A0A087XAR7_POEFO Loading...

SKI2 subunit of superkiller complex

AlphaFold DB , UniProt , Accession A0A087XAR7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,246 aa.

						>A0A087XAR7_POEFO|A0A087XAR7
MDRIHVPPVGPMDLPLSLLEMGRSGRFELITHPLPDQPLPPQSTLPHGLPPTSLGLEREVEKRFLLDPAWLPIHDTDFAFQKFLKVTERKVNVDSLLSCAPSPLHSGLSVVRDPTTGMLLDFTEVLLENTGLSAKNSLSLQRQPGPPSESLRGSNTNYPFLPGGMEELTLDQIKTRSEQEEEIDFEKDLLKIPPGLKAGMDFSDKDAKIAKPEVNLMSLLSTLENIPDLLPEAEEKEDGKTGEEAVKLPRTNSLEDLGIKDAESSCSQTEAGKTDKSKPKENPEEKKKWAVPVDILSPCEDFYKRIPNPAFKWPFELDTFQKQAVLRLEAHDSVFVAAHTSAGKTVVAEYAIALSQKHMTRTIYTSPIKALSNQKFRDFKNTFGDVGLLTGDVQLSPESSCLIMTTEILRSMLYNGSEVIRDLEWVIFDEVHYINDAERGVVWEEVLIMLPDHVSIILLSATVPNALEFSEWIGRIKKRHIYVISTMKRPVPLEHYLYTGNSTKTQKEMFLLVDAAGNFLTKGYYTAVDTKKERTSKHAQSFGTKSTPQHTSASQDRAVWLTLLHFLSQRQQTPVVAFTFSRTRCDENARSLDSMDLTTSIEKAEIHSFFQKSLSRLRGGDRQLPQILLMRDLLKRGIAVHHSGILPILKEVIEMLFSRGLVKVLFATETFAMGVNMPARTVVFDSIRKHDGTGFRNLLPGEYIQMAGRAGRRGLDATGTVIILCKSGVHDMADLHAMMMGKPTILQSQFRLTYTMILNLLRVEALRVTDMMRRSFSESHRDTQAHEKRIGHLKQMLASLPPLETEGQLSDILPYYHTATEMQNTREALQKAIMESVNGLKALSVGRVVIVNNKQHLNALGVILQVSSDSVNRTFTALIICEKGNEEVAGKAEDSTSFQHLYNTALFIPEGPCSHTVQKLKLQDISAITVKTLKVIPDRIIDNYNKRQQPRFRADPPGQAISTATQELLRLAEANPGGVATLDPVNDLQLKSVDVVESSMRLRVLQDSLLDFNCVHSPTFAEQFARIKERMSVQEELDRLLFLVSDQSLMLLPEYHQRIKVLQSLQYIDSSGAVQLKGRVACQISSHELLLTELLFENVLSPLAPEESAALLSCLVFTQNTQTEPHITSTLKESIDRVLSVAQRIGQLQRECGIAQTAEEFVGQFKFGLTEVVYCWARGMPFAEIALLTDVQEGTVVRCIQRLDEVLKEVRQAARIVGDSVLGSKMEKASLAIRRDIVFTASLYTH
					

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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	39	Very low	39.3	Very low	241 Å²	241	149 Å²	149	100%	1.187	81%	0.808	S	S	*	*				0	99.9	0	-83.1	-168.4	179.5	0	0	106
2	D	33	Very low	39.9	Very low	159 Å²	159	151.3 Å²	151.3	85%	0.85	81%	0.813	S	S	*	*			trans	-108.7	137.6	173.2	-65.4	-63.5	0	0	0	108.4
3	R	36.2	Very low	40.4	Very low	243 Å²	243	147.3 Å²	147.3	92%	0.917	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-80.3	122.2	-173.4	-71.1	175.7	171.3	172.9	-4.5	110.1
4	I	33.7	Very low	40.8	Very low	160 Å²	160	144.9 Å²	144.9	82%	0.821	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-85.3	126.1	166.4	-63.1	176.7	0	0	0	108.3
5	H	35	Very low	41.1	Very low	179 Å²	179	142.9 Å²	142.9	83%	0.829	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-75	137.9	170	-88.6	-95.1	0	0	0	110.5
6	V	37.3	Very low	41.5	Very low	127 Å²	127	140.3 Å²	140.3	77%	0.77	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-96.2	139.5	169.8	-176.7	0	0	0	0	108.2
7	P	39.6	Very low	42	Very low	106 Å²	106	136.4 Å²	136.4	69%	0.688	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-68.3	165	-178.6	27.2	-35.1	0	0	0	113.4
8	P	44.3	Very low	42.5	Very low	128 Å²	128	134.4 Å²	134.4	83%	0.831	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-68.8	148.5	-178.6	28.7	-35.4	0	0	0	113.3
9	V	45.9	Very low	43	Very low	122 Å²	122	129.6 Å²	129.6	74%	0.739	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-57.3	135.7	-178.5	-179.7	0	0	0	0	112	D13	V9-D13 HydrophobicContact CG1-CB 3.42Å; V9-D13 VanDerWaalsContact CG1-CB 3.42Å; V9-D13 VanDerWaalsContact CG1-OD2 3.28Å; V9-D13 WeakPolarHBondContact CG1-OD2 3.47Å
10	G	44	Very low	43.2	Very low	33 Å²	33	129.5 Å²	129.5	34%	0.34	70%	0.701	S	S	.	*	P	Polyproline II helix	trans	-94.9	167	-179.7	0	0	0	0	0	113.5	M12 D13	G10-M12 PolarHBondContact O-N 2.69Å; G10-D13 PolarHBondContact N-OD2 3.28Å; G10-D13 PolarHBondContact O-N 2.67Å; G10-D13 VanDerWaalsContact O-N 3.12Å
11	P	44.2	Very low	43.3	Very low	141 Å²	141	129.4 Å²	129.4	92%	0.916	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	3	-175.9	29.7	-36.4	0	0	0	115.3
12	M	46.5	Very low	43.8	Very low	177 Å²	177	120.3 Å²	120.3	87%	0.872	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.5	-2.5	175.4	-66.9	-66.6	-71.4	0	0	113	G10 L14	G10-M12 PolarHBondContact O-N 2.69Å; M12-L14 PolarHBondContact O-N 2.7Å
13	D	46.6	Very low	44.1	Very low	99 Å²	99	125.5 Å²	125.5	53%	0.529	67%	0.673	S	S	.	*			trans	-81.1	112.3	177.8	-68.6	-46.7	0	0	0	110.3	V9 G10	V9-D13 HydrophobicContact CG1-CB 3.42Å; V9-D13 VanDerWaalsContact CG1-CB 3.42Å; V9-D13 VanDerWaalsContact CG1-OD2 3.28Å; V9-D13 WeakPolarHBondContact CG1-OD2 3.47Å; G10-D13 PolarHBondContact N-OD2 3.28Å; G10-D13 PolarHBondContact O-N 2.67Å; G10-D13 VanDerWaalsContact O-N 3.12Å
14	L	46	Very low	44.5	Very low	114 Å²	114	118 Å²	118	60%	0.597	66%	0.658	S	S	*	*			trans	-66.4	132.3	179.1	-77.9	160.3	0	0	0	111.4	M12 L16	M12-L14 PolarHBondContact O-N 2.7Å; L14-L16 PolarHBondContact O-N 2.73Å
15	P	45.8	Very low	45.4	Very low	114 Å²	114	112.7 Å²	112.7	74%	0.74	64%	0.643	S	S	*	*			trans	-76.7	97.5	177.9	30.6	-33.6	0	0	0	110.6	S17	P15-S17 PolarHBondContact O-N 3.1Å
16	L	46.7	Very low	45.7	Very low	102 Å²	102	113.2 Å²	113.2	53%	0.534	64%	0.637	S	S	.	*			trans	-84.8	111.3	-177.6	-63.6	178.2	0	0	0	112	L14 L29 T31	L14-L16 PolarHBondContact O-N 2.73Å; L16-L29 HydrophobicContact CB-CD1 3.8Å; L16-L29 HydrophobicContact CB-CG 4.5Å; L16-L29 HydrophobicContact CD1-CD1 4.23Å; L16-L29 HydrophobicContact CD1-CD2 4.28Å; L16-L29 HydrophobicContact CD2-CD1 4.33Å; L16-L29 HydrophobicContact CD2-CD2 4Å; L16-L29 HydrophobicContact CD2-CG 4.18Å; L16-L29 HydrophobicContact CG-CD1 4.34Å; L16-T31 HydrophobicContact CD2-CG2 3.62Å
17	S	50.8	Low	46.2	Very low	74 Å²	74	113.3 Å²	113.3	52%	0.517	63%	0.628	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.2	126	170.8	65.2	0	0	0	0	111.5	P15 I30	P15-S17 PolarHBondContact O-N 3.1Å; S17-I30 PolarHBondContact O-N 2.98Å; S17-I30 PolarHBondContact OG-O 2.96Å; S17-I30 VanDerWaalsContact OG-O 3.11Å
18	L	51.3	Low	46.6	Very low	101 Å²	101	114.2 Å²	114.2	53%	0.529	62%	0.623	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108	130.9	-176.7	-114.3	157.4	0	0	0	110.4	F27 L29	L18-F27 HydrophobicContact CD2-CB 3.58Å; L18-F27 HydrophobicContact CD2-CD1 4.03Å; L18-F27 HydrophobicContact CD2-CG 4.22Å; L18-L29 HydrophobicContact CD1-CD1 3.77Å; L18-L29 HydrophobicContact CD2-CD1 4.49Å; L18-L29 HydrophobicContact CG-CD1 3.61Å
19	L	50.3	Low	47	Very low	42 Å²	42	112.1 Å²	112.1	22%	0.22	60%	0.604	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-121.4	127.6	-176.6	-137.5	158.7	0	0	0	109.8	M21 E28 I30	L19-M21 HydrophobicContact CD2-CG 4.33Å; L19-E28 PolarHBondContact N-O 2.86Å; L19-E28 PolarHBondContact O-N 3.33Å; L19-I30 HydrophobicContact CD1-CD1 4.42Å
20	E	46.9	Very low	47.4	Very low	128 Å²	128	109.4 Å²	109.4	60%	0.598	59%	0.585	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-99.2	111.5	-179.6	-172.5	-179.2	172	0	0	110.2	G22 F27	E20-G22 PolarHBondContact O-N 2.87Å; E20-F27 HydrophobicContact CB-CD1 4.03Å; E20-F27 HydrophobicContact CB-CE1 3.74Å; E20-F27 HydrophobicContact CG-CD1 4.19Å; E20-F27 HydrophobicContact CG-CE1 3.65Å; E20-F27 HydrophobicContact CG-CZ 4.04Å
21	M	46	Very low	47.8	Very low	128 Å²	128	110.9 Å²	110.9	63%	0.631	59%	0.587	S	S	*	*			trans	-99.1	74.8	-179.3	-73.2	-150.1	77.4	0	0	113.2	L19 S24 R26	L19-M21 HydrophobicContact CD2-CG 4.33Å; M21-S24 PolarHBondContact O-OG 3.06Å; M21-R26 PolarHBondContact N-O 2.97Å
22	G	49.1	Very low	48.2	Very low	49 Å²	49	109.9 Å²	109.9	51%	0.505	57%	0.57	S	S	.	*	G	3₁₀ helix	trans	64.9	-161	162.1	0	0	0	0	0	115.9	E20 S24 G25	E20-G22 PolarHBondContact O-N 2.87Å; G22-S24 PolarHBondContact O-N 2.92Å; G22-G25 PolarHBondContact O-N 3.04Å; G22-G25 VanDerWaalsContact O-N 3.12Å
23	R	39.3	Very low	48.4	Very low	268 Å²	268	106.9 Å²	106.9	100%	1.011	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-65.5	3.6	-164.7	-66.9	-175.7	176.8	173.4	-1.1	116.5
24	S	46.2	Very low	48.8	Very low	87 Å²	87	108.4 Å²	108.4	61%	0.608	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-86.6	-9.5	172.6	64.4	0	0	0	0	113.1	M21 G22 R26	M21-S24 PolarHBondContact O-OG 3.06Å; G22-S24 PolarHBondContact O-N 2.92Å; S24-R26 PolarHBondContact O-N 3.13Å; S24-R26 VanDerWaalsContact O-N 3.16Å
25	G	51.1	Low	48.5	Very low	48 Å²	48	108.3 Å²	108.3	50%	0.495	58%	0.578	S	S	.	*			trans	64	16.8	178.9	0	0	0	0	0	114	G22	G22-G25 PolarHBondContact O-N 3.04Å; G22-G25 VanDerWaalsContact O-N 3.12Å
26	R	42	Very low	48.5	Very low	189 Å²	189	110.9 Å²	110.9	71%	0.713	59%	0.585	S	S	*	*			trans	-84.3	124.1	174.9	-80.3	-170.8	173.6	-174.4	-1.7	110.4	M21 S24	M21-R26 PolarHBondContact N-O 2.97Å; S24-R26 PolarHBondContact O-N 3.13Å; S24-R26 VanDerWaalsContact O-N 3.16Å
27	F	47.3	Very low	48.7	Very low	129 Å²	129	113 Å²	113	57%	0.566	59%	0.593	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-98	119.8	171.3	-74.3	-74.3	0	0	0	108.3	L18 E20	L18-F27 HydrophobicContact CD2-CB 3.58Å; L18-F27 HydrophobicContact CD2-CD1 4.03Å; L18-F27 HydrophobicContact CD2-CG 4.22Å; E20-F27 HydrophobicContact CB-CD1 4.03Å; E20-F27 HydrophobicContact CB-CE1 3.74Å; E20-F27 HydrophobicContact CG-CD1 4.19Å; E20-F27 HydrophobicContact CG-CE1 3.65Å; E20-F27 HydrophobicContact CG-CZ 4.04Å
28	E	49	Very low	48.6	Very low	125 Å²	125	115.6 Å²	115.6	58%	0.584	61%	0.608	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-108.5	133.5	173.3	-101.9	175.1	178.6	0	0	110.7	L19	L19-E28 PolarHBondContact N-O 2.86Å; L19-E28 PolarHBondContact O-N 3.33Å
29	L	51.9	Low	48.5	Very low	85 Å²	85	117.1 Å²	117.1	45%	0.445	62%	0.616	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.4	102.5	-174.5	-173	85.1	0	0	0	107.7	L16 L18 T31	L16-L29 HydrophobicContact CB-CD1 3.8Å; L16-L29 HydrophobicContact CB-CG 4.5Å; L16-L29 HydrophobicContact CD1-CD1 4.23Å; L16-L29 HydrophobicContact CD1-CD2 4.28Å; L16-L29 HydrophobicContact CD2-CD1 4.33Å; L16-L29 HydrophobicContact CD2-CD2 4Å; L16-L29 HydrophobicContact CD2-CG 4.18Å; L16-L29 HydrophobicContact CG-CD1 4.34Å; L18-L29 HydrophobicContact CD1-CD1 3.77Å; L18-L29 HydrophobicContact CD2-CD1 4.49Å; L18-L29 HydrophobicContact CG-CD1 3.61Å; L29-T31 HydrophobicContact CD2-CG2 4.26Å; L29-T31 HydrophobicContact CG-CG2 4.4Å
30	I	54.2	Low	48.5	Very low	65 Å²	65	119.1 Å²	119.1	33%	0.333	63%	0.631	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.8	114.5	178.8	-56.3	178.7	0	0	0	107.7	S17 L19 H32	S17-I30 PolarHBondContact O-N 2.98Å; S17-I30 PolarHBondContact OG-O 2.96Å; S17-I30 VanDerWaalsContact OG-O 3.11Å; L19-I30 HydrophobicContact CD1-CD1 4.42Å; I30-H32 WeakPolarHBondContact CG2-O 3.33Å
31	T	52.6	Low	48.4	Very low	64 Å²	64	119.2 Å²	119.2	39%	0.393	64%	0.642	S	S	.	*			trans	-92.8	-23.7	-174.2	61.3	0	0	0	0	113.6	L16 L29	L16-T31 HydrophobicContact CD2-CG2 3.62Å; L29-T31 HydrophobicContact CD2-CG2 4.26Å; L29-T31 HydrophobicContact CG-CG2 4.4Å
32	H	52.7	Low	48.1	Very low	119 Å²	119	120.5 Å²	120.5	55%	0.551	65%	0.647	S	S	*	*	S	Bend	trans	-145.3	146	176.2	-55	-65.5	0	0	0	111.1	I30 L34	I30-H32 WeakPolarHBondContact CG2-O 3.33Å; H32-L34 PolarHBondContact O-N 3.14Å
33	P	51.2	Low	48.1	Very low	115 Å²	115	123.4 Å²	123.4	75%	0.747	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-70.6	122.7	169	29.5	-32.3	0	0	0	109.9
34	L	54.3	Low	47.7	Very low	130 Å²	130	117.4 Å²	117.4	68%	0.681	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-69	132.9	168	-70.5	165.1	0	0	0	108.9	H32	H32-L34 PolarHBondContact O-N 3.14Å
35	P	40	Very low	47.6	Very low	113 Å²	113	121.4 Å²	121.4	73%	0.734	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	143.6	170	25.1	-31.3	0	0	0	110.1
36	D	47	Very low	47	Very low	167 Å²	167	124 Å²	124	89%	0.893	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	72.3	20.9	177.2	-53.9	-29.7	0	0	0	118.9
37	Q	49.3	Very low	46.5	Very low	148 Å²	148	124.2 Å²	124.2	69%	0.692	68%	0.684	S	S	*	*			trans	-128.3	126.4	164.9	-70.8	-170	-4.2	0	0	114.2
38	P	48.8	Very low	45.8	Very low	128 Å²	128	121.7 Å²	121.7	83%	0.831	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-77.9	135.2	173.9	31.4	-33.1	0	0	0	111.8
39	L	50.3	Low	45.2	Very low	133 Å²	133	123.8 Å²	123.8	70%	0.696	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-70.5	136.5	-179.7	-71.8	164.9	0	0	0	112.3
40	P	49.6	Very low	44.8	Very low	83 Å²	83	125.1 Å²	125.1	54%	0.539	72%	0.722	S	S	.	*	P	Polyproline II helix	trans	-74.3	149.4	178.8	30	-34.5	0	0	0	112.7
41	P	43.9	Very low	44.4	Very low	130 Å²	130	127 Å²	127	84%	0.844	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-73.4	142	-174.7	29.4	-35.4	0	0	0	113.4	S43	P41-S43 PolarHBondContact O-N 3.24Å
42	Q	41.3	Very low	44.2	Very low	155 Å²	155	130.5 Å²	130.5	72%	0.724	76%	0.76	S	S	*	*			trans	-83.1	104.9	-177.3	-67.6	-175.2	-13.6	0	0	113
43	S	48.4	Very low	43.9	Very low	111 Å²	111	130.1 Å²	130.1	78%	0.776	77%	0.771	S	S	*	*			trans	60	125.1	159.9	77.1	0	0	0	0	120	P41	P41-S43 PolarHBondContact O-N 3.24Å
44	T	31.8	Very low	43.8	Very low	142 Å²	142	131.6 Å²	131.6	87%	0.871	77%	0.772	S	S	*	*			trans	-152.2	120	153.8	48.7	0	0	0	0	111.1
45	L	42.3	Very low	43.5	Very low	170 Å²	170	127.3 Å²	127.3	89%	0.89	76%	0.758	S	S	*	*			trans	-72.7	153.4	164.8	-67.4	160.6	0	0	0	109.9
46	P	40.2	Very low	44.3	Very low	104 Å²	104	128.1 Å²	128.1	68%	0.675	76%	0.756	S	S	*	*				-156.4	154.9	103.8	33.2	-12.1	0	0	0	118.9
47	H	30.4	Very low	44.7	Very low	192 Å²	192	128.3 Å²	128.3	89%	0.889	75%	0.752	S	S	*	*			trans	45.2	129.2	145.9	-53.8	-53	0	0	0	123.6
48	G	31.7	Very low	45	Very low	76 Å²	76	129.7 Å²	129.7	78%	0.784	75%	0.75	S	S	*	*			trans	-87.5	-158.3	170.2	0	0	0	0	0	113.7
49	L	38.1	Very low	45.4	Very low	170 Å²	170	127.6 Å²	127.6	89%	0.89	73%	0.729	S	S	*	*			cis	-161.4	-171.5	7.6	-95	170.8	0	0	0	106.4
50	P	43.7	Very low	45.9	Very low	112 Å²	112	124 Å²	124	73%	0.727	71%	0.713	S	S	*	*			cis	-123.6	-140.5	-9.4	44.5	-25.5	0	0	0	109.7
51	P	45.3	Very low	46.6	Very low	104 Å²	104	124.8 Å²	124.8	68%	0.675	71%	0.71	S	S	*	*			cis	-127.6	141.6	-23.3	35.9	-17.3	0	0	0	117.4
52	T	47.2	Very low	47.3	Very low	138 Å²	138	126 Å²	126	85%	0.847	70%	0.702	S	S	*	*			trans	43.4	87.5	145.1	63.9	0	0	0	0	121.2
53	S	46.4	Very low	47.9	Very low	112 Å²	112	124.5 Å²	124.5	78%	0.783	69%	0.689	S	S	*	*	S	Bend		-96.9	165.6	126	59.9	0	0	0	0	109.3	G55	S53-G55 PolarHBondContact O-N 3.28Å
54	L	49	Very low	48.3	Very low	146 Å²	146	124.2 Å²	124.2	76%	0.764	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-59.3	122	175.5	-77.5	162	0	0	0	109.4
55	G	48.9	Very low	49.6	Very low	39 Å²	39	123.8 Å²	123.8	40%	0.402	67%	0.666	S	S	.	*	P	Polyproline II helix	trans	-61.1	137.6	-174.3	0	0	0	0	0	112.3	S53 E57 R58 E59	S53-G55 PolarHBondContact O-N 3.28Å; G55-E57 PolarHBondContact O-N 3.31Å; G55-E57 VanDerWaalsContact O-N 3.09Å; G55-R58 PolarHBondContact O-N 3.13Å; G55-E59 PolarHBondContact O-N 3.33Å
56	L	56	Low	50.4	Low	131 Å²	131	121.5 Å²	121.5	69%	0.686	65%	0.654	S	S	*	*	H	α-helix	trans	-51.3	-34.8	177.5	-160.4	85	0	0	0	111.6	R58 E59 V60	L56-R58 PolarHBondContact O-N 3.44Å; L56-E59 PolarHBondContact O-N 2.9Å; L56-V60 HydrophobicContact CG-CG2 4.36Å; L56-V60 WeakPolarHBondContact O-CB 3.37Å; L56-V60 VanDerWaalsContact O-CG2 3.28Å; L56-V60 WeakPolarHBondContact O-CG2 3.3Å; L56-V60 PolarHBondContact O-N 3.4Å
57	E	56.8	Low	51	Low	171 Å²	171	121 Å²	121	80%	0.799	65%	0.645	S	S	*	*	H	α-helix	trans	-55	-45.2	173.1	-71.6	177.8	143.1	0	0	113	G55 V60 E61	G55-E57 PolarHBondContact O-N 3.31Å; G55-E57 VanDerWaalsContact O-N 3.09Å; E57-V60 PolarHBondContact O-N 2.98Å; E57-E61 WeakPolarHBondContact O-CB 3.28Å; E57-E61 PolarHBondContact O-N 3.1Å
58	R	55.8	Low	52.2	Low	176 Å²	176	116.3 Å²	116.3	66%	0.664	63%	0.632	S	S	*	*	H	α-helix	trans	-71.9	-30	178.1	-80.7	-174.1	174.4	173.3	0.1	112.9	G55 L56 K62	G55-R58 PolarHBondContact O-N 3.13Å; L56-R58 PolarHBondContact O-N 3.44Å; R58-K62 WeakPolarHBondContact O-CB 3.32Å; R58-K62 PolarHBondContact O-N 3.19Å
59	E	55.7	Low	53.4	Low	84 Å²	84	116.9 Å²	116.9	39%	0.393	63%	0.63	S	S	.	*	H	α-helix	trans	-74.2	-37.1	174.8	-159.2	178.3	-172.1	0	0	110.9	G55 L56 R63	G55-E59 PolarHBondContact O-N 3.33Å; L56-E59 PolarHBondContact O-N 2.9Å; E59-R63 VanDerWaalsContact O-CB 3.31Å; E59-R63 WeakPolarHBondContact O-CB 3.42Å; E59-R63 WeakPolarHBondContact O-CG 3.42Å; E59-R63 PolarHBondContact O-N 3.37Å; E59-R63 IonicContact OE1-CZ 2.78Å; E59-R63 IonicContact OE1-NH1 2.7Å; E59-R63 PolarHBondContact OE1-NH1 3.44Å; E59-R63 IonicContact OE1-NH2 3.35Å; E59-R63 PolarHBondContact OE1-NH2 2.89Å
60	V	60.7	Low	54.1	Low	59 Å²	59	116.9 Å²	116.9	36%	0.358	62%	0.618	S	S	.	*	H	α-helix	trans	-67.9	-43	172.2	165.9	0	0	0	0	111.2	L56 E57 R63 F64	L56-V60 HydrophobicContact CG-CG2 4.36Å; L56-V60 WeakPolarHBondContact O-CB 3.37Å; L56-V60 VanDerWaalsContact O-CG2 3.28Å; L56-V60 WeakPolarHBondContact O-CG2 3.3Å; L56-V60 PolarHBondContact O-N 3.4Å; E57-V60 PolarHBondContact O-N 2.98Å; V60-R63 PolarHBondContact O-N 2.96Å; V60-F64 HydrophobicContact CB-CD2 4.26Å; V60-F64 HydrophobicContact CG1-CD2 4.02Å; V60-F64 HydrophobicContact CG2-CD2 4.27Å; V60-F64 HydrophobicContact CG2-CE2 4.42Å; V60-F64 WeakPolarHBondContact O-CA 3.4Å; V60-F64 WeakPolarHBondContact O-CB 3.42Å; V60-F64 PolarHBondContact O-N 2.96Å
61	E	64.9	Low	54.6	Low	98 Å²	98	115 Å²	115	46%	0.458	60%	0.602	S	S	.	*	I	π-helix	trans	-62.8	-43.3	176.8	-173.5	175	-132.4	0	0	110.8	E57 L65 L66	E57-E61 WeakPolarHBondContact O-CB 3.28Å; E57-E61 PolarHBondContact O-N 3.1Å; E61-L65 HydrophobicContact CB-CD1 4.3Å; E61-L65 HydrophobicContact CG-CB 4.43Å; E61-L65 HydrophobicContact CG-CD1 4.21Å; E61-L65 CarbonylContact O-C 3.53Å; E61-L65 WeakPolarHBondContact O-CA 3.45Å; E61-L65 WeakPolarHBondContact O-CB 3.44Å; E61-L65 PolarHBondContact O-N 3.07Å; E61-L65 VanDerWaalsContact O-N 3.16Å; E61-L66 HydrophobicContact CG-CD1 4.33Å; E61-L66 WeakPolarHBondContact O-CB 3.42Å; E61-L66 WeakPolarHBondContact O-CG 3.49Å; E61-L66 PolarHBondContact O-N 3.05Å
62	K	59	Low	55.2	Low	157 Å²	157	114.7 Å²	114.7	68%	0.683	60%	0.599	S	S	*	*	I	π-helix	trans	-68.4	-39.6	172.7	-98.2	-170.1	169.6	-171.9	0	114.9	R58 L66	R58-K62 WeakPolarHBondContact O-CB 3.32Å; R58-K62 PolarHBondContact O-N 3.19Å; K62-L66 HydrophobicContact CG-CD1 4.1Å
63	R	54	Low	55.6	Low	123 Å²	123	113.8 Å²	113.8	46%	0.464	59%	0.588	S	S	.	*	I	π-helix	trans	-86.5	-28.2	-175.5	-76.2	-166.7	179.1	123.1	13	115.2	E59 V60	E59-R63 VanDerWaalsContact O-CB 3.31Å; E59-R63 WeakPolarHBondContact O-CB 3.42Å; E59-R63 WeakPolarHBondContact O-CG 3.42Å; E59-R63 PolarHBondContact O-N 3.37Å; E59-R63 IonicContact OE1-CZ 2.78Å; E59-R63 IonicContact OE1-NH1 2.7Å; E59-R63 PolarHBondContact OE1-NH1 3.44Å; E59-R63 IonicContact OE1-NH2 3.35Å; E59-R63 PolarHBondContact OE1-NH2 2.89Å; V60-R63 PolarHBondContact O-N 2.96Å
64	F	56	Low	56	Low	104 Å²	104	116 Å²	116	46%	0.456	59%	0.586	S	S	.	*	I	π-helix	trans	-123.4	-17.9	-171.6	-59.5	-77.2	0	0	0	114.4	V60 W70	V60-F64 HydrophobicContact CB-CD2 4.26Å; V60-F64 HydrophobicContact CG1-CD2 4.02Å; V60-F64 HydrophobicContact CG2-CD2 4.27Å; V60-F64 HydrophobicContact CG2-CE2 4.42Å; V60-F64 WeakPolarHBondContact O-CA 3.4Å; V60-F64 WeakPolarHBondContact O-CB 3.42Å; V60-F64 PolarHBondContact O-N 2.96Å; F64-W70 HydrophobicContact CE1-CE3 4.29Å
65	L	60.1	Low	56.6	Low	134 Å²	134	113.5 Å²	113.5	70%	0.702	57%	0.573	S	S	*	*	I	π-helix	trans	-109	-28.4	179.5	-59.3	177.3	0	0	0	114	E61	E61-L65 HydrophobicContact CB-CD1 4.3Å; E61-L65 HydrophobicContact CG-CB 4.43Å; E61-L65 HydrophobicContact CG-CD1 4.21Å; E61-L65 CarbonylContact O-C 3.53Å; E61-L65 WeakPolarHBondContact O-CA 3.45Å; E61-L65 WeakPolarHBondContact O-CB 3.44Å; E61-L65 PolarHBondContact O-N 3.07Å; E61-L65 VanDerWaalsContact O-N 3.16Å
66	L	58.3	Low	57.1	Low	121 Å²	121	115.9 Å²	115.9	63%	0.634	58%	0.58	S	S	*	*	S	Bend	trans	-102.1	-18.1	-174.8	-73.3	169.6	0	0	0	115.6	E61 K62	E61-L66 HydrophobicContact CG-CD1 4.33Å; E61-L66 WeakPolarHBondContact O-CB 3.42Å; E61-L66 WeakPolarHBondContact O-CG 3.49Å; E61-L66 PolarHBondContact O-N 3.05Å; K62-L66 HydrophobicContact CG-CD1 4.1Å
67	D	52.6	Low	57.6	Low	93 Å²	93	114.8 Å²	114.8	50%	0.497	58%	0.575	S	S	.	*			trans	-125	95.8	-174.2	-151.7	-18.1	0	0	0	111.3	A69 W70	D67-A69 PolarHBondContact O-N 3.31Å; D67-W70 PolarHBondContact O-N 3.16Å
68	P	56	Low	57.8	Low	95 Å²	95	113.1 Å²	113.1	62%	0.617	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-60.9	-18.2	-173.5	-25.3	34.8	0	0	0	114.9	W70 L71	P68-W70 PolarHBondContact O-N 3.07Å; P68-L71 PolarHBondContact O-N 3.13Å
69	A	56.5	Low	58	Low	88 Å²	88	107.1 Å²	107.1	73%	0.727	55%	0.553	S	S	*	*	G	3₁₀ helix	trans	-66.4	-14.7	-179.3	0	0	0	0	0	114.2	D67	D67-A69 PolarHBondContact O-N 3.31Å
70	W	52.6	Low	58.3	Low	169 Å²	169	109.1 Å²	109.1	64%	0.64	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-100.7	0.5	-179.2	-110.4	68.6	0	0	0	115.1	F64 D67 P68 P72	F64-W70 HydrophobicContact CE1-CE3 4.29Å; D67-W70 PolarHBondContact O-N 3.16Å; P68-W70 PolarHBondContact O-N 3.07Å; W70-P72 WeakPolarHBondContact O-CD 3.43Å
71	L	55.6	Low	58.5	Low	74 Å²	74	112 Å²	112	39%	0.387	57%	0.571	S	S	.	*			trans	-83.4	115.7	171.9	-78	164.7	0	0	0	109.9	P68 I73	P68-L71 PolarHBondContact O-N 3.13Å; L71-I73 HydrophobicContact CB-CD1 4.12Å; L71-I73 HydrophobicContact CB-CG1 4.2Å; L71-I73 HydrophobicContact CD1-CD1 4.34Å; L71-I73 HydrophobicContact CD2-CD1 4.23Å; L71-I73 HydrophobicContact CG-CD1 4.47Å; L71-I73 PolarHBondContact O-N 3.29Å
72	P	57.2	Low	58.3	Low	96 Å²	96	113.9 Å²	113.9	62%	0.623	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	38.8	179	35.7	-37.6	0	0	0	112.1	W70 H74	W70-P72 WeakPolarHBondContact O-CD 3.43Å; P72-H74 VanDerWaalsContact C-N 3.29Å
73	I	55	Low	58.5	Low	120 Å²	120	112.8 Å²	112.8	62%	0.615	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-18.6	171.4	-57	172.3	0	0	0	109.7	L71	L71-I73 HydrophobicContact CB-CD1 4.12Å; L71-I73 HydrophobicContact CB-CG1 4.2Å; L71-I73 HydrophobicContact CD1-CD1 4.34Å; L71-I73 HydrophobicContact CD2-CD1 4.23Å; L71-I73 HydrophobicContact CG-CD1 4.47Å; L71-I73 PolarHBondContact O-N 3.29Å
74	H	55.6	Low	58.7	Low	159 Å²	159	111 Å²	111	74%	0.736	57%	0.572	S	S	*	*	S	Bend	trans	-105.4	-13.9	-178.9	-57.2	-52.2	0	0	0	114.5	P72 T76	P72-H74 VanDerWaalsContact C-N 3.29Å; H74-T76 PolarHBondContact O-N 2.81Å
75	D	61.6	Low	59	Low	93 Å²	93	114 Å²	114	50%	0.497	59%	0.585	S	S	.	*			trans	-94.9	73.3	170.9	-170.2	-7.1	0	0	0	109.5	D77 F78	D75-D77 VanDerWaalsContact C-N 3.27Å; D75-D77 PolarHBondContact O-N 3.13Å; D75-F78 PolarHBondContact OD1-N 3.43Å
76	T	59.2	Low	59.1	Low	89 Å²	89	113.4 Å²	113.4	55%	0.546	59%	0.586	S	S	.	*	H	α-helix	trans	-62.1	-34.8	-175.4	47.2	0	0	0	0	112.3	H74 F80	H74-T76 PolarHBondContact O-N 2.81Å; T76-F80 WeakPolarHBondContact O-CB 3.26Å; T76-F80 PolarHBondContact O-N 3.39Å
77	D	65.6	Low	59.2	Low	107 Å²	107	110.2 Å²	110.2	57%	0.572	57%	0.572	S	S	*	*	H	α-helix	trans	-71.8	-44.1	-171.3	-69.8	-17.3	0	0	0	112.1	D75 F80 Q81	D75-D77 VanDerWaalsContact C-N 3.27Å; D75-D77 PolarHBondContact O-N 3.13Å; D77-F80 PolarHBondContact O-N 3.46Å; D77-Q81 WeakPolarHBondContact O-CB 3.34Å; D77-Q81 VanDerWaalsContact O-CG 3.31Å; D77-Q81 WeakPolarHBondContact O-CG 3.44Å; D77-Q81 PolarHBondContact O-N 2.64Å
78	F	62.8	Low	59.4	Low	136 Å²	136	114 Å²	114	60%	0.596	59%	0.587	S	S	*	*	H	α-helix	trans	-66.8	-42.5	178.3	-175.4	-101.8	0	0	0	112	D75 K82	D75-F78 PolarHBondContact OD1-N 3.43Å; F78-K82 HydrophobicContact CE1-CD 4.39Å; F78-K82 VanDerWaalsContact O-CB 3.3Å; F78-K82 WeakPolarHBondContact O-CB 3.29Å; F78-K82 PolarHBondContact O-N 2.61Å; F78-K82 VanDerWaalsContact O-N 3.14Å
79	A	60	Low	59.7	Low	50 Å²	50	120 Å²	120	41%	0.413	60%	0.597	S	S	.	*	H	α-helix	trans	-64.6	-44.7	176.3	0	0	0	0	0	111.7	K82 F83	A79-K82 PolarHBondContact O-N 3.09Å; A79-F83 WeakPolarHBondContact O-CB 3.41Å; A79-F83 PolarHBondContact O-N 3.31Å
80	F	61.4	Low	60.5	Low	126 Å²	126	125.6 Å²	125.6	55%	0.553	61%	0.605	S	S	*	*	H	α-helix	trans	-67.6	-44.4	-179.3	-174	-113.7	0	0	0	112.4	T76 D77 K82 F83 L84	T76-F80 WeakPolarHBondContact O-CB 3.26Å; T76-F80 PolarHBondContact O-N 3.39Å; D77-F80 PolarHBondContact O-N 3.46Å; F80-K82 VanDerWaalsContact C-N 3.33Å; F80-K82 PolarHBondContact O-N 3.5Å; F80-F83 PolarHBondContact O-N 3.09Å; F80-L84 HydrophobicContact CD1-CD1 3.68Å; F80-L84 HydrophobicContact CD1-CG 4.42Å; F80-L84 HydrophobicContact CE1-CD1 3.43Å; F80-L84 VanDerWaalsContact CE1-CD1 3.43Å; F80-L84 HydrophobicContact CE1-CG 4.25Å; F80-L84 HydrophobicContact CE2-CG 4.49Å; F80-L84 HydrophobicContact CG-CD1 4.33Å; F80-L84 HydrophobicContact CZ-CD1 3.88Å; F80-L84 HydrophobicContact CZ-CD2 4.48Å; F80-L84 HydrophobicContact CZ-CG 4.28Å; F80-L84 WeakPolarHBondContact O-CB 3.47Å; F80-L84 WeakPolarHBondContact O-CG 3.4Å; F80-L84 PolarHBondContact O-N 3.04Å
81	Q	63.8	Low	61.5	Low	121 Å²	121	123.9 Å²	123.9	57%	0.565	61%	0.613	S	S	*	*	H	α-helix	trans	-63	-38.5	175.2	-74.1	-175.2	20.6	0	0	112.5	D77 K85	D77-Q81 WeakPolarHBondContact O-CB 3.34Å; D77-Q81 VanDerWaalsContact O-CG 3.31Å; D77-Q81 WeakPolarHBondContact O-CG 3.44Å; D77-Q81 PolarHBondContact O-N 2.64Å; Q81-K85 PolarHBondContact O-N 3.11Å; Q81-K85 VanDerWaalsContact O-N 3.1Å
82	K	61.4	Low	62.6	Low	137 Å²	137	124.6 Å²	124.6	60%	0.596	62%	0.617	S	S	*	*	H	α-helix	trans	-70.7	-36	177.9	-164.2	173.7	-176.1	-179.8	0	111.7	F78 A79 F80 V86	F78-K82 HydrophobicContact CE1-CD 4.39Å; F78-K82 VanDerWaalsContact O-CB 3.3Å; F78-K82 WeakPolarHBondContact O-CB 3.29Å; F78-K82 PolarHBondContact O-N 2.61Å; F78-K82 VanDerWaalsContact O-N 3.14Å; A79-K82 PolarHBondContact O-N 3.09Å; F80-K82 VanDerWaalsContact C-N 3.33Å; F80-K82 PolarHBondContact O-N 3.5Å; K82-V86 WeakPolarHBondContact O-CG2 3.42Å; K82-V86 PolarHBondContact O-N 2.88Å
83	F	63.3	Low	63.7	Low	134 Å²	134	124.3 Å²	124.3	59%	0.588	61%	0.613	S	S	*	*	H	α-helix	trans	-68.3	-45.1	172.6	-173.5	-97.1	0	0	0	112.2	A79 F80 K85 V86 T87	A79-F83 WeakPolarHBondContact O-CB 3.41Å; A79-F83 PolarHBondContact O-N 3.31Å; F80-F83 PolarHBondContact O-N 3.09Å; F83-K85 PolarHBondContact O-N 3.11Å; F83-V86 CarbonylContact O-C 3.58Å; F83-V86 PolarHBondContact O-N 3.15Å; F83-V86 VanDerWaalsContact O-N 3.07Å; F83-T87 HydrophobicContact CD1-CG2 4.1Å; F83-T87 HydrophobicContact CE1-CG2 3.74Å; F83-T87 HydrophobicContact CE2-CG2 4.22Å; F83-T87 HydrophobicContact CZ-CG2 3.8Å; F83-T87 WeakPolarHBondContact O-CB 3.37Å; F83-T87 WeakPolarHBondContact O-CG2 3.32Å; F83-T87 PolarHBondContact O-N 2.7Å; F83-T87 PolarHBondContact O-OG1 2.73Å
84	L	59	Low	65	Low	84 Å²	84	124.1 Å²	124.1	44%	0.44	61%	0.614	S	S	.	*	H	α-helix	trans	-55.6	-48.1	175.3	-81.6	171.8	0	0	0	112.4	F80 V86 T87 E88	F80-L84 HydrophobicContact CD1-CD1 3.68Å; F80-L84 HydrophobicContact CD1-CG 4.42Å; F80-L84 HydrophobicContact CE1-CD1 3.43Å; F80-L84 VanDerWaalsContact CE1-CD1 3.43Å; F80-L84 HydrophobicContact CE1-CG 4.25Å; F80-L84 HydrophobicContact CE2-CG 4.49Å; F80-L84 HydrophobicContact CG-CD1 4.33Å; F80-L84 HydrophobicContact CZ-CD1 3.88Å; F80-L84 HydrophobicContact CZ-CD2 4.48Å; F80-L84 HydrophobicContact CZ-CG 4.28Å; F80-L84 WeakPolarHBondContact O-CB 3.47Å; F80-L84 WeakPolarHBondContact O-CG 3.4Å; F80-L84 PolarHBondContact O-N 3.04Å; L84-V86 PolarHBondContact O-N 2.85Å; L84-T87 WeakPolarHBondContact CA-OG1 3.48Å; L84-T87 CarbonylContact O-C 3.53Å; L84-T87 PolarHBondContact O-N 3.06Å; L84-T87 PolarHBondContact O-OG1 2.92Å; L84-E88 PolarHBondContact O-N 2.88Å
85	K	62	Low	66.2	Low	168 Å²	168	121 Å²	121	73%	0.73	61%	0.609	S	S	*	*	H	α-helix	trans	-61.8	-23	176.4	-77	-177.5	175.7	178.3	0	114.5	Q81 F83	Q81-K85 PolarHBondContact O-N 3.11Å; Q81-K85 VanDerWaalsContact O-N 3.1Å; F83-K85 PolarHBondContact O-N 3.11Å
86	V	62.3	Low	67.1	Low	122 Å²	122	123.3 Å²	123.3	74%	0.739	62%	0.621	S	S	*	*	H	α-helix	trans	-90.6	-14.3	175	174.4	0	0	0	0	111.5	K82 F83 L84	K82-V86 WeakPolarHBondContact O-CG2 3.42Å; K82-V86 PolarHBondContact O-N 2.88Å; F83-V86 CarbonylContact O-C 3.58Å; F83-V86 PolarHBondContact O-N 3.15Å; F83-V86 VanDerWaalsContact O-N 3.07Å; L84-V86 PolarHBondContact O-N 2.85Å
87	T	60	Low	68.3	Low	54 Å²	54	125.1 Å²	125.1	33%	0.331	63%	0.626	S	S	.	*			trans	-114	15.6	-173.8	50.5	0	0	0	0	114.7	F83 L84 R89	F83-T87 HydrophobicContact CD1-CG2 4.1Å; F83-T87 HydrophobicContact CE1-CG2 3.74Å; F83-T87 HydrophobicContact CE2-CG2 4.22Å; F83-T87 HydrophobicContact CZ-CG2 3.8Å; F83-T87 WeakPolarHBondContact O-CB 3.37Å; F83-T87 WeakPolarHBondContact O-CG2 3.32Å; F83-T87 PolarHBondContact O-N 2.7Å; F83-T87 PolarHBondContact O-OG1 2.73Å; L84-T87 WeakPolarHBondContact CA-OG1 3.48Å; L84-T87 CarbonylContact O-C 3.53Å; L84-T87 PolarHBondContact O-N 3.06Å; L84-T87 PolarHBondContact O-OG1 2.92Å; T87-R89 PolarHBondContact O-N 3.3Å
88	E	55.8	Low	68.8	Low	172 Å²	172	125.6 Å²	125.6	80%	0.804	64%	0.639	S	S	*	*			trans	-61.1	85.7	162.5	-76.8	-171.7	172.8	0	0	110.2	L84 K90	L84-E88 PolarHBondContact O-N 2.88Å; E88-K90 PolarHBondContact O-N 3.47Å
89	R	63.6	Low	69.4	Low	222 Å²	222	125.1 Å²	125.1	84%	0.838	65%	0.65	S	S	*	*			trans	-68.8	130.1	174.2	-67	179.8	179.9	-175.3	-0.7	108.5	T87 V91	T87-R89 PolarHBondContact O-N 3.3Å; R89-V91 PolarHBondContact O-N 3.21Å; R89-V91 VanDerWaalsContact O-N 3.09Å
90	K	72.3	Confident	69.8	Low	205 Å²	205	127 Å²	127	89%	0.891	67%	0.666	S	S	*	*			trans	-58	117	165.9	-68.7	-174.5	178.3	-177.3	0	108.3	E88 N92	E88-K90 PolarHBondContact O-N 3.47Å; K90-N92 PolarHBondContact O-N 3.35Å
91	V	73.6	Confident	70.4	Confident	132 Å²	132	126.7 Å²	126.7	80%	0.8	68%	0.677	S	S	*	*			trans	-69.9	111.5	177.2	-177.6	0	0	0	0	108	R89 V93	R89-V91 PolarHBondContact O-N 3.21Å; R89-V91 VanDerWaalsContact O-N 3.09Å; V91-V93 HydrophobicContact CG1-CG2 3.9Å
92	N	79.4	Confident	70.9	Confident	90 Å²	90	125.2 Å²	125.2	48%	0.481	68%	0.68	S	S	.	*			trans	-110.8	94.8	170.9	-177.8	-13.5	0	0	0	107.8	K90 D94 S95	K90-N92 PolarHBondContact O-N 3.35Å; N92-D94 VanDerWaalsContact C-N 3.26Å; N92-D94 PolarHBondContact O-N 3.16Å; N92-D94 WeakPolarHBondContact OD1-CB 3.29Å; N92-D94 PolarHBondContact OD1-N 3.18Å; N92-D94 VanDerWaalsContact OD1-N 3.16Å; N92-S95 PolarHBondContact O-N 3.34Å; N92-S95 PolarHBondContact O-OG 3.11Å; N92-S95 PolarHBondContact OD1-N 3Å
93	V	80.8	Confident	71.5	Confident	90 Å²	90	121 Å²	121	55%	0.545	67%	0.666	S	S	.	*	G	3₁₀ helix	trans	-66.2	-34.2	-179.2	-175.7	0	0	0	0	110.6	V91 S95 L96	V91-V93 HydrophobicContact CG1-CG2 3.9Å; V93-S95 PolarHBondContact O-N 3.3Å; V93-S95 VanDerWaalsContact O-N 3.14Å; V93-L96 WeakPolarHBondContact O-CB 3.27Å; V93-L96 PolarHBondContact O-N 3.44Å
94	D	80.8	Confident	72.3	Confident	116 Å²	116	121.7 Å²	121.7	62%	0.62	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-61.7	-25.5	-178.8	-45.6	-34.5	0	0	0	112	N92 L96 L97	N92-D94 VanDerWaalsContact C-N 3.26Å; N92-D94 PolarHBondContact O-N 3.16Å; N92-D94 WeakPolarHBondContact OD1-CB 3.29Å; N92-D94 PolarHBondContact OD1-N 3.18Å; N92-D94 VanDerWaalsContact OD1-N 3.16Å; D94-L96 PolarHBondContact O-N 3.08Å; D94-L96 VanDerWaalsContact O-N 3.15Å; D94-L97 WeakPolarHBondContact O-CB 3.25Å; D94-L97 PolarHBondContact O-N 2.96Å
95	S	80.8	Confident	73.3	Confident	92 Å²	92	122.2 Å²	122.2	64%	0.643	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-64.2	-13.2	173	72.7	0	0	0	0	114.8	N92 V93	N92-S95 PolarHBondContact O-N 3.34Å; N92-S95 PolarHBondContact O-OG 3.11Å; N92-S95 PolarHBondContact OD1-N 3Å; V93-S95 PolarHBondContact O-N 3.3Å; V93-S95 VanDerWaalsContact O-N 3.14Å
96	L	81.5	Confident	74.4	Confident	143 Å²	143	115.9 Å²	115.9	75%	0.749	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-90.1	-14.9	172	-59.9	173.8	0	0	0	112.8	V93 D94 S98	V93-L96 WeakPolarHBondContact O-CB 3.27Å; V93-L96 PolarHBondContact O-N 3.44Å; D94-L96 PolarHBondContact O-N 3.08Å; D94-L96 VanDerWaalsContact O-N 3.15Å; L96-S98 PolarHBondContact O-N 3.34Å
97	L	83.2	Confident	75.5	Confident	126 Å²	126	111.2 Å²	111.2	66%	0.66	63%	0.629	S	S	*	*			trans	-86	101.8	-179.6	-60.5	177.8	0	0	0	109.8	D94	D94-L97 WeakPolarHBondContact O-CB 3.25Å; D94-L97 PolarHBondContact O-N 2.96Å
98	S	77.9	Confident	76.9	Confident	118 Å²	118	114.6 Å²	114.6	83%	0.825	64%	0.644	S	S	*	*			trans	-94.8	105	172.4	48.6	0	0	0	0	110.6	L96 A100	L96-S98 PolarHBondContact O-N 3.34Å; S98-A100 PolarHBondContact O-N 2.64Å
99	C	73.5	Confident	78.4	Confident	125 Å²	125	109.3 Å²	109.3	85%	0.845	63%	0.626	S	S	*	*			trans	-74.3	115.5	163.3	-64.3	0	0	0	0	108.4
100	A	68.8	Low	79.7	Confident	90 Å²	90	101.1 Å²	101.1	74%	0.744	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-67	141.4	170.5	0	0	0	0	0	109.6	S98	S98-A100 PolarHBondContact O-N 2.64Å
101	P	74.4	Confident	80.5	Confident	120 Å²	120	94.3 Å²	94.3	78%	0.779	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-62.6	145.9	171.3	28.1	-34.3	0	0	0	109.9
102	S	75.2	Confident	81.4	Confident	89 Å²	89	95.5 Å²	95.5	62%	0.622	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-58.2	137	175.6	-157.3	0	0	0	0	109.9	H105	S102-H105 PolarHBondContact OG-NE2 3.5Å
103	P	74	Confident	81.8	Confident	49 Å²	49	92.8 Å²	92.8	32%	0.318	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-60.1	148.1	169.9	28.4	-35.7	0	0	0	110	H105	P103-H105 PolarHBondContact O-CD2 2.76Å; P103-H105 PolarHBondContact O-N 2.92Å; P103-H105 PolarHBondContact O-NE2 3.5Å
104	L	78.9	Confident	82.2	Confident	148 Å²	148	94.8 Å²	94.8	78%	0.775	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-65.2	124.3	173.9	-67.4	171	0	0	0	109.3	S106 T130	L104-S106 VanDerWaalsContact C-N 3.31Å; L104-T130 WeakPolarHBondContact O-CG2 3.24Å
105	H	81.1	Confident	82.5	Confident	95 Å²	95	95.1 Å²	95.1	44%	0.44	57%	0.573	S	S	.	*	S	Bend	trans	-85.5	-2.3	-178.1	-59.1	-69.5	0	0	0	114.1	S102 P103 L126 L127 T130	S102-H105 PolarHBondContact OG-NE2 3.5Å; P103-H105 PolarHBondContact O-CD2 2.76Å; P103-H105 PolarHBondContact O-N 2.92Å; P103-H105 PolarHBondContact O-NE2 3.5Å; H105-L126 WeakPolarHBondContact O-CA 3.38Å; H105-L127 PolarHBondContact O-N 3.29Å; H105-T130 HydrophobicContact CB-CG2 4.41Å; H105-T130 PolarHBondContact CE1-OG1 3.26Å; H105-T130 PolarHBondContact ND1-OG1 2.96Å
106	S	85.1	Confident	82.8	Confident	36 Å²	36	94.5 Å²	94.5	25%	0.252	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-123.7	154.2	176.9	59.5	0	0	0	0	111.9	L104 E124 V125	L104-S106 VanDerWaalsContact C-N 3.31Å; S106-E124 WeakPolarHBondContact CB-OE1 3.29Å; S106-E124 PolarHBondContact OG-OE1 2.9Å; S106-V125 WeakPolarHBondContact CA-O 3.27Å
107	G	84.1	Confident	83.1	Confident	23 Å²	23	89.7 Å²	89.7	24%	0.237	55%	0.55	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	162.3	173.5	0	0	0	0	0	111.3	E124 V125	G107-E124 WeakPolarHBondContact O-CA 3.47Å; G107-V125 PolarHBondContact N-O 2.71Å; G107-V125 PolarHBondContact O-N 2.89Å
108	L	89.6	Confident	83.4	Confident	126 Å²	126	89.5 Å²	89.5	66%	0.66	55%	0.547	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	115.7	178.1	-63.6	174.2	0	0	0	110.6	E124	L108-E124 HydrophobicContact CD2-CB 4.36Å
109	S	88.8	Confident	84	Confident	60 Å²	60	88.8 Å²	88.8	42%	0.42	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	146.7	166.3	-169.8	0	0	0	0	109.9	F122 T123	S109-F122 CarbonylContact O-C 3.59Å; S109-F122 WeakPolarHBondContact O-CA 3.16Å; S109-T123 PolarHBondContact N-O 2.83Å; S109-T123 PolarHBondContact O-N 2.98Å
110	V	90.9	Very high	84.8	Confident	51 Å²	51	88.2 Å²	88.2	31%	0.309	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	117.3	-177.7	-161.7	0	0	0	0	110.3	R112 L119 F122	V110-R112 PolarHBondContact O-N 3.23Å; V110-L119 HydrophobicContact CG1-CB 4.14Å; V110-L119 HydrophobicContact CG1-CD2 3.87Å; V110-L119 HydrophobicContact CG1-CG 4.39Å; V110-F122 HydrophobicContact CB-CD1 4.37Å; V110-F122 HydrophobicContact CB-CE1 4.36Å; V110-F122 HydrophobicContact CG1-CD1 4.12Å; V110-F122 HydrophobicContact CG1-CE1 3.89Å; V110-F122 HydrophobicContact CG1-CZ 4.33Å; V110-F122 HydrophobicContact CG2-CD1 3.79Å; V110-F122 HydrophobicContact CG2-CE1 3.65Å
111	V	88.8	Confident	85.8	Confident	61 Å²	61	88.9 Å²	88.9	37%	0.37	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	124.3	173.7	-176	0	0	0	0	108.3	L120 D121 T123	V111-L120 PolarHBondContact O-N 2.79Å; V111-D121 HydrophobicContact CB-CB 4.44Å; V111-D121 PolarHBondContact N-O 2.96Å; V111-D121 PolarHBondContact O-N 3.38Å; V111-T123 HydrophobicContact CG2-CG2 3.81Å
112	R	92.1	Very high	86.7	Confident	157 Å²	157	88.8 Å²	88.8	59%	0.592	50%	0.5	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.9	147.4	177.7	-61.7	-172.1	-177.9	-176.1	0.3	110.8	V110 M118 L119	V110-R112 PolarHBondContact O-N 3.23Å; R112-M118 VanDerWaalsContact CA-O 3.3Å; R112-M118 WeakPolarHBondContact CA-O 3.39Å; R112-L119 HydrophobicContact CG-CD2 3.89Å
113	D	86.9	Confident	87.5	Confident	34 Å²	34	87.4 Å²	87.4	18%	0.182	49%	0.488	C	S	.	.			trans	-62.7	121.6	166.9	174.5	-9.8	0	0	0	109.2	T115 T116 G117 M118 L120	D113-T115 PolarHBondContact O-N 2.78Å; D113-T115 VanDerWaalsContact O-N 3.15Å; D113-T115 WeakPolarHBondContact OD1-CA 3.31Å; D113-T115 WeakPolarHBondContact OD1-CB 3.49Å; D113-T115 PolarHBondContact OD1-N 2.9Å; D113-T115 PolarHBondContact OD1-OG1 2.75Å; D113-T115 PolarHBondContact OD2-OG1 3.01Å; D113-T116 WeakPolarHBondContact CB-OG1 3.4Å; D113-T116 PolarHBondContact OD1-N 3.48Å; D113-T116 WeakPolarHBondContact OD2-CB 3.29Å; D113-T116 VanDerWaalsContact OD2-CG2 3.26Å; D113-T116 WeakPolarHBondContact OD2-CG2 3.18Å; D113-T116 PolarHBondContact OD2-OG1 3.19Å; D113-G117 VanDerWaalsContact O-CA 3.3Å; D113-G117 WeakPolarHBondContact O-CA 3.44Å; D113-G117 PolarHBondContact O-N 3.29Å; D113-M118 PolarHBondContact N-O 2.77Å; D113-L120 HydrophobicContact CB-CD1 4Å; D113-L120 HydrophobicContact CB-CD2 4.32Å; D113-L120 HydrophobicContact CB-CG 4.18Å
114	P	88.9	Confident	88.1	Confident	132 Å²	132	91.7 Å²	91.7	86%	0.857	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-15.4	-178.1	27.7	-35.8	0	0	0	113.8
115	T	87.3	Confident	88.5	Confident	122 Å²	122	87.9 Å²	87.9	75%	0.748	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	-38.4	-178.1	66.2	0	0	0	0	113.6	D113	D113-T115 PolarHBondContact O-N 2.78Å; D113-T115 VanDerWaalsContact O-N 3.15Å; D113-T115 WeakPolarHBondContact OD1-CA 3.31Å; D113-T115 WeakPolarHBondContact OD1-CB 3.49Å; D113-T115 PolarHBondContact OD1-N 2.9Å; D113-T115 PolarHBondContact OD1-OG1 2.75Å; D113-T115 PolarHBondContact OD2-OG1 3.01Å
116	T	87.9	Confident	88.5	Confident	80 Å²	80	88.5 Å²	88.5	49%	0.491	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-17.1	-178.4	67.7	0	0	0	0	114	D113 M118	D113-T116 WeakPolarHBondContact CB-OG1 3.4Å; D113-T116 PolarHBondContact OD1-N 3.48Å; D113-T116 WeakPolarHBondContact OD2-CB 3.29Å; D113-T116 VanDerWaalsContact OD2-CG2 3.26Å; D113-T116 WeakPolarHBondContact OD2-CG2 3.18Å; D113-T116 PolarHBondContact OD2-OG1 3.19Å; T116-M118 HydrophobicContact CG2-CE 4.03Å; T116-M118 PolarHBondContact O-N 2.66Å; T116-M118 WeakPolarHBondContact OG1-CE 3.35Å; T116-M118 PolarHBondContact OG1-N 2.86Å
117	G	87.6	Confident	88.1	Confident	41 Å²	41	91.2 Å²	91.2	42%	0.423	50%	0.504	S	S	.	.			trans	70.6	3.5	-174.6	0	0	0	0	0	114.7	D113	D113-G117 VanDerWaalsContact O-CA 3.3Å; D113-G117 WeakPolarHBondContact O-CA 3.44Å; D113-G117 PolarHBondContact O-N 3.29Å
118	M	89.9	Confident	87.2	Confident	122 Å²	122	96.7 Å²	96.7	60%	0.601	52%	0.523	S	S	*	.			trans	-65.6	144	176.8	-68.6	-168.7	-74	0	0	110.9	R112 D113 T116 L120	R112-M118 VanDerWaalsContact CA-O 3.3Å; R112-M118 WeakPolarHBondContact CA-O 3.39Å; D113-M118 PolarHBondContact N-O 2.77Å; T116-M118 HydrophobicContact CG2-CE 4.03Å; T116-M118 PolarHBondContact O-N 2.66Å; T116-M118 WeakPolarHBondContact OG1-CE 3.35Å; T116-M118 PolarHBondContact OG1-N 2.86Å; M118-L120 PolarHBondContact O-N 2.96Å
119	L	90.9	Very high	86.1	Confident	104 Å²	104	94.7 Å²	94.7	55%	0.545	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	123.2	175.7	-46.2	-179.6	0	0	0	108.1	V110 R112	V110-L119 HydrophobicContact CG1-CB 4.14Å; V110-L119 HydrophobicContact CG1-CD2 3.87Å; V110-L119 HydrophobicContact CG1-CG 4.39Å; R112-L119 HydrophobicContact CG-CD2 3.89Å
120	L	89.9	Confident	85.1	Confident	113 Å²	113	93.8 Å²	93.8	59%	0.592	51%	0.505	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.9	-51.4	-179.3	-65.2	177.3	0	0	0	111.4	V111 D113 M118	V111-L120 PolarHBondContact O-N 2.79Å; D113-L120 HydrophobicContact CB-CD1 4Å; D113-L120 HydrophobicContact CB-CD2 4.32Å; D113-L120 HydrophobicContact CB-CG 4.18Å; M118-L120 PolarHBondContact O-N 2.96Å
121	D	90.6	Very high	84.2	Confident	103 Å²	103	93 Å²	93	55%	0.551	51%	0.507	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-157.3	171.4	-173.2	-154.3	-3.3	0	0	0	111.8	V111	V111-D121 HydrophobicContact CB-CB 4.44Å; V111-D121 PolarHBondContact N-O 2.96Å; V111-D121 PolarHBondContact O-N 3.38Å
122	F	91.6	Very high	83.9	Confident	119 Å²	119	91.8 Å²	91.8	52%	0.522	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	124.3	175.7	-62	-93.2	0	0	0	110.4	S109 V110	S109-F122 CarbonylContact O-C 3.59Å; S109-F122 WeakPolarHBondContact O-CA 3.16Å; V110-F122 HydrophobicContact CB-CD1 4.37Å; V110-F122 HydrophobicContact CB-CE1 4.36Å; V110-F122 HydrophobicContact CG1-CD1 4.12Å; V110-F122 HydrophobicContact CG1-CE1 3.89Å; V110-F122 HydrophobicContact CG1-CZ 4.33Å; V110-F122 HydrophobicContact CG2-CD1 3.79Å; V110-F122 HydrophobicContact CG2-CE1 3.65Å
123	T	92	Very high	83.5	Confident	60 Å²	60	86.1 Å²	86.1	37%	0.368	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	132.6	174.8	51.6	0	0	0	0	110.2	S109 V111	S109-T123 PolarHBondContact N-O 2.83Å; S109-T123 PolarHBondContact O-N 2.98Å; V111-T123 HydrophobicContact CG2-CG2 3.81Å
124	E	87.8	Confident	83.2	Confident	138 Å²	138	84.8 Å²	84.8	65%	0.645	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.1	127.9	171.8	-170.2	168.2	-167.7	0	0	109.5	S106 G107 L108	S106-E124 WeakPolarHBondContact CB-OE1 3.29Å; S106-E124 PolarHBondContact OG-OE1 2.9Å; G107-E124 WeakPolarHBondContact O-CA 3.47Å; L108-E124 HydrophobicContact CD2-CB 4.36Å
125	V	86.4	Confident	82.9	Confident	69 Å²	69	84.7 Å²	84.7	42%	0.418	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	134.9	-177.2	-179.9	0	0	0	0	108.3	S106 G107	S106-V125 WeakPolarHBondContact CA-O 3.27Å; G107-V125 PolarHBondContact N-O 2.71Å; G107-V125 PolarHBondContact O-N 2.89Å
126	L	81.4	Confident	82.6	Confident	108 Å²	108	83.4 Å²	83.4	57%	0.565	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.8	137.1	175.9	-66	173	0	0	0	110.4	H105	H105-L126 WeakPolarHBondContact O-CA 3.38Å
127	L	75.8	Confident	82.4	Confident	92 Å²	92	80.2 Å²	80.2	48%	0.482	43%	0.433	S	S	.	.			trans	-103.4	119.5	177.3	-63.9	175.3	0	0	0	108.6	H105 N129 T130	H105-L127 PolarHBondContact O-N 3.29Å; L127-N129 VanDerWaalsContact C-N 3.35Å; L127-T130 HydrophobicContact CB-CG2 3.83Å; L127-T130 WeakPolarHBondContact O-CG2 3.4Å
128	E	65.6	Low	82.2	Confident	138 Å²	138	79.3 Å²	79.3	65%	0.645	42%	0.418	S	S	*	.	S	Bend	trans	-70	-36.7	176.5	-58.5	179.1	155.6	0	0	111.1	T130	E128-T130 VanDerWaalsContact C-N 3.31Å; E128-T130 PolarHBondContact O-N 3.15Å
129	N	67.9	Low	82	Confident	85 Å²	85	74.2 Å²	74.2	46%	0.455	39%	0.394	S	S	.	.	S	Bend	trans	-86.6	50.6	-170.9	-78.9	-27.5	0	0	0	114.1	L127 L132 Q141	L127-N129 VanDerWaalsContact C-N 3.35Å; N129-L132 HydrophobicContact CB-CD1 3.62Å; N129-L132 HydrophobicContact CB-CG 4.29Å; N129-Q141 PolarHBondContact ND2-OE1 3.46Å
130	T	66.8	Low	81.7	Confident	40 Å²	40	72.2 Å²	72.2	25%	0.245	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	138.7	-173	59.2	0	0	0	0	112.7	L104 H105 L127 E128 L132	L104-T130 WeakPolarHBondContact O-CG2 3.24Å; H105-T130 HydrophobicContact CB-CG2 4.41Å; H105-T130 PolarHBondContact CE1-OG1 3.26Å; H105-T130 PolarHBondContact ND1-OG1 2.96Å; L127-T130 HydrophobicContact CB-CG2 3.83Å; L127-T130 WeakPolarHBondContact O-CG2 3.4Å; E128-T130 VanDerWaalsContact C-N 3.31Å; E128-T130 PolarHBondContact O-N 3.15Å; T130-L132 VanDerWaalsContact C-N 3.33Å; T130-L132 PolarHBondContact O-N 2.74Å
131	G	72.7	Confident	81.4	Confident	34 Å²	34	73.4 Å²	73.4	35%	0.351	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.6	9.7	-178	0	0	0	0	0	115.7	S133 N136	G131-S133 PolarHBondContact O-N 2.77Å; G131-N136 PolarHBondContact O-ND2 2.87Å; G131-N136 VanDerWaalsContact O-ND2 3.15Å
132	L	81.4	Confident	81.2	Confident	36 Å²	36	68.5 Å²	68.5	19%	0.188	36%	0.36	C	S	.	.			trans	-70.6	126.1	173.8	-57.6	-172.5	0	0	0	111.4	N129 T130 R142 Q143	N129-L132 HydrophobicContact CB-CD1 3.62Å; N129-L132 HydrophobicContact CB-CG 4.29Å; T130-L132 VanDerWaalsContact C-N 3.33Å; T130-L132 PolarHBondContact O-N 2.74Å; L132-R142 HydrophobicContact CB-CB 3.98Å; L132-Q143 PolarHBondContact O-N 2.96Å
133	S	83.5	Confident	80.8	Confident	39 Å²	39	69.3 Å²	69.3	27%	0.273	37%	0.366	S	S	.	.	B	Isolated β-bridge	trans	-130.5	169.3	-179.3	77	0	0	0	0	110.8	G131 K135 N136 S137	G131-S133 PolarHBondContact O-N 2.77Å; S133-K135 PolarHBondContact O-N 2.87Å; S133-K135 PolarHBondContact OG-N 2.91Å; S133-N136 WeakPolarHBondContact CA-OD1 3.28Å; S133-N136 WeakPolarHBondContact CB-OD1 3.26Å; S133-N136 PolarHBondContact N-OD1 2.78Å; S133-N136 PolarHBondContact O-N 3.42Å; S133-N136 PolarHBondContact O-OD1 2.94Å; S133-N136 PolarHBondContact OG-OD1 2.86Å; S133-S137 PolarHBondContact O-N 3.08Å
134	A	81.6	Confident	80.4	Confident	6 Å²	6	70.4 Å²	70.4	5%	0.05	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-14.7	173.8	0	0	0	0	0	115	N157 Y158	A134-N157 HydrophobicContact CB-CB 4.16Å; A134-N157 CarbonylContact O-C 3.58Å; A134-N157 WeakPolarHBondContact O-CA 3.44Å; A134-Y158 PolarHBondContact O-N 3.42Å
135	K	82.3	Confident	80	Confident	130 Å²	130	64.8 Å²	64.8	57%	0.565	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-12.6	-175.3	-66.3	179.6	179.9	173.7	0	115.3	S133 Y158	S133-K135 PolarHBondContact O-N 2.87Å; S133-K135 PolarHBondContact OG-N 2.91Å; K135-Y158 WeakPolarHBondContact O-CD1 3.41Å; K135-Y158 VanDerWaalsContact O-CE1 3.31Å; K135-Y158 WeakPolarHBondContact O-CE1 3.35Å
136	N	80.9	Confident	79.8	Confident	94 Å²	94	64.7 Å²	64.7	50%	0.503	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.7	-7.2	-176	63.5	-17	0	0	0	114.2	G131 S133	G131-N136 PolarHBondContact O-ND2 2.87Å; G131-N136 VanDerWaalsContact O-ND2 3.15Å; S133-N136 WeakPolarHBondContact CA-OD1 3.28Å; S133-N136 WeakPolarHBondContact CB-OD1 3.26Å; S133-N136 PolarHBondContact N-OD1 2.78Å; S133-N136 PolarHBondContact O-N 3.42Å; S133-N136 PolarHBondContact O-OD1 2.94Å; S133-N136 PolarHBondContact OG-OD1 2.86Å
137	S	83.4	Confident	79.7	Confident	14 Å²	14	65.4 Å²	65.4	10%	0.098	36%	0.364	C	S	.	.			trans	-132.4	143.2	-175.9	-170.5	0	0	0	0	113.7	S133 S139 R142	S133-S137 PolarHBondContact O-N 3.08Å; S137-S139 WeakPolarHBondContact OG-CB 3.38Å; S137-S139 PolarHBondContact OG-N 3.01Å; S137-S139 VanDerWaalsContact OG-N 3.13Å; S137-R142 WeakPolarHBondContact O-CD 3.23Å; S137-R142 PolarHBondContact O-NH1 3.41Å
138	L	84.8	Confident	79.8	Confident	21 Å²	21	66.3 Å²	66.3	11%	0.11	38%	0.379	C	S	.	.			trans	-87.6	-11.2	168.8	-58.3	-175.7	0	0	0	113.4	Y158 P159 F160 L161 V763 A765 L766	L138-Y158 HydrophobicContact CD2-CD2 4.05Å; L138-Y158 HydrophobicContact CD2-CG 4.5Å; L138-P159 HydrophobicContact CD2-CG 4.04Å; L138-P159 WeakPolarHBondContact CD2-O 3.26Å; L138-F160 WeakPolarHBondContact O-CA 3.31Å; L138-L161 HydrophobicContact CB-CB 4.14Å; L138-L161 HydrophobicContact CD1-CD1 3.78Å; L138-L161 PolarHBondContact O-N 3.45Å; L138-V763 HydrophobicContact CD2-CG1 3.96Å; L138-A765 HydrophobicContact CD1-CB 3.66Å; L138-L766 HydrophobicContact CD1-CG 4.47Å
139	S	84.7	Confident	80.2	Confident	16 Å²	16	63 Å²	63	11%	0.112	36%	0.363	C	S	.	.			trans	-70.7	143.1	-171.6	-176.8	0	0	0	0	112.4	S137 Q141 R142	S137-S139 WeakPolarHBondContact OG-CB 3.38Å; S137-S139 PolarHBondContact OG-N 3.01Å; S137-S139 VanDerWaalsContact OG-N 3.13Å; S139-Q141 PolarHBondContact O-N 2.97Å; S139-Q141 PolarHBondContact OG-N 3.32Å; S139-R142 WeakPolarHBondContact O-CB 3.47Å; S139-R142 WeakPolarHBondContact O-CD 3.27Å; S139-R142 VanDerWaalsContact O-CG 3.25Å; S139-R142 WeakPolarHBondContact O-CG 3.46Å; S139-R142 PolarHBondContact O-N 3.39Å
140	L	84.4	Confident	80.7	Confident	62 Å²	62	60.4 Å²	60.4	33%	0.325	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-18.3	171.8	-67.1	165	0	0	0	112.9	R142 F160 H453	L140-R142 VanDerWaalsContact C-N 3.33Å; L140-F160 HydrophobicContact CD2-CB 4.32Å; L140-F160 HydrophobicContact CD2-CD1 3.68Å; L140-F160 HydrophobicContact CD2-CE1 4.08Å; L140-F160 HydrophobicContact CD2-CG 3.96Å; L140-F160 HydrophobicContact CG-CD1 4.35Å; L140-H453 WeakPolarHBondContact CD1-ND1 3.31Å
141	Q	83.7	Confident	81.4	Confident	137 Å²	137	59.8 Å²	59.8	64%	0.64	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-9.2	179	-63	-176.9	-3.6	0	0	113.7	N129 S139	N129-Q141 PolarHBondContact ND2-OE1 3.46Å; S139-Q141 PolarHBondContact O-N 2.97Å; S139-Q141 PolarHBondContact OG-N 3.32Å
142	R	86.1	Confident	81.6	Confident	1 Å²	1	63.1 Å²	63.1	0%	0.004	35%	0.349	C	S	.	.	S	Bend	trans	-58.7	154.7	-179.3	77.1	-168.4	-169.3	-179	0.1	112.6	L132 S137 S139 L140 Y158 F160 G416 R421	L132-R142 HydrophobicContact CB-CB 3.98Å; S137-R142 WeakPolarHBondContact O-CD 3.23Å; S137-R142 PolarHBondContact O-NH1 3.41Å; S139-R142 WeakPolarHBondContact O-CB 3.47Å; S139-R142 WeakPolarHBondContact O-CD 3.27Å; S139-R142 VanDerWaalsContact O-CG 3.25Å; S139-R142 WeakPolarHBondContact O-CG 3.46Å; S139-R142 PolarHBondContact O-N 3.39Å; L140-R142 VanDerWaalsContact C-N 3.33Å; R142-Y158 PolarHBondContact NH1-O 3.02Å; R142-Y158 PolarHBondContact NH2-O 2.75Å; R142-F160 HydrophobicContact CG-CE1 4.32Å; R142-F160 VanDerWaalsContact NE-CE1 3.34Å; R142-G416 PolarHBondContact NH2-O 3.06Å; R142-R421 PolarHBondContact O-NH1 3.08Å
143	Q	84.6	Confident	81.6	Confident	136 Å²	136	62 Å²	62	64%	0.636	35%	0.347	S	S	*	.	B	Isolated β-bridge	trans	-65.1	134.4	172.8	-66.5	-173.3	-0.9	0	0	110.6	L132	L132-Q143 PolarHBondContact O-N 2.96Å
144	P	83.7	Confident	81.6	Confident	83 Å²	83	61.2 Å²	61.2	54%	0.539	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-68.5	148.1	-178.3	29	-35.1	0	0	0	111.7	E418	P144-E418 WeakPolarHBondContact CA-OE1 3.44Å; P144-E418 HydrophobicContact CB-CG 4.33Å
145	G	79.1	Confident	81.3	Confident	20 Å²	20	62.6 Å²	62.6	21%	0.206	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-65.1	173.8	174.3	0	0	0	0	0	114.4	E418	G145-E418 PolarHBondContact N-OE1 3Å
146	P	82.4	Confident	81.2	Confident	66 Å²	66	60.1 Å²	60.1	43%	0.429	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-61	142.3	178.2	26.5	-34.6	0	0	0	111.2	S148 E149	P146-S148 PolarHBondContact O-N 2.99Å; P146-E149 HydrophobicContact CG-CB 4.38Å; P146-E149 HydrophobicContact CG-CG 4.15Å; P146-E149 PolarHBondContact O-N 2.68Å
147	P	79.3	Confident	81.4	Confident	123 Å²	123	55.8 Å²	55.8	80%	0.799	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-54.8	-29.6	-174.1	-29.1	35.2	0	0	0	115	E149 S150	P147-E149 PolarHBondContact O-N 3.35Å; P147-S150 WeakPolarHBondContact O-CB 3.2Å; P147-S150 PolarHBondContact O-N 2.86Å
148	S	77.4	Confident	81.6	Confident	112 Å²	112	58.5 Å²	58.5	78%	0.783	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-61.9	-23.5	176.3	51.9	0	0	0	0	114.7	P146	P146-S148 PolarHBondContact O-N 2.99Å
149	E	74.5	Confident	81.8	Confident	68 Å²	68	57.7 Å²	57.7	32%	0.318	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-105.8	-8.2	-177.7	-60.7	-169.3	168.4	0	0	113.1	P146 P147 L151 G153 S154	P146-E149 HydrophobicContact CG-CB 4.38Å; P146-E149 HydrophobicContact CG-CG 4.15Å; P146-E149 PolarHBondContact O-N 2.68Å; P147-E149 PolarHBondContact O-N 3.35Å; E149-L151 PolarHBondContact O-N 3.06Å; E149-G153 WeakPolarHBondContact O-CA 3.34Å; E149-G153 PolarHBondContact O-N 3.25Å; E149-S154 WeakPolarHBondContact OE2-CB 3.39Å
150	S	77.3	Confident	82	Confident	30 Å²	30	57.3 Å²	57.3	21%	0.21	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.4	-49	-174.8	174.7	0	0	0	0	113.9	P147 S417 E418	P147-S150 WeakPolarHBondContact O-CB 3.2Å; P147-S150 PolarHBondContact O-N 2.86Å; S150-S417 PolarHBondContact O-OG 3.38Å; S150-E418 PolarHBondContact O-N 2.96Å
151	L	81.6	Confident	82.2	Confident	28 Å²	28	56 Å²	56	15%	0.147	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-44.6	-168.5	-174.4	68.9	0	0	0	115.3	E149 L389 P397 M412 S417 V419	E149-L151 PolarHBondContact O-N 3.06Å; L151-L389 HydrophobicContact CD1-CD1 3.78Å; L151-L389 HydrophobicContact CD1-CD2 4.36Å; L151-L389 HydrophobicContact CD2-CD2 4.07Å; L151-L389 HydrophobicContact CG-CD1 4.39Å; L151-P397 HydrophobicContact CD1-CB 3.63Å; L151-P397 HydrophobicContact CD2-CB 3.59Å; L151-P397 HydrophobicContact CD2-CG 4.4Å; L151-P397 HydrophobicContact CG-CB 4.24Å; L151-M412 WeakPolarHBondContact O-CE 3.44Å; L151-S417 PolarHBondContact O-OG 2.94Å; L151-S417 VanDerWaalsContact O-OG 3.08Å; L151-V419 HydrophobicContact CD1-CG2 4.22Å
152	R	77.7	Confident	82.4	Confident	103 Å²	103	49.5 Å²	49.5	39%	0.389	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	-7.6	-178.8	-79.4	-167.8	175.2	-167.2	-2.5	113.2	T390 N415	R152-T390 PolarHBondContact NH2-O 2.93Å; R152-N415 VanDerWaalsContact O-CB 3.22Å; R152-N415 WeakPolarHBondContact O-CB 3.44Å; R152-N415 PolarHBondContact O-ND2 3.25Å
153	G	82	Confident	82.2	Confident	14 Å²	14	49.6 Å²	49.6	14%	0.144	29%	0.285	C	S	.	.			trans	65	-170	-166	0	0	0	0	0	112.3	E149 N415	E149-G153 WeakPolarHBondContact O-CA 3.34Å; E149-G153 PolarHBondContact O-N 3.25Å; G153-N415 VanDerWaalsContact CA-O 3.28Å; G153-N415 WeakPolarHBondContact CA-O 3.3Å
154	S	81.8	Confident	81.8	Confident	21 Å²	21	43.4 Å²	43.4	15%	0.147	26%	0.257	C	S	.	.			trans	-138.1	140.1	178.7	174.9	0	0	0	0	108.7	E149 T156 N157 N415	E149-S154 WeakPolarHBondContact OE2-CB 3.39Å; S154-T156 PolarHBondContact O-N 3.21Å; S154-T156 PolarHBondContact OG-N 3.04Å; S154-T156 PolarHBondContact OG-OG1 3.07Å; S154-N157 WeakPolarHBondContact O-CB 3.36Å; S154-N157 PolarHBondContact O-N 3.04Å; S154-N415 PolarHBondContact N-O 3.14Å
155	N	76.1	Confident	81.5	Confident	35 Å²	35	41 Å²	41	19%	0.187	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	2	173.7	-57.8	65.4	0	0	0	113	N415 R762 Q1083	N155-N415 VanDerWaalsContact CG-OD1 3.23Å; N155-N415 PolarHBondContact ND2-OD1 2.96Å; N155-N415 PolarHBondContact OD1-OD1 3.18Å; N155-R762 PolarHBondContact O-NH1 3.21Å; N155-Q1083 PolarHBondContact ND2-NE2 2.92Å; N155-Q1083 PolarHBondContact OD1-NE2 3.26Å
156	T	80.4	Confident	80.9	Confident	78 Å²	78	47.1 Å²	47.1	48%	0.479	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-22.5	164.5	68.3	0	0	0	0	112.5	S154	S154-T156 PolarHBondContact O-N 3.21Å; S154-T156 PolarHBondContact OG-N 3.04Å; S154-T156 PolarHBondContact OG-OG1 3.07Å
157	N	85.7	Confident	79.9	Confident	4 Å²	4	49.5 Å²	49.5	2%	0.021	27%	0.268	C	S	.	.	S	Bend	trans	-79.4	143.9	177.5	-60	-10.5	0	0	0	110	A134 S154 R762	A134-N157 HydrophobicContact CB-CB 4.16Å; A134-N157 CarbonylContact O-C 3.58Å; A134-N157 WeakPolarHBondContact O-CA 3.44Å; S154-N157 WeakPolarHBondContact O-CB 3.36Å; S154-N157 PolarHBondContact O-N 3.04Å; N157-R762 VanDerWaalsContact O-CZ 3.29Å; N157-R762 PolarHBondContact O-NH1 3.1Å; N157-R762 PolarHBondContact O-NH2 3.46Å
158	Y	86.9	Confident	78.9	Confident	71 Å²	71	48.5 Å²	48.5	28%	0.278	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-76.6	147.4	171.3	-80.4	33.2	0	0	0	108.9	A134 K135 L138 R142 V763	A134-Y158 PolarHBondContact O-N 3.42Å; K135-Y158 WeakPolarHBondContact O-CD1 3.41Å; K135-Y158 VanDerWaalsContact O-CE1 3.31Å; K135-Y158 WeakPolarHBondContact O-CE1 3.35Å; L138-Y158 HydrophobicContact CD2-CD2 4.05Å; L138-Y158 HydrophobicContact CD2-CG 4.5Å; R142-Y158 PolarHBondContact NH1-O 3.02Å; R142-Y158 PolarHBondContact NH2-O 2.75Å; Y158-V763 HydrophobicContact CD2-CG1 4.04Å; Y158-V763 HydrophobicContact CE2-CG1 4.24Å; Y158-V763 HydrophobicContact CG-CG2 4.44Å
159	P	88.9	Confident	77.8	Confident	4 Å²	4	46.7 Å²	46.7	3%	0.026	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-62.3	167.1	172.1	29.9	-35	0	0	0	110.4	L138 L413 M449 V763 L766	L138-P159 HydrophobicContact CD2-CG 4.04Å; L138-P159 WeakPolarHBondContact CD2-O 3.26Å; P159-L413 VanDerWaalsContact CB-O 3.32Å; P159-L413 WeakPolarHBondContact CB-O 3.48Å; P159-M449 HydrophobicContact CB-CE 4.09Å; P159-M449 HydrophobicContact CG-CE 4.41Å; P159-V763 HydrophobicContact CG-CG2 4.35Å; P159-L766 HydrophobicContact CG-CD1 3.65Å
160	F	89.6	Confident	76.6	Confident	7 Å²	7	49 Å²	49	3%	0.031	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-78.2	153.4	163.9	-69.5	-69.1	0	0	0	109.9	L138 L140 R142 P162 S417 I420 P451	L138-F160 WeakPolarHBondContact O-CA 3.31Å; L140-F160 HydrophobicContact CD2-CB 4.32Å; L140-F160 HydrophobicContact CD2-CD1 3.68Å; L140-F160 HydrophobicContact CD2-CE1 4.08Å; L140-F160 HydrophobicContact CD2-CG 3.96Å; L140-F160 HydrophobicContact CG-CD1 4.35Å; R142-F160 HydrophobicContact CG-CE1 4.32Å; R142-F160 VanDerWaalsContact NE-CE1 3.34Å; F160-P162 WeakPolarHBondContact O-CD 3.27Å; F160-S417 WeakPolarHBondContact CE2-O 3.47Å; F160-I420 HydrophobicContact CD2-CB 4.15Å; F160-I420 HydrophobicContact CD2-CG2 4.21Å; F160-I420 HydrophobicContact CE2-CB 4.33Å; F160-P451 HydrophobicContact CB-CG 4.02Å
161	L	87.5	Confident	75.4	Confident	36 Å²	36	52.9 Å²	52.9	19%	0.188	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-59.8	127.5	179.2	-171.5	78.3	0	0	0	111.3	L138 M165 E167 P451	L138-L161 HydrophobicContact CB-CB 4.14Å; L138-L161 HydrophobicContact CD1-CD1 3.78Å; L138-L161 PolarHBondContact O-N 3.45Å; L161-M165 HydrophobicContact CD1-CB 4.42Å; L161-E167 HydrophobicContact CD2-CG 3.35Å; L161-P451 WeakPolarHBondContact O-CA 3.48Å
162	P	87.8	Confident	74.1	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-66.8	137.8	175.3	-22.7	35.3	0	0	0	113.2	F160 G164 M165 I448 M449 L766	F160-P162 WeakPolarHBondContact O-CD 3.27Å; P162-G164 PolarHBondContact O-N 3.4Å; P162-M165 HydrophobicContact CB-CE 4.04Å; P162-M165 HydrophobicContact CB-CG 4.24Å; P162-M165 HydrophobicContact CB-SD 3.88Å; P162-M165 HydrophobicContact CG-CE 4.09Å; P162-M165 HydrophobicContact CG-SD 3.78Å; P162-M165 WeakPolarHBondContact O-CB 3.44Å; P162-M165 PolarHBondContact O-N 3.37Å; P162-M165 VanDerWaalsContact O-N 3.14Å; P162-I448 WeakPolarHBondContact CB-O 3.36Å; P162-M449 HydrophobicContact CG-CE 4.14Å; P162-M449 HydrophobicContact CG-SD 3.8Å; P162-L766 HydrophobicContact CG-CD1 4.33Å; P162-L766 HydrophobicContact CG-CD2 3.96Å
163	G	81.7	Confident	73.1	Confident	2 Å²	2	56 Å²	56	2%	0.021	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	133.6	-179.2	0	0	0	0	0	113.4	M165 L450 D452	G163-M165 VanDerWaalsContact C-N 3.26Å; G163-M165 PolarHBondContact O-N 3.35Å; G163-L450 PolarHBondContact N-O 2.6Å; G163-D452 VanDerWaalsContact CA-N 3.3Å
164	G	75.9	Confident	71.7	Confident	6 Å²	6	58.2 Å²	58.2	6%	0.062	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.3	5.4	-177.3	0	0	0	0	0	115.2	P162 I476 R774	P162-G164 PolarHBondContact O-N 3.4Å; G164-I476 WeakPolarHBondContact CA-O 3.11Å; G164-R774 VanDerWaalsContact C-NH1 3.28Å; G164-R774 PolarHBondContact O-NH1 3.36Å; G164-R774 PolarHBondContact O-NH2 2.93Å
165	M	77.3	Confident	70.4	Confident	32 Å²	32	60.5 Å²	60.5	16%	0.158	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-80.2	143.5	152.6	-61.2	-173.9	-178.2	0	0	108.2	L161 P162 G163 I448 L766	L161-M165 HydrophobicContact CD1-CB 4.42Å; P162-M165 HydrophobicContact CB-CE 4.04Å; P162-M165 HydrophobicContact CB-CG 4.24Å; P162-M165 HydrophobicContact CB-SD 3.88Å; P162-M165 HydrophobicContact CG-CE 4.09Å; P162-M165 HydrophobicContact CG-SD 3.78Å; P162-M165 WeakPolarHBondContact O-CB 3.44Å; P162-M165 PolarHBondContact O-N 3.37Å; P162-M165 VanDerWaalsContact O-N 3.14Å; G163-M165 VanDerWaalsContact C-N 3.26Å; G163-M165 PolarHBondContact O-N 3.35Å; M165-I448 HydrophobicContact CE-CG2 4.34Å; M165-L766 HydrophobicContact CE-CD2 4.37Å; M165-L766 HydrophobicContact SD-CD2 3.44Å; M165-L766 WeakPolarHBondContact SD-CD2 3.29Å
166	E	66.3	Low	69.3	Low	150 Å²	150	64.9 Å²	64.9	70%	0.701	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-90.5	134	176.4	-76.1	157.2	-151.4	0	0	108.1	K478	E166-K478 IonicContact OE1-NZ 3.2Å; E166-K478 PolarHBondContact OE1-NZ 2.95Å
167	E	63.2	Low	68	Low	116 Å²	116	62.6 Å²	62.6	54%	0.542	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-62	139.9	164.8	-66.6	-171.9	151.1	0	0	107.9	L161 T169	L161-E167 HydrophobicContact CD2-CG 3.35Å; E167-T169 PolarHBondContact O-N 3.37Å; E167-T169 VanDerWaalsContact O-N 3.11Å
168	L	58.4	Low	66.3	Low	102 Å²	102	67.7 Å²	67.7	53%	0.534	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-56.7	121.2	175.5	-66.7	171.7	0	0	0	107.9	I173	L168-I173 HydrophobicContact CB-CD1 4.32Å; L168-I173 HydrophobicContact CB-CG1 4.03Å; L168-I173 WeakPolarHBondContact O-CD1 3.32Å
169	T	52.6	Low	64.7	Low	74 Å²	74	71.7 Å²	71.7	45%	0.454	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-61.9	150.6	-177.4	49.1	0	0	0	0	110.3	E167 D171 Q172 I173	E167-T169 PolarHBondContact O-N 3.37Å; E167-T169 VanDerWaalsContact O-N 3.11Å; T169-D171 PolarHBondContact O-N 3.25Å; T169-Q172 WeakPolarHBondContact O-CA 3.45Å; T169-Q172 WeakPolarHBondContact O-CB 3.47Å; T169-Q172 PolarHBondContact O-N 2.99Å; T169-Q172 WeakPolarHBondContact OG1-CG 3.3Å; T169-I173 PolarHBondContact O-N 3.26Å; T169-I173 VanDerWaalsContact O-N 3.08Å
170	L	50.8	Low	62.8	Low	115 Å²	115	77 Å²	77	60%	0.602	38%	0.381	S	S	*	.	H	α-helix	trans	-51.7	-35.3	179.5	-70.3	170.5	0	0	0	112	Q172 I173 K174	L170-Q172 PolarHBondContact O-N 3.17Å; L170-I173 PolarHBondContact O-N 3.19Å; L170-K174 VanDerWaalsContact O-CB 3.3Å; L170-K174 WeakPolarHBondContact O-CB 3.33Å; L170-K174 VanDerWaalsContact O-CG 3.27Å; L170-K174 WeakPolarHBondContact O-CG 3.37Å; L170-K174 PolarHBondContact O-N 2.95Å
171	D	51.5	Low	60.9	Low	112 Å²	112	82 Å²	82	60%	0.599	41%	0.405	S	S	*	.	H	α-helix	trans	-64.7	-33.2	175.6	-53.8	-30.8	0	0	0	114.1	T169 T175	T169-D171 PolarHBondContact O-N 3.25Å; D171-T175 PolarHBondContact O-N 2.96Å; D171-T175 PolarHBondContact O-OG1 2.92Å
172	Q	54.1	Low	59	Low	108 Å²	108	88.1 Å²	88.1	51%	0.505	43%	0.432	S	S	.	.	H	α-helix	trans	-77.3	-32.6	175.5	-68.8	176.7	5.9	0	0	111.7	T169 L170 T175 R176	T169-Q172 WeakPolarHBondContact O-CA 3.45Å; T169-Q172 WeakPolarHBondContact O-CB 3.47Å; T169-Q172 PolarHBondContact O-N 2.99Å; T169-Q172 WeakPolarHBondContact OG1-CG 3.3Å; L170-Q172 PolarHBondContact O-N 3.17Å; Q172-T175 WeakPolarHBondContact CA-OG1 3.35Å; Q172-T175 PolarHBondContact O-OG1 3.32Å; Q172-R176 WeakPolarHBondContact O-CB 3.42Å; Q172-R176 PolarHBondContact O-N 3.44Å
173	I	56.8	Low	57.2	Low	89 Å²	89	91.1 Å²	91.1	46%	0.456	45%	0.448	S	S	.	.	H	α-helix	trans	-70.6	-44.5	172.4	-60.8	174.9	0	0	0	109.5	L168 T169 L170 R176 S177	L168-I173 HydrophobicContact CB-CD1 4.32Å; L168-I173 HydrophobicContact CB-CG1 4.03Å; L168-I173 WeakPolarHBondContact O-CD1 3.32Å; T169-I173 PolarHBondContact O-N 3.26Å; T169-I173 VanDerWaalsContact O-N 3.08Å; L170-I173 PolarHBondContact O-N 3.19Å; I173-R176 CarbonylContact O-C 3.59Å; I173-R176 PolarHBondContact O-N 3.4Å; I173-S177 PolarHBondContact O-N 3.34Å; I173-S177 PolarHBondContact O-OG 3.44Å
174	K	51.6	Low	55.6	Low	61 Å²	61	94 Å²	94	27%	0.265	46%	0.463	S	S	.	.	H	α-helix	trans	-58.2	-51.4	174	-79.5	177.6	169.5	-168.9	0	112.1	L170 R176 S177 E178 S253	L170-K174 VanDerWaalsContact O-CB 3.3Å; L170-K174 WeakPolarHBondContact O-CB 3.33Å; L170-K174 VanDerWaalsContact O-CG 3.27Å; L170-K174 WeakPolarHBondContact O-CG 3.37Å; L170-K174 PolarHBondContact O-N 2.95Å; K174-R176 PolarHBondContact O-N 3.48Å; K174-S177 WeakPolarHBondContact CA-OG 3.46Å; K174-S177 PolarHBondContact O-N 3.04Å; K174-S177 VanDerWaalsContact O-N 3.15Å; K174-S177 PolarHBondContact O-OG 2.78Å; K174-E178 VanDerWaalsContact O-CB 3.32Å; K174-E178 WeakPolarHBondContact O-CB 3.4Å; K174-E178 WeakPolarHBondContact O-CG 3.35Å; K174-E178 PolarHBondContact O-N 3.28Å; K174-S253 PolarHBondContact NZ-OG 3.33Å
