PolarHBondContact O-SG 3.16Å; S1059-C1061 VanDerWaalsContact C-N 3.31Å; S1059-C1061 PolarHBondContact O-N 3.34Å
1062	L	50.5	Low	58	Low	165 Å²	165	98.1 Å²	98.1	86%	0.864	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.4	92.1	174.1	-75.2	158.6	0	0	0	109.8	C1060	C1060-L1062 PolarHBondContact O-N 2.89Å
1063	D	44.6	Very low	57.8	Low	167 Å²	167	94 Å²	94	89%	0.893	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	83	1.1	152.4	-116.3	7.9	0	0	0	122.8
1064	E	44.2	Very low	58	Low	155 Å²	155	92.8 Å²	92.8	72%	0.724	53%	0.531	S	S	*	.			trans	-137.7	109	168.4	-86.6	-177.5	163.8	0	0	113	L1066	E1064-L1066 PolarHBondContact O-N 3Å
1065	A	40.6	Very low	58.4	Low	112 Å²	112	91.9 Å²	91.9	93%	0.926	53%	0.527	S	S	*	.			trans	-69.8	87.4	171.1	0	0	0	0	0	110.6
1066	L	44.2	Very low	58.7	Low	97 Å²	97	93.6 Å²	93.6	51%	0.508	53%	0.531	S	S	.	.			trans	-75.1	145.2	164.4	-74.2	170.9	0	0	0	110	E1064 I1068	E1064-L1066 PolarHBondContact O-N 3Å; L1066-I1068 HydrophobicContact CB-CD1 4.49Å; L1066-I1068 HydrophobicContact CB-CG1 4.06Å; L1066-I1068 PolarHBondContact O-N 3.11Å
1067	P	45.1	Very low	59.3	Low	79 Å²	79	94.2 Å²	94.2	51%	0.513	52%	0.523	S	S	.	.			trans	-73.1	78.9	171.4	32.9	-33.7	0	0	0	108.5
1068	I	43.5	Very low	60.3	Low	82 Å²	82	90.1 Å²	90.1	42%	0.421	50%	0.504	S	S	.	.			trans	-82.6	128.3	172.9	-57.8	172.4	0	0	0	106.5	C1060 L1066	C1060-I1068 HydrophobicContact CB-CD1 4.38Å; L1066-I1068 HydrophobicContact CB-CD1 4.49Å; L1066-I1068 HydrophobicContact CB-CG1 4.06Å; L1066-I1068 PolarHBondContact O-N 3.11Å
1069	L	46.7	Very low	61.2	Low	126 Å²	126	85.8 Å²	85.8	66%	0.66	49%	0.488	S	S	*	.			trans	-43.6	127.6	-179.5	-71.7	153.9	0	0	0	111.3	E1071	L1069-E1071 HydrophobicContact CB-CG 4.16Å; L1069-E1071 PolarHBondContact O-N 3.39Å
1070	P	44.9	Very low	62.3	Low	101 Å²	101	83.2 Å²	83.2	66%	0.656	48%	0.476	S	S	*	.			trans	-71.1	87	163	28.6	-29.4	0	0	0	107.5	N1072	P1070-N1072 PolarHBondContact O-N 3.02Å
1071	E	53.4	Low	63.9	Low	58 Å²	58	82.8 Å²	82.8	27%	0.271	47%	0.469	S	S	.	.			trans	-75.7	66.1	171.5	-70.9	-160.1	167.6	0	0	110.3	R1049 L1069 G1073 L1074	R1049-E1071 IonicContact CZ-OE2 2.97Å; R1049-E1071 IonicContact NH1-OE1 3.76Å; R1049-E1071 IonicContact NH1-OE2 3.49Å; R1049-E1071 PolarHBondContact NH1-OE2 2.93Å; L1069-E1071 HydrophobicContact CB-CG 4.16Å; L1069-E1071 PolarHBondContact O-N 3.39Å; E1071-G1073 PolarHBondContact O-N 3.41Å; E1071-L1074 HydrophobicContact CB-CD1 4.4Å; E1071-L1074 HydrophobicContact CB-CD2 4.21Å; E1071-L1074 HydrophobicContact CB-CG 4.01Å; E1071-L1074 WeakPolarHBondContact OE2-CD1 3.21Å; E1071-L1074 WeakPolarHBondContact OE2-CD2 3.46Å; E1071-L1074 WeakPolarHBondContact OE2-CG 3.3Å
1072	N	55.7	Low	65.8	Low	143 Å²	143	78 Å²	78	77%	0.765	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	17.3	179.7	-61.1	-9.5	0	0	0	113.7	P1070	P1070-N1072 PolarHBondContact O-N 3.02Å
1073	G	73.8	Confident	67.7	Low	20 Å²	20	74.2 Å²	74.2	21%	0.206	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.8	-12.3	-171	0	0	0	0	0	116.1	E1071 N1076 R1077	E1071-G1073 PolarHBondContact O-N 3.41Å; G1073-N1076 PolarHBondContact O-N 3.48Å; G1073-R1077 PolarHBondContact O-N 3.5Å
1074	L	83	Confident	69.8	Low	8 Å²	8	68.1 Å²	68.1	4%	0.042	39%	0.391	C	S	.	.	H	α-helix	trans	-69.3	-42.5	-171.7	-52.8	-170.4	0	0	0	113.3	R1049 K1050 V1053 E1071 N1076 R1077 I1078	R1049-L1074 VanDerWaalsContact NH2-CG 3.28Å; K1050-L1074 HydrophobicContact CB-CD1 4.3Å; V1053-L1074 HydrophobicContact CG2-CD1 4.48Å; E1071-L1074 HydrophobicContact CB-CD1 4.4Å; E1071-L1074 HydrophobicContact CB-CD2 4.21Å; E1071-L1074 HydrophobicContact CB-CG 4.01Å; E1071-L1074 WeakPolarHBondContact OE2-CD1 3.21Å; E1071-L1074 WeakPolarHBondContact OE2-CD2 3.46Å; E1071-L1074 WeakPolarHBondContact OE2-CG 3.3Å; L1074-N1076 PolarHBondContact O-N 3.24Å; L1074-R1077 WeakPolarHBondContact O-CB 3.34Å; L1074-R1077 PolarHBondContact O-N 3.35Å; L1074-R1077 VanDerWaalsContact O-N 3.11Å; L1074-I1078 WeakPolarHBondContact O-CG1 3.3Å; L1074-I1078 PolarHBondContact O-N 3.49Å
1075	S	85.6	Confident	71.9	Confident	24 Å²	24	60.8 Å²	60.8	17%	0.168	36%	0.358	C	S	.	.	H	α-helix	trans	-62.6	-34.9	176.7	-56.5	0	0	0	0	111.6	R1079 E1108	S1075-R1079 VanDerWaalsContact O-CB 3.28Å; S1075-R1079 WeakPolarHBondContact O-CB 3.19Å; S1075-R1079 PolarHBondContact O-N 3.17Å; S1075-E1108 WeakPolarHBondContact CB-OE2 3.33Å; S1075-E1108 VanDerWaalsContact OG-CD 3.24Å; S1075-E1108 PolarHBondContact OG-OE1 3.4Å; S1075-E1108 PolarHBondContact OG-OE2 2.99Å
1076	N	85.8	Confident	74.3	Confident	81 Å²	81	56 Å²	56	43%	0.433	32%	0.317	S	S	.	.	H	α-helix	trans	-69.6	-38	173.7	-73.4	-35.1	0	0	0	111.9	G1073 L1074 R1079 G1080	G1073-N1076 PolarHBondContact O-N 3.48Å; L1074-N1076 PolarHBondContact O-N 3.24Å; N1076-R1079 PolarHBondContact O-N 3.45Å; N1076-R1079 PolarHBondContact OD1-NH2 2.91Å; N1076-G1080 PolarHBondContact O-N 2.69Å
1077	R	87.2	Confident	76.3	Confident	57 Å²	57	55.9 Å²	55.9	22%	0.215	32%	0.324	C	S	.	.	H	α-helix	trans	-63.6	-50.1	174.4	-177.9	69.1	177	-160.5	-4	111.7	D144 G1073 L1074 R1079 G1080 L1081	D144-R1077 IonicContact OD1-CZ 2.68Å; D144-R1077 IonicContact OD1-NH1 3.34Å; D144-R1077 PolarHBondContact OD1-NH1 3.33Å; D144-R1077 IonicContact OD1-NH2 3.16Å; D144-R1077 PolarHBondContact OD1-NH2 3.17Å; D144-R1077 IonicContact OD2-NH1 3.32Å; D144-R1077 PolarHBondContact OD2-NH1 3.41Å; G1073-R1077 PolarHBondContact O-N 3.5Å; L1074-R1077 WeakPolarHBondContact O-CB 3.34Å; L1074-R1077 PolarHBondContact O-N 3.35Å; L1074-R1077 VanDerWaalsContact O-N 3.11Å; R1077-R1079 VanDerWaalsContact C-N 3.27Å; R1077-R1079 PolarHBondContact O-N 3.38Å; R1077-G1080 PolarHBondContact O-N 3.29Å; R1077-G1080 VanDerWaalsContact O-N 3.1Å; R1077-L1081 WeakPolarHBondContact O-CG 3.44Å; R1077-L1081 PolarHBondContact O-N 3.44Å
1078	I	90.7	Very high	78.2	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-58.8	-43.8	178.1	-66.3	164.7	0	0	0	109.8	E1046 Q1047 K1050 L1074 G1080 L1081 F1082 F1104	E1046-I1078 HydrophobicContact CB-CD1 4.41Å; E1046-I1078 HydrophobicContact CB-CG1 3.75Å; Q1047-I1078 HydrophobicContact CG-CD1 4.18Å; Q1047-I1078 HydrophobicContact CG-CG2 4.12Å; K1050-I1078 HydrophobicContact CB-CD1 4.08Å; K1050-I1078 HydrophobicContact CD-CD1 3.86Å; L1074-I1078 WeakPolarHBondContact O-CG1 3.3Å; L1074-I1078 PolarHBondContact O-N 3.49Å; I1078-G1080 PolarHBondContact O-N 3.13Å; I1078-L1081 WeakPolarHBondContact O-CB 3.37Å; I1078-L1081 PolarHBondContact O-N 3.26Å; I1078-F1082 HydrophobicContact CG2-CD2 3.84Å; I1078-F1082 HydrophobicContact CG2-CE2 3.57Å; I1078-F1082 VanDerWaalsContact O-CD2 3.26Å; I1078-F1082 WeakPolarHBondContact O-CD2 3.31Å; I1078-F1082 PolarHBondContact O-N 2.96Å; I1078-F1104 HydrophobicContact CB-CE1 4.08Å; I1078-F1104 HydrophobicContact CB-CE2 4.2Å; I1078-F1104 HydrophobicContact CB-CZ 3.71Å; I1078-F1104 HydrophobicContact CD1-CE2 3.92Å; I1078-F1104 HydrophobicContact CD1-CZ 4.1Å; I1078-F1104 HydrophobicContact CG2-CD1 3.99Å; I1078-F1104 HydrophobicContact CG2-CD2 4.05Å; I1078-F1104 HydrophobicContact CG2-CE1 3.65Å; I1078-F1104 HydrophobicContact CG2-CE2 3.72Å; I1078-F1104 HydrophobicContact CG2-CG 4.18Å; I1078-F1104 HydrophobicContact CG2-CZ 3.51Å
1079	R	90.5	Very high	80	Confident	82 Å²	82	53.9 Å²	53.9	31%	0.309	31%	0.309	S	S	.	.	H	α-helix	trans	-59.6	-45.1	173.4	-179.5	169.3	60.9	100.6	-1.9	112.5	S1075 N1076 R1077 L1081 F1082 E1083 Y1101	S1075-R1079 VanDerWaalsContact O-CB 3.28Å; S1075-R1079 WeakPolarHBondContact O-CB 3.19Å; S1075-R1079 PolarHBondContact O-N 3.17Å; N1076-R1079 PolarHBondContact O-N 3.45Å; N1076-R1079 PolarHBondContact OD1-NH2 2.91Å; R1077-R1079 VanDerWaalsContact C-N 3.27Å; R1077-R1079 PolarHBondContact O-N 3.38Å; R1079-L1081 VanDerWaalsContact C-N 3.27Å; R1079-L1081 PolarHBondContact O-N 3.08Å; R1079-F1082 PolarHBondContact O-N 3.34Å; R1079-F1082 VanDerWaalsContact O-N 3.15Å; R1079-E1083 HydrophobicContact CG-CG 4.31Å; R1079-E1083 VanDerWaalsContact CG-OE1 3.25Å; R1079-E1083 WeakPolarHBondContact CG-OE1 3.44Å; R1079-E1083 IonicContact CZ-OE1 3.8Å; R1079-E1083 IonicContact NH1-OE1 2.94Å; R1079-E1083 PolarHBondContact NH1-OE1 3.43Å; R1079-E1083 VanDerWaalsContact NH1-OE1 3.14Å; R1079-E1083 WeakPolarHBondContact O-CB 3.33Å; R1079-E1083 WeakPolarHBondContact O-CG 3.46Å; R1079-E1083 PolarHBondContact O-N 3.33Å; R1079-Y1101 HydrophobicContact CG-CE2 4.33Å
1080	G	88.1	Confident	81.8	Confident	35 Å²	35	50.2 Å²	50.2	36%	0.361	29%	0.289	S	S	.	.	H	α-helix	trans	-60.9	-34.2	175.2	0	0	0	0	0	113.2	N1076 R1077 I1078 G1084	N1076-G1080 PolarHBondContact O-N 2.69Å; R1077-G1080 PolarHBondContact O-N 3.29Å; R1077-G1080 VanDerWaalsContact O-N 3.1Å; I1078-G1080 PolarHBondContact O-N 3.13Å; G1080-G1084 PolarHBondContact O-N 3.3Å
1081	L	90.5	Very high	83.8	Confident	47 Å²	47	45.4 Å²	45.4	25%	0.246	26%	0.258	C	S	.	.	H	α-helix	trans	-68.4	-40.9	173.1	-67.2	175.2	0	0	0	112.1	I1043 E1046 R1077 I1078 R1079 A1085	I1043-L1081 HydrophobicContact CG1-CB 3.75Å; I1043-L1081 HydrophobicContact CG1-CD1 4.44Å; E1046-L1081 HydrophobicContact CB-CD1 4.3Å; E1046-L1081 HydrophobicContact CG-CD1 3.84Å; R1077-L1081 WeakPolarHBondContact O-CG 3.44Å; R1077-L1081 PolarHBondContact O-N 3.44Å; I1078-L1081 WeakPolarHBondContact O-CB 3.37Å; I1078-L1081 PolarHBondContact O-N 3.26Å; R1079-L1081 VanDerWaalsContact C-N 3.27Å; R1079-L1081 PolarHBondContact O-N 3.08Å; L1081-A1085 VanDerWaalsContact O-CB 3.26Å; L1081-A1085 WeakPolarHBondContact O-CB 3.45Å; L1081-A1085 PolarHBondContact O-N 3.41Å
1082	F	93.6	Very high	85.5	Confident	0 Å²	0	43 Å²	43	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-64.4	-46.2	173.3	-79.3	-65.8	0	0	0	112.1	I1043 I1078 R1079 G1084 A1085 T1086 L1097 M1100 Y1101 F1104	I1043-F1082 HydrophobicContact CD1-CD1 3.75Å; I1043-F1082 HydrophobicContact CD1-CE1 3.89Å; I1043-F1082 HydrophobicContact CD1-CG 4.3Å; I1043-F1082 HydrophobicContact CG2-CD2 4.48Å; I1043-F1082 HydrophobicContact CG2-CE1 3.87Å; I1043-F1082 HydrophobicContact CG2-CE2 3.8Å; I1043-F1082 HydrophobicContact CG2-CZ 3.45Å; I1043-F1082 VanDerWaalsContact CG2-CZ 3.45Å; I1078-F1082 HydrophobicContact CG2-CD2 3.84Å; I1078-F1082 HydrophobicContact CG2-CE2 3.57Å; I1078-F1082 VanDerWaalsContact O-CD2 3.26Å; I1078-F1082 WeakPolarHBondContact O-CD2 3.31Å; I1078-F1082 PolarHBondContact O-N 2.96Å; R1079-F1082 PolarHBondContact O-N 3.34Å; R1079-F1082 VanDerWaalsContact O-N 3.15Å; F1082-G1084 VanDerWaalsContact C-N 3.35Å; F1082-G1084 PolarHBondContact O-N 3.44Å; F1082-A1085 PolarHBondContact O-N 3.1Å; F1082-T1086 WeakPolarHBondContact O-CB 3.38Å; F1082-T1086 WeakPolarHBondContact O-CG2 3.36Å; F1082-T1086 PolarHBondContact O-N 2.89Å; F1082-T1086 PolarHBondContact O-OG1 2.91Å; F1082-L1097 HydrophobicContact CD1-CD1 3.79Å; F1082-L1097 HydrophobicContact CE1-CD1 4.05Å; F1082-M1100 HydrophobicContact CE1-CB 3.84Å; F1082-M1100 HydrophobicContact CZ-CB 3.99Å; F1082-Y1101 HydrophobicContact CB-CD1 3.97Å; F1082-Y1101 HydrophobicContact CB-CD2 3.64Å; F1082-Y1101 HydrophobicContact CB-CE1 4.14Å; F1082-Y1101 HydrophobicContact CB-CE2 3.84Å; F1082-Y1101 HydrophobicContact CB-CG 3.73Å; F1082-Y1101 HydrophobicContact CD1-CD2 4.12Å; F1082-Y1101 AromaticContact CD1-CG 3.87Å; F1082-Y1101 HydrophobicContact CD1-CG 3.87Å; F1082-Y1101 AromaticContact CD2-CD2 3.54Å; F1082-Y1101 HydrophobicContact CD2-CD2 3.54Å; F1082-Y1101 HydrophobicContact CD2-CE2 4.11Å; F1082-Y1101 HydrophobicContact CD2-CG 4.16Å; F1082-Y1101 HydrophobicContact CE1-CG 4.48Å; F1082-Y1101 HydrophobicContact CE2-CD2 4.15Å; F1082-Y1101 HydrophobicContact CG-CD1 4.4Å; F1082-Y1101 AromaticContact CG-CD2 3.52Å; F1082-Y1101 HydrophobicContact CG-CD2 3.52Å; F1082-Y1101 HydrophobicContact CG-CE2 4.16Å; F1082-Y1101 AromaticContact CG-CG 3.69Å; F1082-Y1101 HydrophobicContact CG-CG 3.69Å; F1082-F1104 HydrophobicContact CD2-CD1 4.14Å; F1082-F1104 HydrophobicContact CE2-CB 3.9Å; F1082-F1104 AromaticContact CE2-CD1 3.84Å; F1082-F1104 HydrophobicContact CE2-CD1 3.84Å; F1082-F1104 AromaticContact CE2-CG 3.89Å; F1082-F1104 HydrophobicContact CE2-CG 3.89Å; F1082-F1104 HydrophobicContact CZ-CB 4.3Å