175	T	54.9	Low	54.6	Low	68 Å²	68	101.8 Å²	101.8	42%	0.417	50%	0.495	S	S	.	.	H	α-helix	trans	-64.6	-26.7	177.8	39.4	0	0	0	0	113.2	D171 Q172 Q179	D171-T175 PolarHBondContact O-N 2.96Å; D171-T175 PolarHBondContact O-OG1 2.92Å; Q172-T175 WeakPolarHBondContact CA-OG1 3.35Å; Q172-T175 PolarHBondContact O-OG1 3.32Å; T175-Q179 VanDerWaalsContact O-CG 3.23Å; T175-Q179 WeakPolarHBondContact O-CG 3.4Å; T175-Q179 PolarHBondContact O-N 3.21Å
176	R	53.5	Low	53.6	Low	128 Å²	128	108.5 Å²	108.5	48%	0.483	53%	0.526	S	S	.	.	H	α-helix	trans	-76.1	-41.7	170.9	-176	175.4	172.3	176.7	-1.4	112.2	Q172 I173 K174 Q179 E180 E764	Q172-R176 WeakPolarHBondContact O-CB 3.42Å; Q172-R176 PolarHBondContact O-N 3.44Å; I173-R176 CarbonylContact O-C 3.59Å; I173-R176 PolarHBondContact O-N 3.4Å; K174-R176 PolarHBondContact O-N 3.48Å; R176-Q179 PolarHBondContact O-N 2.92Å; R176-E180 WeakPolarHBondContact CG-OE1 3.19Å; R176-E180 IonicContact CZ-OE1 3.53Å; R176-E180 IonicContact NE-OE1 2.66Å; R176-E180 PolarHBondContact NE-OE1 2.77Å; R176-E180 IonicContact NH2-OE1 3.76Å; R176-E180 WeakPolarHBondContact O-CG 3.44Å; R176-E180 PolarHBondContact O-N 3.05Å; R176-E764 IonicContact NH2-OE2 3.42Å
177	S	52.2	Low	53.1	Low	29 Å²	29	108.6 Å²	108.6	20%	0.203	52%	0.524	C	S	.	.	H	α-helix	trans	-67	-39.2	175.4	61.1	0	0	0	0	111.3	I173 K174 Q179 E180 E181	I173-S177 PolarHBondContact O-N 3.34Å; I173-S177 PolarHBondContact O-OG 3.44Å; K174-S177 WeakPolarHBondContact CA-OG 3.46Å; K174-S177 PolarHBondContact O-N 3.04Å; K174-S177 VanDerWaalsContact O-N 3.15Å; K174-S177 PolarHBondContact O-OG 2.78Å; S177-Q179 VanDerWaalsContact C-N 3.28Å; S177-Q179 PolarHBondContact O-N 3.46Å; S177-E180 CarbonylContact O-C 3.56Å; S177-E180 WeakPolarHBondContact O-CA 3.39Å; S177-E180 PolarHBondContact O-N 3.44Å; S177-E181 WeakPolarHBondContact O-CB 3.3Å; S177-E181 VanDerWaalsContact O-CG 3.22Å; S177-E181 WeakPolarHBondContact O-CG 3.45Å; S177-E181 PolarHBondContact O-N 2.9Å
178	E	51.5	Low	52.9	Low	112 Å²	112	107.8 Å²	107.8	52%	0.523	52%	0.524	S	S	.	.	H	α-helix	trans	-58.3	-39.1	172.7	-73.5	162	-168.9	0	0	111.7	K174 E180 E181	K174-E178 VanDerWaalsContact O-CB 3.32Å; K174-E178 WeakPolarHBondContact O-CB 3.4Å; K174-E178 WeakPolarHBondContact O-CG 3.35Å; K174-E178 PolarHBondContact O-N 3.28Å; E178-E180 VanDerWaalsContact C-N 3.34Å; E178-E181 PolarHBondContact O-N 2.93Å
179	Q	51.7	Low	53.3	Low	155 Å²	155	108.1 Å²	108.1	72%	0.724	53%	0.525	S	S	*	.	H	α-helix	trans	-71	-25.7	172.7	-74.1	170.9	14	0	0	113.8	T175 R176 S177	T175-Q179 VanDerWaalsContact O-CG 3.23Å; T175-Q179 WeakPolarHBondContact O-CG 3.4Å; T175-Q179 PolarHBondContact O-N 3.21Å; R176-Q179 PolarHBondContact O-N 2.92Å; S177-Q179 VanDerWaalsContact C-N 3.28Å; S177-Q179 PolarHBondContact O-N 3.46Å
180	E	50.8	Low	54	Low	114 Å²	114	111.2 Å²	111.2	53%	0.533	54%	0.538	S	S	.	.	H	α-helix	trans	-90.7	-15.8	176.7	-69.4	174.1	-166.4	0	0	112.4	R176 S177 E178	R176-E180 WeakPolarHBondContact CG-OE1 3.19Å; R176-E180 IonicContact CZ-OE1 3.53Å; R176-E180 IonicContact NE-OE1 2.66Å; R176-E180 PolarHBondContact NE-OE1 2.77Å; R176-E180 IonicContact NH2-OE1 3.76Å; R176-E180 WeakPolarHBondContact O-CG 3.44Å; R176-E180 PolarHBondContact O-N 3.05Å; S177-E180 CarbonylContact O-C 3.56Å; S177-E180 WeakPolarHBondContact O-CA 3.39Å; S177-E180 PolarHBondContact O-N 3.44Å; E178-E180 VanDerWaalsContact C-N 3.34Å
181	E	49.5	Very low	55.1	Low	114 Å²	114	111.3 Å²	111.3	53%	0.533	53%	0.534	S	S	.	.	H	α-helix	trans	-100.6	-1.8	-175.3	-75.1	179.5	-174.5	0	0	114.5	S177 E178 I183	S177-E181 WeakPolarHBondContact O-CB 3.3Å; S177-E181 VanDerWaalsContact O-CG 3.22Å; S177-E181 WeakPolarHBondContact O-CG 3.45Å; S177-E181 PolarHBondContact O-N 2.9Å; E178-E181 PolarHBondContact O-N 2.93Å; E181-I183 PolarHBondContact O-N 3.42Å
182	E	46.1	Very low	56.2	Low	164 Å²	164	110.1 Å²	110.1	77%	0.766	53%	0.526	S	S	*	.			trans	-71.9	42.5	168.2	-70	-160.2	143	0	0	113.4	D184	E182-D184 PolarHBondContact O-N 3.38Å
183	I	51.1	Low	57.2	Low	63 Å²	63	108 Å²	108	32%	0.323	52%	0.522	S	S	.	.			trans	-87.8	105.2	178.2	-57.2	176.7	0	0	0	109.6	E181 F185 L190	E181-I183 PolarHBondContact O-N 3.42Å; I183-F185 PolarHBondContact O-N 3.26Å; I183-F185 VanDerWaalsContact O-N 3.14Å; I183-L190 HydrophobicContact CD1-CD1 4.23Å
184	D	48.6	Very low	57.9	Low	62 Å²	62	110 Å²	110	33%	0.332	54%	0.541	S	S	.	.			trans	-73.1	99	170.7	-176	-3.2	0	0	0	109.7	E182 E186 K187 D188	E182-D184 PolarHBondContact O-N 3.38Å; D184-E186 PolarHBondContact O-N 2.96Å; D184-E186 PolarHBondContact OD1-N 3.41Å; D184-K187 HydrophobicContact CB-CB 4.46Å; D184-K187 PolarHBondContact O-N 2.82Å; D184-K187 IonicContact OD2-NZ 2.84Å; D184-K187 PolarHBondContact OD2-NZ 3.32Å; D184-D188 PolarHBondContact O-N 3.28Å
185	F	54.2	Low	58.8	Low	169 Å²	169	110.5 Å²	110.5	74%	0.741	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.3	-18.8	-174.7	-74.9	-86.3	0	0	0	114.9	I183	I183-F185 PolarHBondContact O-N 3.26Å; I183-F185 VanDerWaalsContact O-N 3.14Å
186	E	55.8	Low	59.8	Low	174 Å²	174	113 Å²	113	81%	0.813	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-21.8	175.9	-62.4	-165.2	155.3	0	0	113.9	D184	D184-E186 PolarHBondContact O-N 2.96Å; D184-E186 PolarHBondContact OD1-N 3.41Å
187	K	56.3	Low	61	Low	152 Å²	152	116.6 Å²	116.6	66%	0.661	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.8	-40.1	-173.3	-58.2	-166.8	-164.1	82.8	0	113.7	D184	D184-K187 HydrophobicContact CB-CB 4.46Å; D184-K187 PolarHBondContact O-N 2.82Å; D184-K187 IonicContact OD2-NZ 2.84Å; D184-K187 PolarHBondContact OD2-NZ 3.32Å
188	D	58.5	Low	62.2	Low	99 Å²	99	119 Å²	119	53%	0.529	61%	0.614	S	S	.	*			trans	-108.7	44.9	-171.7	-69.4	-45.8	0	0	0	112.8	D184 L190	D184-D188 PolarHBondContact O-N 3.28Å; D188-L190 PolarHBondContact O-N 2.98Å; D188-L190 VanDerWaalsContact O-N 3.12Å
189	L	66.8	Low	63.4	Low	109 Å²	109	115.7 Å²	115.7	57%	0.571	61%	0.611	S	S	*	*			trans	-56.4	119.3	163.6	-72.2	174.8	0	0	0	109.5	K191	L189-K191 PolarHBondContact O-N 3.04Å
190	L	67	Low	64.6	Low	138 Å²	138	114.1 Å²	114.1	72%	0.723	61%	0.605	S	S	*	*			trans	-66.5	77.2	179.2	-65.6	176.5	0	0	0	111.7	I183 D188 I192	I183-L190 HydrophobicContact CD1-CD1 4.23Å; D188-L190 PolarHBondContact O-N 2.98Å; D188-L190 VanDerWaalsContact O-N 3.12Å; L190-I192 VanDerWaalsContact C-N 3.26Å; L190-I192 PolarHBondContact O-N 3.2Å
191	K	74.1	Confident	65.6	Low	118 Å²	118	114.9 Å²	114.9	51%	0.513	61%	0.613	S	S	.	*			trans	-65.9	-29.4	177.7	-68.4	171.2	-172.1	172.5	0	112.6	L189 G199 M200 F202	L189-K191 PolarHBondContact O-N 3.04Å; K191-G199 CarbonylContact O-C 3.6Å; K191-G199 WeakPolarHBondContact O-CA 3.43Å; K191-M200 PolarHBondContact O-N 3.32Å; K191-F202 HydrophobicContact CG-CD2 4.4Å; K191-F202 HydrophobicContact CG-CE2 4.41Å
192	I	74.9	Confident	66.5	Low	86 Å²	86	116.4 Å²	116.4	44%	0.441	62%	0.618	S	S	.	*	S	Bend	trans	-113	121.7	-177	-54.8	174.9	0	0	0	108.1	L190 L196	L190-I192 VanDerWaalsContact C-N 3.26Å; L190-I192 PolarHBondContact O-N 3.2Å; I192-L196 WeakPolarHBondContact CG2-O 3.46Å
193	P	75.1	Confident	67.5	Low	63 Å²	63	112.9 Å²	112.9	41%	0.409	61%	0.611	S	S	.	*			trans	-66.4	146	175.1	26.2	-32.9	0	0	0	111.3	G195 L196	P193-G195 PolarHBondContact O-N 2.98Å; P193-L196 HydrophobicContact CG-CB 4.19Å; P193-L196 HydrophobicContact CG-CD1 3.85Å; P193-L196 HydrophobicContact CG-CG 4.5Å; P193-L196 PolarHBondContact O-N 3.05Å
194	P	71.5	Confident	67.4	Low	131 Å²	131	116.1 Å²	116.1	85%	0.851	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.3	137.7	-174.1	23	-33.7	0	0	0	112.1	L196	P194-L196 VanDerWaalsContact C-N 3.29Å; P194-L196 PolarHBondContact O-N 2.8Å
195	G	70.9	Confident	67.8	Low	73 Å²	73	122.9 Å²	122.9	75%	0.753	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	81.5	-7.5	-178.2	0	0	0	0	0	115.8	P193	P193-G195 PolarHBondContact O-N 2.98Å
196	L	75.7	Confident	67.3	Low	120 Å²	120	122.3 Å²	122.3	63%	0.628	66%	0.66	S	S	*	*			trans	-106.2	160.8	175.8	-66.5	176.5	0	0	0	111.9	I192 P193 P194	I192-L196 WeakPolarHBondContact CG2-O 3.46Å; P193-L196 HydrophobicContact CG-CB 4.19Å; P193-L196 HydrophobicContact CG-CD1 3.85Å; P193-L196 HydrophobicContact CG-CG 4.5Å; P193-L196 PolarHBondContact O-N 3.05Å; P194-L196 VanDerWaalsContact C-N 3.29Å; P194-L196 PolarHBondContact O-N 2.8Å
197	K	77.8	Confident	66.8	Low	203 Å²	203	117.8 Å²	117.8	88%	0.883	65%	0.653	S	S	*	*	S	Bend	trans	-103.6	-15.6	179.6	-65.6	-174.8	179.8	-178.9	0	114.1
198	A	77.8	Confident	66.3	Low	79 Å²	79	120 Å²	120	65%	0.653	66%	0.662	S	S	*	*			trans	-111.2	135.6	179.8	0	0	0	0	0	109
199	G	76.2	Confident	65.3	Low	43 Å²	43	122.7 Å²	122.7	44%	0.443	68%	0.675	S	S	.	*			trans	-117.3	-165.6	-179.3	0	0	0	0	0	112.8	K191	K191-G199 CarbonylContact O-C 3.6Å; K191-G199 WeakPolarHBondContact O-CA 3.43Å
200	M	77.4	Confident	64	Low	122 Å²	122	121.7 Å²	121.7	60%	0.601	68%	0.682	S	S	*	*			trans	-102.2	119.8	173.7	-168.3	169.2	-169.9	0	0	110.4	K191 F202	K191-M200 PolarHBondContact O-N 3.32Å; M200-F202 HydrophobicContact CB-CE1 4.5Å; M200-F202 HydrophobicContact CB-CE2 3.96Å; M200-F202 HydrophobicContact CB-CZ 3.91Å; M200-F202 HydrophobicContact CE-CE1 4.21Å; M200-F202 HydrophobicContact CG-CD1 4.38Å; M200-F202 HydrophobicContact CG-CE1 3.93Å; M200-F202 HydrophobicContact CG-CE2 4.22Å; M200-F202 HydrophobicContact CG-CZ 3.84Å; M200-F202 VanDerWaalsContact O-CD2 3.29Å; M200-F202 WeakPolarHBondContact O-CD2 3.47Å; M200-F202 WeakPolarHBondContact O-CE2 3.44Å; M200-F202 PolarHBondContact O-N 2.79Å; M200-F202 HydrophobicContact SD-CD1 4.41Å; M200-F202 HydrophobicContact SD-CE1 3.56Å; M200-F202 VanDerWaalsContact SD-CE1 3.56Å; M200-F202 HydrophobicContact SD-CZ 3.67Å
201	D	72.3	Confident	62.4	Low	131 Å²	131	122.7 Å²	122.7	70%	0.701	68%	0.681	S	S	*	*			trans	-86.7	101.2	175.4	-76.5	-33.8	0	0	0	110.4	S203	D201-S203 PolarHBondContact O-N 3.04Å; D201-S203 VanDerWaalsContact O-N 3.13Å
202	F	69.1	Low	60.8	Low	146 Å²	146	122.8 Å²	122.8	64%	0.64	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	14	179	-60.8	-80.9	0	0	0	114.2	K191 M200	K191-F202 HydrophobicContact CG-CD2 4.4Å; K191-F202 HydrophobicContact CG-CE2 4.41Å; M200-F202 HydrophobicContact CB-CE1 4.5Å; M200-F202 HydrophobicContact CB-CE2 3.96Å; M200-F202 HydrophobicContact CB-CZ 3.91Å; M200-F202 HydrophobicContact CE-CE1 4.21Å; M200-F202 HydrophobicContact CG-CD1 4.38Å; M200-F202 HydrophobicContact CG-CE1 3.93Å; M200-F202 HydrophobicContact CG-CE2 4.22Å; M200-F202 HydrophobicContact CG-CZ 3.84Å; M200-F202 VanDerWaalsContact O-CD2 3.29Å; M200-F202 WeakPolarHBondContact O-CD2 3.47Å; M200-F202 WeakPolarHBondContact O-CE2 3.44Å; M200-F202 PolarHBondContact O-N 2.79Å; M200-F202 HydrophobicContact SD-CD1 4.41Å; M200-F202 HydrophobicContact SD-CE1 3.56Å; M200-F202 VanDerWaalsContact SD-CE1 3.56Å; M200-F202 HydrophobicContact SD-CZ 3.67Å
203	S	67.4	Low	59	Low	90 Å²	90	126 Å²	126	63%	0.629	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-14.8	-173.8	45.8	0	0	0	0	115.3	D201	D201-S203 PolarHBondContact O-N 3.04Å; D201-S203 VanDerWaalsContact O-N 3.13Å
204	D	48.7	Very low	57.5	Low	131 Å²	131	128.3 Å²	128.3	70%	0.701	72%	0.719	S	S	*	*			trans	-82.6	124.5	-174.2	-82.8	-13.8	0	0	0	113.4	D206	D204-D206 PolarHBondContact O-N 3.18Å
205	K	55.7	Low	56	Low	203 Å²	203	127.3 Å²	127.3	88%	0.883	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-1.2	-175.8	-67.8	180	177	176.7	0	114.8	A207	K205-A207 VanDerWaalsContact C-N 3.33Å
206	D	44.8	Very low	54.8	Low	157 Å²	157	129.9 Å²	129.9	84%	0.84	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	2.6	-177.6	-76	-28.4	0	0	0	114	D204 K208	D204-D206 PolarHBondContact O-N 3.18Å; D206-K208 PolarHBondContact O-N 2.82Å
207	A	45.2	Very low	53.2	Low	79 Å²	79	130.4 Å²	130.4	65%	0.653	70%	0.704	S	S	*	*	S	Bend	trans	-62.1	97.9	158.6	0	0	0	0	0	109.1	K205 I209	K205-A207 VanDerWaalsContact C-N 3.33Å; A207-I209 PolarHBondContact O-N 3.5Å
208	K	44.5	Very low	51.4	Low	200 Å²	200	123.7 Å²	123.7	87%	0.87	68%	0.682	S	S	*	*			trans	-47.7	116.3	169.7	-76.8	179.6	179.6	172.8	0	108.2	D206 A210	D206-K208 PolarHBondContact O-N 2.82Å; K208-A210 VanDerWaalsContact C-N 3.3Å; K208-A210 PolarHBondContact O-N 3.02Å
209	I	38.6	Very low	49.8	Very low	154 Å²	154	125 Å²	125	79%	0.79	68%	0.678	S	S	*	*			trans	-60.8	93.8	-177.4	-58.8	167.3	0	0	0	108.6	A207 K211	A207-I209 PolarHBondContact O-N 3.5Å; I209-K211 PolarHBondContact O-N 3.02Å
210	A	39.1	Very low	48.4	Very low	88 Å²	88	127.3 Å²	127.3	73%	0.727	68%	0.679	S	S	*	*			trans	-60.5	121.8	152.6	0	0	0	0	0	105.3	K208	K208-A210 VanDerWaalsContact C-N 3.3Å; K208-A210 PolarHBondContact O-N 3.02Å
211	K	34.6	Very low	46.5	Very low	159 Å²	159	124.2 Å²	124.2	69%	0.691	67%	0.67	S	S	*	*			trans	-54.3	134.1	177.9	-69.4	177	172.6	-176.2	0	108.7	I209 E213	I209-K211 PolarHBondContact O-N 3.02Å; K211-E213 HydrophobicContact CB-CG 4.35Å; K211-E213 IonicContact NZ-OE1 2.68Å; K211-E213 PolarHBondContact O-N 2.96Å
212	P	38.8	Very low	45.2	Very low	121 Å²	121	123 Å²	123	79%	0.786	67%	0.668	S	S	*	*			trans	-74.2	75.1	173.2	31.6	-34.4	0	0	0	109.7	V214	P212-V214 PolarHBondContact O-N 2.9Å
213	E	38.9	Very low	44.1	Very low	154 Å²	154	122 Å²	122	72%	0.72	67%	0.668	S	S	*	*			trans	-89.8	48.6	166.7	-72.7	179.7	-157.4	0	0	110.2	K211	K211-E213 HydrophobicContact CB-CG 4.35Å; K211-E213 IonicContact NZ-OE1 2.68Å; K211-E213 PolarHBondContact O-N 2.96Å
214	V	42.7	Very low	42.6	Very low	110 Å²	110	125.2 Å²	125.2	67%	0.667	67%	0.673	S	S	*	*			trans	-129.2	76.1	159.8	-170.6	0	0	0	0	106.8	P212 L219	P212-V214 PolarHBondContact O-N 2.9Å; V214-L219 HydrophobicContact CG1-CD1 4.12Å
215	N	40.4	Very low	42	Very low	110 Å²	110	126.2 Å²	126.2	59%	0.588	68%	0.678	S	S	*	*			trans	-73.8	126	171.8	-166.4	-4.3	0	0	0	107.3	M217 S218	N215-M217 PolarHBondContact O-N 3.07Å; N215-S218 PolarHBondContact O-N 3.33Å; N215-S218 PolarHBondContact O-OG 2.85Å; N215-S218 VanDerWaalsContact O-OG 3.06Å
216	L	45.4	Very low	41.1	Very low	128 Å²	128	123.7 Å²	123.7	67%	0.67	67%	0.673	S	S	*	*	H	α-helix	trans	-58.7	-27.7	-172.6	-149.8	117.8	0	0	0	112.1	S218 L219 L220	L216-S218 VanDerWaalsContact C-N 3.3Å; L216-S218 PolarHBondContact O-N 2.95Å; L216-L219 PolarHBondContact O-N 2.61Å; L216-L220 HydrophobicContact CD2-CD1 4.26Å; L216-L220 PolarHBondContact O-N 2.9Å
217	M	42.6	Very low	40.7	Very low	131 Å²	131	121.5 Å²	121.5	65%	0.645	67%	0.668	S	S	*	*	H	α-helix	trans	-61.7	-27.3	172.6	-60.9	-61.4	-75.5	0	0	114.2	N215 L220 S221	N215-M217 PolarHBondContact O-N 3.07Å; M217-L220 PolarHBondContact O-N 2.87Å; M217-L220 HydrophobicContact SD-CD1 4.4Å; M217-S221 PolarHBondContact O-N 2.8Å
218	S	39.7	Very low	40.1	Very low	62 Å²	62	124.9 Å²	124.9	43%	0.434	68%	0.675	S	S	.	*	H	α-helix	trans	-77.2	-31.2	179	74.6	0	0	0	0	112.6	N215 L216 L220 S221 T222	N215-S218 PolarHBondContact O-N 3.33Å; N215-S218 PolarHBondContact O-OG 2.85Å; N215-S218 VanDerWaalsContact O-OG 3.06Å; L216-S218 VanDerWaalsContact C-N 3.3Å; L216-S218 PolarHBondContact O-N 2.95Å; S218-L220 VanDerWaalsContact C-N 3.31Å; S218-S221 WeakPolarHBondContact CA-OG 3.14Å; S218-S221 PolarHBondContact O-N 2.95Å; S218-S221 PolarHBondContact O-OG 3.4Å; S218-T222 PolarHBondContact O-N 2.78Å; S218-T222 PolarHBondContact O-OG1 3.42Å
219	L	44.4	Very low	39.5	Very low	106 Å²	106	123.3 Å²	123.3	56%	0.555	68%	0.675	S	S	*	*	H	α-helix	trans	-68.7	-32.3	170	-80.2	162.9	0	0	0	111.5	V214 L216 T222	V214-L219 HydrophobicContact CG1-CD1 4.12Å; L216-L219 PolarHBondContact O-N 2.61Å; L219-T222 PolarHBondContact O-OG1 3.44Å
220	L	45.2	Very low	39	Very low	91 Å²	91	124.2 Å²	124.2	48%	0.476	68%	0.68	S	S	.	*	H	α-helix	trans	-74.2	-37.3	172.9	-73.6	162.7	0	0	0	112.3	L216 M217 S218 T222 L223	L216-L220 HydrophobicContact CD2-CD1 4.26Å; L216-L220 PolarHBondContact O-N 2.9Å; M217-L220 PolarHBondContact O-N 2.87Å; M217-L220 HydrophobicContact SD-CD1 4.4Å; S218-L220 VanDerWaalsContact C-N 3.31Å; L220-T222 PolarHBondContact O-N 2.83Å; L220-L223 HydrophobicContact CD2-CD1 4.46Å; L220-L223 WeakPolarHBondContact O-CB 3.32Å; L220-L223 PolarHBondContact O-N 2.86Å
221	S	39.5	Very low	38.6	Very low	58 Å²	58	125.4 Å²	125.4	41%	0.406	68%	0.68	S	S	.	*	H	α-helix	trans	-63	-24.9	176.1	66.8	0	0	0	0	113.8	M217 S218 L223 E224	M217-S221 PolarHBondContact O-N 2.8Å; S218-S221 WeakPolarHBondContact CA-OG 3.14Å; S218-S221 PolarHBondContact O-N 2.95Å; S218-S221 PolarHBondContact O-OG 3.4Å; S221-L223 PolarHBondContact O-N 2.88Å; S221-E224 PolarHBondContact O-N 3.37Å
222	T	44.2	Very low	38.5	Very low	106 Å²	106	127.2 Å²	127.2	65%	0.65	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	-5.9	171.4	34.7	0	0	0	0	114.3	S218 L219 L220	S218-T222 PolarHBondContact O-N 2.78Å; S218-T222 PolarHBondContact O-OG1 3.42Å; L219-T222 PolarHBondContact O-OG1 3.44Å; L220-T222 PolarHBondContact O-N 2.83Å
223	L	45.5	Very low	38	Very low	124 Å²	124	126.1 Å²	126.1	65%	0.649	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	-2.6	176.1	-69.7	158.3	0	0	0	113.3	L220 S221 N225	L220-L223 HydrophobicContact CD2-CD1 4.46Å; L220-L223 WeakPolarHBondContact O-CB 3.32Å; L220-L223 PolarHBondContact O-N 2.86Å; S221-L223 PolarHBondContact O-N 2.88Å; L223-N225 PolarHBondContact O-N 3Å
224	E	35.3	Very low	37.5	Very low	157 Å²	157	128.2 Å²	128.2	73%	0.734	70%	0.702	S	S	*	*			trans	-73.1	25.2	-176.1	-70	-177.4	139.2	0	0	115.5	S221	S221-E224 PolarHBondContact O-N 3.37Å
225	N	36.7	Very low	37.2	Very low	152 Å²	152	131.9 Å²	131.9	81%	0.813	71%	0.712	S	S	*	*			trans	-104.9	22.3	175.6	-83.3	-47.4	0	0	0	113.8	L223	L223-N225 PolarHBondContact O-N 3Å
226	I	38.2	Very low	36.5	Very low	150 Å²	150	136.6 Å²	136.6	77%	0.769	73%	0.728	S	S	*	*			trans	-122.5	93.4	172.4	-54.9	-180	0	0	0	109.1	D228	I226-D228 PolarHBondContact O-N 3.38Å
227	P	34.4	Very low	35.8	Very low	112 Å²	112	139.2 Å²	139.2	73%	0.727	74%	0.736	S	S	*	*			trans	-83.5	107.4	173.5	31.9	-29.7	0	0	0	110.1
228	D	34.2	Very low	35.1	Very low	150 Å²	150	140.5 Å²	140.5	80%	0.802	75%	0.746	S	S	*	*			trans	157.2	94.5	143	-85.2	-15.1	0	0	0	109.9	I226	I226-D228 PolarHBondContact O-N 3.38Å
229	L	32	Very low	34.5	Very low	167 Å²	167	140.5 Å²	140.5	87%	0.874	76%	0.756	S	S	*	*			trans	174.6	80.8	151.9	-97.5	158.3	0	0	0	109.9
230	L	27.4	Very low	33.8	Very low	173 Å²	173	145.6 Å²	145.6	91%	0.906	77%	0.773	S	S	*	*			trans	-117.2	109.7	166	-76.6	173	0	0	0	109.4
231	P	30.4	Very low	33.3	Very low	112 Å²	112	148.3 Å²	148.3	73%	0.727	79%	0.794	S	S	*	*			trans	-79.3	131.1	159.1	-5.2	23.8	0	0	0	109.2
232	E	32.2	Very low	32.8	Very low	198 Å²	198	148.7 Å²	148.7	93%	0.925	81%	0.807	S	S	*	*			trans	-65.8	137.6	176.7	-60.9	172.3	140	0	0	111.1
233	A	29.6	Very low	32.2	Very low	98 Å²	98	153.1 Å²	153.1	81%	0.81	82%	0.82	S	S	*	*			trans	-129.2	113.7	169.5	0	0	0	0	0	109.3
234	E	27.7	Very low	31.4	Very low	197 Å²	197	155.9 Å²	155.9	92%	0.921	83%	0.83	S	S	*	*			trans	-73.5	141.8	178.3	-63.3	-174.9	131.7	0	0	111.7
235	E	35.8	Very low	31.2	Very low	187 Å²	187	152.6 Å²	152.6	87%	0.874	83%	0.83	S	S	*	*			trans	-72.9	139	175.3	-61.5	177.9	143.6	0	0	112.5
236	K	26.6	Very low	30.9	Very low	210 Å²	210	151.4 Å²	151.4	91%	0.913	83%	0.828	S	S	*	*			trans	-163.8	140	140.4	-108.4	151	-165.1	164	0	113.8
237	E	31.2	Very low	30.6	Very low	182 Å²	182	153.3 Å²	153.3	85%	0.85	83%	0.831	S	S	*	*			trans	-73.5	147.8	-176.9	-56.2	162.3	126.4	0	0	111.5
238	D	26.5	Very low	30.3	Very low	159 Å²	159	155.1 Å²	155.1	85%	0.85	83%	0.833	S	S	*	*				172.6	136.5	81	-140.8	-15.2	0	0	0	114.9
239	G	28.3	Very low	30.4	Very low	62 Å²	62	153.2 Å²	153.2	64%	0.639	83%	0.829	S	S	*	*			trans	43.6	96.9	151.4	0	0	0	0	0	124.5
240	K	29.6	Very low	30.7	Very low	212 Å²	212	155.6 Å²	155.6	92%	0.922	83%	0.826	S	S	*	*				-178.1	133.2	108.6	-101.1	169.1	-175.6	174.5	0	113.3	G242	K240-G242 PolarHBondContact O-N 2.99Å
241	T	33.4	Very low	31.3	Very low	149 Å²	149	150.7 Å²	150.7	91%	0.914	80%	0.804	S	S	*	*			trans	-74.6	120.7	-173.6	49.5	0	0	0	0	113.6
242	G	29	Very low	31.8	Very low	66 Å²	66	150.8 Å²	150.8	68%	0.68	80%	0.798	S	S	*	*			trans	-168.5	62.1	169.7	0	0	0	0	0	107.7	K240 E244	K240-G242 PolarHBondContact O-N 2.99Å; G242-E244 VanDerWaalsContact C-N 3.33Å; G242-E244 PolarHBondContact O-N 3.45Å
243	E	31.3	Very low	32.4	Very low	198 Å²	198	142.5 Å²	142.5	93%	0.925	76%	0.762	S	S	*	*			trans	-70.9	90.8	177.5	-70.2	-177.9	159.4	0	0	108.9	A245	E243-A245 PolarHBondContact O-N 3.05Å; E243-A245 VanDerWaalsContact O-N 3.16Å
244	E	29.4	Very low	33.1	Very low	182 Å²	182	140.9 Å²	140.9	85%	0.85	74%	0.74	S	S	*	*			trans	-60.6	113.2	154.8	-72.8	-171.7	152.5	0	0	107	G242 V246	G242-E244 VanDerWaalsContact C-N 3.33Å; G242-E244 PolarHBondContact O-N 3.45Å; E244-V246 PolarHBondContact O-N 3.26Å; E244-V246 VanDerWaalsContact O-N 3.1Å
245	A	31.2	Very low	33.9	Very low	89 Å²	89	140 Å²	140	74%	0.736	74%	0.735	S	S	*	*			trans	-54.7	119.9	178.5	0	0	0	0	0	109.4	E243 K247	E243-A245 PolarHBondContact O-N 3.05Å; E243-A245 VanDerWaalsContact O-N 3.16Å; A245-K247 PolarHBondContact O-N 3.22Å
246	V	31.4	Very low	34.2	Very low	127 Å²	127	136.1 Å²	136.1	77%	0.77	72%	0.721	S	S	*	*			trans	-61.7	101.2	178.2	177.7	0	0	0	0	108.2	E244 L248	E244-V246 PolarHBondContact O-N 3.26Å; E244-V246 VanDerWaalsContact O-N 3.1Å; V246-L248 PolarHBondContact O-N 3.2Å
247	K	30.3	Very low	34.8	Very low	190 Å²	190	131.5 Å²	131.5	83%	0.826	71%	0.705	S	S	*	*			trans	-62.4	99.3	168.7	-73.4	-171	174.7	-169.3	0	107.6	A245 P249	A245-K247 PolarHBondContact O-N 3.22Å; K247-P249 WeakPolarHBondContact O-CD 3.42Å
248	L	29.8	Very low	34.9	Very low	149 Å²	149	125.9 Å²	125.9	78%	0.78	70%	0.696	S	S	*	*			trans	-70.3	109.9	168.7	-75	165.7	0	0	0	108.1	V246 R250	V246-L248 PolarHBondContact O-N 3.2Å; L248-R250 PolarHBondContact O-N 3.05Å
249	P	34.4	Very low	35.5	Very low	110 Å²	110	123.2 Å²	123.2	71%	0.714	68%	0.681	S	S	*	*			trans	-67.8	121.2	173.3	29.3	-32.8	0	0	0	108.5	K247 T251	K247-P249 WeakPolarHBondContact O-CD 3.42Å; P249-T251 PolarHBondContact O-N 3.18Å
250	R	38.8	Very low	35.7	Very low	217 Å²	217	129.6 Å²	129.6	82%	0.819	69%	0.691	S	S	*	*			trans	-79.2	100.3	167.8	-77.2	-177.3	170.3	171	-2.2	108.1	L248 N252	L248-R250 PolarHBondContact O-N 3.05Å; R250-N252 PolarHBondContact O-N 2.68Å; R250-N252 VanDerWaalsContact O-N 3.16Å
251	T	40.4	Very low	35.7	Very low	70 Å²	70	126 Å²	126	43%	0.429	68%	0.682	S	S	.	*			trans	-69.6	107	179.6	51.9	0	0	0	0	110.5	P249 D256	P249-T251 PolarHBondContact O-N 3.18Å; T251-D256 HydrophobicContact CG2-CB 3.92Å
252	N	40.4	Very low	35.7	Very low	114 Å²	114	123.5 Å²	123.5	61%	0.61	68%	0.676	S	S	*	*			trans	-95.2	17.2	176.5	-67.3	-24.9	0	0	0	112.8	R250	R250-N252 PolarHBondContact O-N 2.68Å; R250-N252 VanDerWaalsContact O-N 3.16Å
253	S	45.9	Very low	35.6	Very low	24 Å²	24	128.4 Å²	128.4	17%	0.168	68%	0.681	C	S	.	*	S	Bend	trans	-137.4	146	179.5	24.2	0	0	0	0	114.1	K174 E255 D256	K174-S253 PolarHBondContact NZ-OG 3.33Å; S253-E255 VanDerWaalsContact C-N 3.31Å; S253-E255 PolarHBondContact O-N 3.45Å; S253-D256 PolarHBondContact OG-OD2 3.16Å
254	L	44	Very low	35.5	Very low	65 Å²	65	124.7 Å²	124.7	34%	0.34	68%	0.677	S	S	.	*	G	3₁₀ helix	trans	-66.5	-28.8	-178.9	-127.6	140	0	0	0	113.3	D256	L254-D256 PolarHBondContact O-N 2.99Å
255	E	43.6	Very low	35.5	Very low	177 Å²	177	121.1 Å²	121.1	83%	0.827	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-67.6	-31.9	-177.9	-60.4	-175.3	152.3	0	0	113.2	S253 L257	S253-E255 VanDerWaalsContact C-N 3.31Å; S253-E255 PolarHBondContact O-N 3.45Å; E255-L257 VanDerWaalsContact C-N 3.33Å; E255-L257 PolarHBondContact O-N 3.15Å
256	D	42.8	Very low	35.1	Very low	107 Å²	107	123.3 Å²	123.3	57%	0.572	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-77.7	-15.8	-175.4	-63.4	-62	0	0	0	113.7	T251 S253 L254 G258	T251-D256 HydrophobicContact CG2-CB 3.92Å; S253-D256 PolarHBondContact OG-OD2 3.16Å; L254-D256 PolarHBondContact O-N 2.99Å; D256-G258 VanDerWaalsContact C-N 3.32Å
257	L	39	Very low	35	Very low	113 Å²	113	120.8 Å²	120.8	59%	0.592	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-86.5	0.5	179.8	-73.7	170.7	0	0	0	113.7	E255 I259	E255-L257 VanDerWaalsContact C-N 3.33Å; E255-L257 PolarHBondContact O-N 3.15Å; L257-I259 HydrophobicContact CB-CG1 4.37Å; L257-I259 PolarHBondContact O-N 2.83Å
258	G	33.6	Very low	34.9	Very low	64 Å²	64	120.5 Å²	120.5	66%	0.66	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	66.2	7.6	176.3	0	0	0	0	0	114.9	D256 K260	D256-G258 VanDerWaalsContact C-N 3.32Å; G258-K260 VanDerWaalsContact C-N 3.32Å; G258-K260 PolarHBondContact O-N 3.43Å
259	I	38.9	Very low	34.6	Very low	103 Å²	103	119.8 Å²	119.8	53%	0.528	67%	0.673	S	S	.	*			trans	-71.3	93.5	170.1	-55.8	178.1	0	0	0	106.6	L257 D261	L257-I259 HydrophobicContact CB-CG1 4.37Å; L257-I259 PolarHBondContact O-N 2.83Å; I259-D261 PolarHBondContact O-N 2.92Å; I259-D261 VanDerWaalsContact O-N 3.1Å
260	K	31.8	Very low	34.4	Very low	195 Å²	195	124.6 Å²	124.6	85%	0.848	69%	0.686	S	S	*	*			trans	-59.3	115	163.4	-71	-179	176.7	-178.6	0	107.4	G258 A262	G258-K260 VanDerWaalsContact C-N 3.32Å; G258-K260 PolarHBondContact O-N 3.43Å; K260-A262 PolarHBondContact O-N 2.8Å; K260-A262 VanDerWaalsContact O-N 3.14Å
261	D	31	Very low	34	Very low	138 Å²	138	118.6 Å²	118.6	74%	0.738	68%	0.682	S	S	*	*			trans	-49	124.5	160.2	-86.3	-35.4	0	0	0	108.1	I259 E263	I259-D261 PolarHBondContact O-N 2.92Å; I259-D261 VanDerWaalsContact O-N 3.1Å; D261-E263 PolarHBondContact O-N 2.91Å
262	A	31.7	Very low	33.5	Very low	95 Å²	95	118.6 Å²	118.6	79%	0.785	70%	0.696	S	S	*	*			trans	-61.5	115.2	171.9	0	0	0	0	0	107.3	K260 S264	K260-A262 PolarHBondContact O-N 2.8Å; K260-A262 VanDerWaalsContact O-N 3.14Å; A262-S264 PolarHBondContact O-N 3.29Å
263	E	28.9	Very low	32.9	Very low	169 Å²	169	123.2 Å²	123.2	79%	0.79	71%	0.711	S	S	*	*			trans	-46.1	111.6	-178.4	-64.8	179.6	139.2	0	0	110	D261 S265	D261-E263 PolarHBondContact O-N 2.91Å; E263-S265 PolarHBondContact O-N 3.47Å
264	S	28.9	Very low	32	Very low	120 Å²	120	128.2 Å²	128.2	84%	0.839	74%	0.74	S	S	*	*			trans	-75.9	65.9	173	46.6	0	0	0	0	110.2	A262 C266	A262-S264 PolarHBondContact O-N 3.29Å; S264-C266 PolarHBondContact O-N 2.52Å
265	S	29.4	Very low	31.6	Very low	107 Å²	107	132.7 Å²	132.7	75%	0.748	77%	0.765	S	S	*	*	S	Bend	trans	22.1	82.6	159	67.8	0	0	0	0	117	E263	E263-S265 PolarHBondContact O-N 3.47Å
266	C	22	Very low	30.9	Very low	135 Å²	135	134.1 Å²	134.1	91%	0.912	77%	0.768	S	S	*	*			trans	-146.4	46.3	149.5	-149.5	0	0	0	0	112.8	S264	S264-C266 PolarHBondContact O-N 2.52Å
267	S	28.5	Very low	30.4	Very low	74 Å²	74	134.6 Å²	134.6	52%	0.517	78%	0.78	S	S	.	*			trans	-126.4	75.4	174.6	50	0	0	0	0	111.1
268	Q	28.6	Very low	29.9	Very low	184 Å²	184	138.4 Å²	138.4	86%	0.86	79%	0.792	S	S	*	*			trans	-173.9	104.5	152	-108	158.5	79.1	0	0	113
269	T	24.4	Very low	29.9	Very low	135 Å²	135	141 Å²	141	83%	0.828	80%	0.797	S	S	*	*				173.7	71.1	116.6	32.9	0	0	0	0	111.7	A271	T269-A271 VanDerWaalsContact C-N 3.29Å; T269-A271 PolarHBondContact O-N 3.02Å
270	E	29.8	Very low	29.7	Very low	211 Å²	211	145.8 Å²	145.8	99%	0.986	81%	0.814	S	S	*	*			trans	-77	83.7	158.6	-74.1	-156.3	146.1	0	0	110
271	A	29.9	Very low	29.8	Very low	91 Å²	91	144.3 Å²	144.3	75%	0.752	81%	0.81	S	S	*	*			trans	-145.6	75	171.2	0	0	0	0	0	111.3	T269	T269-A271 VanDerWaalsContact C-N 3.29Å; T269-A271 PolarHBondContact O-N 3.02Å
272	G	30.6	Very low	29.7	Very low	70 Å²	70	142.7 Å²	142.7	72%	0.722	80%	0.801	S	S	*	*			trans	88.1	103.9	159.2	0	0	0	0	0	117.4
273	K	27.7	Very low	30.4	Very low	210 Å²	210	142.9 Å²	142.9	91%	0.913	80%	0.795	S	S	*	*			trans	-162.6	125.1	132.3	-106	149.1	-169.5	170	0	112.9
274	T	26.2	Very low	30.9	Very low	129 Å²	129	141 Å²	141	79%	0.791	79%	0.786	S	S	*	*			trans	-38.7	143.5	169.6	49.6	0	0	0	0	116.6
275	D	35.5	Very low	31.4	Very low	159 Å²	159	141.9 Å²	141.9	85%	0.85	78%	0.777	S	S	*	*			trans	4.5	108.1	153	-77.6	-49.2	0	0	0	118.1
276	K	29.6	Very low	32.2	Very low	207 Å²	207	145.4 Å²	145.4	90%	0.9	78%	0.779	S	S	*	*			trans	-139.5	114.3	133.8	-74.2	-161.5	176.7	178.7	0	110.4	K278	K276-K278 PolarHBondContact O-N 3.3Å
277	S	31.9	Very low	33.9	Very low	118 Å²	118	143.4 Å²	143.4	83%	0.825	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-58.1	118	176.4	52.7	0	0	0	0	112.4
278	K	29.8	Very low	36	Very low	193 Å²	193	146.7 Å²	146.7	84%	0.839	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-71.1	147.9	150.5	-73.6	-177.7	176.4	179.2	0	108.6	K276 K280	K276-K278 PolarHBondContact O-N 3.3Å; K278-K280 PolarHBondContact O-N 3.11Å
279	P	33.5	Very low	38.6	Very low	117 Å²	117	141 Å²	141	76%	0.76	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-60.8	137.4	174.5	-18	31	0	0	0	110.3	E281	P279-E281 PolarHBondContact O-N 3.33Å; P279-E281 VanDerWaalsContact O-N 3.14Å
280	K	33.9	Very low	41.7	Very low	204 Å²	204	134.7 Å²	134.7	89%	0.887	69%	0.692	S	S	*	*			trans	-74.7	96.9	163.8	-74.7	-179.1	174.9	179.7	0	107.7	K278	K278-K280 PolarHBondContact O-N 3.11Å
281	E	33.2	Very low	44.7	Very low	165 Å²	165	127.2 Å²	127.2	77%	0.771	66%	0.66	S	S	*	*			trans	-63	138.2	164.8	-70.9	176.1	170.1	0	0	109.2	P279	P279-E281 PolarHBondContact O-N 3.33Å; P279-E281 VanDerWaalsContact O-N 3.14Å
282	N	30.7	Very low	47.6	Very low	103 Å²	103	127.1 Å²	127.1	55%	0.551	65%	0.652	S	S	*	*			trans	-73.9	137.5	-170.8	-76.9	-42.1	0	0	0	110.6	E284 E285	N282-E284 PolarHBondContact O-N 3.07Å; N282-E285 PolarHBondContact O-N 3.36Å
283	P	44.8	Very low	50.4	Low	99 Å²	99	124.9 Å²	124.9	64%	0.643	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	2.7	173.9	28.6	-35.3	0	0	0	113.6	K287	P283-K287 WeakPolarHBondContact O-CE 3.46Å
284	E	40.2	Very low	53.1	Low	131 Å²	131	119.3 Å²	119.3	61%	0.612	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-28.9	172	-53.6	-136.3	103.2	0	0	113.1	N282 K286 K287	N282-E284 PolarHBondContact O-N 3.07Å; E284-K286 VanDerWaalsContact C-N 3.34Å; E284-K287 WeakPolarHBondContact O-CB 3.31Å; E284-K287 PolarHBondContact O-N 3.41Å; E284-K287 IonicContact OE1-NZ 2.75Å; E284-K287 PolarHBondContact OE1-NZ 3.1Å
285	E	39.9	Very low	55.8	Low	137 Å²	137	114.5 Å²	114.5	64%	0.64	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-74.3	-28	179.8	-68.9	177.8	136.9	0	0	111.6	N282 K287	N282-E285 PolarHBondContact O-N 3.36Å; E285-K287 PolarHBondContact O-N 3.38Å
286	K	45	Very low	58	Low	182 Å²	182	114.5 Å²	114.5	79%	0.791	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-65.1	-3.1	171.2	-69.1	-167.3	175.2	-171	0	115	E284	E284-K286 VanDerWaalsContact C-N 3.34Å
287	K	57.9	Low	60.4	Low	92 Å²	92	106.9 Å²	106.9	40%	0.4	55%	0.546	S	S	.	.	G	3₁₀ helix	trans	-92.7	-8.7	-174.7	-61.6	173.9	-172	163.7	0	114.7	P283 E284 E285	P283-K287 WeakPolarHBondContact O-CE 3.46Å; E284-K287 WeakPolarHBondContact O-CB 3.31Å; E284-K287 PolarHBondContact O-N 3.41Å; E284-K287 IonicContact OE1-NZ 2.75Å; E284-K287 PolarHBondContact OE1-NZ 3.1Å; E285-K287 PolarHBondContact O-N 3.38Å
288	K	72.2	Confident	62.5	Low	143 Å²	143	105.6 Å²	105.6	62%	0.622	54%	0.535	S	S	*	.			trans	-113.6	119.4	-177.5	-64.9	-176.5	-178.9	177.8	0	110.6
289	W	85.1	Confident	64.9	Low	65 Å²	65	97.1 Å²	97.1	25%	0.246	50%	0.499	C	S	.	.	S	Bend	trans	-79.5	-32.6	176.2	-64.1	98.2	0	0	0	111.9	E471 K478 H480 I481	W289-E471 PolarHBondContact N-OE1 3.09Å; W289-E471 PolarHBondContact N-OE2 3.33Å; W289-K478 HydrophobicContact CH2-CB 3.82Å; W289-K478 HydrophobicContact CZ2-CB 4.31Å; W289-K478 HydrophobicContact CZ3-CB 4.31Å; W289-K478 WeakPolarHBondContact CZ3-O 3.5Å; W289-H480 WeakPolarHBondContact O-CA 3.33Å; W289-H480 PolarHBondContact O-ND1 2.98Å; W289-I481 PolarHBondContact O-N 3.05Å
290	A	88.9	Confident	66.8	Low	3 Å²	3	99.6 Å²	99.6	3%	0.025	50%	0.501	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	122.5	178.9	0	0	0	0	0	112.7	L467 E471 I481 V483	A290-L467 HydrophobicContact CB-CD1 3.77Å; A290-E471 HydrophobicContact CB-CB 4.07Å; A290-E471 WeakPolarHBondContact CB-OE2 3.36Å; A290-E471 PolarHBondContact N-OE2 3.23Å; A290-I481 WeakPolarHBondContact CA-O 3.42Å; A290-V483 HydrophobicContact CB-CG2 4.28Å
291	V	92.1	Very high	69.1	Low	54 Å²	54	93.1 Å²	93.1	33%	0.327	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	113.3	-179.5	-177.3	0	0	0	0	109.6	I481 Y482 V483	V291-I481 PolarHBondContact N-O 2.96Å; V291-Y482 HydrophobicContact CB-CD1 3.86Å; V291-Y482 HydrophobicContact CB-CE1 3.93Å; V291-Y482 HydrophobicContact CG1-CD1 4.04Å; V291-Y482 HydrophobicContact CG1-CE1 3.96Å; V291-Y482 HydrophobicContact CG2-CE1 4.36Å; V291-Y482 WeakPolarHBondContact O-CA 3.39Å; V291-V483 PolarHBondContact O-N 3.18Å
292	P	91.3	Very high	71.6	Confident	88 Å²	88	85.6 Å²	85.6	57%	0.571	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.7	131.6	173.9	29.5	-32.3	0	0	0	110.4	L467	P292-L467 HydrophobicContact CB-CD1 4.35Å; P292-L467 HydrophobicContact CG-CD1 4.38Å
293	V	88.8	Confident	74.2	Confident	23 Å²	23	87.4 Å²	87.4	14%	0.139	44%	0.441	C	S	.	.			trans	-97.4	127.5	179	-178.5	0	0	0	0	110.2	I295 Q323 Y482 V483 I484	V293-I295 PolarHBondContact O-N 3.09Å; V293-Q323 HydrophobicContact CG1-CB 4.12Å; V293-Q323 HydrophobicContact CG1-CG 4.12Å; V293-Y482 HydrophobicContact CG2-CD1 3.88Å; V293-Y482 HydrophobicContact CG2-CG 4.38Å; V293-V483 PolarHBondContact N-O 3.29Å; V293-I484 HydrophobicContact CB-CG1 4.03Å; V293-I484 HydrophobicContact CG2-CG1 3.95Å
294	D	85	Confident	76.2	Confident	94 Å²	94	90.6 Å²	90.6	50%	0.503	44%	0.444	S	S	.	.			trans	-76.8	109.5	174.5	-178.9	19.8	0	0	0	112	L296 S297	D294-L296 VanDerWaalsContact C-N 3.35Å; D294-L296 VanDerWaalsContact OD1-CB 3.29Å; D294-L296 WeakPolarHBondContact OD1-CB 3.3Å; D294-L296 PolarHBondContact OD1-N 3.19Å; D294-S297 PolarHBondContact O-OG 2.79Å
295	I	82.7	Confident	78.3	Confident	27 Å²	27	92.4 Å²	92.4	14%	0.138	45%	0.445	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-15.4	-179.6	-65.1	163	0	0	0	112.3	V293 S297 T319 F320 I484 S485	V293-I295 PolarHBondContact O-N 3.09Å; I295-S297 VanDerWaalsContact C-N 3.25Å; I295-S297 PolarHBondContact O-N 3.07Å; I295-T319 WeakPolarHBondContact CG2-OG1 3.42Å; I295-T319 PolarHBondContact O-OG1 3.17Å; I295-F320 HydrophobicContact CD1-CB 3.98Å; I295-F320 HydrophobicContact CG1-CB 4.09Å; I295-F320 HydrophobicContact CG2-CB 3.95Å; I295-I484 HydrophobicContact CD1-CG2 3.72Å; I295-I484 HydrophobicContact CG1-CG2 4.13Å; I295-S485 WeakPolarHBondContact CD1-O 3.44Å
296	L	81.1	Confident	80.5	Confident	159 Å²	159	86.3 Å²	86.3	83%	0.832	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-25.6	174.9	-59.4	176.1	0	0	0	111.5	D294 P298	D294-L296 VanDerWaalsContact C-N 3.35Å; D294-L296 VanDerWaalsContact OD1-CB 3.29Å; D294-L296 WeakPolarHBondContact OD1-CB 3.3Å; D294-L296 PolarHBondContact OD1-N 3.19Å; L296-P298 WeakPolarHBondContact O-CD 3.1Å
297	S	80.7	Confident	82.2	Confident	48 Å²	48	82.2 Å²	82.2	34%	0.336	41%	0.409	S	S	.	.	S	Bend	trans	-69.4	118.9	174.7	72.4	0	0	0	0	111.6	D294 I295	D294-S297 PolarHBondContact O-OG 2.79Å; I295-S297 VanDerWaalsContact C-N 3.25Å; I295-S297 PolarHBondContact O-N 3.07Å
298	P	76.8	Confident	83.6	Confident	91 Å²	91	84 Å²	84	59%	0.591	42%	0.423	S	S	*	.			trans	-73.7	133.5	177.6	29.5	-33.5	0	0	0	110.8	L296 E300	L296-P298 WeakPolarHBondContact O-CD 3.1Å; P298-E300 HydrophobicContact CB-CG 4.46Å; P298-E300 PolarHBondContact O-N 2.92Å
299	C	78.6	Confident	84.3	Confident	14 Å²	14	78.2 Å²	78.2	10%	0.095	40%	0.4	C	S	.	.			trans	-99	75	178.7	-176.1	0	0	0	0	111.3	K322 L326	C299-K322 HydrophobicContact CB-CB 4.44Å; C299-L326 WeakPolarHBondContact SG-CD1 3.42Å
300	E	74.4	Confident	84.5	Confident	170 Å²	170	76.6 Å²	76.6	79%	0.794	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-33.2	-178.8	-60.9	-173.2	176.3	0	0	112.8	P298 F302	P298-E300 HydrophobicContact CB-CG 4.46Å; P298-E300 PolarHBondContact O-N 2.92Å; E300-F302 PolarHBondContact O-N 3.24Å; E300-F302 VanDerWaalsContact O-N 3.11Å
301	D	82.6	Confident	84.7	Confident	67 Å²	67	79 Å²	79	36%	0.358	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	10.9	179.9	-70.3	-35.7	0	0	0	114.7	Y303 K304 R305	D301-Y303 PolarHBondContact O-N 3.27Å; D301-K304 HydrophobicContact CB-CD 4.43Å; D301-K304 WeakPolarHBondContact O-CB 3.39Å; D301-K304 PolarHBondContact O-N 2.94Å; D301-K304 WeakPolarHBondContact OD1-CD 3.38Å; D301-K304 WeakPolarHBondContact OD1-CE 3.33Å; D301-K304 IonicContact OD1-NZ 2.69Å; D301-K304 PolarHBondContact OD1-NZ 3.1Å; D301-R305 PolarHBondContact O-N 3.17Å
302	F	84.3	Confident	84.5	Confident	7 Å²	7	83.7 Å²	83.7	3%	0.031	43%	0.427	C	S	.	.	H	α-helix	trans	-51.1	-52.7	-173.5	-179.9	-101.4	0	0	0	113	E300 K304 R305 I306 L317 K322 V325 L326	E300-F302 PolarHBondContact O-N 3.24Å; E300-F302 VanDerWaalsContact O-N 3.11Å; F302-K304 VanDerWaalsContact C-N 3.27Å; F302-K304 PolarHBondContact O-N 2.93Å; F302-R305 PolarHBondContact O-N 3.28Å; F302-I306 HydrophobicContact CE2-CD1 3.85Å; F302-I306 HydrophobicContact CZ-CD1 4.09Å; F302-I306 PolarHBondContact O-N 3.06Å; F302-L317 HydrophobicContact CZ-CD1 4.39Å; F302-K322 HydrophobicContact CB-CD 4.37Å; F302-K322 HydrophobicContact CD1-CG 4.47Å; F302-K322 HydrophobicContact CD2-CB 3.69Å; F302-K322 HydrophobicContact CD2-CG 3.99Å; F302-K322 HydrophobicContact CE2-CB 3.96Å; F302-K322 HydrophobicContact CE2-CG 4.23Å; F302-K322 WeakPolarHBondContact CE2-O 3.36Å; F302-K322 HydrophobicContact CG-CB 4.26Å; F302-K322 HydrophobicContact CG-CD 4.32Å; F302-K322 HydrophobicContact CG-CG 4.12Å; F302-V325 HydrophobicContact CE2-CB 4.08Å; F302-V325 HydrophobicContact CE2-CG1 3.92Å; F302-V325 HydrophobicContact CZ-CB 4.2Å; F302-V325 HydrophobicContact CZ-CG1 3.75Å; F302-L326 HydrophobicContact CD2-CD1 4.08Å; F302-L326 HydrophobicContact CD2-CD2 4.4Å; F302-L326 HydrophobicContact CD2-CG 3.95Å; F302-L326 HydrophobicContact CE2-CG 4.12Å
303	Y	85.4	Confident	84.5	Confident	142 Å²	142	81.5 Å²	81.5	56%	0.557	41%	0.407	S	S	*	.	H	α-helix	trans	-73.8	-13.1	179.7	-60.8	-71.4	0	0	0	114.3	D301	D301-Y303 PolarHBondContact O-N 3.27Å
304	K	86.3	Confident	84.6	Confident	165 Å²	165	86.7 Å²	86.7	72%	0.717	44%	0.441	S	S	*	.	H	α-helix	trans	-81.5	-36.9	170.7	-58.4	-178.8	-165.5	156.2	0	111.1	D301 F302	D301-K304 HydrophobicContact CB-CD 4.43Å; D301-K304 WeakPolarHBondContact O-CB 3.39Å; D301-K304 PolarHBondContact O-N 2.94Å; D301-K304 WeakPolarHBondContact OD1-CD 3.38Å; D301-K304 WeakPolarHBondContact OD1-CE 3.33Å; D301-K304 IonicContact OD1-NZ 2.69Å; D301-K304 PolarHBondContact OD1-NZ 3.1Å; F302-K304 VanDerWaalsContact C-N 3.27Å; F302-K304 PolarHBondContact O-N 2.93Å
305	R	84.6	Confident	84.8	Confident	169 Å²	169	87 Å²	87	64%	0.638	44%	0.438	S	S	*	.	H	α-helix	trans	-75.3	-38.5	177.6	-66.3	-177	-174.9	-162.8	1.8	112.1	D301 F302 P307 L326	D301-R305 PolarHBondContact O-N 3.17Å; F302-R305 PolarHBondContact O-N 3.28Å; R305-P307 WeakPolarHBondContact O-CD 3.46Å; R305-L326 HydrophobicContact CB-CD2 3.75Å; R305-L326 HydrophobicContact CG-CD2 4.48Å
306	I	87.1	Confident	85.1	Confident	10 Å²	10	92.3 Å²	92.3	5%	0.051	46%	0.462	C	S	.	.			trans	-117.9	87.2	176.5	-53.3	169.5	0	0	0	108.9	F302 P309 V325 L326 E329	F302-I306 HydrophobicContact CE2-CD1 3.85Å; F302-I306 HydrophobicContact CZ-CD1 4.09Å; F302-I306 PolarHBondContact O-N 3.06Å; I306-P309 HydrophobicContact CG2-CB 3.83Å; I306-V325 HydrophobicContact CD1-CG1 3.78Å; I306-L326 HydrophobicContact CD1-CD2 3.71Å; I306-L326 HydrophobicContact CD1-CG 4.18Å; I306-L326 HydrophobicContact CG1-CD2 3.87Å; I306-E329 HydrophobicContact CD1-CB 4.44Å; I306-E329 HydrophobicContact CD1-CG 3.86Å; I306-E329 HydrophobicContact CG1-CG 4.2Å; I306-E329 HydrophobicContact CG2-CG 4.42Å
307	P	80.3	Confident	85.5	Confident	95 Å²	95	85.2 Å²	85.2	62%	0.617	43%	0.425	S	S	*	.	S	Bend	trans	-70.5	-35	179.2	26.6	-33.7	0	0	0	112.6	R305 P309	R305-P307 WeakPolarHBondContact O-CD 3.46Å; P307-P309 WeakPolarHBondContact O-CD 3.43Å
308	N	86.7	Confident	86	Confident	130 Å²	130	85.8 Å²	85.8	70%	0.695	43%	0.425	S	S	*	.	S	Bend	trans	-120.2	76.8	-179.7	-73.2	-26.4	0	0	0	110.6
309	P	87.5	Confident	86.7	Confident	21 Å²	21	84 Å²	84	14%	0.136	41%	0.412	C	S	.	.			trans	-67	142.4	178.5	28.4	-35.3	0	0	0	111.1	I306 P307 F311 K312 Y350	I306-P309 HydrophobicContact CG2-CB 3.83Å; P307-P309 WeakPolarHBondContact O-CD 3.43Å; P309-F311 VanDerWaalsContact C-N 3.25Å; P309-F311 PolarHBondContact O-N 3.01Å; P309-K312 HydrophobicContact CG-CD 4.49Å; P309-K312 HydrophobicContact CG-CG 3.99Å; P309-Y350 WeakPolarHBondContact CA-OH 3.39Å; P309-Y350 HydrophobicContact CB-CE2 4.12Å
310	A	89.5	Confident	87.3	Confident	31 Å²	31	83.9 Å²	83.9	26%	0.256	41%	0.41	S	S	.	.	S	Bend	trans	-61.7	-32.2	-177.9	0	0	0	0	0	113	Y350 A353 L354 K357	A310-Y350 HydrophobicContact CB-CE1 4.27Å; A310-Y350 HydrophobicContact CB-CE2 4.16Å; A310-Y350 PolarHBondContact N-OH 2.7Å; A310-A353 HydrophobicContact CB-CB 4.05Å; A310-L354 HydrophobicContact CB-CB 4.41Å; A310-L354 HydrophobicContact CB-CD1 4.4Å; A310-K357 HydrophobicContact CB-CD 4.25Å
311	F	92.1	Very high	88.1	Confident	54 Å²	54	75.8 Å²	75.8	24%	0.237	37%	0.372	C	S	.	.			trans	-136.4	151.4	176.3	-161.7	-101.3	0	0	0	111.5	P309 W313 Y350 A353 T382 F383	P309-F311 VanDerWaalsContact C-N 3.25Å; P309-F311 PolarHBondContact O-N 3.01Å; F311-W313 AromaticContact CD1-CD2 3.85Å; F311-W313 HydrophobicContact CD1-CD2 3.85Å; F311-W313 AromaticContact CD1-CE2 3.51Å; F311-W313 HydrophobicContact CD1-CE3 4.35Å; F311-W313 HydrophobicContact CD1-CG 4.28Å; F311-W313 HydrophobicContact CD1-CH2 4.38Å; F311-W313 AromaticContact CD1-CZ2 3.8Å; F311-W313 HydrophobicContact CD1-CZ2 3.8Å; F311-W313 AromaticContact CD1-NE1 3.71Å; F311-W313 AromaticContact CE1-CD1 3.85Å; F311-W313 HydrophobicContact CE1-CD2 4.29Å; F311-W313 AromaticContact CE1-CE2 3.93Å; F311-W313 HydrophobicContact CE1-CG 4.27Å; F311-W313 AromaticContact CE1-NE1 3.61Å; F311-Y350 HydrophobicContact CB-CD2 4.29Å; F311-A353 HydrophobicContact CB-CB 3.82Å; F311-A353 HydrophobicContact CD2-CB 4.29Å; F311-A353 HydrophobicContact CG-CB 4.45Å; F311-T382 HydrophobicContact CE2-CG2 4.14Å; F311-T382 HydrophobicContact CZ-CG2 3.79Å; F311-F383 AromaticContact CD2-CE1 3.88Å; F311-F383 HydrophobicContact CD2-CE1 3.88Å; F311-F383 AromaticContact CE2-CE1 3.79Å; F311-F383 HydrophobicContact CE2-CE1 3.79Å; F311-F383 HydrophobicContact CE2-CZ 4.37Å
312	K	89.8	Confident	88.6	Confident	153 Å²	153	73.6 Å²	73.6	67%	0.665	36%	0.359	S	S	*	.			trans	-130.9	125.4	-179.6	-67.4	-178.7	-178.9	177.1	0	110.3	P309	P309-K312 HydrophobicContact CG-CD 4.49Å; P309-K312 HydrophobicContact CG-CG 3.99Å
313	W	90.8	Very high	88.9	Confident	41 Å²	41	74.3 Å²	74.3	16%	0.155	36%	0.363	C	S	.	.			trans	-96.4	155.9	178.2	-63.9	-91.1	0	0	0	112	F311 F315 L317 V346 E349 Y350	F311-W313 AromaticContact CD1-CD2 3.85Å; F311-W313 HydrophobicContact CD1-CD2 3.85Å; F311-W313 AromaticContact CD1-CE2 3.51Å; F311-W313 HydrophobicContact CD1-CE3 4.35Å; F311-W313 HydrophobicContact CD1-CG 4.28Å; F311-W313 HydrophobicContact CD1-CH2 4.38Å; F311-W313 AromaticContact CD1-CZ2 3.8Å; F311-W313 HydrophobicContact CD1-CZ2 3.8Å; F311-W313 AromaticContact CD1-NE1 3.71Å; F311-W313 AromaticContact CE1-CD1 3.85Å; F311-W313 HydrophobicContact CE1-CD2 4.29Å; F311-W313 AromaticContact CE1-CE2 3.93Å; F311-W313 HydrophobicContact CE1-CG 4.27Å; F311-W313 AromaticContact CE1-NE1 3.61Å; W313-F315 HydrophobicContact CB-CD1 4.17Å; W313-F315 HydrophobicContact CB-CD2 4.44Å; W313-F315 HydrophobicContact CB-CE1 3.94Å; W313-F315 HydrophobicContact CB-CE2 4.22Å; W313-F315 HydrophobicContact CB-CG 4.41Å; W313-F315 HydrophobicContact CB-CZ 3.95Å; W313-F315 AromaticContact CD1-CE1 3.83Å; W313-F315 AromaticContact CD1-CZ 3.6Å; W313-F315 HydrophobicContact CG-CE1 4.16Å; W313-F315 HydrophobicContact CG-CE2 4.33Å; W313-F315 AromaticContact CG-CZ 3.86Å; W313-F315 HydrophobicContact CG-CZ 3.86Å; W313-F315 PolarHBondContact O-N 2.84Å; W313-L317 HydrophobicContact CD2-CD2 3.97Å; W313-L317 HydrophobicContact CE3-CD1 3.96Å; W313-L317 HydrophobicContact CE3-CD2 3.72Å; W313-L317 HydrophobicContact CE3-CG 4.18Å; W313-L317 HydrophobicContact CG-CD2 4.38Å; W313-L317 HydrophobicContact CH2-CD1 4.43Å; W313-L317 HydrophobicContact CZ3-CD1 3.68Å; W313-L317 HydrophobicContact CZ3-CD2 4.14Å; W313-L317 HydrophobicContact CZ3-CG 4.39Å; W313-V346 HydrophobicContact CD2-CG1 4.48Å; W313-V346 HydrophobicContact CH2-CG1 3.65Å; W313-V346 HydrophobicContact CZ2-CB 4.15Å; W313-V346 HydrophobicContact CZ2-CG1 3.49Å; W313-V346 VanDerWaalsContact CZ2-CG1 3.49Å; W313-V346 WeakPolarHBondContact CZ2-O 3.49Å; W313-V346 HydrophobicContact CZ3-CG1 4.29Å; W313-E349 HydrophobicContact CZ2-CB 4.16Å; W313-E349 PolarHBondContact NE1-OE2 3.4Å; W313-Y350 AromaticContact CH2-CD2 3.56Å; W313-Y350 HydrophobicContact CH2-CD2 3.56Å; W313-Y350 HydrophobicContact CH2-CG 4.24Å; W313-Y350 AromaticContact CZ3-CD2 3.98Å; W313-Y350 HydrophobicContact CZ3-CD2 3.98Å
314	P	90.5	Very high	89.3	Confident	133 Å²	133	67.5 Å²	67.5	86%	0.864	34%	0.336	S	S	*	.	S	Bend	trans	-78.2	1.2	175.2	33.1	-36.4	0	0	0	113.8
315	F	89.5	Confident	89.7	Confident	101 Å²	101	59.7 Å²	59.7	44%	0.443	30%	0.302	S	S	.	.	S	Bend	trans	-127.1	156.1	179.6	57.6	-97	0	0	0	110.6	W313 L317 V346	W313-F315 HydrophobicContact CB-CD1 4.17Å; W313-F315 HydrophobicContact CB-CD2 4.44Å; W313-F315 HydrophobicContact CB-CE1 3.94Å; W313-F315 HydrophobicContact CB-CE2 4.22Å; W313-F315 HydrophobicContact CB-CG 4.41Å; W313-F315 HydrophobicContact CB-CZ 3.95Å; W313-F315 AromaticContact CD1-CE1 3.83Å; W313-F315 AromaticContact CD1-CZ 3.6Å; W313-F315 HydrophobicContact CG-CE1 4.16Å; W313-F315 HydrophobicContact CG-CE2 4.33Å; W313-F315 AromaticContact CG-CZ 3.86Å; W313-F315 HydrophobicContact CG-CZ 3.86Å; W313-F315 PolarHBondContact O-N 2.84Å; F315-L317 HydrophobicContact CD2-CD2 4.35Å; F315-L317 HydrophobicContact CE2-CD2 3.82Å; F315-V346 HydrophobicContact CE2-CG2 4.26Å; F315-V346 HydrophobicContact CZ-CG2 4.05Å
316	E	88.8	Confident	90	Very high	137 Å²	137	52.8 Å²	52.8	64%	0.64	28%	0.278	S	S	*	.	P	Polyproline II helix	trans	-74	136	174.3	-168.5	-179.5	175.9	0	0	111.2	K322	E316-K322 IonicContact OE1-NZ 2.67Å; E316-K322 PolarHBondContact OE1-NZ 3.3Å
317	L	90.4	Very high	90.3	Very high	10 Å²	10	55.9 Å²	55.9	5%	0.052	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-74	140.6	178.3	-60.4	-172.4	0	0	0	112.7	F302 W313 F315 Q321 K322 V346	F302-L317 HydrophobicContact CZ-CD1 4.39Å; W313-L317 HydrophobicContact CD2-CD2 3.97Å; W313-L317 HydrophobicContact CE3-CD1 3.96Å; W313-L317 HydrophobicContact CE3-CD2 3.72Å; W313-L317 HydrophobicContact CE3-CG 4.18Å; W313-L317 HydrophobicContact CG-CD2 4.38Å; W313-L317 HydrophobicContact CH2-CD1 4.43Å; W313-L317 HydrophobicContact CZ3-CD1 3.68Å; W313-L317 HydrophobicContact CZ3-CD2 4.14Å; W313-L317 HydrophobicContact CZ3-CG 4.39Å; F315-L317 HydrophobicContact CD2-CD2 4.35Å; F315-L317 HydrophobicContact CE2-CD2 3.82Å; L317-Q321 HydrophobicContact CB-CB 4.13Å; L317-K322 HydrophobicContact CB-CG 3.77Å; L317-K322 WeakPolarHBondContact O-CE 3.43Å; L317-V346 HydrophobicContact CD1-CG1 4.39Å; L317-V346 HydrophobicContact CD2-CG1 3.69Å
318	D	90.2	Very high	90.9	Very high	61 Å²	61	51.4 Å²	51.4	33%	0.326	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-63.4	154.8	170.8	-69.7	-55.3	0	0	0	110.9	F320 Q321 K322 R713	D318-F320 VanDerWaalsContact C-N 3.29Å; D318-F320 HydrophobicContact CB-CD1 3.63Å; D318-F320 HydrophobicContact CB-CE1 3.56Å; D318-F320 PolarHBondContact O-N 3.34Å; D318-Q321 HydrophobicContact CB-CG 4.26Å; D318-Q321 WeakPolarHBondContact O-CB 3.17Å; D318-Q321 PolarHBondContact O-N 3.25Å; D318-K322 PolarHBondContact O-N 3.25Å; D318-R713 IonicContact OD1-NH2 3.69Å; D318-R713 IonicContact OD2-CZ 3.82Å; D318-R713 IonicContact OD2-NH1 2.72Å; D318-R713 IonicContact OD2-NH2 2.61Å; D318-R713 PolarHBondContact OD2-NH2 3.45Å
319	T	90.6	Very high	91.1	Very high	53 Å²	53	48.1 Å²	48.1	33%	0.325	24%	0.24	S	C	.	.	H	α-helix	trans	-56.2	-41.3	-175.5	54.1	0	0	0	0	113	I295 Q321 K322 Q323	I295-T319 WeakPolarHBondContact CG2-OG1 3.42Å; I295-T319 PolarHBondContact O-OG1 3.17Å; T319-Q321 VanDerWaalsContact C-N 3.3Å; T319-Q321 PolarHBondContact O-N 3.4Å; T319-K322 PolarHBondContact O-N 3.06Å; T319-Q323 WeakPolarHBondContact O-CG 3.39Å; T319-Q323 PolarHBondContact O-N 3.47Å
320	F	91.6	Very high	91.3	Very high	11 Å²	11	49.9 Å²	49.9	5%	0.048	26%	0.257	C	S	.	.	H	α-helix	trans	-65	-31.5	177.4	84.2	-88.3	0	0	0	113	I295 D318 A324 V336 A338 A342 I484 T486	I295-F320 HydrophobicContact CD1-CB 3.98Å; I295-F320 HydrophobicContact CG1-CB 4.09Å; I295-F320 HydrophobicContact CG2-CB 3.95Å; D318-F320 VanDerWaalsContact C-N 3.29Å; D318-F320 HydrophobicContact CB-CD1 3.63Å; D318-F320 HydrophobicContact CB-CE1 3.56Å; D318-F320 PolarHBondContact O-N 3.34Å; F320-A324 WeakPolarHBondContact O-CB 3.46Å; F320-A324 PolarHBondContact O-N 2.9Å; F320-V336 HydrophobicContact CD2-CG1 4.11Å; F320-V336 HydrophobicContact CE2-CG1 4.01Å; F320-A338 HydrophobicContact CE2-CB 4.46Å; F320-A342 HydrophobicContact CZ-CB 4.47Å; F320-I484 HydrophobicContact CB-CG2 3.74Å; F320-I484 HydrophobicContact CD2-CG2 4.29Å; F320-T486 HydrophobicContact CD1-CG2 4.06Å; F320-T486 HydrophobicContact CD2-CG2 4.28Å; F320-T486 HydrophobicContact CE1-CG2 4.25Å; F320-T486 HydrophobicContact CE2-CG2 4.47Å; F320-T486 HydrophobicContact CG-CG2 4.07Å; F320-T486 HydrophobicContact CZ-CG2 4.46Å
321	Q	92.7	Very high	91.3	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-73.1	-44	175.9	-64.6	171.7	-32.3	0	0	110.7	L317 D318 T319 Q323 A324 V325 G343 V346	L317-Q321 HydrophobicContact CB-CB 4.13Å; D318-Q321 HydrophobicContact CB-CG 4.26Å; D318-Q321 WeakPolarHBondContact O-CB 3.17Å; D318-Q321 PolarHBondContact O-N 3.25Å; T319-Q321 VanDerWaalsContact C-N 3.3Å; T319-Q321 PolarHBondContact O-N 3.4Å; Q321-Q323 VanDerWaalsContact C-N 3.33Å; Q321-Q323 PolarHBondContact O-N 3.37Å; Q321-A324 PolarHBondContact O-N 2.87Å; Q321-V325 WeakPolarHBondContact O-CG2 3.16Å; Q321-V325 PolarHBondContact O-N 3.22Å; Q321-G343 PolarHBondContact NE2-O 2.9Å; Q321-V346 HydrophobicContact CB-CG1 4.18Å; Q321-V346 HydrophobicContact CG-CB 4.46Å; Q321-V346 HydrophobicContact CG-CG1 4.25Å
322	K	91.9	Very high	91.4	Very high	20 Å²	20	51.4 Å²	51.4	9%	0.087	26%	0.26	C	S	.	.	H	α-helix	trans	-58	-44.4	174.1	-69	176.1	176.8	165.8	0	111.5	C299 F302 E316 L317 D318 T319 V325 L326	C299-K322 HydrophobicContact CB-CB 4.44Å; F302-K322 HydrophobicContact CB-CD 4.37Å; F302-K322 HydrophobicContact CD1-CG 4.47Å; F302-K322 HydrophobicContact CD2-CB 3.69Å; F302-K322 HydrophobicContact CD2-CG 3.99Å; F302-K322 HydrophobicContact CE2-CB 3.96Å; F302-K322 HydrophobicContact CE2-CG 4.23Å; F302-K322 WeakPolarHBondContact CE2-O 3.36Å; F302-K322 HydrophobicContact CG-CB 4.26Å; F302-K322 HydrophobicContact CG-CD 4.32Å; F302-K322 HydrophobicContact CG-CG 4.12Å; E316-K322 IonicContact OE1-NZ 2.67Å; E316-K322 PolarHBondContact OE1-NZ 3.3Å; L317-K322 HydrophobicContact CB-CG 3.77Å; L317-K322 WeakPolarHBondContact O-CE 3.43Å; D318-K322 PolarHBondContact O-N 3.25Å; T319-K322 PolarHBondContact O-N 3.06Å; K322-V325 PolarHBondContact O-N 2.84Å; K322-L326 WeakPolarHBondContact O-CG 3.3Å; K322-L326 PolarHBondContact O-N 3.43Å; K322-L326 VanDerWaalsContact O-N 3.1Å
323	Q	91.5	Very high	91.6	Very high	22 Å²	22	44.4 Å²	44.4	10%	0.103	23%	0.23	C	C	.	.	H	α-helix	trans	-63.8	-42.5	175.9	-69.7	-70	0.3	0	0	112.3	V293 T319 Q321 L326 R327	V293-Q323 HydrophobicContact CG1-CB 4.12Å; V293-Q323 HydrophobicContact CG1-CG 4.12Å; T319-Q323 WeakPolarHBondContact O-CG 3.39Å; T319-Q323 PolarHBondContact O-N 3.47Å; Q321-Q323 VanDerWaalsContact C-N 3.33Å; Q321-Q323 PolarHBondContact O-N 3.37Å; Q323-L326 PolarHBondContact O-N 2.93Å; Q323-R327 WeakPolarHBondContact O-CG 3.38Å; Q323-R327 PolarHBondContact O-N 3.48Å
324	A	93.3	Very high	91.8	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61.5	-47.2	176.4	0	0	0	0	0	112	F320 Q321 L326 R327 L328 V336 V347 I484	F320-A324 WeakPolarHBondContact O-CB 3.46Å; F320-A324 PolarHBondContact O-N 2.9Å; Q321-A324 PolarHBondContact O-N 2.87Å; A324-L326 VanDerWaalsContact C-N 3.32Å; A324-L326 PolarHBondContact O-N 3.33Å; A324-R327 PolarHBondContact O-N 3Å; A324-L328 WeakPolarHBondContact O-CG 3.27Å; A324-L328 PolarHBondContact O-N 3.04Å; A324-V336 HydrophobicContact CB-CG2 4.39Å; A324-V347 HydrophobicContact CB-CG1 4.14Å; A324-V347 HydrophobicContact CB-CG2 3.82Å; A324-I484 VanDerWaalsContact CA-CD1 3.5Å; A324-I484 HydrophobicContact CB-CD1 3.66Å
325	V	93.6	Very high	92.1	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61.5	-37.6	179.1	169.5	0	0	0	0	112.3	F302 I306 Q321 K322 R327 L328 E329 Y350	F302-V325 HydrophobicContact CE2-CB 4.08Å; F302-V325 HydrophobicContact CE2-CG1 3.92Å; F302-V325 HydrophobicContact CZ-CB 4.2Å; F302-V325 HydrophobicContact CZ-CG1 3.75Å; I306-V325 HydrophobicContact CD1-CG1 3.78Å; Q321-V325 WeakPolarHBondContact O-CG2 3.16Å; Q321-V325 PolarHBondContact O-N 3.22Å; K322-V325 PolarHBondContact O-N 2.84Å; V325-R327 VanDerWaalsContact C-N 3.27Å; V325-R327 PolarHBondContact O-N 3Å; V325-L328 PolarHBondContact O-N 3.35Å; V325-E329 PolarHBondContact O-N 2.93Å; V325-E329 VanDerWaalsContact O-N 3.09Å; V325-Y350 HydrophobicContact CG1-CD1 3.91Å; V325-Y350 HydrophobicContact CG1-CD2 3.97Å; V325-Y350 HydrophobicContact CG1-CE1 3.67Å; V325-Y350 HydrophobicContact CG1-CE2 3.68Å; V325-Y350 HydrophobicContact CG1-CG 4.05Å; V325-Y350 HydrophobicContact CG2-CD1 4.29Å; V325-Y350 HydrophobicContact CG2-CD2 4.11Å; V325-Y350 HydrophobicContact CG2-CG 3.89Å
326	L	92.1	Very high	92.4	Very high	24 Å²	24	31.3 Å²	31.3	13%	0.126	16%	0.161	C	C	.	.	H	α-helix	trans	-63.2	-29.5	174.2	-78.4	166.8	0	0	0	113.9	C299 F302 R305 I306 K322 Q323 A324	C299-L326 WeakPolarHBondContact SG-CD1 3.42Å; F302-L326 HydrophobicContact CD2-CD1 4.08Å; F302-L326 HydrophobicContact CD2-CD2 4.4Å; F302-L326 HydrophobicContact CD2-CG 3.95Å; F302-L326 HydrophobicContact CE2-CG 4.12Å; R305-L326 HydrophobicContact CB-CD2 3.75Å; R305-L326 HydrophobicContact CG-CD2 4.48Å; I306-L326 HydrophobicContact CD1-CD2 3.71Å; I306-L326 HydrophobicContact CD1-CG 4.18Å; I306-L326 HydrophobicContact CG1-CD2 3.87Å; K322-L326 WeakPolarHBondContact O-CG 3.3Å; K322-L326 PolarHBondContact O-N 3.43Å; K322-L326 VanDerWaalsContact O-N 3.1Å; Q323-L326 PolarHBondContact O-N 2.93Å; A324-L326 VanDerWaalsContact C-N 3.32Å; A324-L326 PolarHBondContact O-N 3.33Å
327	R	92.6	Very high	92.6	Very high	76 Å²	76	24.8 Å²	24.8	29%	0.287	13%	0.13	S	C	.	.	H	α-helix	trans	-81.2	-36.2	175.9	-62.2	-60.3	172.5	176	1.1	111.9	Q323 A324 V325 A330 H331 D332 V334 Y482	Q323-R327 WeakPolarHBondContact O-CG 3.38Å; Q323-R327 PolarHBondContact O-N 3.48Å; A324-R327 PolarHBondContact O-N 3Å; V325-R327 VanDerWaalsContact C-N 3.27Å; V325-R327 PolarHBondContact O-N 3Å; R327-A330 CarbonylContact O-C 3.56Å; R327-A330 WeakPolarHBondContact O-CA 3.48Å; R327-A330 WeakPolarHBondContact O-CB 3.5Å; R327-A330 PolarHBondContact O-N 3.34Å; R327-A330 VanDerWaalsContact O-N 3.07Å; R327-H331 PolarHBondContact O-N 2.95Å; R327-D332 HydrophobicContact CB-CB 4.1Å; R327-D332 IonicContact NH1-OD2 3.98Å; R327-D332 WeakPolarHBondContact O-CB 3.32Å; R327-D332 PolarHBondContact O-N 3.13Å; R327-V334 HydrophobicContact CB-CG1 3.62Å; R327-Y482 HydrophobicContact CG-CD1 4.37Å; R327-Y482 HydrophobicContact CG-CD2 4.28Å; R327-Y482 HydrophobicContact CG-CG 4.01Å; R327-Y482 VanDerWaalsContact NH1-CE1 3.33Å; R327-Y482 VanDerWaalsContact NH1-CZ 3.3Å; R327-Y482 PolarHBondContact NH1-OH 3.37Å; R327-Y482 VanDerWaalsContact NH1-OH 3.11Å
328	L	93	Very high	92.6	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-62.3	-42.7	173.5	-65.4	179.3	0	0	0	112.7	A324 V325 A330 H331 V334 V347 Y350 A351 L354 W425 I457	A324-L328 WeakPolarHBondContact O-CG 3.27Å; A324-L328 PolarHBondContact O-N 3.04Å; V325-L328 PolarHBondContact O-N 3.35Å; L328-A330 PolarHBondContact O-N 3.07Å; L328-H331 PolarHBondContact O-N 3.46Å; L328-V334 HydrophobicContact CD2-CG1 4.35Å; L328-V334 HydrophobicContact CD2-CG2 3.86Å; L328-V334 HydrophobicContact CG-CG2 4.5Å; L328-V347 HydrophobicContact CD1-CG1 3.92Å; L328-Y350 HydrophobicContact CB-CD1 4.38Å; L328-Y350 HydrophobicContact CD1-CD1 4.26Å; L328-A351 HydrophobicContact CD1-CB 4.3Å; L328-L354 HydrophobicContact CB-CD2 4.38Å; L328-L354 WeakPolarHBondContact O-CD2 3.44Å; L328-W425 HydrophobicContact CD2-CE3 4.19Å; L328-W425 HydrophobicContact CD2-CH2 3.6Å; L328-W425 HydrophobicContact CD2-CZ2 4.27Å; L328-W425 HydrophobicContact CD2-CZ3 3.53Å; L328-I457 HydrophobicContact CD1-CD1 4.38Å; L328-I457 HydrophobicContact CD2-CD1 3.6Å; L328-I457 HydrophobicContact CD2-CG1 3.91Å
329	E	91.9	Very high	92.4	Very high	61 Å²	61	22 Å²	22	29%	0.285	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-20.2	173.1	-74.2	-75.5	167.7	0	0	113.3	I306 V325 H331 Y350 K357	I306-E329 HydrophobicContact CD1-CB 4.44Å; I306-E329 HydrophobicContact CD1-CG 3.86Å; I306-E329 HydrophobicContact CG1-CG 4.2Å; I306-E329 HydrophobicContact CG2-CG 4.42Å; V325-E329 PolarHBondContact O-N 2.93Å; V325-E329 VanDerWaalsContact O-N 3.09Å; E329-H331 VanDerWaalsContact C-N 3.27Å; E329-Y350 HydrophobicContact CG-CE1 3.93Å; E329-Y350 WeakPolarHBondContact OE1-CE1 3.42Å; E329-Y350 PolarHBondContact OE1-OH 2.97Å; E329-K357 IonicContact OE1-NZ 3.56Å; E329-K357 IonicContact OE2-NZ 2.76Å; E329-K357 PolarHBondContact OE2-NZ 2.7Å
330	A	90.6	Very high	91.7	Very high	58 Å²	58	20 Å²	20	48%	0.479	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	2.2	171.1	0	0	0	0	0	113.2	R327 L328 D332	R327-A330 CarbonylContact O-C 3.56Å; R327-A330 WeakPolarHBondContact O-CA 3.48Å; R327-A330 WeakPolarHBondContact O-CB 3.5Å; R327-A330 PolarHBondContact O-N 3.34Å; R327-A330 VanDerWaalsContact O-N 3.07Å; L328-A330 PolarHBondContact O-N 3.07Å; A330-D332 PolarHBondContact O-N 3.44Å
331	H	90.9	Very high	91.1	Very high	81 Å²	81	21.5 Å²	21.5	38%	0.375	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.9	22	-173.6	-155	-70.9	0	0	0	113.9	R327 L328 E329 E424 S455	R327-H331 PolarHBondContact O-N 2.95Å; L328-H331 PolarHBondContact O-N 3.46Å; E329-H331 VanDerWaalsContact C-N 3.27Å; H331-E424 IonicContact CD2-OE1 3.61Å; H331-E424 IonicContact NE2-OE1 3.15Å; H331-S455 PolarHBondContact CE1-OG 3.05Å; H331-S455 PolarHBondContact ND1-OG 3.35Å; H331-S455 VanDerWaalsContact ND1-OG 3.15Å; H331-S455 PolarHBondContact O-OG 2.85Å
332	D	92.2	Very high	90.6	Very high	35 Å²	35	21.6 Å²	21.6	19%	0.187	12%	0.115	C	C	.	.			trans	-81.2	144.5	176.3	-75.5	-43.8	0	0	0	111.6	R327 A330 W425 Y482	R327-D332 HydrophobicContact CB-CB 4.1Å; R327-D332 IonicContact NH1-OD2 3.98Å; R327-D332 WeakPolarHBondContact O-CB 3.32Å; R327-D332 PolarHBondContact O-N 3.13Å; A330-D332 PolarHBondContact O-N 3.44Å; D332-W425 WeakPolarHBondContact O-CH2 3.49Å; D332-Y482 HydrophobicContact CB-CD2 3.73Å; D332-Y482 HydrophobicContact CB-CE2 3.6Å; D332-Y482 WeakPolarHBondContact OD2-CE2 3.2Å; D332-Y482 PolarHBondContact OD2-OH 2.95Å
333	S	94.9	Very high	90.2	Very high	6 Å²	6	21.5 Å²	21.5	4%	0.042	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	145.2	172.2	-69	0	0	0	0	111.6	I456 I481 Y482	S333-I456 WeakPolarHBondContact CA-O 3.45Å; S333-I456 VanDerWaalsContact CB-O 3.31Å; S333-I456 WeakPolarHBondContact CB-O 3.49Å; S333-I456 PolarHBondContact OG-N 2.8Å; S333-I481 WeakPolarHBondContact O-CA 3.41Å; S333-Y482 PolarHBondContact O-N 3.32Å
334	V	95.9	Very high	90.1	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	141.9	-172.1	-60.6	0	0	0	0	113.1	R327 L328 V347 I456 I457 L458	R327-V334 HydrophobicContact CB-CG1 3.62Å; L328-V334 HydrophobicContact CD2-CG1 4.35Å; L328-V334 HydrophobicContact CD2-CG2 3.86Å; L328-V334 HydrophobicContact CG-CG2 4.5Å; V334-V347 HydrophobicContact CG2-CG1 4.27Å; V334-I456 PolarHBondContact N-O 3.33Å; V334-I456 VanDerWaalsContact N-O 3.1Å; V334-I457 HydrophobicContact CG2-CB 4.39Å; V334-I457 HydrophobicContact CG2-CG1 4.14Å; V334-I457 HydrophobicContact CG2-CG2 4.02Å; V334-L458 PolarHBondContact O-N 3.05Å
335	F	96.2	Very high	89.9	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	113.4	169.8	-173.5	-165.5	0	0	0	111.3	L458 V463 A466 F469 S470 I481 Y482 V483 I484	F335-L458 HydrophobicContact CB-CB 4.11Å; F335-L458 HydrophobicContact CB-CD1 4.14Å; F335-L458 HydrophobicContact CD2-CB 3.33Å; F335-L458 HydrophobicContact CD2-CD1 4.32Å; F335-L458 HydrophobicContact CD2-CG 4.45Å; F335-L458 WeakPolarHBondContact CD2-O 3.19Å; F335-L458 HydrophobicContact CE2-CB 3.9Å; F335-L458 HydrophobicContact CG-CB 3.92Å; F335-L458 HydrophobicContact CG-CD1 4.15Å; F335-V463 HydrophobicContact CE1-CG2 4.48Å; F335-V463 HydrophobicContact CZ-CG2 4.04Å; F335-A466 HydrophobicContact CD1-CB 4.04Å; F335-A466 HydrophobicContact CE1-CB 3.69Å; F335-A466 HydrophobicContact CZ-CB 4.45Å; F335-F469 HydrophobicContact CD1-CD1 4.48Å; F335-F469 HydrophobicContact CE1-CB 4.48Å; F335-F469 AromaticContact CE1-CD1 3.81Å; F335-F469 HydrophobicContact CE1-CD1 3.81Å; F335-F469 HydrophobicContact CZ-CD1 4.15Å; F335-S470 WeakPolarHBondContact CB-OG 3.11Å; F335-S470 VanDerWaalsContact CD1-OG 3.24Å; F335-S470 WeakPolarHBondContact CD1-OG 3.49Å; F335-I481 HydrophobicContact CB-CG2 4.32Å; F335-Y482 PolarHBondContact N-O 3.45Å; F335-V483 HydrophobicContact CD1-CG1 4.47Å; F335-I484 PolarHBondContact O-N 3.24Å
336	V	95.2	Very high	89.9	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	103.8	179.8	-175.1	0	0	0	0	110.2	F320 A324 A338 V347 L458 L459 S460 I484	F320-V336 HydrophobicContact CD2-CG1 4.11Å; F320-V336 HydrophobicContact CE2-CG1 4.01Å; A324-V336 HydrophobicContact CB-CG2 4.39Å; V336-A338 HydrophobicContact CG1-CB 4.37Å; V336-V347 HydrophobicContact CG2-CG1 4.26Å; V336-V347 HydrophobicContact CG2-CG2 4.27Å; V336-L458 PolarHBondContact N-O 2.94Å; V336-L459 HydrophobicContact CB-CD2 3.97Å; V336-L459 HydrophobicContact CG2-CD2 4.26Å; V336-S460 PolarHBondContact O-N 3Å; V336-I484 WeakPolarHBondContact CA-O 3.28Å
337	A	92.8	Very high	90	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	103.8	173.9	0	0	0	0	0	109.4	V463 A466 I484 S485 T486	A337-V463 HydrophobicContact CB-CG2 4.43Å; A337-A466 HydrophobicContact CB-CB 4.42Å; A337-I484 PolarHBondContact N-O 2.91Å; A337-S485 CarbonylContact O-C 3.53Å; A337-S485 WeakPolarHBondContact O-CA 3.38Å; A337-T486 PolarHBondContact O-N 2.98Å
338	A	90.4	Very high	90	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	153.7	-176.6	0	0	0	0	0	111.6	F320 V336 A342 K344 S460 A461 T486	F320-A338 HydrophobicContact CE2-CB 4.46Å; V336-A338 HydrophobicContact CG1-CB 4.37Å; A338-A342 HydrophobicContact CB-CB 3.84Å; A338-K344 HydrophobicContact CB-CD 4.13Å; A338-K344 HydrophobicContact CB-CG 4.02Å; A338-K344 PolarHBondContact O-NZ 2.8Å; A338-S460 PolarHBondContact N-O 2.8Å; A338-S460 VanDerWaalsContact N-O 3.1Å; A338-A461 WeakPolarHBondContact O-CA 3.46Å; A338-T486 HydrophobicContact CB-CG2 3.58Å
339	H	85.4	Confident	90.1	Very high	14 Å²	14	20 Å²	20	7%	0.065	12%	0.119	C	C	.	.			trans	-56.5	153.6	178.2	-71.9	-60	0	0	0	112.8	A342 T462 M487 R489	H339-A342 WeakPolarHBondContact O-CB 3.36Å; H339-A342 PolarHBondContact O-N 2.95Å; H339-T462 VanDerWaalsContact CE1-CG2 3.47Å; H339-T462 WeakPolarHBondContact CE1-CG2 3.23Å; H339-T462 PolarHBondContact CE1-OG1 3.31Å; H339-T462 PolarHBondContact ND1-OG1 2.84Å; H339-M487 PolarHBondContact NE2-O 3.36Å; H339-R489 HydrophobicContact CB-CG 4.36Å; H339-R489 WeakPolarHBondContact CD2-CG 3.24Å
340	T	77.6	Confident	90.2	Very high	9 Å²	9	17.1 Å²	17.1	6%	0.055	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	143.6	165.5	45.5	0	0	0	0	109.4	A342	T340-A342 PolarHBondContact O-N 3.25Å
341	S	77.5	Confident	90.4	Very high	43 Å²	43	14.4 Å²	14.4	30%	0.301	8%	0.082	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.3	-0.9	-168.5	81	0	0	0	0	117.9	G343	S341-G343 PolarHBondContact O-N 2.92Å
342	A	82.1	Confident	90.6	Very high	3 Å²	3	10.5 Å²	10.5	3%	0.025	6%	0.064	C	C	.	.	S	Bend	trans	-63.3	-13.1	178.1	0	0	0	0	0	115.3	F320 A338 H339 T340 P490 R713	F320-A342 HydrophobicContact CZ-CB 4.47Å; A338-A342 HydrophobicContact CB-CB 3.84Å; H339-A342 WeakPolarHBondContact O-CB 3.36Å; H339-A342 PolarHBondContact O-N 2.95Å; T340-A342 PolarHBondContact O-N 3.25Å; A342-P490 HydrophobicContact CB-CG 4.41Å; A342-R713 PolarHBondContact O-NH1 2.88Å
343	G	84.8	Confident	90.7	Very high	19 Å²	19	9.3 Å²	9.3	20%	0.196	6%	0.059	C	C	.	.			trans	94.3	30.7	-176.1	0	0	0	0	0	113.8	Q321 S341 T345 V346	Q321-G343 PolarHBondContact NE2-O 2.9Å; S341-G343 PolarHBondContact O-N 2.92Å; G343-T345 PolarHBondContact O-N 3.14Å; G343-V346 WeakPolarHBondContact O-CB 3.02Å; G343-V346 PolarHBondContact O-N 2.87Å
344	K	89.3	Confident	90.7	Very high	15 Å²	15	9 Å²	9	7%	0.065	6%	0.057	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-32.4	174.3	-60.8	-171.1	-59.2	-150.7	0	112.8	A338 V346 V347 E430 L459 S460	A338-K344 HydrophobicContact CB-CD 4.13Å; A338-K344 HydrophobicContact CB-CG 4.02Å; A338-K344 PolarHBondContact O-NZ 2.8Å; K344-V346 PolarHBondContact O-N 2.87Å; K344-V347 PolarHBondContact O-N 2.87Å; K344-V347 VanDerWaalsContact O-N 3.09Å; K344-E430 IonicContact NZ-OE2 2.82Å; K344-E430 PolarHBondContact NZ-OE2 3.24Å; K344-L459 HydrophobicContact CB-CD1 4.47Å; K344-L459 HydrophobicContact CB-CD2 4.45Å; K344-S460 VanDerWaalsContact CD-O 3.24Å; K344-S460 WeakPolarHBondContact CD-O 3.36Å; K344-S460 PolarHBondContact NZ-O 2.95Å
345	T	89.4	Confident	90.6	Very high	35 Å²	35	9 Å²	9	22%	0.215	6%	0.057	C	C	.	.	H	α-helix	trans	-57	-30.5	-179.7	-33.7	0	0	0	0	113.6	G343 V347 A348 E349 F379	G343-T345 PolarHBondContact O-N 3.14Å; T345-V347 PolarHBondContact O-N 3.1Å; T345-A348 WeakPolarHBondContact O-CB 3.43Å; T345-A348 PolarHBondContact O-N 2.9Å; T345-E349 HydrophobicContact CG2-CG 4.22Å; T345-E349 WeakPolarHBondContact CG2-OE1 3.48Å; T345-E349 WeakPolarHBondContact O-CB 3.41Å; T345-E349 WeakPolarHBondContact O-CG 3.43Å; T345-E349 PolarHBondContact O-N 2.78Å; T345-F379 HydrophobicContact CG2-CE1 3.87Å; T345-F379 HydrophobicContact CG2-CZ 4.12Å
346	V	92.6	Very high	90.4	Very high	6 Å²	6	12 Å²	12	4%	0.036	7%	0.071	C	C	.	.	H	α-helix	trans	-54.4	-37.4	176.4	169.2	0	0	0	0	111.9	W313 F315 L317 Q321 G343 K344 Y350	W313-V346 HydrophobicContact CD2-CG1 4.48Å; W313-V346 HydrophobicContact CH2-CG1 3.65Å; W313-V346 HydrophobicContact CZ2-CB 4.15Å; W313-V346 HydrophobicContact CZ2-CG1 3.49Å; W313-V346 VanDerWaalsContact CZ2-CG1 3.49Å; W313-V346 WeakPolarHBondContact CZ2-O 3.49Å; W313-V346 HydrophobicContact CZ3-CG1 4.29Å; F315-V346 HydrophobicContact CE2-CG2 4.26Å; F315-V346 HydrophobicContact CZ-CG2 4.05Å; L317-V346 HydrophobicContact CD1-CG1 4.39Å; L317-V346 HydrophobicContact CD2-CG1 3.69Å; Q321-V346 HydrophobicContact CB-CG1 4.18Å; Q321-V346 HydrophobicContact CG-CB 4.46Å; Q321-V346 HydrophobicContact CG-CG1 4.25Å; G343-V346 WeakPolarHBondContact O-CB 3.02Å; G343-V346 PolarHBondContact O-N 2.87Å; K344-V346 PolarHBondContact O-N 2.87Å; V346-Y350 PolarHBondContact O-N 3.47Å
347	V	94.1	Very high	90.2	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-72.5	-38.2	-179.6	-176.2	0	0	0	0	111	A324 L328 V334 V336 K344 T345 A351 I457 L459	A324-V347 HydrophobicContact CB-CG1 4.14Å; A324-V347 HydrophobicContact CB-CG2 3.82Å; L328-V347 HydrophobicContact CD1-CG1 3.92Å; V334-V347 HydrophobicContact CG2-CG1 4.27Å; V336-V347 HydrophobicContact CG2-CG1 4.26Å; V336-V347 HydrophobicContact CG2-CG2 4.27Å; K344-V347 PolarHBondContact O-N 2.87Å; K344-V347 VanDerWaalsContact O-N 3.09Å; T345-V347 PolarHBondContact O-N 3.1Å; V347-A351 PolarHBondContact O-N 2.87Å; V347-I457 HydrophobicContact CG1-CG2 4.13Å; V347-L459 HydrophobicContact CB-CD2 4.29Å; V347-L459 HydrophobicContact CG1-CD2 4.42Å
348	A	93.4	Very high	90.2	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-68.3	-45.1	173.8	0	0	0	0	0	112.5	T345 Y350 A351 I352 Y364 F379 I427 L459	T345-A348 WeakPolarHBondContact O-CB 3.43Å; T345-A348 PolarHBondContact O-N 2.9Å; A348-Y350 VanDerWaalsContact C-N 3.29Å; A348-Y350 PolarHBondContact O-N 3.2Å; A348-A351 PolarHBondContact O-N 3.06Å; A348-I352 WeakPolarHBondContact O-CG1 3.32Å; A348-I352 PolarHBondContact O-N 3.47Å; A348-Y364 HydrophobicContact CB-CD2 4.33Å; A348-Y364 HydrophobicContact CB-CE2 3.86Å; A348-F379 HydrophobicContact CB-CZ 4.47Å; A348-I427 HydrophobicContact CB-CD1 3.94Å; A348-I427 HydrophobicContact CB-CG2 4.07Å; A348-L459 HydrophobicContact CB-CD1 4.19Å
349	E	94.3	Very high	90.3	Very high	35 Å²	35	29.5 Å²	29.5	16%	0.164	15%	0.153	C	C	.	.	H	α-helix	trans	-58	-41.4	176.6	-75.6	161.8	-159.1	0	0	111.4	W313 T345 A353 F379 F383	W313-E349 HydrophobicContact CZ2-CB 4.16Å; W313-E349 PolarHBondContact NE1-OE2 3.4Å; T345-E349 HydrophobicContact CG2-CG 4.22Å; T345-E349 WeakPolarHBondContact CG2-OE1 3.48Å; T345-E349 WeakPolarHBondContact O-CB 3.41Å; T345-E349 WeakPolarHBondContact O-CG 3.43Å; T345-E349 PolarHBondContact O-N 2.78Å; E349-A353 PolarHBondContact O-N 3.41Å; E349-A353 VanDerWaalsContact O-N 3.11Å; E349-F379 HydrophobicContact CG-CE1 4.01Å; E349-F383 HydrophobicContact CB-CZ 4.01Å; E349-F383 HydrophobicContact CG-CE2 4.25Å; E349-F383 HydrophobicContact CG-CZ 4.19Å; E349-F383 WeakPolarHBondContact O-CZ 3.42Å
350	Y	95.2	Very high	90.7	Very high	1 Å²	1	30.5 Å²	30.5	0%	0.004	16%	0.161	C	C	.	.	H	α-helix	trans	-65.3	-43.7	177.1	-158.5	-94.5	0	0	0	112.7	P309 A310 F311 W313 V325 L328 E329 V346 A348 I352 A353 L354	P309-Y350 WeakPolarHBondContact CA-OH 3.39Å; P309-Y350 HydrophobicContact CB-CE2 4.12Å; A310-Y350 HydrophobicContact CB-CE1 4.27Å; A310-Y350 HydrophobicContact CB-CE2 4.16Å; A310-Y350 PolarHBondContact N-OH 2.7Å; F311-Y350 HydrophobicContact CB-CD2 4.29Å; W313-Y350 AromaticContact CH2-CD2 3.56Å; W313-Y350 HydrophobicContact CH2-CD2 3.56Å; W313-Y350 HydrophobicContact CH2-CG 4.24Å; W313-Y350 AromaticContact CZ3-CD2 3.98Å; W313-Y350 HydrophobicContact CZ3-CD2 3.98Å; V325-Y350 HydrophobicContact CG1-CD1 3.91Å; V325-Y350 HydrophobicContact CG1-CD2 3.97Å; V325-Y350 HydrophobicContact CG1-CE1 3.67Å; V325-Y350 HydrophobicContact CG1-CE2 3.68Å; V325-Y350 HydrophobicContact CG1-CG 4.05Å; V325-Y350 HydrophobicContact CG2-CD1 4.29Å; V325-Y350 HydrophobicContact CG2-CD2 4.11Å; V325-Y350 HydrophobicContact CG2-CG 3.89Å; L328-Y350 HydrophobicContact CB-CD1 4.38Å; L328-Y350 HydrophobicContact CD1-CD1 4.26Å; E329-Y350 HydrophobicContact CG-CE1 3.93Å; E329-Y350 WeakPolarHBondContact OE1-CE1 3.42Å; E329-Y350 PolarHBondContact OE1-OH 2.97Å; V346-Y350 PolarHBondContact O-N 3.47Å; A348-Y350 VanDerWaalsContact C-N 3.29Å; A348-Y350 PolarHBondContact O-N 3.2Å; Y350-I352 PolarHBondContact O-N 3.38Å; Y350-A353 PolarHBondContact O-N 2.97Å; Y350-L354 VanDerWaalsContact O-CB 3.3Å; Y350-L354 WeakPolarHBondContact O-CB 3.49Å; Y350-L354 PolarHBondContact O-N 2.62Å
351	A	95.1	Very high	91.5	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-65.3	-38.1	179.8	0	0	0	0	0	112.9	L328 V347 A348 L354 S355 I427 I457	L328-A351 HydrophobicContact CD1-CB 4.3Å; V347-A351 PolarHBondContact O-N 2.87Å; A348-A351 PolarHBondContact O-N 3.06Å; A351-L354 PolarHBondContact O-N 3.48Å; A351-S355 PolarHBondContact O-N 3.08Å; A351-S355 PolarHBondContact O-OG 2.79Å; A351-I427 HydrophobicContact CB-CD1 4.26Å; A351-I457 HydrophobicContact CB-CD1 3.22Å
352	I	94.9	Very high	92.4	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62	-47.6	173.3	-67.1	163.2	0	0	0	110.1	A348 Y350 L354 S355 Q356 T362 F379 F383 C401 I427	A348-I352 WeakPolarHBondContact O-CG1 3.32Å; A348-I352 PolarHBondContact O-N 3.47Å; Y350-I352 PolarHBondContact O-N 3.38Å; I352-L354 VanDerWaalsContact C-N 3.34Å; I352-L354 PolarHBondContact O-N 3.31Å; I352-S355 PolarHBondContact O-N 2.86Å; I352-Q356 WeakPolarHBondContact O-CG 3.34Å; I352-Q356 PolarHBondContact O-N 2.75Å; I352-T362 HydrophobicContact CG1-CG2 4.02Å; I352-F379 HydrophobicContact CD1-CD2 3.99Å; I352-F379 HydrophobicContact CD1-CE1 4.41Å; I352-F379 HydrophobicContact CD1-CE2 3.84Å; I352-F379 HydrophobicContact CD1-CG 4.37Å; I352-F379 HydrophobicContact CD1-CZ 4.05Å; I352-F383 HydrophobicContact CB-CE2 4.34Å; I352-F383 HydrophobicContact CB-CZ 4.35Å; I352-F383 HydrophobicContact CD1-CE2 4.31Å; I352-F383 HydrophobicContact CG2-CD1 4.31Å; I352-F383 HydrophobicContact CG2-CD2 4Å; I352-F383 HydrophobicContact CG2-CE1 4.36Å; I352-F383 HydrophobicContact CG2-CE2 4.04Å; I352-F383 HydrophobicContact CG2-CG 4.14Å; I352-F383 HydrophobicContact CG2-CZ 4.23Å; I352-C401 HydrophobicContact CG2-CB 3.98Å; I352-I427 HydrophobicContact CD1-CD1 4.37Å; I352-I427 HydrophobicContact CG1-CD1 4.07Å
353	A	94.4	Very high	93	Very high	9 Å²	9	29.5 Å²	29.5	7%	0.074	15%	0.149	C	C	.	.	H	α-helix	trans	-65.3	-35	177.5	0	0	0	0	0	113.1	A310 F311 E349 Y350 K357 F383	A310-A353 HydrophobicContact CB-CB 4.05Å; F311-A353 HydrophobicContact CB-CB 3.82Å; F311-A353 HydrophobicContact CD2-CB 4.29Å; F311-A353 HydrophobicContact CG-CB 4.45Å; E349-A353 PolarHBondContact O-N 3.41Å; E349-A353 VanDerWaalsContact O-N 3.11Å; Y350-A353 PolarHBondContact O-N 2.97Å; A353-K357 PolarHBondContact O-N 3.4Å; A353-K357 VanDerWaalsContact O-N 3.07Å; A353-F383 HydrophobicContact CB-CE1 4.19Å
354	L	93.8	Very high	93.6	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-66.3	-45	176.8	-172.8	62.8	0	0	0	111	A310 L328 Y350 A351 I352 Q356 K357 H358 W425	A310-L354 HydrophobicContact CB-CB 4.41Å; A310-L354 HydrophobicContact CB-CD1 4.4Å; L328-L354 HydrophobicContact CB-CD2 4.38Å; L328-L354 WeakPolarHBondContact O-CD2 3.44Å; Y350-L354 VanDerWaalsContact O-CB 3.3Å; Y350-L354 WeakPolarHBondContact O-CB 3.49Å; Y350-L354 PolarHBondContact O-N 2.62Å; A351-L354 PolarHBondContact O-N 3.48Å; I352-L354 VanDerWaalsContact C-N 3.34Å; I352-L354 PolarHBondContact O-N 3.31Å; L354-Q356 PolarHBondContact O-N 2.72Å; L354-K357 HydrophobicContact CD1-CD 4.32Å; L354-K357 CarbonylContact O-C 3.55Å; L354-K357 WeakPolarHBondContact O-CA 3.41Å; L354-K357 WeakPolarHBondContact O-CB 3.06Å; L354-K357 PolarHBondContact O-N 3.38Å; L354-K357 VanDerWaalsContact O-N 3.1Å; L354-H358 VanDerWaalsContact CD1-CE1 3.49Å; L354-H358 WeakPolarHBondContact CD1-CE1 3.46Å; L354-H358 WeakPolarHBondContact CD1-NE2 3.33Å; L354-H358 VanDerWaalsContact O-CG 3.3Å; L354-H358 PolarHBondContact O-N 2.63Å; L354-W425 HydrophobicContact CD2-CZ2 4.3Å
355	S	93.2	Very high	93.9	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-62.7	-41.4	176.4	-50	0	0	0	0	111.8	A351 I352 K357 H358 M359 T360 T362 W425	A351-S355 PolarHBondContact O-N 3.08Å; A351-S355 PolarHBondContact O-OG 2.79Å; I352-S355 PolarHBondContact O-N 2.86Å; S355-K357 VanDerWaalsContact C-N 3.28Å; S355-K357 PolarHBondContact O-N 2.9Å; S355-H358 CarbonylContact O-C 3.58Å; S355-H358 PolarHBondContact O-N 3.01Å; S355-M359 PolarHBondContact O-N 3.16Å; S355-T360 VanDerWaalsContact CA-OG1 3.26Å; S355-T360 WeakPolarHBondContact CA-OG1 3.19Å; S355-T360 VanDerWaalsContact CB-OG1 3.32Å; S355-T360 WeakPolarHBondContact CB-OG1 3.31Å; S355-T360 PolarHBondContact O-N 3.33Å; S355-T360 PolarHBondContact O-OG1 3.35Å; S355-T362 WeakPolarHBondContact CB-OG1 3.47Å; S355-T362 PolarHBondContact OG-OG1 3.27Å; S355-W425 VanDerWaalsContact OG-CD1 3.29Å
356	Q	91.9	Very high	93.9	Very high	62 Å²	62	26.2 Å²	26.2	29%	0.29	13%	0.126	S	C	.	.	H	α-helix	trans	-61.8	-33.9	173.7	-73.8	-178.9	-15.1	0	0	112.9	I352 L354 S400	I352-Q356 WeakPolarHBondContact O-CG 3.34Å; I352-Q356 PolarHBondContact O-N 2.75Å; L354-Q356 PolarHBondContact O-N 2.72Å; Q356-S400 PolarHBondContact NE2-OG 2.96Å
357	K	91.7	Very high	93.5	Very high	108 Å²	108	26 Å²	26	47%	0.47	13%	0.125	S	C	.	.	H	α-helix	trans	-72.1	-30.9	172.3	171	-170.7	164.2	-155	0	112.2	A310 E329 A353 L354 S355	A310-K357 HydrophobicContact CB-CD 4.25Å; E329-K357 IonicContact OE1-NZ 3.56Å; E329-K357 IonicContact OE2-NZ 2.76Å; E329-K357 PolarHBondContact OE2-NZ 2.7Å; A353-K357 PolarHBondContact O-N 3.4Å; A353-K357 VanDerWaalsContact O-N 3.07Å; L354-K357 HydrophobicContact CD1-CD 4.32Å; L354-K357 CarbonylContact O-C 3.55Å; L354-K357 WeakPolarHBondContact O-CA 3.41Å; L354-K357 WeakPolarHBondContact O-CB 3.06Å; L354-K357 PolarHBondContact O-N 3.38Å; L354-K357 VanDerWaalsContact O-N 3.1Å; S355-K357 VanDerWaalsContact C-N 3.28Å; S355-K357 PolarHBondContact O-N 2.9Å
358	H	92.1	Very high	93	Very high	81 Å²	81	28 Å²	28	38%	0.375	14%	0.135	S	C	.	.	H	α-helix	trans	-87.3	-5.7	178	-63.8	171	0	0	0	114.2	L354 S355 T360 E424	L354-H358 VanDerWaalsContact CD1-CE1 3.49Å; L354-H358 WeakPolarHBondContact CD1-CE1 3.46Å; L354-H358 WeakPolarHBondContact CD1-NE2 3.33Å; L354-H358 VanDerWaalsContact O-CG 3.3Å; L354-H358 PolarHBondContact O-N 2.63Å; S355-H358 CarbonylContact O-C 3.58Å; S355-H358 PolarHBondContact O-N 3.01Å; H358-T360 VanDerWaalsContact C-N 3.29Å; H358-T360 HydrophobicContact CB-CG2 4.1Å; H358-E424 VanDerWaalsContact CB-OE2 3.31Å; H358-E424 WeakPolarHBondContact CB-OE2 3.45Å; H358-E424 IonicContact CE1-OE1 2.98Å; H358-E424 IonicContact CG-OE2 2.7Å; H358-E424 IonicContact ND1-OE1 3.87Å; H358-E424 PolarHBondContact ND1-OE1 3.35Å; H358-E424 IonicContact ND1-OE2 3.25Å; H358-E424 PolarHBondContact ND1-OE2 2.94Å; H358-E424 VanDerWaalsContact ND1-OE2 3.09Å
359	M	92.8	Very high	92.6	Very high	179 Å²	179	31.2 Å²	31.2	88%	0.882	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.5	32.3	-172.1	-58.7	-69	-160.6	0	0	113.9	S355	S355-M359 PolarHBondContact O-N 3.16Å
360	T	94	Very high	92	Very high	35 Å²	35	31 Å²	31	22%	0.215	15%	0.153	C	C	.	.			trans	-110.8	170.1	178.6	58.7	0	0	0	0	111.6	S355 H358 E424	S355-T360 VanDerWaalsContact CA-OG1 3.26Å; S355-T360 WeakPolarHBondContact CA-OG1 3.19Å; S355-T360 VanDerWaalsContact CB-OG1 3.32Å; S355-T360 WeakPolarHBondContact CB-OG1 3.31Å; S355-T360 PolarHBondContact O-N 3.33Å; S355-T360 PolarHBondContact O-OG1 3.35Å; H358-T360 VanDerWaalsContact C-N 3.29Å; H358-T360 HydrophobicContact CB-CG2 4.1Å; T360-E424 WeakPolarHBondContact CB-OE2 3.45Å; T360-E424 HydrophobicContact CG2-CB 4.06Å; T360-E424 VanDerWaalsContact CG2-OE2 3.28Å; T360-E424 WeakPolarHBondContact CG2-OE2 3.24Å; T360-E424 WeakPolarHBondContact OG1-CB 3.36Å; T360-E424 PolarHBondContact OG1-OE2 2.92Å
361	R	94.4	Very high	91.5	Very high	33 Å²	33	31.4 Å²	31.4	13%	0.125	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	145.4	177.3	-70.1	-175.8	161.3	156.7	-13.9	111.9	E398 S400 D422 E424	R361-E398 PolarHBondContact NH2-O 2.63Å; R361-E398 IonicContact NH2-OE2 2.7Å; R361-E398 PolarHBondContact NH2-OE2 3.03Å; R361-S400 CarbonylContact C-O 3.5Å; R361-S400 VanDerWaalsContact CA-O 3.28Å; R361-S400 WeakPolarHBondContact CA-O 3.34Å; R361-D422 HydrophobicContact CB-CB 4.17Å; R361-D422 HydrophobicContact CG-CB 3.94Å; R361-D422 IonicContact CZ-OD2 3.46Å; R361-D422 PolarHBondContact N-O 2.87Å; R361-D422 IonicContact NE-OD2 3.79Å; R361-D422 IonicContact NH1-OD2 2.67Å; R361-D422 PolarHBondContact NH1-OD2 2.93Å; R361-E424 PolarHBondContact O-N 2.89Å
362	T	95.9	Very high	91.2	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.006	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	137	172	-44.8	0	0	0	0	110	I352 S355 S400 L402 W425 I427	I352-T362 HydrophobicContact CG1-CG2 4.02Å; S355-T362 WeakPolarHBondContact CB-OG1 3.47Å; S355-T362 PolarHBondContact OG-OG1 3.27Å; T362-S400 PolarHBondContact N-O 2.73Å; T362-L402 PolarHBondContact O-N 2.91Å; T362-W425 WeakPolarHBondContact CA-O 3.34Å; T362-W425 HydrophobicContact CG2-CB 4.17Å; T362-I427 HydrophobicContact CG2-CD1 3.64Å; T362-I427 HydrophobicContact CG2-CG1 4.19Å
363	I	96.6	Very high	90.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	123.7	168.9	-70	173.9	0	0	0	110	T365 L402 M404 L409 L423 W425 V426 I427	I363-T365 HydrophobicContact CG2-CG2 3.9Å; I363-L402 CarbonylContact C-O 3.6Å; I363-L402 WeakPolarHBondContact CA-O 3.32Å; I363-L402 HydrophobicContact CG1-CB 4.32Å; I363-M404 HydrophobicContact CB-CE 4.42Å; I363-M404 HydrophobicContact CD1-CE 3.79Å; I363-M404 HydrophobicContact CD1-SD 4.41Å; I363-M404 HydrophobicContact CG1-CE 3.83Å; I363-M404 HydrophobicContact CG2-CE 3.77Å; I363-M404 HydrophobicContact CG2-CG 3.9Å; I363-M404 HydrophobicContact CG2-SD 3.83Å; I363-L409 HydrophobicContact CD1-CD1 3.95Å; I363-L409 HydrophobicContact CG2-CD2 4.28Å; I363-L423 HydrophobicContact CB-CD1 3.95Å; I363-L423 HydrophobicContact CD1-CD1 3.72Å; I363-L423 HydrophobicContact CD1-CD2 4.07Å; I363-L423 HydrophobicContact CG1-CD1 3.61Å; I363-W425 PolarHBondContact N-O 2.66Å; I363-V426 HydrophobicContact CB-CG2 4.44Å; I363-V426 WeakPolarHBondContact O-CA 3.38Å; I363-I427 PolarHBondContact O-N 3.34Å
364	Y	96.2	Very high	90.5	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	111.2	169.5	-168.5	-78.6	0	0	0	109.5	A348 K375 F379 L402 I403 M404 I427 D429	A348-Y364 HydrophobicContact CB-CD2 4.33Å; A348-Y364 HydrophobicContact CB-CE2 3.86Å; Y364-K375 HydrophobicContact CE1-CB 4.39Å; Y364-K375 HydrophobicContact CE1-CD 4.27Å; Y364-K375 HydrophobicContact CE1-CG 3.99Å; Y364-K375 WeakPolarHBondContact OH-CE 3.3Å; Y364-K375 PolarHBondContact OH-NZ 2.84Å; Y364-F379 AromaticContact CD2-CE2 3.57Å; Y364-F379 HydrophobicContact CD2-CE2 3.57Å; Y364-F379 HydrophobicContact CD2-CZ 4.06Å; Y364-F379 AromaticContact CE2-CE2 3.66Å; Y364-F379 HydrophobicContact CE2-CE2 3.66Å; Y364-F379 AromaticContact CE2-CZ 3.75Å; Y364-F379 HydrophobicContact CE2-CZ 3.75Å; Y364-F379 HydrophobicContact CG-CE2 4.04Å; Y364-L402 PolarHBondContact N-O 2.84Å; Y364-I403 HydrophobicContact CD1-CG2 4.38Å; Y364-I403 WeakPolarHBondContact O-CA 3.37Å; Y364-M404 PolarHBondContact O-N 3.04Å; Y364-I427 HydrophobicContact CD2-CB 3.95Å; Y364-I427 HydrophobicContact CD2-CD1 4.01Å; Y364-I427 HydrophobicContact CD2-CG2 3.69Å; Y364-I427 HydrophobicContact CE2-CG2 3.77Å; Y364-D429 HydrophobicContact CE1-CB 3.9Å; Y364-D429 PolarHBondContact OH-OD2 3.07Å
365	T	94.9	Very high	90.3	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	132.8	175	61.4	0	0	0	0	110.7	I363 M404 T406 L409 V426 I427 F428 D429	I363-T365 HydrophobicContact CG2-CG2 3.9Å; T365-M404 WeakPolarHBondContact CA-O 3.43Å; T365-M404 HydrophobicContact CG2-CG 4.42Å; T365-T406 HydrophobicContact CG2-CG2 4.34Å; T365-L409 HydrophobicContact CG2-CB 4.29Å; T365-L409 HydrophobicContact CG2-CD2 3.49Å; T365-L409 VanDerWaalsContact CG2-CD2 3.49Å; T365-V426 HydrophobicContact CG2-CG1 4.33Å; T365-I427 PolarHBondContact N-O 2.88Å; T365-I427 PolarHBondContact OG1-O 2.65Å; T365-F428 WeakPolarHBondContact OG1-CA 3.43Å; T365-F428 WeakPolarHBondContact OG1-CD1 3.43Å; T365-D429 WeakPolarHBondContact O-CB 3.34Å; T365-D429 PolarHBondContact O-N 3.48Å
366	S	90.3	Very high	90.3	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	138	173.9	145.2	0	0	0	0	109.5	I368 L371 S372 M404 T405	S366-I368 PolarHBondContact O-N 3.24Å; S366-I368 PolarHBondContact OG-N 3.37Å; S366-I368 PolarHBondContact OG-O 3.16Å; S366-L371 WeakPolarHBondContact OG-CB 3.43Å; S366-S372 VanDerWaalsContact CB-OG 3.3Å; S366-S372 WeakPolarHBondContact CB-OG 3.1Å; S366-S372 PolarHBondContact OG-N 3.43Å; S366-S372 PolarHBondContact OG-OG 3.14Å; S366-M404 PolarHBondContact N-O 2.94Å; S366-T405 WeakPolarHBondContact O-CA 3.18Å
367	P	84.3	Confident	90.1	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.013	17%	0.166	C	C	.	.	S	Bend	trans	-69.3	-16.6	-179.2	27	-34.6	0	0	0	113.4	Y433 R439	P367-Y433 HydrophobicContact CB-CD2 3.92Å; P367-Y433 HydrophobicContact CB-CE2 4.25Å; P367-Y433 HydrophobicContact CB-CG 4.06Å; P367-Y433 HydrophobicContact CG-CD2 3.58Å; P367-Y433 HydrophobicContact CG-CE2 3.75Å; P367-Y433 HydrophobicContact CG-CG 4.24Å; P367-R439 VanDerWaalsContact O-CZ 3.28Å; P367-R439 PolarHBondContact O-NH1 3.35Å; P367-R439 PolarHBondContact O-NH2 3.07Å; P367-R439 VanDerWaalsContact O-NH2 3.11Å
368	I	84.5	Confident	90	Very high	40 Å²	40	32.8 Å²	32.8	21%	0.205	16%	0.16	C	C	.	.	S	Bend	trans	-132.9	128.5	-171.3	-59.3	177	0	0	0	111	S366 A370 L371 S372 Y433	S366-I368 PolarHBondContact O-N 3.24Å; S366-I368 PolarHBondContact OG-N 3.37Å; S366-I368 PolarHBondContact OG-O 3.16Å; I368-A370 HydrophobicContact CG2-CB 4.04Å; I368-A370 PolarHBondContact O-N 3.43Å; I368-A370 VanDerWaalsContact O-N 3.12Å; I368-L371 HydrophobicContact CB-CB 4.41Å; I368-L371 PolarHBondContact O-N 3.07Å; I368-S372 PolarHBondContact O-N 3.02Å; I368-S372 PolarHBondContact O-OG 3.38Å; I368-Y433 WeakPolarHBondContact CD1-OH 3.46Å
369	K	84.4	Confident	90	Very high	69 Å²	69	29 Å²	29	30%	0.3	14%	0.143	S	C	.	.	H	α-helix	trans	-48.3	-41	176.7	-66.1	-174.8	177.2	-176.8	0	113	S372 N373 D392 T405 E1205	K369-S372 WeakPolarHBondContact O-CB 3.4Å; K369-S372 PolarHBondContact O-N 2.82Å; K369-N373 VanDerWaalsContact O-CG 3.3Å; K369-N373 PolarHBondContact O-N 3.45Å; K369-N373 PolarHBondContact O-OD1 3.27Å; K369-D392 WeakPolarHBondContact CD-OD2 3.4Å; K369-D392 WeakPolarHBondContact CE-OD2 3.45Å; K369-D392 VanDerWaalsContact NZ-CG 3.33Å; K369-D392 IonicContact NZ-OD1 3.73Å; K369-D392 PolarHBondContact NZ-OD1 3.49Å; K369-D392 IonicContact NZ-OD2 3.6Å; K369-D392 PolarHBondContact NZ-OD2 3.38Å; K369-T405 HydrophobicContact CG-CG2 4.17Å; K369-E1205 IonicContact NZ-OE1 2.82Å; K369-E1205 PolarHBondContact NZ-OE1 3.3Å; K369-E1205 IonicContact NZ-OE2 3.22Å
370	A	81.3	Confident	90	Very high	29 Å²	29	23.9 Å²	23.9	24%	0.24	12%	0.116	C	C	.	.	H	α-helix	trans	-63.4	-41.5	177.1	0	0	0	0	0	113.6	I368 N373 Q374	I368-A370 HydrophobicContact CG2-CB 4.04Å; I368-A370 PolarHBondContact O-N 3.43Å; I368-A370 VanDerWaalsContact O-N 3.12Å; A370-N373 PolarHBondContact O-N 2.97Å; A370-Q374 PolarHBondContact O-N 3.5Å
371	L	85	Confident	89.8	Confident	10 Å²	10	28.1 Å²	28.1	5%	0.052	14%	0.137	C	C	.	.	H	α-helix	trans	-69.7	-37.1	175.5	180	64	0	0	0	110.8	S366 I368 N373 Q374 K375	S366-L371 WeakPolarHBondContact OG-CB 3.43Å; I368-L371 HydrophobicContact CB-CB 4.41Å; I368-L371 PolarHBondContact O-N 3.07Å; L371-N373 VanDerWaalsContact C-N 3.34Å; L371-N373 PolarHBondContact O-N 3.3Å; L371-Q374 PolarHBondContact O-N 3.03Å; L371-K375 HydrophobicContact CD1-CG 4.12Å; L371-K375 HydrophobicContact CG-CG 4.28Å; L371-K375 WeakPolarHBondContact O-CB 3.36Å; L371-K375 VanDerWaalsContact O-CG 3.24Å; L371-K375 WeakPolarHBondContact O-CG 3.45Å; L371-K375 PolarHBondContact O-N 3.29Å
372	S	89.6	Confident	89.6	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-59.5	-43.6	172.5	-51.8	0	0	0	0	111.6	S366 I368 K369 K375 F376	S366-S372 VanDerWaalsContact CB-OG 3.3Å; S366-S372 WeakPolarHBondContact CB-OG 3.1Å; S366-S372 PolarHBondContact OG-N 3.43Å; S366-S372 PolarHBondContact OG-OG 3.14Å; I368-S372 PolarHBondContact O-N 3.02Å; I368-S372 PolarHBondContact O-OG 3.38Å; K369-S372 WeakPolarHBondContact O-CB 3.4Å; K369-S372 PolarHBondContact O-N 2.82Å; S372-K375 PolarHBondContact O-N 3.11Å; S372-F376 VanDerWaalsContact O-CB 3.32Å; S372-F376 WeakPolarHBondContact O-CB 3.48Å; S372-F376 PolarHBondContact O-N 2.83Å
373	N	88.1	Confident	89.4	Confident	24 Å²	24	31.2 Å²	31.2	13%	0.128	16%	0.157	C	C	.	.	H	α-helix	trans	-64.4	-43.1	175.1	-70.1	2.5	0	0	0	112.2	K369 A370 L371 F376 R377 S1242 Y1244	K369-N373 VanDerWaalsContact O-CG 3.3Å; K369-N373 PolarHBondContact O-N 3.45Å; K369-N373 PolarHBondContact O-OD1 3.27Å; A370-N373 PolarHBondContact O-N 2.97Å; L371-N373 VanDerWaalsContact C-N 3.34Å; L371-N373 PolarHBondContact O-N 3.3Å; N373-F376 PolarHBondContact O-N 3.15Å; N373-R377 PolarHBondContact O-N 3.4Å; N373-S1242 PolarHBondContact ND2-OG 3.25Å; N373-Y1244 HydrophobicContact CB-CD2 4.24Å; N373-Y1244 HydrophobicContact CB-CG 4.34Å; N373-Y1244 WeakPolarHBondContact O-CB 3.29Å
374	Q	86.7	Confident	89	Confident	14 Å²	14	33 Å²	33	7%	0.065	18%	0.176	C	C	.	.	H	α-helix	trans	-60.4	-51.8	175.3	-175.9	-178.9	6.4	0	0	110.9	A370 L371 F376 R377 D378 V675 Y1244	A370-Q374 PolarHBondContact O-N 3.5Å; L371-Q374 PolarHBondContact O-N 3.03Å; Q374-F376 VanDerWaalsContact C-N 3.3Å; Q374-F376 PolarHBondContact O-N 2.88Å; Q374-R377 WeakPolarHBondContact O-CB 3.2Å; Q374-R377 PolarHBondContact O-N 3.06Å; Q374-R377 VanDerWaalsContact O-N 3.1Å; Q374-D378 PolarHBondContact O-N 3.15Å; Q374-V675 VanDerWaalsContact OE1-CG1 3.28Å; Q374-Y1244 HydrophobicContact CB-CE1 4.34Å; Q374-Y1244 HydrophobicContact CG-CE1 4.36Å
375	K	89.3	Confident	88.8	Confident	14 Å²	14	36.5 Å²	36.5	6%	0.061	20%	0.195	C	C	.	.	H	α-helix	trans	-63	-34.9	-179.5	-69.5	-74.5	-179.8	152.6	0	112.6	Y364 L371 S372 D378 F379 I403 D429	Y364-K375 HydrophobicContact CE1-CB 4.39Å; Y364-K375 HydrophobicContact CE1-CD 4.27Å; Y364-K375 HydrophobicContact CE1-CG 3.99Å; Y364-K375 WeakPolarHBondContact OH-CE 3.3Å; Y364-K375 PolarHBondContact OH-NZ 2.84Å; L371-K375 HydrophobicContact CD1-CG 4.12Å; L371-K375 HydrophobicContact CG-CG 4.28Å; L371-K375 WeakPolarHBondContact O-CB 3.36Å; L371-K375 VanDerWaalsContact O-CG 3.24Å; L371-K375 WeakPolarHBondContact O-CG 3.45Å; L371-K375 PolarHBondContact O-N 3.29Å; S372-K375 PolarHBondContact O-N 3.11Å; K375-D378 PolarHBondContact O-N 3.43Å; K375-F379 HydrophobicContact CB-CE2 4.41Å; K375-F379 HydrophobicContact CD-CE2 4.36Å; K375-F379 HydrophobicContact CD-CZ 4.24Å; K375-F379 WeakPolarHBondContact O-CB 3.18Å; K375-F379 WeakPolarHBondContact O-CG 3.16Å; K375-F379 PolarHBondContact O-N 2.88Å; K375-I403 HydrophobicContact CB-CD1 4.34Å; K375-D429 IonicContact NZ-OD2 3.48Å
376	F	91.6	Very high	88.7	Confident	13 Å²	13	36.5 Å²	36.5	6%	0.057	20%	0.195	C	C	.	.	H	α-helix	trans	-57.5	-49.3	171.3	175.7	-100.8	0	0	0	111.4	S372 N373 Q374 D378 K380 V386 L388 L395 I403 T1245	S372-F376 VanDerWaalsContact O-CB 3.32Å; S372-F376 WeakPolarHBondContact O-CB 3.48Å; S372-F376 PolarHBondContact O-N 2.83Å; N373-F376 PolarHBondContact O-N 3.15Å; Q374-F376 VanDerWaalsContact C-N 3.3Å; Q374-F376 PolarHBondContact O-N 2.88Å; F376-D378 PolarHBondContact O-N 3.05Å; F376-K380 HydrophobicContact CE2-CD 4.34Å; F376-K380 HydrophobicContact CZ-CD 4.21Å; F376-K380 WeakPolarHBondContact O-CB 3.47Å; F376-K380 PolarHBondContact O-N 3.45Å; F376-V386 HydrophobicContact CD2-CG1 4.01Å; F376-V386 HydrophobicContact CE2-CG1 4.4Å; F376-V386 WeakPolarHBondContact CE2-O 3.35Å; F376-L388 HydrophobicContact CB-CD1 4.4Å; F376-L388 HydrophobicContact CB-CD2 4.4Å; F376-L388 HydrophobicContact CD2-CB 3.63Å; F376-L388 HydrophobicContact CE2-CB 3.97Å; F376-L388 HydrophobicContact CG-CB 4.07Å; F376-L388 HydrophobicContact CG-CD2 4.28Å; F376-L395 HydrophobicContact CE1-CD1 4.05Å; F376-L395 HydrophobicContact CZ-CB 4.45Å; F376-L395 HydrophobicContact CZ-CD1 4.01Å; F376-I403 HydrophobicContact CB-CD1 3.87Å; F376-I403 HydrophobicContact CD2-CD1 4.39Å; F376-T1245 HydrophobicContact CD1-CG2 4.45Å
377	R	89.3	Confident	88.9	Confident	80 Å²	80	36.5 Å²	36.5	30%	0.302	20%	0.195	S	C	.	.	H	α-helix	trans	-61.9	-46.4	176.7	-167.4	-178.1	-169.9	163	15.4	112.3	N373 Q374 K380 N381 M655 Y1244	N373-R377 PolarHBondContact O-N 3.4Å; Q374-R377 WeakPolarHBondContact O-CB 3.2Å; Q374-R377 PolarHBondContact O-N 3.06Å; Q374-R377 VanDerWaalsContact O-N 3.1Å; R377-K380 PolarHBondContact O-N 2.83Å; R377-N381 PolarHBondContact O-N 3.43Å; R377-N381 VanDerWaalsContact O-N 3.09Å; R377-N381 PolarHBondContact O-ND2 2.88Å; R377-N381 VanDerWaalsContact O-ND2 3.1Å; R377-M655 PolarHBondContact NH1-SD 3.04Å; R377-Y1244 HydrophobicContact CB-CD1 4.36Å
378	D	89.1	Confident	89.3	Confident	64 Å²	64	36.5 Å²	36.5	34%	0.342	19%	0.194	S	C	.	.	H	α-helix	trans	-60.5	-50	-178.2	-65.8	-17.4	0	0	0	110.9	Q374 K375 F376 N381 T382	Q374-D378 PolarHBondContact O-N 3.15Å; K375-D378 PolarHBondContact O-N 3.43Å; F376-D378 PolarHBondContact O-N 3.05Å; D378-N381 PolarHBondContact O-N 2.91Å; D378-T382 PolarHBondContact O-N 2.8Å; D378-T382 PolarHBondContact O-OG1 2.84Å; D378-T382 VanDerWaalsContact O-OG1 3.04Å
379	F	92.5	Very high	89.6	Confident	1 Å²	1	34.9 Å²	34.9	0%	0.004	19%	0.186	C	C	.	.	H	α-helix	trans	-74.1	-30.8	179	-62.8	-28.2	0	0	0	113.4	T345 A348 E349 I352 Y364 K375 N381 T382 F383 V386 I403	T345-F379 HydrophobicContact CG2-CE1 3.87Å; T345-F379 HydrophobicContact CG2-CZ 4.12Å; A348-F379 HydrophobicContact CB-CZ 4.47Å; E349-F379 HydrophobicContact CG-CE1 4.01Å; I352-F379 HydrophobicContact CD1-CD2 3.99Å; I352-F379 HydrophobicContact CD1-CE1 4.41Å; I352-F379 HydrophobicContact CD1-CE2 3.84Å; I352-F379 HydrophobicContact CD1-CG 4.37Å; I352-F379 HydrophobicContact CD1-CZ 4.05Å; Y364-F379 AromaticContact CD2-CE2 3.57Å; Y364-F379 HydrophobicContact CD2-CE2 3.57Å; Y364-F379 HydrophobicContact CD2-CZ 4.06Å; Y364-F379 AromaticContact CE2-CE2 3.66Å; Y364-F379 HydrophobicContact CE2-CE2 3.66Å; Y364-F379 AromaticContact CE2-CZ 3.75Å; Y364-F379 HydrophobicContact CE2-CZ 3.75Å; Y364-F379 HydrophobicContact CG-CE2 4.04Å; K375-F379 HydrophobicContact CB-CE2 4.41Å; K375-F379 HydrophobicContact CD-CE2 4.36Å; K375-F379 HydrophobicContact CD-CZ 4.24Å; K375-F379 WeakPolarHBondContact O-CB 3.18Å; K375-F379 WeakPolarHBondContact O-CG 3.16Å; K375-F379 PolarHBondContact O-N 2.88Å; F379-N381 VanDerWaalsContact C-N 3.29Å; F379-N381 PolarHBondContact O-N 3.28Å; F379-T382 PolarHBondContact O-N 3.1Å; F379-T382 VanDerWaalsContact O-N 3.15Å; F379-F383 HydrophobicContact CB-CD2 4.12Å; F379-F383 HydrophobicContact CD1-CD2 4.4Å; F379-F383 HydrophobicContact CD1-CE2 4.06Å; F379-F383 HydrophobicContact CG-CD2 4.49Å; F379-F383 PolarHBondContact O-N 2.84Å; F379-V386 HydrophobicContact CB-CG1 4.23Å; F379-V386 HydrophobicContact CB-CG2 3.93Å; F379-I403 HydrophobicContact CD2-CD1 3.87Å; F379-I403 HydrophobicContact CD2-CG1 4.45Å
380	K	91.9	Very high	89.6	Confident	72 Å²	72	31.9 Å²	31.9	31%	0.313	17%	0.174	S	C	.	.	H	α-helix	trans	-62.9	-37.5	173.7	-163.8	72.7	175	175.2	0	111.5	F376 R377 G384 V386	F376-K380 HydrophobicContact CE2-CD 4.34Å; F376-K380 HydrophobicContact CZ-CD 4.21Å; F376-K380 WeakPolarHBondContact O-CB 3.47Å; F376-K380 PolarHBondContact O-N 3.45Å; R377-K380 PolarHBondContact O-N 2.83Å; K380-G384 VanDerWaalsContact CD-O 3.27Å; K380-G384 WeakPolarHBondContact CD-O 3.44Å; K380-G384 WeakPolarHBondContact CE-O 3.16Å; K380-G384 PolarHBondContact NZ-O 3.35Å; K380-G384 WeakPolarHBondContact O-CA 3.38Å; K380-G384 PolarHBondContact O-N 3Å; K380-G384 VanDerWaalsContact O-N 3.15Å; K380-V386 HydrophobicContact CD-CB 4.12Å; K380-V386 PolarHBondContact NZ-O 3.09Å
381	N	90.6	Very high	89.2	Confident	125 Å²	125	31.2 Å²	31.2	67%	0.668	17%	0.17	S	C	*	.	H	α-helix	trans	-69.1	-31	173.9	-66.3	-29.2	0	0	0	113	R377 D378 F379	R377-N381 PolarHBondContact O-N 3.43Å; R377-N381 VanDerWaalsContact O-N 3.09Å; R377-N381 PolarHBondContact O-ND2 2.88Å; R377-N381 VanDerWaalsContact O-ND2 3.1Å; D378-N381 PolarHBondContact O-N 2.91Å; F379-N381 VanDerWaalsContact C-N 3.29Å; F379-N381 PolarHBondContact O-N 3.28Å
382	T	90.2	Very high	88.5	Confident	67 Å²	67	32.9 Å²	32.9	41%	0.411	18%	0.179	S	C	.	.	H	α-helix	trans	-88.2	-43.4	-175.4	-56.1	0	0	0	0	113.5	F311 D378 F379	F311-T382 HydrophobicContact CE2-CG2 4.14Å; F311-T382 HydrophobicContact CZ-CG2 3.79Å; D378-T382 PolarHBondContact O-N 2.8Å; D378-T382 PolarHBondContact O-OG1 2.84Å; D378-T382 VanDerWaalsContact O-OG1 3.04Å; F379-T382 PolarHBondContact O-N 3.1Å; F379-T382 VanDerWaalsContact O-N 3.15Å
383	F	90.4	Very high	88	Confident	32 Å²	32	36.3 Å²	36.3	14%	0.14	20%	0.199	C	C	.	.	H	α-helix	trans	-115.6	-19.3	-170.8	-59.2	-71.7	0	0	0	114.3	F311 E349 I352 A353 F379 D385 V386	F311-F383 AromaticContact CD2-CE1 3.88Å; F311-F383 HydrophobicContact CD2-CE1 3.88Å; F311-F383 AromaticContact CE2-CE1 3.79Å; F311-F383 HydrophobicContact CE2-CE1 3.79Å; F311-F383 HydrophobicContact CE2-CZ 4.37Å; E349-F383 HydrophobicContact CB-CZ 4.01Å; E349-F383 HydrophobicContact CG-CE2 4.25Å; E349-F383 HydrophobicContact CG-CZ 4.19Å; E349-F383 WeakPolarHBondContact O-CZ 3.42Å; I352-F383 HydrophobicContact CB-CE2 4.34Å; I352-F383 HydrophobicContact CB-CZ 4.35Å; I352-F383 HydrophobicContact CD1-CE2 4.31Å; I352-F383 HydrophobicContact CG2-CD1 4.31Å; I352-F383 HydrophobicContact CG2-CD2 4Å; I352-F383 HydrophobicContact CG2-CE1 4.36Å; I352-F383 HydrophobicContact CG2-CE2 4.04Å; I352-F383 HydrophobicContact CG2-CG 4.14Å; I352-F383 HydrophobicContact CG2-CZ 4.23Å; A353-F383 HydrophobicContact CB-CE1 4.19Å; F379-F383 HydrophobicContact CB-CD2 4.12Å; F379-F383 HydrophobicContact CD1-CD2 4.4Å; F379-F383 HydrophobicContact CD1-CE2 4.06Å; F379-F383 HydrophobicContact CG-CD2 4.49Å; F379-F383 PolarHBondContact O-N 2.84Å; F383-D385 PolarHBondContact O-N 2.87Å; F383-V386 HydrophobicContact CB-CG2 4.21Å
384	G	88.8	Confident	87.9	Confident	38 Å²	38	39.4 Å²	39.4	39%	0.392	21%	0.213	S	C	.	.	S	Bend	trans	72.6	-49.3	-178.3	0	0	0	0	0	115.1	K380 V386	K380-G384 VanDerWaalsContact CD-O 3.27Å; K380-G384 WeakPolarHBondContact CD-O 3.44Å; K380-G384 WeakPolarHBondContact CE-O 3.16Å; K380-G384 PolarHBondContact NZ-O 3.35Å; K380-G384 WeakPolarHBondContact O-CA 3.38Å; K380-G384 PolarHBondContact O-N 3Å; K380-G384 VanDerWaalsContact O-N 3.15Å; G384-V386 PolarHBondContact O-N 2.98Å
385	D	91.6	Very high	88	Confident	73 Å²	73	41 Å²	41	39%	0.39	22%	0.222	S	C	.	.			trans	-88	82	178.7	-174.8	40.5	0	0	0	112.3	F383 S399 S400	F383-D385 PolarHBondContact O-N 2.87Å; D385-S399 WeakPolarHBondContact OD1-CA 3.44Å; D385-S399 WeakPolarHBondContact OD1-CB 3.42Å; D385-S400 PolarHBondContact O-OG 3.36Å; D385-S400 VanDerWaalsContact OD2-CB 3.26Å; D385-S400 WeakPolarHBondContact OD2-CB 3.43Å; D385-S400 PolarHBondContact OD2-N 3.26Å; D385-S400 PolarHBondContact OD2-OG 2.88Å
386	V	94.3	Very high	88	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	139.3	-178.5	-174	0	0	0	0	109.8	F376 F379 K380 F383 G384 C401 I403	F376-V386 HydrophobicContact CD2-CG1 4.01Å; F376-V386 HydrophobicContact CE2-CG1 4.4Å; F376-V386 WeakPolarHBondContact CE2-O 3.35Å; F379-V386 HydrophobicContact CB-CG1 4.23Å; F379-V386 HydrophobicContact CB-CG2 3.93Å; K380-V386 HydrophobicContact CD-CB 4.12Å; K380-V386 PolarHBondContact NZ-O 3.09Å; F383-V386 HydrophobicContact CB-CG2 4.21Å; G384-V386 PolarHBondContact O-N 2.98Å; V386-C401 WeakPolarHBondContact CA-O 3.31Å; V386-C401 HydrophobicContact CG2-CB 4.31Å; V386-I403 HydrophobicContact CG1-CD1 3.64Å; V386-I403 HydrophobicContact CG1-CG1 4.06Å
387	G	93.7	Very high	87.9	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	164.5	177.3	0	0	0	0	0	112.8	L395 S399 C401 I403	G387-L395 CarbonylContact C-O 3.58Å; G387-L395 WeakPolarHBondContact CA-O 3.24Å; G387-S399 WeakPolarHBondContact CA-OG 3.29Å; G387-S399 PolarHBondContact N-OG 2.82Å; G387-C401 PolarHBondContact N-O 3.22Å; G387-I403 PolarHBondContact O-N 3.27Å
388	L	93.3	Very high	87.8	Confident	1 Å²	1	47 Å²	47	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	120.4	-177.9	177.6	66.6	0	0	0	110	F376 T390 Q394 L395 I403 T1245	F376-L388 HydrophobicContact CB-CD1 4.4Å; F376-L388 HydrophobicContact CB-CD2 4.4Å; F376-L388 HydrophobicContact CD2-CB 3.63Å; F376-L388 HydrophobicContact CE2-CB 3.97Å; F376-L388 HydrophobicContact CG-CB 4.07Å; F376-L388 HydrophobicContact CG-CD2 4.28Å; L388-T390 HydrophobicContact CD1-CG2 3.97Å; L388-T390 HydrophobicContact CG-CG2 4.12Å; L388-Q394 CarbonylContact O-C 3.29Å; L388-Q394 WeakPolarHBondContact O-CA 3.4Å; L388-L395 HydrophobicContact CB-CB 4.28Å; L388-L395 HydrophobicContact CB-CD1 4.43Å; L388-L395 HydrophobicContact CD2-CD1 4.2Å; L388-L395 PolarHBondContact N-O 2.78Å; L388-L395 PolarHBondContact O-N 3.48Å; L388-I403 CarbonylContact C-O 3.53Å; L388-I403 WeakPolarHBondContact CA-O 3.32Å; L388-I403 HydrophobicContact CD1-CB 4.22Å; L388-I403 HydrophobicContact CD1-CG2 4.1Å; L388-T1245 HydrophobicContact CD2-CG2 3.95Å
389	L	90.7	Very high	87.9	Confident	6 Å²	6	44.1 Å²	44.1	3%	0.031	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	110.4	177.3	-59.3	179.6	0	0	0	110.1	L151 Q394 P397 L402 I403 M404 I408	L151-L389 HydrophobicContact CD1-CD1 3.78Å; L151-L389 HydrophobicContact CD1-CD2 4.36Å; L151-L389 HydrophobicContact CD2-CD2 4.07Å; L151-L389 HydrophobicContact CG-CD1 4.39Å; L389-Q394 HydrophobicContact CD2-CB 3.97Å; L389-Q394 HydrophobicContact CD2-CG 3.98Å; L389-P397 HydrophobicContact CD2-CB 4.19Å; L389-L402 HydrophobicContact CD1-CD1 4.26Å; L389-L402 HydrophobicContact CD1-CD2 4.35Å; L389-I403 PolarHBondContact N-O 3.35Å; L389-M404 HydrophobicContact CB-CB 4.15Å; L389-M404 HydrophobicContact CD1-CE 4.01Å; L389-M404 WeakPolarHBondContact O-CA 3.18Å; L389-M404 WeakPolarHBondContact O-CB 3.38Å; L389-I408 HydrophobicContact CB-CG2 4.38Å
390	T	84.4	Confident	87.9	Confident	7 Å²	7	45.1 Å²	45.1	4%	0.043	26%	0.256	C	S	.	.			trans	-126.3	173.3	174.4	64.4	0	0	0	0	110.4	R152 L388 D392 V393	R152-T390 PolarHBondContact NH2-O 2.93Å; L388-T390 HydrophobicContact CD1-CG2 3.97Å; L388-T390 HydrophobicContact CG-CG2 4.12Å; T390-D392 PolarHBondContact O-N 3.41Å; T390-V393 PolarHBondContact N-O 2.92Å; T390-V393 PolarHBondContact OG1-N 3.23Å; T390-V393 PolarHBondContact OG1-O 3.09Å
391	G	72.1	Confident	88.1	Confident	15 Å²	15	41.7 Å²	41.7	16%	0.155	24%	0.241	C	C	.	.	S	Bend	trans	-64.7	-25.4	172.3	0	0	0	0	0	113.7	K1208	G391-K1208 PolarHBondContact O-NZ 2.9Å
392	D	71.1	Confident	88.3	Confident	45 Å²	45	35.7 Å²	35.7	24%	0.241	21%	0.209	C	C	.	.	S	Bend	trans	-94.5	-47.6	-174.1	-48.3	-53.4	0	0	0	112.4	K369 T390	K369-D392 WeakPolarHBondContact CD-OD2 3.4Å; K369-D392 WeakPolarHBondContact CE-OD2 3.45Å; K369-D392 VanDerWaalsContact NZ-CG 3.33Å; K369-D392 IonicContact NZ-OD1 3.73Å; K369-D392 PolarHBondContact NZ-OD1 3.49Å; K369-D392 IonicContact NZ-OD2 3.6Å; K369-D392 PolarHBondContact NZ-OD2 3.38Å; T390-D392 PolarHBondContact O-N 3.41Å
393	V	79.1	Confident	88.5	Confident	71 Å²	71	32.5 Å²	32.5	43%	0.43	19%	0.189	S	C	.	.			trans	-135	141.3	-170.4	-170.7	0	0	0	0	110.7	T390 L395	T390-V393 PolarHBondContact N-O 2.92Å; T390-V393 PolarHBondContact OG1-N 3.23Å; T390-V393 PolarHBondContact OG1-O 3.09Å; V393-L395 HydrophobicContact CG1-CD2 3.75Å; V393-L395 HydrophobicContact CG1-CG 3.87Å
394	Q	86.3	Confident	88.7	Confident	89 Å²	89	31 Å²	31	42%	0.416	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	124.2	170.4	-61	175.9	14.2	0	0	108.2	L388 L389	L388-Q394 CarbonylContact O-C 3.29Å; L388-Q394 WeakPolarHBondContact O-CA 3.4Å; L389-Q394 HydrophobicContact CD2-CB 3.97Å; L389-Q394 HydrophobicContact CD2-CG 3.98Å
395	L	88.9	Confident	88.9	Confident	48 Å²	48	29.6 Å²	29.6	25%	0.251	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	130	178.6	-57	176.7	0	0	0	109.2	F376 G387 L388 V393 T1245	F376-L395 HydrophobicContact CE1-CD1 4.05Å; F376-L395 HydrophobicContact CZ-CB 4.45Å; F376-L395 HydrophobicContact CZ-CD1 4.01Å; G387-L395 CarbonylContact C-O 3.58Å; G387-L395 WeakPolarHBondContact CA-O 3.24Å; L388-L395 HydrophobicContact CB-CB 4.28Å; L388-L395 HydrophobicContact CB-CD1 4.43Å; L388-L395 HydrophobicContact CD2-CD1 4.2Å; L388-L395 PolarHBondContact N-O 2.78Å; L388-L395 PolarHBondContact O-N 3.48Å; V393-L395 HydrophobicContact CG1-CD2 3.75Å; V393-L395 HydrophobicContact CG1-CG 3.87Å; L395-T1245 HydrophobicContact CD1-CG2 3.66Å
396	S	89.2	Confident	88.9	Confident	63 Å²	63	26.1 Å²	26.1	44%	0.441	15%	0.148	S	C	.	.			trans	46	58.4	176.3	-59.9	0	0	0	0	114.1	E398 S399	S396-E398 PolarHBondContact O-N 2.89Å; S396-E398 VanDerWaalsContact O-N 3.1Å; S396-S399 PolarHBondContact O-N 3.22Å; S396-S399 PolarHBondContact O-OG 2.76Å
397	P	87.9	Confident	88.7	Confident	39 Å²	39	28.6 Å²	28.6	25%	0.253	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-18.4	-174.8	26.4	-36	0	0	0	114.9	L151 L389 L402	L151-P397 HydrophobicContact CD1-CB 3.63Å; L151-P397 HydrophobicContact CD2-CB 3.59Å; L151-P397 HydrophobicContact CD2-CG 4.4Å; L151-P397 HydrophobicContact CG-CB 4.24Å; L389-P397 HydrophobicContact CD2-CB 4.19Å; P397-L402 WeakPolarHBondContact O-CD2 3.48Å
398	E	87.9	Confident	88.6	Confident	131 Å²	131	29.9 Å²	29.9	61%	0.612	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-5.8	-178	-60.1	-51.1	145.6	0	0	115	R361 S396	R361-E398 PolarHBondContact NH2-O 2.63Å; R361-E398 IonicContact NH2-OE2 2.7Å; R361-E398 PolarHBondContact NH2-OE2 3.03Å; S396-E398 PolarHBondContact O-N 2.89Å; S396-E398 VanDerWaalsContact O-N 3.1Å
399	S	91.6	Very high	88.6	Confident	4 Å²	4	29.8 Å²	29.8	3%	0.028	17%	0.166	C	C	.	.	S	Bend	trans	-62.7	153.7	-176.5	58.4	0	0	0	0	113.7	D385 G387 S396 C401 L402	D385-S399 WeakPolarHBondContact OD1-CA 3.44Å; D385-S399 WeakPolarHBondContact OD1-CB 3.42Å; G387-S399 WeakPolarHBondContact CA-OG 3.29Å; G387-S399 PolarHBondContact N-OG 2.82Å; S396-S399 PolarHBondContact O-N 3.22Å; S396-S399 PolarHBondContact O-OG 2.76Å; S399-C401 PolarHBondContact O-N 2.92Å; S399-C401 PolarHBondContact OG-O 3.46Å; S399-L402 WeakPolarHBondContact OG-CD2 3.44Å
400	S	92	Very high	88.6	Confident	21 Å²	21	32 Å²	32	15%	0.147	17%	0.173	C	C	.	.	S	Bend	trans	-58.5	-40.2	173.9	54.5	0	0	0	0	113.7	Q356 R361 T362 D385	Q356-S400 PolarHBondContact NE2-OG 2.96Å; R361-S400 CarbonylContact C-O 3.5Å; R361-S400 VanDerWaalsContact CA-O 3.28Å; R361-S400 WeakPolarHBondContact CA-O 3.34Å; T362-S400 PolarHBondContact N-O 2.73Å; D385-S400 PolarHBondContact O-OG 3.36Å; D385-S400 VanDerWaalsContact OD2-CB 3.26Å; D385-S400 WeakPolarHBondContact OD2-CB 3.43Å; D385-S400 PolarHBondContact OD2-N 3.26Å; D385-S400 PolarHBondContact OD2-OG 2.88Å
401	C	95.3	Very high	88.9	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	111	179.4	176.9	0	0	0	0	111.8	I352 V386 G387 S399	I352-C401 HydrophobicContact CG2-CB 3.98Å; V386-C401 WeakPolarHBondContact CA-O 3.31Å; V386-C401 HydrophobicContact CG2-CB 4.31Å; G387-C401 PolarHBondContact N-O 3.22Å; S399-C401 PolarHBondContact O-N 2.92Å; S399-C401 PolarHBondContact OG-O 3.46Å
402	L	95.3	Very high	89.8	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	120.4	178.9	-65.2	174.6	0	0	0	111.7	T362 I363 Y364 L389 P397 S399 M404 V419	T362-L402 PolarHBondContact O-N 2.91Å; I363-L402 CarbonylContact C-O 3.6Å; I363-L402 WeakPolarHBondContact CA-O 3.32Å; I363-L402 HydrophobicContact CG1-CB 4.32Å; Y364-L402 PolarHBondContact N-O 2.84Å; L389-L402 HydrophobicContact CD1-CD1 4.26Å; L389-L402 HydrophobicContact CD1-CD2 4.35Å; P397-L402 WeakPolarHBondContact O-CD2 3.48Å; S399-L402 WeakPolarHBondContact OG-CD2 3.44Å; L402-M404 HydrophobicContact CB-CE 3.9Å; L402-M404 HydrophobicContact CD1-CE 4.5Å; L402-V419 HydrophobicContact CD1-CG1 3.67Å
403	I	95.4	Very high	90.8	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	128.7	174.2	-56.7	171.4	0	0	0	109	Y364 K375 F376 F379 V386 G387 L388 L389	Y364-I403 HydrophobicContact CD1-CG2 4.38Å; Y364-I403 WeakPolarHBondContact O-CA 3.37Å; K375-I403 HydrophobicContact CB-CD1 4.34Å; F376-I403 HydrophobicContact CB-CD1 3.87Å; F376-I403 HydrophobicContact CD2-CD1 4.39Å; F379-I403 HydrophobicContact CD2-CD1 3.87Å; F379-I403 HydrophobicContact CD2-CG1 4.45Å; V386-I403 HydrophobicContact CG1-CD1 3.64Å; V386-I403 HydrophobicContact CG1-CG1 4.06Å; G387-I403 PolarHBondContact O-N 3.27Å; L388-I403 CarbonylContact C-O 3.53Å; L388-I403 WeakPolarHBondContact CA-O 3.32Å; L388-I403 HydrophobicContact CD1-CB 4.22Å; L388-I403 HydrophobicContact CD1-CG2 4.1Å; L389-I403 PolarHBondContact N-O 3.35Å
404	M	94.4	Very high	91.3	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	177.6	179.9	65	-173.8	73.7	0	0	112.7	I363 Y364 T365 S366 L389 L402 I408 L409 M412	I363-M404 HydrophobicContact CB-CE 4.42Å; I363-M404 HydrophobicContact CD1-CE 3.79Å; I363-M404 HydrophobicContact CD1-SD 4.41Å; I363-M404 HydrophobicContact CG1-CE 3.83Å; I363-M404 HydrophobicContact CG2-CE 3.77Å; I363-M404 HydrophobicContact CG2-CG 3.9Å; I363-M404 HydrophobicContact CG2-SD 3.83Å; Y364-M404 PolarHBondContact O-N 3.04Å; T365-M404 WeakPolarHBondContact CA-O 3.43Å; T365-M404 HydrophobicContact CG2-CG 4.42Å; S366-M404 PolarHBondContact N-O 2.94Å; L389-M404 HydrophobicContact CB-CB 4.15Å; L389-M404 HydrophobicContact CD1-CE 4.01Å; L389-M404 WeakPolarHBondContact O-CA 3.18Å; L389-M404 WeakPolarHBondContact O-CB 3.38Å; L402-M404 HydrophobicContact CB-CE 3.9Å; L402-M404 HydrophobicContact CD1-CE 4.5Å; M404-I408 HydrophobicContact CB-CB 4.26Å; M404-I408 HydrophobicContact CB-CG2 4.24Å; M404-I408 HydrophobicContact SD-CG2 4.13Å; M404-L409 HydrophobicContact CG-CB 4.5Å; M404-L409 HydrophobicContact SD-CB 3.82Å; M404-L409 HydrophobicContact SD-CD1 4.31Å; M404-M412 HydrophobicContact CE-CE 4.45Å; M404-M412 HydrophobicContact CE-SD 3.93Å; M404-M412 HydrophobicContact SD-SD 3.85Å
405	T	92.1	Very high	91.3	Very high	8 Å²	8	25.2 Å²	25.2	5%	0.049	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	158.7	167.5	76.4	0	0	0	0	110.7	S366 K369 E407 I408 L409	S366-T405 WeakPolarHBondContact O-CA 3.18Å; K369-T405 HydrophobicContact CG-CG2 4.17Å; T405-E407 WeakPolarHBondContact CB-OE2 3.43Å; T405-E407 PolarHBondContact O-N 3.47Å; T405-E407 PolarHBondContact OG1-OE2 3.04Å; T405-I408 PolarHBondContact O-N 3.42Å; T405-I408 VanDerWaalsContact O-N 3.09Å; T405-L409 PolarHBondContact O-N 3.17Å
406	T	91.5	Very high	91.3	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.006	13%	0.125	C	C	.	.	H	α-helix	trans	-61.7	-30.3	-177.6	45.2	0	0	0	0	112.7	T365 I408 L409 R410 W443	T365-T406 HydrophobicContact CG2-CG2 4.34Å; T406-I408 VanDerWaalsContact C-N 3.33Å; T406-I408 PolarHBondContact O-N 3.24Å; T406-L409 PolarHBondContact O-N 2.99Å; T406-R410 WeakPolarHBondContact O-CB 3.22Å; T406-R410 PolarHBondContact O-N 2.91Å; T406-W443 HydrophobicContact CG2-CD2 4.29Å; T406-W443 HydrophobicContact CG2-CZ2 4Å
407	E	90.1	Very high	91.4	Very high	52 Å²	52	19.9 Å²	19.9	24%	0.243	10%	0.104	C	C	.	.	H	α-helix	trans	-66.3	-33.9	176	-51	89.1	160.7	0	0	112.3	T405 S411 R439 V442	T405-E407 WeakPolarHBondContact CB-OE2 3.43Å; T405-E407 PolarHBondContact O-N 3.47Å; T405-E407 PolarHBondContact OG1-OE2 3.04Å; E407-S411 PolarHBondContact O-N 2.99Å; E407-S411 VanDerWaalsContact O-N 3.12Å; E407-R439 IonicContact OE1-CZ 3.84Å; E407-R439 IonicContact OE1-NE 3.15Å; E407-R439 IonicContact OE1-NH2 2.63Å; E407-R439 PolarHBondContact OE1-NH2 3.18Å; E407-V442 HydrophobicContact CG-CG1 4.31Å
408	I	91.1	Very high	91.4	Very high	26 Å²	26	18.8 Å²	18.8	13%	0.133	10%	0.095	C	C	.	.	H	α-helix	trans	-71	-45.2	175.6	-60.3	-63.6	0	0	0	110.4	L389 M404 T405 T406 R410 S411 M412	L389-I408 HydrophobicContact CB-CG2 4.38Å; M404-I408 HydrophobicContact CB-CB 4.26Å; M404-I408 HydrophobicContact CB-CG2 4.24Å; M404-I408 HydrophobicContact SD-CG2 4.13Å; T405-I408 PolarHBondContact O-N 3.42Å; T405-I408 VanDerWaalsContact O-N 3.09Å; T406-I408 VanDerWaalsContact C-N 3.33Å; T406-I408 PolarHBondContact O-N 3.24Å; I408-R410 VanDerWaalsContact C-N 3.33Å; I408-R410 PolarHBondContact O-N 2.8Å; I408-S411 WeakPolarHBondContact O-CB 3.47Å; I408-S411 PolarHBondContact O-N 3.37Å; I408-S411 VanDerWaalsContact O-N 3.15Å; I408-M412 HydrophobicContact CG2-SD 4.21Å; I408-M412 WeakPolarHBondContact O-CG 3.11Å; I408-M412 PolarHBondContact O-N 3.42Å
409	L	93.4	Very high	91.5	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-61	-42.1	176	-178.5	55.5	0	0	0	111.6	I363 T365 M404 T405 T406 S411 M412 L413 V426 V446	I363-L409 HydrophobicContact CD1-CD1 3.95Å; I363-L409 HydrophobicContact CG2-CD2 4.28Å; T365-L409 HydrophobicContact CG2-CB 4.29Å; T365-L409 HydrophobicContact CG2-CD2 3.49Å; T365-L409 VanDerWaalsContact CG2-CD2 3.49Å; M404-L409 HydrophobicContact CG-CB 4.5Å; M404-L409 HydrophobicContact SD-CB 3.82Å; M404-L409 HydrophobicContact SD-CD1 4.31Å; T405-L409 PolarHBondContact O-N 3.17Å; T406-L409 PolarHBondContact O-N 2.99Å; L409-S411 VanDerWaalsContact C-N 3.33Å; L409-S411 PolarHBondContact O-N 3.18Å; L409-M412 PolarHBondContact O-N 3.04Å; L409-L413 HydrophobicContact CD1-CD1 4.38Å; L409-L413 HydrophobicContact CG-CD1 4.15Å; L409-L413 WeakPolarHBondContact O-CG 3.47Å; L409-L413 PolarHBondContact O-N 2.91Å; L409-V426 HydrophobicContact CD2-CG1 3.95Å; L409-V446 HydrophobicContact CD2-CG1 3.69Å; L409-V446 HydrophobicContact CG-CG1 4Å
410	R	92.1	Very high	91.5	Very high	51 Å²	51	12.5 Å²	12.5	19%	0.192	7%	0.066	C	C	.	.	H	α-helix	trans	-56.3	-45.9	172.7	-173.3	-175.8	62.3	159.3	2.8	112	T406 I408 L413 Y414 V442 E445 V446	T406-R410 WeakPolarHBondContact O-CB 3.22Å; T406-R410 PolarHBondContact O-N 2.91Å; I408-R410 VanDerWaalsContact C-N 3.33Å; I408-R410 PolarHBondContact O-N 2.8Å; R410-L413 PolarHBondContact O-N 3.41Å; R410-Y414 HydrophobicContact CG-CD2 3.83Å; R410-Y414 HydrophobicContact CG-CE2 3.59Å; R410-Y414 WeakPolarHBondContact O-CD2 3.49Å; R410-Y414 PolarHBondContact O-N 3.41Å; R410-Y414 VanDerWaalsContact O-N 3.11Å; R410-V442 HydrophobicContact CB-CG1 4.09Å; R410-E445 WeakPolarHBondContact CD-OE2 3.36Å; R410-E445 IonicContact NH1-OE1 2.66Å; R410-E445 PolarHBondContact NH1-OE1 3.05Å; R410-E445 VanDerWaalsContact NH1-OE1 3.12Å; R410-E445 IonicContact NH1-OE2 3.7Å; R410-V446 HydrophobicContact CB-CG2 3.59Å; R410-V446 HydrophobicContact CG-CG2 4.22Å
411	S	89.4	Confident	91.4	Very high	47 Å²	47	16.9 Å²	16.9	33%	0.329	8%	0.079	S	C	.	.	H	α-helix	trans	-63.7	-40.1	177.5	-177.1	0	0	0	0	112.1	E407 I408 L409 L413 N415	E407-S411 PolarHBondContact O-N 2.99Å; E407-S411 VanDerWaalsContact O-N 3.12Å; I408-S411 WeakPolarHBondContact O-CB 3.47Å; I408-S411 PolarHBondContact O-N 3.37Å; I408-S411 VanDerWaalsContact O-N 3.15Å; L409-S411 VanDerWaalsContact C-N 3.33Å; L409-S411 PolarHBondContact O-N 3.18Å; S411-L413 VanDerWaalsContact C-N 3.33Å; S411-L413 PolarHBondContact O-N 3.42Å; S411-N415 WeakPolarHBondContact O-CB 3.47Å; S411-N415 PolarHBondContact O-N 2.82Å; S411-N415 VanDerWaalsContact O-N 3.08Å; S411-N415 PolarHBondContact O-ND2 3.25Å; S411-N415 PolarHBondContact OG-ND2 2.92Å
412	M	91.6	Very high	91.2	Very high	2 Å²	2	20.4 Å²	20.4	1%	0.01	10%	0.097	C	C	.	.	H	α-helix	trans	-63.6	-37.8	176.5	-72	171.9	67	0	0	112.2	L151 M404 I408 L409 G416 S417 V419 I420	L151-M412 WeakPolarHBondContact O-CE 3.44Å; M404-M412 HydrophobicContact CE-CE 4.45Å; M404-M412 HydrophobicContact CE-SD 3.93Å; M404-M412 HydrophobicContact SD-SD 3.85Å; I408-M412 HydrophobicContact CG2-SD 4.21Å; I408-M412 WeakPolarHBondContact O-CG 3.11Å; I408-M412 PolarHBondContact O-N 3.42Å; L409-M412 PolarHBondContact O-N 3.04Å; M412-G416 PolarHBondContact O-N 3.24Å; M412-G416 VanDerWaalsContact O-N 3.13Å; M412-S417 WeakPolarHBondContact CE-OG 3.35Å; M412-S417 PolarHBondContact O-N 3.49Å; M412-V419 HydrophobicContact CE-CB 3.81Å; M412-V419 HydrophobicContact CE-CG1 3.98Å; M412-V419 HydrophobicContact CE-CG2 4.29Å; M412-I420 HydrophobicContact CB-CD1 4.31Å; M412-I420 WeakPolarHBondContact O-CD1 3.49Å
413	L	92.1	Very high	91.1	Very high	8 Å²	8	20.5 Å²	20.5	4%	0.042	10%	0.098	C	C	.	.	H	α-helix	trans	-65.8	-53.2	176.9	-75.8	160.2	0	0	0	111.8	P159 L409 R410 S411 N415 G416 I420 V446 M449 L450	P159-L413 VanDerWaalsContact CB-O 3.32Å; P159-L413 WeakPolarHBondContact CB-O 3.48Å; L409-L413 HydrophobicContact CD1-CD1 4.38Å; L409-L413 HydrophobicContact CG-CD1 4.15Å; L409-L413 WeakPolarHBondContact O-CG 3.47Å; L409-L413 PolarHBondContact O-N 2.91Å; R410-L413 PolarHBondContact O-N 3.41Å; S411-L413 VanDerWaalsContact C-N 3.33Å; S411-L413 PolarHBondContact O-N 3.42Å; L413-N415 VanDerWaalsContact C-N 3.26Å; L413-N415 PolarHBondContact O-N 2.95Å; L413-G416 PolarHBondContact O-N 3.22Å; L413-I420 HydrophobicContact CD2-CD1 3.89Å; L413-I420 HydrophobicContact CG-CD1 4.15Å; L413-V446 HydrophobicContact CD1-CB 4.33Å; L413-V446 HydrophobicContact CD1-CG1 3.93Å; L413-V446 HydrophobicContact CD1-CG2 4.24Å; L413-M449 HydrophobicContact CB-CB 4.4Å; L413-M449 HydrophobicContact CD1-CB 4.19Å; L413-L450 HydrophobicContact CD1-CD2 4.28Å; L413-L450 HydrophobicContact CD2-CD2 4.29Å
414	Y	89.4	Confident	91.1	Very high	13 Å²	13	21.2 Å²	21.2	5%	0.051	10%	0.101	C	C	.	.	H	α-helix	trans	-62.4	-32.1	178.4	-77.2	-59.8	0	0	0	113.7	R410 E445 M449 N759 L760 R762	R410-Y414 HydrophobicContact CG-CD2 3.83Å; R410-Y414 HydrophobicContact CG-CE2 3.59Å; R410-Y414 WeakPolarHBondContact O-CD2 3.49Å; R410-Y414 PolarHBondContact O-N 3.41Å; R410-Y414 VanDerWaalsContact O-N 3.11Å; Y414-E445 VanDerWaalsContact CE2-OE2 3.26Å; Y414-E445 WeakPolarHBondContact CE2-OE2 3.35Å; Y414-E445 PolarHBondContact OH-OE2 2.93Å; Y414-M449 HydrophobicContact CD1-CE 4.45Å; Y414-M449 HydrophobicContact CE1-CE 4.45Å; Y414-N759 HydrophobicContact CD1-CB 3.89Å; Y414-N759 HydrophobicContact CE1-CB 4.08Å; Y414-N759 HydrophobicContact CG-CB 4.33Å; Y414-L760 HydrophobicContact CE1-CD2 4.18Å; Y414-L760 HydrophobicContact CE1-CG 4.49Å; Y414-R762 PolarHBondContact O-NH2 2.83Å
415	N	87.5	Confident	91.1	Very high	15 Å²	15	21.2 Å²	21.2	8%	0.08	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	1.7	-178.8	-67.5	-9.1	0	0	0	113.8	R152 G153 S154 N155 S411 L413	R152-N415 VanDerWaalsContact O-CB 3.22Å; R152-N415 WeakPolarHBondContact O-CB 3.44Å; R152-N415 PolarHBondContact O-ND2 3.25Å; G153-N415 VanDerWaalsContact CA-O 3.28Å; G153-N415 WeakPolarHBondContact CA-O 3.3Å; S154-N415 PolarHBondContact N-O 3.14Å; N155-N415 VanDerWaalsContact CG-OD1 3.23Å; N155-N415 PolarHBondContact ND2-OD1 2.96Å; N155-N415 PolarHBondContact OD1-OD1 3.18Å; S411-N415 WeakPolarHBondContact O-CB 3.47Å; S411-N415 PolarHBondContact O-N 2.82Å; S411-N415 VanDerWaalsContact O-N 3.08Å; S411-N415 PolarHBondContact O-ND2 3.25Å; S411-N415 PolarHBondContact OG-ND2 2.92Å; L413-N415 VanDerWaalsContact C-N 3.26Å; L413-N415 PolarHBondContact O-N 2.95Å
416	G	87.8	Confident	91.4	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	50.7	178.8	0	0	0	0	0	113.9	R142 M412 L413	R142-G416 PolarHBondContact NH2-O 3.06Å; M412-G416 PolarHBondContact O-N 3.24Å; M412-G416 VanDerWaalsContact O-N 3.13Å; L413-G416 PolarHBondContact O-N 3.22Å
417	S	90.6	Very high	91.6	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.099	C	C	.	.			trans	-64.1	131.1	176.1	170.7	0	0	0	0	112.2	S150 L151 F160 M412 V419 I420	S150-S417 PolarHBondContact O-OG 3.38Å; L151-S417 PolarHBondContact O-OG 2.94Å; L151-S417 VanDerWaalsContact O-OG 3.08Å; F160-S417 WeakPolarHBondContact CE2-O 3.47Å; M412-S417 WeakPolarHBondContact CE-OG 3.35Å; M412-S417 PolarHBondContact O-N 3.49Å; S417-V419 PolarHBondContact O-N 3.01Å; S417-V419 PolarHBondContact OG-N 3.07Å; S417-I420 WeakPolarHBondContact O-CB 3.39Å; S417-I420 WeakPolarHBondContact O-CG1 3.37Å; S417-I420 PolarHBondContact O-N 3.05Å
418	E	89.1	Confident	91.8	Very high	15 Å²	15	18.3 Å²	18.3	7%	0.07	9%	0.087	C	C	.	.	G	3₁₀ helix	trans	-63	-23.9	-179.6	-57.9	-61.7	164.3	0	0	113	P144 G145 S150 I420 R421	P144-E418 WeakPolarHBondContact CA-OE1 3.44Å; P144-E418 HydrophobicContact CB-CG 4.33Å; G145-E418 PolarHBondContact N-OE1 3Å; S150-E418 PolarHBondContact O-N 2.96Å; E418-I420 PolarHBondContact O-N 3.32Å; E418-R421 WeakPolarHBondContact O-CB 3.4Å; E418-R421 PolarHBondContact O-N 3.42Å
419	V	90.5	Very high	91.9	Very high	3 Å²	3	17.4 Å²	17.4	2%	0.018	8%	0.083	C	C	.	.	G	3₁₀ helix	trans	-56.3	-25	176	-180	0	0	0	0	112.4	L151 L402 M412 S417 R421	L151-V419 HydrophobicContact CD1-CG2 4.22Å; L402-V419 HydrophobicContact CD1-CG1 3.67Å; M412-V419 HydrophobicContact CE-CB 3.81Å; M412-V419 HydrophobicContact CE-CG1 3.98Å; M412-V419 HydrophobicContact CE-CG2 4.29Å; S417-V419 PolarHBondContact O-N 3.01Å; S417-V419 PolarHBondContact OG-N 3.07Å; V419-R421 PolarHBondContact O-N 3.35Å
420	I	91.6	Very high	91.7	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.005	9%	0.086	C	C	.	.	G	3₁₀ helix	trans	-70.7	-21.3	179.3	-58.4	168.7	0	0	0	111.6	F160 M412 L413 S417 E418 L423 P451 H453	F160-I420 HydrophobicContact CD2-CB 4.15Å; F160-I420 HydrophobicContact CD2-CG2 4.21Å; F160-I420 HydrophobicContact CE2-CB 4.33Å; M412-I420 HydrophobicContact CB-CD1 4.31Å; M412-I420 WeakPolarHBondContact O-CD1 3.49Å; L413-I420 HydrophobicContact CD2-CD1 3.89Å; L413-I420 HydrophobicContact CG-CD1 4.15Å; S417-I420 WeakPolarHBondContact O-CB 3.39Å; S417-I420 WeakPolarHBondContact O-CG1 3.37Å; S417-I420 PolarHBondContact O-N 3.05Å; E418-I420 PolarHBondContact O-N 3.32Å; I420-L423 HydrophobicContact CG2-CD2 4.4Å; I420-L423 VanDerWaalsContact O-CB 3.28Å; I420-L423 WeakPolarHBondContact O-CB 3.49Å; I420-P451 HydrophobicContact CG2-CG 3.68Å; I420-H453 PolarHBondContact O-CE1 3.29Å; I420-H453 PolarHBondContact O-NE2 3.15Å
421	R	89.4	Confident	91.7	Very high	112 Å²	112	15.7 Å²	15.7	42%	0.423	8%	0.077	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-41.5	176.8	-175.1	178.6	177.1	146.6	2.3	112.3	R142 E418 V419 L423	R142-R421 PolarHBondContact O-NH1 3.08Å; E418-R421 WeakPolarHBondContact O-CB 3.4Å; E418-R421 PolarHBondContact O-N 3.42Å; V419-R421 PolarHBondContact O-N 3.35Å; R421-L423 PolarHBondContact O-N 3.45Å
422	D	90.9	Very high	91.6	Very high	74 Å²	74	14.9 Å²	14.9	40%	0.396	7%	0.068	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-1.6	-177.4	-50.7	-31.1	0	0	0	113.1	R361	R361-D422 HydrophobicContact CB-CB 4.17Å; R361-D422 HydrophobicContact CG-CB 3.94Å; R361-D422 IonicContact CZ-OD2 3.46Å; R361-D422 PolarHBondContact N-O 2.87Å; R361-D422 IonicContact NE-OD2 3.79Å; R361-D422 IonicContact NH1-OD2 2.67Å; R361-D422 PolarHBondContact NH1-OD2 2.93Å
423	L	93.4	Very high	91.4	Very high	2 Å²	2	15.6 Å²	15.6	1%	0.01	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	114.8	-168.3	-176.1	64.7	0	0	0	112	I363 I420 R421 W425 V426 H453 V454	I363-L423 HydrophobicContact CB-CD1 3.95Å; I363-L423 HydrophobicContact CD1-CD1 3.72Å; I363-L423 HydrophobicContact CD1-CD2 4.07Å; I363-L423 HydrophobicContact CG1-CD1 3.61Å; I420-L423 HydrophobicContact CG2-CD2 4.4Å; I420-L423 VanDerWaalsContact O-CB 3.28Å; I420-L423 WeakPolarHBondContact O-CB 3.49Å; R421-L423 PolarHBondContact O-N 3.45Å; L423-W425 WeakPolarHBondContact CD1-O 3.3Å; L423-V426 HydrophobicContact CD1-CG2 4.03Å; L423-V426 HydrophobicContact CD2-CG2 3.62Å; L423-V426 HydrophobicContact CG-CG2 4.04Å; L423-H453 PolarHBondContact O-CD2 3.06Å; L423-H453 PolarHBondContact O-NE2 3.46Å; L423-V454 HydrophobicContact CB-CG2 4.31Å; L423-V454 HydrophobicContact CD2-CG1 4.09Å; L423-V454 HydrophobicContact CD2-CG2 3.84Å; L423-V454 HydrophobicContact CG-CG1 4.16Å; L423-V454 HydrophobicContact CG-CG2 4.04Å
424	E	94.6	Very high	91.3	Very high	15 Å²	15	15.2 Å²	15.2	7%	0.07	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	-45.5	173.5	-168.7	-174.9	144.4	0	0	111.3	H331 H358 T360 R361 S455	H331-E424 IonicContact CD2-OE1 3.61Å; H331-E424 IonicContact NE2-OE1 3.15Å; H358-E424 VanDerWaalsContact CB-OE2 3.31Å; H358-E424 WeakPolarHBondContact CB-OE2 3.45Å; H358-E424 IonicContact CE1-OE1 2.98Å; H358-E424 IonicContact CG-OE2 2.7Å; H358-E424 IonicContact ND1-OE1 3.87Å; H358-E424 PolarHBondContact ND1-OE1 3.35Å; H358-E424 IonicContact ND1-OE2 3.25Å; H358-E424 PolarHBondContact ND1-OE2 2.94Å; H358-E424 VanDerWaalsContact ND1-OE2 3.09Å; T360-E424 WeakPolarHBondContact CB-OE2 3.45Å; T360-E424 HydrophobicContact CG2-CB 4.06Å; T360-E424 VanDerWaalsContact CG2-OE2 3.28Å; T360-E424 WeakPolarHBondContact CG2-OE2 3.24Å; T360-E424 WeakPolarHBondContact OG1-CB 3.36Å; T360-E424 PolarHBondContact OG1-OE2 2.92Å; R361-E424 PolarHBondContact O-N 2.89Å; E424-S455 PolarHBondContact O-N 3.43Å
425	W	95.8	Very high	91.2	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	134.3	-173.2	-63	94	0	0	0	113.1	L328 D332 L354 S355 T362 I363 L423 S455 I457	L328-W425 HydrophobicContact CD2-CE3 4.19Å; L328-W425 HydrophobicContact CD2-CH2 3.6Å; L328-W425 HydrophobicContact CD2-CZ2 4.27Å; L328-W425 HydrophobicContact CD2-CZ3 3.53Å; D332-W425 WeakPolarHBondContact O-CH2 3.49Å; L354-W425 HydrophobicContact CD2-CZ2 4.3Å; S355-W425 VanDerWaalsContact OG-CD1 3.29Å; T362-W425 WeakPolarHBondContact CA-O 3.34Å; T362-W425 HydrophobicContact CG2-CB 4.17Å; I363-W425 PolarHBondContact N-O 2.66Å; L423-W425 WeakPolarHBondContact CD1-O 3.3Å; W425-S455 WeakPolarHBondContact CA-O 3.5Å; W425-I457 HydrophobicContact CB-CD1 4.45Å; W425-I457 HydrophobicContact CD2-CD1 4.05Å; W425-I457 HydrophobicContact CD2-CG1 4.5Å; W425-I457 HydrophobicContact CE3-CD1 3.56Å; W425-I457 HydrophobicContact CE3-CG1 3.56Å; W425-I457 HydrophobicContact CG-CD1 4.45Å; W425-I457 HydrophobicContact CZ3-CD1 4.12Å; W425-I457 HydrophobicContact CZ3-CG1 3.92Å
426	V	96.8	Very high	91.1	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	119.3	165.2	-177.8	0	0	0	0	109.8	I363 T365 L409 L423 F428 L450 V454 S455 I457	I363-V426 HydrophobicContact CB-CG2 4.44Å; I363-V426 WeakPolarHBondContact O-CA 3.38Å; T365-V426 HydrophobicContact CG2-CG1 4.33Å; L409-V426 HydrophobicContact CD2-CG1 3.95Å; L423-V426 HydrophobicContact CD1-CG2 4.03Å; L423-V426 HydrophobicContact CD2-CG2 3.62Å; L423-V426 HydrophobicContact CG-CG2 4.04Å; V426-F428 HydrophobicContact CB-CE2 4Å; V426-F428 HydrophobicContact CG1-CD2 3.88Å; V426-F428 HydrophobicContact CG1-CE1 4.24Å; V426-F428 HydrophobicContact CG1-CE2 3.38Å; V426-F428 HydrophobicContact CG1-CG 4.49Å; V426-F428 HydrophobicContact CG1-CZ 3.6Å; V426-L450 HydrophobicContact CB-CD1 4.42Å; V426-L450 HydrophobicContact CG2-CD1 4.35Å; V426-L450 HydrophobicContact CG2-CD2 4Å; V426-V454 HydrophobicContact CB-CG1 4.31Å; V426-V454 HydrophobicContact CG2-CG1 3.59Å; V426-S455 PolarHBondContact N-O 2.8Å; V426-I457 PolarHBondContact O-N 3.19Å
427	I	96.6	Very high	90.8	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	126.2	175.9	-57.1	161	0	0	0	108.4	A348 A351 I352 T362 I363 Y364 T365 I457 L459	A348-I427 HydrophobicContact CB-CD1 3.94Å; A348-I427 HydrophobicContact CB-CG2 4.07Å; A351-I427 HydrophobicContact CB-CD1 4.26Å; I352-I427 HydrophobicContact CD1-CD1 4.37Å; I352-I427 HydrophobicContact CG1-CD1 4.07Å; T362-I427 HydrophobicContact CG2-CD1 3.64Å; T362-I427 HydrophobicContact CG2-CG1 4.19Å; I363-I427 PolarHBondContact O-N 3.34Å; Y364-I427 HydrophobicContact CD2-CB 3.95Å; Y364-I427 HydrophobicContact CD2-CD1 4.01Å; Y364-I427 HydrophobicContact CD2-CG2 3.69Å; Y364-I427 HydrophobicContact CE2-CG2 3.77Å; T365-I427 PolarHBondContact N-O 2.88Å; T365-I427 PolarHBondContact OG1-O 2.65Å; I427-I457 HydrophobicContact CG1-CB 4.16Å; I427-I457 HydrophobicContact CG1-CD1 4.06Å; I427-I457 HydrophobicContact CG1-CG2 4.45Å; I427-I457 HydrophobicContact CG2-CG2 4.41Å; I427-L459 HydrophobicContact CG2-CD1 4Å; I427-L459 HydrophobicContact CG2-CG 4.45Å