1083	E	90.4	Very high	87.1	Confident	84 Å²	84	37.4 Å²	37.4	39%	0.393	22%	0.217	S	C	.	.	H	α-helix	trans	-61.8	-42.5	177.5	-71.3	170.7	-175.5	0	0	111	R1079 T1086 S1087	R1079-E1083 HydrophobicContact CG-CG 4.31Å; R1079-E1083 VanDerWaalsContact CG-OE1 3.25Å; R1079-E1083 WeakPolarHBondContact CG-OE1 3.44Å; R1079-E1083 IonicContact CZ-OE1 3.8Å; R1079-E1083 IonicContact NH1-OE1 2.94Å; R1079-E1083 PolarHBondContact NH1-OE1 3.43Å; R1079-E1083 VanDerWaalsContact NH1-OE1 3.14Å; R1079-E1083 WeakPolarHBondContact O-CB 3.33Å; R1079-E1083 WeakPolarHBondContact O-CG 3.46Å; R1079-E1083 PolarHBondContact O-N 3.33Å; E1083-T1086 PolarHBondContact O-OG1 3.07Å; E1083-S1087 PolarHBondContact O-N 3.45Å
1084	G	88.4	Confident	88	Confident	39 Å²	39	36.4 Å²	36.4	40%	0.402	21%	0.207	S	C	.	.	H	α-helix	trans	-70.7	-27.1	175.5	0	0	0	0	0	114.6	G1080 F1082 S1087	G1080-G1084 PolarHBondContact O-N 3.3Å; F1082-G1084 VanDerWaalsContact C-N 3.35Å; F1082-G1084 PolarHBondContact O-N 3.44Å; G1084-S1087 PolarHBondContact O-OG 3.39Å
1085	A	89.3	Confident	88.4	Confident	2 Å²	2	36 Å²	36	2%	0.017	21%	0.205	C	C	.	.	H	α-helix	trans	-78.8	-42.1	174.7	0	0	0	0	0	111.7	R1039 I1043 L1081 F1082 S1087 T1088 G1091 L1097	R1039-A1085 HydrophobicContact CB-CB 4.26Å; I1043-A1085 HydrophobicContact CD1-CB 4.43Å; L1081-A1085 VanDerWaalsContact O-CB 3.26Å; L1081-A1085 WeakPolarHBondContact O-CB 3.45Å; L1081-A1085 PolarHBondContact O-N 3.41Å; F1082-A1085 PolarHBondContact O-N 3.1Å; A1085-S1087 VanDerWaalsContact C-N 3.29Å; A1085-S1087 PolarHBondContact O-N 2.97Å; A1085-T1088 PolarHBondContact O-N 3.06Å; A1085-T1088 PolarHBondContact O-OG1 3.39Å; A1085-G1091 WeakPolarHBondContact O-CA 3.4Å; A1085-L1097 HydrophobicContact CB-CD1 3.97Å; A1085-L1097 HydrophobicContact CB-CD2 3.67Å; A1085-L1097 HydrophobicContact CB-CG 4.47Å
1086	T	90.3	Very high	88.7	Confident	11 Å²	11	34.9 Å²	34.9	7%	0.067	20%	0.197	C	C	.	.	H	α-helix	trans	-73.8	-15	-179.6	53.3	0	0	0	0	114.1	F1082 E1083 T1088 L1097 W1098	F1082-T1086 WeakPolarHBondContact O-CB 3.38Å; F1082-T1086 WeakPolarHBondContact O-CG2 3.36Å; F1082-T1086 PolarHBondContact O-N 2.89Å; F1082-T1086 PolarHBondContact O-OG1 2.91Å; E1083-T1086 PolarHBondContact O-OG1 3.07Å; T1086-T1088 VanDerWaalsContact C-N 3.28Å; T1086-L1097 HydrophobicContact CG2-CD2 3.65Å; T1086-L1097 HydrophobicContact CG2-CG 4.08Å; T1086-W1098 HydrophobicContact CG2-CD2 4.08Å; T1086-W1098 HydrophobicContact CG2-CE3 4.03Å; T1086-W1098 HydrophobicContact CG2-CH2 3.66Å; T1086-W1098 HydrophobicContact CG2-CZ2 3.71Å; T1086-W1098 HydrophobicContact CG2-CZ3 3.82Å
1087	S	85.7	Confident	89.1	Confident	94 Å²	94	31 Å²	31	66%	0.657	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-16.5	172.1	63.4	0	0	0	0	113.5	E1083 G1084 A1085	E1083-S1087 PolarHBondContact O-N 3.45Å; G1084-S1087 PolarHBondContact O-OG 3.39Å; A1085-S1087 VanDerWaalsContact C-N 3.29Å; A1085-S1087 PolarHBondContact O-N 2.97Å
1088	T	85.1	Confident	89.4	Confident	36 Å²	36	28.4 Å²	28.4	22%	0.221	17%	0.167	C	C	.	.	S	Bend	trans	-82.9	143.8	175.4	68.4	0	0	0	0	110.5	A1085 T1086 I1090 G1091 A1092	A1085-T1088 PolarHBondContact O-N 3.06Å; A1085-T1088 PolarHBondContact O-OG1 3.39Å; T1086-T1088 VanDerWaalsContact C-N 3.28Å; T1088-I1090 VanDerWaalsContact C-N 3.3Å; T1088-I1090 PolarHBondContact O-N 3.2Å; T1088-G1091 PolarHBondContact O-N 3.23Å; T1088-G1091 VanDerWaalsContact O-N 3.13Å; T1088-G1091 PolarHBondContact OG1-N 3.41Å; T1088-G1091 VanDerWaalsContact OG1-N 3.12Å; T1088-A1092 WeakPolarHBondContact O-CB 3.47Å; T1088-A1092 PolarHBondContact O-N 3Å
1089	E	82.5	Confident	89.6	Confident	84 Å²	84	28.5 Å²	28.5	39%	0.393	17%	0.167	S	C	.	.	H	α-helix	trans	-54.5	-46.6	178.2	-173	174.2	165	0	0	111.4	R396 G1091 A1092 H1093	R396-E1089 IonicContact CZ-OE2 3.33Å; R396-E1089 IonicContact NH1-OE2 3.04Å; R396-E1089 PolarHBondContact NH1-OE2 2.82Å; R396-E1089 IonicContact NH2-OE2 3.69Å; R396-E1089 PolarHBondContact NH2-OE2 3.36Å; E1089-G1091 VanDerWaalsContact C-N 3.35Å; E1089-G1091 PolarHBondContact O-N 3.09Å; E1089-A1092 PolarHBondContact O-N 3.08Å; E1089-H1093 PolarHBondContact O-CD2 3.49Å; E1089-H1093 PolarHBondContact O-N 3.29Å
1090	I	82.9	Confident	89.7	Confident	49 Å²	49	25 Å²	25	25%	0.251	15%	0.154	S	C	.	.	H	α-helix	trans	-65.6	-36.7	-180	-55.4	-176.2	0	0	0	112.1	S668 S1033 S1034 V1036 T1088	S668-I1090 VanDerWaalsContact CB-CG2 3.5Å; S668-I1090 WeakPolarHBondContact CB-O 3.2Å; S668-I1090 WeakPolarHBondContact OG-CG2 3.45Å; S668-I1090 PolarHBondContact OG-O 2.87Å; S1033-I1090 VanDerWaalsContact O-CD1 3.28Å; S1033-I1090 WeakPolarHBondContact O-CD1 3.23Å; S1034-I1090 VanDerWaalsContact O-CD1 3.29Å; S1034-I1090 WeakPolarHBondContact O-CD1 3.46Å; V1036-I1090 HydrophobicContact CB-CG2 4.12Å; T1088-I1090 VanDerWaalsContact C-N 3.3Å; T1088-I1090 PolarHBondContact O-N 3.2Å
1091	G	86.6	Confident	90.1	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-76.8	-36.9	177.5	0	0	0	0	0	113.1	A1085 T1088 E1089 H1093 C1094 L1097	A1085-G1091 WeakPolarHBondContact O-CA 3.4Å; T1088-G1091 PolarHBondContact O-N 3.23Å; T1088-G1091 VanDerWaalsContact O-N 3.13Å; T1088-G1091 PolarHBondContact OG1-N 3.41Å; T1088-G1091 VanDerWaalsContact OG1-N 3.12Å; E1089-G1091 VanDerWaalsContact C-N 3.35Å; E1089-G1091 PolarHBondContact O-N 3.09Å; G1091-H1093 PolarHBondContact O-N 3.18Å; G1091-C1094 WeakPolarHBondContact O-CB 3.18Å; G1091-C1094 PolarHBondContact O-N 3.21Å; G1091-L1097 WeakPolarHBondContact O-CD2 3.5Å
1092	A	89.6	Confident	90.3	Very high	8 Å²	8	21.5 Å²	21.5	7%	0.066	13%	0.127	C	C	.	.	H	α-helix	trans	-60.1	-32.6	175.9	0	0	0	0	0	111.9	T1088 E1089 W1098 N1124	T1088-A1092 WeakPolarHBondContact O-CB 3.47Å; T1088-A1092 PolarHBondContact O-N 3Å; E1089-A1092 PolarHBondContact O-N 3.08Å; A1092-W1098 PolarHBondContact O-NE1 3.49Å; A1092-N1124 WeakPolarHBondContact O-CB 3.35Å
1093	H	90.3	Very high	90.3	Very high	24 Å²	24	22.6 Å²	22.6	11%	0.111	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	13.1	176.6	-55.8	-58.2	0	0	0	114.1	L430 S434 M669 E1089 G1091 P1095 N1124	L430-H1093 HydrophobicContact CD1-CB 4.28Å; S434-H1093 VanDerWaalsContact CB-CE1 3.47Å; S434-H1093 WeakPolarHBondContact CB-CE1 3.48Å; S434-H1093 PolarHBondContact OG-CE1 2.95Å; S434-H1093 PolarHBondContact OG-ND1 3.48Å; S434-H1093 VanDerWaalsContact OG-ND1 3.07Å; M669-H1093 VanDerWaalsContact CA-O 3.28Å; M669-H1093 WeakPolarHBondContact CA-O 3.4Å; M669-H1093 HydrophobicContact CG-CB 3.97Å; E1089-H1093 PolarHBondContact O-CD2 3.49Å; E1089-H1093 PolarHBondContact O-N 3.29Å; G1091-H1093 PolarHBondContact O-N 3.18Å; H1093-P1095 WeakPolarHBondContact O-CD 3.44Å; H1093-N1124 PolarHBondContact ND1-O 2.79Å
1094	C	91.7	Very high	90.4	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	12%	0.116	C	C	.	.			trans	-95.3	109.8	178.8	-178.8	0	0	0	0	111.1	V1036 G1091 L1096 L1097 W1098	V1036-C1094 HydrophobicContact CG2-CB 4.21Å; G1091-C1094 WeakPolarHBondContact O-CB 3.18Å; G1091-C1094 PolarHBondContact O-N 3.21Å; C1094-L1096 PolarHBondContact O-N 3.28Å; C1094-L1097 HydrophobicContact CB-CB 3.97Å; C1094-L1097 PolarHBondContact O-N 3.46Å; C1094-W1098 VanDerWaalsContact O-CD1 3.3Å
1095	P	92.2	Very high	90.6	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-59.3	-47.6	-178.9	-25.2	34.9	0	0	0	113.5	M669 L671 E672 H1093 L1097 W1098 R1099 I1125 V1128	M669-P1095 WeakPolarHBondContact O-CD 3.39Å; M669-P1095 WeakPolarHBondContact O-CG 3.47Å; L671-P1095 WeakPolarHBondContact O-CD 3.32Å; E672-P1095 HydrophobicContact CG-CB 3.77Å; E672-P1095 HydrophobicContact CG-CG 4.05Å; H1093-P1095 WeakPolarHBondContact O-CD 3.44Å; P1095-L1097 PolarHBondContact O-N 3.25Å; P1095-W1098 PolarHBondContact O-N 3.1Å; P1095-R1099 VanDerWaalsContact O-CG 3.29Å; P1095-R1099 WeakPolarHBondContact O-CG 3.49Å; P1095-R1099 PolarHBondContact O-N 3.41Å; P1095-I1125 HydrophobicContact CB-CD1 4.47Å; P1095-V1128 HydrophobicContact CB-CG1 4.03Å; P1095-V1128 HydrophobicContact CB-CG2 3.98Å; P1095-V1128 HydrophobicContact CG-CG2 3.72Å
1096	L	91.7	Very high	90.7	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-56.6	-38.8	-178.7	179.5	59	0	0	0	112.3	L671 L674 L677 L706 L1040 C1094 M1100	L671-L1096 HydrophobicContact CB-CB 4.26Å; L671-L1096 HydrophobicContact CB-CD2 4.46Å; L671-L1096 WeakPolarHBondContact O-CB 3.48Å; L671-L1096 PolarHBondContact O-N 2.98Å; L674-L1096 HydrophobicContact CD2-CD1 3.97Å; L674-L1096 HydrophobicContact CG-CD1 4.13Å; L677-L1096 HydrophobicContact CD1-CD2 3.9Å; L677-L1096 HydrophobicContact CD1-CG 4.45Å; L677-L1096 HydrophobicContact CG-CD2 4.41Å; L706-L1096 HydrophobicContact CD1-CD1 3.99Å; L1040-L1096 HydrophobicContact CD1-CD2 4.19Å; C1094-L1096 PolarHBondContact O-N 3.28Å; L1096-M1100 HydrophobicContact CD1-CG 4.12Å; L1096-M1100 HydrophobicContact CD1-SD 4.09Å; L1096-M1100 HydrophobicContact CG-CG 4.46Å; L1096-M1100 HydrophobicContact CG-SD 3.93Å; L1096-M1100 WeakPolarHBondContact O-CB 3.44Å; L1096-M1100 WeakPolarHBondContact O-CG 3.45Å; L1096-M1100 PolarHBondContact O-N 3.46Å
1097	L	93.6	Very high	90.7	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-62.4	-47.3	179.5	-178.3	66.6	0	0	0	111.7	L1040 I1043 F1082 A1085 T1086 G1091 C1094 P1095 M1100 Y1101	L1040-L1097 HydrophobicContact CD2-CB 4.09Å; L1040-L1097 HydrophobicContact CD2-CD1 3.81Å; I1043-L1097 HydrophobicContact CD1-CD1 3.6Å; F1082-L1097 HydrophobicContact CD1-CD1 3.79Å; F1082-L1097 HydrophobicContact CE1-CD1 4.05Å; A1085-L1097 HydrophobicContact CB-CD1 3.97Å; A1085-L1097 HydrophobicContact CB-CD2 3.67Å; A1085-L1097 HydrophobicContact CB-CG 4.47Å; T1086-L1097 HydrophobicContact CG2-CD2 3.65Å; T1086-L1097 HydrophobicContact CG2-CG 4.08Å; G1091-L1097 WeakPolarHBondContact O-CD2 3.5Å; C1094-L1097 HydrophobicContact CB-CB 3.97Å; C1094-L1097 PolarHBondContact O-N 3.46Å; P1095-L1097 PolarHBondContact O-N 3.25Å; L1097-M1100 PolarHBondContact O-N 3.48Å; L1097-Y1101 WeakPolarHBondContact O-CB 3.45Å; L1097-Y1101 PolarHBondContact O-N 3.27Å