428	F	95.1	Very high	90.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	107	179.2	-76.6	-77.1	0	0	0	110	T365 V426 V431 W443 V446 L447 L450 I456 I457 L458 L459	T365-F428 WeakPolarHBondContact OG1-CA 3.43Å; T365-F428 WeakPolarHBondContact OG1-CD1 3.43Å; V426-F428 HydrophobicContact CB-CE2 4Å; V426-F428 HydrophobicContact CG1-CD2 3.88Å; V426-F428 HydrophobicContact CG1-CE1 4.24Å; V426-F428 HydrophobicContact CG1-CE2 3.38Å; V426-F428 HydrophobicContact CG1-CG 4.49Å; V426-F428 HydrophobicContact CG1-CZ 3.6Å; F428-V431 HydrophobicContact CB-CG2 4.01Å; F428-W443 HydrophobicContact CB-CH2 3.73Å; F428-W443 HydrophobicContact CB-CZ3 3.58Å; F428-W443 AromaticContact CD1-CE3 3.81Å; F428-W443 HydrophobicContact CD1-CE3 3.81Å; F428-W443 AromaticContact CD1-CH2 3.72Å; F428-W443 HydrophobicContact CD1-CH2 3.72Å; F428-W443 AromaticContact CD1-CZ3 3.31Å; F428-W443 HydrophobicContact CD1-CZ3 3.31Å; F428-W443 HydrophobicContact CE1-CE3 4.33Å; F428-W443 HydrophobicContact CE1-CZ3 4.25Å; F428-W443 HydrophobicContact CG-CH2 4.18Å; F428-W443 AromaticContact CG-CZ3 3.74Å; F428-W443 HydrophobicContact CG-CZ3 3.74Å; F428-V446 HydrophobicContact CE1-CG1 3.98Å; F428-V446 HydrophobicContact CZ-CG1 3.81Å; F428-L447 HydrophobicContact CD2-CD2 4.24Å; F428-L447 HydrophobicContact CE1-CD2 4.43Å; F428-L447 HydrophobicContact CE2-CD2 3.66Å; F428-L447 HydrophobicContact CZ-CD2 3.77Å; F428-L447 HydrophobicContact CZ-CG 4.35Å; F428-L450 HydrophobicContact CE2-CD1 4Å; F428-L450 HydrophobicContact CZ-CD1 3.99Å; F428-I456 HydrophobicContact CD2-CG2 3.82Å; F428-I456 HydrophobicContact CE2-CG2 3.91Å; F428-I457 PolarHBondContact N-O 2.75Å; F428-L458 HydrophobicContact CB-CD2 4.03Å; F428-L458 HydrophobicContact CD2-CD2 4.15Å; F428-L458 HydrophobicContact CG-CD2 4.29Å; F428-L459 PolarHBondContact O-N 3.06Å
429	D	92.4	Very high	90	Very high	8 Å²	8	30.3 Å²	30.3	4%	0.043	15%	0.149	C	C	.	.	S	Bend	trans	-90.7	140.3	180	-159.2	13.4	0	0	0	112.5	Y364 T365 K375 W443	Y364-D429 HydrophobicContact CE1-CB 3.9Å; Y364-D429 PolarHBondContact OH-OD2 3.07Å; T365-D429 WeakPolarHBondContact O-CB 3.34Å; T365-D429 PolarHBondContact O-N 3.48Å; K375-D429 IonicContact NZ-OD2 3.48Å; D429-W443 WeakPolarHBondContact O-CH2 3.21Å
430	E	89.5	Confident	89.9	Confident	14 Å²	14	30.2 Å²	30.2	7%	0.065	15%	0.148	C	C	.	.			trans	49.7	51.9	-177.7	-54.7	-68.2	-142.5	0	0	114.5	K344 H432 Y433 L459	K344-E430 IonicContact NZ-OE2 2.82Å; K344-E430 PolarHBondContact NZ-OE2 3.24Å; E430-H432 WeakPolarHBondContact CB-CE1 3.18Å; E430-H432 WeakPolarHBondContact CG-CE1 3.4Å; E430-H432 PolarHBondContact O-N 3.29Å; E430-H432 IonicContact OE1-CE1 3.69Å; E430-H432 PolarHBondContact OE1-CE1 3.19Å; E430-H432 IonicContact OE2-CE1 2.78Å; E430-H432 PolarHBondContact OE2-CE1 3.03Å; E430-H432 IonicContact OE2-ND1 2.6Å; E430-Y433 HydrophobicContact CB-CD2 3.95Å; E430-Y433 HydrophobicContact CB-CE2 4.3Å; E430-Y433 WeakPolarHBondContact O-CB 3.32Å; E430-Y433 WeakPolarHBondContact O-CD2 3.23Å; E430-Y433 PolarHBondContact O-N 3.26Å; E430-L459 WeakPolarHBondContact CA-O 3.19Å; E430-L459 PolarHBondContact N-O 3.39Å
431	V	90.9	Very high	89.8	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-49.8	-23.8	-178.6	179.4	0	0	0	0	114.4	F428 Y433 I434 W443 L458 L459 F469	F428-V431 HydrophobicContact CB-CG2 4.01Å; V431-Y433 PolarHBondContact O-N 3.48Å; V431-I434 WeakPolarHBondContact O-CG2 3.41Å; V431-I434 PolarHBondContact O-N 3.05Å; V431-W443 HydrophobicContact CB-CH2 4.35Å; V431-W443 HydrophobicContact CB-CZ3 4.07Å; V431-W443 HydrophobicContact CG1-CZ3 4.14Å; V431-W443 HydrophobicContact CG2-CH2 4.05Å; V431-W443 HydrophobicContact CG2-CZ3 3.79Å; V431-L458 HydrophobicContact CG1-CD2 4.22Å; V431-L458 HydrophobicContact CG2-CB 3.97Å; V431-L458 HydrophobicContact CG2-CD2 3.75Å; V431-L458 HydrophobicContact CG2-CG 4.49Å; V431-L459 WeakPolarHBondContact CG2-O 3.27Å; V431-L459 PolarHBondContact N-O 3.1Å; V431-F469 HydrophobicContact CG1-CE1 3.64Å; V431-F469 HydrophobicContact CG1-CZ 4.02Å
432	H	88.4	Confident	89.9	Confident	31 Å²	31	25.5 Å²	25.5	14%	0.144	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-60	-10.6	173.9	65.3	-96	0	0	0	114.2	E430 I434 N435 S460 A461 V463 Q705 L746	E430-H432 WeakPolarHBondContact CB-CE1 3.18Å; E430-H432 WeakPolarHBondContact CG-CE1 3.4Å; E430-H432 PolarHBondContact O-N 3.29Å; E430-H432 IonicContact OE1-CE1 3.69Å; E430-H432 PolarHBondContact OE1-CE1 3.19Å; E430-H432 IonicContact OE2-CE1 2.78Å; E430-H432 PolarHBondContact OE2-CE1 3.03Å; E430-H432 IonicContact OE2-ND1 2.6Å; H432-I434 PolarHBondContact O-N 2.85Å; H432-N435 PolarHBondContact O-N 3.15Å; H432-S460 PolarHBondContact N-OG 2.83Å; H432-A461 PolarHBondContact ND1-N 3.5Å; H432-V463 HydrophobicContact CB-CG1 4.2Å; H432-Q705 PolarHBondContact NE2-NE2 3.42Å; H432-L746 HydrophobicContact CB-CD2 4.3Å
433	Y	87.1	Confident	89.9	Confident	17 Å²	17	22 Å²	22	7%	0.067	11%	0.113	C	C	.	.	G	3₁₀ helix	trans	-64	-9.5	166	-91.7	-75.7	0	0	0	115.1	P367 I368 E430 V431 N435 D436 M673	P367-Y433 HydrophobicContact CB-CD2 3.92Å; P367-Y433 HydrophobicContact CB-CE2 4.25Å; P367-Y433 HydrophobicContact CB-CG 4.06Å; P367-Y433 HydrophobicContact CG-CD2 3.58Å; P367-Y433 HydrophobicContact CG-CE2 3.75Å; P367-Y433 HydrophobicContact CG-CG 4.24Å; I368-Y433 WeakPolarHBondContact CD1-OH 3.46Å; E430-Y433 HydrophobicContact CB-CD2 3.95Å; E430-Y433 HydrophobicContact CB-CE2 4.3Å; E430-Y433 WeakPolarHBondContact O-CB 3.32Å; E430-Y433 WeakPolarHBondContact O-CD2 3.23Å; E430-Y433 PolarHBondContact O-N 3.26Å; V431-Y433 PolarHBondContact O-N 3.48Å; Y433-N435 PolarHBondContact O-N 3.27Å; Y433-D436 HydrophobicContact CD1-CB 4.33Å; Y433-D436 WeakPolarHBondContact O-CB 3.44Å; Y433-D436 PolarHBondContact O-N 2.77Å; Y433-M673 HydrophobicContact CE1-CE 4.04Å; Y433-M673 WeakPolarHBondContact OH-CB 3.29Å; Y433-M673 WeakPolarHBondContact OH-CE 3.49Å
434	I	89.2	Confident	89.8	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.112	C	C	.	.	G	3₁₀ helix	trans	-59.3	-24	171.9	-163.2	172.7	0	0	0	113.1	V431 H432 D436 G440 W443 E444 F469 L746 Q749	V431-I434 WeakPolarHBondContact O-CG2 3.41Å; V431-I434 PolarHBondContact O-N 3.05Å; H432-I434 PolarHBondContact O-N 2.85Å; I434-D436 PolarHBondContact O-N 2.77Å; I434-G440 VanDerWaalsContact O-CA 3.31Å; I434-G440 WeakPolarHBondContact O-CA 3.29Å; I434-W443 HydrophobicContact CG1-CB 4.45Å; I434-E444 HydrophobicContact CD1-CG 3.84Å; I434-E444 HydrophobicContact CG1-CG 4.22Å; I434-F469 HydrophobicContact CD1-CE2 3.43Å; I434-F469 VanDerWaalsContact CD1-CE2 3.43Å; I434-F469 HydrophobicContact CD1-CZ 3.79Å; I434-L746 HydrophobicContact CG2-CB 4.31Å; I434-L746 HydrophobicContact CG2-CD1 4.49Å; I434-L746 HydrophobicContact CG2-CD2 3.81Å; I434-L746 HydrophobicContact CG2-CG 4.42Å; I434-Q749 WeakPolarHBondContact O-CG 3.29Å
435	N	88.3	Confident	89.7	Confident	46 Å²	46	21.2 Å²	21.2	25%	0.246	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-75.5	-3.4	174.8	-71.7	3.2	0	0	0	114	H432 Y433 I745 L746 Q747	H432-N435 PolarHBondContact O-N 3.15Å; Y433-N435 PolarHBondContact O-N 3.27Å; N435-I745 PolarHBondContact ND2-O 3.04Å; N435-L746 VanDerWaalsContact OD1-CA 3.29Å; N435-L746 WeakPolarHBondContact OD1-CA 3.38Å; N435-Q747 PolarHBondContact OD1-N 3.14Å; N435-Q747 PolarHBondContact OD1-O 2.92Å
436	D	86.3	Confident	89.6	Confident	54 Å²	54	21.2 Å²	21.2	29%	0.289	11%	0.11	S	C	.	.			trans	-78.4	124.5	177.8	-175.9	-71.2	0	0	0	110.6	Y433 I434 E438 R439 G440	Y433-D436 HydrophobicContact CD1-CB 4.33Å; Y433-D436 WeakPolarHBondContact O-CB 3.44Å; Y433-D436 PolarHBondContact O-N 2.77Å; I434-D436 PolarHBondContact O-N 2.77Å; D436-E438 VanDerWaalsContact C-N 3.27Å; D436-E438 PolarHBondContact O-N 2.82Å; D436-E438 PolarHBondContact OD1-N 2.93Å; D436-R439 HydrophobicContact CB-CB 4.13Å; D436-R439 PolarHBondContact O-N 3.24Å; D436-R439 WeakPolarHBondContact OD1-CB 3.48Å; D436-R439 PolarHBondContact OD1-N 2.94Å; D436-G440 WeakPolarHBondContact O-CA 3.47Å; D436-G440 PolarHBondContact O-N 3.49Å
437	A	80.9	Confident	89.4	Confident	55 Å²	55	21.3 Å²	21.3	46%	0.455	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-19.7	-173.6	0	0	0	0	0	114.8
438	E	79.8	Confident	89.2	Confident	138 Å²	138	21.3 Å²	21.3	65%	0.645	11%	0.11	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-37.3	174.6	-67.6	-174.9	173.9	0	0	111.5	D436	D436-E438 VanDerWaalsContact C-N 3.27Å; D436-E438 PolarHBondContact O-N 2.82Å; D436-E438 PolarHBondContact OD1-N 2.93Å
439	R	83.2	Confident	89	Confident	67 Å²	67	21.7 Å²	21.7	25%	0.253	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-24.9	-165.1	-67	167	150.3	-132.1	-36.4	114.5	P367 E407 D436 V441 V442 W443	P367-R439 VanDerWaalsContact O-CZ 3.28Å; P367-R439 PolarHBondContact O-NH1 3.35Å; P367-R439 PolarHBondContact O-NH2 3.07Å; P367-R439 VanDerWaalsContact O-NH2 3.11Å; E407-R439 IonicContact OE1-CZ 3.84Å; E407-R439 IonicContact OE1-NE 3.15Å; E407-R439 IonicContact OE1-NH2 2.63Å; E407-R439 PolarHBondContact OE1-NH2 3.18Å; D436-R439 HydrophobicContact CB-CB 4.13Å; D436-R439 PolarHBondContact O-N 3.24Å; D436-R439 WeakPolarHBondContact OD1-CB 3.48Å; D436-R439 PolarHBondContact OD1-N 2.94Å; R439-V441 PolarHBondContact O-N 3.4Å; R439-V442 WeakPolarHBondContact O-CB 3.46Å; R439-V442 PolarHBondContact O-N 3.39Å; R439-V442 VanDerWaalsContact O-N 3.07Å; R439-W443 PolarHBondContact O-N 3.42Å
440	G	87.3	Confident	89	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-58.6	-33.9	178.5	0	0	0	0	0	113.3	I434 D436 V442 W443 E444	I434-G440 VanDerWaalsContact O-CA 3.31Å; I434-G440 WeakPolarHBondContact O-CA 3.29Å; D436-G440 WeakPolarHBondContact O-CA 3.47Å; D436-G440 PolarHBondContact O-N 3.49Å; G440-V442 VanDerWaalsContact C-N 3.35Å; G440-V442 PolarHBondContact O-N 2.85Å; G440-W443 WeakPolarHBondContact O-CB 3.15Å; G440-W443 PolarHBondContact O-N 2.79Å; G440-W443 VanDerWaalsContact O-N 3.17Å; G440-E444 PolarHBondContact O-N 3.39Å
441	V	89.6	Confident	89.1	Confident	4 Å²	4	20.8 Å²	20.8	2%	0.024	11%	0.107	C	C	.	.	H	α-helix	trans	-54.4	-49.4	172.7	-164.1	0	0	0	0	111.4	R439 W443 E444 E445 Q749 F750 R751	R439-V441 PolarHBondContact O-N 3.4Å; V441-W443 VanDerWaalsContact C-N 3.25Å; V441-W443 PolarHBondContact O-N 3.37Å; V441-E444 PolarHBondContact O-N 3.05Å; V441-E445 HydrophobicContact CG1-CG 4.45Å; V441-E445 WeakPolarHBondContact O-CB 3.27Å; V441-E445 WeakPolarHBondContact O-CG 3.27Å; V441-E445 PolarHBondContact O-N 2.84Å; V441-Q749 WeakPolarHBondContact CG2-O 3.35Å; V441-F750 HydrophobicContact CG1-CD2 4.49Å; V441-R751 HydrophobicContact CG1-CG 4.46Å; V441-R751 HydrophobicContact CG2-CG 3.75Å
442	V	91	Very high	89	Confident	10 Å²	10	24.5 Å²	24.5	6%	0.061	13%	0.128	C	C	.	.	H	α-helix	trans	-61.7	-36.9	-178.9	-179.6	0	0	0	0	111	E407 R410 R439 G440 V446	E407-V442 HydrophobicContact CG-CG1 4.31Å; R410-V442 HydrophobicContact CB-CG1 4.09Å; R439-V442 WeakPolarHBondContact O-CB 3.46Å; R439-V442 PolarHBondContact O-N 3.39Å; R439-V442 VanDerWaalsContact O-N 3.07Å; G440-V442 VanDerWaalsContact C-N 3.35Å; G440-V442 PolarHBondContact O-N 2.85Å; V442-V446 WeakPolarHBondContact O-CB 3.43Å; V442-V446 VanDerWaalsContact O-CG2 3.22Å; V442-V446 WeakPolarHBondContact O-CG2 3.28Å; V442-V446 PolarHBondContact O-N 2.71Å
443	W	91.6	Very high	89.1	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-66.2	-48.2	177.6	-85.6	79	0	0	0	112.3	T406 F428 D429 V431 I434 R439 G440 V441 V446 L447	T406-W443 HydrophobicContact CG2-CD2 4.29Å; T406-W443 HydrophobicContact CG2-CZ2 4Å; F428-W443 HydrophobicContact CB-CH2 3.73Å; F428-W443 HydrophobicContact CB-CZ3 3.58Å; F428-W443 AromaticContact CD1-CE3 3.81Å; F428-W443 HydrophobicContact CD1-CE3 3.81Å; F428-W443 AromaticContact CD1-CH2 3.72Å; F428-W443 HydrophobicContact CD1-CH2 3.72Å; F428-W443 AromaticContact CD1-CZ3 3.31Å; F428-W443 HydrophobicContact CD1-CZ3 3.31Å; F428-W443 HydrophobicContact CE1-CE3 4.33Å; F428-W443 HydrophobicContact CE1-CZ3 4.25Å; F428-W443 HydrophobicContact CG-CH2 4.18Å; F428-W443 AromaticContact CG-CZ3 3.74Å; F428-W443 HydrophobicContact CG-CZ3 3.74Å; D429-W443 WeakPolarHBondContact O-CH2 3.21Å; V431-W443 HydrophobicContact CB-CH2 4.35Å; V431-W443 HydrophobicContact CB-CZ3 4.07Å; V431-W443 HydrophobicContact CG1-CZ3 4.14Å; V431-W443 HydrophobicContact CG2-CH2 4.05Å; V431-W443 HydrophobicContact CG2-CZ3 3.79Å; I434-W443 HydrophobicContact CG1-CB 4.45Å; R439-W443 PolarHBondContact O-N 3.42Å; G440-W443 WeakPolarHBondContact O-CB 3.15Å; G440-W443 PolarHBondContact O-N 2.79Å; G440-W443 VanDerWaalsContact O-N 3.17Å; V441-W443 VanDerWaalsContact C-N 3.25Å; V441-W443 PolarHBondContact O-N 3.37Å; W443-V446 PolarHBondContact O-N 2.6Å; W443-L447 WeakPolarHBondContact O-CB 3.43Å; W443-L447 WeakPolarHBondContact O-CG 3.44Å; W443-L447 PolarHBondContact O-N 2.97Å
444	E	92	Very high	89.4	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-63.7	-43.5	175.7	-69.5	-170.9	-124.6	0	0	111.5	I434 G440 V441 V446 L447 I448 W472 S748 Q749 F750 F776	I434-E444 HydrophobicContact CD1-CG 3.84Å; I434-E444 HydrophobicContact CG1-CG 4.22Å; G440-E444 PolarHBondContact O-N 3.39Å; V441-E444 PolarHBondContact O-N 3.05Å; E444-V446 PolarHBondContact O-N 3.15Å; E444-L447 PolarHBondContact O-N 2.87Å; E444-I448 VanDerWaalsContact O-CG1 3.31Å; E444-I448 WeakPolarHBondContact O-CG1 3.23Å; E444-I448 PolarHBondContact O-N 3.4Å; E444-W472 HydrophobicContact CB-CH2 4.46Å; E444-W472 HydrophobicContact CG-CH2 4.08Å; E444-S748 VanDerWaalsContact CD-OG 3.27Å; E444-S748 VanDerWaalsContact OE1-CA 3.24Å; E444-S748 WeakPolarHBondContact OE1-CA 3.43Å; E444-S748 VanDerWaalsContact OE1-CB 3.29Å; E444-S748 WeakPolarHBondContact OE1-CB 3.37Å; E444-S748 PolarHBondContact OE1-OG 3.25Å; E444-S748 PolarHBondContact OE2-OG 2.57Å; E444-Q749 PolarHBondContact OE1-N 2.92Å; E444-F750 HydrophobicContact CB-CD2 4.22Å; E444-F750 PolarHBondContact OE1-N 3.09Å; E444-F776 VanDerWaalsContact OE2-CB 3.3Å; E444-F776 WeakPolarHBondContact OE2-CB 3.21Å; E444-F776 PolarHBondContact OE2-N 3.47Å
445	E	91.6	Very high	89.6	Confident	1 Å²	1	25 Å²	25	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-56.1	-49.3	176	-73.4	-177.2	-114.2	0	0	111.9	R410 Y414 V441 I448 M449 M756 M771	R410-E445 WeakPolarHBondContact CD-OE2 3.36Å; R410-E445 IonicContact NH1-OE1 2.66Å; R410-E445 PolarHBondContact NH1-OE1 3.05Å; R410-E445 VanDerWaalsContact NH1-OE1 3.12Å; R410-E445 IonicContact NH1-OE2 3.7Å; Y414-E445 VanDerWaalsContact CE2-OE2 3.26Å; Y414-E445 WeakPolarHBondContact CE2-OE2 3.35Å; Y414-E445 PolarHBondContact OH-OE2 2.93Å; V441-E445 HydrophobicContact CG1-CG 4.45Å; V441-E445 WeakPolarHBondContact O-CB 3.27Å; V441-E445 WeakPolarHBondContact O-CG 3.27Å; V441-E445 PolarHBondContact O-N 2.84Å; E445-I448 PolarHBondContact O-N 3.1Å; E445-M449 VanDerWaalsContact O-CB 3.28Å; E445-M449 WeakPolarHBondContact O-CB 3.31Å; E445-M449 VanDerWaalsContact O-CG 3.23Å; E445-M449 WeakPolarHBondContact O-CG 3.43Å; E445-M449 PolarHBondContact O-N 3.07Å; E445-M756 HydrophobicContact CG-SD 4.06Å; E445-M771 HydrophobicContact CB-CE 3.81Å; E445-M771 HydrophobicContact CG-CE 3.71Å
446	V	93.5	Very high	89.9	Confident	1 Å²	1	23 Å²	23	1%	0.006	12%	0.12	C	C	.	.	H	α-helix	trans	-64.4	-47.1	179.6	169.1	0	0	0	0	111.3	L409 R410 L413 F428 V442 W443 E444 I448 M449 L450	L409-V446 HydrophobicContact CD2-CG1 3.69Å; L409-V446 HydrophobicContact CG-CG1 4Å; R410-V446 HydrophobicContact CB-CG2 3.59Å; R410-V446 HydrophobicContact CG-CG2 4.22Å; L413-V446 HydrophobicContact CD1-CB 4.33Å; L413-V446 HydrophobicContact CD1-CG1 3.93Å; L413-V446 HydrophobicContact CD1-CG2 4.24Å; F428-V446 HydrophobicContact CE1-CG1 3.98Å; F428-V446 HydrophobicContact CZ-CG1 3.81Å; V442-V446 WeakPolarHBondContact O-CB 3.43Å; V442-V446 VanDerWaalsContact O-CG2 3.22Å; V442-V446 WeakPolarHBondContact O-CG2 3.28Å; V442-V446 PolarHBondContact O-N 2.71Å; W443-V446 PolarHBondContact O-N 2.6Å; E444-V446 PolarHBondContact O-N 3.15Å; V446-I448 VanDerWaalsContact C-N 3.29Å; V446-I448 PolarHBondContact O-N 3.28Å; V446-M449 PolarHBondContact O-N 2.98Å; V446-L450 HydrophobicContact CG1-CG 4.45Å; V446-L450 WeakPolarHBondContact O-CG 3.33Å; V446-L450 PolarHBondContact O-N 3.36Å
447	L	93.2	Very high	90.4	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-60.2	-40	-180	-74.9	170.2	0	0	0	111.6	F428 W443 E444 I456 L458 F469 W472 I473 K477	F428-L447 HydrophobicContact CD2-CD2 4.24Å; F428-L447 HydrophobicContact CE1-CD2 4.43Å; F428-L447 HydrophobicContact CE2-CD2 3.66Å; F428-L447 HydrophobicContact CZ-CD2 3.77Å; F428-L447 HydrophobicContact CZ-CG 4.35Å; W443-L447 WeakPolarHBondContact O-CB 3.43Å; W443-L447 WeakPolarHBondContact O-CG 3.44Å; W443-L447 PolarHBondContact O-N 2.97Å; E444-L447 PolarHBondContact O-N 2.87Å; L447-I456 HydrophobicContact CD2-CD1 4.35Å; L447-I456 HydrophobicContact CD2-CG2 4.36Å; L447-L458 HydrophobicContact CD2-CD2 4.49Å; L447-F469 HydrophobicContact CD1-CZ 4.12Å; L447-W472 HydrophobicContact CB-CH2 4.42Å; L447-W472 HydrophobicContact CD1-CH2 4.29Å; L447-W472 HydrophobicContact CD1-CZ3 4.02Å; L447-I473 HydrophobicContact CD1-CD1 4.03Å; L447-I473 HydrophobicContact CD2-CD1 4.31Å; L447-K477 WeakPolarHBondContact O-CE 3.22Å; L447-K477 PolarHBondContact O-NZ 3.19Å
448	I	91.6	Very high	91.1	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.005	9%	0.085	C	C	.	.	H	α-helix	trans	-67.3	-46.6	174.7	-65	166.1	0	0	0	110.5	P162 M165 E444 E445 V446 L450 W472 I476 K477 M771 R774	P162-I448 WeakPolarHBondContact CB-O 3.36Å; M165-I448 HydrophobicContact CE-CG2 4.34Å; E444-I448 VanDerWaalsContact O-CG1 3.31Å; E444-I448 WeakPolarHBondContact O-CG1 3.23Å; E444-I448 PolarHBondContact O-N 3.4Å; E445-I448 PolarHBondContact O-N 3.1Å; V446-I448 VanDerWaalsContact C-N 3.29Å; V446-I448 PolarHBondContact O-N 3.28Å; I448-L450 PolarHBondContact O-N 3.45Å; I448-W472 HydrophobicContact CG1-CZ2 4.41Å; I448-I476 HydrophobicContact CG1-CD1 4.29Å; I448-K477 PolarHBondContact O-NZ 3.47Å; I448-M771 HydrophobicContact CD1-CG 4.26Å; I448-M771 HydrophobicContact CG2-CG 4.37Å; I448-R774 HydrophobicContact CD1-CB 4.19Å; I448-R774 HydrophobicContact CG1-CB 4.3Å; I448-R774 HydrophobicContact CG2-CB 4.27Å
449	M	91.3	Very high	91.8	Very high	7 Å²	7	11.3 Å²	11.3	3%	0.034	5%	0.054	C	C	.	.	H	α-helix	trans	-75.2	-18	-172.1	-72.7	-64.7	-64.7	0	0	116.4	P159 P162 L413 Y414 E445 V446 L766 M771	P159-M449 HydrophobicContact CB-CE 4.09Å; P159-M449 HydrophobicContact CG-CE 4.41Å; P162-M449 HydrophobicContact CG-CE 4.14Å; P162-M449 HydrophobicContact CG-SD 3.8Å; L413-M449 HydrophobicContact CB-CB 4.4Å; L413-M449 HydrophobicContact CD1-CB 4.19Å; Y414-M449 HydrophobicContact CD1-CE 4.45Å; Y414-M449 HydrophobicContact CE1-CE 4.45Å; E445-M449 VanDerWaalsContact O-CB 3.28Å; E445-M449 WeakPolarHBondContact O-CB 3.31Å; E445-M449 VanDerWaalsContact O-CG 3.23Å; E445-M449 WeakPolarHBondContact O-CG 3.43Å; E445-M449 PolarHBondContact O-N 3.07Å; V446-M449 PolarHBondContact O-N 2.98Å; M449-L766 HydrophobicContact CE-CD1 4.04Å; M449-M771 HydrophobicContact CG-CE 4.04Å
450	L	93.4	Very high	92.2	Very high	1 Å²	1	8.1 Å²	8.1	1%	0.005	4%	0.042	C	C	.	.	S	Bend	trans	-55.3	138	178.2	-79.6	172.6	0	0	0	112.1	G163 L413 V426 F428 V446 I448 V454 I456 K477	G163-L450 PolarHBondContact N-O 2.6Å; L413-L450 HydrophobicContact CD1-CD2 4.28Å; L413-L450 HydrophobicContact CD2-CD2 4.29Å; V426-L450 HydrophobicContact CB-CD1 4.42Å; V426-L450 HydrophobicContact CG2-CD1 4.35Å; V426-L450 HydrophobicContact CG2-CD2 4Å; F428-L450 HydrophobicContact CE2-CD1 4Å; F428-L450 HydrophobicContact CZ-CD1 3.99Å; V446-L450 HydrophobicContact CG1-CG 4.45Å; V446-L450 WeakPolarHBondContact O-CG 3.33Å; V446-L450 PolarHBondContact O-N 3.36Å; I448-L450 PolarHBondContact O-N 3.45Å; L450-V454 HydrophobicContact CD2-CG1 4.34Å; L450-I456 HydrophobicContact CD1-CD1 4.25Å; L450-I456 HydrophobicContact CD1-CG1 4.32Å; L450-K477 PolarHBondContact O-NZ 3.48Å
451	P	91.6	Very high	92.2	Very high	2 Å²	2	9.2 Å²	9.2	1%	0.013	5%	0.051	C	C	.	.			trans	-60.7	169.4	174.8	-26.9	37.4	0	0	0	114.1	F160 L161 I420 H453 V454	F160-P451 HydrophobicContact CB-CG 4.02Å; L161-P451 WeakPolarHBondContact O-CA 3.48Å; I420-P451 HydrophobicContact CG2-CG 3.68Å; P451-H453 WeakPolarHBondContact CB-ND1 3.41Å; P451-V454 HydrophobicContact CB-CG2 4.44Å
452	D	88.1	Confident	92	Very high	79 Å²	79	9.4 Å²	9.4	42%	0.422	5%	0.052	S	C	.	.	S	Bend	trans	-62.2	-53.9	178.3	-168.9	-30.7	0	0	0	111.3	G163 V454 R479	G163-D452 VanDerWaalsContact CA-N 3.3Å; D452-V454 PolarHBondContact O-N 2.77Å; D452-R479 PolarHBondContact O-NE 3.1Å; D452-R479 VanDerWaalsContact O-NE 3.09Å; D452-R479 PolarHBondContact O-NH1 2.76Å; D452-R479 PolarHBondContact O-NH2 3.47Å; D452-R479 IonicContact OD1-CZ 2.62Å; D452-R479 IonicContact OD1-NE 2.7Å; D452-R479 PolarHBondContact OD1-NE 3.25Å; D452-R479 IonicContact OD1-NH2 3.63Å; D452-R479 PolarHBondContact OD1-NH2 3.01Å
453	H	90.1	Very high	91.9	Very high	52 Å²	52	9.5 Å²	9.5	24%	0.241	5%	0.053	C	C	.	.	S	Bend	trans	-52.9	-32.3	-168.9	65.6	-80.1	0	0	0	114.2	L140 I420 L423 P451 R479	L140-H453 WeakPolarHBondContact CD1-ND1 3.31Å; I420-H453 PolarHBondContact O-CE1 3.29Å; I420-H453 PolarHBondContact O-NE2 3.15Å; L423-H453 PolarHBondContact O-CD2 3.06Å; L423-H453 PolarHBondContact O-NE2 3.46Å; P451-H453 WeakPolarHBondContact CB-ND1 3.41Å; H453-R479 PolarHBondContact O-NH1 3.4Å
454	V	93.2	Very high	91.7	Very high	5 Å²	5	13 Å²	13	3%	0.03	8%	0.076	C	C	.	.			trans	-66.3	124.4	-177.6	-176.4	0	0	0	0	112.5	L423 V426 L450 P451 D452	L423-V454 HydrophobicContact CB-CG2 4.31Å; L423-V454 HydrophobicContact CD2-CG1 4.09Å; L423-V454 HydrophobicContact CD2-CG2 3.84Å; L423-V454 HydrophobicContact CG-CG1 4.16Å; L423-V454 HydrophobicContact CG-CG2 4.04Å; V426-V454 HydrophobicContact CB-CG1 4.31Å; V426-V454 HydrophobicContact CG2-CG1 3.59Å; L450-V454 HydrophobicContact CD2-CG1 4.34Å; P451-V454 HydrophobicContact CB-CG2 4.44Å; D452-V454 PolarHBondContact O-N 2.77Å
455	S	93.8	Very high	91.6	Very high	1 Å²	1	13.8 Å²	13.8	1%	0.007	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	148.6	170.6	-72.2	0	0	0	0	112.4	H331 E424 W425 V426 R479	H331-S455 PolarHBondContact CE1-OG 3.05Å; H331-S455 PolarHBondContact ND1-OG 3.35Å; H331-S455 VanDerWaalsContact ND1-OG 3.15Å; H331-S455 PolarHBondContact O-OG 2.85Å; E424-S455 PolarHBondContact O-N 3.43Å; W425-S455 WeakPolarHBondContact CA-O 3.5Å; V426-S455 PolarHBondContact N-O 2.8Å; S455-R479 PolarHBondContact OG-NH1 3.19Å
456	I	95.4	Very high	91.5	Very high	5 Å²	5	14 Å²	14	3%	0.026	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	130.6	-167.6	-56.6	178	0	0	0	110.7	S333 V334 F428 L447 L450 L458 I473 K477	S333-I456 WeakPolarHBondContact CA-O 3.45Å; S333-I456 VanDerWaalsContact CB-O 3.31Å; S333-I456 WeakPolarHBondContact CB-O 3.49Å; S333-I456 PolarHBondContact OG-N 2.8Å; V334-I456 PolarHBondContact N-O 3.33Å; V334-I456 VanDerWaalsContact N-O 3.1Å; F428-I456 HydrophobicContact CD2-CG2 3.82Å; F428-I456 HydrophobicContact CE2-CG2 3.91Å; L447-I456 HydrophobicContact CD2-CD1 4.35Å; L447-I456 HydrophobicContact CD2-CG2 4.36Å; L450-I456 HydrophobicContact CD1-CD1 4.25Å; L450-I456 HydrophobicContact CD1-CG1 4.32Å; I456-L458 HydrophobicContact CG2-CD1 4.41Å; I456-L458 HydrophobicContact CG2-CD2 4.09Å; I456-L458 HydrophobicContact CG2-CG 3.91Å; I456-I473 HydrophobicContact CD1-CG2 3.94Å; I456-K477 HydrophobicContact CD1-CG 4.25Å
457	I	96.6	Very high	91.4	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	111.3	174.9	-59.4	176.4	0	0	0	108.8	L328 V334 V347 A351 W425 V426 I427 F428 L459	L328-I457 HydrophobicContact CD1-CD1 4.38Å; L328-I457 HydrophobicContact CD2-CD1 3.6Å; L328-I457 HydrophobicContact CD2-CG1 3.91Å; V334-I457 HydrophobicContact CG2-CB 4.39Å; V334-I457 HydrophobicContact CG2-CG1 4.14Å; V334-I457 HydrophobicContact CG2-CG2 4.02Å; V347-I457 HydrophobicContact CG1-CG2 4.13Å; A351-I457 HydrophobicContact CB-CD1 3.22Å; W425-I457 HydrophobicContact CB-CD1 4.45Å; W425-I457 HydrophobicContact CD2-CD1 4.05Å; W425-I457 HydrophobicContact CD2-CG1 4.5Å; W425-I457 HydrophobicContact CE3-CD1 3.56Å; W425-I457 HydrophobicContact CE3-CG1 3.56Å; W425-I457 HydrophobicContact CG-CD1 4.45Å; W425-I457 HydrophobicContact CZ3-CD1 4.12Å; W425-I457 HydrophobicContact CZ3-CG1 3.92Å; V426-I457 PolarHBondContact O-N 3.19Å; I427-I457 HydrophobicContact CG1-CB 4.16Å; I427-I457 HydrophobicContact CG1-CD1 4.06Å; I427-I457 HydrophobicContact CG1-CG2 4.45Å; I427-I457 HydrophobicContact CG2-CG2 4.41Å; F428-I457 PolarHBondContact N-O 2.75Å; I457-L459 HydrophobicContact CG2-CD2 4.12Å; I457-L459 HydrophobicContact CG2-CG 4.39Å
458	L	95.9	Very high	91.3	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	122.7	-178.7	-63.8	159.8	0	0	0	109.4	V334 F335 V336 F428 V431 L447 I456 F469 I473	V334-L458 PolarHBondContact O-N 3.05Å; F335-L458 HydrophobicContact CB-CB 4.11Å; F335-L458 HydrophobicContact CB-CD1 4.14Å; F335-L458 HydrophobicContact CD2-CB 3.33Å; F335-L458 HydrophobicContact CD2-CD1 4.32Å; F335-L458 HydrophobicContact CD2-CG 4.45Å; F335-L458 WeakPolarHBondContact CD2-O 3.19Å; F335-L458 HydrophobicContact CE2-CB 3.9Å; F335-L458 HydrophobicContact CG-CB 3.92Å; F335-L458 HydrophobicContact CG-CD1 4.15Å; V336-L458 PolarHBondContact N-O 2.94Å; F428-L458 HydrophobicContact CB-CD2 4.03Å; F428-L458 HydrophobicContact CD2-CD2 4.15Å; F428-L458 HydrophobicContact CG-CD2 4.29Å; V431-L458 HydrophobicContact CG1-CD2 4.22Å; V431-L458 HydrophobicContact CG2-CB 3.97Å; V431-L458 HydrophobicContact CG2-CD2 3.75Å; V431-L458 HydrophobicContact CG2-CG 4.49Å; L447-L458 HydrophobicContact CD2-CD2 4.49Å; I456-L458 HydrophobicContact CG2-CD1 4.41Å; I456-L458 HydrophobicContact CG2-CD2 4.09Å; I456-L458 HydrophobicContact CG2-CG 3.91Å; L458-F469 HydrophobicContact CD1-CE1 4.32Å; L458-F469 HydrophobicContact CD2-CE1 4.43Å; L458-I473 HydrophobicContact CD1-CD1 3.6Å; L458-I473 HydrophobicContact CD2-CD1 4.29Å
459	L	93.7	Very high	91.2	Very high	1 Å²	1	21 Å²	21	1%	0.005	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	121.2	174.7	-54.1	-179.4	0	0	0	109.3	V336 K344 V347 A348 I427 F428 E430 V431 I457	V336-L459 HydrophobicContact CB-CD2 3.97Å; V336-L459 HydrophobicContact CG2-CD2 4.26Å; K344-L459 HydrophobicContact CB-CD1 4.47Å; K344-L459 HydrophobicContact CB-CD2 4.45Å; V347-L459 HydrophobicContact CB-CD2 4.29Å; V347-L459 HydrophobicContact CG1-CD2 4.42Å; A348-L459 HydrophobicContact CB-CD1 4.19Å; I427-L459 HydrophobicContact CG2-CD1 4Å; I427-L459 HydrophobicContact CG2-CG 4.45Å; F428-L459 PolarHBondContact O-N 3.06Å; E430-L459 WeakPolarHBondContact CA-O 3.19Å; E430-L459 PolarHBondContact N-O 3.39Å; V431-L459 WeakPolarHBondContact CG2-O 3.27Å; V431-L459 PolarHBondContact N-O 3.1Å; I457-L459 HydrophobicContact CG2-CD2 4.12Å; I457-L459 HydrophobicContact CG2-CG 4.39Å
460	S	91.5	Very high	91.3	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	166.3	-178.7	-163.1	0	0	0	0	112.8	V336 A338 K344 H432	V336-S460 PolarHBondContact O-N 3Å; A338-S460 PolarHBondContact N-O 2.8Å; A338-S460 VanDerWaalsContact N-O 3.1Å; K344-S460 VanDerWaalsContact CD-O 3.24Å; K344-S460 WeakPolarHBondContact CD-O 3.36Å; K344-S460 PolarHBondContact NZ-O 2.95Å; H432-S460 PolarHBondContact N-OG 2.83Å
461	A	87.4	Confident	91.1	Very high	22 Å²	22	22.3 Å²	22.3	18%	0.182	12%	0.123	C	C	.	.	S	Bend	trans	-62.1	176.3	160	0	0	0	0	0	111.1	A338 H432 V463	A338-A461 WeakPolarHBondContact O-CA 3.46Å; H432-A461 PolarHBondContact ND1-N 3.5Å; A461-V463 PolarHBondContact O-N 2.82Å; A461-V463 VanDerWaalsContact O-N 3.09Å
462	T	86	Confident	91.1	Very high	8 Å²	8	22.5 Å²	22.5	5%	0.049	12%	0.123	C	C	.	.			trans	-67.6	106.4	173.8	49	0	0	0	0	110.5	H339 M487	H339-T462 VanDerWaalsContact CE1-CG2 3.47Å; H339-T462 WeakPolarHBondContact CE1-CG2 3.23Å; H339-T462 PolarHBondContact CE1-OG1 3.31Å; H339-T462 PolarHBondContact ND1-OG1 2.84Å; T462-M487 HydrophobicContact CG2-SD 3.94Å
463	V	88.3	Confident	91.2	Very high	13 Å²	13	18.8 Å²	18.8	8%	0.079	10%	0.103	C	C	.	.			trans	-115.3	138.4	179.1	-64.1	0	0	0	0	110.8	F335 A337 H432 A461 A466 L746	F335-V463 HydrophobicContact CE1-CG2 4.48Å; F335-V463 HydrophobicContact CZ-CG2 4.04Å; A337-V463 HydrophobicContact CB-CG2 4.43Å; H432-V463 HydrophobicContact CB-CG1 4.2Å; A461-V463 PolarHBondContact O-N 2.82Å; A461-V463 VanDerWaalsContact O-N 3.09Å; V463-A466 HydrophobicContact CG2-CB 4.02Å; V463-L746 HydrophobicContact CB-CD2 4.42Å; V463-L746 HydrophobicContact CB-CG 4.25Å; V463-L746 HydrophobicContact CG1-CD2 3.91Å; V463-L746 HydrophobicContact CG1-CG 4.28Å; V463-L746 HydrophobicContact CG2-CD1 4.18Å; V463-L746 HydrophobicContact CG2-CG 4.39Å
464	P	86.9	Confident	91.2	Very high	73 Å²	73	16.3 Å²	16.3	47%	0.474	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-32.2	-171.5	28.6	-35.8	0	0	0	114	I745	P464-I745 HydrophobicContact CG-CB 4.46Å; P464-I745 HydrophobicContact CG-CG2 3.65Å
465	N	90.4	Very high	90.9	Very high	16 Å²	16	20.1 Å²	20.1	9%	0.086	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	35.6	-178.4	65.3	-32.4	0	0	0	113.4	L467 E468 F469 L746	N465-L467 PolarHBondContact O-N 3.01Å; N465-E468 HydrophobicContact CB-CB 4.22Å; N465-E468 WeakPolarHBondContact CB-OE2 3.42Å; N465-E468 PolarHBondContact ND2-OE2 2.9Å; N465-E468 PolarHBondContact O-N 3Å; N465-F469 PolarHBondContact O-N 2.82Å; N465-L746 PolarHBondContact ND2-O 3Å; N465-L746 PolarHBondContact OD1-N 3.41Å
466	A	90.3	Very high	90.6	Very high	5 Å²	5	20.5 Å²	20.5	4%	0.041	11%	0.107	C	C	.	.	H	α-helix	trans	-56.4	-37.7	-179.3	0	0	0	0	0	113.4	F335 A337 V463 S470 V483	F335-A466 HydrophobicContact CD1-CB 4.04Å; F335-A466 HydrophobicContact CE1-CB 3.69Å; F335-A466 HydrophobicContact CZ-CB 4.45Å; A337-A466 HydrophobicContact CB-CB 4.42Å; V463-A466 HydrophobicContact CG2-CB 4.02Å; A466-S470 PolarHBondContact O-N 2.93Å; A466-S470 VanDerWaalsContact O-N 3.09Å; A466-V483 HydrophobicContact CB-CG1 3.82Å
467	L	91.1	Very high	90.2	Very high	81 Å²	81	20.8 Å²	20.8	42%	0.424	11%	0.108	S	C	.	.	H	α-helix	trans	-67.9	-43.9	-179	-174.3	68.1	0	0	0	112.6	A290 P292 N465 S470 E471 V483	A290-L467 HydrophobicContact CB-CD1 3.77Å; P292-L467 HydrophobicContact CB-CD1 4.35Å; P292-L467 HydrophobicContact CG-CD1 4.38Å; N465-L467 PolarHBondContact O-N 3.01Å; L467-S470 PolarHBondContact O-N 2.58Å; L467-E471 WeakPolarHBondContact O-CB 3.28Å; L467-E471 PolarHBondContact O-N 3.38Å; L467-V483 HydrophobicContact CD1-CG2 4.15Å
468	E	90.2	Very high	89.7	Confident	70 Å²	70	25.5 Å²	25.5	33%	0.327	13%	0.129	S	C	.	.	H	α-helix	trans	-61	-45.3	177.3	-174.9	-156.9	133.3	0	0	111	N465 E471 W472 F776 H780	N465-E468 HydrophobicContact CB-CB 4.22Å; N465-E468 WeakPolarHBondContact CB-OE2 3.42Å; N465-E468 PolarHBondContact ND2-OE2 2.9Å; N465-E468 PolarHBondContact O-N 3Å; E468-E471 PolarHBondContact O-N 3.47Å; E468-W472 PolarHBondContact O-N 3.5Å; E468-F776 WeakPolarHBondContact OE1-CZ 3.25Å; E468-H780 IonicContact OE1-CE1 3.64Å; E468-H780 PolarHBondContact OE1-CE1 3.15Å; E468-H780 IonicContact OE1-NE2 2.75Å
469	F	91.1	Very high	89.3	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-64.5	-40.2	178	-174.2	-107.9	0	0	0	112.8	F335 V431 I434 L447 L458 N465 W472 I473 L746 F776	F335-F469 HydrophobicContact CD1-CD1 4.48Å; F335-F469 HydrophobicContact CE1-CB 4.48Å; F335-F469 AromaticContact CE1-CD1 3.81Å; F335-F469 HydrophobicContact CE1-CD1 3.81Å; F335-F469 HydrophobicContact CZ-CD1 4.15Å; V431-F469 HydrophobicContact CG1-CE1 3.64Å; V431-F469 HydrophobicContact CG1-CZ 4.02Å; I434-F469 HydrophobicContact CD1-CE2 3.43Å; I434-F469 VanDerWaalsContact CD1-CE2 3.43Å; I434-F469 HydrophobicContact CD1-CZ 3.79Å; L447-F469 HydrophobicContact CD1-CZ 4.12Å; L458-F469 HydrophobicContact CD1-CE1 4.32Å; L458-F469 HydrophobicContact CD2-CE1 4.43Å; N465-F469 PolarHBondContact O-N 2.82Å; F469-W472 AromaticContact CD2-CE3 3.87Å; F469-W472 HydrophobicContact CD2-CE3 3.87Å; F469-W472 HydrophobicContact CD2-CZ3 4.23Å; F469-W472 AromaticContact CE2-CE3 3.57Å; F469-W472 HydrophobicContact CE2-CE3 3.57Å; F469-W472 AromaticContact CE2-CZ3 3.45Å; F469-W472 HydrophobicContact CE2-CZ3 3.45Å; F469-W472 VanDerWaalsContact CE2-CZ3 3.45Å; F469-W472 HydrophobicContact CZ-CE3 4.25Å; F469-W472 AromaticContact CZ-CZ3 3.89Å; F469-W472 HydrophobicContact CZ-CZ3 3.89Å; F469-I473 HydrophobicContact CD1-CD1 4.06Å; F469-I473 HydrophobicContact CE1-CD1 3.5Å; F469-I473 VanDerWaalsContact CE1-CD1 3.5Å; F469-I473 HydrophobicContact CE2-CD1 4.47Å; F469-I473 HydrophobicContact CZ-CD1 3.74Å; F469-I473 PolarHBondContact O-N 3.1Å; F469-L746 HydrophobicContact CB-CD1 4Å; F469-L746 HydrophobicContact CD1-CD1 3.95Å; F469-L746 HydrophobicContact CD2-CD1 4.08Å; F469-L746 HydrophobicContact CE1-CD1 4.47Å; F469-L746 HydrophobicContact CG-CD1 3.72Å; F469-F776 HydrophobicContact CD2-CD1 4.38Å; F469-F776 HydrophobicContact CD2-CD2 4.36Å; F469-F776 HydrophobicContact CD2-CE1 4.17Å; F469-F776 HydrophobicContact CD2-CE2 4.13Å; F469-F776 HydrophobicContact CD2-CZ 4.05Å
470	S	91.9	Very high	89.2	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-70	-32.7	172.8	-78	0	0	0	0	113.5	F335 A466 L467 W472 I473 G474 I481 V483	F335-S470 WeakPolarHBondContact CB-OG 3.11Å; F335-S470 VanDerWaalsContact CD1-OG 3.24Å; F335-S470 WeakPolarHBondContact CD1-OG 3.49Å; A466-S470 PolarHBondContact O-N 2.93Å; A466-S470 VanDerWaalsContact O-N 3.09Å; L467-S470 PolarHBondContact O-N 2.58Å; S470-W472 VanDerWaalsContact C-N 3.3Å; S470-I473 PolarHBondContact O-N 2.88Å; S470-G474 PolarHBondContact O-N 2.91Å; S470-I481 WeakPolarHBondContact OG-CG2 3.26Å; S470-V483 WeakPolarHBondContact OG-CG2 3.49Å
471	E	90.7	Very high	89.3	Confident	36 Å²	36	32.6 Å²	32.6	17%	0.168	16%	0.159	C	C	.	.	H	α-helix	trans	-65.5	-38.6	176.9	-172.7	63.4	-147.3	0	0	110.4	W289 A290 L467 E468 R475	W289-E471 PolarHBondContact N-OE1 3.09Å; W289-E471 PolarHBondContact N-OE2 3.33Å; A290-E471 HydrophobicContact CB-CB 4.07Å; A290-E471 WeakPolarHBondContact CB-OE2 3.36Å; A290-E471 PolarHBondContact N-OE2 3.23Å; L467-E471 WeakPolarHBondContact O-CB 3.28Å; L467-E471 PolarHBondContact O-N 3.38Å; E468-E471 PolarHBondContact O-N 3.47Å; E471-R475 WeakPolarHBondContact O-CB 3.44Å; E471-R475 PolarHBondContact O-N 3.44Å
472	W	90.3	Very high	89.7	Confident	5 Å²	5	33 Å²	33	2%	0.019	16%	0.156	C	C	.	.	H	α-helix	trans	-59.1	-55	171.8	170.6	63.5	0	0	0	112.5	E444 L447 I448 E468 F469 S470 G474 R475 I476 R774 S775 F776 S779	E444-W472 HydrophobicContact CB-CH2 4.46Å; E444-W472 HydrophobicContact CG-CH2 4.08Å; L447-W472 HydrophobicContact CB-CH2 4.42Å; L447-W472 HydrophobicContact CD1-CH2 4.29Å; L447-W472 HydrophobicContact CD1-CZ3 4.02Å; I448-W472 HydrophobicContact CG1-CZ2 4.41Å; E468-W472 PolarHBondContact O-N 3.5Å; F469-W472 AromaticContact CD2-CE3 3.87Å; F469-W472 HydrophobicContact CD2-CE3 3.87Å; F469-W472 HydrophobicContact CD2-CZ3 4.23Å; F469-W472 AromaticContact CE2-CE3 3.57Å; F469-W472 HydrophobicContact CE2-CE3 3.57Å; F469-W472 AromaticContact CE2-CZ3 3.45Å; F469-W472 HydrophobicContact CE2-CZ3 3.45Å; F469-W472 VanDerWaalsContact CE2-CZ3 3.45Å; F469-W472 HydrophobicContact CZ-CE3 4.25Å; F469-W472 AromaticContact CZ-CZ3 3.89Å; F469-W472 HydrophobicContact CZ-CZ3 3.89Å; S470-W472 VanDerWaalsContact C-N 3.3Å; W472-G474 VanDerWaalsContact C-N 3.35Å; W472-G474 PolarHBondContact O-N 3.23Å; W472-R475 WeakPolarHBondContact O-CB 3.23Å; W472-R475 PolarHBondContact O-N 3.38Å; W472-I476 HydrophobicContact CD2-CD1 3.81Å; W472-I476 HydrophobicContact CG-CD1 4.16Å; W472-I476 HydrophobicContact CH2-CD1 4.18Å; W472-I476 HydrophobicContact CZ2-CD1 3.43Å; W472-I476 VanDerWaalsContact CZ2-CD1 3.43Å; W472-I476 VanDerWaalsContact NE1-CD1 3.26Å; W472-I476 WeakPolarHBondContact O-CG1 3.42Å; W472-I476 PolarHBondContact O-N 2.94Å; W472-R774 PolarHBondContact NE1-O 3.19Å; W472-S775 PolarHBondContact NE1-O 2.86Å; W472-F776 HydrophobicContact CB-CD2 3.95Å; W472-F776 HydrophobicContact CB-CE2 4.27Å; W472-F776 HydrophobicContact CD2-CB 3.84Å; W472-F776 AromaticContact CD2-CD2 3.61Å; W472-F776 HydrophobicContact CD2-CD2 3.61Å; W472-F776 HydrophobicContact CD2-CG 4.06Å; W472-F776 HydrophobicContact CE3-CB 4.09Å; W472-F776 AromaticContact CE3-CD2 3.88Å; W472-F776 HydrophobicContact CE3-CD2 3.88Å; W472-F776 HydrophobicContact CE3-CG 4.13Å; W472-F776 HydrophobicContact CG-CB 4.5Å; W472-F776 AromaticContact CG-CD2 3.63Å; W472-F776 HydrophobicContact CG-CD2 3.63Å; W472-F776 HydrophobicContact CG-CE2 4.42Å; W472-F776 HydrophobicContact CG-CG 4.49Å; W472-F776 HydrophobicContact CH2-CB 4.03Å; W472-F776 HydrophobicContact CZ2-CB 3.72Å; W472-F776 HydrophobicContact CZ3-CB 4.19Å; W472-S779 WeakPolarHBondContact CB-OG 3.34Å; W472-S779 VanDerWaalsContact CD1-CB 3.44Å
473	I	90.6	Very high	90.1	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-63	-43.3	-179.1	-59.7	172.9	0	0	0	110.8	L447 I456 L458 F469 S470 R475 I476 K477 I481	L447-I473 HydrophobicContact CD1-CD1 4.03Å; L447-I473 HydrophobicContact CD2-CD1 4.31Å; I456-I473 HydrophobicContact CD1-CG2 3.94Å; L458-I473 HydrophobicContact CD1-CD1 3.6Å; L458-I473 HydrophobicContact CD2-CD1 4.29Å; F469-I473 HydrophobicContact CD1-CD1 4.06Å; F469-I473 HydrophobicContact CE1-CD1 3.5Å; F469-I473 VanDerWaalsContact CE1-CD1 3.5Å; F469-I473 HydrophobicContact CE2-CD1 4.47Å; F469-I473 HydrophobicContact CZ-CD1 3.74Å; F469-I473 PolarHBondContact O-N 3.1Å; S470-I473 PolarHBondContact O-N 2.88Å; I473-R475 VanDerWaalsContact C-N 3.33Å; I473-R475 PolarHBondContact O-N 3.09Å; I473-I476 PolarHBondContact O-N 3.22Å; I473-K477 HydrophobicContact CG2-CG 4.33Å; I473-K477 PolarHBondContact O-N 3.43Å; I473-I481 HydrophobicContact CB-CD1 3.63Å; I473-I481 HydrophobicContact CG2-CD1 3.54Å
474	G	89.7	Confident	90.4	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-62.6	-39.1	178.8	0	0	0	0	0	112.6	S470 W472 K478 R479	S470-G474 PolarHBondContact O-N 2.91Å; W472-G474 VanDerWaalsContact C-N 3.35Å; W472-G474 PolarHBondContact O-N 3.23Å; G474-K478 VanDerWaalsContact O-CA 3.29Å; G474-K478 WeakPolarHBondContact O-CA 3.5Å; G474-K478 PolarHBondContact O-N 3.28Å; G474-R479 WeakPolarHBondContact CA-O 3.34Å; G474-R479 PolarHBondContact O-N 2.98Å
475	R	86.6	Confident	90.6	Very high	86 Å²	86	31.4 Å²	31.4	33%	0.325	15%	0.147	S	C	.	.	H	α-helix	trans	-63.4	-43.7	172.4	-176.4	-168.6	-61.6	171.1	-1.5	112.4	E471 W472 I473 S779	E471-R475 WeakPolarHBondContact O-CB 3.44Å; E471-R475 PolarHBondContact O-N 3.44Å; W472-R475 WeakPolarHBondContact O-CB 3.23Å; W472-R475 PolarHBondContact O-N 3.38Å; I473-R475 VanDerWaalsContact C-N 3.33Å; I473-R475 PolarHBondContact O-N 3.09Å; R475-S779 PolarHBondContact NH1-O 2.86Å
476	I	87.8	Confident	90.5	Very high	9 Å²	9	31.4 Å²	31.4	5%	0.046	15%	0.148	C	C	.	.	H	α-helix	trans	-63.1	-48.6	177.8	-65	158.1	0	0	0	110.8	G164 I448 W472 I473 R774	G164-I476 WeakPolarHBondContact CA-O 3.11Å; I448-I476 HydrophobicContact CG1-CD1 4.29Å; W472-I476 HydrophobicContact CD2-CD1 3.81Å; W472-I476 HydrophobicContact CG-CD1 4.16Å; W472-I476 HydrophobicContact CH2-CD1 4.18Å; W472-I476 HydrophobicContact CZ2-CD1 3.43Å; W472-I476 VanDerWaalsContact CZ2-CD1 3.43Å; W472-I476 VanDerWaalsContact NE1-CD1 3.26Å; W472-I476 WeakPolarHBondContact O-CG1 3.42Å; W472-I476 PolarHBondContact O-N 2.94Å; I473-I476 PolarHBondContact O-N 3.22Å; I476-R774 WeakPolarHBondContact CD1-O 3.44Å; I476-R774 HydrophobicContact CG1-CB 4.37Å; I476-R774 PolarHBondContact O-NH1 3.02Å
477	K	87.1	Confident	90.2	Very high	10 Å²	10	37.4 Å²	37.4	4%	0.043	18%	0.177	C	C	.	.	H	α-helix	trans	-84.9	-9.2	-173.1	-64.3	-58.2	179.1	-161.2	0	114.4	L447 I448 L450 I456 I473 R479	L447-K477 WeakPolarHBondContact O-CE 3.22Å; L447-K477 PolarHBondContact O-NZ 3.19Å; I448-K477 PolarHBondContact O-NZ 3.47Å; L450-K477 PolarHBondContact O-NZ 3.48Å; I456-K477 HydrophobicContact CD1-CG 4.25Å; I473-K477 HydrophobicContact CG2-CG 4.33Å; I473-K477 PolarHBondContact O-N 3.43Å; K477-R479 HydrophobicContact CB-CB 4.27Å; K477-R479 HydrophobicContact CB-CG 4.47Å; K477-R479 PolarHBondContact O-N 3.39Å
478	K	87.2	Confident	89.8	Confident	99 Å²	99	41.7 Å²	41.7	43%	0.43	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	39.5	-170.4	-55.7	177.4	179.4	177.4	0	111.9	E166 W289 G474	E166-K478 IonicContact OE1-NZ 3.2Å; E166-K478 PolarHBondContact OE1-NZ 2.95Å; W289-K478 HydrophobicContact CH2-CB 3.82Å; W289-K478 HydrophobicContact CZ2-CB 4.31Å; W289-K478 HydrophobicContact CZ3-CB 4.31Å; W289-K478 WeakPolarHBondContact CZ3-O 3.5Å; G474-K478 VanDerWaalsContact O-CA 3.29Å; G474-K478 WeakPolarHBondContact O-CA 3.5Å; G474-K478 PolarHBondContact O-N 3.28Å
479	R	87.4	Confident	89.5	Confident	64 Å²	64	41.1 Å²	41.1	24%	0.242	19%	0.187	C	C	.	.			trans	-130.4	146.3	-178.8	-73.8	-175.9	175.9	-143	-10.4	111.5	D452 H453 S455 G474 K477	D452-R479 PolarHBondContact O-NE 3.1Å; D452-R479 VanDerWaalsContact O-NE 3.09Å; D452-R479 PolarHBondContact O-NH1 2.76Å; D452-R479 PolarHBondContact O-NH2 3.47Å; D452-R479 IonicContact OD1-CZ 2.62Å; D452-R479 IonicContact OD1-NE 2.7Å; D452-R479 PolarHBondContact OD1-NE 3.25Å; D452-R479 IonicContact OD1-NH2 3.63Å; D452-R479 PolarHBondContact OD1-NH2 3.01Å; H453-R479 PolarHBondContact O-NH1 3.4Å; S455-R479 PolarHBondContact OG-NH1 3.19Å; G474-R479 WeakPolarHBondContact CA-O 3.34Å; G474-R479 PolarHBondContact O-N 2.98Å; K477-R479 HydrophobicContact CB-CB 4.27Å; K477-R479 HydrophobicContact CB-CG 4.47Å; K477-R479 PolarHBondContact O-N 3.39Å
480	H	90.6	Very high	89.2	Confident	83 Å²	83	43.5 Å²	43.5	38%	0.384	20%	0.202	S	C	.	.			trans	-74.1	140.8	176.2	-73	-66.3	0	0	0	111.9	W289 Y482	W289-H480 WeakPolarHBondContact O-CA 3.33Å; W289-H480 PolarHBondContact O-ND1 2.98Å; H480-Y482 HydrophobicContact CB-CE2 4.35Å
481	I	94.1	Very high	89.1	Confident	3 Å²	3	44 Å²	44	2%	0.015	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	126	178.6	-53.9	-175.2	0	0	0	110.1	W289 A290 V291 S333 F335 S470 I473	W289-I481 PolarHBondContact O-N 3.05Å; A290-I481 WeakPolarHBondContact CA-O 3.42Å; V291-I481 PolarHBondContact N-O 2.96Å; S333-I481 WeakPolarHBondContact O-CA 3.41Å; F335-I481 HydrophobicContact CB-CG2 4.32Å; S470-I481 WeakPolarHBondContact OG-CG2 3.26Å; I473-I481 HydrophobicContact CB-CD1 3.63Å; I473-I481 HydrophobicContact CG2-CD1 3.54Å
482	Y	95	Very high	89.2	Confident	31 Å²	31	44.3 Å²	44.3	12%	0.122	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	120.7	-178.6	-68.4	-94.4	0	0	0	111.4	V291 V293 R327 D332 S333 F335 H480	V291-Y482 HydrophobicContact CB-CD1 3.86Å; V291-Y482 HydrophobicContact CB-CE1 3.93Å; V291-Y482 HydrophobicContact CG1-CD1 4.04Å; V291-Y482 HydrophobicContact CG1-CE1 3.96Å; V291-Y482 HydrophobicContact CG2-CE1 4.36Å; V291-Y482 WeakPolarHBondContact O-CA 3.39Å; V293-Y482 HydrophobicContact CG2-CD1 3.88Å; V293-Y482 HydrophobicContact CG2-CG 4.38Å; R327-Y482 HydrophobicContact CG-CD1 4.37Å; R327-Y482 HydrophobicContact CG-CD2 4.28Å; R327-Y482 HydrophobicContact CG-CG 4.01Å; R327-Y482 VanDerWaalsContact NH1-CE1 3.33Å; R327-Y482 VanDerWaalsContact NH1-CZ 3.3Å; R327-Y482 PolarHBondContact NH1-OH 3.37Å; R327-Y482 VanDerWaalsContact NH1-OH 3.11Å; D332-Y482 HydrophobicContact CB-CD2 3.73Å; D332-Y482 HydrophobicContact CB-CE2 3.6Å; D332-Y482 WeakPolarHBondContact OD2-CE2 3.2Å; D332-Y482 PolarHBondContact OD2-OH 2.95Å; S333-Y482 PolarHBondContact O-N 3.32Å; F335-Y482 PolarHBondContact N-O 3.45Å; H480-Y482 HydrophobicContact CB-CE2 4.35Å
483	V	94.8	Very high	89.3	Confident	10 Å²	10	44.7 Å²	44.7	6%	0.061	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	116.1	-176	-173.6	0	0	0	0	110.1	A290 V291 V293 F335 A466 L467 S470	A290-V483 HydrophobicContact CB-CG2 4.28Å; V291-V483 PolarHBondContact O-N 3.18Å; V293-V483 PolarHBondContact N-O 3.29Å; F335-V483 HydrophobicContact CD1-CG1 4.47Å; A466-V483 HydrophobicContact CB-CG1 3.82Å; L467-V483 HydrophobicContact CD1-CG2 4.15Å; S470-V483 WeakPolarHBondContact OG-CG2 3.49Å
484	I	93.9	Very high	89.5	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	96.5	-174.5	-57.7	175.2	0	0	0	107.5	V293 I295 F320 A324 F335 V336 A337	V293-I484 HydrophobicContact CB-CG1 4.03Å; V293-I484 HydrophobicContact CG2-CG1 3.95Å; I295-I484 HydrophobicContact CD1-CG2 3.72Å; I295-I484 HydrophobicContact CG1-CG2 4.13Å; F320-I484 HydrophobicContact CB-CG2 3.74Å; F320-I484 HydrophobicContact CD2-CG2 4.29Å; A324-I484 VanDerWaalsContact CA-CD1 3.5Å; A324-I484 HydrophobicContact CB-CD1 3.66Å; F335-I484 PolarHBondContact O-N 3.24Å; V336-I484 WeakPolarHBondContact CA-O 3.28Å; A337-I484 PolarHBondContact N-O 2.91Å
485	S	91.1	Very high	89.8	Confident	51 Å²	51	47.7 Å²	47.7	36%	0.357	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	117.1	-174.8	-173.7	0	0	0	0	112.9	I295 A337	I295-S485 WeakPolarHBondContact CD1-O 3.44Å; A337-S485 CarbonylContact O-C 3.53Å; A337-S485 WeakPolarHBondContact O-CA 3.38Å
486	T	89	Confident	90.2	Very high	16 Å²	16	45.3 Å²	45.3	10%	0.098	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	123	177.8	-179.9	0	0	0	0	112.8	F320 A337 A338 K488	F320-T486 HydrophobicContact CD1-CG2 4.06Å; F320-T486 HydrophobicContact CD2-CG2 4.28Å; F320-T486 HydrophobicContact CE1-CG2 4.25Å; F320-T486 HydrophobicContact CE2-CG2 4.47Å; F320-T486 HydrophobicContact CG-CG2 4.07Å; F320-T486 HydrophobicContact CZ-CG2 4.46Å; A337-T486 PolarHBondContact O-N 2.98Å; A338-T486 HydrophobicContact CB-CG2 3.58Å; T486-K488 PolarHBondContact OG1-N 3Å
487	M	83.5	Confident	90.5	Very high	131 Å²	131	44.9 Å²	44.9	65%	0.645	22%	0.216	S	C	*	.			trans	-89.2	-5.7	174.4	-58	-62.5	-76.7	0	0	112.6	H339 T462 R489	H339-M487 PolarHBondContact NE2-O 3.36Å; T462-M487 HydrophobicContact CG2-SD 3.94Å; M487-R489 PolarHBondContact O-N 2.72Å
488	K	83.1	Confident	90.8	Very high	170 Å²	170	44.5 Å²	44.5	74%	0.739	21%	0.214	S	C	*	.			trans	-79.8	119.3	-179.2	-173.1	-180	179	-175.3	0	109.9	T486	T486-K488 PolarHBondContact OG1-N 3Å
489	R	84.4	Confident	90.9	Very high	58 Å²	58	40 Å²	40	22%	0.219	20%	0.195	C	C	.	.			trans	-77.6	142.8	170.7	-68.8	-177.6	-179.8	-98.1	8.2	110.9	H339 M487 V491	H339-R489 HydrophobicContact CB-CG 4.36Å; H339-R489 WeakPolarHBondContact CD2-CG 3.24Å; M487-R489 PolarHBondContact O-N 2.72Å; R489-V491 VanDerWaalsContact C-N 3.34Å; R489-V491 WeakPolarHBondContact CB-O 3.31Å
490	P	84.5	Confident	90.8	Very high	50 Å²	50	37 Å²	37	33%	0.325	18%	0.184	S	C	.	.	S	Bend	trans	-66.9	-34.7	172.2	-18.3	29.8	0	0	0	113.2	A342 R713	A342-P490 HydrophobicContact CB-CG 4.41Å; P490-R713 HydrophobicContact CB-CG 4.29Å
491	V	89.5	Confident	90.4	Very high	10 Å²	10	36.2 Å²	36.2	6%	0.061	18%	0.182	C	C	.	.	S	Bend	trans	-122.1	120.1	174.3	-173.8	0	0	0	0	107.6	R489 R713	R489-V491 VanDerWaalsContact C-N 3.34Å; R489-V491 WeakPolarHBondContact CB-O 3.31Å; V491-R713 HydrophobicContact CG2-CB 4.48Å
492	P	92.4	Very high	89.7	Confident	44 Å²	44	38.6 Å²	38.6	29%	0.286	20%	0.199	S	C	.	.			trans	-70.5	155.1	175.8	29.7	-34.6	0	0	0	111.2	A515 T718 G719	P492-A515 HydrophobicContact CB-CB 4.03Å; P492-A515 VanDerWaalsContact CB-O 3.28Å; P492-A515 WeakPolarHBondContact CB-O 3.32Å; P492-A515 HydrophobicContact CG-CB 4.26Å; P492-T718 HydrophobicContact CG-CG2 4.27Å; P492-T718 WeakPolarHBondContact O-CA 3.37Å; P492-G719 PolarHBondContact O-N 3.29Å
493	L	93.7	Very high	88.8	Confident	13 Å²	13	41.9 Å²	41.9	7%	0.068	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	141.2	-176	-58	-176.7	0	0	0	111.1	A707 A710 G719 V721	L493-A707 HydrophobicContact CD1-CB 4.39Å; L493-A710 HydrophobicContact CD2-CB 4.02Å; L493-A710 VanDerWaalsContact CD2-O 3.31Å; L493-A710 WeakPolarHBondContact CD2-O 3.13Å; L493-G719 WeakPolarHBondContact CA-O 3.26Å; L493-V721 HydrophobicContact CB-CG2 4.47Å; L493-V721 HydrophobicContact CD1-CG2 4.41Å
494	E	95.3	Very high	87.9	Confident	42 Å²	42	50.8 Å²	50.8	20%	0.196	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	124	172.6	-66.3	176.5	115.7	0	0	108.8	Y496 L511 V513 A515 T718 G719 V721	E494-Y496 HydrophobicContact CB-CE2 3.61Å; E494-L511 HydrophobicContact CB-CD1 4.11Å; E494-V513 WeakPolarHBondContact CA-O 3.42Å; E494-A515 HydrophobicContact CG-CB 4.09Å; E494-T718 HydrophobicContact CG-CG2 4.48Å; E494-T718 WeakPolarHBondContact OE2-CB 3.21Å; E494-T718 PolarHBondContact OE2-OG1 2.9Å; E494-G719 PolarHBondContact N-O 3.24Å; E494-V721 PolarHBondContact O-N 3.14Å
495	H	95.4	Very high	87.3	Confident	22 Å²	22	51.8 Å²	51.8	10%	0.102	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	131.4	-172.5	-58.2	-113.5	0	0	0	111.1	L512 V513 Y703 V721 M739	H495-L512 PolarHBondContact O-N 3.11Å; H495-V513 HydrophobicContact CB-CB 3.99Å; H495-V513 PolarHBondContact N-O 2.78Å; H495-V513 PolarHBondContact O-N 2.93Å; H495-Y703 AromaticContact CE1-CE1 3.83Å; H495-Y703 AromaticContact ND1-CE1 3.87Å; H495-Y703 AromaticContact ND1-CZ 3.76Å; H495-Y703 PolarHBondContact ND1-OH 3.11Å; H495-V721 CarbonylContact C-O 3.47Å; H495-V721 WeakPolarHBondContact CA-O 3.38Å; H495-M739 HydrophobicContact CB-CE 3.34Å
496	Y	95.2	Very high	86.8	Confident	36 Å²	36	51.1 Å²	51.1	14%	0.141	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	147.5	-173.4	-59.3	-92	0	0	0	113.3	E494 M509 F510 L511 T720 V721 I722 I723	E494-Y496 HydrophobicContact CB-CE2 3.61Å; Y496-M509 HydrophobicContact CD1-CG 3.45Å; Y496-M509 VanDerWaalsContact CD1-CG 3.45Å; Y496-M509 HydrophobicContact CD1-SD 3.98Å; Y496-M509 HydrophobicContact CD2-SD 4.36Å; Y496-M509 HydrophobicContact CE1-CG 4.18Å; Y496-M509 HydrophobicContact CE1-SD 4.26Å; Y496-M509 HydrophobicContact CG-CG 3.66Å; Y496-M509 HydrophobicContact CG-SD 4.03Å; Y496-F510 CarbonylContact C-O 3.55Å; Y496-F510 WeakPolarHBondContact CA-O 3.39Å; Y496-L511 HydrophobicContact CD1-CB 3.96Å; Y496-L511 HydrophobicContact CD1-CD1 3.94Å; Y496-L511 HydrophobicContact CE1-CB 3.79Å; Y496-L511 HydrophobicContact CE1-CD1 3.45Å; Y496-L511 VanDerWaalsContact CE1-CD1 3.45Å; Y496-L511 HydrophobicContact CE1-CG 4.2Å; Y496-L511 HydrophobicContact CE2-CD1 4.14Å; Y496-L511 HydrophobicContact CG-CD1 4.48Å; Y496-T720 HydrophobicContact CD2-CG2 3.93Å; Y496-T720 HydrophobicContact CE2-CG2 3.87Å; Y496-V721 PolarHBondContact N-O 2.84Å; Y496-I722 CarbonylContact O-C 3.57Å; Y496-I722 WeakPolarHBondContact O-CA 3.42Å; Y496-I723 PolarHBondContact O-N 3.47Å
497	L	94.3	Very high	86.4	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	137.5	160.9	-61.5	-179.7	0	0	0	110.1	M509 F510 L512 Y524 A527 I723 V729 L735	L497-M509 WeakPolarHBondContact O-CA 3.47Å; L497-F510 PolarHBondContact N-O 3.36Å; L497-F510 PolarHBondContact O-N 2.91Å; L497-L512 HydrophobicContact CD1-CD1 3.9Å; L497-L512 HydrophobicContact CD1-CD2 4.27Å; L497-L512 HydrophobicContact CD1-CG 4.15Å; L497-L512 HydrophobicContact CD2-CD1 3.54Å; L497-L512 HydrophobicContact CD2-CG 4.44Å; L497-L512 HydrophobicContact CG-CD1 3.46Å; L497-L512 VanDerWaalsContact CG-CD1 3.46Å; L497-L512 HydrophobicContact CG-CD2 4.48Å; L497-L512 HydrophobicContact CG-CG 3.82Å; L497-Y524 HydrophobicContact CD1-CD2 4.33Å; L497-A527 HydrophobicContact CB-CB 4.45Å; L497-A527 HydrophobicContact CD1-CB 3.92Å; L497-I723 HydrophobicContact CD2-CB 4.03Å; L497-I723 HydrophobicContact CD2-CD1 4.49Å; L497-I723 HydrophobicContact CD2-CG2 4.4Å; L497-V729 HydrophobicContact CD1-CG1 3.85Å; L497-L735 HydrophobicContact CD2-CD1 4.31Å
498	Y	93	Very high	86.6	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.008	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	123.5	174.4	-179.5	-103	0	0	0	111.4	G500 E508 V559 T562 L563 I723 L724 C725	Y498-G500 WeakPolarHBondContact CE1-O 3.27Å; Y498-E508 VanDerWaalsContact CD2-O 3.26Å; Y498-E508 WeakPolarHBondContact CD2-O 3.14Å; Y498-V559 HydrophobicContact CD1-CG1 4.4Å; Y498-V559 HydrophobicContact CE1-CG1 4.07Å; Y498-T562 VanDerWaalsContact OH-CG2 3.27Å; Y498-T562 WeakPolarHBondContact OH-CG2 3.45Å; Y498-L563 HydrophobicContact CD1-CB 4.44Å; Y498-L563 HydrophobicContact CD1-CD1 4.33Å; Y498-L563 HydrophobicContact CD1-CD2 4.37Å; Y498-L563 HydrophobicContact CD2-CD1 4.02Å; Y498-L563 HydrophobicContact CE1-CB 3.8Å; Y498-L563 HydrophobicContact CE1-CD1 4.27Å; Y498-L563 HydrophobicContact CE1-CG 4.42Å; Y498-L563 HydrophobicContact CE2-CD1 3.97Å; Y498-L563 HydrophobicContact CG-CD1 4.19Å; Y498-L563 PolarHBondContact OH-N 3.02Å; Y498-I723 PolarHBondContact N-O 3.41Å; Y498-L724 HydrophobicContact CD1-CD2 3.85Å; Y498-C725 WeakPolarHBondContact O-CB 3.1Å; Y498-C725 PolarHBondContact O-N 3.48Å
499	T	89.6	Confident	86.9	Confident	5 Å²	5	47 Å²	47	3%	0.031	24%	0.236	C	C	.	.			trans	-114.6	-0.6	179.1	56.7	0	0	0	0	113.5	E508 F510 K531 R534 C725	T499-E508 PolarHBondContact N-O 3Å; T499-E508 WeakPolarHBondContact OG1-CB 3.45Å; T499-E508 PolarHBondContact OG1-OE2 2.86Å; T499-F510 HydrophobicContact CG2-CE2 4.4Å; T499-F510 WeakPolarHBondContact OG1-CE2 3.2Å; T499-K531 HydrophobicContact CG2-CD 4.23Å; T499-R534 PolarHBondContact O-NH1 3.3Å; T499-C725 HydrophobicContact CG2-CB 3.95Å
500	G	83.8	Confident	87.3	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.232	C	C	.	.			trans	-65.1	140.2	-177.7	0	0	0	0	0	113.5	Y498 T505	Y498-G500 WeakPolarHBondContact CE1-O 3.27Å; G500-T505 VanDerWaalsContact CA-O 3.32Å; G500-T505 WeakPolarHBondContact CA-O 3.31Å
501	N	82.4	Confident	87.7	Confident	67 Å²	67	45.7 Å²	45.7	36%	0.358	23%	0.229	S	C	.	.			trans	-141	2.4	-176.9	70.6	-18.5	0	0	0	114	T505 R534 V559	N501-T505 PolarHBondContact N-OG1 2.91Å; N501-T505 PolarHBondContact OD1-OG1 3.45Å; N501-R534 PolarHBondContact OD1-NH1 2.91Å; N501-V559 HydrophobicContact CB-CG2 4.08Å
502	S	80.2	Confident	87.9	Confident	53 Å²	53	45.2 Å²	45.2	37%	0.371	23%	0.226	S	C	.	.	S	Bend	trans	-158	160.9	-175.9	-175.9	0	0	0	0	109.6	K504 T505 Q506 T562	S502-K504 PolarHBondContact O-N 2.82Å; S502-K504 VanDerWaalsContact O-N 3.11Å; S502-T505 PolarHBondContact N-OG1 3.27Å; S502-T505 CarbonylContact O-C 3.58Å; S502-T505 WeakPolarHBondContact O-CA 3.38Å; S502-T505 PolarHBondContact O-N 2.84Å; S502-T505 PolarHBondContact O-OG1 2.99Å; S502-T505 VanDerWaalsContact O-OG1 3.11Å; S502-Q506 PolarHBondContact O-N 2.9Å; S502-T562 VanDerWaalsContact O-CG2 3.29Å; S502-T562 WeakPolarHBondContact O-CG2 3.36Å
503	T	75.2	Confident	87.9	Confident	100 Å²	100	43.4 Å²	43.4	61%	0.613	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-29.7	178.3	53.2	0	0	0	0	113.6	Q506	T503-Q506 VanDerWaalsContact O-CD 3.27Å; T503-Q506 VanDerWaalsContact O-CG 3.26Å; T503-Q506 WeakPolarHBondContact O-CG 3.4Å; T503-Q506 PolarHBondContact O-NE2 3.02Å
504	K	77	Confident	87.9	Confident	196 Å²	196	44.5 Å²	44.5	85%	0.852	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-29.3	173.4	-65.2	-174.4	-179.7	-178.8	0	113.3	S502	S502-K504 PolarHBondContact O-N 2.82Å; S502-K504 VanDerWaalsContact O-N 3.11Å
505	T	80.9	Confident	87.6	Confident	21 Å²	21	44.5 Å²	44.5	13%	0.129	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	6.3	-174.2	58	0	0	0	0	112.8	G500 N501 S502 K507 E508	G500-T505 VanDerWaalsContact CA-O 3.32Å; G500-T505 WeakPolarHBondContact CA-O 3.31Å; N501-T505 PolarHBondContact N-OG1 2.91Å; N501-T505 PolarHBondContact OD1-OG1 3.45Å; S502-T505 PolarHBondContact N-OG1 3.27Å; S502-T505 CarbonylContact O-C 3.58Å; S502-T505 WeakPolarHBondContact O-CA 3.38Å; S502-T505 PolarHBondContact O-N 2.84Å; S502-T505 PolarHBondContact O-OG1 2.99Å; S502-T505 VanDerWaalsContact O-OG1 3.11Å; T505-K507 PolarHBondContact O-N 2.92Å; T505-K507 VanDerWaalsContact O-N 3.07Å; T505-E508 VanDerWaalsContact CB-OE1 3.31Å; T505-E508 WeakPolarHBondContact CB-OE1 3.39Å; T505-E508 VanDerWaalsContact CG2-OE1 3.25Å; T505-E508 WeakPolarHBondContact CG2-OE1 3.32Å; T505-E508 WeakPolarHBondContact O-CB 3.42Å; T505-E508 WeakPolarHBondContact O-CG 3.08Å; T505-E508 PolarHBondContact O-N 3.06Å; T505-E508 VanDerWaalsContact O-N 3.09Å
506	Q	79.9	Confident	87.2	Confident	37 Å²	37	47.4 Å²	47.4	17%	0.173	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-21.8	-179.1	72.5	-174.5	-22.6	0	0	115.2	S502 T503 T562 F566	S502-Q506 PolarHBondContact O-N 2.9Å; T503-Q506 VanDerWaalsContact O-CD 3.27Å; T503-Q506 VanDerWaalsContact O-CG 3.26Å; T503-Q506 WeakPolarHBondContact O-CG 3.4Å; T503-Q506 PolarHBondContact O-NE2 3.02Å; Q506-T562 HydrophobicContact CB-CG2 3.44Å; Q506-T562 VanDerWaalsContact CB-CG2 3.44Å; Q506-F566 HydrophobicContact CG-CD2 4.4Å; Q506-F566 WeakPolarHBondContact O-CD2 3.27Å; Q506-F566 WeakPolarHBondContact O-CG 3.32Å
507	K	81.6	Confident	86.8	Confident	166 Å²	166	47.3 Å²	47.3	72%	0.722	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-1.1	-179.6	-62.5	-173.1	179	-178.8	0	113.7	T505 M509 F566	T505-K507 PolarHBondContact O-N 2.92Å; T505-K507 VanDerWaalsContact O-N 3.07Å; K507-M509 VanDerWaalsContact C-N 3.35Å; K507-M509 PolarHBondContact O-N 2.97Å; K507-F566 HydrophobicContact CG-CE2 4.17Å
508	E	86.6	Confident	86.7	Confident	37 Å²	37	51.7 Å²	51.7	17%	0.173	29%	0.289	C	S	.	.			trans	-78.1	81.3	-177.7	-66.9	177.9	-167.4	0	0	112.2	Y498 T499 T505 F510 T530 R534	Y498-E508 VanDerWaalsContact CD2-O 3.26Å; Y498-E508 WeakPolarHBondContact CD2-O 3.14Å; T499-E508 PolarHBondContact N-O 3Å; T499-E508 WeakPolarHBondContact OG1-CB 3.45Å; T499-E508 PolarHBondContact OG1-OE2 2.86Å; T505-E508 VanDerWaalsContact CB-OE1 3.31Å; T505-E508 WeakPolarHBondContact CB-OE1 3.39Å; T505-E508 VanDerWaalsContact CG2-OE1 3.25Å; T505-E508 WeakPolarHBondContact CG2-OE1 3.32Å; T505-E508 WeakPolarHBondContact O-CB 3.42Å; T505-E508 WeakPolarHBondContact O-CG 3.08Å; T505-E508 PolarHBondContact O-N 3.06Å; T505-E508 VanDerWaalsContact O-N 3.09Å; E508-F510 HydrophobicContact CB-CE2 4.11Å; E508-F510 HydrophobicContact CB-CZ 4.48Å; E508-T530 HydrophobicContact CG-CG2 4.45Å; E508-R534 IonicContact OE1-CZ 3.64Å; E508-R534 IonicContact OE1-NH2 3.84Å; E508-R534 PolarHBondContact OE1-NH2 2.82Å; E508-R534 IonicContact OE2-CZ 2.8Å; E508-R534 IonicContact OE2-NH2 3.58Å; E508-R534 PolarHBondContact OE2-NH2 3.21Å
509	M	89.3	Confident	86.6	Confident	28 Å²	28	53.1 Å²	53.1	14%	0.138	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	113.8	177.6	175.8	-177.7	-81.5	0	0	108.4	Y496 L497 K507 F566 L567 I722	Y496-M509 HydrophobicContact CD1-CG 3.45Å; Y496-M509 VanDerWaalsContact CD1-CG 3.45Å; Y496-M509 HydrophobicContact CD1-SD 3.98Å; Y496-M509 HydrophobicContact CD2-SD 4.36Å; Y496-M509 HydrophobicContact CE1-CG 4.18Å; Y496-M509 HydrophobicContact CE1-SD 4.26Å; Y496-M509 HydrophobicContact CG-CG 3.66Å; Y496-M509 HydrophobicContact CG-SD 4.03Å; L497-M509 WeakPolarHBondContact O-CA 3.47Å; K507-M509 VanDerWaalsContact C-N 3.35Å; K507-M509 PolarHBondContact O-N 2.97Å; M509-F566 HydrophobicContact CE-CD1 4.38Å; M509-F566 HydrophobicContact CE-CE1 3.82Å; M509-F566 HydrophobicContact SD-CE1 4.25Å; M509-L567 HydrophobicContact CE-CD2 4.42Å; M509-I722 HydrophobicContact CE-CD1 3.5Å; M509-I722 VanDerWaalsContact CE-CD1 3.5Å; M509-I722 HydrophobicContact CE-CG1 4.09Å
510	F	93.2	Very high	86.7	Confident	31 Å²	31	55.9 Å²	55.9	14%	0.136	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	121.2	-172.9	-57.8	-85	0	0	0	110.9	Y496 L497 T499 E508 L512 T526 A527 T530	Y496-F510 CarbonylContact C-O 3.55Å; Y496-F510 WeakPolarHBondContact CA-O 3.39Å; L497-F510 PolarHBondContact N-O 3.36Å; L497-F510 PolarHBondContact O-N 2.91Å; T499-F510 HydrophobicContact CG2-CE2 4.4Å; T499-F510 WeakPolarHBondContact OG1-CE2 3.2Å; E508-F510 HydrophobicContact CB-CE2 4.11Å; E508-F510 HydrophobicContact CB-CZ 4.48Å; F510-L512 PolarHBondContact O-N 3.09Å; F510-T526 VanDerWaalsContact CD1-OG1 3.29Å; F510-T526 WeakPolarHBondContact CD1-OG1 3.44Å; F510-A527 HydrophobicContact CB-CB 4.09Å; F510-A527 HydrophobicContact CD1-CB 4.44Å; F510-A527 HydrophobicContact CD2-CB 3.51Å; F510-A527 HydrophobicContact CE2-CB 4.01Å; F510-A527 HydrophobicContact CG-CB 3.76Å; F510-T530 HydrophobicContact CZ-CG2 4.07Å; F510-T530 WeakPolarHBondContact CZ-OG1 3.24Å
511	L	93.8	Very high	87.1	Confident	49 Å²	49	58.4 Å²	58.4	26%	0.257	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	122.4	179.5	-174.2	70.1	0	0	0	110.6	E494 Y496 V513 D514 L520 G523	E494-L511 HydrophobicContact CB-CD1 4.11Å; Y496-L511 HydrophobicContact CD1-CB 3.96Å; Y496-L511 HydrophobicContact CD1-CD1 3.94Å; Y496-L511 HydrophobicContact CE1-CB 3.79Å; Y496-L511 HydrophobicContact CE1-CD1 3.45Å; Y496-L511 VanDerWaalsContact CE1-CD1 3.45Å; Y496-L511 HydrophobicContact CE1-CG 4.2Å; Y496-L511 HydrophobicContact CE2-CD1 4.14Å; Y496-L511 HydrophobicContact CG-CD1 4.48Å; L511-V513 VanDerWaalsContact CD1-O 3.3Å; L511-V513 WeakPolarHBondContact CD1-O 3.36Å; L511-D514 HydrophobicContact CD2-CB 4.41Å; L511-L520 HydrophobicContact CD2-CD1 3.59Å; L511-L520 HydrophobicContact CG-CD1 3.94Å; L511-G523 WeakPolarHBondContact O-CA 3.45Å
512	L	93.3	Very high	87.5	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	-39.9	173.5	-83.6	-177.8	0	0	0	113.2	H495 L497 F510 F519 L520 Y524 L735 M739	H495-L512 PolarHBondContact O-N 3.11Å; L497-L512 HydrophobicContact CD1-CD1 3.9Å; L497-L512 HydrophobicContact CD1-CD2 4.27Å; L497-L512 HydrophobicContact CD1-CG 4.15Å; L497-L512 HydrophobicContact CD2-CD1 3.54Å; L497-L512 HydrophobicContact CD2-CG 4.44Å; L497-L512 HydrophobicContact CG-CD1 3.46Å; L497-L512 VanDerWaalsContact CG-CD1 3.46Å; L497-L512 HydrophobicContact CG-CD2 4.48Å; L497-L512 HydrophobicContact CG-CG 3.82Å; F510-L512 PolarHBondContact O-N 3.09Å; L512-F519 HydrophobicContact CD2-CE1 4.38Å; L512-F519 HydrophobicContact CD2-CE2 4.47Å; L512-F519 HydrophobicContact CD2-CZ 3.94Å; L512-F519 CarbonylContact O-C 3.56Å; L512-F519 WeakPolarHBondContact O-CA 3.43Å; L512-L520 PolarHBondContact O-N 3.45Å; L512-Y524 HydrophobicContact CD2-CD2 4.3Å; L512-L735 HydrophobicContact CD1-CD1 4.12Å; L512-M739 HydrophobicContact CB-CE 4.37Å; L512-M739 HydrophobicContact CD1-SD 4.21Å
513	V	92.7	Very high	87.9	Confident	7 Å²	7	61.4 Å²	61.4	4%	0.042	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	125.8	178.9	177.4	0	0	0	0	108.8	E494 H495 L511 N518 F519 M739	E494-V513 WeakPolarHBondContact CA-O 3.42Å; H495-V513 HydrophobicContact CB-CB 3.99Å; H495-V513 PolarHBondContact N-O 2.78Å; H495-V513 PolarHBondContact O-N 2.93Å; L511-V513 VanDerWaalsContact CD1-O 3.3Å; L511-V513 WeakPolarHBondContact CD1-O 3.36Å; V513-N518 WeakPolarHBondContact CA-O 3.47Å; V513-F519 HydrophobicContact CG2-CB 4.5Å; V513-F519 HydrophobicContact CG2-CD2 3.79Å; V513-F519 HydrophobicContact CG2-CG 4.49Å; V513-M739 HydrophobicContact CB-CE 4.23Å; V513-M739 HydrophobicContact CG2-CE 3.54Å
514	D	92.8	Very high	88.6	Confident	36 Å²	36	57.7 Å²	57.7	19%	0.193	31%	0.306	C	S	.	.			trans	-77.7	170.9	178.3	68.9	17.2	0	0	0	112.5	L511 A516 G517 N518 L520	L511-D514 HydrophobicContact CD2-CB 4.41Å; D514-A516 PolarHBondContact O-N 2.78Å; D514-A516 WeakPolarHBondContact OD1-CA 3.45Å; D514-A516 WeakPolarHBondContact OD1-CB 3.49Å; D514-A516 PolarHBondContact OD1-N 3.35Å; D514-G517 PolarHBondContact O-N 2.7Å; D514-G517 PolarHBondContact OD1-N 3.44Å; D514-N518 PolarHBondContact N-O 2.75Å; D514-N518 PolarHBondContact OD1-N 2.71Å; D514-N518 PolarHBondContact OD1-ND2 2.8Å; D514-N518 PolarHBondContact OD2-ND2 3.46Å; D514-L520 HydrophobicContact CB-CD1 4.41Å