1098	W	94.9	Very high	90.8	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.008	11%	0.113	C	C	.	.	H	α-helix	trans	-66.3	-46	179.1	-72.4	110.3	0	0	0	112.1	T1086 A1092 C1094 P1095 M1100 Y1101 I1102 I1117 K1120 A1121 I1125	T1086-W1098 HydrophobicContact CG2-CD2 4.08Å; T1086-W1098 HydrophobicContact CG2-CE3 4.03Å; T1086-W1098 HydrophobicContact CG2-CH2 3.66Å; T1086-W1098 HydrophobicContact CG2-CZ2 3.71Å; T1086-W1098 HydrophobicContact CG2-CZ3 3.82Å; A1092-W1098 PolarHBondContact O-NE1 3.49Å; C1094-W1098 VanDerWaalsContact O-CD1 3.3Å; P1095-W1098 PolarHBondContact O-N 3.1Å; W1098-M1100 VanDerWaalsContact C-N 3.31Å; W1098-M1100 PolarHBondContact O-N 2.91Å; W1098-Y1101 HydrophobicContact CE3-CD1 4.4Å; W1098-Y1101 HydrophobicContact CZ3-CD1 4.35Å; W1098-Y1101 PolarHBondContact O-N 3.04Å; W1098-I1102 WeakPolarHBondContact O-CG1 3.4Å; W1098-I1102 PolarHBondContact O-N 3.48Å; W1098-I1117 HydrophobicContact CE3-CG2 3.98Å; W1098-I1117 HydrophobicContact CZ3-CG2 4Å; W1098-K1120 HydrophobicContact CH2-CD 4.09Å; W1098-K1120 HydrophobicContact CH2-CG 4.07Å; W1098-K1120 HydrophobicContact CZ3-CD 4.37Å; W1098-K1120 HydrophobicContact CZ3-CG 4.42Å; W1098-A1121 HydrophobicContact CB-CB 3.88Å; W1098-A1121 HydrophobicContact CD2-CB 3.55Å; W1098-A1121 HydrophobicContact CE3-CB 3.66Å; W1098-A1121 HydrophobicContact CG-CB 3.67Å; W1098-A1121 HydrophobicContact CZ3-CB 4.39Å; W1098-I1125 HydrophobicContact CB-CD1 3.86Å; W1098-I1125 VanDerWaalsContact CD1-CD1 3.44Å; W1098-I1125 HydrophobicContact CG-CD1 3.86Å; W1098-I1125 HydrophobicContact CG-CG1 4.45Å
1099	R	93.8	Very high	90.9	Very high	2 Å²	2	22 Å²	22	1%	0.008	13%	0.134	C	C	.	.	H	α-helix	trans	-56	-47.5	176.5	-63.6	177.5	76.3	172.9	17.8	110.7	E672 T704 L706 P1095 Y1101 I1102 H1103 G1130 L1131 D1134	E672-R1099 PolarHBondContact O-NH1 3.26Å; E672-R1099 VanDerWaalsContact O-NH1 3.13Å; T704-R1099 PolarHBondContact O-NH2 3.39Å; L706-R1099 HydrophobicContact CD1-CB 3.8Å; L706-R1099 HydrophobicContact CD2-CB 4.03Å; L706-R1099 HydrophobicContact CG-CB 4.35Å; P1095-R1099 VanDerWaalsContact O-CG 3.29Å; P1095-R1099 WeakPolarHBondContact O-CG 3.49Å; P1095-R1099 PolarHBondContact O-N 3.41Å; R1099-Y1101 VanDerWaalsContact C-N 3.34Å; R1099-Y1101 PolarHBondContact O-N 3.34Å; R1099-I1102 PolarHBondContact O-N 3.33Å; R1099-H1103 WeakPolarHBondContact O-CB 3.5Å; R1099-H1103 PolarHBondContact O-N 3.07Å; R1099-G1130 PolarHBondContact NH2-O 3.42Å; R1099-L1131 HydrophobicContact CG-CD1 4.09Å; R1099-D1134 WeakPolarHBondContact CB-OD2 3.28Å; R1099-D1134 VanDerWaalsContact CG-OD2 3.27Å; R1099-D1134 WeakPolarHBondContact CG-OD2 3.47Å; R1099-D1134 IonicContact CZ-OD1 2.67Å; R1099-D1134 IonicContact CZ-OD2 2.75Å; R1099-D1134 IonicContact NE-OD1 3.26Å; R1099-D1134 IonicContact NE-OD2 3.88Å; R1099-D1134 PolarHBondContact NE-OD2 3.45Å; R1099-D1134 IonicContact NH2-OD1 3.94Å; R1099-D1134 PolarHBondContact NH2-OD1 3.05Å; R1099-D1134 IonicContact NH2-OD2 3.17Å; R1099-D1134 PolarHBondContact NH2-OD2 3.01Å
1100	M	93.6	Very high	91.3	Very high	7 Å²	7	21.4 Å²	21.4	3%	0.034	13%	0.129	C	C	.	.	H	α-helix	trans	-60.3	-39.9	175.1	-75.5	174.2	68	0	0	113.1	L674 L677 L706 L1040 I1043 V1044 F1082 L1096 L1097 W1098 F1104	L674-M1100 HydrophobicContact CD2-CG 3.75Å; L674-M1100 HydrophobicContact CD2-SD 3.96Å; L677-M1100 HydrophobicContact CD1-CE 3.87Å; L677-M1100 HydrophobicContact CD1-SD 3.48Å; L677-M1100 WeakPolarHBondContact CD1-SD 3.2Å; L706-M1100 HydrophobicContact CD2-CG 4.45Å; L1040-M1100 HydrophobicContact CD2-SD 4.13Å; I1043-M1100 HydrophobicContact CG2-CE 4.16Å; V1044-M1100 HydrophobicContact CG2-CE 3.86Å; F1082-M1100 HydrophobicContact CE1-CB 3.84Å; F1082-M1100 HydrophobicContact CZ-CB 3.99Å; L1096-M1100 HydrophobicContact CD1-CG 4.12Å; L1096-M1100 HydrophobicContact CD1-SD 4.09Å; L1096-M1100 HydrophobicContact CG-CG 4.46Å; L1096-M1100 HydrophobicContact CG-SD 3.93Å; L1096-M1100 WeakPolarHBondContact O-CB 3.44Å; L1096-M1100 WeakPolarHBondContact O-CG 3.45Å; L1096-M1100 PolarHBondContact O-N 3.46Å; L1097-M1100 PolarHBondContact O-N 3.48Å; W1098-M1100 VanDerWaalsContact C-N 3.31Å; W1098-M1100 PolarHBondContact O-N 2.91Å; M1100-F1104 VanDerWaalsContact O-CB 3.3Å; M1100-F1104 WeakPolarHBondContact O-CB 3.35Å; M1100-F1104 PolarHBondContact O-N 3.13Å
1101	Y	94.9	Very high	91.7	Very high	7 Å²	7	22.1 Å²	22.1	3%	0.027	14%	0.136	C	C	.	.	H	α-helix	trans	-67.5	-46	-177.9	-172.1	-162.9	0	0	0	111.8	R1079 F1082 L1097 W1098 R1099 H1103 F1104 L1105 I1117	R1079-Y1101 HydrophobicContact CG-CE2 4.33Å; F1082-Y1101 HydrophobicContact CB-CD1 3.97Å; F1082-Y1101 HydrophobicContact CB-CD2 3.64Å; F1082-Y1101 HydrophobicContact CB-CE1 4.14Å; F1082-Y1101 HydrophobicContact CB-CE2 3.84Å; F1082-Y1101 HydrophobicContact CB-CG 3.73Å; F1082-Y1101 HydrophobicContact CD1-CD2 4.12Å; F1082-Y1101 AromaticContact CD1-CG 3.87Å; F1082-Y1101 HydrophobicContact CD1-CG 3.87Å; F1082-Y1101 AromaticContact CD2-CD2 3.54Å; F1082-Y1101 HydrophobicContact CD2-CD2 3.54Å; F1082-Y1101 HydrophobicContact CD2-CE2 4.11Å; F1082-Y1101 HydrophobicContact CD2-CG 4.16Å; F1082-Y1101 HydrophobicContact CE1-CG 4.48Å; F1082-Y1101 HydrophobicContact CE2-CD2 4.15Å; F1082-Y1101 HydrophobicContact CG-CD1 4.4Å; F1082-Y1101 AromaticContact CG-CD2 3.52Å; F1082-Y1101 HydrophobicContact CG-CD2 3.52Å; F1082-Y1101 HydrophobicContact CG-CE2 4.16Å; F1082-Y1101 AromaticContact CG-CG 3.69Å; F1082-Y1101 HydrophobicContact CG-CG 3.69Å; L1097-Y1101 WeakPolarHBondContact O-CB 3.45Å; L1097-Y1101 PolarHBondContact O-N 3.27Å; W1098-Y1101 HydrophobicContact CE3-CD1 4.4Å; W1098-Y1101 HydrophobicContact CZ3-CD1 4.35Å; W1098-Y1101 PolarHBondContact O-N 3.04Å; R1099-Y1101 VanDerWaalsContact C-N 3.34Å; R1099-Y1101 PolarHBondContact O-N 3.34Å; Y1101-H1103 VanDerWaalsContact C-N 3.33Å; Y1101-H1103 PolarHBondContact O-N 2.83Å; Y1101-F1104 PolarHBondContact O-N 3.46Å; Y1101-L1105 HydrophobicContact CD2-CD1 4.08Å; Y1101-L1105 HydrophobicContact CD2-CG 4.03Å; Y1101-L1105 HydrophobicContact CE2-CD1 3.65Å; Y1101-L1105 HydrophobicContact CE2-CD2 4.03Å; Y1101-L1105 HydrophobicContact CE2-CG 3.73Å; Y1101-L1105 PolarHBondContact O-N 2.87Å; Y1101-I1117 HydrophobicContact CD1-CD1 4.43Å; Y1101-I1117 HydrophobicContact CD1-CG1 4.36Å; Y1101-I1117 HydrophobicContact CD1-CG2 3.54Å; Y1101-I1117 HydrophobicContact CE1-CD1 3.64Å; Y1101-I1117 HydrophobicContact CE1-CG1 3.84Å; Y1101-I1117 HydrophobicContact CE1-CG2 3.87Å; Y1101-I1117 HydrophobicContact CG-CG2 4.16Å
1102	I	95.1	Very high	91.8	Very high	2 Å²	2	28 Å²	28	1%	0.01	17%	0.167	C	C	.	.	H	α-helix	trans	-59.8	-48.5	176.5	-61.8	164.9	0	0	0	109.2	W1098 R1099 F1104 L1105 V1106 A1114 I1117 F1118 L1131 L1138 F1139	W1098-I1102 WeakPolarHBondContact O-CG1 3.4Å; W1098-I1102 PolarHBondContact O-N 3.48Å; R1099-I1102 PolarHBondContact O-N 3.33Å; I1102-F1104 VanDerWaalsContact C-N 3.3Å; I1102-F1104 PolarHBondContact O-N 2.6Å; I1102-L1105 PolarHBondContact O-N 3.19Å; I1102-L1105 VanDerWaalsContact O-N 3.16Å; I1102-V1106 WeakPolarHBondContact O-CG2 3.33Å; I1102-V1106 PolarHBondContact O-N 3.01Å; I1102-A1114 HydrophobicContact CG2-CB 4.18Å; I1102-I1117 HydrophobicContact CG1-CG2 3.85Å; I1102-F1118 HydrophobicContact CD1-CB 4.02Å; I1102-F1118 HydrophobicContact CD1-CD2 4.31Å; I1102-L1131 HydrophobicContact CD1-CD1 3.59Å; I1102-L1138 HydrophobicContact CG2-CD1 3.69Å; I1102-F1139 HydrophobicContact CG2-CE2 4.34Å; I1102-F1139 HydrophobicContact CG2-CZ 4.07Å
1103	H	93.1	Very high	91.9	Very high	24 Å²	24	34.1 Å²	34.1	11%	0.111	19%	0.193	C	C	.	.	H	α-helix	trans	-61.5	-38.7	-179.4	-138.4	-54.9	0	0	0	113	L706 Q707 R1099 Y1101 S1107	L706-H1103 HydrophobicContact CD2-CB 3.96Å; Q707-H1103 VanDerWaalsContact CG-NE2 3.33Å; Q707-H1103 WeakPolarHBondContact CG-NE2 3.39Å; Q707-H1103 PolarHBondContact NE2-CE1 3.33Å; Q707-H1103 PolarHBondContact NE2-NE2 3.41Å; Q707-H1103 PolarHBondContact OE1-CE1 3.42Å; R1099-H1103 WeakPolarHBondContact O-CB 3.5Å; R1099-H1103 PolarHBondContact O-N 3.07Å; Y1101-H1103 VanDerWaalsContact C-N 3.33Å; Y1101-H1103 PolarHBondContact O-N 2.83Å; H1103-S1107 WeakPolarHBondContact O-CB 3.39Å; H1103-S1107 PolarHBondContact O-N 3.37Å
1104	F	93	Very high	92.1	Very high	13 Å²	13	33 Å²	33	6%	0.057	19%	0.187	C	C	.	.	H	α-helix	trans	-63.5	-44.9	175.4	172.1	-106.6	0	0	0	111.8	K1050 I1078 F1082 M1100 Y1101 I1102 S1107 E1108	K1050-F1104 HydrophobicContact CD-CE2 4.39Å; I1078-F1104 HydrophobicContact CB-CE1 4.08Å; I1078-F1104 HydrophobicContact CB-CE2 4.2Å; I1078-F1104 HydrophobicContact CB-CZ 3.71Å; I1078-F1104 HydrophobicContact CD1-CE2 3.92Å; I1078-F1104 HydrophobicContact CD1-CZ 4.1Å; I1078-F1104 HydrophobicContact CG2-CD1 3.99Å; I1078-F1104 HydrophobicContact CG2-CD2 4.05Å; I1078-F1104 HydrophobicContact CG2-CE1 3.65Å; I1078-F1104 HydrophobicContact CG2-CE2 3.72Å; I1078-F1104 HydrophobicContact CG2-CG 4.18Å; I1078-F1104 HydrophobicContact CG2-CZ 3.51Å; F1082-F1104 HydrophobicContact CD2-CD1 4.14Å; F1082-F1104 HydrophobicContact CE2-CB 3.9Å; F1082-F1104 AromaticContact CE2-CD1 3.84Å; F1082-F1104 HydrophobicContact CE2-CD1 3.84Å; F1082-F1104 AromaticContact CE2-CG 3.89Å; F1082-F1104 HydrophobicContact CE2-CG 3.89Å; F1082-F1104 HydrophobicContact CZ-CB 4.3Å; M1100-F1104 VanDerWaalsContact O-CB 3.3Å; M1100-F1104 WeakPolarHBondContact O-CB 3.35Å; M1100-F1104 PolarHBondContact O-N 3.13Å; Y1101-F1104 PolarHBondContact O-N 3.46Å; I1102-F1104 VanDerWaalsContact C-N 3.3Å; I1102-F1104 PolarHBondContact O-N 2.6Å; F1104-S1107 PolarHBondContact O-N 3.28Å; F1104-S1107 PolarHBondContact O-OG 3.45Å; F1104-E1108 HydrophobicContact CE1-CG 4.49Å; F1104-E1108 HydrophobicContact CE2-CG 4.16Å; F1104-E1108 HydrophobicContact CZ-CG 4.05Å; F1104-E1108 PolarHBondContact O-N 3.42Å
1105	L	92.6	Very high	92.2	Very high	4 Å²	4	37 Å²	37	2%	0.021	20%	0.202	C	C	.	.	H	α-helix	trans	-65.8	-39.2	179	-71.9	176.5	0	0	0	112.8	Y1101 I1102 S1107 E1108 G1109 K1110 A1114 I1117	Y1101-L1105 HydrophobicContact CD2-CD1 4.08Å; Y1101-L1105 HydrophobicContact CD2-CG 4.03Å; Y1101-L1105 HydrophobicContact CE2-CD1 3.65Å; Y1101-L1105 HydrophobicContact CE2-CD2 4.03Å; Y1101-L1105 HydrophobicContact CE2-CG 3.73Å; Y1101-L1105 PolarHBondContact O-N 2.87Å; I1102-L1105 PolarHBondContact O-N 3.19Å; I1102-L1105 VanDerWaalsContact O-N 3.16Å; L1105-S1107 VanDerWaalsContact C-N 3.34Å; L1105-E1108 PolarHBondContact O-N 3.11Å; L1105-G1109 PolarHBondContact O-N 3.47Å; L1105-K1110 PolarHBondContact O-N 3.44Å; L1105-A1114 HydrophobicContact CB-CB 3.77Å; L1105-A1114 HydrophobicContact CD1-CB 4.49Å; L1105-I1117 HydrophobicContact CD1-CB 4.24Å; L1105-I1117 HydrophobicContact CD1-CG1 3.63Å