515	A	89.5	Confident	89.3	Confident	42 Å²	42	54.7 Å²	54.7	35%	0.347	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-12.1	177.7	0	0	0	0	0	114.5	P492 E494 T718	P492-A515 HydrophobicContact CB-CB 4.03Å; P492-A515 VanDerWaalsContact CB-O 3.28Å; P492-A515 WeakPolarHBondContact CB-O 3.32Å; P492-A515 HydrophobicContact CG-CB 4.26Å; E494-A515 HydrophobicContact CG-CB 4.09Å; A515-T718 HydrophobicContact CB-CG2 4.35Å
516	A	87.6	Confident	89.8	Confident	82 Å²	82	56.3 Å²	56.3	68%	0.678	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-8.2	174.4	0	0	0	0	0	112.9	D514	D514-A516 PolarHBondContact O-N 2.78Å; D514-A516 WeakPolarHBondContact OD1-CA 3.45Å; D514-A516 WeakPolarHBondContact OD1-CB 3.49Å; D514-A516 PolarHBondContact OD1-N 3.35Å
517	G	86.7	Confident	90.1	Very high	34 Å²	34	54.5 Å²	54.5	35%	0.351	29%	0.291	S	S	.	.			trans	91.8	12.6	179.6	0	0	0	0	0	115	D514 M740	D514-G517 PolarHBondContact O-N 2.7Å; D514-G517 PolarHBondContact OD1-N 3.44Å; G517-M740 VanDerWaalsContact O-CE 3.31Å; G517-M740 WeakPolarHBondContact O-CE 3.5Å
518	N	91.3	Very high	90.4	Very high	92 Å²	92	47.7 Å²	47.7	49%	0.492	26%	0.263	S	S	.	.			trans	-84.2	133.4	180	-54.2	-64.1	0	0	0	111.8	V513 D514 L520	V513-N518 WeakPolarHBondContact CA-O 3.47Å; D514-N518 PolarHBondContact N-O 2.75Å; D514-N518 PolarHBondContact OD1-N 2.71Å; D514-N518 PolarHBondContact OD1-ND2 2.8Å; D514-N518 PolarHBondContact OD2-ND2 3.46Å; N518-L520 PolarHBondContact O-N 3.23Å
519	F	91.6	Very high	90.5	Very high	33 Å²	33	49.6 Å²	49.6	15%	0.145	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-81.1	114.8	175.8	-164.9	-83.1	0	0	0	111.9	L512 V513 T521 M732 M739 M740	L512-F519 HydrophobicContact CD2-CE1 4.38Å; L512-F519 HydrophobicContact CD2-CE2 4.47Å; L512-F519 HydrophobicContact CD2-CZ 3.94Å; L512-F519 CarbonylContact O-C 3.56Å; L512-F519 WeakPolarHBondContact O-CA 3.43Å; V513-F519 HydrophobicContact CG2-CB 4.5Å; V513-F519 HydrophobicContact CG2-CD2 3.79Å; V513-F519 HydrophobicContact CG2-CG 4.49Å; F519-T521 PolarHBondContact O-N 3.48Å; F519-M732 HydrophobicContact CD1-CE 4.31Å; F519-M732 HydrophobicContact CE1-CE 3.9Å; F519-M732 HydrophobicContact CE1-CG 4.23Å; F519-M732 HydrophobicContact CZ-CG 4.4Å; F519-M739 HydrophobicContact CE2-SD 4.21Å; F519-M740 HydrophobicContact CB-CG 4.49Å; F519-M740 HydrophobicContact CD2-CG 4.3Å
520	L	92.4	Very high	90.3	Very high	63 Å²	63	50.3 Å²	50.3	33%	0.33	28%	0.281	S	S	.	.			trans	-93.8	87.2	-175.1	-60.8	-178.6	0	0	0	112	L511 L512 D514 N518 K522 G523	L511-L520 HydrophobicContact CD2-CD1 3.59Å; L511-L520 HydrophobicContact CG-CD1 3.94Å; L512-L520 PolarHBondContact O-N 3.45Å; D514-L520 HydrophobicContact CB-CD1 4.41Å; N518-L520 PolarHBondContact O-N 3.23Å; L520-K522 PolarHBondContact O-N 3.12Å; L520-G523 PolarHBondContact O-N 3.41Å
521	T	90.8	Very high	89.8	Confident	53 Å²	53	49.8 Å²	49.8	33%	0.325	28%	0.279	S	S	.	.	H	α-helix	trans	-54.9	-28.8	178.6	-40.1	0	0	0	0	113.8	F519 G523 Y524 Y525 M732	F519-T521 PolarHBondContact O-N 3.48Å; T521-G523 VanDerWaalsContact C-N 3.34Å; T521-G523 PolarHBondContact O-N 2.95Å; T521-Y524 WeakPolarHBondContact O-CB 3.24Å; T521-Y524 PolarHBondContact O-N 3.23Å; T521-Y525 HydrophobicContact CG2-CD2 3.93Å; T521-Y525 HydrophobicContact CG2-CE2 3.47Å; T521-Y525 VanDerWaalsContact CG2-CE2 3.47Å; T521-Y525 WeakPolarHBondContact O-CD2 3.49Å; T521-Y525 PolarHBondContact O-N 3.31Å; T521-Y525 VanDerWaalsContact O-N 3.16Å; T521-M732 HydrophobicContact CG2-CE 3.7Å; T521-M732 HydrophobicContact CG2-SD 3.84Å
522	K	91.1	Very high	89.2	Confident	174 Å²	174	53.6 Å²	53.6	76%	0.757	29%	0.293	S	S	*	.	H	α-helix	trans	-59	-42.9	174.6	-175.5	177.9	178.9	-179.8	0	112.1	L520 Y524 Y525 T526	L520-K522 PolarHBondContact O-N 3.12Å; K522-Y524 VanDerWaalsContact C-N 3.34Å; K522-Y524 PolarHBondContact O-N 3.04Å; K522-Y525 PolarHBondContact O-N 3.1Å; K522-T526 WeakPolarHBondContact O-CG2 3.49Å; K522-T526 PolarHBondContact O-N 3.41Å; K522-T526 VanDerWaalsContact O-N 3.09Å; K522-T526 PolarHBondContact O-OG1 2.56Å; K522-T526 VanDerWaalsContact O-OG1 3.13Å
523	G	88.1	Confident	88.6	Confident	9 Å²	9	58.6 Å²	58.6	9%	0.093	32%	0.316	C	S	.	.	H	α-helix	trans	-63	-41.5	178.8	0	0	0	0	0	112	L511 L520 T521 T526 A527	L511-G523 WeakPolarHBondContact O-CA 3.45Å; L520-G523 PolarHBondContact O-N 3.41Å; T521-G523 VanDerWaalsContact C-N 3.34Å; T521-G523 PolarHBondContact O-N 2.95Å; G523-T526 WeakPolarHBondContact CA-OG1 3.35Å; G523-T526 PolarHBondContact O-N 3.25Å; G523-T526 PolarHBondContact O-OG1 3.31Å; G523-A527 PolarHBondContact O-N 3.3Å
524	Y	90.9	Very high	87.8	Confident	22 Å²	22	61 Å²	61	9%	0.086	33%	0.325	C	S	.	.	H	α-helix	trans	-57.3	-55.1	174.9	-178.8	-97.1	0	0	0	112.3	L497 L512 T521 K522 T526 A527 V528 V729 H730 M732 L735	L497-Y524 HydrophobicContact CD1-CD2 4.33Å; L512-Y524 HydrophobicContact CD2-CD2 4.3Å; T521-Y524 WeakPolarHBondContact O-CB 3.24Å; T521-Y524 PolarHBondContact O-N 3.23Å; K522-Y524 VanDerWaalsContact C-N 3.34Å; K522-Y524 PolarHBondContact O-N 3.04Å; Y524-T526 VanDerWaalsContact C-N 3.34Å; Y524-T526 PolarHBondContact O-N 2.96Å; Y524-A527 WeakPolarHBondContact O-CB 3.37Å; Y524-A527 PolarHBondContact O-N 3.44Å; Y524-A527 VanDerWaalsContact O-N 3.13Å; Y524-V528 HydrophobicContact CD1-CG2 4.15Å; Y524-V528 HydrophobicContact CE1-CG2 3.65Å; Y524-V528 HydrophobicContact CE2-CG2 4.25Å; Y524-V528 WeakPolarHBondContact O-CG2 3.45Å; Y524-V528 PolarHBondContact O-N 2.93Å; Y524-V729 HydrophobicContact CD2-CG1 4.4Å; Y524-V729 HydrophobicContact CE2-CG1 3.8Å; Y524-H730 VanDerWaalsContact CE2-O 3.24Å; Y524-H730 WeakPolarHBondContact CE2-O 3.46Å; Y524-H730 PolarHBondContact OH-O 3.03Å; Y524-H730 VanDerWaalsContact OH-O 3.05Å; Y524-M732 HydrophobicContact CD1-CB 4.21Å; Y524-M732 HydrophobicContact CD1-CG 4.5Å; Y524-M732 HydrophobicContact CD1-SD 4.39Å; Y524-M732 HydrophobicContact CD2-CB 4.37Å; Y524-M732 HydrophobicContact CE1-CB 3.83Å; Y524-M732 HydrophobicContact CE2-CB 3.99Å; Y524-M732 HydrophobicContact CG-CB 4.47Å; Y524-M732 PolarHBondContact OH-N 3.3Å; Y524-L735 HydrophobicContact CD2-CD1 4.16Å; Y524-L735 HydrophobicContact CE2-CD1 3.98Å
525	Y	91.9	Very high	86.8	Confident	132 Å²	132	63.6 Å²	63.6	52%	0.518	34%	0.342	S	S	.	.	H	α-helix	trans	-61	-41.9	-179.8	-71.2	-58.3	0	0	0	112.1	T521 K522 A527 V528 D529	T521-Y525 HydrophobicContact CG2-CD2 3.93Å; T521-Y525 HydrophobicContact CG2-CE2 3.47Å; T521-Y525 VanDerWaalsContact CG2-CE2 3.47Å; T521-Y525 WeakPolarHBondContact O-CD2 3.49Å; T521-Y525 PolarHBondContact O-N 3.31Å; T521-Y525 VanDerWaalsContact O-N 3.16Å; K522-Y525 PolarHBondContact O-N 3.1Å; Y525-A527 VanDerWaalsContact C-N 3.28Å; Y525-A527 PolarHBondContact O-N 3.48Å; Y525-V528 PolarHBondContact O-N 2.82Å; Y525-V528 VanDerWaalsContact O-N 3.15Å; Y525-D529 PolarHBondContact O-N 3.47Å
526	T	89.9	Confident	85.7	Confident	55 Å²	55	64.8 Å²	64.8	34%	0.337	35%	0.348	S	S	.	.	H	α-helix	trans	-61	-34.4	176.2	51.4	0	0	0	0	113.6	F510 K522 G523 Y524 T530	F510-T526 VanDerWaalsContact CD1-OG1 3.29Å; F510-T526 WeakPolarHBondContact CD1-OG1 3.44Å; K522-T526 WeakPolarHBondContact O-CG2 3.49Å; K522-T526 PolarHBondContact O-N 3.41Å; K522-T526 VanDerWaalsContact O-N 3.09Å; K522-T526 PolarHBondContact O-OG1 2.56Å; K522-T526 VanDerWaalsContact O-OG1 3.13Å; G523-T526 WeakPolarHBondContact CA-OG1 3.35Å; G523-T526 PolarHBondContact O-N 3.25Å; G523-T526 PolarHBondContact O-OG1 3.31Å; Y524-T526 VanDerWaalsContact C-N 3.34Å; Y524-T526 PolarHBondContact O-N 2.96Å; T526-T530 VanDerWaalsContact O-CB 3.27Å; T526-T530 WeakPolarHBondContact O-CB 3.48Å; T526-T530 PolarHBondContact O-N 3.37Å; T526-T530 PolarHBondContact O-OG1 3.24Å
527	A	87.6	Confident	84.5	Confident	0 Å²	0	67 Å²	67	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-69.8	-42.7	174.6	0	0	0	0	0	111.9	L497 F510 G523 Y524 Y525 K531	L497-A527 HydrophobicContact CB-CB 4.45Å; L497-A527 HydrophobicContact CD1-CB 3.92Å; F510-A527 HydrophobicContact CB-CB 4.09Å; F510-A527 HydrophobicContact CD1-CB 4.44Å; F510-A527 HydrophobicContact CD2-CB 3.51Å; F510-A527 HydrophobicContact CE2-CB 4.01Å; F510-A527 HydrophobicContact CG-CB 3.76Å; G523-A527 PolarHBondContact O-N 3.3Å; Y524-A527 WeakPolarHBondContact O-CB 3.37Å; Y524-A527 PolarHBondContact O-N 3.44Å; Y524-A527 VanDerWaalsContact O-N 3.13Å; Y525-A527 VanDerWaalsContact C-N 3.28Å; Y525-A527 PolarHBondContact O-N 3.48Å; A527-K531 VanDerWaalsContact O-CB 3.32Å; A527-K531 WeakPolarHBondContact O-CB 3.44Å; A527-K531 PolarHBondContact O-N 3.27Å
528	V	88.5	Confident	83.1	Confident	22 Å²	22	72 Å²	72	13%	0.133	36%	0.356	C	S	.	.	H	α-helix	trans	-61.4	-47.2	176.7	171.1	0	0	0	0	111.1	Y524 Y525 K531 K532 V729	Y524-V528 HydrophobicContact CD1-CG2 4.15Å; Y524-V528 HydrophobicContact CE1-CG2 3.65Å; Y524-V528 HydrophobicContact CE2-CG2 4.25Å; Y524-V528 WeakPolarHBondContact O-CG2 3.45Å; Y524-V528 PolarHBondContact O-N 2.93Å; Y525-V528 PolarHBondContact O-N 2.82Å; Y525-V528 VanDerWaalsContact O-N 3.15Å; V528-K531 PolarHBondContact O-N 3.23Å; V528-K532 HydrophobicContact CG1-CD 3.95Å; V528-K532 VanDerWaalsContact CG1-CE 3.42Å; V528-K532 HydrophobicContact CG1-CG 4.4Å; V528-K532 WeakPolarHBondContact O-CB 3.35Å; V528-K532 WeakPolarHBondContact O-CG 3.39Å; V528-K532 PolarHBondContact O-N 2.86Å; V528-V729 HydrophobicContact CG2-CB 4.01Å; V528-V729 HydrophobicContact CG2-CG1 3.91Å; V528-V729 HydrophobicContact CG2-CG2 4.22Å
529	D	87.6	Confident	81.4	Confident	78 Å²	78	71.1 Å²	71.1	42%	0.417	36%	0.362	S	S	.	.	H	α-helix	trans	-70.4	-44.4	-176.6	-65.1	-25.9	0	0	0	111.4	Y525 K531 K532 E533	Y525-D529 PolarHBondContact O-N 3.47Å; D529-K531 PolarHBondContact O-N 2.82Å; D529-K532 PolarHBondContact O-N 2.96Å; D529-K532 IonicContact OD1-NZ 2.91Å; D529-E533 WeakPolarHBondContact O-CB 3.48Å; D529-E533 PolarHBondContact O-N 2.91Å
530	T	85	Confident	79.6	Confident	43 Å²	43	78 Å²	78	26%	0.264	39%	0.394	S	S	.	.	H	α-helix	trans	-56	-40	173.2	-58	0	0	0	0	111.5	E508 F510 T526 R534	E508-T530 HydrophobicContact CG-CG2 4.45Å; F510-T530 HydrophobicContact CZ-CG2 4.07Å; F510-T530 WeakPolarHBondContact CZ-OG1 3.24Å; T526-T530 VanDerWaalsContact O-CB 3.27Å; T526-T530 WeakPolarHBondContact O-CB 3.48Å; T526-T530 PolarHBondContact O-N 3.37Å; T526-T530 PolarHBondContact O-OG1 3.24Å; T530-R534 PolarHBondContact O-N 3.5Å
531	K	82.1	Confident	77.6	Confident	20 Å²	20	78.7 Å²	78.7	9%	0.087	40%	0.404	C	S	.	.	H	α-helix	trans	-74.4	-41.5	178.9	-164.8	161	-172.5	172.1	0	112.5	T499 A527 V528 D529 E533 R534 T535 C725 K726 S727 G728 V729	T499-K531 HydrophobicContact CG2-CD 4.23Å; A527-K531 VanDerWaalsContact O-CB 3.32Å; A527-K531 WeakPolarHBondContact O-CB 3.44Å; A527-K531 PolarHBondContact O-N 3.27Å; V528-K531 PolarHBondContact O-N 3.23Å; D529-K531 PolarHBondContact O-N 2.82Å; K531-E533 VanDerWaalsContact C-N 3.35Å; K531-E533 PolarHBondContact O-N 3.09Å; K531-R534 PolarHBondContact O-N 2.98Å; K531-R534 VanDerWaalsContact O-N 3.16Å; K531-T535 PolarHBondContact O-N 2.98Å; K531-T535 VanDerWaalsContact O-N 3.07Å; K531-T535 PolarHBondContact O-OG1 3.48Å; K531-T535 VanDerWaalsContact O-OG1 3.04Å; K531-C725 PolarHBondContact NZ-O 2.73Å; K531-K726 VanDerWaalsContact NZ-C 3.31Å; K531-K726 PolarHBondContact NZ-O 3.08Å; K531-S727 WeakPolarHBondContact CE-O 3.46Å; K531-S727 PolarHBondContact NZ-O 3.12Å; K531-G728 PolarHBondContact NZ-O 3.45Å; K531-V729 HydrophobicContact CB-CG2 4.14Å; K531-V729 HydrophobicContact CD-CG2 3.85Å
532	K	82.5	Confident	75.4	Confident	128 Å²	128	84.8 Å²	84.8	56%	0.557	43%	0.426	S	S	*	.	H	α-helix	trans	-58.2	-44.7	173.1	-78.1	172.6	-178.9	167.3	0	111.8	V528 D529 R534 T535 S536	V528-K532 HydrophobicContact CG1-CD 3.95Å; V528-K532 VanDerWaalsContact CG1-CE 3.42Å; V528-K532 HydrophobicContact CG1-CG 4.4Å; V528-K532 WeakPolarHBondContact O-CB 3.35Å; V528-K532 WeakPolarHBondContact O-CG 3.39Å; V528-K532 PolarHBondContact O-N 2.86Å; D529-K532 PolarHBondContact O-N 2.96Å; D529-K532 IonicContact OD1-NZ 2.91Å; K532-R534 VanDerWaalsContact C-N 3.26Å; K532-R534 PolarHBondContact O-N 3.25Å; K532-T535 PolarHBondContact O-N 2.98Å; K532-S536 PolarHBondContact O-N 2.82Å; K532-S536 PolarHBondContact O-OG 2.79Å
533	E	80.2	Confident	73.3	Confident	106 Å²	106	80 Å²	80	50%	0.495	43%	0.427	S	S	.	.	H	α-helix	trans	-58.2	-36.7	175.6	-84.7	-163.8	-146	0	0	112.9	D529 K531 S536 K537	D529-E533 WeakPolarHBondContact O-CB 3.48Å; D529-E533 PolarHBondContact O-N 2.91Å; K531-E533 VanDerWaalsContact C-N 3.35Å; K531-E533 PolarHBondContact O-N 3.09Å; E533-S536 PolarHBondContact O-OG 2.93Å; E533-S536 VanDerWaalsContact O-OG 3.08Å; E533-K537 WeakPolarHBondContact O-CB 3.35Å; E533-K537 VanDerWaalsContact O-CD 3.29Å; E533-K537 WeakPolarHBondContact O-CD 3.32Å; E533-K537 WeakPolarHBondContact O-CG 3.38Å; E533-K537 PolarHBondContact O-N 2.74Å; E533-K537 IonicContact OE2-NZ 3.23Å; E533-K537 PolarHBondContact OE2-NZ 3.4Å
534	R	75.8	Confident	71.1	Confident	56 Å²	56	86.4 Å²	86.4	21%	0.211	46%	0.464	C	S	.	.	H	α-helix	trans	-69.7	-45.8	175.9	-171.1	-178	-63.3	153.7	4.9	111.1	T499 N501 E508 T530 K531 K532 S536 K537 H538	T499-R534 PolarHBondContact O-NH1 3.3Å; N501-R534 PolarHBondContact OD1-NH1 2.91Å; E508-R534 IonicContact OE1-CZ 3.64Å; E508-R534 IonicContact OE1-NH2 3.84Å; E508-R534 PolarHBondContact OE1-NH2 2.82Å; E508-R534 IonicContact OE2-CZ 2.8Å; E508-R534 IonicContact OE2-NH2 3.58Å; E508-R534 PolarHBondContact OE2-NH2 3.21Å; T530-R534 PolarHBondContact O-N 3.5Å; K531-R534 PolarHBondContact O-N 2.98Å; K531-R534 VanDerWaalsContact O-N 3.16Å; K532-R534 VanDerWaalsContact C-N 3.26Å; K532-R534 PolarHBondContact O-N 3.25Å; R534-S536 VanDerWaalsContact C-N 3.34Å; R534-S536 PolarHBondContact O-N 3.17Å; R534-K537 PolarHBondContact O-N 2.85Å; R534-H538 PolarHBondContact O-N 3.04Å
535	T	71.3	Confident	69	Low	91 Å²	91	95.7 Å²	95.7	56%	0.558	51%	0.505	S	S	*	.	H	α-helix	trans	-63.7	-39.4	-179.5	-43.6	0	0	0	0	111.5	K531 K532 H538 A539	K531-T535 PolarHBondContact O-N 2.98Å; K531-T535 VanDerWaalsContact O-N 3.07Å; K531-T535 PolarHBondContact O-OG1 3.48Å; K531-T535 VanDerWaalsContact O-OG1 3.04Å; K532-T535 PolarHBondContact O-N 2.98Å; T535-H538 PolarHBondContact O-N 3.27Å; T535-A539 WeakPolarHBondContact O-CB 3.29Å; T535-A539 PolarHBondContact O-N 3.03Å
536	S	66.9	Low	66.2	Low	67 Å²	67	94.3 Å²	94.3	47%	0.469	52%	0.515	S	S	.	.	H	α-helix	trans	-68	-42	177	62.7	0	0	0	0	112.8	K532 E533 R534 H538 A539 Q540	K532-S536 PolarHBondContact O-N 2.82Å; K532-S536 PolarHBondContact O-OG 2.79Å; E533-S536 PolarHBondContact O-OG 2.93Å; E533-S536 VanDerWaalsContact O-OG 3.08Å; R534-S536 VanDerWaalsContact C-N 3.34Å; R534-S536 PolarHBondContact O-N 3.17Å; S536-H538 VanDerWaalsContact C-N 3.26Å; S536-H538 PolarHBondContact O-N 2.93Å; S536-A539 PolarHBondContact O-N 3.03Å; S536-Q540 PolarHBondContact O-N 3.43Å
537	K	63.3	Low	63.9	Low	128 Å²	128	98 Å²	98	56%	0.557	54%	0.538	S	S	*	.	H	α-helix	trans	-63.4	-30	174	-71.2	166.2	-166.3	163	0	112.6	E533 R534	E533-K537 WeakPolarHBondContact O-CB 3.35Å; E533-K537 VanDerWaalsContact O-CD 3.29Å; E533-K537 WeakPolarHBondContact O-CD 3.32Å; E533-K537 WeakPolarHBondContact O-CG 3.38Å; E533-K537 PolarHBondContact O-N 2.74Å; E533-K537 IonicContact OE2-NZ 3.23Å; E533-K537 PolarHBondContact OE2-NZ 3.4Å; R534-K537 PolarHBondContact O-N 2.85Å
538	H	57	Low	61.6	Low	141 Å²	141	102.2 Å²	102.2	65%	0.653	57%	0.565	S	S	*	*	H	α-helix	trans	-80	-39.1	176	-135.7	56.7	0	0	0	112.5	R534 T535 S536 Q540 S541	R534-H538 PolarHBondContact O-N 3.04Å; T535-H538 PolarHBondContact O-N 3.27Å; S536-H538 VanDerWaalsContact C-N 3.26Å; S536-H538 PolarHBondContact O-N 2.93Å; H538-Q540 PolarHBondContact O-N 3.03Å; H538-S541 PolarHBondContact O-N 3.33Å; H538-S541 PolarHBondContact O-OG 3.18Å
539	A	54.9	Low	59.7	Low	73 Å²	73	109.4 Å²	109.4	60%	0.603	60%	0.597	S	S	*	*	H	α-helix	trans	-64.6	-18.9	178.9	0	0	0	0	0	114	T535 S536	T535-A539 WeakPolarHBondContact O-CB 3.29Å; T535-A539 PolarHBondContact O-N 3.03Å; S536-A539 PolarHBondContact O-N 3.03Å
540	Q	53	Low	58	Low	176 Å²	176	113.6 Å²	113.6	82%	0.822	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	-13.8	175.3	-76.5	-176.3	-22.6	0	0	114.6	S536 H538	S536-Q540 PolarHBondContact O-N 3.43Å; H538-Q540 PolarHBondContact O-N 3.03Å
541	S	50.4	Low	56.9	Low	78 Å²	78	113.3 Å²	113.3	55%	0.545	61%	0.612	S	S	.	*	T	Hydrogen-bonded Turn	trans	-106.1	-22.4	-175.5	70.5	0	0	0	0	115.8	H538	H538-S541 PolarHBondContact O-N 3.33Å; H538-S541 PolarHBondContact O-OG 3.18Å
542	F	46.4	Very low	56.2	Low	181 Å²	181	115.3 Å²	115.3	79%	0.794	63%	0.629	S	S	*	*			trans	-140	116.2	176.5	-88.8	-90.5	0	0	0	111.8
543	G	46.5	Very low	55.6	Low	74 Å²	74	113.3 Å²	113.3	76%	0.763	64%	0.636	S	S	*	*			trans	-87.8	107.7	176.7	0	0	0	0	0	112.8
544	T	40.9	Very low	55.3	Low	144 Å²	144	112.7 Å²	112.7	88%	0.883	64%	0.643	S	S	*	*			trans	-168.2	143.2	144.1	9.2	0	0	0	0	110.4
545	K	46.9	Very low	55.4	Low	216 Å²	216	115.2 Å²	115.2	94%	0.939	66%	0.657	S	S	*	*			trans	-85.7	111.9	176.5	-70.7	178.1	178	176.4	0	110.4
546	S	34	Very low	55.9	Low	104 Å²	104	111.4 Å²	111.4	73%	0.727	63%	0.633	S	S	*	*			trans	-140.1	146.2	144.6	76.2	0	0	0	0	108.8	P548	S546-P548 VanDerWaalsContact C-CD 3.48Å; S546-P548 WeakPolarHBondContact O-CD 3.33Å
547	T	40.6	Very low	56.7	Low	133 Å²	133	113.2 Å²	113.2	82%	0.816	63%	0.63	S	S	*	*			trans	-110.4	84.2	179.6	-51.8	0	0	0	0	108.6	Q549	T547-Q549 PolarHBondContact O-N 2.83Å
548	P	40.6	Very low	57.8	Low	88 Å²	88	108.9 Å²	108.9	57%	0.571	62%	0.618	S	S	*	*			trans	-73.5	115.8	170.1	31.1	-32.2	0	0	0	108.5	S546 H550	S546-P548 VanDerWaalsContact C-CD 3.48Å; S546-P548 WeakPolarHBondContact O-CD 3.33Å; P548-H550 PolarHBondContact O-N 2.87Å
549	Q	47.6	Very low	59.3	Low	173 Å²	173	102.9 Å²	102.9	81%	0.808	59%	0.591	S	S	*	*	S	Bend	trans	-66.4	-11.6	168.5	-76.4	179.7	-22.3	0	0	112.4	T547	T547-Q549 PolarHBondContact O-N 2.83Å
550	H	52.5	Low	61	Low	166 Å²	166	99.4 Å²	99.4	77%	0.769	56%	0.562	S	S	*	*	S	Bend	trans	-99.4	124.9	174.4	-70.4	-89.4	0	0	0	111.7	P548	P548-H550 PolarHBondContact O-N 2.87Å
551	T	60.7	Low	62.7	Low	36 Å²	36	93.3 Å²	93.3	22%	0.221	54%	0.535	C	S	.	.	P	Polyproline II helix	trans	-69.5	149	165	43.9	0	0	0	0	110.5	D556 K726	T551-D556 VanDerWaalsContact CB-OD1 3.29Å; T551-D556 WeakPolarHBondContact CB-OD1 3.47Å; T551-D556 PolarHBondContact OG1-OD1 2.93Å; T551-K726 HydrophobicContact CG2-CB 4.05Å
552	S	67.7	Low	64.6	Low	63 Å²	63	90.3 Å²	90.3	44%	0.441	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-77.3	146	177.5	66.6	0	0	0	0	110.9	S554 Q555 D556	S552-S554 PolarHBondContact O-N 2.92Å; S552-Q555 WeakPolarHBondContact O-CB 3.46Å; S552-Q555 PolarHBondContact O-N 2.97Å; S552-Q555 WeakPolarHBondContact OG-CG 3.48Å; S552-D556 PolarHBondContact O-N 2.9Å; S552-D556 VanDerWaalsContact O-N 3.16Å
553	A	70.4	Confident	66.7	Low	85 Å²	85	81.7 Å²	81.7	70%	0.702	48%	0.476	S	S	*	.	H	α-helix	trans	-55.6	-28.6	-177.6	0	0	0	0	0	113.7	R557	A553-R557 WeakPolarHBondContact O-CB 3.37Å; A553-R557 PolarHBondContact O-N 3.44Å
554	S	74.3	Confident	68.9	Low	93 Å²	93	78.3 Å²	78.3	65%	0.65	44%	0.44	S	S	*	.	H	α-helix	trans	-66.6	-39.1	173.8	-173.5	0	0	0	0	112.9	S552 A558	S552-S554 PolarHBondContact O-N 2.92Å; S554-A558 PolarHBondContact O-N 3.43Å; S554-A558 VanDerWaalsContact O-N 3.15Å
555	Q	78.1	Confident	71.1	Confident	110 Å²	110	75.9 Å²	75.9	51%	0.514	42%	0.419	S	S	.	.	H	α-helix	trans	-68.5	-44.3	174.9	-69.7	176	-14.3	0	0	111.1	S552 R557 A558 V559	S552-Q555 WeakPolarHBondContact O-CB 3.46Å; S552-Q555 PolarHBondContact O-N 2.97Å; S552-Q555 WeakPolarHBondContact OG-CG 3.48Å; Q555-R557 VanDerWaalsContact C-N 3.34Å; Q555-R557 PolarHBondContact O-N 2.94Å; Q555-A558 PolarHBondContact O-N 2.89Å; Q555-A558 VanDerWaalsContact O-N 3.16Å; Q555-V559 WeakPolarHBondContact O-CG2 3.26Å; Q555-V559 PolarHBondContact O-N 3.23Å
556	D	80.8	Confident	73.2	Confident	10 Å²	10	66 Å²	66	5%	0.053	38%	0.376	C	S	.	.	H	α-helix	trans	-58.3	-44.3	176.4	-84.6	36.3	0	0	0	111.7	T551 S552 A558 V559 W560 R584 K726	T551-D556 VanDerWaalsContact CB-OD1 3.29Å; T551-D556 WeakPolarHBondContact CB-OD1 3.47Å; T551-D556 PolarHBondContact OG1-OD1 2.93Å; S552-D556 PolarHBondContact O-N 2.9Å; S552-D556 VanDerWaalsContact O-N 3.16Å; D556-A558 PolarHBondContact O-N 2.96Å; D556-V559 PolarHBondContact O-N 2.84Å; D556-W560 PolarHBondContact O-N 2.82Å; D556-R584 IonicContact OD2-CZ 3.73Å; D556-R584 IonicContact OD2-NE 2.94Å; D556-R584 IonicContact OD2-NH2 2.73Å; D556-R584 PolarHBondContact OD2-NH2 3.28Å; D556-K726 WeakPolarHBondContact OD2-CE 3.5Å; D556-K726 IonicContact OD2-NZ 3.88Å; D556-K726 PolarHBondContact OD2-NZ 3.07Å
557	R	84.8	Confident	76	Confident	106 Å²	106	61.1 Å²	61.1	40%	0.4	34%	0.342	S	S	.	.	H	α-helix	trans	-57.9	-45.3	173.8	-179	179.2	-178.8	175.7	0.9	112.2	A553 Q555 W560 L561 S591	A553-R557 WeakPolarHBondContact O-CB 3.37Å; A553-R557 PolarHBondContact O-N 3.44Å; Q555-R557 VanDerWaalsContact C-N 3.34Å; Q555-R557 PolarHBondContact O-N 2.94Å; R557-W560 PolarHBondContact O-N 2.99Å; R557-L561 HydrophobicContact CG-CD1 3.91Å; R557-L561 HydrophobicContact CG-CG 4.47Å; R557-L561 WeakPolarHBondContact O-CB 3.35Å; R557-L561 WeakPolarHBondContact O-CG 3.22Å; R557-L561 PolarHBondContact O-N 3.17Å; R557-S591 WeakPolarHBondContact CD-O 3.45Å; R557-S591 PolarHBondContact NE-O 3.33Å
558	A	85.5	Confident	78.3	Confident	36 Å²	36	57.1 Å²	57.1	30%	0.298	32%	0.319	S	S	.	.	H	α-helix	trans	-65.5	-38.8	179.9	0	0	0	0	0	112.5	S554 Q555 D556 T562	S554-A558 PolarHBondContact O-N 3.43Å; S554-A558 VanDerWaalsContact O-N 3.15Å; Q555-A558 PolarHBondContact O-N 2.89Å; Q555-A558 VanDerWaalsContact O-N 3.16Å; D556-A558 PolarHBondContact O-N 2.96Å; A558-T562 VanDerWaalsContact O-CB 3.3Å; A558-T562 WeakPolarHBondContact O-CB 3.35Å; A558-T562 PolarHBondContact O-N 3.39Å; A558-T562 VanDerWaalsContact O-N 3.08Å; A558-T562 PolarHBondContact O-OG1 3.31Å
559	V	88.6	Confident	80.6	Confident	15 Å²	15	58.6 Å²	58.6	9%	0.091	32%	0.318	C	S	.	.	H	α-helix	trans	-61.1	-51	174.6	170.9	0	0	0	0	110.6	Y498 N501 Q555 D556 T562 L563 L724	Y498-V559 HydrophobicContact CD1-CG1 4.4Å; Y498-V559 HydrophobicContact CE1-CG1 4.07Å; N501-V559 HydrophobicContact CB-CG2 4.08Å; Q555-V559 WeakPolarHBondContact O-CG2 3.26Å; Q555-V559 PolarHBondContact O-N 3.23Å; D556-V559 PolarHBondContact O-N 2.84Å; V559-T562 PolarHBondContact O-N 3.25Å; V559-L563 WeakPolarHBondContact O-CB 3.47Å; V559-L563 PolarHBondContact O-N 3.03Å; V559-L724 HydrophobicContact CG1-CD1 4.41Å; V559-L724 HydrophobicContact CG1-CD2 4.47Å
560	W	90.7	Very high	82.6	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-63.6	-47.5	-180	-81.5	121.1	0	0	0	113.1	D556 R557 T562 L563 L564 A577 N588 L592 F666 V683 D685 L724	D556-W560 PolarHBondContact O-N 2.82Å; R557-W560 PolarHBondContact O-N 2.99Å; W560-T562 VanDerWaalsContact C-N 3.32Å; W560-T562 PolarHBondContact O-N 3.06Å; W560-L563 HydrophobicContact CE3-CD2 4.48Å; W560-L563 HydrophobicContact CZ3-CD2 4.29Å; W560-L563 PolarHBondContact O-N 3.33Å; W560-L564 HydrophobicContact CE3-CG 4.38Å; W560-L564 WeakPolarHBondContact O-CB 3.18Å; W560-L564 VanDerWaalsContact O-CG 3.32Å; W560-L564 WeakPolarHBondContact O-CG 3.35Å; W560-L564 PolarHBondContact O-N 3.26Å; W560-A577 HydrophobicContact CH2-CB 3.48Å; W560-A577 VanDerWaalsContact CH2-CB 3.48Å; W560-A577 HydrophobicContact CZ2-CB 4.27Å; W560-A577 HydrophobicContact CZ3-CB 3.97Å; W560-N588 PolarHBondContact NE1-ND2 2.96Å; W560-N588 PolarHBondContact NE1-OD1 2.83Å; W560-L592 HydrophobicContact CB-CD2 4.13Å; W560-F666 HydrophobicContact CD2-CE1 4.05Å; W560-F666 HydrophobicContact CD2-CZ 4.3Å; W560-F666 AromaticContact CE2-CE1 3.82Å; W560-F666 HydrophobicContact CE3-CE1 4.15Å; W560-F666 HydrophobicContact CE3-CZ 4.28Å; W560-F666 AromaticContact CH2-CE1 3.92Å; W560-F666 HydrophobicContact CH2-CE1 3.92Å; W560-F666 AromaticContact CZ2-CE1 3.76Å; W560-F666 HydrophobicContact CZ2-CE1 3.76Å; W560-F666 HydrophobicContact CZ3-CE1 4.1Å; W560-V683 HydrophobicContact CH2-CB 4.2Å; W560-V683 HydrophobicContact CH2-CG1 3.63Å; W560-V683 HydrophobicContact CZ3-CB 4.34Å; W560-V683 HydrophobicContact CZ3-CG1 3.85Å; W560-D685 HydrophobicContact CZ2-CB 4.29Å; W560-D685 VanDerWaalsContact CZ2-OD1 3.32Å; W560-D685 WeakPolarHBondContact CZ2-OD1 3.31Å; W560-D685 PolarHBondContact NE1-OD1 2.95Å; W560-L724 HydrophobicContact CD2-CD1 4.27Å; W560-L724 HydrophobicContact CE3-CD1 4.49Å; W560-L724 HydrophobicContact CH2-CD1 3.74Å; W560-L724 HydrophobicContact CZ2-CD1 3.48Å; W560-L724 VanDerWaalsContact CZ2-CD1 3.48Å; W560-L724 HydrophobicContact CZ3-CD1 4.26Å
561	L	89.6	Confident	84.3	Confident	48 Å²	48	55.6 Å²	55.6	25%	0.251	30%	0.299	S	S	.	.	H	α-helix	trans	-58.2	-44.2	177	-76.5	170.2	0	0	0	111.8	R557 H565 L592 M595	R557-L561 HydrophobicContact CG-CD1 3.91Å; R557-L561 HydrophobicContact CG-CG 4.47Å; R557-L561 WeakPolarHBondContact O-CB 3.35Å; R557-L561 WeakPolarHBondContact O-CG 3.22Å; R557-L561 PolarHBondContact O-N 3.17Å; L561-H565 VanDerWaalsContact O-CB 3.29Å; L561-H565 WeakPolarHBondContact O-CB 3.49Å; L561-H565 PolarHBondContact O-N 3.22Å; L561-H565 VanDerWaalsContact O-N 3.08Å; L561-L592 HydrophobicContact CD2-CD2 3.51Å; L561-L592 HydrophobicContact CG-CD2 3.76Å; L561-M595 HydrophobicContact CD2-CB 4.4Å
562	T	89.3	Confident	85.7	Confident	15 Å²	15	54.9 Å²	54.9	9%	0.092	29%	0.293	C	S	.	.	H	α-helix	trans	-64.5	-46.3	179.4	-54.7	0	0	0	0	111.1	Y498 S502 Q506 A558 V559 W560 F566	Y498-T562 VanDerWaalsContact OH-CG2 3.27Å; Y498-T562 WeakPolarHBondContact OH-CG2 3.45Å; S502-T562 VanDerWaalsContact O-CG2 3.29Å; S502-T562 WeakPolarHBondContact O-CG2 3.36Å; Q506-T562 HydrophobicContact CB-CG2 3.44Å; Q506-T562 VanDerWaalsContact CB-CG2 3.44Å; A558-T562 VanDerWaalsContact O-CB 3.3Å; A558-T562 WeakPolarHBondContact O-CB 3.35Å; A558-T562 PolarHBondContact O-N 3.39Å; A558-T562 VanDerWaalsContact O-N 3.08Å; A558-T562 PolarHBondContact O-OG1 3.31Å; V559-T562 PolarHBondContact O-N 3.25Å; W560-T562 VanDerWaalsContact C-N 3.32Å; W560-T562 PolarHBondContact O-N 3.06Å; T562-F566 WeakPolarHBondContact O-CB 3.29Å; T562-F566 PolarHBondContact O-N 3.32Å; T562-F566 VanDerWaalsContact O-N 3.1Å
563	L	91.4	Very high	86.8	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-65.1	-48.6	-179.6	177.9	60.4	0	0	0	111.9	Y498 V559 W560 H565 F566 L567 V683 I722 L724	Y498-L563 HydrophobicContact CD1-CB 4.44Å; Y498-L563 HydrophobicContact CD1-CD1 4.33Å; Y498-L563 HydrophobicContact CD1-CD2 4.37Å; Y498-L563 HydrophobicContact CD2-CD1 4.02Å; Y498-L563 HydrophobicContact CE1-CB 3.8Å; Y498-L563 HydrophobicContact CE1-CD1 4.27Å; Y498-L563 HydrophobicContact CE1-CG 4.42Å; Y498-L563 HydrophobicContact CE2-CD1 3.97Å; Y498-L563 HydrophobicContact CG-CD1 4.19Å; Y498-L563 PolarHBondContact OH-N 3.02Å; V559-L563 WeakPolarHBondContact O-CB 3.47Å; V559-L563 PolarHBondContact O-N 3.03Å; W560-L563 HydrophobicContact CE3-CD2 4.48Å; W560-L563 HydrophobicContact CZ3-CD2 4.29Å; W560-L563 PolarHBondContact O-N 3.33Å; L563-H565 VanDerWaalsContact C-N 3.31Å; L563-H565 PolarHBondContact O-N 3Å; L563-F566 WeakPolarHBondContact O-CB 3.42Å; L563-F566 PolarHBondContact O-N 3.12Å; L563-L567 HydrophobicContact CD1-CD1 3.9Å; L563-L567 HydrophobicContact CD1-CD2 4.41Å; L563-L567 HydrophobicContact CD1-CG 3.91Å; L563-L567 HydrophobicContact CD2-CD1 4.45Å; L563-L567 HydrophobicContact CG-CD1 3.86Å; L563-L567 HydrophobicContact CG-CG 4.26Å; L563-L567 WeakPolarHBondContact O-CG 3.34Å; L563-L567 PolarHBondContact O-N 3.47Å; L563-V683 HydrophobicContact CD2-CG1 4.02Å; L563-V683 HydrophobicContact CD2-CG2 4.29Å; L563-I722 HydrophobicContact CD1-CD1 4.23Å; L563-L724 HydrophobicContact CD2-CD2 3.6Å
564	L	91.3	Very high	87.9	Confident	4 Å²	4	50.1 Å²	50.1	2%	0.021	25%	0.253	C	S	.	.	H	α-helix	trans	-66.7	-34.9	-177.1	-66.2	177.7	0	0	0	111.8	W560 S568 L592 M595 V664	W560-L564 HydrophobicContact CE3-CG 4.38Å; W560-L564 WeakPolarHBondContact O-CB 3.18Å; W560-L564 VanDerWaalsContact O-CG 3.32Å; W560-L564 WeakPolarHBondContact O-CG 3.35Å; W560-L564 PolarHBondContact O-N 3.26Å; L564-S568 VanDerWaalsContact O-CB 3.23Å; L564-S568 WeakPolarHBondContact O-CB 3.37Å; L564-S568 PolarHBondContact O-N 2.95Å; L564-L592 HydrophobicContact CD1-CD1 3.48Å; L564-L592 VanDerWaalsContact CD1-CD1 3.48Å; L564-L592 HydrophobicContact CD1-CD2 4.12Å; L564-L592 HydrophobicContact CD1-CG 4.46Å; L564-M595 HydrophobicContact CB-CE 3.77Å; L564-M595 HydrophobicContact CB-SD 3.75Å; L564-M595 HydrophobicContact CD1-SD 4.22Å; L564-V664 HydrophobicContact CD1-CG1 4.13Å; L564-V664 HydrophobicContact CD1-CG2 4.24Å; L564-V664 HydrophobicContact CD2-CG1 4.06Å; L564-V664 HydrophobicContact CD2-CG2 3.73Å
565	H	88.9	Confident	88.9	Confident	93 Å²	93	45.7 Å²	45.7	43%	0.431	22%	0.222	S	C	.	.	H	α-helix	trans	-63.6	-44.9	172.1	-169	71.5	0	0	0	111.6	L561 L563 S568 Q569 M595	L561-H565 VanDerWaalsContact O-CB 3.29Å; L561-H565 WeakPolarHBondContact O-CB 3.49Å; L561-H565 PolarHBondContact O-N 3.22Å; L561-H565 VanDerWaalsContact O-N 3.08Å; L563-H565 VanDerWaalsContact C-N 3.31Å; L563-H565 PolarHBondContact O-N 3Å; H565-S568 PolarHBondContact O-N 2.99Å; H565-Q569 PolarHBondContact CD2-NE2 2.91Å; H565-Q569 VanDerWaalsContact CD2-NE2 3.31Å; H565-Q569 PolarHBondContact NE2-NE2 3.26Å; H565-Q569 WeakPolarHBondContact O-CG 3.45Å; H565-Q569 PolarHBondContact O-N 2.57Å; H565-M595 HydrophobicContact CB-CE 4.46Å
566	F	90.5	Very high	89.7	Confident	9 Å²	9	40.4 Å²	40.4	4%	0.039	20%	0.197	C	C	.	.	H	α-helix	trans	-62.6	-44.7	176.5	177.6	-108.3	0	0	0	113.1	Q506 K507 M509 T562 L563 Q569 R570	Q506-F566 HydrophobicContact CG-CD2 4.4Å; Q506-F566 WeakPolarHBondContact O-CD2 3.27Å; Q506-F566 WeakPolarHBondContact O-CG 3.32Å; K507-F566 HydrophobicContact CG-CE2 4.17Å; M509-F566 HydrophobicContact CE-CD1 4.38Å; M509-F566 HydrophobicContact CE-CE1 3.82Å; M509-F566 HydrophobicContact SD-CE1 4.25Å; T562-F566 WeakPolarHBondContact O-CB 3.29Å; T562-F566 PolarHBondContact O-N 3.32Å; T562-F566 VanDerWaalsContact O-N 3.1Å; L563-F566 WeakPolarHBondContact O-CB 3.42Å; L563-F566 PolarHBondContact O-N 3.12Å; F566-Q569 PolarHBondContact O-N 3.28Å; F566-R570 PolarHBondContact O-N 2.96Å; F566-R570 VanDerWaalsContact O-N 3.13Å
567	L	91.8	Very high	90.4	Very high	1 Å²	1	40 Å²	40	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-65.8	-38	176.6	-67.1	176.1	0	0	0	111.9	M509 L563 R570 Q571 Q572 V575 T681 V683 I722	M509-L567 HydrophobicContact CE-CD2 4.42Å; L563-L567 HydrophobicContact CD1-CD1 3.9Å; L563-L567 HydrophobicContact CD1-CD2 4.41Å; L563-L567 HydrophobicContact CD1-CG 3.91Å; L563-L567 HydrophobicContact CD2-CD1 4.45Å; L563-L567 HydrophobicContact CG-CD1 3.86Å; L563-L567 HydrophobicContact CG-CG 4.26Å; L563-L567 WeakPolarHBondContact O-CG 3.34Å; L563-L567 PolarHBondContact O-N 3.47Å; L567-R570 CarbonylContact O-C 3.58Å; L567-R570 PolarHBondContact O-N 2.8Å; L567-Q571 PolarHBondContact O-N 2.98Å; L567-Q571 VanDerWaalsContact O-N 3.14Å; L567-Q572 HydrophobicContact CB-CB 4.29Å; L567-Q572 HydrophobicContact CD2-CB 3.87Å; L567-Q572 PolarHBondContact O-N 3.11Å; L567-V575 HydrophobicContact CD1-CG1 4.27Å; L567-V575 HydrophobicContact CD1-CG2 3.89Å; L567-T681 HydrophobicContact CD1-CG2 4.25Å; L567-T681 HydrophobicContact CD2-CG2 4.42Å; L567-V683 HydrophobicContact CD1-CG2 4.5Å; L567-I722 HydrophobicContact CD1-CD1 4.18Å; L567-I722 HydrophobicContact CD2-CD1 3.85Å
568	S	89.9	Confident	90.9	Very high	48 Å²	48	34.9 Å²	34.9	34%	0.336	18%	0.175	S	C	.	.	H	α-helix	trans	-63.8	-46.6	175.2	-172.4	0	0	0	0	111.8	L564 H565 R570 Q571	L564-S568 VanDerWaalsContact O-CB 3.23Å; L564-S568 WeakPolarHBondContact O-CB 3.37Å; L564-S568 PolarHBondContact O-N 2.95Å; H565-S568 PolarHBondContact O-N 2.99Å; S568-R570 PolarHBondContact O-N 3.1Å; S568-Q571 PolarHBondContact O-N 3.28Å
569	Q	88.6	Confident	91.3	Very high	120 Å²	120	33.2 Å²	33.2	56%	0.561	16%	0.162	S	C	*	.	H	α-helix	trans	-58	-33.5	173.9	-73.6	-175.8	6.3	0	0	113	H565 F566 Q571	H565-Q569 PolarHBondContact CD2-NE2 2.91Å; H565-Q569 VanDerWaalsContact CD2-NE2 3.31Å; H565-Q569 PolarHBondContact NE2-NE2 3.26Å; H565-Q569 WeakPolarHBondContact O-CG 3.45Å; H565-Q569 PolarHBondContact O-N 2.57Å; F566-Q569 PolarHBondContact O-N 3.28Å; Q569-Q571 VanDerWaalsContact C-N 3.33Å
570	R	89.2	Confident	91.4	Very high	133 Å²	133	34.7 Å²	34.7	50%	0.502	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	4.2	176.8	-73.4	-176	152.9	-165.9	-6.2	114.4	F566 L567 S568 Q572	F566-R570 PolarHBondContact O-N 2.96Å; F566-R570 VanDerWaalsContact O-N 3.13Å; L567-R570 CarbonylContact O-C 3.58Å; L567-R570 PolarHBondContact O-N 2.8Å; S568-R570 PolarHBondContact O-N 3.1Å; R570-Q572 HydrophobicContact CB-CB 4.49Å; R570-Q572 HydrophobicContact CB-CG 3.97Å; R570-Q572 VanDerWaalsContact CD-OE1 3.28Å; R570-Q572 PolarHBondContact O-N 3.12Å; R570-Q572 VanDerWaalsContact O-N 3.13Å
571	Q	88.6	Confident	91.3	Very high	143 Å²	143	37 Å²	37	67%	0.668	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.7	22.3	-173.8	-56.1	179.5	-10.6	0	0	113.8	L567 S568 Q569 T573 R680	L567-Q571 PolarHBondContact O-N 2.98Å; L567-Q571 VanDerWaalsContact O-N 3.14Å; S568-Q571 PolarHBondContact O-N 3.28Å; Q569-Q571 VanDerWaalsContact C-N 3.33Å; Q571-T573 PolarHBondContact O-N 2.72Å; Q571-T573 VanDerWaalsContact O-N 3.1Å; Q571-R680 PolarHBondContact O-NH1 3.45Å
572	Q	90.3	Very high	91.4	Very high	21 Å²	21	38.2 Å²	38.2	10%	0.098	18%	0.184	C	C	.	.			trans	-79	16.1	-176.8	-76.6	-177.5	-72.2	0	0	113.5	L567 R570 T681 T720	L567-Q572 HydrophobicContact CB-CB 4.29Å; L567-Q572 HydrophobicContact CD2-CB 3.87Å; L567-Q572 PolarHBondContact O-N 3.11Å; R570-Q572 HydrophobicContact CB-CB 4.49Å; R570-Q572 HydrophobicContact CB-CG 3.97Å; R570-Q572 VanDerWaalsContact CD-OE1 3.28Å; R570-Q572 PolarHBondContact O-N 3.12Å; R570-Q572 VanDerWaalsContact O-N 3.13Å; Q572-T681 WeakPolarHBondContact O-CB 3.3Å; Q572-T681 PolarHBondContact O-OG1 3.49Å; Q572-T720 PolarHBondContact NE2-OG1 3.33Å
573	T	89.6	Confident	91.4	Very high	35 Å²	35	41.3 Å²	41.3	22%	0.215	20%	0.203	C	C	.	.			trans	-84.2	155.7	170.8	51.2	0	0	0	0	110.8	Q571 V575 K663	Q571-T573 PolarHBondContact O-N 2.72Å; Q571-T573 VanDerWaalsContact O-N 3.1Å; T573-V575 HydrophobicContact CG2-CG2 4.12Å; T573-K663 HydrophobicContact CG2-CB 4.38Å
574	P	93.8	Very high	91.3	Very high	12 Å²	12	44.8 Å²	44.8	8%	0.078	22%	0.216	C	C	.	.	S	Bend	cis	-74.2	151.2	-1.3	32.1	-35.8	0	0	0	113.2	F657 K663 R680 T681	P574-F657 HydrophobicContact CB-CE2 3.98Å; P574-F657 HydrophobicContact CB-CZ 4.26Å; P574-F657 HydrophobicContact CG-CZ 4.42Å; P574-K663 CarbonylContact C-O 3.57Å; P574-K663 VanDerWaalsContact CA-O 3.3Å; P574-K663 WeakPolarHBondContact CA-O 3.48Å; P574-R680 PolarHBondContact O-N 2.84Å; P574-T681 PolarHBondContact O-N 3.26Å
575	V	95.1	Very high	91.4	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	133.1	-177.6	-173	0	0	0	0	110.2	L567 T573 K663 V664 L665 T681 V683	L567-V575 HydrophobicContact CD1-CG1 4.27Å; L567-V575 HydrophobicContact CD1-CG2 3.89Å; T573-V575 HydrophobicContact CG2-CG2 4.12Å; V575-K663 PolarHBondContact N-O 2.97Å; V575-V664 HydrophobicContact CB-CG2 4.48Å; V575-V664 WeakPolarHBondContact O-CA 3.41Å; V575-L665 PolarHBondContact O-N 2.88Å; V575-T681 WeakPolarHBondContact CA-O 3.29Å; V575-T681 HydrophobicContact CG1-CG2 4.43Å; V575-V683 HydrophobicContact CG1-CG2 3.55Å
576	V	95.6	Very high	91.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	121.3	168.7	175.3	0	0	0	0	109.3	F578 F657 L665 A667 F671 A679 T681 V682 V683	V576-F578 HydrophobicContact CG1-CD1 4.45Å; V576-F578 HydrophobicContact CG1-CD2 4.34Å; V576-F578 HydrophobicContact CG1-CE1 3.95Å; V576-F578 HydrophobicContact CG1-CE2 3.84Å; V576-F578 HydrophobicContact CG1-CZ 3.6Å; V576-F657 HydrophobicContact CG2-CE1 4.31Å; V576-F657 HydrophobicContact CG2-CE2 3.84Å; V576-F657 HydrophobicContact CG2-CZ 3.45Å; V576-F657 VanDerWaalsContact CG2-CZ 3.45Å; V576-L665 CarbonylContact C-O 3.52Å; V576-L665 WeakPolarHBondContact CA-O 3.43Å; V576-L665 HydrophobicContact CG2-CB 4.35Å; V576-L665 HydrophobicContact CG2-CD2 4.34Å; V576-A667 HydrophobicContact CG1-CB 4.25Å; V576-F671 HydrophobicContact CG1-CD1 4.08Å; V576-F671 HydrophobicContact CG1-CE1 4.15Å; V576-F671 HydrophobicContact CG2-CE1 4.01Å; V576-A679 HydrophobicContact CB-CB 4.25Å; V576-A679 HydrophobicContact CG2-CB 3.61Å; V576-T681 PolarHBondContact N-O 2.96Å; V576-V682 CarbonylContact O-C 3.53Å; V576-V682 WeakPolarHBondContact O-CA 3.24Å; V576-V683 PolarHBondContact O-N 3.12Å
577	A	95.5	Very high	91.6	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	100	-178	0	0	0	0	0	110.7	W560 T579 L665 F666 A667 V683	W560-A577 HydrophobicContact CH2-CB 3.48Å; W560-A577 VanDerWaalsContact CH2-CB 3.48Å; W560-A577 HydrophobicContact CZ2-CB 4.27Å; W560-A577 HydrophobicContact CZ3-CB 3.97Å; A577-T579 PolarHBondContact O-N 3.13Å; A577-L665 PolarHBondContact N-O 3.17Å; A577-F666 HydrophobicContact CB-CD1 3.56Å; A577-F666 HydrophobicContact CB-CE1 3.69Å; A577-F666 HydrophobicContact CB-CG 4.34Å; A577-A667 PolarHBondContact O-N 2.97Å; A577-V683 CarbonylContact C-O 3.48Å; A577-V683 WeakPolarHBondContact CA-O 3.37Å
578	F	95.8	Very high	91.5	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	118.7	177.3	-70.8	-63.5	0	0	0	111.6	V576 A667 F671 A672 V682 V683 F684 D685 M706	V576-F578 HydrophobicContact CG1-CD1 4.45Å; V576-F578 HydrophobicContact CG1-CD2 4.34Å; V576-F578 HydrophobicContact CG1-CE1 3.95Å; V576-F578 HydrophobicContact CG1-CE2 3.84Å; V576-F578 HydrophobicContact CG1-CZ 3.6Å; F578-A667 VanDerWaalsContact CA-O 3.31Å; F578-A667 WeakPolarHBondContact CA-O 3.3Å; F578-A667 HydrophobicContact CD1-CB 4.32Å; F578-A667 HydrophobicContact CE1-CB 4.25Å; F578-F671 HydrophobicContact CE1-CB 4.44Å; F578-F671 HydrophobicContact CE1-CD1 4.28Å; F578-F671 HydrophobicContact CZ-CD1 4.35Å; F578-A672 HydrophobicContact CE1-CB 3.81Å; F578-A672 HydrophobicContact CZ-CB 3.66Å; F578-V682 HydrophobicContact CD2-CG1 3.59Å; F578-V682 HydrophobicContact CE2-CG1 3.64Å; F578-V682 HydrophobicContact CE2-CG2 4.35Å; F578-V683 PolarHBondContact N-O 3.05Å; F578-F684 HydrophobicContact CB-CD1 4.23Å; F578-F684 HydrophobicContact CB-CE1 4.48Å; F578-F684 HydrophobicContact CD2-CE1 4.31Å; F578-F684 HydrophobicContact CD2-CZ 4.5Å; F578-D685 WeakPolarHBondContact O-CB 3.3Å; F578-D685 PolarHBondContact O-N 3.47Å; F578-M706 HydrophobicContact CB-SD 4.24Å; F578-M706 HydrophobicContact CD1-CG 4.37Å; F578-M706 HydrophobicContact CD1-SD 4.12Å; F578-M706 HydrophobicContact CD2-CB 3.91Å; F578-M706 HydrophobicContact CD2-CG 4.16Å; F578-M706 HydrophobicContact CD2-SD 4.24Å; F578-M706 HydrophobicContact CE1-CG 4.32Å; F578-M706 HydrophobicContact CE2-CB 3.8Å; F578-M706 HydrophobicContact CE2-CG 4.11Å; F578-M706 HydrophobicContact CG-CG 4.31Å; F578-M706 HydrophobicContact CG-SD 3.93Å; F578-M706 HydrophobicContact CZ-CB 4.32Å; F578-M706 HydrophobicContact CZ-CG 4.21Å
579	T	92.8	Very high	91.6	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.006	21%	0.211	C	C	.	.			trans	-129.9	124.6	178.5	-53.1	0	0	0	0	109.2	A577 S581 R584 A667 T668 D685	A577-T579 PolarHBondContact O-N 3.13Å; T579-S581 PolarHBondContact O-N 2.86Å; T579-S581 VanDerWaalsContact O-N 3.14Å; T579-R584 HydrophobicContact CG2-CB 3.77Å; T579-R584 HydrophobicContact CG2-CG 3.89Å; T579-A667 PolarHBondContact N-O 3.34Å; T579-T668 WeakPolarHBondContact O-CG2 3.32Å; T579-D685 HydrophobicContact CG2-CB 4.19Å
580	F	90.9	Very high	91.6	Very high	45 Å²	45	45.4 Å²	45.4	20%	0.197	21%	0.209	C	C	.	.	S	Bend	trans	-84.1	22.3	-172.7	-55.6	-65.8	0	0	0	115	E669 F684 S686 R688 K689 L698 M706	F580-E669 HydrophobicContact CE1-CB 4.36Å; F580-F684 HydrophobicContact CZ-CD1 4.4Å; F580-S686 WeakPolarHBondContact CE2-O 3.43Å; F580-R688 WeakPolarHBondContact CD2-O 3.42Å; F580-K689 HydrophobicContact CB-CB 3.78Å; F580-K689 HydrophobicContact CD1-CB 3.99Å; F580-K689 HydrophobicContact CD1-CD 4.45Å; F580-K689 HydrophobicContact CD2-CB 4.06Å; F580-K689 HydrophobicContact CG-CB 3.65Å; F580-L698 HydrophobicContact CE1-CD2 3.98Å; F580-L698 HydrophobicContact CE2-CD1 3.93Å; F580-L698 HydrophobicContact CE2-CD2 4.11Å; F580-L698 HydrophobicContact CE2-CG 4.33Å; F580-L698 HydrophobicContact CZ-CD1 3.66Å; F580-L698 HydrophobicContact CZ-CD2 3.67Å; F580-L698 HydrophobicContact CZ-CG 4.17Å; F580-M706 HydrophobicContact CE1-CE 3.92Å; F580-M706 HydrophobicContact CE1-SD 3.74Å; F580-M706 HydrophobicContact CZ-CE 3.9Å; F580-M706 HydrophobicContact CZ-SD 3.88Å
581	S	89.8	Confident	91.5	Very high	48 Å²	48	40.2 Å²	40.2	34%	0.336	19%	0.193	S	C	.	.			trans	-141.3	135.6	172.2	173.2	0	0	0	0	110.1	T579 T583 R584 C585	T579-S581 PolarHBondContact O-N 2.86Å; T579-S581 VanDerWaalsContact O-N 3.14Å; S581-T583 PolarHBondContact OG-OG1 3.18Å; S581-T583 VanDerWaalsContact OG-OG1 3.1Å; S581-R584 PolarHBondContact O-N 3.33Å; S581-C585 PolarHBondContact O-N 3Å; S581-C585 VanDerWaalsContact O-N 3.12Å; S581-C585 PolarHBondContact O-SG 3.26Å
582	R	90.6	Very high	91.5	Very high	75 Å²	75	33.5 Å²	33.5	28%	0.283	16%	0.162	S	C	.	.	H	α-helix	trans	-62.4	-51.9	178.9	-57.2	-178.3	-167.6	147	4.1	110.8	R584 C585 D586 H642 S643	R582-R584 VanDerWaalsContact C-N 3.28Å; R582-R584 PolarHBondContact O-N 2.78Å; R582-C585 VanDerWaalsContact O-CB 3.31Å; R582-C585 WeakPolarHBondContact O-CB 3.26Å; R582-C585 PolarHBondContact O-N 3.16Å; R582-D586 PolarHBondContact O-N 3.04Å; R582-H642 HydrophobicContact CG-CB 4.14Å; R582-S643 PolarHBondContact NE-OG 2.9Å; R582-S643 PolarHBondContact NH2-OG 3.15Å
583	T	89.6	Confident	91	Very high	79 Å²	79	36.7 Å²	36.7	49%	0.485	18%	0.18	S	C	.	.	H	α-helix	trans	-59.1	-39.8	179	55.6	0	0	0	0	111.9	S581 C585 D586 E587	S581-T583 PolarHBondContact OG-OG1 3.18Å; S581-T583 VanDerWaalsContact OG-OG1 3.1Å; T583-C585 VanDerWaalsContact C-N 3.33Å; T583-C585 PolarHBondContact O-N 3.01Å; T583-D586 WeakPolarHBondContact O-CB 3.33Å; T583-D586 PolarHBondContact O-N 3.35Å; T583-E587 VanDerWaalsContact O-CG 3.32Å; T583-E587 WeakPolarHBondContact O-CG 3.46Å; T583-E587 PolarHBondContact O-N 3.22Å
584	R	90.3	Very high	90.7	Very high	74 Å²	74	39.1 Å²	39.1	28%	0.279	20%	0.198	S	C	.	.	H	α-helix	trans	-69.1	-28.5	177.7	-159.9	-179.6	-165.9	172.3	9.8	112.9	D556 T579 S581 R582 N588 D685 K726	D556-R584 IonicContact OD2-CZ 3.73Å; D556-R584 IonicContact OD2-NE 2.94Å; D556-R584 IonicContact OD2-NH2 2.73Å; D556-R584 PolarHBondContact OD2-NH2 3.28Å; T579-R584 HydrophobicContact CG2-CB 3.77Å; T579-R584 HydrophobicContact CG2-CG 3.89Å; S581-R584 PolarHBondContact O-N 3.33Å; R582-R584 VanDerWaalsContact C-N 3.28Å; R582-R584 PolarHBondContact O-N 2.78Å; R584-N588 WeakPolarHBondContact O-CB 3.28Å; R584-N588 PolarHBondContact O-N 3.48Å; R584-N588 PolarHBondContact O-ND2 2.77Å; R584-D685 IonicContact CZ-OD2 3.29Å; R584-D685 IonicContact NE-OD2 3.03Å; R584-D685 PolarHBondContact NE-OD2 3.43Å; R584-D685 IonicContact NH1-OD2 3.87Å; R584-D685 PolarHBondContact NH1-OD2 3.04Å; R584-D685 IonicContact NH2-OD2 2.94Å; R584-K726 VanDerWaalsContact NH2-NZ 3.19Å
585	C	92.7	Very high	90.3	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-63.4	-47.9	170.3	-63	0	0	0	0	110.9	S581 R582 T583 N588 A589 V640 F666	S581-C585 PolarHBondContact O-N 3Å; S581-C585 VanDerWaalsContact O-N 3.12Å; S581-C585 PolarHBondContact O-SG 3.26Å; R582-C585 VanDerWaalsContact O-CB 3.31Å; R582-C585 WeakPolarHBondContact O-CB 3.26Å; R582-C585 PolarHBondContact O-N 3.16Å; T583-C585 VanDerWaalsContact C-N 3.33Å; T583-C585 PolarHBondContact O-N 3.01Å; C585-N588 PolarHBondContact O-N 3.21Å; C585-A589 WeakPolarHBondContact O-CB 3.07Å; C585-A589 PolarHBondContact O-N 3.17Å; C585-V640 HydrophobicContact CB-CG1 3.81Å; C585-F666 HydrophobicContact CB-CB 4.27Å
586	D	91.7	Very high	90.1	Very high	25 Å²	25	43.4 Å²	43.4	13%	0.134	22%	0.22	C	C	.	.	H	α-helix	trans	-62	-45.5	177.8	-69.5	-47.7	0	0	0	111.7	R582 T583 A589 R590 H642 Q1192	R582-D586 PolarHBondContact O-N 3.04Å; T583-D586 WeakPolarHBondContact O-CB 3.33Å; T583-D586 PolarHBondContact O-N 3.35Å; D586-A589 PolarHBondContact O-N 3.01Å; D586-R590 WeakPolarHBondContact O-CB 3.4Å; D586-R590 VanDerWaalsContact O-CG 3.23Å; D586-R590 WeakPolarHBondContact O-CG 3.33Å; D586-R590 PolarHBondContact O-N 3.13Å; D586-H642 IonicContact OD1-NE2 3.27Å; D586-H642 IonicContact OD2-CE1 2.97Å; D586-H642 IonicContact OD2-NE2 3.81Å; D586-Q1192 PolarHBondContact OD2-NE2 2.85Å
587	E	90.7	Very high	89.8	Confident	119 Å²	119	44.8 Å²	44.8	56%	0.556	23%	0.227	S	C	*	.	H	α-helix	trans	-62.1	-48.2	176.5	-72.9	167.2	-171.9	0	0	112.4	T583 A589 R590 S591	T583-E587 VanDerWaalsContact O-CG 3.32Å; T583-E587 WeakPolarHBondContact O-CG 3.46Å; T583-E587 PolarHBondContact O-N 3.22Å; E587-A589 VanDerWaalsContact C-N 3.32Å; E587-A589 PolarHBondContact O-N 3.23Å; E587-R590 PolarHBondContact O-N 2.96Å; E587-S591 WeakPolarHBondContact O-CB 3.42Å; E587-S591 PolarHBondContact O-N 2.87Å
588	N	90.9	Very high	89.7	Confident	7 Å²	7	45.4 Å²	45.4	4%	0.037	23%	0.231	C	C	.	.	H	α-helix	trans	-57.7	-46.2	177.8	-80	-20.5	0	0	0	110.4	W560 R584 C585 S591 F666 D685	W560-N588 PolarHBondContact NE1-ND2 2.96Å; W560-N588 PolarHBondContact NE1-OD1 2.83Å; R584-N588 WeakPolarHBondContact O-CB 3.28Å; R584-N588 PolarHBondContact O-N 3.48Å; R584-N588 PolarHBondContact O-ND2 2.77Å; C585-N588 PolarHBondContact O-N 3.21Å; N588-S591 PolarHBondContact O-N 2.78Å; N588-S591 PolarHBondContact O-OG 3.17Å; N588-F666 HydrophobicContact CB-CD1 3.83Å; N588-F666 HydrophobicContact CB-CE1 3.73Å; N588-F666 HydrophobicContact CB-CG 4.38Å; N588-F666 HydrophobicContact CB-CZ 4.2Å; N588-D685 PolarHBondContact ND2-OD1 2.93Å
589	A	91.1	Very high	89.6	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-65.9	-44.9	178.4	0	0	0	0	0	113	C585 D586 E587 S591 L592 L633 I638 V640 F666	C585-A589 WeakPolarHBondContact O-CB 3.07Å; C585-A589 PolarHBondContact O-N 3.17Å; D586-A589 PolarHBondContact O-N 3.01Å; E587-A589 VanDerWaalsContact C-N 3.32Å; E587-A589 PolarHBondContact O-N 3.23Å; A589-S591 VanDerWaalsContact C-N 3.28Å; A589-S591 PolarHBondContact O-N 3.45Å; A589-L592 PolarHBondContact O-N 3.32Å; A589-L633 HydrophobicContact CB-CD1 4.32Å; A589-I638 HydrophobicContact CB-CG2 4.35Å; A589-V640 HydrophobicContact CB-CG2 3.33Å; A589-F666 HydrophobicContact CB-CD2 4Å; A589-F666 HydrophobicContact CB-CE2 4.46Å
590	R	89.2	Confident	89.6	Confident	136 Å²	136	53.8 Å²	53.8	51%	0.513	29%	0.287	S	S	.	.	H	α-helix	trans	-61.5	-35.2	175.4	-70.8	171.4	-169.2	-172.3	4.8	112.1	D586 E587 L592 D593	D586-R590 WeakPolarHBondContact O-CB 3.4Å; D586-R590 VanDerWaalsContact O-CG 3.23Å; D586-R590 WeakPolarHBondContact O-CG 3.33Å; D586-R590 PolarHBondContact O-N 3.13Å; E587-R590 PolarHBondContact O-N 2.96Å; R590-L592 PolarHBondContact O-N 2.87Å; R590-L592 VanDerWaalsContact O-N 3.08Å; R590-D593 PolarHBondContact O-N 3.48Å
591	S	87.6	Confident	89.8	Confident	25 Å²	25	58.3 Å²	58.3	18%	0.175	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-18	178.8	84	0	0	0	0	114.1	R557 E587 N588 A589	R557-S591 WeakPolarHBondContact CD-O 3.45Å; R557-S591 PolarHBondContact NE-O 3.33Å; E587-S591 WeakPolarHBondContact O-CB 3.42Å; E587-S591 PolarHBondContact O-N 2.87Å; N588-S591 PolarHBondContact O-N 2.78Å; N588-S591 PolarHBondContact O-OG 3.17Å; A589-S591 VanDerWaalsContact C-N 3.28Å; A589-S591 PolarHBondContact O-N 3.45Å
592	L	87.2	Confident	90	Very high	1 Å²	1	57.8 Å²	57.8	1%	0.005	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	17	-175.9	-64.6	171.5	0	0	0	113.8	W560 L561 L564 A589 R590 S594 M595 I638 F666	W560-L592 HydrophobicContact CB-CD2 4.13Å; L561-L592 HydrophobicContact CD2-CD2 3.51Å; L561-L592 HydrophobicContact CG-CD2 3.76Å; L564-L592 HydrophobicContact CD1-CD1 3.48Å; L564-L592 VanDerWaalsContact CD1-CD1 3.48Å; L564-L592 HydrophobicContact CD1-CD2 4.12Å; L564-L592 HydrophobicContact CD1-CG 4.46Å; A589-L592 PolarHBondContact O-N 3.32Å; R590-L592 PolarHBondContact O-N 2.87Å; R590-L592 VanDerWaalsContact O-N 3.08Å; L592-S594 PolarHBondContact O-N 3.22Å; L592-M595 WeakPolarHBondContact O-CB 3.19Å; L592-M595 PolarHBondContact O-N 3.02Å; L592-I638 HydrophobicContact CB-CD1 3.93Å; L592-I638 HydrophobicContact CD1-CD1 4.45Å; L592-F666 HydrophobicContact CD1-CE2 3.58Å; L592-F666 HydrophobicContact CD1-CZ 3.58Å
593	D	79.9	Confident	90.3	Very high	88 Å²	88	57 Å²	57	47%	0.471	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50	-30.6	-177.8	-99	-36.3	0	0	0	114.8	R590 M595 R636	R590-D593 PolarHBondContact O-N 3.48Å; D593-M595 VanDerWaalsContact C-N 3.28Å; D593-M595 PolarHBondContact O-N 3.04Å; D593-R636 VanDerWaalsContact CA-NH1 3.32Å; D593-R636 PolarHBondContact O-NH1 3.5Å; D593-R636 IonicContact OD1-CZ 2.73Å; D593-R636 VanDerWaalsContact OD1-CZ 3.27Å; D593-R636 IonicContact OD1-NH1 2.64Å; D593-R636 PolarHBondContact OD1-NH1 2.84Å; D593-R636 IonicContact OD1-NH2 3.93Å; D593-R636 PolarHBondContact OD1-NH2 3.43Å
594	S	83.4	Confident	90.5	Very high	87 Å²	87	56.2 Å²	56.2	61%	0.608	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-1.3	179.1	54.6	0	0	0	0	115.1	L592	L592-S594 PolarHBondContact O-N 3.22Å
595	M	85.3	Confident	90.8	Very high	20 Å²	20	56.6 Å²	56.6	10%	0.099	31%	0.308	C	S	.	.			trans	-108.7	138.3	-176.1	-160.6	178.5	-161.7	0	0	111.6	L561 L564 H565 L592 D593 L597 R636	L561-M595 HydrophobicContact CD2-CB 4.4Å; L564-M595 HydrophobicContact CB-CE 3.77Å; L564-M595 HydrophobicContact CB-SD 3.75Å; L564-M595 HydrophobicContact CD1-SD 4.22Å; H565-M595 HydrophobicContact CB-CE 4.46Å; L592-M595 WeakPolarHBondContact O-CB 3.19Å; L592-M595 PolarHBondContact O-N 3.02Å; D593-M595 VanDerWaalsContact C-N 3.28Å; D593-M595 PolarHBondContact O-N 3.04Å; M595-L597 HydrophobicContact CE-CD1 4.5Å; M595-L597 HydrophobicContact CE-CD2 3.68Å; M595-L597 HydrophobicContact CE-CG 4.29Å; M595-L597 HydrophobicContact CG-CG 4.36Å; M595-L597 HydrophobicContact SD-CD1 4.34Å; M595-L597 HydrophobicContact SD-CD2 4.4Å; M595-L597 HydrophobicContact SD-CG 4.38Å; M595-R636 WeakPolarHBondContact O-CD 3.16Å
596	D	91.4	Very high	90.9	Very high	81 Å²	81	56.7 Å²	56.7	43%	0.433	31%	0.309	S	S	.	.			trans	-136.5	125	176.1	-175.6	-0.1	0	0	0	108.8	T598 K603 R636	D596-T598 PolarHBondContact OD1-N 2.85Å; D596-T598 VanDerWaalsContact OD1-N 3.15Å; D596-T598 PolarHBondContact OD1-OG1 2.94Å; D596-K603 WeakPolarHBondContact OD1-CE 3.44Å; D596-K603 IonicContact OD1-NZ 3.73Å; D596-K603 PolarHBondContact OD1-NZ 2.8Å; D596-K603 WeakPolarHBondContact OD2-CE 3.49Å; D596-K603 IonicContact OD2-NZ 2.73Å; D596-K603 PolarHBondContact OD2-NZ 2.96Å; D596-R636 HydrophobicContact CB-CG 4.45Å
597	L	90	Very high	91	Very high	30 Å²	30	59.1 Å²	59.1	16%	0.157	32%	0.32	C	S	.	.			trans	-116.3	10.3	-173.6	-67.4	172.6	0	0	0	112.6	M595 R636 K663 V664	M595-L597 HydrophobicContact CE-CD1 4.5Å; M595-L597 HydrophobicContact CE-CD2 3.68Å; M595-L597 HydrophobicContact CE-CG 4.29Å; M595-L597 HydrophobicContact CG-CG 4.36Å; M595-L597 HydrophobicContact SD-CD1 4.34Å; M595-L597 HydrophobicContact SD-CD2 4.4Å; M595-L597 HydrophobicContact SD-CG 4.38Å; L597-R636 PolarHBondContact N-O 2.97Å; L597-K663 HydrophobicContact CB-CB 4.01Å; L597-K663 HydrophobicContact CB-CG 3.91Å; L597-K663 HydrophobicContact CD1-CB 3.99Å; L597-V664 HydrophobicContact CD1-CB 4.45Å; L597-V664 HydrophobicContact CD1-CG2 3.49Å; L597-V664 VanDerWaalsContact CD1-CG2 3.49Å
598	T	92.3	Very high	91.2	Very high	12 Å²	12	57.3 Å²	57.3	7%	0.074	32%	0.32	C	S	.	.			trans	-124.2	139	-171.9	47.9	0	0	0	0	113.4	D596 E602 K603 I606 K635 G637	D596-T598 PolarHBondContact OD1-N 2.85Å; D596-T598 VanDerWaalsContact OD1-N 3.15Å; D596-T598 PolarHBondContact OD1-OG1 2.94Å; T598-E602 HydrophobicContact CG2-CB 4.45Å; T598-K603 VanDerWaalsContact O-CE 3.26Å; T598-K603 WeakPolarHBondContact O-CE 3.48Å; T598-K603 PolarHBondContact O-NZ 3.48Å; T598-K603 WeakPolarHBondContact OG1-CE 3.38Å; T598-I606 HydrophobicContact CG2-CD1 4.12Å; T598-K635 PolarHBondContact OG1-O 3.31Å; T598-G637 VanDerWaalsContact CG2-CA 3.48Å
599	T	93.4	Very high	91.3	Very high	78 Å²	78	58.3 Å²	58.3	48%	0.479	32%	0.324	S	S	.	.			trans	-72.9	160.9	171.9	63.4	0	0	0	0	111.5	I601 E602 K603	T599-I601 PolarHBondContact O-N 2.87Å; T599-E602 WeakPolarHBondContact CB-OE2 3.49Å; T599-E602 WeakPolarHBondContact CG2-OE2 3.41Å; T599-E602 PolarHBondContact N-OE2 3.41Å; T599-E602 PolarHBondContact O-N 2.79Å; T599-E602 VanDerWaalsContact OG1-CG 3.28Å; T599-E602 WeakPolarHBondContact OG1-CG 3.41Å; T599-E602 PolarHBondContact OG1-N 3.21Å; T599-E602 PolarHBondContact OG1-OE2 3.07Å; T599-K603 WeakPolarHBondContact O-CG 3.4Å; T599-K603 PolarHBondContact O-N 2.87Å
600	S	94.1	Very high	91.3	Very high	100 Å²	100	58.6 Å²	58.6	70%	0.699	33%	0.325	S	S	*	.	H	α-helix	trans	-59.3	-28.2	177	-52.5	0	0	0	0	113.6	A604	S600-A604 PolarHBondContact O-N 2.95Å
601	I	94.9	Very high	91.4	Very high	140 Å²	140	58 Å²	58	72%	0.718	33%	0.328	S	S	*	.	H	α-helix	trans	-73.9	-50	177.3	-60.7	170.7	0	0	0	110.1	T599 K603 A604 E605	T599-I601 PolarHBondContact O-N 2.87Å; I601-K603 VanDerWaalsContact C-N 3.26Å; I601-K603 PolarHBondContact O-N 2.97Å; I601-A604 WeakPolarHBondContact O-CB 3.37Å; I601-A604 PolarHBondContact O-N 3.32Å; I601-E605 PolarHBondContact O-N 3.38Å
602	E	94.8	Very high	91.6	Very high	37 Å²	37	64.5 Å²	64.5	17%	0.173	35%	0.353	C	S	.	.	H	α-helix	trans	-58.2	-40.2	175.7	-68.6	166.3	127.2	0	0	111.1	T598 T599 A604 E605 I606 L661 K663	T598-E602 HydrophobicContact CG2-CB 4.45Å; T599-E602 WeakPolarHBondContact CB-OE2 3.49Å; T599-E602 WeakPolarHBondContact CG2-OE2 3.41Å; T599-E602 PolarHBondContact N-OE2 3.41Å; T599-E602 PolarHBondContact O-N 2.79Å; T599-E602 VanDerWaalsContact OG1-CG 3.28Å; T599-E602 WeakPolarHBondContact OG1-CG 3.41Å; T599-E602 PolarHBondContact OG1-N 3.21Å; T599-E602 PolarHBondContact OG1-OE2 3.07Å; E602-A604 VanDerWaalsContact C-N 3.33Å; E602-A604 PolarHBondContact O-N 3.32Å; E602-E605 PolarHBondContact O-N 2.75Å; E602-I606 WeakPolarHBondContact O-CB 3.2Å; E602-I606 WeakPolarHBondContact O-CD1 3.5Å; E602-I606 WeakPolarHBondContact O-CG1 3.17Å; E602-I606 PolarHBondContact O-N 2.88Å; E602-L661 HydrophobicContact CB-CD2 3.95Å; E602-L661 HydrophobicContact CG-CD2 3.85Å; E602-K663 VanDerWaalsContact OE1-CE 3.24Å; E602-K663 WeakPolarHBondContact OE1-CE 3.2Å; E602-K663 IonicContact OE1-NZ 3.01Å; E602-K663 PolarHBondContact OE1-NZ 3.21Å
603	K	95.2	Very high	91.7	Very high	58 Å²	58	64.8 Å²	64.8	25%	0.252	36%	0.355	S	S	.	.	H	α-helix	trans	-59.9	-39.8	174.1	-73.5	173.7	-174.5	165.5	0	113.1	D596 T598 T599 I601 H607 K635	D596-K603 WeakPolarHBondContact OD1-CE 3.44Å; D596-K603 IonicContact OD1-NZ 3.73Å; D596-K603 PolarHBondContact OD1-NZ 2.8Å; D596-K603 WeakPolarHBondContact OD2-CE 3.49Å; D596-K603 IonicContact OD2-NZ 2.73Å; D596-K603 PolarHBondContact OD2-NZ 2.96Å; T598-K603 VanDerWaalsContact O-CE 3.26Å; T598-K603 WeakPolarHBondContact O-CE 3.48Å; T598-K603 PolarHBondContact O-NZ 3.48Å; T598-K603 WeakPolarHBondContact OG1-CE 3.38Å; T599-K603 WeakPolarHBondContact O-CG 3.4Å; T599-K603 PolarHBondContact O-N 2.87Å; I601-K603 VanDerWaalsContact C-N 3.26Å; I601-K603 PolarHBondContact O-N 2.97Å; K603-H607 WeakPolarHBondContact O-CB 3.34Å; K603-H607 PolarHBondContact O-N 2.77Å; K603-K635 WeakPolarHBondContact CE-O 3.44Å; K603-K635 WeakPolarHBondContact CG-O 3.34Å
604	A	94.8	Very high	92.1	Very high	62 Å²	62	61.3 Å²	61.3	51%	0.512	34%	0.337	S	S	.	.	H	α-helix	trans	-68.7	-42.2	176.9	0	0	0	0	0	111.5	S600 I601 E602 H607 S608	S600-A604 PolarHBondContact O-N 2.95Å; I601-A604 WeakPolarHBondContact O-CB 3.37Å; I601-A604 PolarHBondContact O-N 3.32Å; E602-A604 VanDerWaalsContact C-N 3.33Å; E602-A604 PolarHBondContact O-N 3.32Å; A604-H607 PolarHBondContact O-N 3.49Å; A604-S608 WeakPolarHBondContact O-CB 3.3Å; A604-S608 PolarHBondContact O-N 3.28Å
605	E	95.2	Very high	92.3	Very high	82 Å²	82	60.5 Å²	60.5	38%	0.383	33%	0.331	S	S	.	.	H	α-helix	trans	-63.3	-50.7	175	-166.9	-167	157.2	0	0	111.4	I601 E602 H607 S608 F609 R659 L661	I601-E605 PolarHBondContact O-N 3.38Å; E602-E605 PolarHBondContact O-N 2.75Å; E605-H607 VanDerWaalsContact C-N 3.29Å; E605-H607 PolarHBondContact O-N 3.25Å; E605-S608 PolarHBondContact O-N 3.44Å; E605-F609 WeakPolarHBondContact O-CB 3.45Å; E605-F609 PolarHBondContact O-N 2.93Å; E605-R659 IonicContact OE1-NH1 3.26Å; E605-R659 PolarHBondContact OE1-NH1 2.86Å; E605-L661 HydrophobicContact CG-CD1 4.38Å
606	I	94.8	Very high	92.3	Very high	3 Å²	3	64.3 Å²	64.3	2%	0.015	34%	0.344	C	S	.	.	H	α-helix	trans	-54.8	-47.1	176.3	-69.3	164.9	0	0	0	109.9	T598 E602 F610 L634 L656 L661	T598-I606 HydrophobicContact CG2-CD1 4.12Å; E602-I606 WeakPolarHBondContact O-CB 3.2Å; E602-I606 WeakPolarHBondContact O-CD1 3.5Å; E602-I606 WeakPolarHBondContact O-CG1 3.17Å; E602-I606 PolarHBondContact O-N 2.88Å; I606-F610 WeakPolarHBondContact O-CB 3.47Å; I606-F610 PolarHBondContact O-N 3.45Å; I606-L634 WeakPolarHBondContact CD1-O 3.39Å; I606-L634 HydrophobicContact CG2-CB 3.93Å; I606-L656 HydrophobicContact CG1-CD2 4.3Å; I606-L656 HydrophobicContact CG2-CD1 4.23Å; I606-L661 HydrophobicContact CD1-CB 4.02Å; I606-L661 HydrophobicContact CG1-CB 3.91Å; I606-L661 HydrophobicContact CG1-CD1 4.04Å; I606-L661 HydrophobicContact CG1-CD2 4.33Å; I606-L661 HydrophobicContact CG1-CG 4.32Å
607	H	94.4	Very high	92	Very high	76 Å²	76	60.7 Å²	60.7	35%	0.352	33%	0.325	S	S	.	.	H	α-helix	trans	-64.1	-44.4	-179.7	-172.7	32.7	0	0	0	112.4	K603 A604 E605 Q611	K603-H607 WeakPolarHBondContact O-CB 3.34Å; K603-H607 PolarHBondContact O-N 2.77Å; A604-H607 PolarHBondContact O-N 3.49Å; E605-H607 VanDerWaalsContact C-N 3.29Å; E605-H607 PolarHBondContact O-N 3.25Å; H607-Q611 VanDerWaalsContact O-CB 3.29Å; H607-Q611 WeakPolarHBondContact O-CB 3.49Å; H607-Q611 PolarHBondContact O-N 2.94Å
608	S	94.5	Very high	91.6	Very high	80 Å²	80	67 Å²	67	56%	0.559	35%	0.346	S	S	*	.	H	α-helix	trans	-63	-47.5	177.3	-174.6	0	0	0	0	111.9	A604 E605 Q611 K612	A604-S608 WeakPolarHBondContact O-CB 3.3Å; A604-S608 PolarHBondContact O-N 3.28Å; E605-S608 PolarHBondContact O-N 3.44Å; S608-Q611 PolarHBondContact O-N 3.37Å; S608-K612 WeakPolarHBondContact O-CB 3.43Å; S608-K612 PolarHBondContact O-N 3.06Å
609	F	93.1	Very high	90.8	Very high	29 Å²	29	68.9 Å²	68.9	13%	0.127	37%	0.369	C	S	.	.	H	α-helix	trans	-63.4	-43.3	177.7	-177.7	-96	0	0	0	112.2	E605 K612 S613 V652 M655 L656	E605-F609 WeakPolarHBondContact O-CB 3.45Å; E605-F609 PolarHBondContact O-N 2.93Å; F609-K612 PolarHBondContact O-N 2.91Å; F609-S613 WeakPolarHBondContact O-CB 3.36Å; F609-S613 PolarHBondContact O-N 3.01Å; F609-S613 PolarHBondContact O-OG 2.86Å; F609-V652 HydrophobicContact CD1-CG1 4.42Å; F609-V652 HydrophobicContact CE1-CG1 4.19Å; F609-M655 HydrophobicContact CE1-CB 4.19Å; F609-M655 HydrophobicContact CZ-CB 3.9Å; F609-M655 HydrophobicContact CZ-SD 3.97Å; F609-L656 HydrophobicContact CB-CD2 4.34Å; F609-L656 HydrophobicContact CD1-CD1 4.29Å; F609-L656 HydrophobicContact CD1-CD2 3.54Å; F609-L656 HydrophobicContact CD1-CG 3.84Å; F609-L656 HydrophobicContact CE1-CD2 4.12Å; F609-L656 HydrophobicContact CE1-CG 4.05Å; F609-L656 HydrophobicContact CG-CD2 4.1Å
610	F	92.7	Very high	90.1	Very high	5 Å²	5	67.7 Å²	67.7	2%	0.022	37%	0.372	C	S	.	.	H	α-helix	trans	-63.1	-45.7	176.8	-167.8	-96.7	0	0	0	111	I606 K612 S613 L614 I627 R631 L634 L649 V652	I606-F610 WeakPolarHBondContact O-CB 3.47Å; I606-F610 PolarHBondContact O-N 3.45Å; F610-K612 PolarHBondContact O-N 3.48Å; F610-S613 PolarHBondContact O-N 3.41Å; F610-L614 HydrophobicContact CD1-CD1 3.67Å; F610-L614 HydrophobicContact CD1-CG 4.16Å; F610-L614 HydrophobicContact CE1-CD1 3.25Å; F610-L614 HydrophobicContact CE1-CG 4.03Å; F610-L614 HydrophobicContact CZ-CD1 3.92Å; F610-L614 HydrophobicContact CZ-CG 4.45Å; F610-L614 WeakPolarHBondContact O-CG 3.48Å; F610-L614 PolarHBondContact O-N 2.85Å; F610-I627 HydrophobicContact CE1-CG2 4.09Å; F610-I627 HydrophobicContact CZ-CG2 3.89Å; F610-R631 HydrophobicContact CD1-CB 4.2Å; F610-R631 HydrophobicContact CD1-CG 3.91Å; F610-R631 HydrophobicContact CE1-CB 3.48Å; F610-R631 VanDerWaalsContact CE1-CB 3.48Å; F610-R631 HydrophobicContact CE1-CG 3.66Å; F610-R631 HydrophobicContact CZ-CB 3.73Å; F610-R631 HydrophobicContact CZ-CG 4.36Å; F610-L634 HydrophobicContact CD2-CD1 3.66Å; F610-L634 HydrophobicContact CE2-CD1 3.62Å; F610-L649 HydrophobicContact CE2-CD2 3.93Å; F610-L649 HydrophobicContact CZ-CD2 4.08Å; F610-V652 HydrophobicContact CD2-CG1 3.83Å; F610-V652 HydrophobicContact CE2-CG1 4.33Å
611	Q	91	Very high	89.8	Confident	124 Å²	124	63.3 Å²	63.3	58%	0.579	34%	0.341	S	S	*	.	H	α-helix	trans	-64.2	-40.4	177	-173.6	174.5	-2.7	0	0	112.5	H607 S608 S613 L614 S615	H607-Q611 VanDerWaalsContact O-CB 3.29Å; H607-Q611 WeakPolarHBondContact O-CB 3.49Å; H607-Q611 PolarHBondContact O-N 2.94Å; S608-Q611 PolarHBondContact O-N 3.37Å; Q611-S613 VanDerWaalsContact C-N 3.3Å; Q611-S613 PolarHBondContact O-N 3.28Å; Q611-L614 PolarHBondContact O-N 3.38Å; Q611-S615 PolarHBondContact O-N 3.3Å
612	K	90.9	Very high	89.4	Confident	162 Å²	162	61.6 Å²	61.6	70%	0.704	33%	0.325	S	S	*	.	H	α-helix	trans	-64.6	-32.8	173.4	-177.2	177.1	178.3	179.3	0	112.6	S608 F609 F610 S615	S608-K612 WeakPolarHBondContact O-CB 3.43Å; S608-K612 PolarHBondContact O-N 3.06Å; F609-K612 PolarHBondContact O-N 2.91Å; F610-K612 PolarHBondContact O-N 3.48Å; K612-S615 PolarHBondContact O-OG 3.2Å
613	S	90.6	Very high	89	Confident	6 Å²	6	65.9 Å²	65.9	4%	0.042	35%	0.345	C	S	.	.	H	α-helix	trans	-73.3	-45.1	176.4	-56.5	0	0	0	0	111.1	F609 F610 Q611 S615	F609-S613 WeakPolarHBondContact O-CB 3.36Å; F609-S613 PolarHBondContact O-N 3.01Å; F609-S613 PolarHBondContact O-OG 2.86Å; F610-S613 PolarHBondContact O-N 3.41Å; Q611-S613 VanDerWaalsContact C-N 3.3Å; Q611-S613 PolarHBondContact O-N 3.28Å; S613-S615 VanDerWaalsContact C-N 3.31Å; S613-S615 PolarHBondContact O-N 3.1Å
614	L	88	Confident	88.8	Confident	16 Å²	16	63.2 Å²	63.2	8%	0.084	33%	0.334	C	S	.	.	H	α-helix	trans	-73.6	-14.6	178.7	-64.8	-172.5	0	0	0	114.6	F610 Q611 R616 L617 R622 I627	F610-L614 HydrophobicContact CD1-CD1 3.67Å; F610-L614 HydrophobicContact CD1-CG 4.16Å; F610-L614 HydrophobicContact CE1-CD1 3.25Å; F610-L614 HydrophobicContact CE1-CG 4.03Å; F610-L614 HydrophobicContact CZ-CD1 3.92Å; F610-L614 HydrophobicContact CZ-CG 4.45Å; F610-L614 WeakPolarHBondContact O-CG 3.48Å; F610-L614 PolarHBondContact O-N 2.85Å; Q611-L614 PolarHBondContact O-N 3.38Å; L614-R616 PolarHBondContact O-N 2.99Å; L614-R616 VanDerWaalsContact O-N 3.1Å; L614-L617 HydrophobicContact CD2-CD1 3.72Å; L614-L617 PolarHBondContact O-N 2.87Å; L614-R622 PolarHBondContact O-NE 3.17Å; L614-R622 VanDerWaalsContact O-NE 3.12Å; L614-I627 HydrophobicContact CD1-CG2 3.51Å; L614-I627 HydrophobicContact CD2-CD1 4.2Å; L614-I627 HydrophobicContact CD2-CG2 4.04Å; L614-I627 HydrophobicContact CG-CG2 4.44Å