1106	V	91.8	Very high	92.3	Very high	35 Å²	35	39.1 Å²	39.1	21%	0.212	22%	0.224	C	C	.	.	H	α-helix	trans	-63.9	-41.4	173.7	177.2	0	0	0	0	110.6	I1102 E1108 G1109 A1114 L1138 F1139	I1102-V1106 WeakPolarHBondContact O-CG2 3.33Å; I1102-V1106 PolarHBondContact O-N 3.01Å; V1106-E1108 PolarHBondContact O-N 2.93Å; V1106-E1108 VanDerWaalsContact O-N 3.17Å; V1106-G1109 PolarHBondContact O-N 3.27Å; V1106-A1114 HydrophobicContact CG2-CB 3.56Å; V1106-L1138 HydrophobicContact CB-CD2 4.32Å; V1106-L1138 HydrophobicContact CG1-CD2 4.06Å; V1106-L1138 HydrophobicContact CG2-CB 4.34Å; V1106-L1138 HydrophobicContact CG2-CD1 4.28Å; V1106-L1138 HydrophobicContact CG2-CD2 4.31Å; V1106-F1139 HydrophobicContact CG2-CE1 4.18Å; V1106-F1139 HydrophobicContact CG2-CZ 4.37Å
1107	S	89.6	Confident	92.5	Very high	85 Å²	85	40.3 Å²	40.3	59%	0.594	23%	0.231	S	C	*	.	H	α-helix	trans	-62.8	-22.5	176.8	76.9	0	0	0	0	114	H1103 F1104 L1105 G1109	H1103-S1107 WeakPolarHBondContact O-CB 3.39Å; H1103-S1107 PolarHBondContact O-N 3.37Å; F1104-S1107 PolarHBondContact O-N 3.28Å; F1104-S1107 PolarHBondContact O-OG 3.45Å; L1105-S1107 VanDerWaalsContact C-N 3.34Å; S1107-G1109 VanDerWaalsContact C-N 3.34Å
1108	E	88.2	Confident	92.6	Very high	54 Å²	54	40.3 Å²	40.3	25%	0.252	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	4.7	174.4	-72.4	-82.7	116.5	0	0	113	K1050 S1075 F1104 L1105 V1106 K1110	K1050-E1108 WeakPolarHBondContact CE-OE1 3.41Å; K1050-E1108 IonicContact NZ-OE1 2.89Å; K1050-E1108 PolarHBondContact NZ-OE1 3.29Å; S1075-E1108 WeakPolarHBondContact CB-OE2 3.33Å; S1075-E1108 VanDerWaalsContact OG-CD 3.24Å; S1075-E1108 PolarHBondContact OG-OE1 3.4Å; S1075-E1108 PolarHBondContact OG-OE2 2.99Å; F1104-E1108 HydrophobicContact CE1-CG 4.49Å; F1104-E1108 HydrophobicContact CE2-CG 4.16Å; F1104-E1108 HydrophobicContact CZ-CG 4.05Å; F1104-E1108 PolarHBondContact O-N 3.42Å; L1105-E1108 PolarHBondContact O-N 3.11Å; V1106-E1108 PolarHBondContact O-N 2.93Å; V1106-E1108 VanDerWaalsContact O-N 3.17Å; E1108-K1110 VanDerWaalsContact C-N 3.32Å; E1108-K1110 PolarHBondContact O-N 3.44Å
1109	G	87.5	Confident	92.5	Very high	63 Å²	63	43.9 Å²	43.9	65%	0.649	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.3	13.9	-178.2	0	0	0	0	0	114.8	L1105 V1106 S1107 V1111	L1105-G1109 PolarHBondContact O-N 3.47Å; V1106-G1109 PolarHBondContact O-N 3.27Å; S1107-G1109 VanDerWaalsContact C-N 3.34Å; G1109-V1111 PolarHBondContact O-N 2.87Å
1110	K	89.9	Confident	92.5	Very high	70 Å²	70	48.4 Å²	48.4	30%	0.304	26%	0.264	S	S	.	.			trans	-99.5	59.1	-176.7	-64	174	-175.6	160.6	0	111.6	L1105 E1108 D1112 K1113 A1114	L1105-K1110 PolarHBondContact O-N 3.44Å; E1108-K1110 VanDerWaalsContact C-N 3.32Å; E1108-K1110 PolarHBondContact O-N 3.44Å; K1110-D1112 PolarHBondContact O-N 3.05Å; K1110-K1113 HydrophobicContact CB-CB 4.27Å; K1110-K1113 HydrophobicContact CB-CD 4.49Å; K1110-K1113 HydrophobicContact CD-CD 4.38Å; K1110-K1113 PolarHBondContact O-N 3.21Å; K1110-A1114 PolarHBondContact O-N 3.48Å
1111	V	91.4	Very high	92.6	Very high	64 Å²	64	48.1 Å²	48.1	39%	0.388	26%	0.263	S	S	.	.	H	α-helix	trans	-59.4	-46.1	-172.9	-174.1	0	0	0	0	112.3	G1109 K1113 A1114 R1115 F1139	G1109-V1111 PolarHBondContact O-N 2.87Å; V1111-K1113 VanDerWaalsContact C-N 3.3Å; V1111-K1113 PolarHBondContact O-N 2.87Å; V1111-A1114 WeakPolarHBondContact O-CA 3.43Å; V1111-A1114 WeakPolarHBondContact O-CB 3.5Å; V1111-A1114 PolarHBondContact O-N 2.87Å; V1111-R1115 PolarHBondContact O-N 3.14Å; V1111-F1139 HydrophobicContact CG1-CD1 3.6Å; V1111-F1139 HydrophobicContact CG1-CE1 3.62Å
1112	D	89.9	Confident	92.5	Very high	124 Å²	124	47.9 Å²	47.9	66%	0.663	26%	0.262	S	S	*	.	H	α-helix	trans	-60.4	-39.9	179.4	-61.8	-49	0	0	0	112.9	K1110 R1115 G1116	K1110-D1112 PolarHBondContact O-N 3.05Å; D1112-R1115 PolarHBondContact O-N 3.48Å; D1112-G1116 PolarHBondContact O-N 3.01Å
1113	K	91.5	Very high	92.3	Very high	137 Å²	137	53.8 Å²	53.8	60%	0.596	29%	0.29	S	S	*	.	H	α-helix	trans	-69.1	-39.1	176.4	-66.7	-173.4	178.5	-177.5	0	110.8	K1110 V1111 R1115 G1116 I1117	K1110-K1113 HydrophobicContact CB-CB 4.27Å; K1110-K1113 HydrophobicContact CB-CD 4.49Å; K1110-K1113 HydrophobicContact CD-CD 4.38Å; K1110-K1113 PolarHBondContact O-N 3.21Å; V1111-K1113 VanDerWaalsContact C-N 3.3Å; V1111-K1113 PolarHBondContact O-N 2.87Å; K1113-R1115 VanDerWaalsContact C-N 3.31Å; K1113-R1115 PolarHBondContact O-N 2.93Å; K1113-G1116 PolarHBondContact O-N 3.37Å; K1113-I1117 WeakPolarHBondContact O-CG1 3.46Å; K1113-I1117 PolarHBondContact O-N 3.19Å
1114	A	94.1	Very high	92.2	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-60.9	-41.5	175.5	0	0	0	0	0	111.3	I1102 L1105 V1106 K1110 V1111 I1117 F1118 F1139	I1102-A1114 HydrophobicContact CG2-CB 4.18Å; L1105-A1114 HydrophobicContact CB-CB 3.77Å; L1105-A1114 HydrophobicContact CD1-CB 4.49Å; V1106-A1114 HydrophobicContact CG2-CB 3.56Å; K1110-A1114 PolarHBondContact O-N 3.48Å; V1111-A1114 WeakPolarHBondContact O-CA 3.43Å; V1111-A1114 WeakPolarHBondContact O-CB 3.5Å; V1111-A1114 PolarHBondContact O-N 2.87Å; A1114-I1117 CarbonylContact O-C 3.44Å; A1114-I1117 PolarHBondContact O-N 3.49Å; A1114-F1118 PolarHBondContact O-N 3.23Å; A1114-F1139 HydrophobicContact CB-CE1 4.09Å; A1114-F1139 HydrophobicContact CB-CZ 3.85Å
1115	R	94	Very high	92.2	Very high	83 Å²	83	53.9 Å²	53.9	31%	0.313	29%	0.292	S	S	.	.	H	α-helix	trans	-63.3	-42.7	174.2	-170.3	179.4	65.2	-172	-2.2	112.2	V1111 D1112 K1113 I1117 F1118 Y1119 F1139 H1142	V1111-R1115 PolarHBondContact O-N 3.14Å; D1112-R1115 PolarHBondContact O-N 3.48Å; K1113-R1115 VanDerWaalsContact C-N 3.31Å; K1113-R1115 PolarHBondContact O-N 2.93Å; R1115-I1117 VanDerWaalsContact C-N 3.3Å; R1115-I1117 PolarHBondContact O-N 2.72Å; R1115-F1118 WeakPolarHBondContact O-CB 3.26Å; R1115-F1118 PolarHBondContact O-N 3Å; R1115-F1118 VanDerWaalsContact O-N 3.15Å; R1115-Y1119 HydrophobicContact CG-CD2 4.28Å; R1115-Y1119 HydrophobicContact CG-CE2 3.63Å; R1115-Y1119 WeakPolarHBondContact O-CD2 3.24Å; R1115-Y1119 PolarHBondContact O-N 3.21Å; R1115-F1139 HydrophobicContact CB-CE1 4.17Å; R1115-F1139 HydrophobicContact CB-CE2 4.49Å; R1115-F1139 HydrophobicContact CB-CZ 4.12Å; R1115-H1142 PolarHBondContact NH1-CE1 3.25Å; R1115-H1142 PolarHBondContact NH1-NE2 3.41Å
1116	G	93.8	Very high	92.3	Very high	45 Å²	45	53.7 Å²	53.7	46%	0.464	29%	0.291	S	S	.	.	H	α-helix	trans	-60	-38.6	172.5	0	0	0	0	0	113.3	D1112 K1113 K1120	D1112-G1116 PolarHBondContact O-N 3.01Å; K1113-G1116 PolarHBondContact O-N 3.37Å; G1116-K1120 PolarHBondContact O-N 2.94Å; G1116-K1120 VanDerWaalsContact O-N 3.15Å
1117	I	95.4	Very high	92.4	Very high	25 Å²	25	52 Å²	52	13%	0.128	28%	0.28	C	S	.	.	H	α-helix	trans	-69	-34.6	174	-68.5	-54.7	0	0	0	112	W1098 Y1101 I1102 L1105 K1113 A1114 R1115 K1120 A1121	W1098-I1117 HydrophobicContact CE3-CG2 3.98Å; W1098-I1117 HydrophobicContact CZ3-CG2 4Å; Y1101-I1117 HydrophobicContact CD1-CD1 4.43Å; Y1101-I1117 HydrophobicContact CD1-CG1 4.36Å; Y1101-I1117 HydrophobicContact CD1-CG2 3.54Å; Y1101-I1117 HydrophobicContact CE1-CD1 3.64Å; Y1101-I1117 HydrophobicContact CE1-CG1 3.84Å; Y1101-I1117 HydrophobicContact CE1-CG2 3.87Å; Y1101-I1117 HydrophobicContact CG-CG2 4.16Å; I1102-I1117 HydrophobicContact CG1-CG2 3.85Å; L1105-I1117 HydrophobicContact CD1-CB 4.24Å; L1105-I1117 HydrophobicContact CD1-CG1 3.63Å; K1113-I1117 WeakPolarHBondContact O-CG1 3.46Å; K1113-I1117 PolarHBondContact O-N 3.19Å; A1114-I1117 CarbonylContact O-C 3.44Å; A1114-I1117 PolarHBondContact O-N 3.49Å; R1115-I1117 VanDerWaalsContact C-N 3.3Å; R1115-I1117 PolarHBondContact O-N 2.72Å; I1117-K1120 HydrophobicContact CD1-CD 4.38Å; I1117-K1120 WeakPolarHBondContact O-CB 3.34Å; I1117-K1120 PolarHBondContact O-N 3.19Å; I1117-A1121 WeakPolarHBondContact O-CB 3.26Å; I1117-A1121 PolarHBondContact O-N 3.19Å
1118	F	95.7	Very high	92.7	Very high	1 Å²	1	48 Å²	48	0%	0.004	25%	0.252	C	S	.	.	H	α-helix	trans	-58.1	-52.1	173.3	166.5	-101.5	0	0	0	111.6	I1102 A1114 R1115 K1120 A1121 L1122 L1131 Y1132 A1135 F1139 F1146	I1102-F1118 HydrophobicContact CD1-CB 4.02Å; I1102-F1118 HydrophobicContact CD1-CD2 4.31Å; A1114-F1118 PolarHBondContact O-N 3.23Å; R1115-F1118 WeakPolarHBondContact O-CB 3.26Å; R1115-F1118 PolarHBondContact O-N 3Å; R1115-F1118 VanDerWaalsContact O-N 3.15Å; F1118-K1120 VanDerWaalsContact C-N 3.27Å; F1118-K1120 PolarHBondContact O-N 3.47Å; F1118-A1121 WeakPolarHBondContact O-CA 3.26Å; F1118-A1121 WeakPolarHBondContact O-CB 3.23Å; F1118-A1121 PolarHBondContact O-N 3.24Å; F1118-L1122 HydrophobicContact CD1-CD1 4.12Å; F1118-L1122 HydrophobicContact CE1-CD1 3.5Å; F1118-L1122 VanDerWaalsContact CE1-CD1 3.5Å; F1118-L1122 HydrophobicContact CE1-CG 4.27Å; F1118-L1122 HydrophobicContact CE2-CD1 4.24Å; F1118-L1122 HydrophobicContact CE2-CD2 4.24Å; F1118-L1122 HydrophobicContact CE2-CG 4.23Å; F1118-L1122 HydrophobicContact CZ-CD1 3.58Å; F1118-L1122 HydrophobicContact CZ-CD2 4.21Å; F1118-L1122 HydrophobicContact CZ-CG 4.06Å; F1118-L1122 WeakPolarHBondContact O-CG 3.49Å; F1118-L1122 PolarHBondContact O-N 3.14Å; F1118-L1131 HydrophobicContact CD2-CD1 4.42Å; F1118-L1131 HydrophobicContact CD2-CD2 4.35Å; F1118-L1131 HydrophobicContact CD2-CG 4.01Å; F1118-L1131 HydrophobicContact CE2-CD2 4.3Å; F1118-L1131 HydrophobicContact CE2-CG 3.95Å; F1118-Y1132 HydrophobicContact CZ-CD1 4.25Å; F1118-A1135 HydrophobicContact CD2-CB 3.82Å; F1118-A1135 HydrophobicContact CE1-CB 4.34Å; F1118-A1135 HydrophobicContact CE2-CB 3.47Å; F1118-A1135 VanDerWaalsContact CE2-CB 3.47Å; F1118-A1135 HydrophobicContact CG-CB 4.39Å; F1118-A1135 HydrophobicContact CZ-CB 3.75Å; F1118-F1139 HydrophobicContact CB-CE2 4.4Å; F1118-F1146 HydrophobicContact CD1-CE1 4.25Å; F1118-F1146 AromaticContact CE1-CD1 3.9Å; F1118-F1146 HydrophobicContact CE1-CD1 3.9Å; F1118-F1146 AromaticContact CE1-CE1 3.59Å; F1118-F1146 HydrophobicContact CE1-CE1 3.59Å; F1118-F1146 HydrophobicContact CE1-CZ 4.47Å; F1118-F1146 HydrophobicContact CZ-CD1 4.06Å; F1118-F1146 HydrophobicContact CZ-CE1 4.11Å
1119	Y	94.6	Very high	92.9	Very high	76 Å²	76	45.4 Å²	45.4	30%	0.298	24%	0.24	S	C	.	.	H	α-helix	trans	-64.9	-31	176.7	-61.6	-69.7	0	0	0	113	R1115 L1122 Q1123 E1145	R1115-Y1119 HydrophobicContact CG-CD2 4.28Å; R1115-Y1119 HydrophobicContact CG-CE2 3.63Å; R1115-Y1119 WeakPolarHBondContact O-CD2 3.24Å; R1115-Y1119 PolarHBondContact O-N 3.21Å; Y1119-L1122 HydrophobicContact CD1-CD1 3.98Å; Y1119-L1122 PolarHBondContact O-N 3.48Å; Y1119-Q1123 PolarHBondContact O-N 3.18Å; Y1119-E1145 PolarHBondContact OH-OE1 2.9Å
1120	K	93.8	Very high	93.2	Very high	98 Å²	98	42.4 Å²	42.4	43%	0.426	21%	0.209	S	C	.	.	H	α-helix	trans	-65.7	-38.6	171.4	-171.7	-178.8	179.5	-174.8	0	112	W1098 G1116 I1117 F1118 Q1123 N1124	W1098-K1120 HydrophobicContact CH2-CD 4.09Å; W1098-K1120 HydrophobicContact CH2-CG 4.07Å; W1098-K1120 HydrophobicContact CZ3-CD 4.37Å; W1098-K1120 HydrophobicContact CZ3-CG 4.42Å; G1116-K1120 PolarHBondContact O-N 2.94Å; G1116-K1120 VanDerWaalsContact O-N 3.15Å; I1117-K1120 HydrophobicContact CD1-CD 4.38Å; I1117-K1120 WeakPolarHBondContact O-CB 3.34Å; I1117-K1120 PolarHBondContact O-N 3.19Å; F1118-K1120 VanDerWaalsContact C-N 3.27Å; F1118-K1120 PolarHBondContact O-N 3.47Å; K1120-Q1123 WeakPolarHBondContact O-CB 3.24Å; K1120-Q1123 PolarHBondContact O-N 3.49Å; K1120-N1124 PolarHBondContact O-ND2 3.45Å; K1120-N1124 VanDerWaalsContact O-ND2 3.1Å