615	S	87.3	Confident	88.6	Confident	70 Å²	70	64.9 Å²	64.9	49%	0.49	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-17.5	176.9	73.1	0	0	0	0	112.9	Q611 K612 S613 R622	Q611-S615 PolarHBondContact O-N 3.3Å; K612-S615 PolarHBondContact O-OG 3.2Å; S613-S615 VanDerWaalsContact C-N 3.31Å; S613-S615 PolarHBondContact O-N 3.1Å; S615-R622 PolarHBondContact O-NH2 3.36Å
616	R	83.9	Confident	88.4	Confident	100 Å²	100	61.8 Å²	61.8	38%	0.377	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-25.5	172.3	-59.1	-177.1	-179.3	-165.2	2.6	113.6	L614 T1240 A1241 S1242	L614-R616 PolarHBondContact O-N 2.99Å; L614-R616 VanDerWaalsContact O-N 3.1Å; R616-T1240 HydrophobicContact CB-CG2 4.45Å; R616-A1241 PolarHBondContact NH1-O 2.84Å; R616-S1242 PolarHBondContact NH1-O 2.68Å
617	L	85.6	Confident	88.2	Confident	4 Å²	4	61.7 Å²	61.7	2%	0.021	32%	0.324	C	S	.	.	S	Bend	trans	-84.9	155.5	-177.9	-58.9	-176.7	0	0	0	112.2	L614 D621 R622 I627 I648 I1237 T1240	L614-L617 HydrophobicContact CD2-CD1 3.72Å; L614-L617 PolarHBondContact O-N 2.87Å; L617-D621 HydrophobicContact CB-CB 4.25Å; L617-D621 HydrophobicContact CD1-CB 4.47Å; L617-R622 HydrophobicContact CB-CG 4.04Å; L617-R622 VanDerWaalsContact O-CZ 3.25Å; L617-R622 PolarHBondContact O-NE 2.94Å; L617-R622 PolarHBondContact O-NH2 3Å; L617-I627 HydrophobicContact CD1-CD1 3.8Å; L617-I648 HydrophobicContact CD1-CD1 4.4Å; L617-I648 HydrophobicContact CD2-CD1 4.03Å; L617-I648 HydrophobicContact CG-CD1 4.13Å; L617-I1237 HydrophobicContact CD1-CD1 3.87Å; L617-I1237 HydrophobicContact CD2-CD1 3.55Å; L617-I1237 HydrophobicContact CG-CD1 4.38Å; L617-T1240 HydrophobicContact CD2-CG2 3.84Å; L617-T1240 WeakPolarHBondContact CD2-OG1 3.43Å
618	R	82.1	Confident	88.1	Confident	162 Å²	162	60.4 Å²	60.4	61%	0.611	32%	0.319	S	S	*	.			trans	-71.7	160.6	172.3	-66.6	-164.4	178.2	159	-8.1	111.6	G620 D621 R622 D1236	R618-G620 PolarHBondContact O-N 2.78Å; R618-D621 PolarHBondContact O-N 3.03Å; R618-R622 WeakPolarHBondContact O-CG 3.17Å; R618-R622 PolarHBondContact O-N 3.18Å; R618-D1236 WeakPolarHBondContact CD-OD1 3.38Å; R618-D1236 IonicContact CZ-OD1 3.89Å; R618-D1236 IonicContact NE-OD1 3.35Å; R618-D1236 PolarHBondContact NE-OD1 3.37Å; R618-D1236 IonicContact NH1-OD1 3.79Å; R618-D1236 PolarHBondContact NH1-OD1 3.39Å; R618-D1236 IonicContact NH1-OD2 2.77Å; R618-D1236 PolarHBondContact NH1-OD2 3.21Å; R618-D1236 IonicContact NH2-OD1 3.07Å
619	G	74.6	Confident	88	Confident	53 Å²	53	59.2 Å²	59.2	55%	0.546	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-40.2	-170.5	0	0	0	0	0	114.9
620	G	80.5	Confident	88	Confident	52 Å²	52	58.1 Å²	58.1	54%	0.536	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-46.6	176.6	0	0	0	0	0	112.7	R618 R622 Q623	R618-G620 PolarHBondContact O-N 2.78Å; G620-R622 PolarHBondContact O-N 2.8Å; G620-Q623 PolarHBondContact O-N 3.41Å
621	D	86.1	Confident	88	Confident	9 Å²	9	61.4 Å²	61.4	5%	0.048	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-59.3	-34.2	-179.7	-57.6	-29.8	0	0	0	112.1	L617 R618 Q623 L624 I627 I1237	L617-D621 HydrophobicContact CB-CB 4.25Å; L617-D621 HydrophobicContact CD1-CB 4.47Å; R618-D621 PolarHBondContact O-N 3.03Å; D621-Q623 PolarHBondContact O-N 3.39Å; D621-Q623 VanDerWaalsContact O-N 3.16Å; D621-L624 HydrophobicContact CB-CD1 4.37Å; D621-L624 WeakPolarHBondContact O-CB 3.37Å; D621-L624 WeakPolarHBondContact O-CD1 3.49Å; D621-L624 WeakPolarHBondContact O-CG 3.46Å; D621-L624 PolarHBondContact O-N 2.98Å; D621-I627 VanDerWaalsContact O-CD1 3.27Å; D621-I627 WeakPolarHBondContact O-CD1 3.17Å; D621-I1237 HydrophobicContact CB-CB 4.47Å
622	R	87.5	Confident	88.1	Confident	103 Å²	103	58.1 Å²	58.1	39%	0.389	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-62.9	-19.6	177.6	-65.2	176.2	-164.1	-178.1	5.1	114.1	L614 S615 L617 R618 G620	L614-R622 PolarHBondContact O-NE 3.17Å; L614-R622 VanDerWaalsContact O-NE 3.12Å; S615-R622 PolarHBondContact O-NH2 3.36Å; L617-R622 HydrophobicContact CB-CG 4.04Å; L617-R622 VanDerWaalsContact O-CZ 3.25Å; L617-R622 PolarHBondContact O-NE 2.94Å; L617-R622 PolarHBondContact O-NH2 3Å; R618-R622 WeakPolarHBondContact O-CG 3.17Å; R618-R622 PolarHBondContact O-N 3.18Å; G620-R622 PolarHBondContact O-N 2.8Å
623	Q	87.2	Confident	88.3	Confident	128 Å²	128	50.6 Å²	50.6	60%	0.598	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-97.6	7.2	-179.5	-58.1	-65.1	-2.8	0	0	113.1	G620 D621 L628	G620-Q623 PolarHBondContact O-N 3.41Å; D621-Q623 PolarHBondContact O-N 3.39Å; D621-Q623 VanDerWaalsContact O-N 3.16Å; Q623-L628 WeakPolarHBondContact O-CD1 3.4Å
624	L	90.3	Very high	88.4	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.01	27%	0.266	C	S	.	.			trans	-56.7	134.9	176.9	-74.1	168.4	0	0	0	111.4	D621 Q626 I627 L628 L646 F1182 A1183	D621-L624 HydrophobicContact CB-CD1 4.37Å; D621-L624 WeakPolarHBondContact O-CB 3.37Å; D621-L624 WeakPolarHBondContact O-CD1 3.49Å; D621-L624 WeakPolarHBondContact O-CG 3.46Å; D621-L624 PolarHBondContact O-N 2.98Å; L624-Q626 VanDerWaalsContact C-N 3.26Å; L624-Q626 PolarHBondContact O-N 3.42Å; L624-Q626 VanDerWaalsContact O-N 3.17Å; L624-I627 HydrophobicContact CB-CB 4.42Å; L624-I627 HydrophobicContact CB-CD1 4.26Å; L624-I627 HydrophobicContact CB-CG1 4.08Å; L624-I627 HydrophobicContact CD1-CD1 4.3Å; L624-I627 WeakPolarHBondContact O-CB 3.33Å; L624-I627 PolarHBondContact O-N 2.86Å; L624-L628 PolarHBondContact O-N 2.79Å; L624-L628 VanDerWaalsContact O-N 3.09Å; L624-L646 HydrophobicContact CD1-CD1 4.05Å; L624-F1182 HydrophobicContact CD1-CD1 3.71Å; L624-F1182 HydrophobicContact CD1-CE1 4.28Å; L624-F1182 HydrophobicContact CD2-CD1 3.92Å; L624-A1183 HydrophobicContact CD2-CB 3.67Å
625	P	89.5	Confident	88.7	Confident	96 Å²	96	52.8 Å²	52.8	62%	0.623	28%	0.276	S	S	*	.	H	α-helix	trans	-53.6	-39.5	-178.1	-29.1	35.7	0	0	0	113.9	I627 L628 L629	P625-I627 VanDerWaalsContact C-N 3.35Å; P625-I627 PolarHBondContact O-N 3.14Å; P625-L628 PolarHBondContact O-N 3.29Å; P625-L629 WeakPolarHBondContact O-CB 3.27Å; P625-L629 PolarHBondContact O-N 3.29Å
626	Q	91.3	Very high	89	Confident	18 Å²	18	51.9 Å²	51.9	8%	0.084	26%	0.262	C	S	.	.	H	α-helix	trans	-62.3	-38.5	176.2	-167.5	-173.9	102.8	0	0	112.6	L624 M630 I645 L649 E1193	L624-Q626 VanDerWaalsContact C-N 3.26Å; L624-Q626 PolarHBondContact O-N 3.42Å; L624-Q626 VanDerWaalsContact O-N 3.17Å; Q626-M630 WeakPolarHBondContact O-CB 3.37Å; Q626-M630 PolarHBondContact O-N 3.06Å; Q626-I645 HydrophobicContact CG-CD1 4.39Å; Q626-L649 HydrophobicContact CG-CD1 4.11Å; Q626-E1193 WeakPolarHBondContact CB-OE1 3.33Å; Q626-E1193 PolarHBondContact NE2-OE1 3.01Å; Q626-E1193 PolarHBondContact NE2-OE2 3.43Å
627	I	92.2	Very high	89.4	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-69.1	-43.5	177.6	-62.6	-171.9	0	0	0	110.6	F610 L614 L617 D621 L624 P625 M630 R631 L646 L649	F610-I627 HydrophobicContact CE1-CG2 4.09Å; F610-I627 HydrophobicContact CZ-CG2 3.89Å; L614-I627 HydrophobicContact CD1-CG2 3.51Å; L614-I627 HydrophobicContact CD2-CD1 4.2Å; L614-I627 HydrophobicContact CD2-CG2 4.04Å; L614-I627 HydrophobicContact CG-CG2 4.44Å; L617-I627 HydrophobicContact CD1-CD1 3.8Å; D621-I627 VanDerWaalsContact O-CD1 3.27Å; D621-I627 WeakPolarHBondContact O-CD1 3.17Å; L624-I627 HydrophobicContact CB-CB 4.42Å; L624-I627 HydrophobicContact CB-CD1 4.26Å; L624-I627 HydrophobicContact CB-CG1 4.08Å; L624-I627 HydrophobicContact CD1-CD1 4.3Å; L624-I627 WeakPolarHBondContact O-CB 3.33Å; L624-I627 PolarHBondContact O-N 2.86Å; P625-I627 VanDerWaalsContact C-N 3.35Å; P625-I627 PolarHBondContact O-N 3.14Å; I627-M630 PolarHBondContact O-N 2.89Å; I627-R631 WeakPolarHBondContact O-CB 3.41Å; I627-R631 PolarHBondContact O-N 3.28Å; I627-L646 HydrophobicContact CD1-CD1 4.32Å; I627-L646 HydrophobicContact CG1-CD1 4.12Å; I627-L649 HydrophobicContact CG1-CD1 4Å; I627-L649 HydrophobicContact CG1-CD2 4.25Å; I627-L649 HydrophobicContact CG1-CG 4.31Å
628	L	91.6	Very high	89.9	Confident	48 Å²	48	47 Å²	47	25%	0.251	24%	0.244	S	C	.	.	H	α-helix	trans	-64.2	-45.8	178.4	-63.7	176.8	0	0	0	111.5	Q623 L624 P625 R631 D632	Q623-L628 WeakPolarHBondContact O-CD1 3.4Å; L624-L628 PolarHBondContact O-N 2.79Å; L624-L628 VanDerWaalsContact O-N 3.09Å; P625-L628 PolarHBondContact O-N 3.29Å; L628-R631 WeakPolarHBondContact O-CB 3.47Å; L628-R631 PolarHBondContact O-N 2.98Å; L628-D632 PolarHBondContact O-N 3.43Å
629	L	91.9	Very high	90.5	Very high	55 Å²	55	39.3 Å²	39.3	29%	0.288	21%	0.214	S	C	.	.	H	α-helix	trans	-59.6	-48.5	174.4	179.2	64.5	0	0	0	111.3	P625 R631 D632 L633	P625-L629 WeakPolarHBondContact O-CB 3.27Å; P625-L629 PolarHBondContact O-N 3.29Å; L629-R631 VanDerWaalsContact C-N 3.34Å; L629-R631 PolarHBondContact O-N 3.47Å; L629-D632 PolarHBondContact O-N 3.37Å; L629-L633 HydrophobicContact CD1-CD1 4.34Å; L629-L633 HydrophobicContact CD1-CG 4.44Å; L629-L633 HydrophobicContact CG-CD1 4.09Å; L629-L633 WeakPolarHBondContact O-CG 3.34Å; L629-L633 PolarHBondContact O-N 3.48Å
630	M	93.2	Very high	91.5	Very high	6 Å²	6	36.8 Å²	36.8	3%	0.03	19%	0.189	C	C	.	.	H	α-helix	trans	-63.8	-38.6	-179	-170	60.7	66.5	0	0	112.2	Q626 I627 D632 L633 L634 A639 V640 I645 L649 I653	Q626-M630 WeakPolarHBondContact O-CB 3.37Å; Q626-M630 PolarHBondContact O-N 3.06Å; I627-M630 PolarHBondContact O-N 2.89Å; M630-D632 VanDerWaalsContact C-N 3.28Å; M630-D632 PolarHBondContact O-N 3Å; M630-L633 PolarHBondContact O-N 2.63Å; M630-L634 HydrophobicContact CG-CD1 3.88Å; M630-L634 HydrophobicContact CG-CG 4.22Å; M630-L634 VanDerWaalsContact O-CB 3.29Å; M630-L634 WeakPolarHBondContact O-CB 3.48Å; M630-L634 VanDerWaalsContact O-CG 3.23Å; M630-L634 WeakPolarHBondContact O-CG 3.26Å; M630-L634 PolarHBondContact O-N 3.27Å; M630-L634 HydrophobicContact SD-CG 4.3Å; M630-A639 HydrophobicContact SD-CB 4.49Å; M630-V640 HydrophobicContact CE-CB 4.12Å; M630-I645 HydrophobicContact CE-CD1 4.17Å; M630-I645 HydrophobicContact CE-CG2 4.42Å; M630-L649 HydrophobicContact CB-CD1 4.15Å; M630-L649 HydrophobicContact CB-CD2 4.49Å; M630-L649 HydrophobicContact CG-CD1 4.4Å; M630-L649 HydrophobicContact CG-CD2 4.38Å; M630-I653 HydrophobicContact CE-CD1 3.61Å; M630-I653 HydrophobicContact CG-CD1 4.01Å; M630-I653 HydrophobicContact CG-CG1 4.4Å; M630-I653 HydrophobicContact SD-CD1 3.47Å; M630-I653 WeakPolarHBondContact SD-CD1 3.28Å; M630-I653 HydrophobicContact SD-CG1 4.05Å
631	R	92.9	Very high	92.1	Very high	75 Å²	75	34.5 Å²	34.5	28%	0.283	16%	0.164	S	C	.	.	H	α-helix	trans	-55.4	-44.8	173.5	-175	-167.3	68.3	-158.5	-9.4	111.7	F610 I627 L628 L629 K635	F610-R631 HydrophobicContact CD1-CB 4.2Å; F610-R631 HydrophobicContact CD1-CG 3.91Å; F610-R631 HydrophobicContact CE1-CB 3.48Å; F610-R631 VanDerWaalsContact CE1-CB 3.48Å; F610-R631 HydrophobicContact CE1-CG 3.66Å; F610-R631 HydrophobicContact CZ-CB 3.73Å; F610-R631 HydrophobicContact CZ-CG 4.36Å; I627-R631 WeakPolarHBondContact O-CB 3.41Å; I627-R631 PolarHBondContact O-N 3.28Å; L628-R631 WeakPolarHBondContact O-CB 3.47Å; L628-R631 PolarHBondContact O-N 2.98Å; L629-R631 VanDerWaalsContact C-N 3.34Å; L629-R631 PolarHBondContact O-N 3.47Å; R631-K635 WeakPolarHBondContact O-CB 3.35Å; R631-K635 WeakPolarHBondContact O-CG 3.5Å; R631-K635 PolarHBondContact O-N 3.41Å
632	D	92.8	Very high	92.4	Very high	55 Å²	55	34 Å²	34	29%	0.294	16%	0.162	S	C	.	.	H	α-helix	trans	-84	-20.6	-172.4	-63	-17.6	0	0	0	112.4	L628 L629 M630 R636	L628-D632 PolarHBondContact O-N 3.43Å; L629-D632 PolarHBondContact O-N 3.37Å; M630-D632 VanDerWaalsContact C-N 3.28Å; M630-D632 PolarHBondContact O-N 3Å; D632-R636 PolarHBondContact O-NE 3.46Å; D632-R636 PolarHBondContact O-NH2 3.02Å
633	L	94.4	Very high	92.4	Very high	4 Å²	4	30.1 Å²	30.1	2%	0.021	15%	0.15	C	C	.	.	H	α-helix	trans	-74.3	-47.5	164.4	-69.6	173	0	0	0	111.7	A589 L629 M630 K635 R636 G637 I638	A589-L633 HydrophobicContact CB-CD1 4.32Å; L629-L633 HydrophobicContact CD1-CD1 4.34Å; L629-L633 HydrophobicContact CD1-CG 4.44Å; L629-L633 HydrophobicContact CG-CD1 4.09Å; L629-L633 WeakPolarHBondContact O-CG 3.34Å; L629-L633 PolarHBondContact O-N 3.48Å; M630-L633 PolarHBondContact O-N 2.63Å; L633-K635 VanDerWaalsContact C-N 3.29Å; L633-K635 PolarHBondContact O-N 2.73Å; L633-R636 CarbonylContact O-C 3.41Å; L633-R636 WeakPolarHBondContact O-CA 3.47Å; L633-R636 WeakPolarHBondContact O-CB 3.42Å; L633-R636 PolarHBondContact O-N 3.21Å; L633-G637 PolarHBondContact O-N 3.32Å; L633-I638 CarbonylContact C-O 3.58Å; L633-I638 WeakPolarHBondContact CB-O 3.34Å; L633-I638 PolarHBondContact O-N 3.03Å; L633-I638 VanDerWaalsContact O-N 3.14Å
634	L	94.4	Very high	92.5	Very high	1 Å²	1	24 Å²	24	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-60	-39.5	178.9	-76.4	171.1	0	0	0	111.6	I606 F610 M630 R636 G637 I638 A639 V652 I653 L656 V662	I606-L634 WeakPolarHBondContact CD1-O 3.39Å; I606-L634 HydrophobicContact CG2-CB 3.93Å; F610-L634 HydrophobicContact CD2-CD1 3.66Å; F610-L634 HydrophobicContact CE2-CD1 3.62Å; M630-L634 HydrophobicContact CG-CD1 3.88Å; M630-L634 HydrophobicContact CG-CG 4.22Å; M630-L634 VanDerWaalsContact O-CB 3.29Å; M630-L634 WeakPolarHBondContact O-CB 3.48Å; M630-L634 VanDerWaalsContact O-CG 3.23Å; M630-L634 WeakPolarHBondContact O-CG 3.26Å; M630-L634 PolarHBondContact O-N 3.27Å; M630-L634 HydrophobicContact SD-CG 4.3Å; L634-R636 PolarHBondContact O-N 3.09Å; L634-R636 VanDerWaalsContact O-N 3.07Å; L634-G637 PolarHBondContact O-N 2.72Å; L634-I638 PolarHBondContact N-O 3.09Å; L634-A639 HydrophobicContact CD2-CB 3.87Å; L634-V652 HydrophobicContact CD1-CG1 4.29Å; L634-I653 HydrophobicContact CD1-CG1 4.48Å; L634-I653 HydrophobicContact CD2-CG1 4.33Å; L634-L656 HydrophobicContact CD1-CD1 3.91Å; L634-L656 HydrophobicContact CD2-CD1 3.87Å; L634-L656 HydrophobicContact CG-CD1 4.4Å; L634-V662 HydrophobicContact CD2-CG2 3.66Å
635	K	93.3	Very high	92.7	Very high	66 Å²	66	24 Å²	24	29%	0.287	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-7.6	171.2	-82.3	-179.4	174.4	-176.5	0	115.3	T598 K603 R631 L633	T598-K635 PolarHBondContact OG1-O 3.31Å; K603-K635 WeakPolarHBondContact CE-O 3.44Å; K603-K635 WeakPolarHBondContact CG-O 3.34Å; R631-K635 WeakPolarHBondContact O-CB 3.35Å; R631-K635 WeakPolarHBondContact O-CG 3.5Å; R631-K635 PolarHBondContact O-N 3.41Å; L633-K635 VanDerWaalsContact C-N 3.29Å; L633-K635 PolarHBondContact O-N 2.73Å
636	R	93.1	Very high	92.8	Very high	51 Å²	51	19.4 Å²	19.4	19%	0.192	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	0.7	173.4	-71.9	177.8	-94.6	-177.2	5.5	112.4	D593 M595 D596 L597 D632 L633 L634	D593-R636 VanDerWaalsContact CA-NH1 3.32Å; D593-R636 PolarHBondContact O-NH1 3.5Å; D593-R636 IonicContact OD1-CZ 2.73Å; D593-R636 VanDerWaalsContact OD1-CZ 3.27Å; D593-R636 IonicContact OD1-NH1 2.64Å; D593-R636 PolarHBondContact OD1-NH1 2.84Å; D593-R636 IonicContact OD1-NH2 3.93Å; D593-R636 PolarHBondContact OD1-NH2 3.43Å; M595-R636 WeakPolarHBondContact O-CD 3.16Å; D596-R636 HydrophobicContact CB-CG 4.45Å; L597-R636 PolarHBondContact N-O 2.97Å; D632-R636 PolarHBondContact O-NE 3.46Å; D632-R636 PolarHBondContact O-NH2 3.02Å; L633-R636 CarbonylContact O-C 3.41Å; L633-R636 WeakPolarHBondContact O-CA 3.47Å; L633-R636 WeakPolarHBondContact O-CB 3.42Å; L633-R636 PolarHBondContact O-N 3.21Å; L634-R636 PolarHBondContact O-N 3.09Å; L634-R636 VanDerWaalsContact O-N 3.07Å
637	G	93.3	Very high	92.8	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.8	14.5	-176.2	0	0	0	0	0	114.7	T598 L633 L634 K663 V664	T598-G637 VanDerWaalsContact CG2-CA 3.48Å; L633-G637 PolarHBondContact O-N 3.32Å; L634-G637 PolarHBondContact O-N 2.72Å; G637-K663 PolarHBondContact O-N 3.33Å; G637-V664 PolarHBondContact O-N 3.23Å
638	I	94.9	Very high	92.7	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.01	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	140.3	-179.3	-55.2	176.5	0	0	0	108.7	A589 L592 L633 L634 V664 F666	A589-I638 HydrophobicContact CB-CG2 4.35Å; L592-I638 HydrophobicContact CB-CD1 3.93Å; L592-I638 HydrophobicContact CD1-CD1 4.45Å; L633-I638 CarbonylContact C-O 3.58Å; L633-I638 WeakPolarHBondContact CB-O 3.34Å; L633-I638 PolarHBondContact O-N 3.03Å; L633-I638 VanDerWaalsContact O-N 3.14Å; L634-I638 PolarHBondContact N-O 3.09Å; I638-V664 CarbonylContact C-O 3.51Å; I638-V664 WeakPolarHBondContact CA-O 3.32Å; I638-F666 HydrophobicContact CG2-CD2 4.31Å; I638-F666 HydrophobicContact CG2-CE2 4.2Å
639	A	95.1	Very high	92.7	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	164.7	175.3	0	0	0	0	0	112.7	M630 L634 I653 V662 V664 L665 F666	M630-A639 HydrophobicContact SD-CB 4.49Å; L634-A639 HydrophobicContact CD2-CB 3.87Å; A639-I653 HydrophobicContact CB-CG1 4.26Å; A639-I653 HydrophobicContact CB-CG2 3.65Å; A639-V662 HydrophobicContact CB-CG1 3.76Å; A639-V662 HydrophobicContact CB-CG2 4.16Å; A639-V664 PolarHBondContact N-O 3.08Å; A639-L665 HydrophobicContact CB-CD1 3.75Å; A639-F666 PolarHBondContact O-N 2.78Å
640	V	95.2	Very high	92.7	Very high	1 Å²	1	17.6 Å²	17.6	1%	0.006	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	131.1	179.1	175.5	0	0	0	0	110.2	C585 A589 M630 H642 I645 I653 F666	C585-V640 HydrophobicContact CB-CG1 3.81Å; A589-V640 HydrophobicContact CB-CG2 3.33Å; M630-V640 HydrophobicContact CE-CB 4.12Å; V640-H642 WeakPolarHBondContact CG1-CD2 3.46Å; V640-H642 WeakPolarHBondContact CG1-NE2 3.31Å; V640-I645 HydrophobicContact CG1-CD1 4.39Å; V640-I645 HydrophobicContact CG1-CG1 4.46Å; V640-I653 VanDerWaalsContact O-CD1 3.28Å; V640-I653 WeakPolarHBondContact O-CD1 3.45Å; V640-F666 CarbonylContact C-O 3.56Å; V640-F666 WeakPolarHBondContact CA-O 3.22Å; V640-F666 HydrophobicContact CG2-CB 4.39Å
641	H	93.8	Very high	92.6	Very high	3 Å²	3	18.4 Å²	18.4	1%	0.014	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	107.8	179.6	-171.3	-73.4	0	0	0	112.1	K650 E654 L665 F666 A667 T668 F671	H641-K650 VanDerWaalsContact CE1-CE 3.46Å; H641-K650 WeakPolarHBondContact CE1-CE 3.43Å; H641-E654 IonicContact CD2-OE1 4Å; H641-E654 IonicContact CE1-OE1 2.99Å; H641-E654 IonicContact NE2-OE1 2.76Å; H641-E654 PolarHBondContact NE2-OE1 2.9Å; H641-L665 HydrophobicContact CB-CD1 4.01Å; H641-F666 PolarHBondContact N-O 2.88Å; H641-A667 HydrophobicContact CB-CB 4.41Å; H641-A667 VanDerWaalsContact O-CA 3.27Å; H641-A667 WeakPolarHBondContact O-CA 3.45Å; H641-T668 PolarHBondContact O-N 3.28Å; H641-F671 AromaticContact CD2-CD2 3.95Å; H641-F671 AromaticContact CE1-CD2 3.8Å; H641-F671 AromaticContact CG-CD2 3.91Å; H641-F671 AromaticContact ND1-CD2 3.87Å; H641-F671 AromaticContact NE2-CD2 3.88Å
642	H	92.3	Very high	92.5	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.073	C	C	.	.	S	Bend	trans	-149.4	173.1	167.8	53.9	89.3	0	0	0	110.7	R582 D586 V640 G644 I645 T668 Q1192	R582-H642 HydrophobicContact CG-CB 4.14Å; D586-H642 IonicContact OD1-NE2 3.27Å; D586-H642 IonicContact OD2-CE1 2.97Å; D586-H642 IonicContact OD2-NE2 3.81Å; V640-H642 WeakPolarHBondContact CG1-CD2 3.46Å; V640-H642 WeakPolarHBondContact CG1-NE2 3.31Å; H642-G644 PolarHBondContact ND1-N 3.49Å; H642-G644 PolarHBondContact O-N 3.49Å; H642-I645 PolarHBondContact O-N 3.19Å; H642-T668 WeakPolarHBondContact CA-OG1 3.05Å; H642-T668 HydrophobicContact CB-CG2 3.65Å; H642-T668 VanDerWaalsContact CB-OG1 3.26Å; H642-T668 WeakPolarHBondContact CB-OG1 3.42Å; H642-Q1192 PolarHBondContact CE1-OE1 3.49Å; H642-Q1192 PolarHBondContact ND1-OE1 3.41Å
643	S	87.6	Confident	92.6	Very high	20 Å²	20	12.2 Å²	12.2	14%	0.14	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	1.2	-178.6	68.8	0	0	0	0	115.7	R582 R1198	R582-S643 PolarHBondContact NE-OG 2.9Å; R582-S643 PolarHBondContact NH2-OG 3.15Å; S643-R1198 PolarHBondContact O-NH1 3.47Å; S643-R1198 PolarHBondContact O-NH2 2.85Å
644	G	90.3	Very high	92.4	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	-11.7	177.8	0	0	0	0	0	114.2	H642 G1194	H642-G644 PolarHBondContact ND1-N 3.49Å; H642-G644 PolarHBondContact O-N 3.49Å; G644-G1194 WeakPolarHBondContact O-CA 3.36Å; G644-G1194 PolarHBondContact O-N 3.3Å
645	I	93.4	Very high	92.2	Very high	1 Å²	1	12.5 Å²	12.5	1%	0.005	6%	0.061	C	C	.	.	S	Bend	trans	-74.8	142.1	170.2	-58.1	-58.1	0	0	0	109.1	Q626 M630 V640 H642 L649 K650 I653	Q626-I645 HydrophobicContact CG-CD1 4.39Å; M630-I645 HydrophobicContact CE-CD1 4.17Å; M630-I645 HydrophobicContact CE-CG2 4.42Å; V640-I645 HydrophobicContact CG1-CD1 4.39Å; V640-I645 HydrophobicContact CG1-CG1 4.46Å; H642-I645 PolarHBondContact O-N 3.19Å; I645-L649 HydrophobicContact CG2-CB 3.61Å; I645-L649 HydrophobicContact CG2-CD1 4.17Å; I645-K650 HydrophobicContact CB-CG 3.96Å; I645-K650 HydrophobicContact CG2-CG 3.98Å; I645-I653 HydrophobicContact CG2-CD1 4.45Å
646	L	92.4	Very high	92.2	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.047	C	C	.	.			trans	-52.2	138.3	177.1	-72.5	169.3	0	0	0	111.5	L624 I627 I648 L649 K650 F1182 E1193 V1197 I1237	L624-L646 HydrophobicContact CD1-CD1 4.05Å; I627-L646 HydrophobicContact CD1-CD1 4.32Å; I627-L646 HydrophobicContact CG1-CD1 4.12Å; L646-I648 PolarHBondContact O-N 3.28Å; L646-L649 HydrophobicContact CB-CB 4.39Å; L646-L649 HydrophobicContact CB-CD1 4.31Å; L646-L649 HydrophobicContact CB-CG 4.26Å; L646-L649 HydrophobicContact CD1-CD1 4.4Å; L646-L649 WeakPolarHBondContact O-CB 3.47Å; L646-L649 PolarHBondContact O-N 3.17Å; L646-K650 PolarHBondContact O-N 3.31Å; L646-F1182 HydrophobicContact CD2-CE1 4.11Å; L646-F1182 HydrophobicContact CD2-CZ 4.12Å; L646-E1193 HydrophobicContact CD2-CB 3.9Å; L646-E1193 HydrophobicContact CG-CB 4.22Å; L646-V1197 HydrophobicContact CD2-CG2 3.73Å; L646-I1237 HydrophobicContact CD1-CD1 4.35Å; L646-I1237 HydrophobicContact CD1-CG1 4.32Å; L646-I1237 HydrophobicContact CD2-CG1 3.99Å
647	P	89.8	Confident	92.1	Very high	41 Å²	41	7.3 Å²	7.3	27%	0.266	4%	0.04	S	C	.	.	H	α-helix	trans	-52.7	-47.2	-176.2	-29.8	36.5	0	0	0	114.2	L649 K650 E651 V1197	P647-L649 VanDerWaalsContact C-N 3.31Å; P647-L649 PolarHBondContact O-N 2.62Å; P647-K650 WeakPolarHBondContact O-CB 3.17Å; P647-K650 PolarHBondContact O-N 3.06Å; P647-K650 VanDerWaalsContact O-N 3.12Å; P647-E651 WeakPolarHBondContact O-CG 3.37Å; P647-E651 PolarHBondContact O-N 3.27Å; P647-E651 VanDerWaalsContact O-N 3.11Å; P647-V1197 HydrophobicContact CG-CB 4.47Å; P647-V1197 HydrophobicContact CG-CG1 3.72Å
648	I	90.8	Very high	91.9	Very high	8 Å²	8	11 Å²	11	4%	0.041	7%	0.066	C	C	.	.	H	α-helix	trans	-58.8	-39.9	177.2	-172.6	172.3	0	0	0	112.5	L617 L646 E651 V652 I1237 T1240 L1243	L617-I648 HydrophobicContact CD1-CD1 4.4Å; L617-I648 HydrophobicContact CD2-CD1 4.03Å; L617-I648 HydrophobicContact CG-CD1 4.13Å; L646-I648 PolarHBondContact O-N 3.28Å; I648-E651 PolarHBondContact O-N 3.41Å; I648-V652 WeakPolarHBondContact O-CG2 3.23Å; I648-V652 PolarHBondContact O-N 2.81Å; I648-I1237 HydrophobicContact CG2-CD1 3.67Å; I648-T1240 HydrophobicContact CD1-CG2 4.04Å; I648-L1243 HydrophobicContact CG1-CD1 4.31Å; I648-L1243 HydrophobicContact CG1-CD2 4.49Å; I648-L1243 HydrophobicContact CG1-CG 4.37Å
649	L	92.6	Very high	91.6	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-67.1	-38.9	177.2	-72.1	-176.4	0	0	0	111.4	F610 Q626 I627 M630 I645 L646 P647 E651 V652 I653	F610-L649 HydrophobicContact CE2-CD2 3.93Å; F610-L649 HydrophobicContact CZ-CD2 4.08Å; Q626-L649 HydrophobicContact CG-CD1 4.11Å; I627-L649 HydrophobicContact CG1-CD1 4Å; I627-L649 HydrophobicContact CG1-CD2 4.25Å; I627-L649 HydrophobicContact CG1-CG 4.31Å; M630-L649 HydrophobicContact CB-CD1 4.15Å; M630-L649 HydrophobicContact CB-CD2 4.49Å; M630-L649 HydrophobicContact CG-CD1 4.4Å; M630-L649 HydrophobicContact CG-CD2 4.38Å; I645-L649 HydrophobicContact CG2-CB 3.61Å; I645-L649 HydrophobicContact CG2-CD1 4.17Å; L646-L649 HydrophobicContact CB-CB 4.39Å; L646-L649 HydrophobicContact CB-CD1 4.31Å; L646-L649 HydrophobicContact CB-CG 4.26Å; L646-L649 HydrophobicContact CD1-CD1 4.4Å; L646-L649 WeakPolarHBondContact O-CB 3.47Å; L646-L649 PolarHBondContact O-N 3.17Å; P647-L649 VanDerWaalsContact C-N 3.31Å; P647-L649 PolarHBondContact O-N 2.62Å; L649-E651 VanDerWaalsContact C-N 3.34Å; L649-E651 PolarHBondContact O-N 3.07Å; L649-V652 PolarHBondContact O-N 3.24Å; L649-I653 WeakPolarHBondContact O-CB 3.42Å; L649-I653 VanDerWaalsContact O-CD1 3.29Å; L649-I653 WeakPolarHBondContact O-CD1 3.29Å; L649-I653 WeakPolarHBondContact O-CG1 3.4Å; L649-I653 PolarHBondContact O-N 3.32Å
650	K	90.9	Very high	91.4	Very high	35 Å²	35	18.2 Å²	18.2	15%	0.152	10%	0.101	C	C	.	.	H	α-helix	trans	-58.5	-47.5	175.2	-65.5	-178.6	63.8	-89.8	0	111.3	H641 I645 L646 P647 V652 I653 E654	H641-K650 VanDerWaalsContact CE1-CE 3.46Å; H641-K650 WeakPolarHBondContact CE1-CE 3.43Å; I645-K650 HydrophobicContact CB-CG 3.96Å; I645-K650 HydrophobicContact CG2-CG 3.98Å; L646-K650 PolarHBondContact O-N 3.31Å; P647-K650 WeakPolarHBondContact O-CB 3.17Å; P647-K650 PolarHBondContact O-N 3.06Å; P647-K650 VanDerWaalsContact O-N 3.12Å; K650-V652 PolarHBondContact O-N 3.38Å; K650-I653 PolarHBondContact O-N 3.46Å; K650-E654 IonicContact NZ-OE1 3.28Å; K650-E654 PolarHBondContact NZ-OE1 3.24Å; K650-E654 WeakPolarHBondContact O-CB 3.37Å; K650-E654 WeakPolarHBondContact O-CG 2.89Å; K650-E654 PolarHBondContact O-N 3.1Å
651	E	90.6	Very high	91.3	Very high	23 Å²	23	18.6 Å²	18.6	11%	0.107	10%	0.102	C	C	.	.	H	α-helix	trans	-64.1	-39.2	178.7	-60.5	-177.2	153.5	0	0	112	P647 I648 L649 M655 S1242 L1243 Y1244	P647-E651 WeakPolarHBondContact O-CG 3.37Å; P647-E651 PolarHBondContact O-N 3.27Å; P647-E651 VanDerWaalsContact O-N 3.11Å; I648-E651 PolarHBondContact O-N 3.41Å; L649-E651 VanDerWaalsContact C-N 3.34Å; L649-E651 PolarHBondContact O-N 3.07Å; E651-M655 WeakPolarHBondContact O-CB 3.43Å; E651-M655 VanDerWaalsContact O-CG 3.3Å; E651-M655 WeakPolarHBondContact O-CG 3.32Å; E651-M655 PolarHBondContact O-N 3.27Å; E651-S1242 VanDerWaalsContact CD-OG 3.22Å; E651-S1242 WeakPolarHBondContact OE1-CB 2.99Å; E651-S1242 PolarHBondContact OE1-OG 2.99Å; E651-S1242 WeakPolarHBondContact OE2-CA 3.48Å; E651-S1242 PolarHBondContact OE2-OG 2.91Å; E651-L1243 HydrophobicContact CB-CB 4.21Å; E651-L1243 HydrophobicContact CB-CD1 4.1Å; E651-L1243 HydrophobicContact CB-CG 4.28Å; E651-L1243 PolarHBondContact OE2-N 2.73Å; E651-Y1244 HydrophobicContact CB-CD2 4.35Å; E651-Y1244 HydrophobicContact CB-CE2 4.01Å; E651-Y1244 HydrophobicContact CG-CD2 4Å; E651-Y1244 HydrophobicContact CG-CE2 3.81Å
652	V	92.4	Very high	91.3	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-59.8	-46.7	172.3	169.9	0	0	0	0	111.4	F609 F610 L634 I648 L649 K650 M655 L656 L1243	F609-V652 HydrophobicContact CD1-CG1 4.42Å; F609-V652 HydrophobicContact CE1-CG1 4.19Å; F610-V652 HydrophobicContact CD2-CG1 3.83Å; F610-V652 HydrophobicContact CE2-CG1 4.33Å; L634-V652 HydrophobicContact CD1-CG1 4.29Å; I648-V652 WeakPolarHBondContact O-CG2 3.23Å; I648-V652 PolarHBondContact O-N 2.81Å; L649-V652 PolarHBondContact O-N 3.24Å; K650-V652 PolarHBondContact O-N 3.38Å; V652-M655 PolarHBondContact O-N 3.3Å; V652-L656 HydrophobicContact CG1-CD1 3.71Å; V652-L656 HydrophobicContact CG1-CG 4.3Å; V652-L656 WeakPolarHBondContact O-CB 3.32Å; V652-L656 VanDerWaalsContact O-CG 3.3Å; V652-L656 WeakPolarHBondContact O-CG 3.26Å; V652-L656 PolarHBondContact O-N 2.94Å; V652-L1243 HydrophobicContact CB-CD1 4.38Å; V652-L1243 HydrophobicContact CG2-CD1 3.38Å
653	I	93.1	Very high	91.4	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-65	-44.7	-178.5	-68.2	160.8	0	0	0	110.6	M630 L634 A639 V640 I645 L649 K650 L656 F657 L665	M630-I653 HydrophobicContact CE-CD1 3.61Å; M630-I653 HydrophobicContact CG-CD1 4.01Å; M630-I653 HydrophobicContact CG-CG1 4.4Å; M630-I653 HydrophobicContact SD-CD1 3.47Å; M630-I653 WeakPolarHBondContact SD-CD1 3.28Å; M630-I653 HydrophobicContact SD-CG1 4.05Å; L634-I653 HydrophobicContact CD1-CG1 4.48Å; L634-I653 HydrophobicContact CD2-CG1 4.33Å; A639-I653 HydrophobicContact CB-CG1 4.26Å; A639-I653 HydrophobicContact CB-CG2 3.65Å; V640-I653 VanDerWaalsContact O-CD1 3.28Å; V640-I653 WeakPolarHBondContact O-CD1 3.45Å; I645-I653 HydrophobicContact CG2-CD1 4.45Å; L649-I653 WeakPolarHBondContact O-CB 3.42Å; L649-I653 VanDerWaalsContact O-CD1 3.29Å; L649-I653 WeakPolarHBondContact O-CD1 3.29Å; L649-I653 WeakPolarHBondContact O-CG1 3.4Å; L649-I653 PolarHBondContact O-N 3.32Å; K650-I653 PolarHBondContact O-N 3.46Å; I653-L656 PolarHBondContact O-N 2.82Å; I653-F657 VanDerWaalsContact O-CB 3.23Å; I653-F657 WeakPolarHBondContact O-CB 3.48Å; I653-F657 PolarHBondContact O-N 2.89Å; I653-L665 HydrophobicContact CG2-CD1 3.56Å
654	E	90.9	Very high	91.7	Very high	3 Å²	3	19.3 Å²	19.3	1%	0.014	10%	0.103	C	C	.	.	H	α-helix	trans	-56.9	-49.6	174.1	-71.6	162	-159.9	0	0	110.6	H641 K650 L656 F657 S658 V675 M677 Y1244	H641-E654 IonicContact CD2-OE1 4Å; H641-E654 IonicContact CE1-OE1 2.99Å; H641-E654 IonicContact NE2-OE1 2.76Å; H641-E654 PolarHBondContact NE2-OE1 2.9Å; K650-E654 IonicContact NZ-OE1 3.28Å; K650-E654 PolarHBondContact NZ-OE1 3.24Å; K650-E654 WeakPolarHBondContact O-CB 3.37Å; K650-E654 WeakPolarHBondContact O-CG 2.89Å; K650-E654 PolarHBondContact O-N 3.1Å; E654-L656 PolarHBondContact O-N 3.18Å; E654-F657 PolarHBondContact O-N 3.33Å; E654-S658 PolarHBondContact O-N 2.96Å; E654-V675 HydrophobicContact CG-CG1 4.41Å; E654-V675 HydrophobicContact CG-CG2 4.2Å; E654-M677 HydrophobicContact CB-CE 3.73Å; E654-M677 HydrophobicContact CB-SD 3.9Å; E654-M677 HydrophobicContact CG-SD 4.4Å; E654-M677 VanDerWaalsContact O-CE 3.27Å; E654-M677 WeakPolarHBondContact O-CE 3.23Å; E654-Y1244 WeakPolarHBondContact CB-OH 3.35Å; E654-Y1244 WeakPolarHBondContact OE2-CE2 3.31Å; E654-Y1244 PolarHBondContact OE2-OH 3.28Å
655	M	90	Very high	92	Very high	9 Å²	9	19.3 Å²	19.3	4%	0.044	10%	0.103	C	C	.	.	H	α-helix	trans	-66.5	-36.3	178.7	-69.1	-175	-161.9	0	0	114	R377 F609 E651 V652 F657 S658 R659 L1243 Y1244	R377-M655 PolarHBondContact NH1-SD 3.04Å; F609-M655 HydrophobicContact CE1-CB 4.19Å; F609-M655 HydrophobicContact CZ-CB 3.9Å; F609-M655 HydrophobicContact CZ-SD 3.97Å; E651-M655 WeakPolarHBondContact O-CB 3.43Å; E651-M655 VanDerWaalsContact O-CG 3.3Å; E651-M655 WeakPolarHBondContact O-CG 3.32Å; E651-M655 PolarHBondContact O-N 3.27Å; V652-M655 PolarHBondContact O-N 3.3Å; M655-F657 VanDerWaalsContact C-N 3.35Å; M655-S658 PolarHBondContact O-OG 3.38Å; M655-R659 VanDerWaalsContact O-CG 3.31Å; M655-R659 WeakPolarHBondContact O-CG 3.27Å; M655-R659 PolarHBondContact O-N 3.22Å; M655-L1243 HydrophobicContact CE-CB 3.48Å; M655-L1243 VanDerWaalsContact CE-CB 3.48Å; M655-L1243 WeakPolarHBondContact CE-O 3.3Å; M655-L1243 HydrophobicContact SD-CB 4.12Å; M655-Y1244 HydrophobicContact CE-CD1 3.56Å; M655-Y1244 HydrophobicContact CE-CD2 3.88Å; M655-Y1244 HydrophobicContact CE-CE1 3.63Å; M655-Y1244 HydrophobicContact CE-CE2 3.98Å; M655-Y1244 HydrophobicContact CE-CG 3.67Å; M655-Y1244 HydrophobicContact CG-CE1 4.48Å
656	L	93.2	Very high	92.1	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-72.8	-30.1	175.2	-69.9	174.5	0	0	0	111.8	I606 F609 L634 V652 I653 E654 G660 L661 V662	I606-L656 HydrophobicContact CG1-CD2 4.3Å; I606-L656 HydrophobicContact CG2-CD1 4.23Å; F609-L656 HydrophobicContact CB-CD2 4.34Å; F609-L656 HydrophobicContact CD1-CD1 4.29Å; F609-L656 HydrophobicContact CD1-CD2 3.54Å; F609-L656 HydrophobicContact CD1-CG 3.84Å; F609-L656 HydrophobicContact CE1-CD2 4.12Å; F609-L656 HydrophobicContact CE1-CG 4.05Å; F609-L656 HydrophobicContact CG-CD2 4.1Å; L634-L656 HydrophobicContact CD1-CD1 3.91Å; L634-L656 HydrophobicContact CD2-CD1 3.87Å; L634-L656 HydrophobicContact CG-CD1 4.4Å; V652-L656 HydrophobicContact CG1-CD1 3.71Å; V652-L656 HydrophobicContact CG1-CG 4.3Å; V652-L656 WeakPolarHBondContact O-CB 3.32Å; V652-L656 VanDerWaalsContact O-CG 3.3Å; V652-L656 WeakPolarHBondContact O-CG 3.26Å; V652-L656 PolarHBondContact O-N 2.94Å; I653-L656 PolarHBondContact O-N 2.82Å; E654-L656 PolarHBondContact O-N 3.18Å; L656-G660 PolarHBondContact O-N 2.98Å; L656-L661 HydrophobicContact CD2-CB 4.43Å; L656-L661 HydrophobicContact CD2-CD1 3.58Å; L656-L661 WeakPolarHBondContact O-CB 3.44Å; L656-L661 PolarHBondContact O-N 2.85Å; L656-V662 HydrophobicContact CB-CG2 3.83Å; L656-V662 PolarHBondContact O-N 2.78Å
657	F	92.6	Very high	92.2	Very high	7 Å²	7	19.3 Å²	19.3	3%	0.031	10%	0.103	C	C	.	.	H	α-helix	trans	-71.3	-42.4	173.4	-173.9	-92.4	0	0	0	111.7	P574 V576 I653 E654 M655 R659 G660 V662 L665 F671 M677 A679	P574-F657 HydrophobicContact CB-CE2 3.98Å; P574-F657 HydrophobicContact CB-CZ 4.26Å; P574-F657 HydrophobicContact CG-CZ 4.42Å; V576-F657 HydrophobicContact CG2-CE1 4.31Å; V576-F657 HydrophobicContact CG2-CE2 3.84Å; V576-F657 HydrophobicContact CG2-CZ 3.45Å; V576-F657 VanDerWaalsContact CG2-CZ 3.45Å; I653-F657 VanDerWaalsContact O-CB 3.23Å; I653-F657 WeakPolarHBondContact O-CB 3.48Å; I653-F657 PolarHBondContact O-N 2.89Å; E654-F657 PolarHBondContact O-N 3.33Å; M655-F657 VanDerWaalsContact C-N 3.35Å; F657-R659 VanDerWaalsContact C-N 3.27Å; F657-R659 PolarHBondContact O-N 3.35Å; F657-G660 WeakPolarHBondContact O-CA 3.43Å; F657-G660 PolarHBondContact O-N 3.37Å; F657-V662 HydrophobicContact CB-CB 4.2Å; F657-V662 HydrophobicContact CD2-CB 4.01Å; F657-V662 HydrophobicContact CD2-CG1 3.98Å; F657-L665 HydrophobicContact CD2-CB 4.03Å; F657-L665 HydrophobicContact CD2-CD2 4.02Å; F657-L665 HydrophobicContact CE2-CB 3.98Å; F657-L665 HydrophobicContact CE2-CD2 4.23Å; F657-L665 HydrophobicContact CG-CD2 4.29Å; F657-F671 HydrophobicContact CD1-CZ 4.18Å; F657-F671 HydrophobicContact CE1-CZ 4.19Å; F657-M677 HydrophobicContact CD1-CB 3.91Å; F657-M677 HydrophobicContact CD1-CG 4.46Å; F657-M677 HydrophobicContact CD1-SD 4.15Å; F657-M677 HydrophobicContact CE1-CB 4.01Å; F657-A679 HydrophobicContact CZ-CB 3.98Å
658	S	87.7	Confident	92.4	Very high	78 Å²	78	18 Å²	18	55%	0.545	10%	0.095	S	C	.	.	H	α-helix	trans	-64.2	-30.2	176	70.8	0	0	0	0	113.3	E654 M655 G660	E654-S658 PolarHBondContact O-N 2.96Å; M655-S658 PolarHBondContact O-OG 3.38Å; S658-G660 PolarHBondContact O-N 3.26Å
659	R	89.5	Confident	92.2	Very high	129 Å²	129	19.3 Å²	19.3	49%	0.487	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-6.6	169.6	-68.9	175.7	-175.7	-143.6	0	114.4	E605 M655 F657 L661	E605-R659 IonicContact OE1-NH1 3.26Å; E605-R659 PolarHBondContact OE1-NH1 2.86Å; M655-R659 VanDerWaalsContact O-CG 3.31Å; M655-R659 WeakPolarHBondContact O-CG 3.27Å; M655-R659 PolarHBondContact O-N 3.22Å; F657-R659 VanDerWaalsContact C-N 3.27Å; F657-R659 PolarHBondContact O-N 3.35Å; R659-L661 VanDerWaalsContact C-N 3.26Å; R659-L661 HydrophobicContact CB-CD1 3.99Å; R659-L661 HydrophobicContact CB-CG 4.07Å; R659-L661 PolarHBondContact O-N 3.49Å
660	G	89.8	Confident	91.8	Very high	25 Å²	25	22.4 Å²	22.4	26%	0.258	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.9	15.8	-176.1	0	0	0	0	0	114.8	L656 F657 S658 K663	L656-G660 PolarHBondContact O-N 2.98Å; F657-G660 WeakPolarHBondContact O-CA 3.43Å; F657-G660 PolarHBondContact O-N 3.37Å; S658-G660 PolarHBondContact O-N 3.26Å; G660-K663 WeakPolarHBondContact O-CE 3.5Å; G660-K663 PolarHBondContact O-NZ 3.2Å
661	L	93	Very high	91.6	Very high	8 Å²	8	20.7 Å²	20.7	4%	0.042	11%	0.112	C	C	.	.			trans	-78.8	-37	177.7	-67.7	168.2	0	0	0	111.3	E602 E605 I606 L656 R659 K663	E602-L661 HydrophobicContact CB-CD2 3.95Å; E602-L661 HydrophobicContact CG-CD2 3.85Å; E605-L661 HydrophobicContact CG-CD1 4.38Å; I606-L661 HydrophobicContact CD1-CB 4.02Å; I606-L661 HydrophobicContact CG1-CB 3.91Å; I606-L661 HydrophobicContact CG1-CD1 4.04Å; I606-L661 HydrophobicContact CG1-CD2 4.33Å; I606-L661 HydrophobicContact CG1-CG 4.32Å; L656-L661 HydrophobicContact CD2-CB 4.43Å; L656-L661 HydrophobicContact CD2-CD1 3.58Å; L656-L661 WeakPolarHBondContact O-CB 3.44Å; L656-L661 PolarHBondContact O-N 2.85Å; R659-L661 VanDerWaalsContact C-N 3.26Å; R659-L661 HydrophobicContact CB-CD1 3.99Å; R659-L661 HydrophobicContact CB-CG 4.07Å; R659-L661 PolarHBondContact O-N 3.49Å; L661-K663 PolarHBondContact O-N 3.16Å
662	V	94.6	Very high	91.2	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.006	11%	0.107	C	C	.	.			trans	-77.8	119.2	167.7	178.6	0	0	0	0	108.9	L634 A639 L656 F657 V664 L665	L634-V662 HydrophobicContact CD2-CG2 3.66Å; A639-V662 HydrophobicContact CB-CG1 3.76Å; A639-V662 HydrophobicContact CB-CG2 4.16Å; L656-V662 HydrophobicContact CB-CG2 3.83Å; L656-V662 PolarHBondContact O-N 2.78Å; F657-V662 HydrophobicContact CB-CB 4.2Å; F657-V662 HydrophobicContact CD2-CB 4.01Å; F657-V662 HydrophobicContact CD2-CG1 3.98Å; V662-V664 WeakPolarHBondContact CG1-O 3.31Å; V662-L665 HydrophobicContact CG1-CB 4.31Å
663	K	94.1	Very high	90.2	Very high	37 Å²	37	21.9 Å²	21.9	16%	0.161	12%	0.118	C	C	.	.	S	Bend	trans	-94.5	-27.1	-178.9	-48.8	-55.8	-179	-177.9	0	112.5	T573 P574 V575 L597 E602 G637 G660 L661	T573-K663 HydrophobicContact CG2-CB 4.38Å; P574-K663 CarbonylContact C-O 3.57Å; P574-K663 VanDerWaalsContact CA-O 3.3Å; P574-K663 WeakPolarHBondContact CA-O 3.48Å; V575-K663 PolarHBondContact N-O 2.97Å; L597-K663 HydrophobicContact CB-CB 4.01Å; L597-K663 HydrophobicContact CB-CG 3.91Å; L597-K663 HydrophobicContact CD1-CB 3.99Å; E602-K663 VanDerWaalsContact OE1-CE 3.24Å; E602-K663 WeakPolarHBondContact OE1-CE 3.2Å; E602-K663 IonicContact OE1-NZ 3.01Å; E602-K663 PolarHBondContact OE1-NZ 3.21Å; G637-K663 PolarHBondContact O-N 3.33Å; G660-K663 WeakPolarHBondContact O-CE 3.5Å; G660-K663 PolarHBondContact O-NZ 3.2Å; L661-K663 PolarHBondContact O-N 3.16Å
664	V	95.1	Very high	88.7	Confident	1 Å²	1	22.1 Å²	22.1	1%	0.006	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	123.6	177.5	-179.6	0	0	0	0	109.7	L564 V575 L597 G637 I638 A639 V662 F666	L564-V664 HydrophobicContact CD1-CG1 4.13Å; L564-V664 HydrophobicContact CD1-CG2 4.24Å; L564-V664 HydrophobicContact CD2-CG1 4.06Å; L564-V664 HydrophobicContact CD2-CG2 3.73Å; V575-V664 HydrophobicContact CB-CG2 4.48Å; V575-V664 WeakPolarHBondContact O-CA 3.41Å; L597-V664 HydrophobicContact CD1-CB 4.45Å; L597-V664 HydrophobicContact CD1-CG2 3.49Å; L597-V664 VanDerWaalsContact CD1-CG2 3.49Å; G637-V664 PolarHBondContact O-N 3.23Å; I638-V664 CarbonylContact C-O 3.51Å; I638-V664 WeakPolarHBondContact CA-O 3.32Å; A639-V664 PolarHBondContact N-O 3.08Å; V662-V664 WeakPolarHBondContact CG1-O 3.31Å; V664-F666 HydrophobicContact CG1-CD2 4.3Å; V664-F666 HydrophobicContact CG1-CE2 3.72Å; V664-F666 HydrophobicContact CG1-CZ 4.08Å
665	L	95.6	Very high	87.6	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	114.3	179.1	-177.9	67.5	0	0	0	110.2	V575 V576 A577 A639 H641 I653 F657 V662 A667 F671	V575-L665 PolarHBondContact O-N 2.88Å; V576-L665 CarbonylContact C-O 3.52Å; V576-L665 WeakPolarHBondContact CA-O 3.43Å; V576-L665 HydrophobicContact CG2-CB 4.35Å; V576-L665 HydrophobicContact CG2-CD2 4.34Å; A577-L665 PolarHBondContact N-O 3.17Å; A639-L665 HydrophobicContact CB-CD1 3.75Å; H641-L665 HydrophobicContact CB-CD1 4.01Å; I653-L665 HydrophobicContact CG2-CD1 3.56Å; F657-L665 HydrophobicContact CD2-CB 4.03Å; F657-L665 HydrophobicContact CD2-CD2 4.02Å; F657-L665 HydrophobicContact CE2-CB 3.98Å; F657-L665 HydrophobicContact CE2-CD2 4.23Å; F657-L665 HydrophobicContact CG-CD2 4.29Å; V662-L665 HydrophobicContact CG1-CB 4.31Å; L665-A667 HydrophobicContact CG-CB 4.4Å; L665-F671 HydrophobicContact CD2-CD1 4.22Å; L665-F671 HydrophobicContact CD2-CD2 4.02Å; L665-F671 HydrophobicContact CD2-CE1 3.78Å; L665-F671 HydrophobicContact CD2-CE2 3.56Å; L665-F671 HydrophobicContact CD2-CG 4.33Å; L665-F671 HydrophobicContact CD2-CZ 3.43Å; L665-F671 VanDerWaalsContact CD2-CZ 3.43Å
666	F	95.8	Very high	86.8	Confident	0 Å²	0	25 Å²	25	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	119.3	168.5	-69.2	-81.4	0	0	0	109.2	W560 A577 C585 N588 A589 L592 I638 A639 V640 H641 V664	W560-F666 HydrophobicContact CD2-CE1 4.05Å; W560-F666 HydrophobicContact CD2-CZ 4.3Å; W560-F666 AromaticContact CE2-CE1 3.82Å; W560-F666 HydrophobicContact CE3-CE1 4.15Å; W560-F666 HydrophobicContact CE3-CZ 4.28Å; W560-F666 AromaticContact CH2-CE1 3.92Å; W560-F666 HydrophobicContact CH2-CE1 3.92Å; W560-F666 AromaticContact CZ2-CE1 3.76Å; W560-F666 HydrophobicContact CZ2-CE1 3.76Å; W560-F666 HydrophobicContact CZ3-CE1 4.1Å; A577-F666 HydrophobicContact CB-CD1 3.56Å; A577-F666 HydrophobicContact CB-CE1 3.69Å; A577-F666 HydrophobicContact CB-CG 4.34Å; C585-F666 HydrophobicContact CB-CB 4.27Å; N588-F666 HydrophobicContact CB-CD1 3.83Å; N588-F666 HydrophobicContact CB-CE1 3.73Å; N588-F666 HydrophobicContact CB-CG 4.38Å; N588-F666 HydrophobicContact CB-CZ 4.2Å; A589-F666 HydrophobicContact CB-CD2 4Å; A589-F666 HydrophobicContact CB-CE2 4.46Å; L592-F666 HydrophobicContact CD1-CE2 3.58Å; L592-F666 HydrophobicContact CD1-CZ 3.58Å; I638-F666 HydrophobicContact CG2-CD2 4.31Å; I638-F666 HydrophobicContact CG2-CE2 4.2Å; A639-F666 PolarHBondContact O-N 2.78Å; V640-F666 CarbonylContact C-O 3.56Å; V640-F666 WeakPolarHBondContact CA-O 3.22Å; V640-F666 HydrophobicContact CG2-CB 4.39Å; H641-F666 PolarHBondContact N-O 2.88Å; V664-F666 HydrophobicContact CG1-CD2 4.3Å; V664-F666 HydrophobicContact CG1-CE2 3.72Å; V664-F666 HydrophobicContact CG1-CZ 4.08Å
667	A	94.9	Very high	86.2	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	147.9	-170.6	0	0	0	0	0	113.4	V576 A577 F578 T579 H641 L665 F671	V576-A667 HydrophobicContact CG1-CB 4.25Å; A577-A667 PolarHBondContact O-N 2.97Å; F578-A667 VanDerWaalsContact CA-O 3.31Å; F578-A667 WeakPolarHBondContact CA-O 3.3Å; F578-A667 HydrophobicContact CD1-CB 4.32Å; F578-A667 HydrophobicContact CE1-CB 4.25Å; T579-A667 PolarHBondContact N-O 3.34Å; H641-A667 HydrophobicContact CB-CB 4.41Å; H641-A667 VanDerWaalsContact O-CA 3.27Å; H641-A667 WeakPolarHBondContact O-CA 3.45Å; L665-A667 HydrophobicContact CG-CB 4.4Å; A667-F671 HydrophobicContact CB-CB 3.73Å; A667-F671 HydrophobicContact CB-CD1 4.21Å; A667-F671 HydrophobicContact CB-CG 4.04Å
668	T	92.4	Very high	85.8	Confident	15 Å²	15	27.6 Å²	27.6	9%	0.092	15%	0.153	C	C	.	.			trans	-83.8	163.9	162.4	50.3	0	0	0	0	111.2	T579 H641 H642 T670 F671	T579-T668 WeakPolarHBondContact O-CG2 3.32Å; H641-T668 PolarHBondContact O-N 3.28Å; H642-T668 WeakPolarHBondContact CA-OG1 3.05Å; H642-T668 HydrophobicContact CB-CG2 3.65Å; H642-T668 VanDerWaalsContact CB-OG1 3.26Å; H642-T668 WeakPolarHBondContact CB-OG1 3.42Å; T668-T670 PolarHBondContact O-N 2.86Å; T668-T670 PolarHBondContact OG1-OG1 3.26Å; T668-F671 WeakPolarHBondContact O-CB 3.42Å; T668-F671 PolarHBondContact O-N 3.11Å
669	E	87.3	Confident	86	Confident	35 Å²	35	23.9 Å²	23.9	16%	0.164	13%	0.127	C	C	.	.	H	α-helix	trans	-44.4	-36	177.4	-177	170.4	-157.9	0	0	113.9	F580 F671 A672 M673 K689 M706	F580-E669 HydrophobicContact CE1-CB 4.36Å; E669-F671 PolarHBondContact O-N 3.39Å; E669-A672 WeakPolarHBondContact O-CB 3.42Å; E669-A672 PolarHBondContact O-N 2.84Å; E669-M673 HydrophobicContact CG-SD 4.3Å; E669-M673 PolarHBondContact O-N 2.81Å; E669-K689 IonicContact OE1-NZ 2.85Å; E669-K689 PolarHBondContact OE1-NZ 2.76Å; E669-K689 IonicContact OE2-NZ 3.44Å; E669-K689 PolarHBondContact OE2-NZ 2.95Å; E669-M706 HydrophobicContact CB-SD 4.46Å; E669-M706 HydrophobicContact CG-SD 4.36Å
670	T	83.8	Confident	86.1	Confident	64 Å²	64	21.3 Å²	21.3	39%	0.393	12%	0.117	S	C	.	.	H	α-helix	trans	-51.6	-26.1	174.7	55.2	0	0	0	0	115.2	T668 G674	T668-T670 PolarHBondContact O-N 2.86Å; T668-T670 PolarHBondContact OG1-OG1 3.26Å; T670-G674 WeakPolarHBondContact O-CA 3.31Å; T670-G674 PolarHBondContact O-N 3.2Å
671	F	88	Confident	86.4	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-73.4	-41.9	174.7	-179.8	-100.2	0	0	0	111.9	V576 F578 H641 F657 L665 A667 T668 E669 M673 V675 M677	V576-F671 HydrophobicContact CG1-CD1 4.08Å; V576-F671 HydrophobicContact CG1-CE1 4.15Å; V576-F671 HydrophobicContact CG2-CE1 4.01Å; F578-F671 HydrophobicContact CE1-CB 4.44Å; F578-F671 HydrophobicContact CE1-CD1 4.28Å; F578-F671 HydrophobicContact CZ-CD1 4.35Å; H641-F671 AromaticContact CD2-CD2 3.95Å; H641-F671 AromaticContact CE1-CD2 3.8Å; H641-F671 AromaticContact CG-CD2 3.91Å; H641-F671 AromaticContact ND1-CD2 3.87Å; H641-F671 AromaticContact NE2-CD2 3.88Å; F657-F671 HydrophobicContact CD1-CZ 4.18Å; F657-F671 HydrophobicContact CE1-CZ 4.19Å; L665-F671 HydrophobicContact CD2-CD1 4.22Å; L665-F671 HydrophobicContact CD2-CD2 4.02Å; L665-F671 HydrophobicContact CD2-CE1 3.78Å; L665-F671 HydrophobicContact CD2-CE2 3.56Å; L665-F671 HydrophobicContact CD2-CG 4.33Å; L665-F671 HydrophobicContact CD2-CZ 3.43Å; L665-F671 VanDerWaalsContact CD2-CZ 3.43Å; A667-F671 HydrophobicContact CB-CB 3.73Å; A667-F671 HydrophobicContact CB-CD1 4.21Å; A667-F671 HydrophobicContact CB-CG 4.04Å; T668-F671 WeakPolarHBondContact O-CB 3.42Å; T668-F671 PolarHBondContact O-N 3.11Å; E669-F671 PolarHBondContact O-N 3.39Å; F671-M673 PolarHBondContact O-N 2.97Å; F671-V675 HydrophobicContact CD2-CG2 4.45Å; F671-M677 HydrophobicContact CZ-CB 3.86Å
672	A	81.6	Confident	86.6	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-64.7	-31.1	177.5	0	0	0	0	0	112.4	F578 E669 M706 R709	F578-A672 HydrophobicContact CE1-CB 3.81Å; F578-A672 HydrophobicContact CZ-CB 3.66Å; E669-A672 WeakPolarHBondContact O-CB 3.42Å; E669-A672 PolarHBondContact O-N 2.84Å; A672-M706 HydrophobicContact CB-CB 4.28Å; A672-M706 HydrophobicContact CB-CG 3.55Å; A672-R709 HydrophobicContact CB-CG 4.36Å; A672-R709 VanDerWaalsContact O-CZ 3.29Å; A672-R709 PolarHBondContact O-NE 3.28Å; A672-R709 PolarHBondContact O-NH2 3.1Å
673	M	71.8	Confident	86.6	Confident	48 Å²	48	19.7 Å²	19.7	24%	0.236	10%	0.103	C	C	.	.	H	α-helix	trans	-85.8	-42.7	178	-55.5	-178	102.9	0	0	113.1	Y433 E669 F671	Y433-M673 HydrophobicContact CE1-CE 4.04Å; Y433-M673 WeakPolarHBondContact OH-CB 3.29Å; Y433-M673 WeakPolarHBondContact OH-CE 3.49Å; E669-M673 HydrophobicContact CG-SD 4.3Å; E669-M673 PolarHBondContact O-N 2.81Å; F671-M673 PolarHBondContact O-N 2.97Å
674	G	61.3	Low	86.7	Confident	5 Å²	5	17.9 Å²	17.9	5%	0.052	10%	0.095	C	C	.	.	H	α-helix	trans	-91	-10.9	-162.1	0	0	0	0	0	117.4	T670	T670-G674 WeakPolarHBondContact O-CA 3.31Å; T670-G674 PolarHBondContact O-N 3.2Å
675	V	68.4	Low	86.6	Confident	6 Å²	6	18.1 Å²	18.1	4%	0.036	10%	0.096	C	C	.	.			trans	-145.1	139.4	-173.6	-159.3	0	0	0	0	111	Q374 E654 F671 M677 R709	Q374-V675 VanDerWaalsContact OE1-CG1 3.28Å; E654-V675 HydrophobicContact CG-CG1 4.41Å; E654-V675 HydrophobicContact CG-CG2 4.2Å; F671-V675 HydrophobicContact CD2-CG2 4.45Å; V675-M677 HydrophobicContact CG1-CE 3.66Å; V675-M677 HydrophobicContact CG1-CG 3.82Å; V675-M677 HydrophobicContact CG1-SD 3.79Å; V675-M677 PolarHBondContact O-N 3.19Å; V675-M677 VanDerWaalsContact O-N 3.17Å; V675-R709 PolarHBondContact O-NH2 3.19Å
676	N	71.8	Confident	86.4	Confident	67 Å²	67	19.5 Å²	19.5	36%	0.358	11%	0.106	S	C	.	.			trans	-87.6	76.4	176.2	-171.1	39.4	0	0	0	112.2	R709	N676-R709 PolarHBondContact OD1-NH1 3.4Å
677	M	81.8	Confident	86.2	Confident	10 Å²	10	19.6 Å²	19.6	5%	0.049	11%	0.106	C	C	.	.			trans	-129.1	102.3	-179.2	-72.4	-177.7	-175.9	0	0	112.3	E654 F657 F671 V675	E654-M677 HydrophobicContact CB-CE 3.73Å; E654-M677 HydrophobicContact CB-SD 3.9Å; E654-M677 HydrophobicContact CG-SD 4.4Å; E654-M677 VanDerWaalsContact O-CE 3.27Å; E654-M677 WeakPolarHBondContact O-CE 3.23Å; F657-M677 HydrophobicContact CD1-CB 3.91Å; F657-M677 HydrophobicContact CD1-CG 4.46Å; F657-M677 HydrophobicContact CD1-SD 4.15Å; F657-M677 HydrophobicContact CE1-CB 4.01Å; F671-M677 HydrophobicContact CZ-CB 3.86Å; V675-M677 HydrophobicContact CG1-CE 3.66Å; V675-M677 HydrophobicContact CG1-CG 3.82Å; V675-M677 HydrophobicContact CG1-SD 3.79Å; V675-M677 PolarHBondContact O-N 3.19Å; V675-M677 VanDerWaalsContact O-N 3.17Å
678	P	83.4	Confident	86	Confident	50 Å²	50	25.6 Å²	25.6	33%	0.325	13%	0.129	S	C	.	.			trans	-79.4	145.9	177.8	31.4	-33.4	0	0	0	112.5	R709 R712	P678-R709 CarbonylContact C-O 3.56Å; P678-R709 WeakPolarHBondContact CA-O 3.35Å; P678-R712 HydrophobicContact CB-CG 3.95Å; P678-R712 HydrophobicContact CG-CG 4.05Å
679	A	91.8	Very high	85.8	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.129	C	C	.	.	B	Isolated β-bridge	trans	-113.8	163.1	177.3	0	0	0	0	0	110.7	V576 F657 R709 A710 G711	V576-A679 HydrophobicContact CB-CB 4.25Å; V576-A679 HydrophobicContact CG2-CB 3.61Å; F657-A679 HydrophobicContact CZ-CB 3.98Å; A679-R709 PolarHBondContact N-O 2.85Å; A679-A710 CarbonylContact O-C 3.41Å; A679-A710 WeakPolarHBondContact O-CA 3.4Å; A679-G711 PolarHBondContact O-N 3.09Å
680	R	93.1	Very high	85.8	Confident	75 Å²	75	28.7 Å²	28.7	28%	0.283	14%	0.142	S	C	.	.	S	Bend	trans	-75.9	-40	171.9	-176.7	166.7	-179.2	175.8	11	111.1	Q571 P574 D716 T720	Q571-R680 PolarHBondContact O-NH1 3.45Å; P574-R680 PolarHBondContact O-N 2.84Å; R680-D716 WeakPolarHBondContact CD-OD1 3.29Å; R680-D716 IonicContact NE-OD1 3.13Å; R680-T720 PolarHBondContact O-N 2.98Å
681	T	95.4	Very high	85.6	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	137.5	179.4	-54.3	0	0	0	0	111.5	L567 Q572 P574 V575 V576 V683 T720 I722	L567-T681 HydrophobicContact CD1-CG2 4.25Å; L567-T681 HydrophobicContact CD2-CG2 4.42Å; Q572-T681 WeakPolarHBondContact O-CB 3.3Å; Q572-T681 PolarHBondContact O-OG1 3.49Å; P574-T681 PolarHBondContact O-N 3.26Å; V575-T681 WeakPolarHBondContact CA-O 3.29Å; V575-T681 HydrophobicContact CG1-CG2 4.43Å; V576-T681 PolarHBondContact N-O 2.96Å; T681-V683 HydrophobicContact CG2-CG2 4.17Å; T681-T720 CarbonylContact C-O 3.51Å; T681-T720 VanDerWaalsContact CA-O 3.27Å; T681-T720 WeakPolarHBondContact CA-O 3.38Å; T681-T720 HydrophobicContact CG2-CG2 4.06Å; T681-I722 HydrophobicContact CG2-CD1 3.67Å; T681-I722 HydrophobicContact CG2-CG1 4.17Å
682	V	96	Very high	85	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	135	168.1	169.6	0	0	0	0	109.6	V576 F578 F684 R709 A710 T720 V721 I722	V576-V682 CarbonylContact O-C 3.53Å; V576-V682 WeakPolarHBondContact O-CA 3.24Å; F578-V682 HydrophobicContact CD2-CG1 3.59Å; F578-V682 HydrophobicContact CE2-CG1 3.64Å; F578-V682 HydrophobicContact CE2-CG2 4.35Å; V682-F684 HydrophobicContact CG1-CD2 4.28Å; V682-F684 HydrophobicContact CG1-CE2 3.83Å; V682-F684 HydrophobicContact CG1-CZ 4.26Å; V682-R709 HydrophobicContact CG2-CB 4.19Å; V682-A710 HydrophobicContact CB-CB 4.08Å; V682-A710 HydrophobicContact CG2-CB 3.75Å; V682-T720 PolarHBondContact N-O 3.03Å; V682-V721 CarbonylContact O-C 3.58Å; V682-V721 WeakPolarHBondContact O-CA 3.48Å; V682-I722 PolarHBondContact O-N 2.81Å
683	V	96.4	Very high	84.9	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	132.2	178.3	-174.4	0	0	0	0	109.4	W560 L563 L567 V575 V576 A577 F578 T681 I722 L724	W560-V683 HydrophobicContact CH2-CB 4.2Å; W560-V683 HydrophobicContact CH2-CG1 3.63Å; W560-V683 HydrophobicContact CZ3-CB 4.34Å; W560-V683 HydrophobicContact CZ3-CG1 3.85Å; L563-V683 HydrophobicContact CD2-CG1 4.02Å; L563-V683 HydrophobicContact CD2-CG2 4.29Å; L567-V683 HydrophobicContact CD1-CG2 4.5Å; V575-V683 HydrophobicContact CG1-CG2 3.55Å; V576-V683 PolarHBondContact O-N 3.12Å; A577-V683 CarbonylContact C-O 3.48Å; A577-V683 WeakPolarHBondContact CA-O 3.37Å; F578-V683 PolarHBondContact N-O 3.05Å; T681-V683 HydrophobicContact CG2-CG2 4.17Å; V683-I722 CarbonylContact C-O 3.54Å; V683-I722 VanDerWaalsContact CA-O 3.3Å; V683-I722 WeakPolarHBondContact CA-O 3.41Å; V683-I722 HydrophobicContact CG1-CB 4.46Å; V683-I722 HydrophobicContact CG2-CB 4.25Å; V683-I722 HydrophobicContact CG2-CD1 4.33Å; V683-L724 HydrophobicContact CG1-CD1 4.27Å; V683-L724 HydrophobicContact CG1-CD2 3.8Å; V683-L724 HydrophobicContact CG1-CG 3.81Å
684	F	95.6	Very high	85.5	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	119.5	173.1	-70.2	-89.2	0	0	0	110.2	F578 F580 V682 S686 L698 Y703 M706 A707 V721 I722 I723 L724	F578-F684 HydrophobicContact CB-CD1 4.23Å; F578-F684 HydrophobicContact CB-CE1 4.48Å; F578-F684 HydrophobicContact CD2-CE1 4.31Å; F578-F684 HydrophobicContact CD2-CZ 4.5Å; F580-F684 HydrophobicContact CZ-CD1 4.4Å; V682-F684 HydrophobicContact CG1-CD2 4.28Å; V682-F684 HydrophobicContact CG1-CE2 3.83Å; V682-F684 HydrophobicContact CG1-CZ 4.26Å; F684-S686 VanDerWaalsContact C-N 3.26Å; F684-S686 PolarHBondContact O-N 3.43Å; F684-L698 HydrophobicContact CD1-CD1 4.27Å; F684-L698 HydrophobicContact CE1-CD1 4.23Å; F684-Y703 AromaticContact CD2-CE2 3.9Å; F684-Y703 HydrophobicContact CD2-CE2 3.9Å; F684-Y703 AromaticContact CE1-CD2 3.95Å; F684-Y703 HydrophobicContact CE1-CD2 3.95Å; F684-Y703 HydrophobicContact CE1-CE2 4.16Å; F684-Y703 AromaticContact CE2-CD2 3.96Å; F684-Y703 HydrophobicContact CE2-CD2 3.96Å; F684-Y703 AromaticContact CE2-CE2 3.39Å; F684-Y703 HydrophobicContact CE2-CE2 3.39Å; F684-Y703 HydrophobicContact CG-CE2 4.46Å; F684-Y703 AromaticContact CZ-CD2 3.58Å; F684-Y703 HydrophobicContact CZ-CD2 3.58Å; F684-Y703 AromaticContact CZ-CE2 3.53Å; F684-Y703 HydrophobicContact CZ-CE2 3.53Å; F684-M706 HydrophobicContact CE1-CB 3.74Å; F684-M706 HydrophobicContact CE1-CE 4.08Å; F684-M706 HydrophobicContact CE1-CG 4.44Å; F684-M706 HydrophobicContact CE1-SD 3.89Å; F684-M706 HydrophobicContact CZ-CB 3.64Å; F684-A707 HydrophobicContact CE2-CB 4.24Å; F684-A707 HydrophobicContact CZ-CB 4.27Å; F684-V721 HydrophobicContact CD2-CG1 4.06Å; F684-V721 HydrophobicContact CE2-CG1 3.7Å; F684-I722 PolarHBondContact N-O 2.75Å; F684-I723 HydrophobicContact CB-CG1 4.41Å; F684-I723 HydrophobicContact CD2-CG1 4.36Å; F684-L724 WeakPolarHBondContact O-CB 3.44Å; F684-L724 WeakPolarHBondContact O-CG 3.43Å; F684-L724 PolarHBondContact O-N 3.26Å
685	D	92.5	Very high	86.8	Confident	6 Å²	6	45.5 Å²	45.5	3%	0.032	25%	0.248	C	C	.	.	S	Bend	trans	-68.8	-26.9	176.9	-169.3	82.7	0	0	0	112.7	W560 F578 T579 R584 N588 K726	W560-D685 HydrophobicContact CZ2-CB 4.29Å; W560-D685 VanDerWaalsContact CZ2-OD1 3.32Å; W560-D685 WeakPolarHBondContact CZ2-OD1 3.31Å; W560-D685 PolarHBondContact NE1-OD1 2.95Å; F578-D685 WeakPolarHBondContact O-CB 3.3Å; F578-D685 PolarHBondContact O-N 3.47Å; T579-D685 HydrophobicContact CG2-CB 4.19Å; R584-D685 IonicContact CZ-OD2 3.29Å; R584-D685 IonicContact NE-OD2 3.03Å; R584-D685 PolarHBondContact NE-OD2 3.43Å; R584-D685 IonicContact NH1-OD2 3.87Å; R584-D685 PolarHBondContact NH1-OD2 3.04Å; R584-D685 IonicContact NH2-OD2 2.94Å; N588-D685 PolarHBondContact ND2-OD1 2.93Å; D685-K726 WeakPolarHBondContact OD1-CE 3.4Å; D685-K726 IonicContact OD1-NZ 2.91Å; D685-K726 PolarHBondContact OD1-NZ 3.39Å; D685-K726 IonicContact OD2-NZ 3.12Å; D685-K726 PolarHBondContact OD2-NZ 2.82Å
686	S	90.9	Very high	87.9	Confident	29 Å²	29	48.4 Å²	48.4	20%	0.203	26%	0.258	C	S	.	.			trans	-155.4	161.2	-177.1	176.7	0	0	0	0	109	F580 F684 R688	F580-S686 WeakPolarHBondContact CE2-O 3.43Å; F684-S686 VanDerWaalsContact C-N 3.26Å; F684-S686 PolarHBondContact O-N 3.43Å; S686-R688 PolarHBondContact OG-N 3.05Å; S686-R688 PolarHBondContact OG-O 3.06Å
687	I	91.6	Very high	88.9	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.01	25%	0.253	C	S	.	.	S	Bend	trans	-104.6	3.4	164.9	66.9	169.2	0	0	0	112.9	N697 L698 I723 H730 D734 L735 M738	I687-N697 WeakPolarHBondContact O-CA 3.45Å; I687-L698 PolarHBondContact O-N 2.91Å; I687-I723 HydrophobicContact CG2-CD1 4.44Å; I687-I723 HydrophobicContact CG2-CG2 3.72Å; I687-H730 HydrophobicContact CD1-CB 3.68Å; I687-H730 VanDerWaalsContact CD1-CG 3.46Å; I687-D734 HydrophobicContact CD1-CB 4.45Å; I687-L735 HydrophobicContact CD1-CD2 4.25Å; I687-M738 HydrophobicContact CB-SD 4.02Å; I687-M738 HydrophobicContact CG2-CE 3.96Å; I687-M738 HydrophobicContact CG2-SD 4.05Å
688	R	90.6	Very high	89.3	Confident	126 Å²	126	47.2 Å²	47.2	48%	0.475	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	135.3	178.5	-71.9	-179.1	-179.4	-179.8	3.7	111.2	F580 S686 R696 N697 D734	F580-R688 WeakPolarHBondContact CD2-O 3.42Å; S686-R688 PolarHBondContact OG-N 3.05Å; S686-R688 PolarHBondContact OG-O 3.06Å; R688-R696 CarbonylContact C-O 3.59Å; R688-R696 WeakPolarHBondContact CA-O 3.4Å; R688-N697 WeakPolarHBondContact CG-OD1 3.34Å; R688-N697 PolarHBondContact NE-OD1 3.14Å; R688-D734 IonicContact NH2-OD2 3.93Å
689	K	89.9	Confident	89.7	Confident	20 Å²	20	48.3 Å²	48.3	9%	0.087	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	166.3	173.1	72.4	171	179.6	175.7	0	111.1	F580 E669 D691 F695 R696 L698 E702	F580-K689 HydrophobicContact CB-CB 3.78Å; F580-K689 HydrophobicContact CD1-CB 3.99Å; F580-K689 HydrophobicContact CD1-CD 4.45Å; F580-K689 HydrophobicContact CD2-CB 4.06Å; F580-K689 HydrophobicContact CG-CB 3.65Å; E669-K689 IonicContact OE1-NZ 2.85Å; E669-K689 PolarHBondContact OE1-NZ 2.76Å; E669-K689 IonicContact OE2-NZ 3.44Å; E669-K689 PolarHBondContact OE2-NZ 2.95Å; K689-D691 WeakPolarHBondContact CE-OD1 3.43Å; K689-F695 CarbonylContact O-C 3.55Å; K689-F695 VanDerWaalsContact O-CA 3.29Å; K689-F695 WeakPolarHBondContact O-CA 3.29Å; K689-R696 PolarHBondContact N-O 3.18Å; K689-R696 PolarHBondContact O-N 3.05Å; K689-L698 HydrophobicContact CB-CD2 4.4Å; K689-L698 HydrophobicContact CD-CD2 3.85Å; K689-L698 HydrophobicContact CG-CD2 4.01Å; K689-E702 WeakPolarHBondContact CE-OE1 3.44Å; K689-E702 WeakPolarHBondContact CE-OE2 3.36Å; K689-E702 IonicContact NZ-OE1 2.78Å; K689-E702 PolarHBondContact NZ-OE1 2.95Å; K689-E702 IonicContact NZ-OE2 3.71Å
690	H	86.4	Confident	89.6	Confident	95 Å²	95	49.3 Å²	49.3	44%	0.44	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	119.3	178.1	-174.2	-93.8	0	0	0	109.9	G692 G694 F695	H690-G692 VanDerWaalsContact C-N 3.3Å; H690-G692 VanDerWaalsContact CE1-C 3.42Å; H690-G692 VanDerWaalsContact CE1-CA 3.47Å; H690-G692 WeakPolarHBondContact CE1-CA 3.48Å; H690-G692 PolarHBondContact CE1-O 3.06Å; H690-G692 PolarHBondContact ND1-N 2.89Å; H690-G692 PolarHBondContact O-N 2.85Å; H690-G694 WeakPolarHBondContact CA-O 3.28Å; H690-G694 VanDerWaalsContact CD2-C 3.48Å; H690-F695 HydrophobicContact CB-CD1 4.06Å; H690-F695 HydrophobicContact CB-CE1 3.84Å; H690-F695 HydrophobicContact CB-CE2 4.48Å; H690-F695 HydrophobicContact CB-CG 4.49Å; H690-F695 HydrophobicContact CB-CZ 4.06Å; H690-F695 AromaticContact CD2-CD2 3.78Å; H690-F695 AromaticContact CD2-CE2 3.74Å
691	D	78.8	Confident	89.2	Confident	77 Å²	77	46.6 Å²	46.6	41%	0.412	26%	0.257	S	S	.	.			trans	-90.7	9.8	-174.3	-89.5	41.7	0	0	0	113.4	K689 G694 R696	K689-D691 WeakPolarHBondContact CE-OD1 3.43Å; D691-G694 PolarHBondContact N-O 2.95Å; D691-R696 IonicContact OD1-CZ 2.66Å; D691-R696 IonicContact OD1-NE 2.61Å; D691-R696 PolarHBondContact OD1-NE 3.19Å; D691-R696 IonicContact OD1-NH2 3.63Å; D691-R696 PolarHBondContact OD1-NH2 2.6Å; D691-R696 IonicContact OD2-CZ 3.61Å; D691-R696 IonicContact OD2-NE 2.93Å; D691-R696 PolarHBondContact OD2-NE 3.42Å; D691-R696 IonicContact OD2-NH2 3.58Å; D691-R696 PolarHBondContact OD2-NH2 3.44Å
692	G	75.6	Confident	88.9	Confident	61 Å²	61	48 Å²	48	63%	0.629	26%	0.264	S	S	*	.	S	Bend	trans	99.2	-35.3	-176.4	0	0	0	0	0	112.8	H690	H690-G692 VanDerWaalsContact C-N 3.3Å; H690-G692 VanDerWaalsContact CE1-C 3.42Å; H690-G692 VanDerWaalsContact CE1-CA 3.47Å; H690-G692 WeakPolarHBondContact CE1-CA 3.48Å; H690-G692 PolarHBondContact CE1-O 3.06Å; H690-G692 PolarHBondContact ND1-N 2.89Å; H690-G692 PolarHBondContact O-N 2.85Å
693	T	79.1	Confident	88.7	Confident	144 Å²	144	48.1 Å²	48.1	88%	0.883	26%	0.264	S	S	*	.	S	Bend	trans	-94.5	-32	175.2	54.3	0	0	0	0	113.6
694	G	86.1	Confident	88.4	Confident	28 Å²	28	49.8 Å²	49.8	29%	0.289	27%	0.273	S	S	.	.	S	Bend	trans	-178	179.9	-179.1	0	0	0	0	0	113.3	H690 D691	H690-G694 WeakPolarHBondContact CA-O 3.28Å; H690-G694 VanDerWaalsContact CD2-C 3.48Å; D691-G694 PolarHBondContact N-O 2.95Å
695	F	87.4	Confident	88	Confident	160 Å²	160	50.7 Å²	50.7	70%	0.702	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	125.7	177.6	-77.8	-85.6	0	0	0	112	K689 H690	K689-F695 CarbonylContact O-C 3.55Å; K689-F695 VanDerWaalsContact O-CA 3.29Å; K689-F695 WeakPolarHBondContact O-CA 3.29Å; H690-F695 HydrophobicContact CB-CD1 4.06Å; H690-F695 HydrophobicContact CB-CE1 3.84Å; H690-F695 HydrophobicContact CB-CE2 4.48Å; H690-F695 HydrophobicContact CB-CG 4.49Å; H690-F695 HydrophobicContact CB-CZ 4.06Å; H690-F695 AromaticContact CD2-CD2 3.78Å; H690-F695 AromaticContact CD2-CE2 3.74Å
696	R	92	Very high	88	Confident	66 Å²	66	50.4 Å²	50.4	25%	0.249	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	164.7	172.1	66.8	156.3	174.8	88.1	-2.9	112.4	R688 K689 D691 E702	R688-R696 CarbonylContact C-O 3.59Å; R688-R696 WeakPolarHBondContact CA-O 3.4Å; K689-R696 PolarHBondContact N-O 3.18Å; K689-R696 PolarHBondContact O-N 3.05Å; D691-R696 IonicContact OD1-CZ 2.66Å; D691-R696 IonicContact OD1-NE 2.61Å; D691-R696 PolarHBondContact OD1-NE 3.19Å; D691-R696 IonicContact OD1-NH2 3.63Å; D691-R696 PolarHBondContact OD1-NH2 2.6Å; D691-R696 IonicContact OD2-CZ 3.61Å; D691-R696 IonicContact OD2-NE 2.93Å; D691-R696 PolarHBondContact OD2-NE 3.42Å; D691-R696 IonicContact OD2-NH2 3.58Å; D691-R696 PolarHBondContact OD2-NH2 3.44Å; R696-E702 IonicContact CZ-OE1 2.71Å; R696-E702 IonicContact CZ-OE2 3.81Å; R696-E702 IonicContact NH1-OE1 3.02Å; R696-E702 PolarHBondContact NH1-OE1 3.46Å; R696-E702 IonicContact NH1-OE2 3.29Å; R696-E702 PolarHBondContact NH1-OE2 2.99Å; R696-E702 IonicContact NH2-OE1 3.85Å; R696-E702 PolarHBondContact NH2-OE1 3.32Å; R696-E702 IonicContact NH2-OE2 2.7Å
697	N	91.6	Very high	88	Confident	46 Å²	46	49.1 Å²	49.1	25%	0.246	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	155.8	167.7	-67.7	-19.5	0	0	0	110.6	I687 R688 D734	I687-N697 WeakPolarHBondContact O-CA 3.45Å; R688-N697 WeakPolarHBondContact CG-OD1 3.34Å; R688-N697 PolarHBondContact NE-OD1 3.14Å; N697-D734 PolarHBondContact ND2-OD1 3.44Å; N697-D734 PolarHBondContact ND2-OD2 2.67Å
698	L	91.9	Very high	87.9	Confident	7 Å²	7	49.2 Å²	49.2	4%	0.037	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-63.9	141.4	172.2	-65.5	171.6	0	0	0	111.6	F580 F684 I687 K689 M706 M738	F580-L698 HydrophobicContact CE1-CD2 3.98Å; F580-L698 HydrophobicContact CE2-CD1 3.93Å; F580-L698 HydrophobicContact CE2-CD2 4.11Å; F580-L698 HydrophobicContact CE2-CG 4.33Å; F580-L698 HydrophobicContact CZ-CD1 3.66Å; F580-L698 HydrophobicContact CZ-CD2 3.67Å; F580-L698 HydrophobicContact CZ-CG 4.17Å; F684-L698 HydrophobicContact CD1-CD1 4.27Å; F684-L698 HydrophobicContact CE1-CD1 4.23Å; I687-L698 PolarHBondContact O-N 2.91Å; K689-L698 HydrophobicContact CB-CD2 4.4Å; K689-L698 HydrophobicContact CD-CD2 3.85Å; K689-L698 HydrophobicContact CG-CD2 4.01Å; L698-M706 HydrophobicContact CD1-CE 3.94Å; L698-M706 HydrophobicContact CD2-CE 3.88Å; L698-M706 HydrophobicContact CG-CE 4.5Å; L698-M738 HydrophobicContact CB-CG 4.3Å; L698-M738 HydrophobicContact CB-SD 4.02Å; L698-M738 HydrophobicContact CD1-SD 4.19Å
699	L	90.3	Very high	87.8	Confident	73 Å²	73	43.6 Å²	43.6	38%	0.382	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-74.7	153.9	171	-66.5	170.9	0	0	0	110.3	G701 E702 Y703 T744	L699-G701 VanDerWaalsContact C-N 3.26Å; L699-G701 PolarHBondContact O-N 2.7Å; L699-E702 HydrophobicContact CB-CG 4.04Å; L699-E702 PolarHBondContact N-OE2 2.84Å; L699-E702 PolarHBondContact O-N 3.08Å; L699-E702 VanDerWaalsContact O-N 3.17Å; L699-Y703 PolarHBondContact O-N 3.49Å; L699-T744 HydrophobicContact CD1-CG2 4.27Å
700	P	90.4	Very high	87.9	Confident	20 Å²	20	42.9 Å²	42.9	13%	0.13	24%	0.244	C	C	.	.	H	α-helix	trans	-57.6	-38.4	-179.6	-25	34.7	0	0	0	113	Y703 I704 A737 M738	P700-Y703 PolarHBondContact O-N 3.46Å; P700-I704 WeakPolarHBondContact O-CB 3.31Å; P700-I704 WeakPolarHBondContact O-CD1 3.44Å; P700-I704 WeakPolarHBondContact O-CG1 3.42Å; P700-I704 PolarHBondContact O-N 2.82Å; P700-A737 WeakPolarHBondContact CG-O 3.28Å; P700-M738 WeakPolarHBondContact CA-O 3.37Å
701	G	85.6	Confident	88.1	Confident	19 Å²	19	38.4 Å²	38.4	20%	0.196	22%	0.224	C	C	.	.	H	α-helix	trans	-62.1	-47.3	176.2	0	0	0	0	0	113.3	L699 Y703 I704 Q705	L699-G701 VanDerWaalsContact C-N 3.26Å; L699-G701 PolarHBondContact O-N 2.7Å; G701-Y703 VanDerWaalsContact C-N 3.35Å; G701-Y703 PolarHBondContact O-N 3.42Å; G701-I704 PolarHBondContact O-N 2.96Å; G701-Q705 WeakPolarHBondContact O-CB 3.44Å; G701-Q705 PolarHBondContact O-N 3.21Å
702	E	88.9	Confident	88.5	Confident	29 Å²	29	37.6 Å²	37.6	14%	0.136	22%	0.215	C	C	.	.	H	α-helix	trans	-59.5	-46.5	177.4	-59.5	171.2	154.6	0	0	110.6	K689 R696 L699 Q705 M706	K689-E702 WeakPolarHBondContact CE-OE1 3.44Å; K689-E702 WeakPolarHBondContact CE-OE2 3.36Å; K689-E702 IonicContact NZ-OE1 2.78Å; K689-E702 PolarHBondContact NZ-OE1 2.95Å; K689-E702 IonicContact NZ-OE2 3.71Å; R696-E702 IonicContact CZ-OE1 2.71Å; R696-E702 IonicContact CZ-OE2 3.81Å; R696-E702 IonicContact NH1-OE1 3.02Å; R696-E702 PolarHBondContact NH1-OE1 3.46Å; R696-E702 IonicContact NH1-OE2 3.29Å; R696-E702 PolarHBondContact NH1-OE2 2.99Å; R696-E702 IonicContact NH2-OE1 3.85Å; R696-E702 PolarHBondContact NH2-OE1 3.32Å; R696-E702 IonicContact NH2-OE2 2.7Å; L699-E702 HydrophobicContact CB-CG 4.04Å; L699-E702 PolarHBondContact N-OE2 2.84Å; L699-E702 PolarHBondContact O-N 3.08Å; L699-E702 VanDerWaalsContact O-N 3.17Å; E702-Q705 PolarHBondContact O-N 2.95Å; E702-M706 HydrophobicContact CB-CE 4.07Å; E702-M706 VanDerWaalsContact O-CE 3.27Å; E702-M706 WeakPolarHBondContact O-CE 3.42Å; E702-M706 PolarHBondContact O-N 3.4Å
703	Y	91.9	Very high	89	Confident	3 Å²	3	39.8 Å²	39.8	1%	0.012	20%	0.204	C	C	.	.	H	α-helix	trans	-62.8	-47.6	176.5	-176.9	-102.7	0	0	0	112.2	H495 F684 L699 P700 G701 Q705 M706 A707 I723 M738 M739	H495-Y703 AromaticContact CE1-CE1 3.83Å; H495-Y703 AromaticContact ND1-CE1 3.87Å; H495-Y703 AromaticContact ND1-CZ 3.76Å; H495-Y703 PolarHBondContact ND1-OH 3.11Å; F684-Y703 AromaticContact CD2-CE2 3.9Å; F684-Y703 HydrophobicContact CD2-CE2 3.9Å; F684-Y703 AromaticContact CE1-CD2 3.95Å; F684-Y703 HydrophobicContact CE1-CD2 3.95Å; F684-Y703 HydrophobicContact CE1-CE2 4.16Å; F684-Y703 AromaticContact CE2-CD2 3.96Å; F684-Y703 HydrophobicContact CE2-CD2 3.96Å; F684-Y703 AromaticContact CE2-CE2 3.39Å; F684-Y703 HydrophobicContact CE2-CE2 3.39Å; F684-Y703 HydrophobicContact CG-CE2 4.46Å; F684-Y703 AromaticContact CZ-CD2 3.58Å; F684-Y703 HydrophobicContact CZ-CD2 3.58Å; F684-Y703 AromaticContact CZ-CE2 3.53Å; F684-Y703 HydrophobicContact CZ-CE2 3.53Å; L699-Y703 PolarHBondContact O-N 3.49Å; P700-Y703 PolarHBondContact O-N 3.46Å; G701-Y703 VanDerWaalsContact C-N 3.35Å; G701-Y703 PolarHBondContact O-N 3.42Å; Y703-Q705 VanDerWaalsContact C-N 3.28Å; Y703-Q705 PolarHBondContact O-N 3.25Å; Y703-M706 PolarHBondContact O-N 3.12Å; Y703-A707 HydrophobicContact CE1-CB 4.22Å; Y703-A707 WeakPolarHBondContact O-CB 3.15Å; Y703-A707 PolarHBondContact O-N 3.15Å; Y703-I723 HydrophobicContact CE2-CD1 4.43Å; Y703-M738 HydrophobicContact CD1-CG 4.3Å; Y703-M738 HydrophobicContact CD2-CE 3.63Å; Y703-M738 HydrophobicContact CD2-CG 4.01Å; Y703-M738 HydrophobicContact CD2-SD 3.63Å; Y703-M738 HydrophobicContact CE1-CE 4.44Å; Y703-M738 HydrophobicContact CE2-CE 3.51Å; Y703-M738 HydrophobicContact CE2-SD 4.14Å; Y703-M738 HydrophobicContact CG-CE 4.15Å; Y703-M738 HydrophobicContact CG-CG 3.75Å; Y703-M738 HydrophobicContact CG-SD 4.03Å; Y703-M739 HydrophobicContact CD1-CG 4.35Å; Y703-M739 HydrophobicContact CE1-CB 4.3Å; Y703-M739 HydrophobicContact CE1-CG 3.71Å
704	I	89.3	Confident	89.2	Confident	34 Å²	34	36.7 Å²	36.7	17%	0.174	20%	0.202	C	C	.	.	H	α-helix	trans	-60.3	-36	178.9	-81.4	168.5	0	0	0	112.2	P700 G701 G708 P743	P700-I704 WeakPolarHBondContact O-CB 3.31Å; P700-I704 WeakPolarHBondContact O-CD1 3.44Å; P700-I704 WeakPolarHBondContact O-CG1 3.42Å; P700-I704 PolarHBondContact O-N 2.82Å; G701-I704 PolarHBondContact O-N 2.96Å; I704-G708 WeakPolarHBondContact O-CA 3.05Å; I704-G708 PolarHBondContact O-N 3.44Å; I704-P743 HydrophobicContact CD1-CG 4.14Å
705	Q	87.6	Confident	89.2	Confident	19 Å²	19	41.4 Å²	41.4	9%	0.089	22%	0.22	C	C	.	.	H	α-helix	trans	-73.3	-45.3	177.7	-167.1	-179.7	20.6	0	0	111.8	H432 G701 E702 Y703	H432-Q705 PolarHBondContact NE2-NE2 3.42Å; G701-Q705 WeakPolarHBondContact O-CB 3.44Å; G701-Q705 PolarHBondContact O-N 3.21Å; E702-Q705 PolarHBondContact O-N 2.95Å; Y703-Q705 VanDerWaalsContact C-N 3.28Å; Y703-Q705 PolarHBondContact O-N 3.25Å
706	M	91.4	Very high	89.3	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.005	19%	0.19	C	C	.	.	H	α-helix	trans	-67.4	-50.2	176.5	-76.8	-176.1	-81.6	0	0	112.5	F578 F580 E669 A672 F684 L698 E702 Y703 G708 R709	F578-M706 HydrophobicContact CB-SD 4.24Å; F578-M706 HydrophobicContact CD1-CG 4.37Å; F578-M706 HydrophobicContact CD1-SD 4.12Å; F578-M706 HydrophobicContact CD2-CB 3.91Å; F578-M706 HydrophobicContact CD2-CG 4.16Å; F578-M706 HydrophobicContact CD2-SD 4.24Å; F578-M706 HydrophobicContact CE1-CG 4.32Å; F578-M706 HydrophobicContact CE2-CB 3.8Å; F578-M706 HydrophobicContact CE2-CG 4.11Å; F578-M706 HydrophobicContact CG-CG 4.31Å; F578-M706 HydrophobicContact CG-SD 3.93Å; F578-M706 HydrophobicContact CZ-CB 4.32Å; F578-M706 HydrophobicContact CZ-CG 4.21Å; F580-M706 HydrophobicContact CE1-CE 3.92Å; F580-M706 HydrophobicContact CE1-SD 3.74Å; F580-M706 HydrophobicContact CZ-CE 3.9Å; F580-M706 HydrophobicContact CZ-SD 3.88Å; E669-M706 HydrophobicContact CB-SD 4.46Å; E669-M706 HydrophobicContact CG-SD 4.36Å; A672-M706 HydrophobicContact CB-CB 4.28Å; A672-M706 HydrophobicContact CB-CG 3.55Å; F684-M706 HydrophobicContact CE1-CB 3.74Å; F684-M706 HydrophobicContact CE1-CE 4.08Å; F684-M706 HydrophobicContact CE1-CG 4.44Å; F684-M706 HydrophobicContact CE1-SD 3.89Å; F684-M706 HydrophobicContact CZ-CB 3.64Å; L698-M706 HydrophobicContact CD1-CE 3.94Å; L698-M706 HydrophobicContact CD2-CE 3.88Å; L698-M706 HydrophobicContact CG-CE 4.5Å; E702-M706 HydrophobicContact CB-CE 4.07Å; E702-M706 VanDerWaalsContact O-CE 3.27Å; E702-M706 WeakPolarHBondContact O-CE 3.42Å; E702-M706 PolarHBondContact O-N 3.4Å; Y703-M706 PolarHBondContact O-N 3.12Å; M706-G708 VanDerWaalsContact C-N 3.25Å; M706-G708 PolarHBondContact O-N 3.39Å; M706-R709 WeakPolarHBondContact O-CB 3.36Å; M706-R709 PolarHBondContact O-N 2.69Å; M706-R709 VanDerWaalsContact O-N 3.13Å
707	A	91.9	Very high	89.3	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.008	21%	0.214	C	C	.	.	H	α-helix	trans	-63.7	-32.5	177.2	0	0	0	0	0	111.8	L493 F684 Y703 R709 A710 V721	L493-A707 HydrophobicContact CD1-CB 4.39Å; F684-A707 HydrophobicContact CE2-CB 4.24Å; F684-A707 HydrophobicContact CZ-CB 4.27Å; Y703-A707 HydrophobicContact CE1-CB 4.22Å; Y703-A707 WeakPolarHBondContact O-CB 3.15Å; Y703-A707 PolarHBondContact O-N 3.15Å; A707-R709 PolarHBondContact O-N 3.02Å; A707-A710 WeakPolarHBondContact O-CB 3.35Å; A707-A710 PolarHBondContact O-N 3.46Å; A707-V721 HydrophobicContact CB-CG1 4.19Å; A707-V721 HydrophobicContact CB-CG2 4.12Å
708	G	88.6	Confident	89.3	Confident	4 Å²	4	35.6 Å²	35.6	4%	0.041	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-1.3	173.5	0	0	0	0	0	115.6	I704 M706	I704-G708 WeakPolarHBondContact O-CA 3.05Å; I704-G708 PolarHBondContact O-N 3.44Å; M706-G708 VanDerWaalsContact C-N 3.25Å; M706-G708 PolarHBondContact O-N 3.39Å
709	R	89.2	Confident	89.4	Confident	9 Å²	9	35.3 Å²	35.3	3%	0.034	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-7.5	167.3	-59.2	-61.8	179.5	-172.3	0.1	113.2	A672 V675 N676 P678 A679 V682 M706 A707	A672-R709 HydrophobicContact CB-CG 4.36Å; A672-R709 VanDerWaalsContact O-CZ 3.29Å; A672-R709 PolarHBondContact O-NE 3.28Å; A672-R709 PolarHBondContact O-NH2 3.1Å; V675-R709 PolarHBondContact O-NH2 3.19Å; N676-R709 PolarHBondContact OD1-NH1 3.4Å; P678-R709 CarbonylContact C-O 3.56Å; P678-R709 WeakPolarHBondContact CA-O 3.35Å; A679-R709 PolarHBondContact N-O 2.85Å; V682-R709 HydrophobicContact CG2-CB 4.19Å; M706-R709 WeakPolarHBondContact O-CB 3.36Å; M706-R709 PolarHBondContact O-N 2.69Å; M706-R709 VanDerWaalsContact O-N 3.13Å; A707-R709 PolarHBondContact O-N 3.02Å
710	A	91.9	Very high	89.6	Confident	4 Å²	4	32.1 Å²	32.1	3%	0.033	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-81.7	142.9	171.3	0	0	0	0	0	111.7	L493 A679 V682 A707 V721	L493-A710 HydrophobicContact CD2-CB 4.02Å; L493-A710 VanDerWaalsContact CD2-O 3.31Å; L493-A710 WeakPolarHBondContact CD2-O 3.13Å; A679-A710 CarbonylContact O-C 3.41Å; A679-A710 WeakPolarHBondContact O-CA 3.4Å; V682-A710 HydrophobicContact CB-CB 4.08Å; V682-A710 HydrophobicContact CG2-CB 3.75Å; A707-A710 WeakPolarHBondContact O-CB 3.35Å; A707-A710 PolarHBondContact O-N 3.46Å; A710-V721 HydrophobicContact CB-CG2 3.88Å
711	G	90.1	Very high	89.9	Confident	2 Å²	2	31.1 Å²	31.1	2%	0.021	19%	0.191	C	C	.	.	S	Bend	trans	85.7	114.6	-179.8	0	0	0	0	0	113	A679	A679-G711 PolarHBondContact O-N 3.09Å
712	R	88.2	Confident	90.4	Very high	60 Å²	60	30.2 Å²	30.2	23%	0.226	18%	0.181	C	C	.	.			trans	-94.6	116.3	177.3	-59.5	167.4	-64.7	163.7	5.9	110	P678 G714 L715 D716	P678-R712 HydrophobicContact CB-CG 3.95Å; P678-R712 HydrophobicContact CG-CG 4.05Å; R712-G714 PolarHBondContact O-N 3.27Å; R712-L715 HydrophobicContact CB-CB 4.06Å; R712-L715 HydrophobicContact CB-CD1 4.16Å; R712-L715 PolarHBondContact O-N 3.37Å; R712-D716 VanDerWaalsContact CB-OD2 3.27Å; R712-D716 WeakPolarHBondContact CB-OD2 3.26Å; R712-D716 WeakPolarHBondContact CG-OD2 3.37Å; R712-D716 IonicContact CZ-OD1 3.73Å; R712-D716 IonicContact CZ-OD2 3.2Å; R712-D716 PolarHBondContact N-OD2 3.17Å; R712-D716 IonicContact NE-OD1 3.97Å; R712-D716 IonicContact NE-OD2 3.55Å; R712-D716 PolarHBondContact NE-OD2 3.22Å; R712-D716 IonicContact NH2-OD1 2.93Å; R712-D716 PolarHBondContact NH2-OD1 3.27Å; R712-D716 IonicContact NH2-OD2 2.74Å; R712-D716 PolarHBondContact NH2-OD2 3.11Å; R712-D716 PolarHBondContact O-N 3.4Å
713	R	86.2	Confident	90.7	Very high	106 Å²	106	28.9 Å²	28.9	40%	0.4	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.7	123.3	178.3	-173.6	176.8	-177.2	152.1	3.4	110.2	D318 A342 P490 V491 L715	D318-R713 IonicContact OD1-NH2 3.69Å; D318-R713 IonicContact OD2-CZ 3.82Å; D318-R713 IonicContact OD2-NH1 2.72Å; D318-R713 IonicContact OD2-NH2 2.61Å; D318-R713 PolarHBondContact OD2-NH2 3.45Å; A342-R713 PolarHBondContact O-NH1 2.88Å; P490-R713 HydrophobicContact CB-CG 4.29Å; V491-R713 HydrophobicContact CG2-CB 4.48Å; R713-L715 VanDerWaalsContact C-N 3.35Å; R713-L715 PolarHBondContact O-N 2.89Å
714	G	83.3	Confident	90.7	Very high	80 Å²	80	28.9 Å²	28.9	83%	0.825	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.2	-4.7	-179.8	0	0	0	0	0	116.3	R712	R712-G714 PolarHBondContact O-N 3.27Å
715	L	85.8	Confident	90.7	Very high	127 Å²	127	27.6 Å²	27.6	67%	0.665	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118.8	-40.1	177.3	-62.2	176.2	0	0	0	113.1	R712 R713	R712-L715 HydrophobicContact CB-CB 4.06Å; R712-L715 HydrophobicContact CB-CD1 4.16Å; R712-L715 PolarHBondContact O-N 3.37Å; R713-L715 VanDerWaalsContact C-N 3.35Å; R713-L715 PolarHBondContact O-N 2.89Å
716	D	89.9	Confident	90.4	Very high	16 Å²	16	28.2 Å²	28.2	9%	0.086	17%	0.171	C	C	.	.			trans	-111.5	137.4	-178	-53.8	-51	0	0	0	110.6	R680 R712	R680-D716 WeakPolarHBondContact CD-OD1 3.29Å; R680-D716 IonicContact NE-OD1 3.13Å; R712-D716 VanDerWaalsContact CB-OD2 3.27Å; R712-D716 WeakPolarHBondContact CB-OD2 3.26Å; R712-D716 WeakPolarHBondContact CG-OD2 3.37Å; R712-D716 IonicContact CZ-OD1 3.73Å; R712-D716 IonicContact CZ-OD2 3.2Å; R712-D716 PolarHBondContact N-OD2 3.17Å; R712-D716 IonicContact NE-OD1 3.97Å; R712-D716 IonicContact NE-OD2 3.55Å; R712-D716 PolarHBondContact NE-OD2 3.22Å; R712-D716 IonicContact NH2-OD1 2.93Å; R712-D716 PolarHBondContact NH2-OD1 3.27Å; R712-D716 IonicContact NH2-OD2 2.74Å; R712-D716 PolarHBondContact NH2-OD2 3.11Å; R712-D716 PolarHBondContact O-N 3.4Å
717	A	90.4	Very high	89.6	Confident	90 Å²	90	32 Å²	32	74%	0.744	20%	0.198	S	C	*	.	S	Bend	trans	-79.3	-36.9	177.6	0	0	0	0	0	113
718	T	92.2	Very high	89.1	Confident	44 Å²	44	33.5 Å²	33.5	27%	0.27	21%	0.214	S	C	.	.	S	Bend	trans	-133.6	147.5	171.7	65.2	0	0	0	0	109.3	P492 E494 A515	P492-T718 HydrophobicContact CG-CG2 4.27Å; P492-T718 WeakPolarHBondContact O-CA 3.37Å; E494-T718 HydrophobicContact CG-CG2 4.48Å; E494-T718 WeakPolarHBondContact OE2-CB 3.21Å; E494-T718 PolarHBondContact OE2-OG1 2.9Å; A515-T718 HydrophobicContact CB-CG2 4.35Å
719	G	93.9	Very high	89	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	126.9	172.1	0	0	0	0	0	110.8	P492 L493 E494	P492-G719 PolarHBondContact O-N 3.29Å; L493-G719 WeakPolarHBondContact CA-O 3.26Å; E494-G719 PolarHBondContact N-O 3.24Å
720	T	95.6	Very high	88.9	Confident	6 Å²	6	36.3 Å²	36.3	4%	0.037	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	127.2	-179.2	-53.8	0	0	0	0	110.9	Y496 Q572 R680 T681 V682 I722	Y496-T720 HydrophobicContact CD2-CG2 3.93Å; Y496-T720 HydrophobicContact CE2-CG2 3.87Å; Q572-T720 PolarHBondContact NE2-OG1 3.33Å; R680-T720 PolarHBondContact O-N 2.98Å; T681-T720 CarbonylContact C-O 3.51Å; T681-T720 VanDerWaalsContact CA-O 3.27Å; T681-T720 WeakPolarHBondContact CA-O 3.38Å; T681-T720 HydrophobicContact CG2-CG2 4.06Å; V682-T720 PolarHBondContact N-O 3.03Å; T720-I722 HydrophobicContact CG2-CD1 4.16Å; T720-I722 HydrophobicContact CG2-CG1 3.98Å
721	V	96.2	Very high	88.8	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	129.5	176	-177.3	0	0	0	0	109.7	L493 E494 H495 Y496 V682 F684 A707 A710	L493-V721 HydrophobicContact CB-CG2 4.47Å; L493-V721 HydrophobicContact CD1-CG2 4.41Å; E494-V721 PolarHBondContact O-N 3.14Å; H495-V721 CarbonylContact C-O 3.47Å; H495-V721 WeakPolarHBondContact CA-O 3.38Å; Y496-V721 PolarHBondContact N-O 2.84Å; V682-V721 CarbonylContact O-C 3.58Å; V682-V721 WeakPolarHBondContact O-CA 3.48Å; F684-V721 HydrophobicContact CD2-CG1 4.06Å; F684-V721 HydrophobicContact CE2-CG1 3.7Å; A707-V721 HydrophobicContact CB-CG1 4.19Å; A707-V721 HydrophobicContact CB-CG2 4.12Å; A710-V721 HydrophobicContact CB-CG2 3.88Å
722	I	95.9	Very high	88.8	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	133.2	-173.5	-53.8	172.5	0	0	0	110.2	Y496 M509 L563 L567 T681 V682 V683 F684 T720	Y496-I722 CarbonylContact O-C 3.57Å; Y496-I722 WeakPolarHBondContact O-CA 3.42Å; M509-I722 HydrophobicContact CE-CD1 3.5Å; M509-I722 VanDerWaalsContact CE-CD1 3.5Å; M509-I722 HydrophobicContact CE-CG1 4.09Å; L563-I722 HydrophobicContact CD1-CD1 4.23Å; L567-I722 HydrophobicContact CD1-CD1 4.18Å; L567-I722 HydrophobicContact CD2-CD1 3.85Å; T681-I722 HydrophobicContact CG2-CD1 3.67Å; T681-I722 HydrophobicContact CG2-CG1 4.17Å; V682-I722 PolarHBondContact O-N 2.81Å; V683-I722 CarbonylContact C-O 3.54Å; V683-I722 VanDerWaalsContact CA-O 3.3Å; V683-I722 WeakPolarHBondContact CA-O 3.41Å; V683-I722 HydrophobicContact CG1-CB 4.46Å; V683-I722 HydrophobicContact CG2-CB 4.25Å; V683-I722 HydrophobicContact CG2-CD1 4.33Å; F684-I722 PolarHBondContact N-O 2.75Å; T720-I722 HydrophobicContact CG2-CD1 4.16Å; T720-I722 HydrophobicContact CG2-CG1 3.98Å
723	I	95.1	Very high	88.9	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.005	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	125.5	173.3	-57.4	171.4	0	0	0	108.9	Y496 L497 Y498 F684 I687 Y703 C725 L735 M738 M739	Y496-I723 PolarHBondContact O-N 3.47Å; L497-I723 HydrophobicContact CD2-CB 4.03Å; L497-I723 HydrophobicContact CD2-CD1 4.49Å; L497-I723 HydrophobicContact CD2-CG2 4.4Å; Y498-I723 PolarHBondContact N-O 3.41Å; F684-I723 HydrophobicContact CB-CG1 4.41Å; F684-I723 HydrophobicContact CD2-CG1 4.36Å; I687-I723 HydrophobicContact CG2-CD1 4.44Å; I687-I723 HydrophobicContact CG2-CG2 3.72Å; Y703-I723 HydrophobicContact CE2-CD1 4.43Å; I723-C725 PolarHBondContact O-N 2.98Å; I723-L735 HydrophobicContact CD1-CD2 3.99Å; I723-M738 HydrophobicContact CD1-CE 3.92Å; I723-M739 HydrophobicContact CD1-SD 4.46Å
724	L	92.6	Very high	89.2	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.01	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	111.4	-179.6	-62.9	-167.8	0	0	0	112.1	Y498 V559 W560 L563 V683 F684 K726	Y498-L724 HydrophobicContact CD1-CD2 3.85Å; V559-L724 HydrophobicContact CG1-CD1 4.41Å; V559-L724 HydrophobicContact CG1-CD2 4.47Å; W560-L724 HydrophobicContact CD2-CD1 4.27Å; W560-L724 HydrophobicContact CE3-CD1 4.49Å; W560-L724 HydrophobicContact CH2-CD1 3.74Å; W560-L724 HydrophobicContact CZ2-CD1 3.48Å; W560-L724 VanDerWaalsContact CZ2-CD1 3.48Å; W560-L724 HydrophobicContact CZ3-CD1 4.26Å; L563-L724 HydrophobicContact CD2-CD2 3.6Å; V683-L724 HydrophobicContact CG1-CD1 4.27Å; V683-L724 HydrophobicContact CG1-CD2 3.8Å; V683-L724 HydrophobicContact CG1-CG 3.81Å; F684-L724 WeakPolarHBondContact O-CB 3.44Å; F684-L724 WeakPolarHBondContact O-CG 3.43Å; F684-L724 PolarHBondContact O-N 3.26Å; L724-K726 HydrophobicContact CB-CG 4.3Å; L724-K726 PolarHBondContact O-N 2.67Å
725	C	88.4	Confident	89.5	Confident	7 Å²	7	37.4 Å²	37.4	5%	0.047	24%	0.235	C	C	.	.			trans	-87.3	80.5	171.3	-67.1	0	0	0	0	110.1	Y498 T499 K531 I723 G728	Y498-C725 WeakPolarHBondContact O-CB 3.1Å; Y498-C725 PolarHBondContact O-N 3.48Å; T499-C725 HydrophobicContact CG2-CB 3.95Å; K531-C725 PolarHBondContact NZ-O 2.73Å; I723-C725 PolarHBondContact O-N 2.98Å; C725-G728 WeakPolarHBondContact CB-O 3.5Å
726	K	82.2	Confident	89.8	Confident	32 Å²	32	35.5 Å²	35.5	14%	0.139	22%	0.223	C	C	.	.	S	Bend	trans	-70.8	-72.1	-180	-65.6	180	178.5	-178.7	0	112.8	K531 T551 D556 R584 D685 L724	K531-K726 VanDerWaalsContact NZ-C 3.31Å; K531-K726 PolarHBondContact NZ-O 3.08Å; T551-K726 HydrophobicContact CG2-CB 4.05Å; D556-K726 WeakPolarHBondContact OD2-CE 3.5Å; D556-K726 IonicContact OD2-NZ 3.88Å; D556-K726 PolarHBondContact OD2-NZ 3.07Å; R584-K726 VanDerWaalsContact NH2-NZ 3.19Å; D685-K726 WeakPolarHBondContact OD1-CE 3.4Å; D685-K726 IonicContact OD1-NZ 2.91Å; D685-K726 PolarHBondContact OD1-NZ 3.39Å; D685-K726 IonicContact OD2-NZ 3.12Å; D685-K726 PolarHBondContact OD2-NZ 2.82Å; L724-K726 HydrophobicContact CB-CG 4.3Å; L724-K726 PolarHBondContact O-N 2.67Å
727	S	74.8	Confident	89.9	Confident	81 Å²	81	37.4 Å²	37.4	57%	0.566	24%	0.241	S	C	*	.	S	Bend	trans	-78.2	-67.8	-178.7	52.5	0	0	0	0	113	K531	K531-S727 WeakPolarHBondContact CE-O 3.46Å; K531-S727 PolarHBondContact NZ-O 3.12Å
728	G	80.8	Confident	90	Very high	33 Å²	33	33.3 Å²	33.3	34%	0.34	21%	0.206	S	C	.	.	S	Bend	trans	-106.7	-171.9	174.9	0	0	0	0	0	113.3	K531 C725	K531-G728 PolarHBondContact NZ-O 3.45Å; C725-G728 WeakPolarHBondContact CB-O 3.5Å
729	V	85.4	Confident	89.9	Confident	28 Å²	28	32.1 Å²	32.1	17%	0.17	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-92.8	141.5	151	-179.8	0	0	0	0	105.9	L497 Y524 V528 K531	L497-V729 HydrophobicContact CD1-CG1 3.85Å; Y524-V729 HydrophobicContact CD2-CG1 4.4Å; Y524-V729 HydrophobicContact CE2-CG1 3.8Å; V528-V729 HydrophobicContact CG2-CB 4.01Å; V528-V729 HydrophobicContact CG2-CG1 3.91Å; V528-V729 HydrophobicContact CG2-CG2 4.22Å; K531-V729 HydrophobicContact CB-CG2 4.14Å; K531-V729 HydrophobicContact CD-CG2 3.85Å
730	H	87.9	Confident	89.7	Confident	43 Å²	43	36.2 Å²	36.2	20%	0.199	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-70.6	154.6	178	-61	-65.2	0	0	0	111.3	Y524 I687 L735	Y524-H730 VanDerWaalsContact CE2-O 3.24Å; Y524-H730 WeakPolarHBondContact CE2-O 3.46Å; Y524-H730 PolarHBondContact OH-O 3.03Å; Y524-H730 VanDerWaalsContact OH-O 3.05Å; I687-H730 HydrophobicContact CD1-CB 3.68Å; I687-H730 VanDerWaalsContact CD1-CG 3.46Å; H730-L735 HydrophobicContact CB-CD1 4.13Å; H730-L735 HydrophobicContact CB-CD2 4.11Å; H730-L735 HydrophobicContact CB-CG 4Å
731	D	89.8	Confident	89.2	Confident	105 Å²	105	37 Å²	37	56%	0.561	23%	0.228	S	C	*	.	P	Polyproline II helix	trans	-65.1	140.7	-179.2	-68.8	-47	0	0	0	112.1	A733 D734 L735	D731-A733 PolarHBondContact O-N 2.96Å; D731-D734 PolarHBondContact O-N 3.42Å; D731-L735 PolarHBondContact O-N 3Å
732	M	90.1	Very high	88.6	Confident	55 Å²	55	45.8 Å²	45.8	27%	0.271	27%	0.266	S	S	.	.	H	α-helix	trans	-59.1	-35.6	-178.9	-177.2	-179.7	164.2	0	0	112.2	F519 T521 Y524 H736	F519-M732 HydrophobicContact CD1-CE 4.31Å; F519-M732 HydrophobicContact CE1-CE 3.9Å; F519-M732 HydrophobicContact CE1-CG 4.23Å; F519-M732 HydrophobicContact CZ-CG 4.4Å; T521-M732 HydrophobicContact CG2-CE 3.7Å; T521-M732 HydrophobicContact CG2-SD 3.84Å; Y524-M732 HydrophobicContact CD1-CB 4.21Å; Y524-M732 HydrophobicContact CD1-CG 4.5Å; Y524-M732 HydrophobicContact CD1-SD 4.39Å; Y524-M732 HydrophobicContact CD2-CB 4.37Å; Y524-M732 HydrophobicContact CE1-CB 3.83Å; Y524-M732 HydrophobicContact CE2-CB 3.99Å; Y524-M732 HydrophobicContact CG-CB 4.47Å; Y524-M732 PolarHBondContact OH-N 3.3Å; M732-H736 WeakPolarHBondContact O-CB 3.47Å; M732-H736 PolarHBondContact O-N 2.71Å
733	A	90.6	Very high	88	Confident	73 Å²	73	47.2 Å²	47.2	60%	0.603	28%	0.275	S	S	*	.	H	α-helix	trans	-64.1	-46.5	177.7	0	0	0	0	0	111.8	D731 H736 A737	D731-A733 PolarHBondContact O-N 2.96Å; A733-H736 PolarHBondContact O-N 2.7Å; A733-A737 VanDerWaalsContact O-CB 3.24Å; A733-A737 WeakPolarHBondContact O-CB 3.23Å; A733-A737 PolarHBondContact O-N 2.81Å
734	D	91.4	Very high	87.4	Confident	43 Å²	43	50.3 Å²	50.3	23%	0.23	29%	0.294	C	S	.	.	H	α-helix	trans	-60.2	-47	176.4	-79.6	6.4	0	0	0	111.2	I687 R688 N697 D731 M738	I687-D734 HydrophobicContact CD1-CB 4.45Å; R688-D734 IonicContact NH2-OD2 3.93Å; N697-D734 PolarHBondContact ND2-OD1 3.44Å; N697-D734 PolarHBondContact ND2-OD2 2.67Å; D731-D734 PolarHBondContact O-N 3.42Å; D734-M738 VanDerWaalsContact O-CB 3.31Å; D734-M738 WeakPolarHBondContact O-CB 3.47Å; D734-M738 PolarHBondContact O-N 2.85Å
735	L	91.4	Very high	87.2	Confident	0 Å²	0	54 Å²	54	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-64.5	-45.6	178.3	-69.1	172.9	0	0	0	112	L497 L512 Y524 I687 I723 H730 D731 M738 M739	L497-L735 HydrophobicContact CD2-CD1 4.31Å; L512-L735 HydrophobicContact CD1-CD1 4.12Å; Y524-L735 HydrophobicContact CD2-CD1 4.16Å; Y524-L735 HydrophobicContact CE2-CD1 3.98Å; I687-L735 HydrophobicContact CD1-CD2 4.25Å; I723-L735 HydrophobicContact CD1-CD2 3.99Å; H730-L735 HydrophobicContact CB-CD1 4.13Å; H730-L735 HydrophobicContact CB-CD2 4.11Å; H730-L735 HydrophobicContact CB-CG 4Å; D731-L735 PolarHBondContact O-N 3Å; L735-M738 HydrophobicContact CD2-CE 4.19Å; L735-M738 PolarHBondContact O-N 2.93Å; L735-M739 HydrophobicContact CB-SD 4.39Å; L735-M739 VanDerWaalsContact O-CB 3.27Å; L735-M739 WeakPolarHBondContact O-CB 3.48Å; L735-M739 WeakPolarHBondContact O-CG 3.47Å; L735-M739 PolarHBondContact O-N 3.31Å
736	H	91.9	Very high	87.3	Confident	87 Å²	87	53.8 Å²	53.8	40%	0.403	31%	0.311	S	S	.	.	H	α-helix	trans	-65.3	-41.8	179.1	-172.1	-77.8	0	0	0	111.4	M732 A733 M740	M732-H736 WeakPolarHBondContact O-CB 3.47Å; M732-H736 PolarHBondContact O-N 2.71Å; A733-H736 PolarHBondContact O-N 2.7Å; H736-M740 WeakPolarHBondContact O-CA 3.42Å; H736-M740 WeakPolarHBondContact O-CB 3.42Å; H736-M740 PolarHBondContact O-N 2.89Å
737	A	91.6	Very high	87.6	Confident	56 Å²	56	57.5 Å²	57.5	46%	0.463	33%	0.329	S	S	.	.	H	α-helix	trans	-62.4	-43.4	175.4	0	0	0	0	0	111.9	P700 A733 G741	P700-A737 WeakPolarHBondContact CG-O 3.28Å; A733-A737 VanDerWaalsContact O-CB 3.24Å; A733-A737 WeakPolarHBondContact O-CB 3.23Å; A733-A737 PolarHBondContact O-N 2.81Å; A737-G741 WeakPolarHBondContact O-CA 3.31Å; A737-G741 PolarHBondContact O-N 2.95Å; A737-G741 VanDerWaalsContact O-N 3.1Å
738	M	92.4	Very high	88.3	Confident	4 Å²	4	54.8 Å²	54.8	2%	0.02	31%	0.31	C	S	.	.	H	α-helix	trans	-69.3	-39.8	178.8	-176.7	-171.5	67.9	0	0	113.1	I687 L698 P700 Y703 I723 D734 L735	I687-M738 HydrophobicContact CB-SD 4.02Å; I687-M738 HydrophobicContact CG2-CE 3.96Å; I687-M738 HydrophobicContact CG2-SD 4.05Å; L698-M738 HydrophobicContact CB-CG 4.3Å; L698-M738 HydrophobicContact CB-SD 4.02Å; L698-M738 HydrophobicContact CD1-SD 4.19Å; P700-M738 WeakPolarHBondContact CA-O 3.37Å; Y703-M738 HydrophobicContact CD1-CG 4.3Å; Y703-M738 HydrophobicContact CD2-CE 3.63Å; Y703-M738 HydrophobicContact CD2-CG 4.01Å; Y703-M738 HydrophobicContact CD2-SD 3.63Å; Y703-M738 HydrophobicContact CE1-CE 4.44Å; Y703-M738 HydrophobicContact CE2-CE 3.51Å; Y703-M738 HydrophobicContact CE2-SD 4.14Å; Y703-M738 HydrophobicContact CG-CE 4.15Å; Y703-M738 HydrophobicContact CG-CG 3.75Å; Y703-M738 HydrophobicContact CG-SD 4.03Å; I723-M738 HydrophobicContact CD1-CE 3.92Å; D734-M738 VanDerWaalsContact O-CB 3.31Å; D734-M738 WeakPolarHBondContact O-CB 3.47Å; D734-M738 PolarHBondContact O-N 2.85Å; L735-M738 HydrophobicContact CD2-CE 4.19Å; L735-M738 PolarHBondContact O-N 2.93Å
739	M	90.8	Very high	88.7	Confident	19 Å²	19	56.2 Å²	56.2	9%	0.094	31%	0.308	C	S	.	.	H	α-helix	trans	-90.6	-39.9	-171.3	-62.2	172.3	73.7	0	0	113.4	H495 L512 V513 F519 Y703 I723 L735	H495-M739 HydrophobicContact CB-CE 3.34Å; L512-M739 HydrophobicContact CB-CE 4.37Å; L512-M739 HydrophobicContact CD1-SD 4.21Å; V513-M739 HydrophobicContact CB-CE 4.23Å; V513-M739 HydrophobicContact CG2-CE 3.54Å; F519-M739 HydrophobicContact CE2-SD 4.21Å; Y703-M739 HydrophobicContact CD1-CG 4.35Å; Y703-M739 HydrophobicContact CE1-CB 4.3Å; Y703-M739 HydrophobicContact CE1-CG 3.71Å; I723-M739 HydrophobicContact CD1-SD 4.46Å; L735-M739 HydrophobicContact CB-SD 4.39Å; L735-M739 VanDerWaalsContact O-CB 3.27Å; L735-M739 WeakPolarHBondContact O-CB 3.48Å; L735-M739 WeakPolarHBondContact O-CG 3.47Å; L735-M739 PolarHBondContact O-N 3.31Å
740	M	88.6	Confident	88.8	Confident	86 Å²	86	55.6 Å²	55.6	42%	0.424	30%	0.303	S	S	.	.	H	α-helix	trans	-107.2	1.4	-177.4	-55.6	-58.5	-67.9	0	0	112.7	G517 F519 H736	G517-M740 VanDerWaalsContact O-CE 3.31Å; G517-M740 WeakPolarHBondContact O-CE 3.5Å; F519-M740 HydrophobicContact CB-CG 4.49Å; F519-M740 HydrophobicContact CD2-CG 4.3Å; H736-M740 WeakPolarHBondContact O-CA 3.42Å; H736-M740 WeakPolarHBondContact O-CB 3.42Å; H736-M740 PolarHBondContact O-N 2.89Å
741	G	85.4	Confident	88.9	Confident	23 Å²	23	59.1 Å²	59.1	24%	0.237	32%	0.315	C	S	.	.	S	Bend	trans	-65.4	151.6	176.8	0	0	0	0	0	112.6	A737	A737-G741 WeakPolarHBondContact O-CA 3.31Å; A737-G741 PolarHBondContact O-N 2.95Å; A737-G741 VanDerWaalsContact O-N 3.1Å
742	K	83.5	Confident	88.9	Confident	184 Å²	184	54.1 Å²	54.1	80%	0.8	29%	0.288	S	S	*	.	P	Polyproline II helix	trans	-64.8	137.8	172	-64.8	-176.5	179.7	-178.5	0	109.2
743	P	82.7	Confident	88.9	Confident	29 Å²	29	52.9 Å²	52.9	19%	0.188	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-55.5	155.5	168.8	-23	33.1	0	0	0	111.2	I704 I745	I704-P743 HydrophobicContact CD1-CG 4.14Å; P743-I745 PolarHBondContact O-N 3.31Å
744	T	83.1	Confident	89	Confident	66 Å²	66	50.1 Å²	50.1	41%	0.405	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-57.7	133.4	174.9	43.8	0	0	0	0	110.6	L699	L699-T744 HydrophobicContact CD1-CG2 4.27Å
745	I	89.4	Confident	88.9	Confident	80 Å²	80	48.9 Å²	48.9	41%	0.41	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-62.7	151.6	167.3	47.8	162.6	0	0	0	109.9	N435 P464 P743 Q747	N435-I745 PolarHBondContact ND2-O 3.04Å; P464-I745 HydrophobicContact CG-CB 4.46Å; P464-I745 HydrophobicContact CG-CG2 3.65Å; P743-I745 PolarHBondContact O-N 3.31Å; I745-Q747 HydrophobicContact CD1-CG 3.75Å; I745-Q747 HydrophobicContact CG1-CG 3.93Å
746	L	88.9	Confident	88.9	Confident	3 Å²	3	49 Å²	49	2%	0.016	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-69.6	127.6	166	-59.6	-174.6	0	0	0	108.4	H432 I434 N435 V463 N465 F469 F776	H432-L746 HydrophobicContact CB-CD2 4.3Å; I434-L746 HydrophobicContact CG2-CB 4.31Å; I434-L746 HydrophobicContact CG2-CD1 4.49Å; I434-L746 HydrophobicContact CG2-CD2 3.81Å; I434-L746 HydrophobicContact CG2-CG 4.42Å; N435-L746 VanDerWaalsContact OD1-CA 3.29Å; N435-L746 WeakPolarHBondContact OD1-CA 3.38Å; V463-L746 HydrophobicContact CB-CD2 4.42Å; V463-L746 HydrophobicContact CB-CG 4.25Å; V463-L746 HydrophobicContact CG1-CD2 3.91Å; V463-L746 HydrophobicContact CG1-CG 4.28Å; V463-L746 HydrophobicContact CG2-CD1 4.18Å; V463-L746 HydrophobicContact CG2-CG 4.39Å; N465-L746 PolarHBondContact ND2-O 3Å; N465-L746 PolarHBondContact OD1-N 3.41Å; F469-L746 HydrophobicContact CB-CD1 4Å; F469-L746 HydrophobicContact CD1-CD1 3.95Å; F469-L746 HydrophobicContact CD2-CD1 4.08Å; F469-L746 HydrophobicContact CE1-CD1 4.47Å; F469-L746 HydrophobicContact CG-CD1 3.72Å; L746-F776 HydrophobicContact CB-CE1 4.4Å
747	Q	89.1	Confident	88.9	Confident	109 Å²	109	44.8 Å²	44.8	51%	0.509	23%	0.233	S	C	.	.			trans	-131.6	137.2	177.3	-68.8	-174	-44.9	0	0	108.9	N435 I745 Q749	N435-Q747 PolarHBondContact OD1-N 3.14Å; N435-Q747 PolarHBondContact OD1-O 2.92Å; I745-Q747 HydrophobicContact CD1-CG 3.75Å; I745-Q747 HydrophobicContact CG1-CG 3.93Å; Q747-Q749 PolarHBondContact O-N 3.46Å
748	S	89.4	Confident	88.9	Confident	25 Å²	25	42.1 Å²	42.1	18%	0.175	21%	0.211	C	C	.	.			trans	-58	137.2	173.7	-179	0	0	0	0	110.8	E444 F750 S777	E444-S748 VanDerWaalsContact CD-OG 3.27Å; E444-S748 VanDerWaalsContact OE1-CA 3.24Å; E444-S748 WeakPolarHBondContact OE1-CA 3.43Å; E444-S748 VanDerWaalsContact OE1-CB 3.29Å; E444-S748 WeakPolarHBondContact OE1-CB 3.37Å; E444-S748 PolarHBondContact OE1-OG 3.25Å; E444-S748 PolarHBondContact OE2-OG 2.57Å; S748-F750 VanDerWaalsContact OG-CB 3.29Å; S748-F750 WeakPolarHBondContact OG-CB 3.49Å; S748-F750 PolarHBondContact OG-N 3.05Å; S748-S777 VanDerWaalsContact CB-N 3.33Å; S748-S777 PolarHBondContact OG-N 3.2Å
749	Q	89.5	Confident	88.8	Confident	62 Å²	62	42.4 Å²	42.4	29%	0.29	21%	0.212	S	C	.	.			trans	-114.2	19.1	168.2	-62.5	-59.9	-59.3	0	0	110.6	I434 V441 E444 Q747 R751	I434-Q749 WeakPolarHBondContact O-CG 3.29Å; V441-Q749 WeakPolarHBondContact CG2-O 3.35Å; E444-Q749 PolarHBondContact OE1-N 2.92Å; Q747-Q749 PolarHBondContact O-N 3.46Å; Q749-R751 PolarHBondContact O-N 3.33Å
750	F	88.3	Confident	88.7	Confident	15 Å²	15	41.8 Å²	41.8	7%	0.066	21%	0.209	C	C	.	.			trans	-59.5	126	-176.6	-172.8	-100.3	0	0	0	111.1	V441 E444 S748 L752 M756 M771 M772 L1051	V441-F750 HydrophobicContact CG1-CD2 4.49Å; E444-F750 HydrophobicContact CB-CD2 4.22Å; E444-F750 PolarHBondContact OE1-N 3.09Å; S748-F750 VanDerWaalsContact OG-CB 3.29Å; S748-F750 WeakPolarHBondContact OG-CB 3.49Å; S748-F750 PolarHBondContact OG-N 3.05Å; F750-L752 HydrophobicContact CE1-CD2 3.93Å; F750-L752 HydrophobicContact CZ-CD2 4.38Å; F750-M756 HydrophobicContact CE2-CE 4.47Å; F750-M756 HydrophobicContact CE2-SD 4.04Å; F750-M756 HydrophobicContact CZ-CE 3.8Å; F750-M756 HydrophobicContact CZ-SD 3.94Å; F750-M771 HydrophobicContact CZ-CG 4.41Å; F750-M772 HydrophobicContact CE1-CG 4.2Å; F750-L1051 HydrophobicContact CD1-CD1 3.54Å; F750-L1051 HydrophobicContact CE1-CD1 3.93Å
751	R	88.8	Confident	88.7	Confident	117 Å²	117	40 Å²	40	44%	0.442	20%	0.201	S	C	.	.			trans	-140.5	147.7	178.7	74.9	-167.2	176.6	169.1	-4.7	109.4	V441 Q749 T753	V441-R751 HydrophobicContact CG1-CG 4.46Å; V441-R751 HydrophobicContact CG2-CG 3.75Å; Q749-R751 PolarHBondContact O-N 3.33Å; R751-T753 PolarHBondContact O-N 2.88Å
752	L	90	Very high	88.7	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.005	20%	0.199	C	C	.	.			trans	-76.5	121.6	179.4	-54.5	-178.7	0	0	0	110	F750 M756 I757 M772 L1051 E1054 Y1055 R1058	F750-L752 HydrophobicContact CE1-CD2 3.93Å; F750-L752 HydrophobicContact CZ-CD2 4.38Å; L752-M756 HydrophobicContact CD2-CE 3.52Å; L752-I757 HydrophobicContact CB-CD1 4.36Å; L752-M772 HydrophobicContact CD1-SD 4.23Å; L752-M772 HydrophobicContact CD2-CG 4.08Å; L752-M772 HydrophobicContact CD2-SD 3.96Å; L752-L1051 HydrophobicContact CD1-CB 4.19Å; L752-L1051 HydrophobicContact CD2-CD1 4.46Å; L752-L1051 HydrophobicContact CG-CB 4.36Å; L752-L1051 HydrophobicContact CG-CD1 4.49Å; L752-E1054 HydrophobicContact CD1-CB 4.39Å; L752-Y1055 HydrophobicContact CD1-CD2 4.44Å; L752-R1058 PolarHBondContact O-NE 3.14Å; L752-R1058 PolarHBondContact O-NH1 3.37Å; L752-R1058 PolarHBondContact O-NH2 3.11Å
753	T	90	Very high	88.4	Confident	29 Å²	29	32.6 Å²	32.6	18%	0.178	16%	0.161	C	C	.	.			trans	-103.4	152.1	170	63.6	0	0	0	0	109.8	R751 T755 M756 I757	R751-T753 PolarHBondContact O-N 2.88Å; T753-T755 VanDerWaalsContact C-N 3.34Å; T753-M756 PolarHBondContact O-N 3.44Å; T753-M756 WeakPolarHBondContact OG1-CB 3.32Å; T753-M756 PolarHBondContact OG1-N 3.17Å; T753-I757 WeakPolarHBondContact O-CG1 3.42Å; T753-I757 PolarHBondContact O-N 3.05Å; T753-I757 VanDerWaalsContact O-N 3.14Å
754	Y	92	Very high	87.7	Confident	15 Å²	15	38.3 Å²	38.3	6%	0.059	19%	0.185	C	C	.	.	H	α-helix	trans	-70.1	-37.1	179.7	-56.8	-84.9	0	0	0	110.2	M756 I757 L758 R1058 V1061 L1062 E1088 L1089 Q1149 I1154	Y754-M756 VanDerWaalsContact C-N 3.31Å; Y754-M756 PolarHBondContact O-N 2.84Å; Y754-I757 PolarHBondContact O-N 3.12Å; Y754-L758 WeakPolarHBondContact O-CB 3.42Å; Y754-L758 VanDerWaalsContact O-CG 3.28Å; Y754-L758 WeakPolarHBondContact O-CG 3.34Å; Y754-L758 PolarHBondContact O-N 2.99Å; Y754-R1058 HydrophobicContact CD1-CB 4.21Å; Y754-R1058 HydrophobicContact CD1-CG 4.46Å; Y754-R1058 HydrophobicContact CE1-CB 3.76Å; Y754-R1058 HydrophobicContact CE1-CG 3.8Å; Y754-R1058 VanDerWaalsContact CE2-NH1 3.33Å; Y754-V1061 HydrophobicContact CE1-CB 4.33Å; Y754-V1061 HydrophobicContact CE1-CG1 4.31Å; Y754-L1062 HydrophobicContact CD1-CD1 4.13Å; Y754-L1062 HydrophobicContact CD1-CD2 3.9Å; Y754-L1062 HydrophobicContact CD1-CG 3.91Å; Y754-L1062 HydrophobicContact CE1-CG 4.48Å; Y754-L1062 HydrophobicContact CG-CD2 4.5Å; Y754-E1088 WeakPolarHBondContact CA-OE1 3.26Å; Y754-E1088 VanDerWaalsContact CB-OE1 3.27Å; Y754-E1088 WeakPolarHBondContact CB-OE1 3.37Å; Y754-E1088 PolarHBondContact N-OE1 3.28Å; Y754-E1088 VanDerWaalsContact N-OE1 3.09Å; Y754-L1089 HydrophobicContact CD1-CD1 4.42Å; Y754-L1089 HydrophobicContact CD2-CD1 3.85Å; Y754-L1089 HydrophobicContact CD2-CG 4.06Å; Y754-L1089 HydrophobicContact CE1-CD1 4.18Å; Y754-L1089 HydrophobicContact CE2-CD1 3.58Å; Y754-L1089 HydrophobicContact CE2-CG 4.29Å; Y754-L1089 HydrophobicContact CG-CD1 4.25Å; Y754-L1089 HydrophobicContact CG-CD2 4.33Å; Y754-L1089 HydrophobicContact CG-CG 4.34Å; Y754-Q1149 PolarHBondContact OH-NE2 3.02Å; Y754-Q1149 VanDerWaalsContact OH-NE2 3.15Å; Y754-I1154 VanDerWaalsContact OH-CD1 3.28Å; Y754-I1154 WeakPolarHBondContact OH-CD1 3.5Å
755	T	90	Very high	87	Confident	16 Å²	16	38 Å²	38	10%	0.098	19%	0.19	C	C	.	.	H	α-helix	trans	-57.7	-38.1	172.3	-54.2	0	0	0	0	112.9	T753 N759 I1084 E1088	T753-T755 VanDerWaalsContact C-N 3.34Å; T755-N759 WeakPolarHBondContact CG2-ND2 3.19Å; T755-N759 WeakPolarHBondContact O-CB 3.36Å; T755-N759 PolarHBondContact O-N 2.84Å; T755-N759 VanDerWaalsContact O-N 3.09Å; T755-N759 PolarHBondContact O-ND2 2.95Å; T755-I1084 PolarHBondContact OG1-O 3.12Å; T755-I1084 VanDerWaalsContact OG1-O 3.1Å; T755-E1088 PolarHBondContact N-OE1 3.23Å; T755-E1088 VanDerWaalsContact N-OE1 3.16Å; T755-E1088 WeakPolarHBondContact OG1-CG 3.49Å; T755-E1088 PolarHBondContact OG1-OE1 2.79Å
756	M	90.6	Very high	86.5	Confident	2 Å²	2	34.6 Å²	34.6	1%	0.01	17%	0.172	C	C	.	.	H	α-helix	trans	-66.6	-49.7	173.8	-178.6	-175.2	83	0	0	111.5	E445 F750 L752 T753 Y754 L758 N759 L760 V768 M771	E445-M756 HydrophobicContact CG-SD 4.06Å; F750-M756 HydrophobicContact CE2-CE 4.47Å; F750-M756 HydrophobicContact CE2-SD 4.04Å; F750-M756 HydrophobicContact CZ-CE 3.8Å; F750-M756 HydrophobicContact CZ-SD 3.94Å; L752-M756 HydrophobicContact CD2-CE 3.52Å; T753-M756 PolarHBondContact O-N 3.44Å; T753-M756 WeakPolarHBondContact OG1-CB 3.32Å; T753-M756 PolarHBondContact OG1-N 3.17Å; Y754-M756 VanDerWaalsContact C-N 3.31Å; Y754-M756 PolarHBondContact O-N 2.84Å; M756-L758 VanDerWaalsContact C-N 3.34Å; M756-L758 PolarHBondContact O-N 3.38Å; M756-N759 PolarHBondContact O-N 3.01Å; M756-L760 HydrophobicContact CG-CD1 3.83Å; M756-L760 WeakPolarHBondContact O-CG 3.4Å; M756-L760 PolarHBondContact O-N 3.32Å; M756-V768 HydrophobicContact CE-CG1 4.43Å; M756-M771 HydrophobicContact CG-SD 4.16Å; M756-M771 HydrophobicContact SD-CE 4.46Å; M756-M771 HydrophobicContact SD-SD 3.77Å
757	I	92.6	Very high	86.3	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-56.4	-48.2	179.2	-68.1	168	0	0	0	110.7	L752 T753 Y754 L760 L761 Y1055 R1058 I1059 L1062	L752-I757 HydrophobicContact CB-CD1 4.36Å; T753-I757 WeakPolarHBondContact O-CG1 3.42Å; T753-I757 PolarHBondContact O-N 3.05Å; T753-I757 VanDerWaalsContact O-N 3.14Å; Y754-I757 PolarHBondContact O-N 3.12Å; I757-L760 PolarHBondContact O-N 3.02Å; I757-L761 HydrophobicContact CG2-CD1 3.69Å; I757-L761 HydrophobicContact CG2-CG 4.25Å; I757-L761 WeakPolarHBondContact O-CB 3.34Å; I757-L761 VanDerWaalsContact O-CG 3.3Å; I757-L761 WeakPolarHBondContact O-CG 3.27Å; I757-L761 PolarHBondContact O-N 2.87Å; I757-Y1055 HydrophobicContact CD1-CD2 4.03Å; I757-Y1055 HydrophobicContact CD1-CE2 4.35Å; I757-Y1055 HydrophobicContact CG1-CD2 4.2Å; I757-Y1055 HydrophobicContact CG1-CE2 4.19Å; I757-Y1055 HydrophobicContact CG2-CE2 4.09Å; I757-R1058 HydrophobicContact CD1-CB 3.88Å; I757-I1059 HydrophobicContact CG2-CD1 3.83Å; I757-L1062 HydrophobicContact CG2-CD1 3.9Å
758	L	91.9	Very high	86.2	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-68.5	-34.3	-178.5	-66.8	168.6	0	0	0	113.1	Y754 M756 R762 L1062 Y1067 I1068 V1074 A1081 C1082	Y754-L758 WeakPolarHBondContact O-CB 3.42Å; Y754-L758 VanDerWaalsContact O-CG 3.28Å; Y754-L758 WeakPolarHBondContact O-CG 3.34Å; Y754-L758 PolarHBondContact O-N 2.99Å; M756-L758 VanDerWaalsContact C-N 3.34Å; M756-L758 PolarHBondContact O-N 3.38Å; L758-R762 PolarHBondContact O-N 3.49Å; L758-L1062 HydrophobicContact CD1-CD2 4.2Å; L758-L1062 HydrophobicContact CD2-CD1 4.02Å; L758-L1062 HydrophobicContact CD2-CD2 4.26Å; L758-L1062 HydrophobicContact CG-CD1 4.21Å; L758-L1062 HydrophobicContact CG-CD2 4.41Å; L758-Y1067 HydrophobicContact CD1-CD1 4.19Å; L758-I1068 HydrophobicContact CD2-CG2 3.79Å; L758-V1074 HydrophobicContact CD2-CG1 4.33Å; L758-A1081 HydrophobicContact CD1-CB 3.73Å; L758-C1082 VanDerWaalsContact CB-SG 3.53Å
759	N	89.5	Confident	86.1	Confident	10 Å²	10	37.8 Å²	37.8	5%	0.053	18%	0.179	C	C	.	.	H	α-helix	trans	-71.8	-30.5	176	-83.3	-52	0	0	0	113.2	Y414 T755 M756 R762	Y414-N759 HydrophobicContact CD1-CB 3.89Å; Y414-N759 HydrophobicContact CE1-CB 4.08Å; Y414-N759 HydrophobicContact CG-CB 4.33Å; T755-N759 WeakPolarHBondContact CG2-ND2 3.19Å; T755-N759 WeakPolarHBondContact O-CB 3.36Å; T755-N759 PolarHBondContact O-N 2.84Å; T755-N759 VanDerWaalsContact O-N 3.09Å; T755-N759 PolarHBondContact O-ND2 2.95Å; M756-N759 PolarHBondContact O-N 3.01Å; N759-R762 WeakPolarHBondContact O-CB 3.44Å
760	L	89	Confident	85.9	Confident	5 Å²	5	36.9 Å²	36.9	3%	0.026	18%	0.176	C	C	.	.	H	α-helix	trans	-78.2	-45.7	174.9	-66.2	168.1	0	0	0	111.6	Y414 M756 I757 R762 V763 L766 V768 M771	Y414-L760 HydrophobicContact CE1-CD2 4.18Å; Y414-L760 HydrophobicContact CE1-CG 4.49Å; M756-L760 HydrophobicContact CG-CD1 3.83Å; M756-L760 WeakPolarHBondContact O-CG 3.4Å; M756-L760 PolarHBondContact O-N 3.32Å; I757-L760 PolarHBondContact O-N 3.02Å; L760-R762 PolarHBondContact O-N 3.07Å; L760-V763 PolarHBondContact O-N 3.06Å; L760-L766 HydrophobicContact CD2-CB 4.38Å; L760-V768 HydrophobicContact CB-CG2 3.89Å; L760-V768 HydrophobicContact CD1-CB 4.3Å; L760-V768 HydrophobicContact CD1-CG1 4.2Å; L760-V768 HydrophobicContact CD1-CG2 3.93Å; L760-M771 HydrophobicContact CD1-CB 4.45Å; L760-M771 HydrophobicContact CD1-SD 3.6Å; L760-M771 VanDerWaalsContact CD1-SD 3.6Å; L760-M771 HydrophobicContact CD2-SD 4.32Å
761	L	89.6	Confident	85.8	Confident	49 Å²	49	36.4 Å²	36.4	26%	0.257	17%	0.174	S	C	.	.	H	α-helix	trans	-61.1	-13.4	175.4	-70.6	176.7	0	0	0	114	I757 V763 I1059 I1068 V1074	I757-L761 HydrophobicContact CG2-CD1 3.69Å; I757-L761 HydrophobicContact CG2-CG 4.25Å; I757-L761 WeakPolarHBondContact O-CB 3.34Å; I757-L761 VanDerWaalsContact O-CG 3.3Å; I757-L761 WeakPolarHBondContact O-CG 3.27Å; I757-L761 PolarHBondContact O-N 2.87Å; L761-V763 PolarHBondContact O-N 3.35Å; L761-I1059 HydrophobicContact CD1-CD1 3.87Å; L761-I1068 HydrophobicContact CD1-CD1 4.33Å; L761-I1068 HydrophobicContact CD1-CG2 4.12Å; L761-V1074 HydrophobicContact CB-CG2 3.68Å
762	R	84.3	Confident	85.7	Confident	49 Å²	49	31 Å²	31	19%	0.185	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-19.9	170.8	-172.4	178.1	69.8	91.1	-3	113.1	N155 N157 Y414 L758 N759 L760	N155-R762 PolarHBondContact O-NH1 3.21Å; N157-R762 VanDerWaalsContact O-CZ 3.29Å; N157-R762 PolarHBondContact O-NH1 3.1Å; N157-R762 PolarHBondContact O-NH2 3.46Å; Y414-R762 PolarHBondContact O-NH2 2.83Å; L758-R762 PolarHBondContact O-N 3.49Å; N759-R762 WeakPolarHBondContact O-CB 3.44Å; L760-R762 PolarHBondContact O-N 3.07Å
763	V	77	Confident	85.5	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.012	18%	0.177	C	C	.	.			trans	-132.1	100.6	-169.4	-179.3	0	0	0	0	109.2	L138 Y158 P159 L760 L761 A765 L766	L138-V763 HydrophobicContact CD2-CG1 3.96Å; Y158-V763 HydrophobicContact CD2-CG1 4.04Å; Y158-V763 HydrophobicContact CE2-CG1 4.24Å; Y158-V763 HydrophobicContact CG-CG2 4.44Å; P159-V763 HydrophobicContact CG-CG2 4.35Å; L760-V763 PolarHBondContact O-N 3.06Å; L761-V763 PolarHBondContact O-N 3.35Å; V763-A765 PolarHBondContact O-N 2.95Å; V763-L766 HydrophobicContact CG1-CB 4.47Å; V763-L766 HydrophobicContact CG1-CD1 4.38Å; V763-L766 HydrophobicContact CG1-CG 4.28Å; V763-L766 PolarHBondContact O-N 2.92Å
764	E	68.4	Low	85.3	Confident	149 Å²	149	38.8 Å²	38.8	70%	0.696	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-32.2	-173.2	-65.7	-172.5	-172	0	0	114.5	R176 L766	R176-E764 IonicContact NH2-OE2 3.42Å; E764-L766 VanDerWaalsContact C-N 3.28Å; E764-L766 PolarHBondContact O-N 3.37Å
765	A	69.6	Low	85.2	Confident	60 Å²	60	38.1 Å²	38.1	50%	0.496	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-10.4	-178.5	0	0	0	0	0	114.6	L138 V763	L138-A765 HydrophobicContact CD1-CB 3.66Å; V763-A765 PolarHBondContact O-N 2.95Å
766	L	77.9	Confident	85.1	Confident	8 Å²	8	37.5 Å²	37.5	4%	0.042	17%	0.174	C	C	.	.	S	Bend	trans	-121.2	92	-179.8	-65.7	-179.8	0	0	0	111.2	L138 P159 P162 M165 M449 L760 V763 E764	L138-L766 HydrophobicContact CD1-CG 4.47Å; P159-L766 HydrophobicContact CG-CD1 3.65Å; P162-L766 HydrophobicContact CG-CD1 4.33Å; P162-L766 HydrophobicContact CG-CD2 3.96Å; M165-L766 HydrophobicContact CE-CD2 4.37Å; M165-L766 HydrophobicContact SD-CD2 3.44Å; M165-L766 WeakPolarHBondContact SD-CD2 3.29Å; M449-L766 HydrophobicContact CE-CD1 4.04Å; L760-L766 HydrophobicContact CD2-CB 4.38Å; V763-L766 HydrophobicContact CG1-CB 4.47Å; V763-L766 HydrophobicContact CG1-CD1 4.38Å; V763-L766 HydrophobicContact CG1-CG 4.28Å; V763-L766 PolarHBondContact O-N 2.92Å; E764-L766 VanDerWaalsContact C-N 3.28Å; E764-L766 PolarHBondContact O-N 3.37Å
767	R	85.1	Confident	84.7	Confident	174 Å²	174	39.7 Å²	39.7	66%	0.657	19%	0.189	S	C	*	.			trans	-79.3	144.2	-178.2	-52.2	177.8	175.8	175.9	0.3	111.4	T769 D770 M771	R767-T769 WeakPolarHBondContact CB-OG1 3.42Å; R767-T769 PolarHBondContact O-N 3.27Å; R767-D770 WeakPolarHBondContact CB-OD2 3.31Å; R767-D770 PolarHBondContact O-N 3.29Å; R767-M771 PolarHBondContact O-N 2.85Å
768	V	87.6	Confident	84	Confident	4 Å²	4	40.2 Å²	40.2	2%	0.024	19%	0.192	C	C	.	.	H	α-helix	trans	-60.1	-31.3	175.2	-167.7	0	0	0	0	111.6	M756 L760 D770 M771 M772 Y1055	M756-V768 HydrophobicContact CE-CG1 4.43Å; L760-V768 HydrophobicContact CB-CG2 3.89Å; L760-V768 HydrophobicContact CD1-CB 4.3Å; L760-V768 HydrophobicContact CD1-CG1 4.2Å; L760-V768 HydrophobicContact CD1-CG2 3.93Å; V768-D770 PolarHBondContact O-N 2.73Å; V768-M771 PolarHBondContact O-N 2.73Å; V768-M772 HydrophobicContact CG1-CE 4.38Å; V768-M772 WeakPolarHBondContact O-CG 3.44Å; V768-M772 PolarHBondContact O-N 3.04Å; V768-Y1055 HydrophobicContact CB-CD2 4.36Å; V768-Y1055 HydrophobicContact CB-CE2 3.75Å; V768-Y1055 HydrophobicContact CG1-CD2 3.92Å; V768-Y1055 HydrophobicContact CG1-CE2 3.76Å; V768-Y1055 HydrophobicContact CG2-CE2 3.79Å
769	T	86.4	Confident	82.8	Confident	27 Å²	27	41 Å²	41	17%	0.166	20%	0.197	C	C	.	.	H	α-helix	trans	-61.3	-39.6	173.9	48.8	0	0	0	0	112.7	R767 M771 M772 R773 L1052	R767-T769 WeakPolarHBondContact CB-OG1 3.42Å; R767-T769 PolarHBondContact O-N 3.27Å; T769-M771 VanDerWaalsContact C-N 3.32Å; T769-M771 PolarHBondContact O-N 3.14Å; T769-M772 HydrophobicContact CG2-CE 4.09Å; T769-M772 PolarHBondContact O-N 3.19Å; T769-R773 WeakPolarHBondContact O-CB 3.31Å; T769-R773 PolarHBondContact O-N 3.38Å; T769-L1052 HydrophobicContact CG2-CD1 4.29Å
770	D	85.3	Confident	81.5	Confident	43 Å²	43	47 Å²	47	23%	0.23	23%	0.225	C	C	.	.	H	α-helix	trans	-69.4	-34.3	179.6	-59.3	-43.1	0	0	0	111.3	R767 V768 R774	R767-D770 WeakPolarHBondContact CB-OD2 3.31Å; R767-D770 PolarHBondContact O-N 3.29Å; V768-D770 PolarHBondContact O-N 2.73Å; D770-R774 WeakPolarHBondContact O-CB 3.5Å; D770-R774 WeakPolarHBondContact O-CD 3.47Å; D770-R774 VanDerWaalsContact O-CG 3.26Å; D770-R774 WeakPolarHBondContact O-CG 3.06Å; D770-R774 PolarHBondContact O-N 2.93Å
771	M	85.9	Confident	80.2	Confident	5 Å²	5	49.2 Å²	49.2	3%	0.025	23%	0.233	C	C	.	.	H	α-helix	trans	-68.9	-43.6	173	-163.5	173.4	-153.6	0	0	111.9	E445 I448 M449 F750 M756 L760 R767 V768 T769 R774 S775	E445-M771 HydrophobicContact CB-CE 3.81Å; E445-M771 HydrophobicContact CG-CE 3.71Å; I448-M771 HydrophobicContact CD1-CG 4.26Å; I448-M771 HydrophobicContact CG2-CG 4.37Å; M449-M771 HydrophobicContact CG-CE 4.04Å; F750-M771 HydrophobicContact CZ-CG 4.41Å; M756-M771 HydrophobicContact CG-SD 4.16Å; M756-M771 HydrophobicContact SD-CE 4.46Å; M756-M771 HydrophobicContact SD-SD 3.77Å; L760-M771 HydrophobicContact CD1-CB 4.45Å; L760-M771 HydrophobicContact CD1-SD 3.6Å; L760-M771 VanDerWaalsContact CD1-SD 3.6Å; L760-M771 HydrophobicContact CD2-SD 4.32Å; R767-M771 PolarHBondContact O-N 2.85Å; V768-M771 PolarHBondContact O-N 2.73Å; T769-M771 VanDerWaalsContact C-N 3.32Å; T769-M771 PolarHBondContact O-N 3.14Å; M771-R774 PolarHBondContact O-N 3.39Å; M771-S775 PolarHBondContact O-N 2.83Å; M771-S775 VanDerWaalsContact O-N 3.11Å
772	M	87.9	Confident	78.9	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-61.3	-46.1	174	-72.5	-172.9	-67.2	0	0	111.6	F750 L752 V768 T769 R774 S775 L1049 L1051 L1052 Y1055	F750-M772 HydrophobicContact CE1-CG 4.2Å; L752-M772 HydrophobicContact CD1-SD 4.23Å; L752-M772 HydrophobicContact CD2-CG 4.08Å; L752-M772 HydrophobicContact CD2-SD 3.96Å; V768-M772 HydrophobicContact CG1-CE 4.38Å; V768-M772 WeakPolarHBondContact O-CG 3.44Å; V768-M772 PolarHBondContact O-N 3.04Å; T769-M772 HydrophobicContact CG2-CE 4.09Å; T769-M772 PolarHBondContact O-N 3.19Å; M772-R774 PolarHBondContact O-N 3.18Å; M772-S775 VanDerWaalsContact O-CB 3.31Å; M772-S775 WeakPolarHBondContact O-CB 3.43Å; M772-S775 PolarHBondContact O-N 3.49Å; M772-S775 VanDerWaalsContact O-N 3.07Å; M772-S775 PolarHBondContact O-OG 3.28Å; M772-L1049 HydrophobicContact CB-CD1 4.07Å; M772-L1049 HydrophobicContact CE-CD1 4.42Å; M772-L1051 HydrophobicContact SD-CB 3.96Å; M772-L1052 HydrophobicContact CE-CD1 3.89Å; M772-Y1055 HydrophobicContact CE-CD1 4.47Å; M772-Y1055 HydrophobicContact CE-CG 4.25Å
773	R	84.6	Confident	78.1	Confident	132 Å²	132	51.9 Å²	51.9	50%	0.498	25%	0.253	S	S	.	.	H	α-helix	trans	-60.2	-29	177.7	-166.2	-168.3	-68.4	177.4	0.7	112.8	T769 D1046 L1049	T769-R773 WeakPolarHBondContact O-CB 3.31Å; T769-R773 PolarHBondContact O-N 3.38Å; R773-D1046 IonicContact CZ-OD1 2.74Å; R773-D1046 VanDerWaalsContact CZ-OD1 3.28Å; R773-D1046 IonicContact CZ-OD2 3.13Å; R773-D1046 IonicContact NE-OD1 2.91Å; R773-D1046 PolarHBondContact NE-OD1 2.89Å; R773-D1046 IonicContact NH2-OD1 3.68Å; R773-D1046 PolarHBondContact NH2-OD1 3.45Å; R773-D1046 IonicContact NH2-OD2 2.88Å; R773-D1046 PolarHBondContact NH2-OD2 3.11Å; R773-L1049 HydrophobicContact CB-CD2 4.37Å
774	R	86	Confident	77.6	Confident	62 Å²	62	56 Å²	56	23%	0.234	27%	0.272	C	S	.	.	H	α-helix	trans	-92.3	-4.6	177.9	-68.3	171.1	-173.7	-102.3	-1.1	114	G164 I448 W472 I476 D770 M771 M772	G164-R774 VanDerWaalsContact C-NH1 3.28Å; G164-R774 PolarHBondContact O-NH1 3.36Å; G164-R774 PolarHBondContact O-NH2 2.93Å; I448-R774 HydrophobicContact CD1-CB 4.19Å; I448-R774 HydrophobicContact CG1-CB 4.3Å; I448-R774 HydrophobicContact CG2-CB 4.27Å; W472-R774 PolarHBondContact NE1-O 3.19Å; I476-R774 WeakPolarHBondContact CD1-O 3.44Å; I476-R774 HydrophobicContact CG1-CB 4.37Å; I476-R774 PolarHBondContact O-NH1 3.02Å; D770-R774 WeakPolarHBondContact O-CB 3.5Å; D770-R774 WeakPolarHBondContact O-CD 3.47Å; D770-R774 VanDerWaalsContact O-CG 3.26Å; D770-R774 WeakPolarHBondContact O-CG 3.06Å; D770-R774 PolarHBondContact O-N 2.93Å; M771-R774 PolarHBondContact O-N 3.39Å; M772-R774 PolarHBondContact O-N 3.18Å
775	S	89.3	Confident	78	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.007	26%	0.258	C	S	.	.	S	Bend	trans	-61.4	157	177.9	67.3	0	0	0	0	113	W472 M771 M772 S777 E778	W472-S775 PolarHBondContact NE1-O 2.86Å; M771-S775 PolarHBondContact O-N 2.83Å; M771-S775 VanDerWaalsContact O-N 3.11Å; M772-S775 VanDerWaalsContact O-CB 3.31Å; M772-S775 WeakPolarHBondContact O-CB 3.43Å; M772-S775 PolarHBondContact O-N 3.49Å; M772-S775 VanDerWaalsContact O-N 3.07Å; M772-S775 PolarHBondContact O-OG 3.28Å; S775-S777 VanDerWaalsContact C-N 3.34Å; S775-S777 PolarHBondContact OG-OG 2.95Å; S775-S777 VanDerWaalsContact OG-OG 3.08Å; S775-E778 PolarHBondContact O-N 3Å; S775-E778 WeakPolarHBondContact OG-CG 2.93Å
776	F	88.2	Confident	78.6	Confident	4 Å²	4	51 Å²	51	2%	0.018	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-29.5	-178	-179.6	-131.7	0	0	0	112.4	E444 E468 F469 W472 L746 E778 S779	E444-F776 VanDerWaalsContact OE2-CB 3.3Å; E444-F776 WeakPolarHBondContact OE2-CB 3.21Å; E444-F776 PolarHBondContact OE2-N 3.47Å; E468-F776 WeakPolarHBondContact OE1-CZ 3.25Å; F469-F776 HydrophobicContact CD2-CD1 4.38Å; F469-F776 HydrophobicContact CD2-CD2 4.36Å; F469-F776 HydrophobicContact CD2-CE1 4.17Å; F469-F776 HydrophobicContact CD2-CE2 4.13Å; F469-F776 HydrophobicContact CD2-CZ 4.05Å; W472-F776 HydrophobicContact CB-CD2 3.95Å; W472-F776 HydrophobicContact CB-CE2 4.27Å; W472-F776 HydrophobicContact CD2-CB 3.84Å; W472-F776 AromaticContact CD2-CD2 3.61Å; W472-F776 HydrophobicContact CD2-CD2 3.61Å; W472-F776 HydrophobicContact CD2-CG 4.06Å; W472-F776 HydrophobicContact CE3-CB 4.09Å; W472-F776 AromaticContact CE3-CD2 3.88Å; W472-F776 HydrophobicContact CE3-CD2 3.88Å; W472-F776 HydrophobicContact CE3-CG 4.13Å; W472-F776 HydrophobicContact CG-CB 4.5Å; W472-F776 AromaticContact CG-CD2 3.63Å; W472-F776 HydrophobicContact CG-CD2 3.63Å; W472-F776 HydrophobicContact CG-CE2 4.42Å; W472-F776 HydrophobicContact CG-CG 4.49Å; W472-F776 HydrophobicContact CH2-CB 4.03Å; W472-F776 HydrophobicContact CZ2-CB 3.72Å; W472-F776 HydrophobicContact CZ3-CB 4.19Å; L746-F776 HydrophobicContact CB-CE1 4.4Å; F776-E778 VanDerWaalsContact C-N 3.32Å; F776-E778 PolarHBondContact O-N 3.13Å; F776-S779 VanDerWaalsContact O-CB 3.23Å; F776-S779 WeakPolarHBondContact O-CB 3.39Å; F776-S779 PolarHBondContact O-N 2.7Å
777	S	83.6	Confident	78.7	Confident	48 Å²	48	55.5 Å²	55.5	34%	0.336	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-59.1	-40.9	175.3	50.8	0	0	0	0	112.6	S748 S775 S779	S748-S777 VanDerWaalsContact CB-N 3.33Å; S748-S777 PolarHBondContact OG-N 3.2Å; S775-S777 VanDerWaalsContact C-N 3.34Å; S775-S777 PolarHBondContact OG-OG 2.95Å; S775-S777 VanDerWaalsContact OG-OG 3.08Å; S777-S779 VanDerWaalsContact C-N 3.32Å; S777-S779 PolarHBondContact O-N 2.7Å
778	E	77.6	Confident	78.7	Confident	11 Å²	11	53 Å²	53	5%	0.051	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-80.4	-10.6	-179.5	-60.1	-70.2	165.8	0	0	112.8	S775 F776 H780 R781 L1049 M1050	S775-E778 PolarHBondContact O-N 3Å; S775-E778 WeakPolarHBondContact OG-CG 2.93Å; F776-E778 VanDerWaalsContact C-N 3.32Å; F776-E778 PolarHBondContact O-N 3.13Å; E778-H780 PolarHBondContact O-N 2.98Å; E778-H780 VanDerWaalsContact O-N 3.09Å; E778-R781 VanDerWaalsContact O-CB 3.31Å; E778-R781 WeakPolarHBondContact O-CB 3.49Å; E778-R781 WeakPolarHBondContact O-CG 3.42Å; E778-R781 PolarHBondContact O-N 3.14Å; E778-R781 WeakPolarHBondContact OE2-CD 3.29Å; E778-R781 IonicContact OE2-CZ 3.05Å; E778-R781 IonicContact OE2-NE 3.66Å; E778-R781 IonicContact OE2-NH1 2.66Å; E778-R781 PolarHBondContact OE2-NH1 3.1Å; E778-L1049 HydrophobicContact CG-CD2 3.99Å; E778-M1050 WeakPolarHBondContact OE1-CB 3.49Å; E778-M1050 PolarHBondContact OE1-N 2.79Å
779	S	66.9	Low	78.7	Confident	17 Å²	17	57.4 Å²	57.4	12%	0.119	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-61.7	-21.9	-176.3	-169.7	0	0	0	0	114.9	W472 R475 F776 S777 R781	W472-S779 WeakPolarHBondContact CB-OG 3.34Å; W472-S779 VanDerWaalsContact CD1-CB 3.44Å; R475-S779 PolarHBondContact NH1-O 2.86Å; F776-S779 VanDerWaalsContact O-CB 3.23Å; F776-S779 WeakPolarHBondContact O-CB 3.39Å; F776-S779 PolarHBondContact O-N 2.7Å; S777-S779 VanDerWaalsContact C-N 3.32Å; S777-S779 PolarHBondContact O-N 2.7Å; S779-R781 PolarHBondContact O-N 2.81Å
780	H	61.6	Low	78.9	Confident	136 Å²	136	56.8 Å²	56.8	63%	0.63	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-70.7	-8.5	176.1	-77.1	74.1	0	0	0	113.5	E468 E778 D782	E468-H780 IonicContact OE1-CE1 3.64Å; E468-H780 PolarHBondContact OE1-CE1 3.15Å; E468-H780 IonicContact OE1-NE2 2.75Å; E778-H780 PolarHBondContact O-N 2.98Å; E778-H780 VanDerWaalsContact O-N 3.09Å; H780-D782 PolarHBondContact O-N 3.23Å
781	R	61.9	Low	79.1	Confident	51 Å²	51	56.6 Å²	56.6	19%	0.192	28%	0.281	C	S	.	.	S	Bend	trans	-81.3	114.4	176.5	-62.3	168.7	69.9	149.2	9.1	108.4	E778 S779 T783 L1043 S1048	E778-R781 VanDerWaalsContact O-CB 3.31Å; E778-R781 WeakPolarHBondContact O-CB 3.49Å; E778-R781 WeakPolarHBondContact O-CG 3.42Å; E778-R781 PolarHBondContact O-N 3.14Å; E778-R781 WeakPolarHBondContact OE2-CD 3.29Å; E778-R781 IonicContact OE2-CZ 3.05Å; E778-R781 IonicContact OE2-NE 3.66Å; E778-R781 IonicContact OE2-NH1 2.66Å; E778-R781 PolarHBondContact OE2-NH1 3.1Å; S779-R781 PolarHBondContact O-N 2.81Å; R781-T783 PolarHBondContact O-N 3.41Å; R781-T783 PolarHBondContact O-OG1 2.99Å; R781-L1043 PolarHBondContact NH2-O 2.86Å; R781-S1048 PolarHBondContact NH1-O 2.84Å; R781-S1048 PolarHBondContact NH2-OG 2.98Å
782	D	62.8	Low	79.4	Confident	102 Å²	102	60.7 Å²	60.7	55%	0.545	30%	0.3	S	S	.	.			trans	-75.5	64.4	173.7	-88.1	-32.4	0	0	0	110.5	H780 Q784 A785 H786	H780-D782 PolarHBondContact O-N 3.23Å; D782-Q784 PolarHBondContact O-N 3.11Å; D782-Q784 VanDerWaalsContact O-N 3.14Å; D782-A785 HydrophobicContact CB-CB 3.77Å; D782-A785 WeakPolarHBondContact O-CA 3.27Å; D782-A785 PolarHBondContact O-N 3.03Å; D782-H786 PolarHBondContact O-CD2 3.2Å; D782-H786 PolarHBondContact O-N 3.19Å
783	T	65.9	Low	79.6	Confident	52 Å²	52	60.6 Å²	60.6	32%	0.319	30%	0.3	S	S	.	.	H	α-helix	trans	-51.4	-40.9	-180	-22.8	0	0	0	0	111	R781 A785 H786 E787 V1044	R781-T783 PolarHBondContact O-N 3.41Å; R781-T783 PolarHBondContact O-OG1 2.99Å; T783-A785 PolarHBondContact O-N 3.43Å; T783-H786 PolarHBondContact O-N 3.3Å; T783-E787 WeakPolarHBondContact O-CB 3.43Å; T783-E787 VanDerWaalsContact O-CG 3.27Å; T783-E787 WeakPolarHBondContact O-CG 3.39Å; T783-E787 PolarHBondContact O-N 3.27Å; T783-V1044 HydrophobicContact CG2-CB 4.48Å; T783-V1044 HydrophobicContact CG2-CG1 4.01Å; T783-V1044 HydrophobicContact CG2-CG2 4.08Å
784	Q	67.3	Low	79.9	Confident	88 Å²	88	59.8 Å²	59.8	41%	0.411	30%	0.3	S	S	.	.	H	α-helix	trans	-70.1	-23.6	176.9	-63.7	-173	6.9	0	0	115	D782 K788	D782-Q784 PolarHBondContact O-N 3.11Å; D782-Q784 VanDerWaalsContact O-N 3.14Å; Q784-K788 WeakPolarHBondContact O-CD 2.97Å; Q784-K788 VanDerWaalsContact O-CG 3.26Å; Q784-K788 WeakPolarHBondContact O-CG 3.22Å; Q784-K788 PolarHBondContact O-N 2.9Å; Q784-K788 PolarHBondContact O-NZ 3.22Å
785	A	77	Confident	80.2	Confident	49 Å²	49	63.5 Å²	63.5	41%	0.405	32%	0.32	S	S	.	.	H	α-helix	trans	-80.1	-40.2	172.3	0	0	0	0	0	109.8	D782 T783 K788 R789	D782-A785 HydrophobicContact CB-CB 3.77Å; D782-A785 WeakPolarHBondContact O-CA 3.27Å; D782-A785 PolarHBondContact O-N 3.03Å; T783-A785 PolarHBondContact O-N 3.43Å; A785-K788 PolarHBondContact O-N 3.23Å; A785-R789 WeakPolarHBondContact O-CB 3.38Å; A785-R789 PolarHBondContact O-N 3.13Å
786	H	81.1	Confident	80.2	Confident	54 Å²	54	66.4 Å²	66.4	25%	0.25	33%	0.334	C	S	.	.	H	α-helix	trans	-60.8	-46.6	172.4	-60.5	-45.5	0	0	0	111.5	D782 T783 K788 R789 I790 L1040 V1044	D782-H786 PolarHBondContact O-CD2 3.2Å; D782-H786 PolarHBondContact O-N 3.19Å; T783-H786 PolarHBondContact O-N 3.3Å; H786-K788 PolarHBondContact O-N 3.37Å; H786-R789 CarbonylContact O-C 3.46Å; H786-R789 PolarHBondContact O-N 3.06Å; H786-R789 VanDerWaalsContact O-N 3.17Å; H786-I790 WeakPolarHBondContact O-CB 3.48Å; H786-I790 WeakPolarHBondContact O-CD1 3.44Å; H786-I790 WeakPolarHBondContact O-CG1 3.46Å; H786-I790 PolarHBondContact O-N 3.08Å; H786-L1040 HydrophobicContact CB-CD2 4.2Å; H786-L1040 VanDerWaalsContact ND1-CD2 3.29Å; H786-L1040 WeakPolarHBondContact ND1-CD2 3.4Å; H786-V1044 HydrophobicContact CB-CG2 3.7Å
787	E	81.6	Confident	80.3	Confident	103 Å²	103	68 Å²	68	48%	0.481	34%	0.343	S	S	.	.	H	α-helix	trans	-57.1	-44.4	175.1	-76.9	163.8	-173.2	0	0	113	T783 I790 G791	T783-E787 WeakPolarHBondContact O-CB 3.43Å; T783-E787 VanDerWaalsContact O-CG 3.27Å; T783-E787 WeakPolarHBondContact O-CG 3.39Å; T783-E787 PolarHBondContact O-N 3.27Å; E787-I790 WeakPolarHBondContact O-CB 3.44Å; E787-I790 PolarHBondContact O-N 2.69Å; E787-G791 PolarHBondContact O-N 3.43Å
788	K	84.8	Confident	80.5	Confident	122 Å²	122	69.8 Å²	69.8	53%	0.53	36%	0.36	S	S	.	.	H	α-helix	trans	-65.2	-41.4	175.7	-72.2	168.6	-168.4	127.1	0	111.8	Q784 A785 H786 G791 H792	Q784-K788 WeakPolarHBondContact O-CD 2.97Å; Q784-K788 VanDerWaalsContact O-CG 3.26Å; Q784-K788 WeakPolarHBondContact O-CG 3.22Å; Q784-K788 PolarHBondContact O-N 2.9Å; Q784-K788 PolarHBondContact O-NZ 3.22Å; A785-K788 PolarHBondContact O-N 3.23Å; H786-K788 PolarHBondContact O-N 3.37Å; K788-G791 PolarHBondContact O-N 3.26Å; K788-H792 PolarHBondContact O-N 2.98Å
789	R	87.3	Confident	81.1	Confident	96 Å²	96	73.8 Å²	73.8	36%	0.362	39%	0.389	S	S	.	.	H	α-helix	trans	-66.2	-40.5	176.1	-175.7	61.6	176.9	166.8	7.4	111.2	A785 H786 H792 L793 E1036 L1040	A785-R789 WeakPolarHBondContact O-CB 3.38Å; A785-R789 PolarHBondContact O-N 3.13Å; H786-R789 CarbonylContact O-C 3.46Å; H786-R789 PolarHBondContact O-N 3.06Å; H786-R789 VanDerWaalsContact O-N 3.17Å; R789-H792 PolarHBondContact O-N 2.94Å; R789-L793 HydrophobicContact CG-CD1 3.94Å; R789-L793 HydrophobicContact CG-CG 4.34Å; R789-L793 WeakPolarHBondContact O-CB 3.49Å; R789-L793 VanDerWaalsContact O-CG 3.27Å; R789-L793 WeakPolarHBondContact O-CG 3.37Å; R789-L793 PolarHBondContact O-N 3.32Å; R789-E1036 IonicContact CZ-OE1 3.43Å; R789-E1036 VanDerWaalsContact CZ-OE1 3.26Å; R789-E1036 IonicContact CZ-OE2 3.84Å; R789-E1036 IonicContact NE-OE1 3.64Å; R789-E1036 PolarHBondContact NE-OE1 3.3Å; R789-E1036 VanDerWaalsContact NH2-CD 3.28Å; R789-E1036 IonicContact NH2-OE1 2.69Å; R789-E1036 PolarHBondContact NH2-OE1 2.79Å; R789-E1036 IonicContact NH2-OE2 3.84Å; R789-E1036 PolarHBondContact NH2-OE2 3.34Å; R789-L1040 HydrophobicContact CB-CD1 4.11Å; R789-L1040 HydrophobicContact CG-CD1 3.5Å
790	I	90.1	Very high	82.1	Confident	14 Å²	14	74.6 Å²	74.6	7%	0.072	39%	0.392	C	S	.	.	H	α-helix	trans	-58.3	-47.4	172	-74.3	161.9	0	0	0	110.4	H786 E787 H792 L793 K794 L1037 L1040 L1041 V1044	H786-I790 WeakPolarHBondContact O-CB 3.48Å; H786-I790 WeakPolarHBondContact O-CD1 3.44Å; H786-I790 WeakPolarHBondContact O-CG1 3.46Å; H786-I790 PolarHBondContact O-N 3.08Å; E787-I790 WeakPolarHBondContact O-CB 3.44Å; E787-I790 PolarHBondContact O-N 2.69Å; I790-H792 VanDerWaalsContact C-N 3.35Å; I790-H792 PolarHBondContact O-N 3.04Å; I790-L793 PolarHBondContact O-N 3.39Å; I790-K794 HydrophobicContact CG2-CD 4.13Å; I790-K794 WeakPolarHBondContact O-CB 3.41Å; I790-K794 VanDerWaalsContact O-CG 3.31Å; I790-K794 WeakPolarHBondContact O-CG 3.29Å; I790-K794 PolarHBondContact O-N 2.76Å; I790-L1037 HydrophobicContact CB-CD1 4.22Å; I790-L1037 HydrophobicContact CG1-CD1 4.19Å; I790-L1037 HydrophobicContact CG2-CD1 3.83Å; I790-L1040 HydrophobicContact CD1-CB 4Å; I790-L1040 HydrophobicContact CG1-CB 3.69Å; I790-L1040 HydrophobicContact CG1-CD1 4.48Å; I790-L1041 HydrophobicContact CD1-CD2 4.15Å; I790-L1041 HydrophobicContact CD1-CG 4.48Å; I790-L1041 HydrophobicContact CG2-CD2 4.14Å; I790-V1044 HydrophobicContact CD1-CB 4.49Å; I790-V1044 HydrophobicContact CD1-CG2 3.86Å
791	G	89.8	Confident	83	Confident	40 Å²	40	71.2 Å²	71.2	41%	0.412	38%	0.382	S	S	.	.	H	α-helix	trans	-58.8	-44.7	175.8	0	0	0	0	0	112.6	E787 K788 Q795	E787-G791 PolarHBondContact O-N 3.43Å; K788-G791 PolarHBondContact O-N 3.26Å; G791-Q795 PolarHBondContact O-N 2.99Å; G791-Q795 VanDerWaalsContact O-N 3.09Å
792	H	92.3	Very high	83.6	Confident	90 Å²	90	74 Å²	74	42%	0.417	41%	0.407	S	S	.	.	H	α-helix	trans	-66.9	-43	176.7	-176.7	62.5	0	0	0	113.1	K788 R789 I790 Q795 M796	K788-H792 PolarHBondContact O-N 2.98Å; R789-H792 PolarHBondContact O-N 2.94Å; I790-H792 VanDerWaalsContact C-N 3.35Å; I790-H792 PolarHBondContact O-N 3.04Å; H792-Q795 WeakPolarHBondContact O-CB 3.35Å; H792-Q795 PolarHBondContact O-N 2.85Å; H792-M796 WeakPolarHBondContact O-CG 3.16Å; H792-M796 PolarHBondContact O-N 3.05Å
793	L	91.6	Very high	84	Confident	1 Å²	1	71.2 Å²	71.2	1%	0.005	39%	0.392	C	S	.	.	H	α-helix	trans	-66	-38.4	176.9	-71.4	168.4	0	0	0	112.1	R789 I790 Q795 M796 L797 V1033 E1036 L1037 L1040	R789-L793 HydrophobicContact CG-CD1 3.94Å; R789-L793 HydrophobicContact CG-CG 4.34Å; R789-L793 WeakPolarHBondContact O-CB 3.49Å; R789-L793 VanDerWaalsContact O-CG 3.27Å; R789-L793 WeakPolarHBondContact O-CG 3.37Å; R789-L793 PolarHBondContact O-N 3.32Å; I790-L793 PolarHBondContact O-N 3.39Å; L793-Q795 VanDerWaalsContact C-N 3.31Å; L793-Q795 PolarHBondContact O-N 3.48Å; L793-M796 HydrophobicContact CD2-SD 4.33Å; L793-M796 PolarHBondContact O-N 3.49Å; L793-L797 WeakPolarHBondContact O-CB 3.39Å; L793-L797 PolarHBondContact O-N 3.32Å; L793-V1033 HydrophobicContact CB-CG1 4.42Å; L793-V1033 HydrophobicContact CD2-CG1 4.01Å; L793-E1036 HydrophobicContact CD1-CB 4.12Å; L793-E1036 HydrophobicContact CD1-CG 3.88Å; L793-L1037 HydrophobicContact CB-CB 4.39Å; L793-L1037 HydrophobicContact CB-CD1 4.32Å; L793-L1037 HydrophobicContact CD1-CB 4.41Å; L793-L1040 HydrophobicContact CD1-CD1 3.52Å