1121	A	94.5	Very high	93.4	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-63.9	-42.7	174.6	0	0	0	0	0	110.6	W1098 I1117 F1118 Q1123 N1124 I1125 L1131	W1098-A1121 HydrophobicContact CB-CB 3.88Å; W1098-A1121 HydrophobicContact CD2-CB 3.55Å; W1098-A1121 HydrophobicContact CE3-CB 3.66Å; W1098-A1121 HydrophobicContact CG-CB 3.67Å; W1098-A1121 HydrophobicContact CZ3-CB 4.39Å; I1117-A1121 WeakPolarHBondContact O-CB 3.26Å; I1117-A1121 PolarHBondContact O-N 3.19Å; F1118-A1121 WeakPolarHBondContact O-CA 3.26Å; F1118-A1121 WeakPolarHBondContact O-CB 3.23Å; F1118-A1121 PolarHBondContact O-N 3.24Å; A1121-Q1123 PolarHBondContact O-N 3.39Å; A1121-N1124 PolarHBondContact O-N 3.21Å; A1121-I1125 HydrophobicContact CB-CD1 4.38Å; A1121-I1125 HydrophobicContact CB-CG1 4.24Å; A1121-I1125 WeakPolarHBondContact O-CG1 3.29Å; A1121-I1125 PolarHBondContact O-N 3.44Å; A1121-L1131 HydrophobicContact CB-CD2 3.89Å
1122	L	93.9	Very high	93.5	Very high	3 Å²	3	36 Å²	36	2%	0.016	18%	0.176	C	C	.	.	H	α-helix	trans	-58.3	-29.3	176.8	-68.7	178.9	0	0	0	113.8	F436 F1118 Y1119 N1124 P1126 L1131 Y1132 L1149	F436-L1122 HydrophobicContact CD2-CB 4.06Å; F436-L1122 WeakPolarHBondContact CD2-O 3.23Å; F436-L1122 HydrophobicContact CE2-CB 4.17Å; F436-L1122 HydrophobicContact CE2-CD1 4.45Å; F1118-L1122 HydrophobicContact CD1-CD1 4.12Å; F1118-L1122 HydrophobicContact CE1-CD1 3.5Å; F1118-L1122 VanDerWaalsContact CE1-CD1 3.5Å; F1118-L1122 HydrophobicContact CE1-CG 4.27Å; F1118-L1122 HydrophobicContact CE2-CD1 4.24Å; F1118-L1122 HydrophobicContact CE2-CD2 4.24Å; F1118-L1122 HydrophobicContact CE2-CG 4.23Å; F1118-L1122 HydrophobicContact CZ-CD1 3.58Å; F1118-L1122 HydrophobicContact CZ-CD2 4.21Å; F1118-L1122 HydrophobicContact CZ-CG 4.06Å; F1118-L1122 WeakPolarHBondContact O-CG 3.49Å; F1118-L1122 PolarHBondContact O-N 3.14Å; Y1119-L1122 HydrophobicContact CD1-CD1 3.98Å; Y1119-L1122 PolarHBondContact O-N 3.48Å; L1122-N1124 PolarHBondContact O-N 3.4Å; L1122-P1126 WeakPolarHBondContact O-CB 3.43Å; L1122-P1126 WeakPolarHBondContact O-CD 3.29Å; L1122-L1131 HydrophobicContact CD2-CD2 3.87Å; L1122-L1131 HydrophobicContact CG-CD2 4.45Å; L1122-Y1132 HydrophobicContact CD2-CE1 3.77Å; L1122-Y1132 HydrophobicContact CD2-CE2 3.86Å; L1122-Y1132 WeakPolarHBondContact CD2-OH 3.36Å; L1122-L1149 HydrophobicContact CD1-CD2 3.61Å
1123	Q	90.4	Very high	93.7	Very high	126 Å²	126	30.1 Å²	30.1	59%	0.589	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-15.9	174	-68.3	178.2	-11.1	0	0	114.1	S434 Y1119 K1120 A1121	S434-Q1123 CarbonylContact O-C 3.25Å; Y1119-Q1123 PolarHBondContact O-N 3.18Å; K1120-Q1123 WeakPolarHBondContact O-CB 3.24Å; K1120-Q1123 PolarHBondContact O-N 3.49Å; A1121-Q1123 PolarHBondContact O-N 3.39Å
1124	N	89.8	Confident	93.8	Very high	38 Å²	38	23.7 Å²	23.7	20%	0.203	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.8	-30.5	-176.1	-64.6	-84.7	0	0	0	113.4	S434 A1092 H1093 K1120 A1121 L1122 P1126 W1127	S434-N1124 WeakPolarHBondContact CB-O 3.39Å; S434-N1124 PolarHBondContact OG-O 3.16Å; A1092-N1124 WeakPolarHBondContact O-CB 3.35Å; H1093-N1124 PolarHBondContact ND1-O 2.79Å; K1120-N1124 PolarHBondContact O-ND2 3.45Å; K1120-N1124 VanDerWaalsContact O-ND2 3.1Å; A1121-N1124 PolarHBondContact O-N 3.21Å; L1122-N1124 PolarHBondContact O-N 3.4Å; N1124-P1126 VanDerWaalsContact C-CD 3.48Å; N1124-W1127 WeakPolarHBondContact O-CZ3 3.38Å
1125	I	93.8	Very high	93.8	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.117	C	C	.	.			trans	-132.8	52.7	-176.7	57.1	159.6	0	0	0	113.1	P1095 W1098 A1121 W1127 V1128 L1131	P1095-I1125 HydrophobicContact CB-CD1 4.47Å; W1098-I1125 HydrophobicContact CB-CD1 3.86Å; W1098-I1125 VanDerWaalsContact CD1-CD1 3.44Å; W1098-I1125 HydrophobicContact CG-CD1 3.86Å; W1098-I1125 HydrophobicContact CG-CG1 4.45Å; A1121-I1125 HydrophobicContact CB-CD1 4.38Å; A1121-I1125 HydrophobicContact CB-CG1 4.24Å; A1121-I1125 WeakPolarHBondContact O-CG1 3.29Å; A1121-I1125 PolarHBondContact O-N 3.44Å; I1125-W1127 HydrophobicContact CB-CH2 4.17Å; I1125-W1127 HydrophobicContact CB-CZ2 4.4Å; I1125-W1127 HydrophobicContact CB-CZ3 4.26Å; I1125-W1127 HydrophobicContact CG2-CH2 3.67Å; I1125-W1127 HydrophobicContact CG2-CZ2 4.01Å; I1125-W1127 HydrophobicContact CG2-CZ3 4.18Å; I1125-W1127 PolarHBondContact O-N 2.69Å; I1125-W1127 VanDerWaalsContact O-N 3.17Å; I1125-V1128 HydrophobicContact CB-CG2 4.06Å; I1125-V1128 HydrophobicContact CD1-CG2 4.38Å; I1125-L1131 HydrophobicContact CD1-CD2 3.86Å; I1125-L1131 HydrophobicContact CG1-CD2 4.08Å
1126	P	95.1	Very high	93.7	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-20	-175.5	28.8	-38.1	0	0	0	114.7	Q433 F436 F439 L1122 N1124 Y1132	Q433-P1126 WeakPolarHBondContact O-CD 3.31Å; Q433-P1126 WeakPolarHBondContact O-CG 3.3Å; F436-P1126 HydrophobicContact CD2-CB 3.88Å; F439-P1126 HydrophobicContact CB-CG 4.09Å; F439-P1126 HydrophobicContact CD1-CB 3.71Å; F439-P1126 HydrophobicContact CD1-CG 3.85Å; F439-P1126 HydrophobicContact CD2-CG 4.04Å; F439-P1126 HydrophobicContact CE1-CB 4.1Å; F439-P1126 HydrophobicContact CE1-CG 4.32Å; F439-P1126 HydrophobicContact CG-CB 4.09Å; F439-P1126 HydrophobicContact CG-CG 3.69Å; L1122-P1126 WeakPolarHBondContact O-CB 3.43Å; L1122-P1126 WeakPolarHBondContact O-CD 3.29Å; N1124-P1126 VanDerWaalsContact C-CD 3.48Å; P1126-Y1132 WeakPolarHBondContact O-CE2 3.34Å; P1126-Y1132 PolarHBondContact O-OH 3.01Å
1127	W	94.6	Very high	93.6	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-9.9	-173.4	68.4	91.1	0	0	0	115	Q433 F439 F486 Q489 S490 M669 N1124 I1125 K1129	Q433-W1127 HydrophobicContact CB-CD2 4.44Å; Q433-W1127 HydrophobicContact CB-CE3 3.83Å; Q433-W1127 HydrophobicContact CB-CZ3 3.85Å; Q433-W1127 VanDerWaalsContact O-CE3 3.25Å; F439-W1127 HydrophobicContact CE1-CB 4.3Å; F439-W1127 HydrophobicContact CE2-CB 3.74Å; F439-W1127 HydrophobicContact CZ-CB 3.41Å; F439-W1127 VanDerWaalsContact CZ-CB 3.41Å; F486-W1127 HydrophobicContact CD2-CB 4Å; F486-W1127 AromaticContact CD2-CD1 3.94Å; F486-W1127 AromaticContact CD2-CG 3.99Å; F486-W1127 HydrophobicContact CD2-CG 3.99Å; F486-W1127 HydrophobicContact CE2-CB 3.52Å; F486-W1127 AromaticContact CE2-CG 3.99Å; F486-W1127 HydrophobicContact CE2-CG 3.99Å; Q489-W1127 CarbonylContact C-O 3.58Å; S490-W1127 WeakPolarHBondContact CA-O 3.27Å; S490-W1127 PolarHBondContact N-O 3.46Å; M669-W1127 HydrophobicContact CE-CZ2 4.3Å; N1124-W1127 WeakPolarHBondContact O-CZ3 3.38Å; I1125-W1127 HydrophobicContact CB-CH2 4.17Å; I1125-W1127 HydrophobicContact CB-CZ2 4.4Å; I1125-W1127 HydrophobicContact CB-CZ3 4.26Å; I1125-W1127 HydrophobicContact CG2-CH2 3.67Å; I1125-W1127 HydrophobicContact CG2-CZ2 4.01Å; I1125-W1127 HydrophobicContact CG2-CZ3 4.18Å; I1125-W1127 PolarHBondContact O-N 2.69Å; I1125-W1127 VanDerWaalsContact O-N 3.17Å; W1127-K1129 PolarHBondContact O-N 3.28Å
1128	V	94	Very high	93.4	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.097	C	C	.	.			trans	-85.9	97.2	-170.5	-178.7	0	0	0	0	109.9	P1095 I1125 G1130 L1131 Y1132	P1095-V1128 HydrophobicContact CB-CG1 4.03Å; P1095-V1128 HydrophobicContact CB-CG2 3.98Å; P1095-V1128 HydrophobicContact CG-CG2 3.72Å; I1125-V1128 HydrophobicContact CB-CG2 4.06Å; I1125-V1128 HydrophobicContact CD1-CG2 4.38Å; V1128-G1130 PolarHBondContact O-N 2.84Å; V1128-L1131 HydrophobicContact CB-CB 4.27Å; V1128-L1131 HydrophobicContact CG1-CB 4.19Å; V1128-L1131 VanDerWaalsContact O-CB 3.29Å; V1128-L1131 WeakPolarHBondContact O-CB 3.41Å; V1128-L1131 PolarHBondContact O-N 3.01Å; V1128-Y1132 WeakPolarHBondContact O-CD2 3.48Å
1129	K	94.3	Very high	93.3	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-53.3	-40.8	176.6	-176.2	-178.8	175.7	-172.7	0	112.4	Q489 E592 E596 W1127 L1131 Y1132 M1133 R1156	Q489-K1129 VanDerWaalsContact O-CB 3.24Å; Q489-K1129 WeakPolarHBondContact O-CB 3.41Å; Q489-K1129 PolarHBondContact O-N 3.31Å; E592-K1129 WeakPolarHBondContact OE1-CE 3.4Å; E592-K1129 IonicContact OE1-NZ 3.76Å; E592-K1129 PolarHBondContact OE1-NZ 2.99Å; E596-K1129 IonicContact OE2-NZ 3.97Å; E596-K1129 PolarHBondContact OE2-NZ 3.43Å; W1127-K1129 PolarHBondContact O-N 3.28Å; K1129-L1131 PolarHBondContact O-N 2.74Å; K1129-Y1132 WeakPolarHBondContact O-CB 3.43Å; K1129-Y1132 PolarHBondContact O-N 3.48Å; K1129-M1133 HydrophobicContact CG-CG 4.29Å; K1129-M1133 WeakPolarHBondContact O-CG 3.44Å; K1129-M1133 PolarHBondContact O-N 3.4Å; K1129-R1156 WeakPolarHBondContact CE-O 3.49Å; K1129-R1156 PolarHBondContact NZ-O 3.25Å
1130	G	92.3	Very high	92.9	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-57.2	-24.7	178.2	0	0	0	0	0	114.8	R1099 V1128 D1134	R1099-G1130 PolarHBondContact NH2-O 3.42Å; V1128-G1130 PolarHBondContact O-N 2.84Å; G1130-D1134 PolarHBondContact O-N 2.73Å
1131	L	94.1	Very high	92.6	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-72.2	-37.6	174.8	-174.7	70	0	0	0	111.9	R1099 I1102 F1118 A1121 L1122 I1125 V1128 K1129 D1134 A1135	R1099-L1131 HydrophobicContact CG-CD1 4.09Å; I1102-L1131 HydrophobicContact CD1-CD1 3.59Å; F1118-L1131 HydrophobicContact CD2-CD1 4.42Å; F1118-L1131 HydrophobicContact CD2-CD2 4.35Å; F1118-L1131 HydrophobicContact CD2-CG 4.01Å; F1118-L1131 HydrophobicContact CE2-CD2 4.3Å; F1118-L1131 HydrophobicContact CE2-CG 3.95Å; A1121-L1131 HydrophobicContact CB-CD2 3.89Å; L1122-L1131 HydrophobicContact CD2-CD2 3.87Å; L1122-L1131 HydrophobicContact CG-CD2 4.45Å; I1125-L1131 HydrophobicContact CD1-CD2 3.86Å; I1125-L1131 HydrophobicContact CG1-CD2 4.08Å; V1128-L1131 HydrophobicContact CB-CB 4.27Å; V1128-L1131 HydrophobicContact CG1-CB 4.19Å; V1128-L1131 VanDerWaalsContact O-CB 3.29Å; V1128-L1131 WeakPolarHBondContact O-CB 3.41Å; V1128-L1131 PolarHBondContact O-N 3.01Å; K1129-L1131 PolarHBondContact O-N 2.74Å; L1131-D1134 PolarHBondContact O-N 2.98Å; L1131-A1135 PolarHBondContact O-N 2.88Å
1132	Y	94.8	Very high	92.4	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-71.6	-40.1	175.8	-59.9	-101.2	0	0	0	110.6	F1118 L1122 P1126 V1128 K1129 D1134 A1135 V1136 L1149 M1150 L1155	F1118-Y1132 HydrophobicContact CZ-CD1 4.25Å; L1122-Y1132 HydrophobicContact CD2-CE1 3.77Å; L1122-Y1132 HydrophobicContact CD2-CE2 3.86Å; L1122-Y1132 WeakPolarHBondContact CD2-OH 3.36Å; P1126-Y1132 WeakPolarHBondContact O-CE2 3.34Å; P1126-Y1132 PolarHBondContact O-OH 3.01Å; V1128-Y1132 WeakPolarHBondContact O-CD2 3.48Å; K1129-Y1132 WeakPolarHBondContact O-CB 3.43Å; K1129-Y1132 PolarHBondContact O-N 3.48Å; Y1132-D1134 VanDerWaalsContact C-N 3.31Å; Y1132-D1134 PolarHBondContact O-N 3.32Å; Y1132-A1135 WeakPolarHBondContact O-CA 3.5Å; Y1132-A1135 WeakPolarHBondContact O-CB 3.09Å; Y1132-A1135 PolarHBondContact O-N 2.9Å; Y1132-V1136 WeakPolarHBondContact O-CG2 3.42Å; Y1132-V1136 PolarHBondContact O-N 3.3Å; Y1132-L1149 HydrophobicContact CD1-CD2 4.4Å; Y1132-L1149 HydrophobicContact CE1-CB 4.45Å; Y1132-L1149 HydrophobicContact CE1-CD2 3.62Å; Y1132-L1149 HydrophobicContact CE1-CG 3.82Å; Y1132-M1150 WeakPolarHBondContact CB-SD 3.38Å; Y1132-M1150 HydrophobicContact CD1-CG 3.59Å; Y1132-M1150 HydrophobicContact CD1-SD 4.45Å; Y1132-M1150 HydrophobicContact CD2-CG 4.32Å; Y1132-M1150 HydrophobicContact CE1-CG 4.2Å; Y1132-M1150 HydrophobicContact CG-CG 3.65Å; Y1132-M1150 HydrophobicContact CG-SD 4.03Å; Y1132-L1155 HydrophobicContact CD2-CD1 3.59Å; Y1132-L1155 HydrophobicContact CE1-CD1 4.18Å; Y1132-L1155 HydrophobicContact CE2-CD1 3.19Å; Y1132-L1155 HydrophobicContact CG-CD1 4.26Å; Y1132-L1155 VanDerWaalsContact CZ-CD1 3.49Å
1133	M	93.3	Very high	92.3	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-58.9	-42.9	173	-59.6	-66.6	-83	0	0	111.3	W588 L589 E592 T705 K1129 A1135 V1136 Q1137	W588-M1133 HydrophobicContact CH2-CE 4.45Å; W588-M1133 HydrophobicContact CH2-SD 3.49Å; W588-M1133 WeakPolarHBondContact CH2-SD 3.04Å; W588-M1133 HydrophobicContact CZ3-CE 4.16Å; W588-M1133 HydrophobicContact CZ3-SD 3.43Å; W588-M1133 WeakPolarHBondContact CZ3-SD 3.42Å; L589-M1133 HydrophobicContact CD2-CB 4.04Å; L589-M1133 HydrophobicContact CD2-CE 3.53Å; L589-M1133 HydrophobicContact CD2-SD 3.81Å; E592-M1133 HydrophobicContact CB-CE 4.16Å; E592-M1133 HydrophobicContact CG-CE 3.7Å; E592-M1133 HydrophobicContact CG-SD 4.14Å; T705-M1133 HydrophobicContact CG2-CB 4.07Å; K1129-M1133 HydrophobicContact CG-CG 4.29Å; K1129-M1133 WeakPolarHBondContact O-CG 3.44Å; K1129-M1133 PolarHBondContact O-N 3.4Å; M1133-A1135 VanDerWaalsContact C-N 3.32Å; M1133-A1135 PolarHBondContact O-N 3Å; M1133-V1136 PolarHBondContact O-N 2.96Å; M1133-Q1137 PolarHBondContact O-N 3.31Å; M1133-Q1137 VanDerWaalsContact O-N 3.11Å
1134	D	93.4	Very high	92.5	Very high	3 Å²	3	25 Å²	25	2%	0.016	13%	0.129	C	C	.	.	H	α-helix	trans	-61.5	-40.9	172.9	-70.7	-9.7	0	0	0	111.7	T705 L706 R1099 G1130 L1131 Y1132 Q1137 L1138	T705-D1134 WeakPolarHBondContact CA-OD1 3.38Å; T705-D1134 WeakPolarHBondContact CB-OD1 3.5Å; L706-D1134 PolarHBondContact N-OD1 3.05Å; R1099-D1134 WeakPolarHBondContact CB-OD2 3.28Å; R1099-D1134 VanDerWaalsContact CG-OD2 3.27Å; R1099-D1134 WeakPolarHBondContact CG-OD2 3.47Å; R1099-D1134 IonicContact CZ-OD1 2.67Å; R1099-D1134 IonicContact CZ-OD2 2.75Å; R1099-D1134 IonicContact NE-OD1 3.26Å; R1099-D1134 IonicContact NE-OD2 3.88Å; R1099-D1134 PolarHBondContact NE-OD2 3.45Å; R1099-D1134 IonicContact NH2-OD1 3.94Å; R1099-D1134 PolarHBondContact NH2-OD1 3.05Å; R1099-D1134 IonicContact NH2-OD2 3.17Å; R1099-D1134 PolarHBondContact NH2-OD2 3.01Å; G1130-D1134 PolarHBondContact O-N 2.73Å; L1131-D1134 PolarHBondContact O-N 2.98Å; Y1132-D1134 VanDerWaalsContact C-N 3.31Å; Y1132-D1134 PolarHBondContact O-N 3.32Å; D1134-Q1137 PolarHBondContact O-N 3.3Å; D1134-L1138 HydrophobicContact CB-CD1 4.48Å; D1134-L1138 WeakPolarHBondContact O-CB 3.36Å; D1134-L1138 WeakPolarHBondContact O-CG 3.3Å; D1134-L1138 PolarHBondContact O-N 3.43Å
1135	A	93.6	Very high	92.7	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.008	14%	0.137	C	C	.	.	H	α-helix	trans	-64.1	-41.3	178.7	0	0	0	0	0	112.1	F1118 L1131 Y1132 M1133 Q1137 L1138 F1139 F1146	F1118-A1135 HydrophobicContact CD2-CB 3.82Å; F1118-A1135 HydrophobicContact CE1-CB 4.34Å; F1118-A1135 HydrophobicContact CE2-CB 3.47Å; F1118-A1135 VanDerWaalsContact CE2-CB 3.47Å; F1118-A1135 HydrophobicContact CG-CB 4.39Å; F1118-A1135 HydrophobicContact CZ-CB 3.75Å; L1131-A1135 PolarHBondContact O-N 2.88Å; Y1132-A1135 WeakPolarHBondContact O-CA 3.5Å; Y1132-A1135 WeakPolarHBondContact O-CB 3.09Å; Y1132-A1135 PolarHBondContact O-N 2.9Å; M1133-A1135 VanDerWaalsContact C-N 3.32Å; M1133-A1135 PolarHBondContact O-N 3Å; A1135-Q1137 VanDerWaalsContact C-N 3.3Å; A1135-Q1137 PolarHBondContact O-N 3.31Å; A1135-L1138 PolarHBondContact O-N 2.68Å; A1135-F1139 HydrophobicContact CB-CD2 4.06Å; A1135-F1139 HydrophobicContact CB-CE2 4.38Å; A1135-F1139 WeakPolarHBondContact O-CA 3.28Å; A1135-F1139 WeakPolarHBondContact O-CB 3.31Å; A1135-F1139 WeakPolarHBondContact O-CD2 3.41Å; A1135-F1139 PolarHBondContact O-N 3.37Å; A1135-F1146 HydrophobicContact CB-CD1 4.42Å; A1135-F1146 HydrophobicContact CB-CD2 3.98Å; A1135-F1146 HydrophobicContact CB-CE1 4.27Å; A1135-F1146 HydrophobicContact CB-CE2 3.79Å; A1135-F1146 HydrophobicContact CB-CG 4.3Å; A1135-F1146 HydrophobicContact CB-CZ 3.95Å; A1135-F1146 WeakPolarHBondContact O-CE2 3.37Å
1136	V	92.9	Very high	92.7	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.006	14%	0.137	C	C	.	.	H	α-helix	trans	-60.9	-40.3	173.5	174	0	0	0	0	111.1	W588 L589 Y1132 M1133 L1143 F1146	W588-V1136 HydrophobicContact CE3-CG1 4.02Å; W588-V1136 HydrophobicContact CE3-CG2 4.41Å; W588-V1136 HydrophobicContact CZ3-CB 4.43Å; W588-V1136 HydrophobicContact CZ3-CG1 4.33Å; W588-V1136 HydrophobicContact CZ3-CG2 4.03Å; L589-V1136 HydrophobicContact CD1-CB 4.34Å; L589-V1136 HydrophobicContact CD1-CG1 3.89Å; L589-V1136 HydrophobicContact CD2-CB 4.18Å; L589-V1136 HydrophobicContact CD2-CG1 4.14Å; L589-V1136 HydrophobicContact CG-CB 4.32Å; L589-V1136 HydrophobicContact CG-CG1 3.77Å; Y1132-V1136 WeakPolarHBondContact O-CG2 3.42Å; Y1132-V1136 PolarHBondContact O-N 3.3Å; M1133-V1136 PolarHBondContact O-N 2.96Å; V1136-L1143 HydrophobicContact CB-CD1 4.44Å; V1136-L1143 HydrophobicContact CG1-CD1 3.6Å; V1136-L1143 HydrophobicContact CG2-CD1 3.91Å; V1136-F1146 HydrophobicContact CG2-CB 4.1Å; V1136-F1146 HydrophobicContact CG2-CD2 3.93Å
1137	Q	91.8	Very high	92.7	Very high	73 Å²	73	27.1 Å²	27.1	34%	0.341	14%	0.139	S	C	.	.	H	α-helix	trans	-68.4	-40	177.6	-171.7	-176.6	0.5	0	0	112.3	L589 T705 M1133 D1134 A1135	L589-Q1137 HydrophobicContact CD1-CB 3.81Å; L589-Q1137 HydrophobicContact CD1-CG 4.43Å; T705-Q1137 HydrophobicContact CG2-CB 4.1Å; T705-Q1137 PolarHBondContact OG1-OE1 3.01Å; M1133-Q1137 PolarHBondContact O-N 3.31Å; M1133-Q1137 VanDerWaalsContact O-N 3.11Å; D1134-Q1137 PolarHBondContact O-N 3.3Å; A1135-Q1137 VanDerWaalsContact C-N 3.3Å; A1135-Q1137 PolarHBondContact O-N 3.31Å
1138	L	91.9	Very high	92.7	Very high	26 Å²	26	31 Å²	31	14%	0.136	16%	0.16	C	C	.	.	H	α-helix	trans	-89.2	-24.6	-171.8	-64.4	173.4	0	0	0	113.4	I1102 V1106 D1134 A1135	I1102-L1138 HydrophobicContact CG2-CD1 3.69Å; V1106-L1138 HydrophobicContact CB-CD2 4.32Å; V1106-L1138 HydrophobicContact CG1-CD2 4.06Å; V1106-L1138 HydrophobicContact CG2-CB 4.34Å; V1106-L1138 HydrophobicContact CG2-CD1 4.28Å; V1106-L1138 HydrophobicContact CG2-CD2 4.31Å; D1134-L1138 HydrophobicContact CB-CD1 4.48Å; D1134-L1138 WeakPolarHBondContact O-CB 3.36Å; D1134-L1138 WeakPolarHBondContact O-CG 3.3Å; D1134-L1138 PolarHBondContact O-N 3.43Å; A1135-L1138 PolarHBondContact O-N 2.68Å
1139	F	92.1	Very high	92.8	Very high	8 Å²	8	32 Å²	32	4%	0.035	17%	0.165	C	C	.	.			trans	-132.6	67.5	-178.1	-39.6	-66.9	0	0	0	110.5	I1102 V1106 V1111 A1114 R1115 F1118 A1135 D1141 H1142 F1146	I1102-F1139 HydrophobicContact CG2-CE2 4.34Å; I1102-F1139 HydrophobicContact CG2-CZ 4.07Å; V1106-F1139 HydrophobicContact CG2-CE1 4.18Å; V1106-F1139 HydrophobicContact CG2-CZ 4.37Å; V1111-F1139 HydrophobicContact CG1-CD1 3.6Å; V1111-F1139 HydrophobicContact CG1-CE1 3.62Å; A1114-F1139 HydrophobicContact CB-CE1 4.09Å; A1114-F1139 HydrophobicContact CB-CZ 3.85Å; R1115-F1139 HydrophobicContact CB-CE1 4.17Å; R1115-F1139 HydrophobicContact CB-CE2 4.49Å; R1115-F1139 HydrophobicContact CB-CZ 4.12Å; F1118-F1139 HydrophobicContact CB-CE2 4.4Å; A1135-F1139 HydrophobicContact CB-CD2 4.06Å; A1135-F1139 HydrophobicContact CB-CE2 4.38Å; A1135-F1139 WeakPolarHBondContact O-CA 3.28Å; A1135-F1139 WeakPolarHBondContact O-CB 3.31Å; A1135-F1139 WeakPolarHBondContact O-CD2 3.41Å; A1135-F1139 PolarHBondContact O-N 3.37Å; F1139-D1141 PolarHBondContact O-N 2.87Å; F1139-D1141 VanDerWaalsContact O-N 3.1Å; F1139-H1142 PolarHBondContact O-N 3.39Å; F1139-H1142 VanDerWaalsContact O-N 3.14Å; F1139-F1146 HydrophobicContact CB-CE2 3.96Å; F1139-F1146 HydrophobicContact CB-CZ 4.09Å; F1139-F1146 HydrophobicContact CD2-CE2 4.25Å; F1139-F1146 AromaticContact CD2-CZ 3.96Å; F1139-F1146 HydrophobicContact CD2-CZ 3.96Å; F1139-F1146 HydrophobicContact CG-CZ 4.47Å
1140	P	86.2	Confident	92.8	Very high	64 Å²	64	32 Å²	32	42%	0.416	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-62.2	-23.7	-170.7	25.4	-35.4	0	0	0	114.2	H1142	P1140-H1142 PolarHBondContact O-N 2.89Å
1141	D	88.3	Confident	92.9	Very high	152 Å²	152	36 Å²	36	81%	0.813	19%	0.189	S	C	*	.	G	3₁₀ helix	trans	-67.3	-14	179.4	-56	-36.4	0	0	0	113.5	F1139	F1139-D1141 PolarHBondContact O-N 2.87Å; F1139-D1141 VanDerWaalsContact O-N 3.1Å
1142	H	90.6	Very high	93	Very high	52 Å²	52	41.9 Å²	41.9	24%	0.241	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-113.4	21.5	-173.7	-69.1	-86.3	0	0	0	113.4	R1115 F1139 P1140 Q1144 E1145 F1146	R1115-H1142 PolarHBondContact NH1-CE1 3.25Å; R1115-H1142 PolarHBondContact NH1-NE2 3.41Å; F1139-H1142 PolarHBondContact O-N 3.39Å; F1139-H1142 VanDerWaalsContact O-N 3.14Å; P1140-H1142 PolarHBondContact O-N 2.89Å; H1142-Q1144 PolarHBondContact O-N 2.92Å; H1142-E1145 IonicContact CE1-OE2 2.7Å; H1142-E1145 IonicContact CG-OE2 2.86Å; H1142-E1145 IonicContact ND1-OE2 3.46Å; H1142-E1145 PolarHBondContact ND1-OE2 3.46Å; H1142-E1145 WeakPolarHBondContact O-CB 3.46Å; H1142-E1145 PolarHBondContact O-N 2.98Å; H1142-F1146 HydrophobicContact CB-CD2 4.2Å; H1142-F1146 HydrophobicContact CB-CE1 4.23Å; H1142-F1146 HydrophobicContact CB-CE2 3.56Å; H1142-F1146 HydrophobicContact CB-CZ 3.57Å; H1142-F1146 VanDerWaalsContact O-CD2 3.28Å; H1142-F1146 WeakPolarHBondContact O-CD2 3.24Å; H1142-F1146 WeakPolarHBondContact O-CG 3.33Å; H1142-F1146 PolarHBondContact O-N 3.37Å
1143	L	91.5	Very high	93	Very high	11 Å²	11	42.3 Å²	42.3	6%	0.058	22%	0.219	C	C	.	.	H	α-helix	trans	-50.1	-51.7	-177.8	174.5	65	0	0	0	113	R584 W588 V1136 E1145 F1146 V1147 L1161	R584-L1143 HydrophobicContact CB-CD2 4.48Å; R584-L1143 HydrophobicContact CG-CD2 3.81Å; W588-L1143 HydrophobicContact CB-CD1 4.5Å; W588-L1143 HydrophobicContact CD2-CD1 4.11Å; W588-L1143 HydrophobicContact CE3-CD1 4.09Å; W588-L1143 HydrophobicContact CG-CD1 4.27Å; V1136-L1143 HydrophobicContact CB-CD1 4.44Å; V1136-L1143 HydrophobicContact CG1-CD1 3.6Å; V1136-L1143 HydrophobicContact CG2-CD1 3.91Å; L1143-E1145 VanDerWaalsContact C-N 3.35Å; L1143-E1145 PolarHBondContact O-N 3.48Å; L1143-F1146 PolarHBondContact O-N 3.28Å; L1143-V1147 HydrophobicContact CD1-CG2 3.95Å; L1143-V1147 HydrophobicContact CG-CG2 4.48Å; L1143-V1147 WeakPolarHBondContact O-CG2 3.31Å; L1143-V1147 PolarHBondContact O-N 2.98Å; L1143-L1161 HydrophobicContact CD2-CD2 3.86Å; L1143-L1161 HydrophobicContact CG-CD2 4.06Å
1144	Q	93.6	Very high	93.1	Very high	95 Å²	95	45.8 Å²	45.8	44%	0.444	24%	0.235	S	C	.	.	H	α-helix	trans	-56.5	-48.9	-178.9	-173.9	72.1	49.5	0	0	111.4	H1142 F1146 V1147 D1148 L1161	H1142-Q1144 PolarHBondContact O-N 2.92Å; Q1144-F1146 VanDerWaalsContact C-N 3.29Å; Q1144-F1146 PolarHBondContact O-N 3.44Å; Q1144-V1147 PolarHBondContact O-N 3.23Å; Q1144-D1148 PolarHBondContact NE2-OD1 3.38Å; Q1144-D1148 WeakPolarHBondContact O-CB 3.49Å; Q1144-D1148 PolarHBondContact O-N 3.45Å; Q1144-L1161 HydrophobicContact CB-CD1 4.48Å; Q1144-L1161 VanDerWaalsContact CD-CD1 3.48Å; Q1144-L1161 VanDerWaalsContact OE1-CD1 3.24Å
1145	E	94.6	Very high	93.2	Very high	79 Å²	79	46 Å²	46	37%	0.369	24%	0.236	S	C	.	.	H	α-helix	trans	-57.5	-42.1	-179.4	-174.7	-170.7	160.7	0	0	112	Y1119 H1142 L1143 L1149	Y1119-E1145 PolarHBondContact OH-OE1 2.9Å; H1142-E1145 IonicContact CE1-OE2 2.7Å; H1142-E1145 IonicContact CG-OE2 2.86Å; H1142-E1145 IonicContact ND1-OE2 3.46Å; H1142-E1145 PolarHBondContact ND1-OE2 3.46Å; H1142-E1145 WeakPolarHBondContact O-CB 3.46Å; H1142-E1145 PolarHBondContact O-N 2.98Å; L1143-E1145 VanDerWaalsContact C-N 3.35Å; L1143-E1145 PolarHBondContact O-N 3.48Å; E1145-L1149 WeakPolarHBondContact O-CB 3.5Å; E1145-L1149 PolarHBondContact O-N 3.22Å
1146	F	94.3	Very high	93.3	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-72.9	-36.8	-179.8	-57.5	-37.3	0	0	0	112.6	F1118 A1135 V1136 F1139 H1142 L1143 Q1144 L1149 M1150	F1118-F1146 HydrophobicContact CD1-CE1 4.25Å; F1118-F1146 AromaticContact CE1-CD1 3.9Å; F1118-F1146 HydrophobicContact CE1-CD1 3.9Å; F1118-F1146 AromaticContact CE1-CE1 3.59Å; F1118-F1146 HydrophobicContact CE1-CE1 3.59Å; F1118-F1146 HydrophobicContact CE1-CZ 4.47Å; F1118-F1146 HydrophobicContact CZ-CD1 4.06Å; F1118-F1146 HydrophobicContact CZ-CE1 4.11Å; A1135-F1146 HydrophobicContact CB-CD1 4.42Å; A1135-F1146 HydrophobicContact CB-CD2 3.98Å; A1135-F1146 HydrophobicContact CB-CE1 4.27Å; A1135-F1146 HydrophobicContact CB-CE2 3.79Å; A1135-F1146 HydrophobicContact CB-CG 4.3Å; A1135-F1146 HydrophobicContact CB-CZ 3.95Å; A1135-F1146 WeakPolarHBondContact O-CE2 3.37Å; V1136-F1146 HydrophobicContact CG2-CB 4.1Å; V1136-F1146 HydrophobicContact CG2-CD2 3.93Å; F1139-F1146 HydrophobicContact CB-CE2 3.96Å; F1139-F1146 HydrophobicContact CB-CZ 4.09Å; F1139-F1146 HydrophobicContact CD2-CE2 4.25Å; F1139-F1146 AromaticContact CD2-CZ 3.96Å; F1139-F1146 HydrophobicContact CD2-CZ 3.96Å; F1139-F1146 HydrophobicContact CG-CZ 4.47Å; H1142-F1146 HydrophobicContact CB-CD2 4.2Å; H1142-F1146 HydrophobicContact CB-CE1 4.23Å; H1142-F1146 HydrophobicContact CB-CE2 3.56Å; H1142-F1146 HydrophobicContact CB-CZ 3.57Å; H1142-F1146 VanDerWaalsContact O-CD2 3.28Å; H1142-F1146 WeakPolarHBondContact O-CD2 3.24Å; H1142-F1146 WeakPolarHBondContact O-CG 3.33Å; H1142-F1146 PolarHBondContact O-N 3.37Å; L1143-F1146 PolarHBondContact O-N 3.28Å; Q1144-F1146 VanDerWaalsContact C-N 3.29Å; Q1144-F1146 PolarHBondContact O-N 3.44Å; F1146-L1149 PolarHBondContact O-N 3.43Å; F1146-M1150 WeakPolarHBondContact O-CG 3.39Å; F1146-M1150 PolarHBondContact O-N 2.98Å
1147	V	94.6	Very high	93.2	Very high	5 Å²	5	47.4 Å²	47.4	3%	0.03	24%	0.243	C	C	.	.	H	α-helix	trans	-70	-41.2	176.1	177.7	0	0	0	0	111.4	W588 L1143 Q1144 L1149 M1150 T1151 L1157 L1161	W588-V1147 HydrophobicContact CH2-CG2 4.5Å; W588-V1147 HydrophobicContact CZ2-CG2 4.05Å; L1143-V1147 HydrophobicContact CD1-CG2 3.95Å; L1143-V1147 HydrophobicContact CG-CG2 4.48Å; L1143-V1147 WeakPolarHBondContact O-CG2 3.31Å; L1143-V1147 PolarHBondContact O-N 2.98Å; Q1144-V1147 PolarHBondContact O-N 3.23Å; V1147-L1149 VanDerWaalsContact C-N 3.27Å; V1147-L1149 PolarHBondContact O-N 3.46Å; V1147-M1150 HydrophobicContact CB-CE 4.29Å; V1147-M1150 HydrophobicContact CG2-CE 3.81Å; V1147-M1150 PolarHBondContact O-N 3.41Å; V1147-T1151 PolarHBondContact O-N 2.97Å; V1147-T1151 PolarHBondContact O-OG1 3.33Å; V1147-L1157 HydrophobicContact CG1-CD1 3.77Å; V1147-L1157 HydrophobicContact CG1-CD2 4.3Å; V1147-L1161 HydrophobicContact CB-CD1 3.78Å; V1147-L1161 HydrophobicContact CB-CG 4.23Å; V1147-L1161 HydrophobicContact CG1-CD1 3.92Å; V1147-L1161 HydrophobicContact CG1-CG 3.98Å; V1147-L1161 HydrophobicContact CG2-CD1 4.05Å; V1147-L1161 HydrophobicContact CG2-CD2 4.28Å; V1147-L1161 HydrophobicContact CG2-CG 4.21Å
1148	D	95.1	Very high	93.2	Very high	82 Å²	82	44.3 Å²	44.3	44%	0.439	23%	0.228	S	C	.	.	H	α-helix	trans	-59	-43.1	173.7	-67.7	-12.9	0	0	0	110.4	Q1144 T1151 E1152	Q1144-D1148 PolarHBondContact NE2-OD1 3.38Å; Q1144-D1148 WeakPolarHBondContact O-CB 3.49Å; Q1144-D1148 PolarHBondContact O-N 3.45Å; D1148-T1151 WeakPolarHBondContact O-CB 3.4Å; D1148-T1151 PolarHBondContact O-N 3.11Å; D1148-E1152 WeakPolarHBondContact O-CB 3.3Å; D1148-E1152 PolarHBondContact O-N 2.91Å
1149	L	95	Very high	93.1	Very high	21 Å²	21	43.1 Å²	43.1	11%	0.11	22%	0.221	C	C	.	.	H	α-helix	trans	-67.1	-39	177.4	-177	62.8	0	0	0	112.5	F436 L1122 Y1132 E1145 F1146 V1147 T1151 E1152 K1153	F436-L1149 HydrophobicContact CE2-CD1 4Å; F436-L1149 HydrophobicContact CE2-CD2 4.43Å; F436-L1149 HydrophobicContact CZ-CD1 3.64Å; L1122-L1149 HydrophobicContact CD1-CD2 3.61Å; Y1132-L1149 HydrophobicContact CD1-CD2 4.4Å; Y1132-L1149 HydrophobicContact CE1-CB 4.45Å; Y1132-L1149 HydrophobicContact CE1-CD2 3.62Å; Y1132-L1149 HydrophobicContact CE1-CG 3.82Å; E1145-L1149 WeakPolarHBondContact O-CB 3.5Å; E1145-L1149 PolarHBondContact O-N 3.22Å; F1146-L1149 PolarHBondContact O-N 3.43Å; V1147-L1149 VanDerWaalsContact C-N 3.27Å; V1147-L1149 PolarHBondContact O-N 3.46Å; L1149-T1151 VanDerWaalsContact C-N 3.3Å; L1149-T1151 PolarHBondContact O-N 2.97Å; L1149-E1152 PolarHBondContact O-N 3.39Å; L1149-K1153 HydrophobicContact CD1-CG 4.22Å; L1149-K1153 WeakPolarHBondContact O-CG 3.43Å; L1149-K1153 PolarHBondContact O-N 3.17Å
1150	M	95.1	Very high	93	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-60.3	-43.2	172.6	-76.8	-174.2	-75.3	0	0	111	W588 Y1132 F1146 V1147 K1153 E1154 L1155 L1157	W588-M1150 HydrophobicContact CH2-CE 3.56Å; W588-M1150 HydrophobicContact CH2-SD 4.42Å; W588-M1150 HydrophobicContact CZ2-CE 4.05Å; W588-M1150 HydrophobicContact CZ3-CE 4.38Å; Y1132-M1150 WeakPolarHBondContact CB-SD 3.38Å; Y1132-M1150 HydrophobicContact CD1-CG 3.59Å; Y1132-M1150 HydrophobicContact CD1-SD 4.45Å; Y1132-M1150 HydrophobicContact CD2-CG 4.32Å; Y1132-M1150 HydrophobicContact CE1-CG 4.2Å; Y1132-M1150 HydrophobicContact CG-CG 3.65Å; Y1132-M1150 HydrophobicContact CG-SD 4.03Å; F1146-M1150 WeakPolarHBondContact O-CG 3.39Å; F1146-M1150 PolarHBondContact O-N 2.98Å; V1147-M1150 HydrophobicContact CB-CE 4.29Å; V1147-M1150 HydrophobicContact CG2-CE 3.81Å; V1147-M1150 PolarHBondContact O-N 3.41Å; M1150-K1153 PolarHBondContact O-N 3.42Å; M1150-E1154 PolarHBondContact O-N 2.79Å; M1150-E1154 VanDerWaalsContact O-N 3.12Å; M1150-L1155 HydrophobicContact CB-CB 4.06Å; M1150-L1155 HydrophobicContact CB-CD1 4.36Å; M1150-L1155 HydrophobicContact CG-CB 4.28Å; M1150-L1155 HydrophobicContact CG-CD1 3.89Å; M1150-L1155 PolarHBondContact O-N 2.87Å; M1150-L1157 HydrophobicContact CB-CD1 4.29Å; M1150-L1157 HydrophobicContact CB-CD2 3.96Å; M1150-L1157 HydrophobicContact CB-CG 4.28Å; M1150-L1157 HydrophobicContact CE-CD2 3.82Å; M1150-L1157 HydrophobicContact SD-CD2 3.9Å
1151	T	94.9	Very high	93.2	Very high	83 Å²	83	42.6 Å²	42.6	51%	0.509	22%	0.219	S	C	.	.	H	α-helix	trans	-62.8	-48.6	176.4	-52	0	0	0	0	111.3	V1147 D1148 L1149 K1153 E1154 L1157	V1147-T1151 PolarHBondContact O-N 2.97Å; V1147-T1151 PolarHBondContact O-OG1 3.33Å; D1148-T1151 WeakPolarHBondContact O-CB 3.4Å; D1148-T1151 PolarHBondContact O-N 3.11Å; L1149-T1151 VanDerWaalsContact C-N 3.3Å; L1149-T1151 PolarHBondContact O-N 2.97Å; T1151-K1153 PolarHBondContact O-N 2.97Å; T1151-E1154 PolarHBondContact O-N 3.03Å; T1151-L1157 WeakPolarHBondContact OG1-CD1 2.96Å
1152	E	95	Very high	93.2	Very high	124 Å²	124	41.7 Å²	41.7	58%	0.579	21%	0.209	S	C	*	.	H	α-helix	trans	-57.5	-38.1	178.3	-169	-154.9	131.7	0	0	112	D1148 L1149 E1154	D1148-E1152 WeakPolarHBondContact O-CB 3.3Å; D1148-E1152 PolarHBondContact O-N 2.91Å; L1149-E1152 PolarHBondContact O-N 3.39Å; E1152-E1154 VanDerWaalsContact C-N 3.32Å
1153	K	95.4	Very high	93.1	Very high	9 Å²	9	42.2 Å²	42.2	4%	0.039	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	3.7	-179.8	-61.1	-44.5	-174.1	-162.1	0	114	F436 F439 V441 L1149 M1150 T1151 L1155	F436-K1153 PolarHBondContact O-NZ 3Å; F439-K1153 HydrophobicContact CD1-CB 4.14Å; F439-K1153 HydrophobicContact CD1-CD 4.19Å; F439-K1153 HydrophobicContact CD1-CG 4.29Å; F439-K1153 HydrophobicContact CE1-CB 4.02Å; V441-K1153 PolarHBondContact N-O 3.24Å; L1149-K1153 HydrophobicContact CD1-CG 4.22Å; L1149-K1153 WeakPolarHBondContact O-CG 3.43Å; L1149-K1153 PolarHBondContact O-N 3.17Å; M1150-K1153 PolarHBondContact O-N 3.42Å; T1151-K1153 PolarHBondContact O-N 2.97Å; K1153-L1155 HydrophobicContact CB-CG 4.32Å; K1153-L1155 PolarHBondContact O-N 3.15Å
1154	E	96.1	Very high	92.9	Very high	72 Å²	72	41.7 Å²	41.7	34%	0.336	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	30	-179.9	-52.5	164.8	172.9	0	0	112.8	S440 V441 T442 H492 M1150 T1151 E1152	S440-E1154 VanDerWaalsContact CB-OE2 3.25Å; S440-E1154 WeakPolarHBondContact CB-OE2 3.43Å; S440-E1154 PolarHBondContact OG-OE2 3.43Å; V441-E1154 HydrophobicContact CB-CB 4.07Å; V441-E1154 HydrophobicContact CG2-CB 4.38Å; V441-E1154 VanDerWaalsContact CG2-O 3.26Å; V441-E1154 WeakPolarHBondContact CG2-O 3.44Å; V441-E1154 PolarHBondContact N-OE2 3.21Å; T442-E1154 VanDerWaalsContact CB-OE2 3.27Å; T442-E1154 WeakPolarHBondContact CB-OE2 3.34Å; T442-E1154 WeakPolarHBondContact CG2-OE2 3.43Å; T442-E1154 PolarHBondContact N-OE2 2.82Å; T442-E1154 VanDerWaalsContact OG1-CD 3.3Å; T442-E1154 PolarHBondContact OG1-OE1 2.92Å; T442-E1154 PolarHBondContact OG1-OE2 3.31Å; H492-E1154 PolarHBondContact NE2-O 2.93Å; M1150-E1154 PolarHBondContact O-N 2.79Å; M1150-E1154 VanDerWaalsContact O-N 3.12Å; T1151-E1154 PolarHBondContact O-N 3.03Å; E1152-E1154 VanDerWaalsContact C-N 3.32Å
1155	L	95.7	Very high	92.5	Very high	7 Å²	7	40 Å²	40	4%	0.037	20%	0.203	C	C	.	.			trans	-71.9	142.2	170.3	-62.2	178.3	0	0	0	109.2	V441 Y1132 M1150 K1153 L1157	V441-L1155 HydrophobicContact CG2-CD2 4Å; Y1132-L1155 HydrophobicContact CD2-CD1 3.59Å; Y1132-L1155 HydrophobicContact CE1-CD1 4.18Å; Y1132-L1155 HydrophobicContact CE2-CD1 3.19Å; Y1132-L1155 HydrophobicContact CG-CD1 4.26Å; Y1132-L1155 VanDerWaalsContact CZ-CD1 3.49Å; M1150-L1155 HydrophobicContact CB-CB 4.06Å; M1150-L1155 HydrophobicContact CB-CD1 4.36Å; M1150-L1155 HydrophobicContact CG-CB 4.28Å; M1150-L1155 HydrophobicContact CG-CD1 3.89Å; M1150-L1155 PolarHBondContact O-N 2.87Å; K1153-L1155 HydrophobicContact CB-CG 4.32Å; K1153-L1155 PolarHBondContact O-N 3.15Å; L1155-L1157 PolarHBondContact O-N 3.05Å; L1155-L1157 VanDerWaalsContact O-N 3.15Å
1156	R	94.1	Very high	92.1	Very high	5 Å²	5	40.8 Å²	40.8	2%	0.019	21%	0.209	C	C	.	.			trans	-71.6	112.6	-172.5	-177.1	55.7	163	106.3	-1.9	111.2	S490 G491 E494 D618 K1129	S490-R1156 PolarHBondContact O-N 3.43Å; G491-R1156 WeakPolarHBondContact O-CG 3.36Å; E494-R1156 IonicContact OE1-CZ 2.94Å; E494-R1156 IonicContact OE1-NE 3.16Å; E494-R1156 PolarHBondContact OE1-NE 2.79Å; E494-R1156 IonicContact OE1-NH2 3.54Å; D618-R1156 IonicContact OD1-CZ 3.62Å; D618-R1156 IonicContact OD1-NH1 2.66Å; D618-R1156 PolarHBondContact OD1-NH1 3.49Å; D618-R1156 IonicContact OD1-NH2 3.53Å; D618-R1156 PolarHBondContact OD1-NH2 2.93Å; D618-R1156 IonicContact OD2-CZ 3.67Å; D618-R1156 VanDerWaalsContact OD2-CZ 3.31Å; D618-R1156 IonicContact OD2-NH1 3.6Å; D618-R1156 PolarHBondContact OD2-NH1 3.43Å; D618-R1156 IonicContact OD2-NH2 2.8Å; D618-R1156 PolarHBondContact OD2-NH2 3.33Å; K1129-R1156 WeakPolarHBondContact CE-O 3.49Å; K1129-R1156 PolarHBondContact NZ-O 3.25Å
1157	L	92.6	Very high	91.5	Very high	28 Å²	28	42.7 Å²	42.7	15%	0.147	22%	0.219	C	C	.	.			trans	-102.4	132.6	171.6	-64.6	170.7	0	0	0	109.2	W588 V1147 M1150 T1151 L1155	W588-L1157 HydrophobicContact CH2-CD2 4.43Å; W588-L1157 HydrophobicContact CZ2-CD2 3.86Å; V1147-L1157 HydrophobicContact CG1-CD1 3.77Å; V1147-L1157 HydrophobicContact CG1-CD2 4.3Å; M1150-L1157 HydrophobicContact CB-CD1 4.29Å; M1150-L1157 HydrophobicContact CB-CD2 3.96Å; M1150-L1157 HydrophobicContact CB-CG 4.28Å; M1150-L1157 HydrophobicContact CE-CD2 3.82Å; M1150-L1157 HydrophobicContact SD-CD2 3.9Å; T1151-L1157 WeakPolarHBondContact OG1-CD1 2.96Å; L1155-L1157 PolarHBondContact O-N 3.05Å; L1155-L1157 VanDerWaalsContact O-N 3.15Å
1158	R	90.1	Very high	90.9	Very high	8 Å²	8	45 Å²	45	3%	0.03	23%	0.231	C	C	.	.	S	Bend	trans	-107.9	-17.2	177.6	-64.5	-176.9	178.9	-84.4	1.2	113	E494 E592 R595 H599	E494-R1158 IonicContact OE2-CZ 3.65Å; E494-R1158 IonicContact OE2-NH2 2.87Å; E494-R1158 PolarHBondContact OE2-NH2 3.08Å; E592-R1158 PolarHBondContact OE1-N 3.11Å; E592-R1158 VanDerWaalsContact OE1-N 3.13Å; E592-R1158 WeakPolarHBondContact OE2-CA 3.48Å; E592-R1158 PolarHBondContact OE2-N 3.19Å; R595-R1158 VanDerWaalsContact C-CD 3.49Å; R595-R1158 HydrophobicContact CB-CB 3.9Å; R595-R1158 PolarHBondContact NH1-O 3.5Å; H599-R1158 VanDerWaalsContact O-CZ 3.27Å; H599-R1158 PolarHBondContact O-NH1 2.75Å; H599-R1158 PolarHBondContact O-NH2 3.4Å
1159	L	90.1	Very high	90	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.247	C	C	.	.	S	Bend	trans	-125.7	97.9	171.4	-178	67.7	0	0	0	109.5	W588 V591 E592 E1163 L1164 L1167	W588-L1159 HydrophobicContact CG-CD2 4.42Å; W588-L1159 PolarHBondContact NE1-O 3.32Å; V591-L1159 HydrophobicContact CB-CD2 3.74Å; V591-L1159 HydrophobicContact CG1-CD1 4.34Å; V591-L1159 HydrophobicContact CG1-CD2 3.73Å; V591-L1159 HydrophobicContact CG1-CG 4.44Å; V591-L1159 HydrophobicContact CG2-CD2 4.48Å; E592-L1159 PolarHBondContact OE2-N 3.32Å; L1159-E1163 HydrophobicContact CD1-CB 3.87Å; L1159-E1163 HydrophobicContact CD1-CG 3.88Å; L1159-L1164 HydrophobicContact CD2-CB 4.04Å; L1159-L1164 HydrophobicContact CD2-CD1 3.87Å; L1159-L1164 HydrophobicContact CD2-CG 4.47Å; L1159-L1164 HydrophobicContact CG-CB 4.23Å; L1159-L1167 HydrophobicContact CD1-CD1 3.83Å
1160	P	90.4	Very high	88	Confident	56 Å²	56	54.5 Å²	54.5	36%	0.364	28%	0.277	S	S	.	.			trans	-56.8	152.6	165.4	-21.3	33.9	0	0	0	111.3	E1162 E1163 L1164	P1160-E1162 VanDerWaalsContact CB-OE2 3.27Å; P1160-E1162 WeakPolarHBondContact CB-OE2 3.39Å; P1160-E1162 PolarHBondContact O-N 3.42Å; P1160-E1163 WeakPolarHBondContact CD-OE2 3.22Å; P1160-E1163 PolarHBondContact O-N 3.34Å; P1160-L1164 PolarHBondContact O-N 2.87Å; P1160-L1164 VanDerWaalsContact O-N 3.15Å
1161	L	89.7	Confident	87.7	Confident	5 Å²	5	57.3 Å²	57.3	3%	0.026	29%	0.291	C	S	.	.	H	α-helix	trans	-69.9	-26.8	-177.2	-75.1	174.8	0	0	0	112.5	R584 L1143 Q1144 V1147 L1164 D1165	R584-L1161 PolarHBondContact NH2-O 3.02Å; L1143-L1161 HydrophobicContact CD2-CD2 3.86Å; L1143-L1161 HydrophobicContact CG-CD2 4.06Å; Q1144-L1161 HydrophobicContact CB-CD1 4.48Å; Q1144-L1161 VanDerWaalsContact CD-CD1 3.48Å; Q1144-L1161 VanDerWaalsContact OE1-CD1 3.24Å; V1147-L1161 HydrophobicContact CB-CD1 3.78Å; V1147-L1161 HydrophobicContact CB-CG 4.23Å; V1147-L1161 HydrophobicContact CG1-CD1 3.92Å; V1147-L1161 HydrophobicContact CG1-CG 3.98Å; V1147-L1161 HydrophobicContact CG2-CD1 4.05Å; V1147-L1161 HydrophobicContact CG2-CD2 4.28Å; V1147-L1161 HydrophobicContact CG2-CG 4.21Å; L1161-L1164 HydrophobicContact CD2-CD2 3.95Å; L1161-L1164 WeakPolarHBondContact O-CB 3.5Å; L1161-L1164 PolarHBondContact O-N 3.06Å; L1161-D1165 PolarHBondContact O-N 3Å; L1161-D1165 VanDerWaalsContact O-N 3.13Å
1162	E	88.8	Confident	87.3	Confident	133 Å²	133	55.9 Å²	55.9	62%	0.621	28%	0.279	S	S	*	.	H	α-helix	trans	-65.1	-40.7	175.1	-58.4	76.6	-169.1	0	0	111.1	P1160 D1165 I1166	P1160-E1162 VanDerWaalsContact CB-OE2 3.27Å; P1160-E1162 WeakPolarHBondContact CB-OE2 3.39Å; P1160-E1162 PolarHBondContact O-N 3.42Å; E1162-D1165 PolarHBondContact O-N 3.23Å; E1162-I1166 PolarHBondContact O-N 3.09Å
1163	E	88	Confident	86.9	Confident	64 Å²	64	52.1 Å²	52.1	30%	0.299	26%	0.262	S	S	.	.	H	α-helix	trans	-71.4	-36.8	177	-169.4	-170.2	164.2	0	0	111.3	R595 L1159 P1160 D1165 I1166 L1167	R595-E1163 IonicContact CZ-OE1 2.58Å; R595-E1163 IonicContact NH1-OE1 2.83Å; R595-E1163 PolarHBondContact NH1-OE1 3.2Å; R595-E1163 IonicContact NH1-OE2 2.65Å; R595-E1163 PolarHBondContact NH1-OE2 3.25Å; R595-E1163 IonicContact NH2-OE1 3.44Å; R595-E1163 PolarHBondContact NH2-OE1 3.01Å; L1159-E1163 HydrophobicContact CD1-CB 3.87Å; L1159-E1163 HydrophobicContact CD1-CG 3.88Å; P1160-E1163 WeakPolarHBondContact CD-OE2 3.22Å; P1160-E1163 PolarHBondContact O-N 3.34Å; E1163-D1165 VanDerWaalsContact C-N 3.25Å; E1163-D1165 PolarHBondContact O-N 3.41Å; E1163-I1166 WeakPolarHBondContact O-CB 3.42Å; E1163-I1166 PolarHBondContact O-N 3.42Å; E1163-L1167 WeakPolarHBondContact O-CG 3.47Å; E1163-L1167 PolarHBondContact O-N 2.95Å
1164	L	87.4	Confident	86.4	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-59	-38.7	173.1	177.3	69.4	0	0	0	111.9	R584 V587 W588 L1159 P1160 L1161 I1166 L1167 L1168	R584-L1164 HydrophobicContact CG-CD2 3.62Å; V587-L1164 HydrophobicContact CB-CD1 4.38Å; V587-L1164 HydrophobicContact CG1-CD1 3.85Å; W588-L1164 HydrophobicContact CB-CD1 4.41Å; W588-L1164 HydrophobicContact CB-CD2 3.8Å; W588-L1164 HydrophobicContact CG-CD2 4.25Å; L1159-L1164 HydrophobicContact CD2-CB 4.04Å; L1159-L1164 HydrophobicContact CD2-CD1 3.87Å; L1159-L1164 HydrophobicContact CD2-CG 4.47Å; L1159-L1164 HydrophobicContact CG-CB 4.23Å; P1160-L1164 PolarHBondContact O-N 2.87Å; P1160-L1164 VanDerWaalsContact O-N 3.15Å; L1161-L1164 HydrophobicContact CD2-CD2 3.95Å; L1161-L1164 WeakPolarHBondContact O-CB 3.5Å; L1161-L1164 PolarHBondContact O-N 3.06Å; L1164-I1166 VanDerWaalsContact C-N 3.33Å; L1164-L1167 PolarHBondContact O-N 3.19Å; L1164-L1168 HydrophobicContact CD1-CD1 4.16Å; L1164-L1168 HydrophobicContact CD1-CG 4.31Å; L1164-L1168 HydrophobicContact CG-CD1 4.01Å; L1164-L1168 VanDerWaalsContact O-CG 3.28Å; L1164-L1168 WeakPolarHBondContact O-CG 3.42Å; L1164-L1168 PolarHBondContact O-N 3.02Å; L1164-L1168 VanDerWaalsContact O-N 3.16Å
1165	D	86	Confident	85.8	Confident	58 Å²	58	53.6 Å²	53.6	31%	0.31	27%	0.272	S	S	.	.	H	α-helix	trans	-63	-41.4	177.6	-74.2	-40.8	0	0	0	111.1	R584 L1161 E1162 E1163 L1168 E1169	R584-D1165 IonicContact CZ-OD1 3.87Å; R584-D1165 IonicContact CZ-OD2 4Å; R584-D1165 IonicContact NH1-OD1 3.08Å; R584-D1165 PolarHBondContact NH1-OD1 3.41Å; R584-D1165 IonicContact NH1-OD2 2.65Å; R584-D1165 IonicContact NH2-OD1 2.82Å; R584-D1165 PolarHBondContact NH2-OD1 3.19Å; R584-D1165 IonicContact NH2-OD2 3.14Å; R584-D1165 PolarHBondContact NH2-OD2 3.46Å; L1161-D1165 PolarHBondContact O-N 3Å; L1161-D1165 VanDerWaalsContact O-N 3.13Å; E1162-D1165 PolarHBondContact O-N 3.23Å; E1163-D1165 VanDerWaalsContact C-N 3.25Å; E1163-D1165 PolarHBondContact O-N 3.41Å; D1165-L1168 PolarHBondContact O-N 3.05Å; D1165-E1169 WeakPolarHBondContact O-CG 3.46Å; D1165-E1169 PolarHBondContact O-N 3.23Å; D1165-E1169 VanDerWaalsContact O-N 3.09Å
1166	I	85.4	Confident	85.1	Confident	96 Å²	96	56.7 Å²	56.7	49%	0.492	29%	0.287	S	S	.	.	H	α-helix	trans	-62	-47.4	175	-60.7	168.4	0	0	0	110.9	E1162 E1163 L1164 L1168 E1169 D1170	E1162-I1166 PolarHBondContact O-N 3.09Å; E1163-I1166 WeakPolarHBondContact O-CB 3.42Å; E1163-I1166 PolarHBondContact O-N 3.42Å; L1164-I1166 VanDerWaalsContact C-N 3.33Å; I1166-L1168 PolarHBondContact O-N 3.47Å; I1166-L1168 VanDerWaalsContact O-N 3.15Å; I1166-E1169 PolarHBondContact O-N 3.16Å; I1166-E1169 VanDerWaalsContact O-N 3.1Å; I1166-D1170 PolarHBondContact O-N 3Å
1167	L	82.3	Confident	84.5	Confident	40 Å²	40	60.4 Å²	60.4	21%	0.209	31%	0.307	C	S	.	.	H	α-helix	trans	-63.2	-20.7	-180	-70.1	175	0	0	0	114.1	L1159 E1163 L1164	L1159-L1167 HydrophobicContact CD1-CD1 3.83Å; E1163-L1167 WeakPolarHBondContact O-CG 3.47Å; E1163-L1167 PolarHBondContact O-N 2.95Å; L1164-L1167 PolarHBondContact O-N 3.19Å
1168	L	81.9	Confident	83.8	Confident	55 Å²	55	62.8 Å²	62.8	29%	0.288	32%	0.319	S	S	.	.	H	α-helix	trans	-94.6	-19.6	177.2	-69.2	174.6	0	0	0	113.3	R584 V587 L1164 D1165 I1166	R584-L1168 HydrophobicContact CG-CD1 4.26Å; V587-L1168 HydrophobicContact CG1-CD2 4.16Å; V587-L1168 HydrophobicContact CG2-CD2 4.38Å; L1164-L1168 HydrophobicContact CD1-CD1 4.16Å; L1164-L1168 HydrophobicContact CD1-CG 4.31Å; L1164-L1168 HydrophobicContact CG-CD1 4.01Å; L1164-L1168 VanDerWaalsContact O-CG 3.28Å; L1164-L1168 WeakPolarHBondContact O-CG 3.42Å; L1164-L1168 PolarHBondContact O-N 3.02Å; L1164-L1168 VanDerWaalsContact O-N 3.16Å; D1165-L1168 PolarHBondContact O-N 3.05Å; I1166-L1168 PolarHBondContact O-N 3.47Å; I1166-L1168 VanDerWaalsContact O-N 3.15Å
1169	E	76.1	Confident	83.3	Confident	163 Å²	163	67.4 Å²	67.4	76%	0.762	34%	0.343	S	S	*	.	H	α-helix	trans	-84.8	-38.3	178.3	-77.5	-179	-177.5	0	0	113	D1165 I1166	D1165-E1169 WeakPolarHBondContact O-CG 3.46Å; D1165-E1169 PolarHBondContact O-N 3.23Å; D1165-E1169 VanDerWaalsContact O-N 3.09Å; I1166-E1169 PolarHBondContact O-N 3.16Å; I1166-E1169 VanDerWaalsContact O-N 3.1Å
1170	D	53.5	Low	82.7	Confident	139 Å²	139	73.5 Å²	73.5	74%	0.743	37%	0.374	S	S	*	.			trans	-70.4	0	168.1	-72	-27.4	0	0	0	111.6	R580 I1166	R580-D1170 VanDerWaalsContact CZ-O 3.3Å; R580-D1170 PolarHBondContact NE-OXT 3.01Å; R580-D1170 PolarHBondContact NH1-O 3.37Å; R580-D1170 PolarHBondContact NH1-OXT 3.34Å; R580-D1170 VanDerWaalsContact NH2-C 3.33Å; R580-D1170 PolarHBondContact NH2-O 3.14Å; R580-D1170 PolarHBondContact NH2-OXT 3.2Å; I1166-D1170 PolarHBondContact O-N 3Å

Retrieved 1,170 of 1,170 residues in 1149.8 ms (Link to these results)

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