794	K	91.9	Very high	84.2	Confident	114 Å²	114	74 Å²	74	50%	0.496	40%	0.401	S	S	.	.	H	α-helix	trans	-59.9	-41.4	171	-76.4	179	176.5	-174.9	0	111.4	I790 A798 L1037	I790-K794 HydrophobicContact CG2-CD 4.13Å; I790-K794 WeakPolarHBondContact O-CB 3.41Å; I790-K794 VanDerWaalsContact O-CG 3.31Å; I790-K794 WeakPolarHBondContact O-CG 3.29Å; I790-K794 PolarHBondContact O-N 2.76Å; K794-A798 WeakPolarHBondContact O-CB 3.36Å; K794-A798 PolarHBondContact O-N 2.59Å; K794-L1037 HydrophobicContact CG-CD1 3.95Å; K794-L1037 HydrophobicContact CG-CD2 4Å
795	Q	92.1	Very high	84	Confident	140 Å²	140	73 Å²	73	65%	0.654	40%	0.401	S	S	*	.	H	α-helix	trans	-66	-42.6	174.9	-170.4	-178.8	11.9	0	0	112.1	G791 H792 L793 A798 S799	G791-Q795 PolarHBondContact O-N 2.99Å; G791-Q795 VanDerWaalsContact O-N 3.09Å; H792-Q795 WeakPolarHBondContact O-CB 3.35Å; H792-Q795 PolarHBondContact O-N 2.85Å; L793-Q795 VanDerWaalsContact C-N 3.31Å; L793-Q795 PolarHBondContact O-N 3.48Å; Q795-A798 PolarHBondContact O-N 3.39Å; Q795-S799 PolarHBondContact O-N 3.34Å; Q795-S799 VanDerWaalsContact O-N 3.1Å
796	M	89.9	Confident	83.7	Confident	62 Å²	62	79 Å²	79	31%	0.305	42%	0.421	S	S	.	.	H	α-helix	trans	-60	-49.6	174.4	-72.3	-179.8	66	0	0	111.2	H792 L793 A798 S799 L800 V1033	H792-M796 WeakPolarHBondContact O-CG 3.16Å; H792-M796 PolarHBondContact O-N 3.05Å; L793-M796 HydrophobicContact CD2-SD 4.33Å; L793-M796 PolarHBondContact O-N 3.49Å; M796-A798 VanDerWaalsContact C-N 3.28Å; M796-A798 PolarHBondContact O-N 2.7Å; M796-S799 WeakPolarHBondContact O-CA 3.45Å; M796-S799 PolarHBondContact O-N 2.71Å; M796-S799 PolarHBondContact O-OG 3.33Å; M796-L800 PolarHBondContact O-N 2.84Å; M796-L800 VanDerWaalsContact O-N 3.14Å; M796-V1033 HydrophobicContact CB-CG1 4.38Å; M796-V1033 HydrophobicContact CE-CG2 4.29Å
797	L	89.3	Confident	83.2	Confident	38 Å²	38	79.4 Å²	79.4	20%	0.199	44%	0.44	C	S	.	.	H	α-helix	trans	-62.1	-34	-179.7	-171.3	145.2	0	0	0	112.5	L793 S799 V1033 Q1034 L1037	L793-L797 WeakPolarHBondContact O-CB 3.39Å; L793-L797 PolarHBondContact O-N 3.32Å; L797-S799 VanDerWaalsContact C-N 3.34Å; L797-V1033 HydrophobicContact CB-CG1 4Å; L797-V1033 HydrophobicContact CD1-CG1 4.39Å; L797-Q1034 HydrophobicContact CD1-CB 3.96Å; L797-Q1034 HydrophobicContact CD1-CG 4.4Å; L797-L1037 HydrophobicContact CD1-CD2 4.48Å
798	A	88.9	Confident	82.5	Confident	85 Å²	85	80.4 Å²	80.4	70%	0.702	44%	0.444	S	S	*	.	H	α-helix	trans	-72.2	-23.8	172.4	0	0	0	0	0	113.7	K794 Q795 M796	K794-A798 WeakPolarHBondContact O-CB 3.36Å; K794-A798 PolarHBondContact O-N 2.59Å; Q795-A798 PolarHBondContact O-N 3.39Å; M796-A798 VanDerWaalsContact C-N 3.28Å; M796-A798 PolarHBondContact O-N 2.7Å
799	S	89.8	Confident	81.9	Confident	95 Å²	95	75.2 Å²	75.2	66%	0.664	42%	0.422	S	S	*	.	H	α-helix	trans	-86.3	-15.9	177.1	72	0	0	0	0	114.4	Q795 M796 L797	Q795-S799 PolarHBondContact O-N 3.34Å; Q795-S799 VanDerWaalsContact O-N 3.1Å; M796-S799 WeakPolarHBondContact O-CA 3.45Å; M796-S799 PolarHBondContact O-N 2.71Å; M796-S799 PolarHBondContact O-OG 3.33Å; L797-S799 VanDerWaalsContact C-N 3.34Å
800	L	86.6	Confident	81.5	Confident	34 Å²	34	74.6 Å²	74.6	18%	0.178	43%	0.433	C	S	.	.	S	Bend	trans	-73.1	140.1	177.2	-71.1	174.8	0	0	0	111.1	M796 E1029 R1030	M796-L800 PolarHBondContact O-N 2.84Å; M796-L800 VanDerWaalsContact O-N 3.14Å; L800-E1029 HydrophobicContact CD2-CG 4.31Å; L800-R1030 HydrophobicContact CD1-CB 4.01Å; L800-R1030 HydrophobicContact CD1-CG 4.23Å
801	P	80.4	Confident	81.2	Confident	65 Å²	65	75.1 Å²	75.1	42%	0.422	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-61	154.3	-179.1	25.2	-34.1	0	0	0	112.5	R1030	P801-R1030 PolarHBondContact O-NH1 3.02Å
802	P	74.3	Confident	80.8	Confident	109 Å²	109	73.3 Å²	73.3	71%	0.708	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-63.9	152	172	28.8	-34.6	0	0	0	111
803	L	72.6	Confident	80.4	Confident	45 Å²	45	71.8 Å²	71.8	24%	0.236	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-84	136.8	179.7	-60.5	179.4	0	0	0	110.9	T805 L813 I1027	L803-T805 HydrophobicContact CB-CG2 4.05Å; L803-T805 PolarHBondContact O-N 2.78Å; L803-L813 HydrophobicContact CD1-CD2 4.34Å; L803-I1027 HydrophobicContact CD1-CD1 4.47Å; L803-I1027 HydrophobicContact CD1-CG1 3.88Å; L803-I1027 HydrophobicContact CD2-CG1 3.57Å; L803-I1027 HydrophobicContact CG-CG1 4.33Å
804	E	69	Low	80.1	Confident	109 Å²	109	74.8 Å²	74.8	51%	0.509	43%	0.431	S	S	.	.			trans	-86.2	99.1	170.2	-71	162.7	-139.6	0	0	109.2	Q1023 R1026	E804-Q1023 PolarHBondContact OE1-NE2 2.98Å; E804-Q1023 PolarHBondContact OE2-NE2 3.14Å; E804-R1026 IonicContact OE1-NH1 2.72Å
805	T	64.8	Low	79.8	Confident	68 Å²	68	69.6 Å²	69.6	42%	0.417	41%	0.408	S	S	.	.			trans	-106.5	15.2	-175.8	55.1	0	0	0	0	113.9	L803 S810	L803-T805 HydrophobicContact CB-CG2 4.05Å; L803-T805 PolarHBondContact O-N 2.78Å; T805-S810 WeakPolarHBondContact O-CA 3.31Å
806	E	69.2	Low	79.5	Confident	176 Å²	176	63.4 Å²	63.4	82%	0.822	38%	0.379	S	S	*	.			trans	-82	147.1	-174.8	-64	-171.1	-179	0	0	113.2	Q808 L809	E806-Q808 PolarHBondContact O-N 2.63Å; E806-L809 PolarHBondContact O-N 3.43Å
807	G	70.1	Confident	79.3	Confident	62 Å²	62	65.2 Å²	65.2	64%	0.639	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	61.9	-122.5	174.6	0	0	0	0	0	113.9	L809 S810	G807-L809 PolarHBondContact O-N 3.18Å; G807-S810 WeakPolarHBondContact O-CB 3.2Å; G807-S810 PolarHBondContact O-N 3.28Å; G807-S810 PolarHBondContact O-OG 3.48Å
808	Q	67.8	Low	79.1	Confident	124 Å²	124	64.4 Å²	64.4	58%	0.579	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-68	-8.4	-176.2	-69.7	179	-25.6	0	0	114.1	E806 C1014	E806-Q808 PolarHBondContact O-N 2.63Å; Q808-C1014 WeakPolarHBondContact O-CA 3.45Å; Q808-C1014 PolarHBondContact O-N 3.25Å
809	L	71.9	Confident	78.9	Confident	12 Å²	12	60.5 Å²	60.5	6%	0.063	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-100.1	7.8	179	-65.8	173.7	0	0	0	113.4	E806 G807 D811 I812 C1014 Q1023	E806-L809 PolarHBondContact O-N 3.43Å; G807-L809 PolarHBondContact O-N 3.18Å; L809-D811 VanDerWaalsContact C-N 3.26Å; L809-D811 PolarHBondContact O-N 2.79Å; L809-I812 HydrophobicContact CD2-CD1 4.13Å; L809-I812 WeakPolarHBondContact O-CB 3.45Å; L809-I812 WeakPolarHBondContact O-CG2 3.39Å; L809-I812 PolarHBondContact O-N 3.16Å; L809-C1014 HydrophobicContact CD2-CB 4.5Å; L809-Q1023 HydrophobicContact CD1-CG 4.1Å
810	S	78.6	Confident	78.6	Confident	84 Å²	84	57.6 Å²	57.6	59%	0.587	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-23.4	-174.9	46.8	0	0	0	0	114.7	T805 G807	T805-S810 WeakPolarHBondContact O-CA 3.31Å; G807-S810 WeakPolarHBondContact O-CB 3.2Å; G807-S810 PolarHBondContact O-N 3.28Å; G807-S810 PolarHBondContact O-OG 3.48Å
811	D	83.9	Confident	78.6	Confident	24 Å²	24	59.1 Å²	59.1	13%	0.128	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	6.5	-177.6	63.2	-37	0	0	0	114.2	L809 L813 P814 Y815 F1012 N1013 C1014	L809-D811 VanDerWaalsContact C-N 3.26Å; L809-D811 PolarHBondContact O-N 2.79Å; D811-L813 VanDerWaalsContact C-N 3.34Å; D811-L813 PolarHBondContact O-N 3.48Å; D811-P814 VanDerWaalsContact O-CD 3.31Å; D811-P814 WeakPolarHBondContact O-CD 3.35Å; D811-Y815 PolarHBondContact O-N 2.75Å; D811-F1012 HydrophobicContact CB-CD1 4.04Å; D811-F1012 VanDerWaalsContact OD2-CA 3.27Å; D811-F1012 WeakPolarHBondContact OD2-CA 3.33Å; D811-F1012 WeakPolarHBondContact OD2-CB 3.42Å; D811-F1012 WeakPolarHBondContact OD2-CD1 3.34Å; D811-N1013 PolarHBondContact OD2-N 2.98Å; D811-C1014 WeakPolarHBondContact OD1-CB 3.39Å; D811-C1014 PolarHBondContact OD1-N 3.47Å; D811-C1014 VanDerWaalsContact OD1-N 3.12Å; D811-C1014 PolarHBondContact OD2-N 3.17Å
812	I	82.5	Confident	78.8	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-65.3	-30.5	-175.3	-164.5	163.4	0	0	0	114.4	L809 Y816 C1014 F1020 Q1023 F1024 I1027	L809-I812 HydrophobicContact CD2-CD1 4.13Å; L809-I812 WeakPolarHBondContact O-CB 3.45Å; L809-I812 WeakPolarHBondContact O-CG2 3.39Å; L809-I812 PolarHBondContact O-N 3.16Å; I812-Y816 PolarHBondContact O-N 2.85Å; I812-C1014 HydrophobicContact CB-CB 4.18Å; I812-F1020 HydrophobicContact CD1-CD2 4.03Å; I812-F1020 HydrophobicContact CD1-CE2 4.21Å; I812-F1020 HydrophobicContact CG1-CD2 4.49Å; I812-F1020 HydrophobicContact CG1-CE2 4.23Å; I812-Q1023 HydrophobicContact CD1-CB 4.1Å; I812-F1024 HydrophobicContact CD1-CB 4.35Å; I812-F1024 HydrophobicContact CG1-CD2 4.33Å; I812-I1027 HydrophobicContact CB-CD1 4.08Å; I812-I1027 HydrophobicContact CD1-CD1 3.6Å; I812-I1027 HydrophobicContact CG1-CD1 3.57Å; I812-I1027 HydrophobicContact CG2-CD1 3.39Å
813	L	83.1	Confident	79.1	Confident	59 Å²	59	55.5 Å²	55.5	31%	0.309	30%	0.303	S	S	.	.	H	α-helix	trans	-72.6	-50.6	175.8	-74.8	171.7	0	0	0	111.6	L803 D811 Y815 Y816 H817 I1027 M1031	L803-L813 HydrophobicContact CD1-CD2 4.34Å; D811-L813 VanDerWaalsContact C-N 3.34Å; D811-L813 PolarHBondContact O-N 3.48Å; L813-Y815 VanDerWaalsContact C-N 3.29Å; L813-Y815 PolarHBondContact O-N 2.86Å; L813-Y816 WeakPolarHBondContact O-CB 3.24Å; L813-Y816 PolarHBondContact O-N 3.42Å; L813-H817 PolarHBondContact O-CD2 3.25Å; L813-H817 PolarHBondContact O-N 3.48Å; L813-I1027 HydrophobicContact CD2-CG2 3.93Å; L813-M1031 HydrophobicContact CD2-SD 4.38Å
814	P	85.5	Confident	79.7	Confident	64 Å²	64	57.8 Å²	57.8	42%	0.416	32%	0.316	S	S	.	.	H	α-helix	trans	-48.6	-47.6	165.6	-31.3	35.1	0	0	0	113.6	D811 Y816 H817 T818 F1012	D811-P814 VanDerWaalsContact O-CD 3.31Å; D811-P814 WeakPolarHBondContact O-CD 3.35Å; P814-Y816 PolarHBondContact O-N 2.95Å; P814-H817 PolarHBondContact O-N 3.1Å; P814-T818 PolarHBondContact O-N 2.61Å; P814-T818 PolarHBondContact O-OG1 3.08Å; P814-F1012 HydrophobicContact CB-CE1 3.72Å; P814-F1012 HydrophobicContact CB-CZ 4.25Å
815	Y	85.4	Confident	80.5	Confident	5 Å²	5	53.4 Å²	53.4	2%	0.02	30%	0.297	C	S	.	.	H	α-helix	trans	-58.4	-44.7	177.2	-179.3	-84.1	0	0	0	112.3	D811 L813 H817 T818 A819 L1009 F1012 V1015 F1020 F1024	D811-Y815 PolarHBondContact O-N 2.75Å; L813-Y815 VanDerWaalsContact C-N 3.29Å; L813-Y815 PolarHBondContact O-N 2.86Å; Y815-H817 PolarHBondContact O-N 3.1Å; Y815-T818 PolarHBondContact O-N 3.29Å; Y815-A819 HydrophobicContact CE1-CB 4.33Å; Y815-A819 VanDerWaalsContact O-CB 3.27Å; Y815-A819 WeakPolarHBondContact O-CB 3.43Å; Y815-A819 PolarHBondContact O-N 3.16Å; Y815-L1009 HydrophobicContact CD2-CD2 3.83Å; Y815-L1009 HydrophobicContact CE2-CD2 3.58Å; Y815-F1012 HydrophobicContact CD2-CB 3.82Å; Y815-F1012 AromaticContact CD2-CD2 3.64Å; Y815-F1012 HydrophobicContact CD2-CD2 3.64Å; Y815-F1012 HydrophobicContact CD2-CE2 4.38Å; Y815-F1012 AromaticContact CD2-CG 3.84Å; Y815-F1012 HydrophobicContact CD2-CG 3.84Å; Y815-F1012 HydrophobicContact CE2-CD2 4.47Å; Y815-F1012 HydrophobicContact CG-CD2 4.47Å; Y815-V1015 HydrophobicContact CD2-CG2 3.93Å; Y815-V1015 HydrophobicContact CE2-CG2 3.39Å; Y815-F1020 HydrophobicContact CD1-CE2 4.18Å; Y815-F1020 AromaticContact CD1-CZ 3.95Å; Y815-F1020 HydrophobicContact CD1-CZ 3.95Å; Y815-F1020 HydrophobicContact CE1-CE2 4.25Å; Y815-F1020 AromaticContact CE1-CZ 3.57Å; Y815-F1020 HydrophobicContact CE1-CZ 3.57Å; Y815-F1020 AromaticContact CZ-CZ 4Å; Y815-F1024 HydrophobicContact CD1-CD2 4.17Å; Y815-F1024 AromaticContact CD1-CE2 3.7Å; Y815-F1024 HydrophobicContact CD1-CE2 3.7Å; Y815-F1024 HydrophobicContact CE1-CD2 4.39Å; Y815-F1024 AromaticContact CE1-CE2 3.9Å; Y815-F1024 HydrophobicContact CE1-CE2 3.9Å; Y815-F1024 HydrophobicContact CE1-CZ 4.41Å
816	Y	85.3	Confident	81.4	Confident	10 Å²	10	53.1 Å²	53.1	4%	0.039	29%	0.288	C	S	.	.	H	α-helix	trans	-58.2	-46	174.9	173.5	-90.5	0	0	0	112	I812 L813 P814 A819 T820 F1024 I1027 K1028 M1031 E1035	I812-Y816 PolarHBondContact O-N 2.85Å; L813-Y816 WeakPolarHBondContact O-CB 3.24Å; L813-Y816 PolarHBondContact O-N 3.42Å; P814-Y816 PolarHBondContact O-N 2.95Å; Y816-A819 PolarHBondContact O-N 3.36Å; Y816-T820 WeakPolarHBondContact O-CB 3.47Å; Y816-T820 PolarHBondContact O-N 3.04Å; Y816-T820 PolarHBondContact O-OG1 3.39Å; Y816-F1024 AromaticContact CD2-CE2 3.95Å; Y816-F1024 HydrophobicContact CD2-CE2 3.95Å; Y816-F1024 AromaticContact CD2-CZ 3.83Å; Y816-F1024 HydrophobicContact CD2-CZ 3.83Å; Y816-F1024 HydrophobicContact CG-CE2 4.46Å; Y816-I1027 HydrophobicContact CD2-CG2 4.14Å; Y816-I1027 HydrophobicContact CG-CG2 4.1Å; Y816-K1028 HydrophobicContact CE2-CB 4.09Å; Y816-K1028 HydrophobicContact CE2-CG 4.15Å; Y816-M1031 HydrophobicContact CD1-CB 4.28Å; Y816-M1031 HydrophobicContact CD1-CE 4.25Å; Y816-M1031 HydrophobicContact CD1-CG 3.91Å; Y816-M1031 HydrophobicContact CE1-CB 3.52Å; Y816-M1031 HydrophobicContact CE1-CE 3.92Å; Y816-M1031 HydrophobicContact CE1-CG 3.66Å; Y816-M1031 HydrophobicContact CE2-CB 4.18Å; Y816-M1031 HydrophobicContact CG-CG 4.46Å; Y816-M1031 VanDerWaalsContact CZ-CB 3.47Å; Y816-M1031 WeakPolarHBondContact OH-CB 3.28Å; Y816-E1035 WeakPolarHBondContact CE1-OE1 3.38Å; Y816-E1035 PolarHBondContact OH-OE1 3.16Å
817	H	86	Confident	82	Confident	99 Å²	99	48.7 Å²	48.7	46%	0.458	27%	0.267	S	S	.	.	H	α-helix	trans	-63.7	-46.2	178.4	-70.7	-62.9	0	0	0	112.1	L813 P814 Y815 A819 T820 E821 M1031	L813-H817 PolarHBondContact O-CD2 3.25Å; L813-H817 PolarHBondContact O-N 3.48Å; P814-H817 PolarHBondContact O-N 3.1Å; Y815-H817 PolarHBondContact O-N 3.1Å; H817-A819 PolarHBondContact O-N 2.96Å; H817-T820 PolarHBondContact O-N 2.84Å; H817-E821 WeakPolarHBondContact O-CB 3.29Å; H817-E821 PolarHBondContact O-N 3.18Å; H817-M1031 VanDerWaalsContact CE1-CE 3.5Å; H817-M1031 WeakPolarHBondContact CE1-CE 3.49Å
818	T	86.3	Confident	82.6	Confident	22 Å²	22	48.3 Å²	48.3	14%	0.135	26%	0.258	C	S	.	.	H	α-helix	trans	-62.3	-41.6	177.1	-57.1	0	0	0	0	112.1	P814 Y815 M822 L1005 S1008 L1009 F1012	P814-T818 PolarHBondContact O-N 2.61Å; P814-T818 PolarHBondContact O-OG1 3.08Å; Y815-T818 PolarHBondContact O-N 3.29Å; T818-M822 WeakPolarHBondContact O-CB 3.25Å; T818-M822 PolarHBondContact O-N 3.38Å; T818-L1005 HydrophobicContact CG2-CD2 3.82Å; T818-S1008 WeakPolarHBondContact CG2-OG 3.48Å; T818-L1009 HydrophobicContact CG2-CD2 3.83Å; T818-L1009 HydrophobicContact CG2-CG 3.82Å; T818-F1012 HydrophobicContact CG2-CE2 4.21Å
819	A	83.6	Confident	83.4	Confident	3 Å²	3	43 Å²	43	3%	0.025	23%	0.234	C	C	.	.	H	α-helix	trans	-66.2	-42.5	177.5	0	0	0	0	0	112.5	Y815 Y816 H817 M822 Q823 L901	Y815-A819 HydrophobicContact CE1-CB 4.33Å; Y815-A819 VanDerWaalsContact O-CB 3.27Å; Y815-A819 WeakPolarHBondContact O-CB 3.43Å; Y815-A819 PolarHBondContact O-N 3.16Å; Y816-A819 PolarHBondContact O-N 3.36Å; H817-A819 PolarHBondContact O-N 2.96Å; A819-M822 PolarHBondContact O-N 3.42Å; A819-Q823 PolarHBondContact O-N 3.48Å; A819-L901 HydrophobicContact CB-CD1 4.44Å
820	T	84.3	Confident	83.8	Confident	33 Å²	33	44.4 Å²	44.4	20%	0.202	24%	0.24	C	C	.	.	H	α-helix	trans	-68.9	-41	177.7	-61.6	0	0	0	0	111.5	Y816 H817 Q823 N824	Y816-T820 WeakPolarHBondContact O-CB 3.47Å; Y816-T820 PolarHBondContact O-N 3.04Å; Y816-T820 PolarHBondContact O-OG1 3.39Å; H817-T820 PolarHBondContact O-N 2.84Å; T820-Q823 PolarHBondContact O-N 3.18Å; T820-N824 VanDerWaalsContact O-CG 3.29Å; T820-N824 PolarHBondContact O-N 2.67Å; T820-N824 PolarHBondContact O-ND2 3.47Å
821	E	85.9	Confident	83.9	Confident	67 Å²	67	46.7 Å²	46.7	31%	0.313	24%	0.239	S	C	.	.	H	α-helix	trans	-61.1	-46.9	172.7	-164.8	-172.1	159.8	0	0	110.9	H817 Q823 N824 T825 R1001 L1005	H817-E821 WeakPolarHBondContact O-CB 3.29Å; H817-E821 PolarHBondContact O-N 3.18Å; E821-Q823 VanDerWaalsContact C-N 3.29Å; E821-Q823 PolarHBondContact O-N 3.4Å; E821-N824 PolarHBondContact O-N 2.99Å; E821-N824 VanDerWaalsContact O-N 3.15Å; E821-T825 PolarHBondContact O-N 3.08Å; E821-T825 PolarHBondContact O-OG1 3.38Å; E821-T825 VanDerWaalsContact O-OG1 3.05Å; E821-R1001 IonicContact OE1-CZ 2.75Å; E821-R1001 IonicContact OE1-NE 3.64Å; E821-R1001 PolarHBondContact OE1-NE 2.88Å; E821-R1001 IonicContact OE1-NH2 2.72Å; E821-R1001 PolarHBondContact OE1-NH2 3.04Å; E821-R1001 IonicContact OE2-CZ 3.35Å; E821-R1001 IonicContact OE2-NH2 2.96Å; E821-R1001 PolarHBondContact OE2-NH2 2.98Å; E821-L1005 HydrophobicContact CB-CD1 4.17Å; E821-L1005 HydrophobicContact CB-CD2 4.42Å; E821-L1005 HydrophobicContact CG-CD1 3.85Å; E821-L1005 HydrophobicContact CG-CD2 4.48Å
822	M	84.6	Confident	83.9	Confident	10 Å²	10	46.9 Å²	46.9	5%	0.049	24%	0.244	C	C	.	.	H	α-helix	trans	-56.7	-41.4	176.1	-179.5	-171.4	53.1	0	0	111.9	T818 A819 R826 L1002 L1005 Q1006 L1009	T818-M822 WeakPolarHBondContact O-CB 3.25Å; T818-M822 PolarHBondContact O-N 3.38Å; A819-M822 PolarHBondContact O-N 3.42Å; M822-R826 VanDerWaalsContact O-CB 3.23Å; M822-R826 WeakPolarHBondContact O-CB 3.45Å; M822-R826 PolarHBondContact O-N 2.74Å; M822-R826 PolarHBondContact SD-NH2 2.75Å; M822-L1002 HydrophobicContact CG-CD1 3.72Å; M822-L1005 HydrophobicContact CB-CB 4.29Å; M822-L1005 HydrophobicContact CB-CD1 4.43Å; M822-Q1006 HydrophobicContact SD-CG 3.88Å; M822-L1009 HydrophobicContact CE-CD1 3.51Å; M822-L1009 HydrophobicContact SD-CD1 3.56Å; M822-L1009 VanDerWaalsContact SD-CD1 3.56Å
823	Q	81.8	Confident	83.8	Confident	87 Å²	87	47.9 Å²	47.9	41%	0.407	25%	0.249	S	C	.	.	H	α-helix	trans	-64.3	-49.3	175.8	-177.2	175.1	-19.2	0	0	111.2	A819 T820 E821 T825 R826 E827	A819-Q823 PolarHBondContact O-N 3.48Å; T820-Q823 PolarHBondContact O-N 3.18Å; E821-Q823 VanDerWaalsContact C-N 3.29Å; E821-Q823 PolarHBondContact O-N 3.4Å; Q823-T825 PolarHBondContact O-N 3.09Å; Q823-R826 WeakPolarHBondContact O-CB 3.45Å; Q823-R826 PolarHBondContact O-N 3.49Å; Q823-R826 VanDerWaalsContact O-N 3.15Å; Q823-E827 HydrophobicContact CG-CG 4.48Å; Q823-E827 WeakPolarHBondContact CG-OE1 3.32Å; Q823-E827 PolarHBondContact NE2-OE1 3.2Å; Q823-E827 WeakPolarHBondContact O-CG 3.1Å; Q823-E827 PolarHBondContact O-N 2.94Å
824	N	84.8	Confident	83.3	Confident	94 Å²	94	47.6 Å²	47.6	50%	0.503	25%	0.247	S	C	.	.	H	α-helix	trans	-60.5	-44.4	180	-69.7	-24.3	0	0	0	112.3	T820 E821 R826 E827 A828	T820-N824 VanDerWaalsContact O-CG 3.29Å; T820-N824 PolarHBondContact O-N 2.67Å; T820-N824 PolarHBondContact O-ND2 3.47Å; E821-N824 PolarHBondContact O-N 2.99Å; E821-N824 VanDerWaalsContact O-N 3.15Å; N824-R826 VanDerWaalsContact C-N 3.35Å; N824-R826 PolarHBondContact O-N 3.24Å; N824-E827 PolarHBondContact O-N 3.43Å; N824-A828 WeakPolarHBondContact O-CB 3.45Å; N824-A828 PolarHBondContact O-N 3.48Å
825	T	85.4	Confident	83	Confident	17 Å²	17	51.1 Å²	51.1	10%	0.104	26%	0.258	C	S	.	.	H	α-helix	trans	-63.3	-39.5	175	-53.6	0	0	0	0	111.4	E821 Q823 L829 S998 L1002	E821-T825 PolarHBondContact O-N 3.08Å; E821-T825 PolarHBondContact O-OG1 3.38Å; E821-T825 VanDerWaalsContact O-OG1 3.05Å; Q823-T825 PolarHBondContact O-N 3.09Å; T825-L829 VanDerWaalsContact O-CB 3.23Å; T825-L829 WeakPolarHBondContact O-CB 3.34Å; T825-L829 PolarHBondContact O-N 2.96Å; T825-S998 VanDerWaalsContact CG2-O 3.3Å; T825-S998 WeakPolarHBondContact CG2-O 3.48Å; T825-L1002 HydrophobicContact CG2-CB 4.14Å; T825-L1002 HydrophobicContact CG2-CD1 4.38Å
826	R	82.9	Confident	82.9	Confident	62 Å²	62	51.7 Å²	51.7	23%	0.234	26%	0.263	C	S	.	.	H	α-helix	trans	-64.7	-44.3	176.3	-176.5	176.1	-67.1	125.2	3.8	111.9	M822 Q823 N824 L829 Q830 L1002	M822-R826 VanDerWaalsContact O-CB 3.23Å; M822-R826 WeakPolarHBondContact O-CB 3.45Å; M822-R826 PolarHBondContact O-N 2.74Å; M822-R826 PolarHBondContact SD-NH2 2.75Å; Q823-R826 WeakPolarHBondContact O-CB 3.45Å; Q823-R826 PolarHBondContact O-N 3.49Å; Q823-R826 VanDerWaalsContact O-N 3.15Å; N824-R826 VanDerWaalsContact C-N 3.35Å; N824-R826 PolarHBondContact O-N 3.24Å; R826-L829 PolarHBondContact O-N 3.21Å; R826-Q830 WeakPolarHBondContact O-CB 3.19Å; R826-Q830 VanDerWaalsContact O-CG 3.31Å; R826-Q830 WeakPolarHBondContact O-CG 3.44Å; R826-Q830 PolarHBondContact O-N 3.42Å; R826-L1002 HydrophobicContact CB-CD1 4.14Å
827	E	81.9	Confident	82.7	Confident	82 Å²	82	55.9 Å²	55.9	38%	0.383	29%	0.289	S	S	.	.	H	α-helix	trans	-65.3	-42.8	177.7	-72.4	-176.5	-155.1	0	0	112.1	Q823 N824 L829 Q830 K831	Q823-E827 HydrophobicContact CG-CG 4.48Å; Q823-E827 WeakPolarHBondContact CG-OE1 3.32Å; Q823-E827 PolarHBondContact NE2-OE1 3.2Å; Q823-E827 WeakPolarHBondContact O-CG 3.1Å; Q823-E827 PolarHBondContact O-N 2.94Å; N824-E827 PolarHBondContact O-N 3.43Å; E827-L829 PolarHBondContact O-N 2.96Å; E827-Q830 PolarHBondContact O-N 3.26Å; E827-K831 PolarHBondContact O-N 2.93Å
828	A	83.8	Confident	82.6	Confident	55 Å²	55	54 Å²	54	46%	0.455	28%	0.282	S	S	.	.	H	α-helix	trans	-60.6	-44.1	174.5	0	0	0	0	0	112	N824 K831 A832	N824-A828 WeakPolarHBondContact O-CB 3.45Å; N824-A828 PolarHBondContact O-N 3.48Å; A828-K831 WeakPolarHBondContact O-CB 3.19Å; A828-K831 PolarHBondContact O-N 2.95Å; A828-A832 PolarHBondContact O-N 2.77Å
829	L	83.9	Confident	82.3	Confident	13 Å²	13	53 Å²	53	7%	0.068	28%	0.276	C	S	.	.	H	α-helix	trans	-65	-41.6	177.3	-171.6	62.6	0	0	0	111.9	T825 R826 E827 K831 A832 I833 P984 V995 L1002	T825-L829 VanDerWaalsContact O-CB 3.23Å; T825-L829 WeakPolarHBondContact O-CB 3.34Å; T825-L829 PolarHBondContact O-N 2.96Å; R826-L829 PolarHBondContact O-N 3.21Å; E827-L829 PolarHBondContact O-N 2.96Å; L829-K831 VanDerWaalsContact C-N 3.35Å; L829-K831 PolarHBondContact O-N 2.9Å; L829-A832 PolarHBondContact O-N 2.68Å; L829-I833 HydrophobicContact CG-CD1 4.36Å; L829-I833 WeakPolarHBondContact O-CD1 3.22Å; L829-I833 VanDerWaalsContact O-CG1 3.25Å; L829-I833 WeakPolarHBondContact O-CG1 3.28Å; L829-I833 PolarHBondContact O-N 3.2Å; L829-P984 HydrophobicContact CD1-CB 4.19Å; L829-P984 HydrophobicContact CD1-CG 4.25Å; L829-P984 HydrophobicContact CD2-CG 4.16Å; L829-P984 HydrophobicContact CG-CG 4.26Å; L829-V995 HydrophobicContact CD1-CG1 3.81Å; L829-L1002 HydrophobicContact CD2-CD2 3.97Å
830	Q	81.1	Confident	82.1	Confident	41 Å²	41	55.5 Å²	55.5	19%	0.192	29%	0.289	C	S	.	.	H	α-helix	trans	-61.5	-40.2	173.3	-76.3	179	-5.5	0	0	112.4	R826 E827 I833 M834 I925	R826-Q830 WeakPolarHBondContact O-CB 3.19Å; R826-Q830 VanDerWaalsContact O-CG 3.31Å; R826-Q830 WeakPolarHBondContact O-CG 3.44Å; R826-Q830 PolarHBondContact O-N 3.42Å; E827-Q830 PolarHBondContact O-N 3.26Å; Q830-I833 PolarHBondContact O-N 3.2Å; Q830-M834 PolarHBondContact O-N 3.21Å; Q830-I925 PolarHBondContact NE2-O 3.04Å
831	K	81.1	Confident	82	Confident	132 Å²	132	60.4 Å²	60.4	57%	0.574	31%	0.307	S	S	*	.	H	α-helix	trans	-63.1	-46.1	175.4	-171.5	-172.2	175.6	-156.8	0	111.7	E827 A828 L829 I833 M834 E835	E827-K831 PolarHBondContact O-N 2.93Å; A828-K831 WeakPolarHBondContact O-CB 3.19Å; A828-K831 PolarHBondContact O-N 2.95Å; L829-K831 VanDerWaalsContact C-N 3.35Å; L829-K831 PolarHBondContact O-N 2.9Å; K831-I833 VanDerWaalsContact C-N 3.28Å; K831-I833 PolarHBondContact O-N 3.41Å; K831-M834 WeakPolarHBondContact O-CB 3.4Å; K831-M834 PolarHBondContact O-N 3.22Å; K831-E835 WeakPolarHBondContact CE-OE1 3.44Å; K831-E835 IonicContact NZ-OE1 3.93Å; K831-E835 PolarHBondContact O-N 3.35Å; K831-E835 VanDerWaalsContact O-N 3.07Å
832	A	82	Confident	81.9	Confident	28 Å²	28	57.6 Å²	57.6	23%	0.231	30%	0.295	C	S	.	.	H	α-helix	trans	-61.4	-36.1	176	0	0	0	0	0	112.5	A828 L829 S836 V995	A828-A832 PolarHBondContact O-N 2.77Å; L829-A832 PolarHBondContact O-N 2.68Å; A832-S836 PolarHBondContact O-N 3.22Å; A832-V995 HydrophobicContact CB-CG2 3.58Å
833	I	81.6	Confident	81.9	Confident	22 Å²	22	57.2 Å²	57.2	11%	0.113	29%	0.294	C	S	.	.	H	α-helix	trans	-64.6	-39.1	173.1	-67.8	163.3	0	0	0	111.3	L829 Q830 K831 S836 I928 P984 L988 L990	L829-I833 HydrophobicContact CG-CD1 4.36Å; L829-I833 WeakPolarHBondContact O-CD1 3.22Å; L829-I833 VanDerWaalsContact O-CG1 3.25Å; L829-I833 WeakPolarHBondContact O-CG1 3.28Å; L829-I833 PolarHBondContact O-N 3.2Å; Q830-I833 PolarHBondContact O-N 3.2Å; K831-I833 VanDerWaalsContact C-N 3.28Å; K831-I833 PolarHBondContact O-N 3.41Å; I833-S836 PolarHBondContact O-N 2.87Å; I833-S836 PolarHBondContact O-OG 3.28Å; I833-I928 HydrophobicContact CG2-CD1 4.22Å; I833-P984 HydrophobicContact CD1-CB 4.24Å; I833-P984 HydrophobicContact CD1-CG 3.88Å; I833-P984 HydrophobicContact CG1-CB 4.43Å; I833-L988 HydrophobicContact CD1-CD1 4.34Å; I833-L988 HydrophobicContact CG1-CD1 4.1Å; I833-L988 HydrophobicContact CG2-CD1 3.97Å; I833-L990 HydrophobicContact CG1-CD1 3.87Å
834	M	72.3	Confident	82.2	Confident	54 Å²	54	55.6 Å²	55.6	27%	0.266	29%	0.292	S	S	.	.	H	α-helix	trans	-64.9	-42.1	177.4	-179.3	-175.1	178.5	0	0	113.1	Q830 K831 S836 R873 L922	Q830-M834 PolarHBondContact O-N 3.21Å; K831-M834 WeakPolarHBondContact O-CB 3.4Å; K831-M834 PolarHBondContact O-N 3.22Å; M834-S836 PolarHBondContact O-N 2.76Å; M834-R873 HydrophobicContact CE-CB 4.3Å; M834-L922 HydrophobicContact CB-CD1 3.96Å; M834-L922 HydrophobicContact CE-CD1 4.08Å; M834-L922 HydrophobicContact CG-CD1 3.58Å; M834-L922 HydrophobicContact SD-CD1 3.36Å; M834-L922 WeakPolarHBondContact SD-CD1 3.25Å
835	E	78.9	Confident	82.3	Confident	138 Å²	138	54.7 Å²	54.7	65%	0.645	29%	0.29	S	S	*	.	H	α-helix	trans	-69.3	-21.2	177.8	-68.3	174.9	-174.1	0	0	111.7	K831	K831-E835 WeakPolarHBondContact CE-OE1 3.44Å; K831-E835 IonicContact NZ-OE1 3.93Å; K831-E835 PolarHBondContact O-N 3.35Å; K831-E835 VanDerWaalsContact O-N 3.07Å
836	S	83	Confident	82.4	Confident	17 Å²	17	54.1 Å²	54.1	12%	0.119	29%	0.287	C	S	.	.	S	Bend	trans	-80.8	135.8	179.5	84.3	0	0	0	0	114.2	A832 I833 M834 N838 G839 L840 L990	A832-S836 PolarHBondContact O-N 3.22Å; I833-S836 PolarHBondContact O-N 2.87Å; I833-S836 PolarHBondContact O-OG 3.28Å; M834-S836 PolarHBondContact O-N 2.76Å; S836-N838 PolarHBondContact O-N 2.72Å; S836-G839 PolarHBondContact O-N 3.05Å; S836-G839 WeakPolarHBondContact OG-CA 3.34Å; S836-G839 PolarHBondContact OG-N 3.41Å; S836-L840 WeakPolarHBondContact O-CG 3.2Å; S836-L840 PolarHBondContact O-N 3.31Å; S836-L990 VanDerWaalsContact CB-CD2 3.42Å
837	V	82.5	Confident	82.7	Confident	98 Å²	98	52.8 Å²	52.8	59%	0.594	28%	0.282	S	S	*	.	H	α-helix	trans	-62	-30.9	173.9	178.9	0	0	0	0	112	K841	V837-K841 HydrophobicContact CG1-CD 4.48Å; V837-K841 WeakPolarHBondContact O-CG 3.26Å; V837-K841 PolarHBondContact O-N 3.21Å
838	N	82.6	Confident	83.2	Confident	59 Å²	59	49 Å²	49	32%	0.316	26%	0.264	S	S	.	.	H	α-helix	trans	-76.5	-39.3	-180	-71.5	-9.3	0	0	0	112.5	S836 L840 K841 A842 L988	S836-N838 PolarHBondContact O-N 2.72Å; N838-L840 VanDerWaalsContact C-N 3.34Å; N838-L840 PolarHBondContact O-N 3.07Å; N838-K841 WeakPolarHBondContact O-CB 3.02Å; N838-K841 PolarHBondContact O-N 3.37Å; N838-A842 PolarHBondContact O-N 3.08Å; N838-L988 VanDerWaalsContact CB-O 3.31Å; N838-L988 WeakPolarHBondContact CB-O 3.37Å; N838-L988 PolarHBondContact ND2-O 3.27Å
839	G	80.9	Confident	83.5	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-61.2	-42.1	172.1	0	0	0	0	0	112.4	S836 K841 A842 L843	S836-G839 PolarHBondContact O-N 3.05Å; S836-G839 WeakPolarHBondContact OG-CA 3.34Å; S836-G839 PolarHBondContact OG-N 3.41Å; G839-K841 VanDerWaalsContact C-N 3.31Å; G839-K841 PolarHBondContact O-N 3.32Å; G839-A842 WeakPolarHBondContact O-CB 3.26Å; G839-A842 PolarHBondContact O-N 3.36Å; G839-A842 VanDerWaalsContact O-N 3.11Å; G839-L843 PolarHBondContact O-N 3.22Å
840	L	79.4	Confident	83.7	Confident	56 Å²	56	46.5 Å²	46.5	29%	0.293	24%	0.243	S	C	.	.	H	α-helix	trans	-64.1	-32.4	174.1	-66.4	178	0	0	0	113.4	S836 N838	S836-L840 WeakPolarHBondContact O-CG 3.2Å; S836-L840 PolarHBondContact O-N 3.31Å; N838-L840 VanDerWaalsContact C-N 3.34Å; N838-L840 PolarHBondContact O-N 3.07Å
841	K	82.6	Confident	83.9	Confident	136 Å²	136	44.6 Å²	44.6	59%	0.591	23%	0.234	S	C	*	.	H	α-helix	trans	-71.9	-34.3	171.3	-73.2	168.4	-177.8	170.1	0	112.3	V837 N838 G839 S844	V837-K841 HydrophobicContact CG1-CD 4.48Å; V837-K841 WeakPolarHBondContact O-CG 3.26Å; V837-K841 PolarHBondContact O-N 3.21Å; N838-K841 WeakPolarHBondContact O-CB 3.02Å; N838-K841 PolarHBondContact O-N 3.37Å; G839-K841 VanDerWaalsContact C-N 3.31Å; G839-K841 PolarHBondContact O-N 3.32Å; K841-S844 VanDerWaalsContact O-CB 3.29Å; K841-S844 WeakPolarHBondContact O-CB 3.39Å; K841-S844 PolarHBondContact O-N 3.45Å; K841-S844 PolarHBondContact O-OG 3.27Å
842	A	83.3	Confident	84	Confident	8 Å²	8	40.9 Å²	40.9	7%	0.066	22%	0.221	C	C	.	.	H	α-helix	trans	-65.6	-40.9	176.6	0	0	0	0	0	111.6	N838 G839 S844 R847 L982 L988	N838-A842 PolarHBondContact O-N 3.08Å; G839-A842 WeakPolarHBondContact O-CB 3.26Å; G839-A842 PolarHBondContact O-N 3.36Å; G839-A842 VanDerWaalsContact O-N 3.11Å; A842-S844 PolarHBondContact O-N 3.39Å; A842-R847 WeakPolarHBondContact O-CG 3.1Å; A842-R847 PolarHBondContact O-NE 3.22Å; A842-L982 HydrophobicContact CB-CD1 4.02Å; A842-L988 HydrophobicContact CB-CD2 3.63Å
843	L	84.9	Confident	83.9	Confident	3 Å²	3	41.3 Å²	41.3	2%	0.016	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	40.6	173.1	-65.6	170.2	0	0	0	113.4	G839 V849 I863 F875 L922 I928	G839-L843 PolarHBondContact O-N 3.22Å; L843-V849 HydrophobicContact CD2-CG1 4.13Å; L843-I863 HydrophobicContact CB-CD1 4.08Å; L843-I863 HydrophobicContact CD2-CD1 3.71Å; L843-F875 HydrophobicContact CB-CD1 4.41Å; L843-F875 HydrophobicContact CB-CE1 3.72Å; L843-F875 HydrophobicContact CB-CZ 4.4Å; L843-F875 HydrophobicContact CD1-CE1 3.97Å; L843-F875 HydrophobicContact CD1-CZ 3.84Å; L843-F875 HydrophobicContact CG-CE1 4.37Å; L843-L922 HydrophobicContact CD1-CD2 3.71Å; L843-I928 HydrophobicContact CD1-CD1 4.25Å; L843-I928 HydrophobicContact CD2-CD1 3.69Å; L843-I928 HydrophobicContact CD2-CG1 3.81Å; L843-I928 HydrophobicContact CD2-CG2 4.4Å; L843-I928 HydrophobicContact CG-CD1 3.77Å; L843-I928 HydrophobicContact CG-CG1 4.45Å
844	S	86.9	Confident	83.5	Confident	52 Å²	52	50 Å²	50	36%	0.364	26%	0.256	S	S	.	.			trans	-81.7	161.5	174.8	38.3	0	0	0	0	112.4	K841 A842 G846 R847	K841-S844 VanDerWaalsContact O-CB 3.29Å; K841-S844 WeakPolarHBondContact O-CB 3.39Å; K841-S844 PolarHBondContact O-N 3.45Å; K841-S844 PolarHBondContact O-OG 3.27Å; A842-S844 PolarHBondContact O-N 3.39Å; S844-G846 PolarHBondContact O-N 2.87Å; S844-R847 WeakPolarHBondContact O-CB 3.49Å; S844-R847 PolarHBondContact O-N 3Å
845	V	87.6	Confident	83.5	Confident	76 Å²	76	51.9 Å²	51.9	46%	0.461	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	133.1	175.2	175.7	0	0	0	0	110.9	L864 P937	V845-L864 WeakPolarHBondContact CG2-O 3.37Å; V845-P937 HydrophobicContact CG1-CB 4.4Å; V845-P937 HydrophobicContact CG1-CG 3.32Å
846	G	87	Confident	83.5	Confident	4 Å²	4	45.9 Å²	45.9	4%	0.041	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.3	-6.1	-175	0	0	0	0	0	114.8	S844 I863 T932 L933	S844-G846 PolarHBondContact O-N 2.87Å; G846-I863 PolarHBondContact N-O 3.21Å; G846-T932 CarbonylContact O-C 3.52Å; G846-T932 VanDerWaalsContact O-CA 3.29Å; G846-T932 WeakPolarHBondContact O-CA 3.31Å; G846-L933 WeakPolarHBondContact CA-O 3.38Å; G846-L933 PolarHBondContact O-N 3.48Å
847	R	90.6	Very high	83.2	Confident	34 Å²	34	48 Å²	48	13%	0.128	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	134.2	171.7	-179.7	61.9	60.8	-174.1	-6.2	110.9	A842 S844 V849 V862 I863 I928 T929 V930 T932	A842-R847 WeakPolarHBondContact O-CG 3.1Å; A842-R847 PolarHBondContact O-NE 3.22Å; S844-R847 WeakPolarHBondContact O-CB 3.49Å; S844-R847 PolarHBondContact O-N 3Å; R847-V849 HydrophobicContact CG-CG1 4.14Å; R847-V862 WeakPolarHBondContact O-CA 3.46Å; R847-I863 HydrophobicContact CB-CD1 4.16Å; R847-I863 HydrophobicContact CB-CG1 4.49Å; R847-I863 HydrophobicContact CG-CD1 4.48Å; R847-I863 PolarHBondContact O-N 2.98Å; R847-I928 HydrophobicContact CG-CG2 3.83Å; R847-T929 WeakPolarHBondContact CD-O 3.22Å; R847-T929 PolarHBondContact NH1-O 2.85Å; R847-V930 VanDerWaalsContact NH1-C 3.3Å; R847-V930 PolarHBondContact NH1-O 3.13Å; R847-T932 VanDerWaalsContact CZ-CG2 3.47Å
848	V	90.5	Very high	83.2	Confident	2 Å²	2	44 Å²	44	1%	0.012	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	131.5	168.5	179.2	0	0	0	0	109.3	L860 G861 V862 T929 K931 L933 L968	V848-L860 HydrophobicContact CG1-CD2 4.3Å; V848-G861 CarbonylContact C-O 3.54Å; V848-G861 VanDerWaalsContact CA-O 3.31Å; V848-G861 WeakPolarHBondContact CA-O 3.27Å; V848-V862 HydrophobicContact CG2-CG2 4.14Å; V848-T929 WeakPolarHBondContact CB-OG1 3.43Å; V848-T929 HydrophobicContact CG1-CG2 4.34Å; V848-T929 WeakPolarHBondContact O-CB 3.24Å; V848-T929 PolarHBondContact O-N 3.4Å; V848-T929 VanDerWaalsContact O-N 3.14Å; V848-T929 PolarHBondContact O-OG1 2.9Å; V848-K931 HydrophobicContact CB-CB 4.4Å; V848-K931 HydrophobicContact CG2-CB 4.38Å; V848-K931 PolarHBondContact N-O 2.94Å; V848-K931 VanDerWaalsContact N-O 3.13Å; V848-L933 HydrophobicContact CG2-CD1 3.96Å; V848-L933 HydrophobicContact CG2-CG 3.8Å; V848-L968 HydrophobicContact CG1-CD2 4.12Å; V848-L968 HydrophobicContact CG2-CD2 4.28Å
849	V	90.3	Very high	83.4	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	152.8	178.9	-67.2	0	0	0	0	110.5	L843 R847 V851 G861 I863 I925	L843-V849 HydrophobicContact CD2-CG1 4.13Å; R847-V849 HydrophobicContact CG-CG1 4.14Å; V849-V851 HydrophobicContact CG2-CG2 4.15Å; V849-G861 PolarHBondContact N-O 3.46Å; V849-G861 PolarHBondContact O-N 2.89Å; V849-I863 HydrophobicContact CG1-CD1 3.95Å; V849-I863 HydrophobicContact CG1-CG1 4.2Å; V849-I863 HydrophobicContact CG2-CG1 4.31Å; V849-I925 HydrophobicContact CB-CG2 4.01Å; V849-I925 HydrophobicContact CG1-CG2 4.16Å
850	I	88.1	Confident	83.8	Confident	17 Å²	17	41.3 Å²	41.3	9%	0.087	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	120.4	170	-56.5	179.2	0	0	0	107.3	N858 L860 L906 I925 S926 A927 T929	I850-N858 HydrophobicContact CG2-CB 4.49Å; I850-L860 HydrophobicContact CG1-CD2 4Å; I850-L906 HydrophobicContact CD1-CD2 4.06Å; I850-L906 HydrophobicContact CG1-CD2 4.32Å; I850-L906 HydrophobicContact CG2-CD2 4.39Å; I850-I925 CarbonylContact O-C 3.4Å; I850-S926 PolarHBondContact O-N 3.47Å; I850-A927 HydrophobicContact CD1-CB 4.31Å; I850-A927 PolarHBondContact N-O 2.7Å; I850-T929 HydrophobicContact CG1-CG2 4.1Å
851	V	86.2	Confident	84.3	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	131.6	180	-173.7	0	0	0	0	109.1	V849 N858 A859 I879 L920 D924	V849-V851 HydrophobicContact CG2-CG2 4.15Å; V851-N858 CarbonylContact O-C 3.48Å; V851-N858 WeakPolarHBondContact O-CA 3.46Å; V851-N858 PolarHBondContact O-N 3.22Å; V851-N858 VanDerWaalsContact O-N 3.12Å; V851-A859 PolarHBondContact N-O 3.38Å; V851-A859 PolarHBondContact O-N 2.69Å; V851-I879 HydrophobicContact CG1-CD1 4.16Å; V851-I879 HydrophobicContact CG2-CD1 4.31Å; V851-I879 HydrophobicContact CG2-CG1 4.24Å; V851-L920 HydrophobicContact CB-CD1 4.43Å; V851-L920 HydrophobicContact CG1-CD1 3.93Å; V851-L920 HydrophobicContact CG1-CD2 3.82Å; V851-L920 HydrophobicContact CG2-CD1 3.58Å; V851-D924 CarbonylContact C-O 3.59Å; V851-D924 WeakPolarHBondContact CA-O 3.37Å; V851-D924 WeakPolarHBondContact CG1-O 3.27Å
852	N	83.6	Confident	84.8	Confident	54 Å²	54	32.2 Å²	32.2	29%	0.289	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	102.3	174.1	-166.4	4.4	0	0	0	108.9	H856 D924	N852-H856 CarbonylContact C-O 3.6Å; N852-H856 VanDerWaalsContact CA-O 3.31Å; N852-H856 WeakPolarHBondContact CA-O 3.43Å; N852-D924 PolarHBondContact N-O 3.34Å
853	N	79.9	Confident	85.2	Confident	38 Å²	38	31.9 Å²	31.9	20%	0.203	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	166.8	-178.2	-165.3	-12.1	0	0	0	108.6	Q855 H856 D924	N853-Q855 PolarHBondContact O-N 3.47Å; N853-H856 PolarHBondContact N-O 3.03Å; N853-H856 CarbonylContact O-C 3.57Å; N853-H856 PolarHBondContact O-N 3.48Å; N853-H856 VanDerWaalsContact O-O 3.13Å; N853-D924 HydrophobicContact CB-CB 4.24Å; N853-D924 PolarHBondContact ND2-OD1 2.82Å
854	K	73.4	Confident	85.4	Confident	205 Å²	205	31.9 Å²	31.9	89%	0.891	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-21.9	-179	-62.9	-170.1	175.2	-165.5	0	115.2
855	Q	72.5	Confident	85.4	Confident	92 Å²	92	34.5 Å²	34.5	43%	0.43	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-19.8	-179.8	-65.8	177.2	-47.6	0	0	114	N853	N853-Q855 PolarHBondContact O-N 3.47Å
856	H	78.3	Confident	85.3	Confident	12 Å²	12	32.8 Å²	32.8	6%	0.056	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	103.6	-168.8	-65.4	-41.3	0	0	0	109.1	N852 N853 A859 I879 T916	N852-H856 CarbonylContact C-O 3.6Å; N852-H856 VanDerWaalsContact CA-O 3.31Å; N852-H856 WeakPolarHBondContact CA-O 3.43Å; N853-H856 PolarHBondContact N-O 3.03Å; N853-H856 CarbonylContact O-C 3.57Å; N853-H856 PolarHBondContact O-N 3.48Å; N853-H856 VanDerWaalsContact O-O 3.13Å; H856-A859 HydrophobicContact CB-CB 4.1Å; H856-I879 HydrophobicContact CB-CG2 4.32Å; H856-T916 PolarHBondContact CE1-OG1 3.14Å; H856-T916 PolarHBondContact NE2-OG1 3.29Å
857	L	76.8	Confident	85.2	Confident	62 Å²	62	34.5 Å²	34.5	33%	0.325	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	119.7	-175	-63.6	159.7	0	0	0	109.1	A859 F907	L857-A859 PolarHBondContact O-N 3.41Å; L857-F907 WeakPolarHBondContact O-CB 3.43Å
858	N	81.4	Confident	84.2	Confident	15 Å²	15	38.7 Å²	38.7	8%	0.08	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	47	33.8	-177.4	-62.1	-14.6	0	0	0	115.2	I850 V851 N903 A905 F907	I850-N858 HydrophobicContact CG2-CB 4.49Å; V851-N858 CarbonylContact O-C 3.48Å; V851-N858 WeakPolarHBondContact O-CA 3.46Å; V851-N858 PolarHBondContact O-N 3.22Å; V851-N858 VanDerWaalsContact O-N 3.12Å; N858-N903 PolarHBondContact ND2-O 3.12Å; N858-A905 VanDerWaalsContact CB-O 3.3Å; N858-A905 WeakPolarHBondContact CB-O 3.39Å; N858-A905 PolarHBondContact ND2-O 2.89Å; N858-F907 PolarHBondContact O-N 2.97Å; N858-F907 VanDerWaalsContact O-N 3.1Å
859	A	87.4	Confident	83.4	Confident	1 Å²	1	42 Å²	42	1%	0.008	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	139.6	-178.9	0	0	0	0	0	110.7	V851 H856 L857 I879 I880 F907	V851-A859 PolarHBondContact N-O 3.38Å; V851-A859 PolarHBondContact O-N 2.69Å; H856-A859 HydrophobicContact CB-CB 4.1Å; L857-A859 PolarHBondContact O-N 3.41Å; A859-I879 HydrophobicContact CB-CG2 3.64Å; A859-I880 HydrophobicContact CB-CG1 4.33Å; A859-F907 HydrophobicContact CB-CB 4.36Å
860	L	88.9	Confident	82	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	133.6	172.2	-63.9	-175.7	0	0	0	110.7	V848 I850 I880 L906 L968 L971 A972	V848-L860 HydrophobicContact CG1-CD2 4.3Å; I850-L860 HydrophobicContact CG1-CD2 4Å; L860-I880 HydrophobicContact CB-CD1 4.25Å; L860-I880 PolarHBondContact O-N 2.7Å; L860-L906 HydrophobicContact CD1-CD1 4.08Å; L860-L906 HydrophobicContact CD2-CD1 3.97Å; L860-L906 HydrophobicContact CD2-CD2 3.94Å; L860-L906 HydrophobicContact CG-CD1 4.1Å; L860-L906 HydrophobicContact CG-CD2 4.46Å; L860-L968 HydrophobicContact CB-CD2 3.9Å; L860-L971 HydrophobicContact CD1-CB 3.89Å; L860-A972 HydrophobicContact CD1-CB 4.01Å
861	G	90	Very high	80.8	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	155.7	173.5	0	0	0	0	0	113.8	V848 V849 L878	V848-G861 CarbonylContact C-O 3.54Å; V848-G861 VanDerWaalsContact CA-O 3.31Å; V848-G861 WeakPolarHBondContact CA-O 3.27Å; V849-G861 PolarHBondContact N-O 3.46Å; V849-G861 PolarHBondContact O-N 2.89Å; G861-L878 CarbonylContact C-O 3.58Å; G861-L878 WeakPolarHBondContact CA-O 3.29Å
862	V	92.3	Very high	80	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.006	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	128	174.4	-179.4	0	0	0	0	110.2	R847 V848 L864 A877 L878 L933 V935 L968	R847-V862 WeakPolarHBondContact O-CA 3.46Å; V848-V862 HydrophobicContact CG2-CG2 4.14Å; V862-L864 PolarHBondContact O-N 2.88Å; V862-A877 CarbonylContact O-C 3.59Å; V862-A877 WeakPolarHBondContact O-CA 3.32Å; V862-A877 WeakPolarHBondContact O-CB 3.48Å; V862-L878 PolarHBondContact N-O 3.39Å; V862-L878 PolarHBondContact O-N 3.49Å; V862-L933 HydrophobicContact CG2-CB 4.37Å; V862-L933 HydrophobicContact CG2-CD1 3.76Å; V862-L933 HydrophobicContact CG2-CG 4.47Å; V862-V935 HydrophobicContact CG1-CG1 4.15Å; V862-V935 HydrophobicContact CG1-CG2 3.89Å; V862-L968 HydrophobicContact CG2-CD1 3.95Å; V862-L968 HydrophobicContact CG2-CD2 3.78Å; V862-L968 HydrophobicContact CG2-CG 4.02Å
863	I	91.8	Very high	79.8	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	121.6	173.2	-57.5	-178.6	0	0	0	109.8	L843 G846 R847 V849 V866 F875	L843-I863 HydrophobicContact CB-CD1 4.08Å; L843-I863 HydrophobicContact CD2-CD1 3.71Å; G846-I863 PolarHBondContact N-O 3.21Å; R847-I863 HydrophobicContact CB-CD1 4.16Å; R847-I863 HydrophobicContact CB-CG1 4.49Å; R847-I863 HydrophobicContact CG-CD1 4.48Å; R847-I863 PolarHBondContact O-N 2.98Å; V849-I863 HydrophobicContact CG1-CD1 3.95Å; V849-I863 HydrophobicContact CG1-CG1 4.2Å; V849-I863 HydrophobicContact CG2-CG1 4.31Å; I863-V866 HydrophobicContact CG2-CG2 3.96Å; I863-F875 HydrophobicContact CD1-CD1 4.19Å; I863-F875 HydrophobicContact CG2-CD1 4.45Å
864	L	89.1	Confident	80.1	Confident	3 Å²	3	57.9 Å²	57.9	2%	0.016	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	-41.6	176.5	-58	179.9	0	0	0	111.9	V845 V862 T876 L878 V917 V935 P937 I940 I941	V845-L864 WeakPolarHBondContact CG2-O 3.37Å; V862-L864 PolarHBondContact O-N 2.88Å; L864-T876 WeakPolarHBondContact CB-O 3.48Å; L864-T876 PolarHBondContact N-O 2.98Å; L864-L878 HydrophobicContact CD1-CB 4.06Å; L864-L878 HydrophobicContact CD2-CB 4.47Å; L864-L878 HydrophobicContact CG-CB 4.36Å; L864-V917 HydrophobicContact CD1-CG1 4.05Å; L864-V917 HydrophobicContact CD1-CG2 4.38Å; L864-V935 HydrophobicContact CD2-CG2 4.27Å; L864-P937 HydrophobicContact CB-CB 4.19Å; L864-P937 VanDerWaalsContact O-CB 3.23Å; L864-P937 WeakPolarHBondContact O-CB 3.43Å; L864-I940 HydrophobicContact CD1-CB 4.37Å; L864-I940 HydrophobicContact CD1-CG2 3.51Å; L864-I940 HydrophobicContact CD2-CB 4.44Å; L864-I940 HydrophobicContact CD2-CD1 3.96Å; L864-I940 HydrophobicContact CD2-CG2 4.1Å; L864-I940 HydrophobicContact CG-CG2 4.48Å; L864-I941 HydrophobicContact CB-CD1 4.13Å; L864-I941 HydrophobicContact CB-CG1 4.4Å; L864-I941 HydrophobicContact CD1-CG1 3.99Å
865	Q	87.9	Confident	80.8	Confident	108 Å²	108	48.2 Å²	48.2	51%	0.505	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	146.4	-175.5	-167.5	-178.2	14.1	0	0	111	T876 I941	Q865-T876 PolarHBondContact N-O 2.98Å; Q865-T876 PolarHBondContact O-N 3.15Å; Q865-I941 HydrophobicContact CB-CD1 4.19Å
866	V	86.3	Confident	81.6	Confident	40 Å²	40	44.6 Å²	44.6	24%	0.242	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	132.1	177.2	-172.1	0	0	0	0	109.3	I863 R873 F875	I863-V866 HydrophobicContact CG2-CG2 3.96Å; V866-R873 HydrophobicContact CG1-CG 4.35Å; V866-F875 HydrophobicContact CB-CD1 4.39Å; V866-F875 HydrophobicContact CB-CE1 4.41Å; V866-F875 HydrophobicContact CG1-CD1 3.92Å; V866-F875 HydrophobicContact CG1-CE1 3.56Å; V866-F875 HydrophobicContact CG1-CZ 4.19Å; V866-F875 HydrophobicContact CG2-CD1 3.89Å; V866-F875 HydrophobicContact CG2-CE1 4.05Å
867	S	83.3	Confident	82.1	Confident	39 Å²	39	44 Å²	44	27%	0.273	25%	0.254	S	S	.	.			trans	-65.5	153.9	176.3	-172.9	0	0	0	0	112.5	D869 R873 T874	S867-D869 PolarHBondContact OG-N 3.23Å; S867-R873 PolarHBondContact O-NE 3.42Å; S867-R873 PolarHBondContact O-NH2 3.32Å; S867-T874 WeakPolarHBondContact CB-O 3.26Å; S867-T874 PolarHBondContact N-O 3.09Å
868	S	70.6	Confident	82.7	Confident	122 Å²	122	41.1 Å²	41.1	85%	0.853	24%	0.239	S	C	*	.	S	Bend	trans	-90	-11.3	176.1	57.8	0	0	0	0	114.3
869	D	72.8	Confident	83.1	Confident	71 Å²	71	40.4 Å²	40.4	38%	0.38	24%	0.235	S	C	.	.			trans	-69.7	131.5	174.8	-174.3	-2.3	0	0	0	110.3	S867 V871 R873	S867-D869 PolarHBondContact OG-N 3.23Å; D869-V871 PolarHBondContact OD1-N 3.09Å; D869-R873 WeakPolarHBondContact O-CB 3.42Å; D869-R873 WeakPolarHBondContact O-CG 3.17Å
870	S	62.2	Low	83.1	Confident	99 Å²	99	40.4 Å²	40.4	69%	0.692	24%	0.235	S	C	*	.	S	Bend	trans	-83.3	-25.2	179.7	53.9	0	0	0	0	113.4
871	V	61.3	Low	82.8	Confident	110 Å²	110	40.4 Å²	40.4	67%	0.667	24%	0.235	S	C	*	.	S	Bend	trans	-90.8	-45.2	-174.6	-176.3	0	0	0	0	111.2	D869	D869-V871 PolarHBondContact OD1-N 3.09Å
872	N	70.9	Confident	82.4	Confident	120 Å²	120	43.9 Å²	43.9	64%	0.642	25%	0.251	S	S	*	.	S	Bend	trans	-118.3	57.2	-179.8	-74.4	-59.5	0	0	0	112	T874	N872-T874 PolarHBondContact O-N 3.02Å
873	R	79.1	Confident	81.1	Confident	73 Å²	73	50.8 Å²	50.8	28%	0.275	28%	0.281	S	S	.	.			trans	-68.2	124.2	-175.6	-155.5	166.9	-162.3	-176.7	-0.7	112	M834 V866 S867 D869 F875	M834-R873 HydrophobicContact CE-CB 4.3Å; V866-R873 HydrophobicContact CG1-CG 4.35Å; S867-R873 PolarHBondContact O-NE 3.42Å; S867-R873 PolarHBondContact O-NH2 3.32Å; D869-R873 WeakPolarHBondContact O-CB 3.42Å; D869-R873 WeakPolarHBondContact O-CG 3.17Å; R873-F875 HydrophobicContact CG-CE2 4.46Å; R873-F875 HydrophobicContact CG-CZ 4.42Å
874	T	86.1	Confident	79.7	Confident	41 Å²	41	53.6 Å²	53.6	25%	0.252	31%	0.31	S	S	.	.			trans	-118.6	150.9	179.5	44.6	0	0	0	0	111.8	S867 N872 L920	S867-T874 WeakPolarHBondContact CB-O 3.26Å; S867-T874 PolarHBondContact N-O 3.09Å; N872-T874 PolarHBondContact O-N 3.02Å; T874-L920 WeakPolarHBondContact CA-O 3.21Å
875	F	88	Confident	78.3	Confident	2 Å²	2	58 Å²	58	1%	0.009	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	112.9	-175.5	-61.6	-94.5	0	0	0	108.8	L843 I863 V866 R873 A877 L920 L922 I925	L843-F875 HydrophobicContact CB-CD1 4.41Å; L843-F875 HydrophobicContact CB-CE1 3.72Å; L843-F875 HydrophobicContact CB-CZ 4.4Å; L843-F875 HydrophobicContact CD1-CE1 3.97Å; L843-F875 HydrophobicContact CD1-CZ 3.84Å; L843-F875 HydrophobicContact CG-CE1 4.37Å; I863-F875 HydrophobicContact CD1-CD1 4.19Å; I863-F875 HydrophobicContact CG2-CD1 4.45Å; V866-F875 HydrophobicContact CB-CD1 4.39Å; V866-F875 HydrophobicContact CB-CE1 4.41Å; V866-F875 HydrophobicContact CG1-CD1 3.92Å; V866-F875 HydrophobicContact CG1-CE1 3.56Å; V866-F875 HydrophobicContact CG1-CZ 4.19Å; V866-F875 HydrophobicContact CG2-CD1 3.89Å; V866-F875 HydrophobicContact CG2-CE1 4.05Å; R873-F875 HydrophobicContact CG-CE2 4.46Å; R873-F875 HydrophobicContact CG-CZ 4.42Å; F875-A877 PolarHBondContact O-N 2.96Å; F875-L920 PolarHBondContact N-O 2.91Å; F875-L920 WeakPolarHBondContact O-CB 3.36Å; F875-L920 PolarHBondContact O-N 3.31Å; F875-L922 HydrophobicContact CD2-CG 4.37Å; F875-L922 HydrophobicContact CE2-CD1 4.02Å; F875-L922 HydrophobicContact CE2-CD2 3.94Å; F875-L922 HydrophobicContact CE2-CG 3.7Å; F875-L922 HydrophobicContact CZ-CD2 4.33Å; F875-L922 HydrophobicContact CZ-CG 4.48Å; F875-I925 HydrophobicContact CB-CD1 4.44Å; F875-I925 HydrophobicContact CD2-CD1 4.33Å; F875-I925 HydrophobicContact CG-CD1 4.35Å
876	T	89.3	Confident	76.7	Confident	17 Å²	17	57.5 Å²	57.5	10%	0.104	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	119.3	173.8	-52.9	0	0	0	0	108.1	L864 Q865 V917 Q918	L864-T876 WeakPolarHBondContact CB-O 3.48Å; L864-T876 PolarHBondContact N-O 2.98Å; Q865-T876 PolarHBondContact N-O 2.98Å; Q865-T876 PolarHBondContact O-N 3.15Å; T876-V917 HydrophobicContact CG2-CG1 3.61Å; T876-Q918 WeakPolarHBondContact CA-O 3.45Å
877	A	89	Confident	74.9	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	148.1	-178.7	0	0	0	0	0	112	V862 F875 I879 V917 Q918 L920	V862-A877 CarbonylContact O-C 3.59Å; V862-A877 WeakPolarHBondContact O-CA 3.32Å; V862-A877 WeakPolarHBondContact O-CB 3.48Å; F875-A877 PolarHBondContact O-N 2.96Å; A877-I879 HydrophobicContact CB-CG1 4.43Å; A877-V917 WeakPolarHBondContact O-CA 3.43Å; A877-Q918 PolarHBondContact N-O 2.83Å; A877-Q918 PolarHBondContact O-N 3.35Å; A877-L920 HydrophobicContact CB-CD1 3.79Å; A877-L920 HydrophobicContact CB-CG 4.44Å
878	L	89.8	Confident	72.9	Confident	1 Å²	1	63 Å²	63	1%	0.005	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	126.1	166.6	179.2	138.9	0	0	0	108.9	G861 V862 L864 H915 T916 V917 I940 I961 L968	G861-L878 CarbonylContact C-O 3.58Å; G861-L878 WeakPolarHBondContact CA-O 3.29Å; V862-L878 PolarHBondContact N-O 3.39Å; V862-L878 PolarHBondContact O-N 3.49Å; L864-L878 HydrophobicContact CD1-CB 4.06Å; L864-L878 HydrophobicContact CD2-CB 4.47Å; L864-L878 HydrophobicContact CG-CB 4.36Å; L878-H915 HydrophobicContact CD1-CB 4.25Å; L878-H915 HydrophobicContact CD2-CB 4.3Å; L878-H915 HydrophobicContact CG-CB 4.22Å; L878-T916 CarbonylContact C-O 3.5Å; L878-T916 WeakPolarHBondContact CA-O 3.28Å; L878-V917 HydrophobicContact CB-CG2 4.19Å; L878-V917 HydrophobicContact CD1-CG2 4.06Å; L878-V917 HydrophobicContact CG-CG2 4.35Å; L878-I940 HydrophobicContact CD1-CG2 3.86Å; L878-I961 HydrophobicContact CD1-CG2 4.12Å; L878-L968 HydrophobicContact CD2-CD1 3.82Å
879	I	89.2	Confident	71.4	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	140.5	-169.5	-51.8	166	0	0	0	108.8	V851 H856 A859 A877 H915 T916 Q918 L920	V851-I879 HydrophobicContact CG1-CD1 4.16Å; V851-I879 HydrophobicContact CG2-CD1 4.31Å; V851-I879 HydrophobicContact CG2-CG1 4.24Å; H856-I879 HydrophobicContact CB-CG2 4.32Å; A859-I879 HydrophobicContact CB-CG2 3.64Å; A877-I879 HydrophobicContact CB-CG1 4.43Å; I879-H915 VanDerWaalsContact O-CA 3.31Å; I879-H915 WeakPolarHBondContact O-CA 3.38Å; I879-T916 PolarHBondContact N-O 3Å; I879-T916 PolarHBondContact O-N 2.89Å; I879-Q918 HydrophobicContact CD1-CB 3.98Å; I879-L920 HydrophobicContact CD1-CD1 4.27Å; I879-L920 HydrophobicContact CD1-CD2 4.01Å; I879-L920 HydrophobicContact CD1-CG 4.44Å
880	I	87.6	Confident	69.7	Low	0 Å²	0	61.5 Å²	61.5	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	140.3	172.8	62.3	178.6	0	0	0	111.3	A859 L860 F907 T965 L968 A972	A859-I880 HydrophobicContact CB-CG1 4.33Å; L860-I880 HydrophobicContact CB-CD1 4.25Å; L860-I880 PolarHBondContact O-N 2.7Å; I880-F907 HydrophobicContact CD1-CD1 4.49Å; I880-F907 HydrophobicContact CG1-CD1 4.33Å; I880-T965 HydrophobicContact CG2-CG2 4.44Å; I880-L968 HydrophobicContact CG2-CB 3.51Å; I880-L968 HydrophobicContact CG2-CD1 3.88Å; I880-L968 HydrophobicContact CG2-CG 4.36Å; I880-A972 HydrophobicContact CD1-CB 4.23Å
881	C	83.1	Confident	68.3	Low	2 Å²	2	66.1 Å²	66.1	1%	0.014	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	173.3	178	66.4	0	0	0	0	110.9	S914 H915	C881-S914 PolarHBondContact N-O 2.83Å; C881-S914 CarbonylContact O-C 3.6Å; C881-S914 PolarHBondContact O-N 2.79Å; C881-S914 VanDerWaalsContact O-O 3.1Å; C881-H915 PolarHBondContact SG-N 3.24Å
882	E	80.8	Confident	66.9	Low	72 Å²	72	65.3 Å²	65.3	34%	0.336	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	143.7	173	-172.9	168.4	-156.8	0	0	111.6	G884 N885 F907 P909 G911	E882-G884 PolarHBondContact O-N 2.89Å; E882-N885 PolarHBondContact O-N 2.91Å; E882-N885 VanDerWaalsContact O-N 3.13Å; E882-F907 HydrophobicContact CB-CZ 4.32Å; E882-P909 HydrophobicContact CB-CB 4.46Å; E882-G911 WeakPolarHBondContact OE1-CA 3.12Å; E882-G911 PolarHBondContact OE1-N 3.08Å
883	K	65.7	Low	65	Low	147 Å²	147	67.9 Å²	67.9	64%	0.639	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	91.3	-176.3	-169.7	178.3	-176.4	179	0	112.3	P912	K883-P912 HydrophobicContact CB-CG 4.08Å; K883-P912 VanDerWaalsContact CB-O 3.26Å; K883-P912 WeakPolarHBondContact CB-O 3.47Å; K883-P912 HydrophobicContact CD-CB 4.5Å; K883-P912 HydrophobicContact CD-CG 4.14Å; K883-P912 PolarHBondContact N-O 2.76Å
884	G	61	Low	62.8	Low	58 Å²	58	72.3 Å²	72.3	60%	0.598	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	156.9	-30.3	-177.1	0	0	0	0	0	111.9	E882 E886	E882-G884 PolarHBondContact O-N 2.89Å; G884-E886 PolarHBondContact O-N 3.4Å
885	N	59.6	Low	60.3	Low	97 Å²	97	74.9 Å²	74.9	52%	0.519	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	10.1	176.7	-99.3	-8.5	0	0	0	114.4	E882 E887	E882-N885 PolarHBondContact O-N 2.91Å; E882-N885 VanDerWaalsContact O-N 3.13Å; N885-E887 VanDerWaalsContact C-N 3.32Å; N885-E887 PolarHBondContact O-N 3.48Å
886	E	54.3	Low	58.1	Low	97 Å²	97	80 Å²	80	45%	0.453	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-18.6	-177.1	-67.6	174.1	-150	0	0	113.7	G884 S914 T916	G884-E886 PolarHBondContact O-N 3.4Å; E886-S914 VanDerWaalsContact OE1-CB 3.27Å; E886-S914 WeakPolarHBondContact OE1-CB 3.4Å; E886-S914 PolarHBondContact OE1-OG 3.15Å; E886-T916 HydrophobicContact CG-CG2 4.44Å
887	E	48.3	Very low	55.9	Low	120 Å²	120	82.8 Å²	82.8	56%	0.561	49%	0.486	S	S	*	.	S	Bend	trans	-133.5	-2.1	-164.8	-71.7	-149.3	116.7	0	0	118.1	N885 A889 R953	N885-E887 VanDerWaalsContact C-N 3.32Å; N885-E887 PolarHBondContact O-N 3.48Å; E887-A889 PolarHBondContact O-N 3.03Å; E887-R953 IonicContact OE1-CZ 3.64Å; E887-R953 IonicContact OE1-NH1 3.75Å; E887-R953 PolarHBondContact OE1-NH1 2.99Å; E887-R953 IonicContact OE1-NH2 2.7Å; E887-R953 PolarHBondContact OE1-NH2 2.96Å; E887-R953 IonicContact OE2-CZ 3.44Å; E887-R953 IonicContact OE2-NH1 3.56Å; E887-R953 IonicContact OE2-NH2 2.67Å; E887-R953 PolarHBondContact OE2-NH2 3.35Å
888	V	41.6	Very low	54	Low	75 Å²	75	85.5 Å²	85.5	46%	0.455	50%	0.498	S	S	.	.			trans	-79.9	74.1	-179.3	-168.6	0	0	0	0	110.9	G890	V888-G890 VanDerWaalsContact C-N 3.28Å
889	A	39.2	Very low	52	Low	103 Å²	103	92.9 Å²	92.9	85%	0.851	53%	0.532	S	S	*	.			trans	-85	4.1	172.4	0	0	0	0	0	113.4	E887	E887-A889 PolarHBondContact O-N 3.03Å
890	G	37.1	Very low	50.2	Low	57 Å²	57	95.1 Å²	95.1	59%	0.588	54%	0.543	S	S	*	.	S	Bend	trans	-161.1	132.8	175.7	0	0	0	0	0	111.4	V888	V888-G890 VanDerWaalsContact C-N 3.28Å
891	K	33.1	Very low	48.6	Very low	197 Å²	197	98.2 Å²	98.2	86%	0.857	56%	0.559	S	S	*	*			trans	69.7	66.3	-172	-52.3	-175.3	179	-172.6	0	115.2
892	A	32.3	Very low	47.2	Very low	92 Å²	92	102.9 Å²	102.9	76%	0.76	58%	0.577	S	S	*	*			trans	-80.4	127.9	130.7	0	0	0	0	0	106.3
893	E	31	Very low	46.3	Very low	175 Å²	175	103 Å²	103	82%	0.818	58%	0.579	S	S	*	*			trans	-70	155.6	168.4	-65.7	179.5	149.4	0	0	109	S895	E893-S895 PolarHBondContact O-N 3.29Å
894	D	33.7	Very low	46.2	Very low	166 Å²	166	100.8 Å²	100.8	89%	0.888	58%	0.578	S	S	*	*			trans	-73.2	52	-179.4	-71	-57.5	0	0	0	112.5	T896	D894-T896 PolarHBondContact O-N 2.93Å; D894-T896 VanDerWaalsContact O-N 3.08Å
895	S	33.8	Very low	46.9	Very low	95 Å²	95	99.9 Å²	99.9	66%	0.664	57%	0.566	S	S	*	*			trans	-68.4	102.6	163	61.7	0	0	0	0	108.2	E893 S897	E893-S895 PolarHBondContact O-N 3.29Å; S895-S897 PolarHBondContact O-N 2.76Å
896	T	41	Very low	47.8	Very low	108 Å²	108	95.8 Å²	95.8	66%	0.663	54%	0.544	S	S	*	.			trans	-66.6	77.1	178.2	49.9	0	0	0	0	111.4	D894 F898	D894-T896 PolarHBondContact O-N 2.93Å; D894-T896 VanDerWaalsContact O-N 3.08Å; T896-F898 VanDerWaalsContact C-N 3.31Å; T896-F898 PolarHBondContact O-N 3.48Å
897	S	42.6	Very low	49.1	Very low	76 Å²	76	94.2 Å²	94.2	53%	0.531	54%	0.535	S	S	.	.			trans	-74.1	78	-176.6	58.5	0	0	0	0	111.7	S895 Q899	S895-S897 PolarHBondContact O-N 2.76Å; S897-Q899 PolarHBondContact O-N 3.02Å; S897-Q899 VanDerWaalsContact O-N 3.12Å
898	F	49	Very low	50.6	Low	58 Å²	58	91.8 Å²	91.8	25%	0.254	53%	0.526	S	S	.	.			trans	-75	11.2	-174.8	-108.6	-71.4	0	0	0	116	T896 H900 L901 F1024 A1025 K1028	T896-F898 VanDerWaalsContact C-N 3.31Å; T896-F898 PolarHBondContact O-N 3.48Å; F898-H900 PolarHBondContact O-N 3.36Å; F898-L901 HydrophobicContact CE1-CD1 4.36Å; F898-F1024 AromaticContact CD1-CD1 3.9Å; F898-F1024 HydrophobicContact CD1-CD1 3.9Å; F898-F1024 HydrophobicContact CD1-CE1 4.08Å; F898-F1024 AromaticContact CE1-CD1 3.69Å; F898-F1024 HydrophobicContact CE1-CD1 3.69Å; F898-F1024 AromaticContact CE1-CE1 3.55Å; F898-F1024 HydrophobicContact CE1-CE1 3.55Å; F898-F1024 HydrophobicContact CZ-CD1 4.18Å; F898-F1024 HydrophobicContact CZ-CE1 4.18Å; F898-A1025 HydrophobicContact CD2-CB 4.42Å; F898-A1025 HydrophobicContact CE2-CB 4.3Å; F898-K1028 HydrophobicContact CE1-CD 4.48Å; F898-K1028 HydrophobicContact CZ-CD 3.68Å
899	Q	47.1	Very low	52.3	Low	156 Å²	156	89 Å²	89	73%	0.729	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	2.9	-172	-83.3	-179.2	-23.9	0	0	116.3	S897	S897-Q899 PolarHBondContact O-N 3.02Å; S897-Q899 VanDerWaalsContact O-N 3.12Å
900	H	52.2	Low	53.9	Low	47 Å²	47	93.4 Å²	93.4	22%	0.218	51%	0.512	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.6	10.4	-155.7	-57.9	-68.3	0	0	0	117.8	F898 Y902	F898-H900 PolarHBondContact O-N 3.36Å; H900-Y902 VanDerWaalsContact C-N 3.33Å
901	L	53.9	Low	55.6	Low	65 Å²	65	92 Å²	92	34%	0.34	50%	0.497	S	S	.	.	S	Bend	trans	-72.3	-27.6	171.6	-75.8	174.4	0	0	0	113.3	A819 F898 F1024	A819-L901 HydrophobicContact CB-CD1 4.44Å; F898-L901 HydrophobicContact CE1-CD1 4.36Å; L901-F1024 HydrophobicContact CD1-CE1 3.69Å; L901-F1024 HydrophobicContact CD1-CZ 3.74Å
902	Y	55.1	Low	57.5	Low	100 Å²	100	86.8 Å²	86.8	39%	0.392	48%	0.484	S	S	.	.	S	Bend	trans	-117.1	-13.9	-178.1	-166.2	-96.1	0	0	0	114.1	H900 T904 L1009 L1010	H900-Y902 VanDerWaalsContact C-N 3.33Å; Y902-T904 PolarHBondContact O-N 3.24Å; Y902-L1009 HydrophobicContact CD2-CB 4.29Å; Y902-L1009 HydrophobicContact CE2-CB 4.21Å; Y902-L1010 WeakPolarHBondContact OH-CD2 3.31Å; Y902-L1010 WeakPolarHBondContact OH-CG 3.22Å
903	N	61.2	Low	59.6	Low	73 Å²	73	84.5 Å²	84.5	39%	0.39	46%	0.462	S	S	.	.			trans	-72.8	105	-179	-168.7	-2.2	0	0	0	110.6	N858 A905	N858-N903 PolarHBondContact ND2-O 3.12Å; N903-A905 WeakPolarHBondContact OD1-CB 3.38Å; N903-A905 PolarHBondContact OD1-N 2.93Å
904	T	64.1	Low	61.9	Low	101 Å²	101	76.8 Å²	76.8	62%	0.62	43%	0.427	S	S	*	.			trans	-89.2	-4.8	173.3	52.5	0	0	0	0	113.2	Y902	Y902-T904 PolarHBondContact O-N 3.24Å
905	A	74.7	Confident	64.4	Low	40 Å²	40	70 Å²	70	33%	0.331	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-64	138.7	179.6	0	0	0	0	0	110.5	N858 N903 P976	N858-A905 VanDerWaalsContact CB-O 3.3Å; N858-A905 WeakPolarHBondContact CB-O 3.39Å; N858-A905 PolarHBondContact ND2-O 2.89Å; N903-A905 WeakPolarHBondContact OD1-CB 3.38Å; N903-A905 PolarHBondContact OD1-N 2.93Å; A905-P976 VanDerWaalsContact CA-O 3.22Å; A905-P976 WeakPolarHBondContact CA-O 3.43Å
906	L	79.6	Confident	66.9	Low	11 Å²	11	66 Å²	66	6%	0.058	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-74.6	147.7	174.6	-66.7	-179.6	0	0	0	110.4	I850 L860 I908 A972 P976 V979	I850-L906 HydrophobicContact CD1-CD2 4.06Å; I850-L906 HydrophobicContact CG1-CD2 4.32Å; I850-L906 HydrophobicContact CG2-CD2 4.39Å; L860-L906 HydrophobicContact CD1-CD1 4.08Å; L860-L906 HydrophobicContact CD2-CD1 3.97Å; L860-L906 HydrophobicContact CD2-CD2 3.94Å; L860-L906 HydrophobicContact CG-CD1 4.1Å; L860-L906 HydrophobicContact CG-CD2 4.46Å; L906-I908 PolarHBondContact O-N 3.33Å; L906-A972 HydrophobicContact CB-CB 4.5Å; L906-P976 PolarHBondContact N-O 3.09Å; L906-P976 VanDerWaalsContact N-O 3.12Å; L906-V979 HydrophobicContact CD1-CG2 3.78Å
907	F	81.8	Confident	69.1	Low	63 Å²	63	61.8 Å²	61.8	28%	0.276	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-63.8	120.1	172.6	177.9	-99.1	0	0	0	110.9	L857 N858 A859 I880 E882 P909	L857-F907 WeakPolarHBondContact O-CB 3.43Å; N858-F907 PolarHBondContact O-N 2.97Å; N858-F907 VanDerWaalsContact O-N 3.1Å; A859-F907 HydrophobicContact CB-CB 4.36Å; I880-F907 HydrophobicContact CD1-CD1 4.49Å; I880-F907 HydrophobicContact CG1-CD1 4.33Å; E882-F907 HydrophobicContact CB-CZ 4.32Å; F907-P909 HydrophobicContact CE1-CB 4.01Å; F907-P909 HydrophobicContact CZ-CB 4.22Å
908	I	79.6	Confident	71.2	Confident	69 Å²	69	60.2 Å²	60.2	35%	0.354	32%	0.32	S	S	.	.			trans	-116.1	121.8	171	-62.4	169.4	0	0	0	106	L906 E910 A972 P976	L906-I908 PolarHBondContact O-N 3.33Å; I908-E910 PolarHBondContact O-N 3.01Å; I908-A972 HydrophobicContact CG1-CB 4.42Å; I908-P976 HydrophobicContact CD1-CB 4.11Å
909	P	76.3	Confident	72.9	Confident	16 Å²	16	64.8 Å²	64.8	10%	0.104	34%	0.34	C	S	.	.			trans	-70.6	130.1	-179.7	28.4	-33.1	0	0	0	110.7	E882 F907 C913 L969	E882-P909 HydrophobicContact CB-CB 4.46Å; F907-P909 HydrophobicContact CE1-CB 4.01Å; F907-P909 HydrophobicContact CZ-CB 4.22Å; P909-C913 HydrophobicContact CG-CB 3.83Å; P909-L969 HydrophobicContact CG-CD1 3.79Å
910	E	73.6	Confident	74.8	Confident	196 Å²	196	57.3 Å²	57.3	92%	0.916	31%	0.305	S	S	*	.	S	Bend	trans	-78.1	-31.6	176.8	-61.9	-171.3	168.5	0	0	111.9	I908	I908-E910 PolarHBondContact O-N 3.01Å
911	G	71.8	Confident	76.2	Confident	27 Å²	27	61 Å²	61	28%	0.278	32%	0.32	S	S	.	.	S	Bend	trans	-99.1	-165.3	170.4	0	0	0	0	0	114.7	E882 C913	E882-G911 WeakPolarHBondContact OE1-CA 3.12Å; E882-G911 PolarHBondContact OE1-N 3.08Å; G911-C913 PolarHBondContact O-N 3.49Å
912	P	73.3	Confident	77.2	Confident	89 Å²	89	59.6 Å²	59.6	58%	0.578	31%	0.313	S	S	*	.			trans	-65.7	120.3	-175.5	24.1	-30.9	0	0	0	112.1	K883	K883-P912 HydrophobicContact CB-CG 4.08Å; K883-P912 VanDerWaalsContact CB-O 3.26Å; K883-P912 WeakPolarHBondContact CB-O 3.47Å; K883-P912 HydrophobicContact CD-CB 4.5Å; K883-P912 HydrophobicContact CD-CG 4.14Å; K883-P912 PolarHBondContact N-O 2.76Å
913	C	76.4	Confident	78.2	Confident	43 Å²	43	61.5 Å²	61.5	29%	0.291	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	134.1	-179.7	-175.8	0	0	0	0	112.7	P909 G911 L969	P909-C913 HydrophobicContact CG-CB 3.83Å; G911-C913 PolarHBondContact O-N 3.49Å; C913-L969 HydrophobicContact CB-CD2 4Å
914	S	80.4	Confident	79.2	Confident	14 Å²	14	59.2 Å²	59.2	10%	0.098	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	-175.7	174.2	-158.1	0	0	0	0	111.2	C881 E886	C881-S914 PolarHBondContact N-O 2.83Å; C881-S914 CarbonylContact O-C 3.6Å; C881-S914 PolarHBondContact O-N 2.79Å; C881-S914 VanDerWaalsContact O-O 3.1Å; E886-S914 VanDerWaalsContact OE1-CB 3.27Å; E886-S914 WeakPolarHBondContact OE1-CB 3.4Å; E886-S914 PolarHBondContact OE1-OG 3.15Å
915	H	85	Confident	80.1	Confident	22 Å²	22	54.7 Å²	54.7	10%	0.102	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	140.4	-173.5	57.9	-78.1	0	0	0	112.1	L878 I879 C881 I961 T965	L878-H915 HydrophobicContact CD1-CB 4.25Å; L878-H915 HydrophobicContact CD2-CB 4.3Å; L878-H915 HydrophobicContact CG-CB 4.22Å; I879-H915 VanDerWaalsContact O-CA 3.31Å; I879-H915 WeakPolarHBondContact O-CA 3.38Å; C881-H915 PolarHBondContact SG-N 3.24Å; H915-I961 VanDerWaalsContact CD2-CG2 3.46Å; H915-I961 WeakPolarHBondContact CD2-CG2 3.35Å; H915-I961 VanDerWaalsContact NE2-CG2 3.34Å; H915-I961 WeakPolarHBondContact NE2-CG2 3.37Å; H915-T965 HydrophobicContact CB-CG2 4.2Å
916	T	86.4	Confident	80.3	Confident	12 Å²	12	54.7 Å²	54.7	7%	0.074	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	152.1	169.4	49.4	0	0	0	0	109.8	H856 L878 I879 E886	H856-T916 PolarHBondContact CE1-OG1 3.14Å; H856-T916 PolarHBondContact NE2-OG1 3.29Å; L878-T916 CarbonylContact C-O 3.5Å; L878-T916 WeakPolarHBondContact CA-O 3.28Å; I879-T916 PolarHBondContact N-O 3Å; I879-T916 PolarHBondContact O-N 2.89Å; E886-T916 HydrophobicContact CG-CG2 4.44Å
917	V	87	Confident	80.4	Confident	19 Å²	19	55.3 Å²	55.3	12%	0.115	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	112.5	169.2	-179.5	0	0	0	0	108.5	L864 T876 A877 L878 Y944	L864-V917 HydrophobicContact CD1-CG1 4.05Å; L864-V917 HydrophobicContact CD1-CG2 4.38Å; T876-V917 HydrophobicContact CG2-CG1 3.61Å; A877-V917 WeakPolarHBondContact O-CA 3.43Å; L878-V917 HydrophobicContact CB-CG2 4.19Å; L878-V917 HydrophobicContact CD1-CG2 4.06Å; L878-V917 HydrophobicContact CG-CG2 4.35Å; V917-Y944 HydrophobicContact CB-CD1 3.84Å; V917-Y944 HydrophobicContact CB-CD2 4Å; V917-Y944 HydrophobicContact CB-CE1 3.73Å; V917-Y944 HydrophobicContact CB-CE2 3.9Å; V917-Y944 HydrophobicContact CB-CG 3.94Å; V917-Y944 HydrophobicContact CG2-CD1 4.21Å; V917-Y944 HydrophobicContact CG2-CD2 3.65Å; V917-Y944 HydrophobicContact CG2-CE1 4.45Å; V917-Y944 HydrophobicContact CG2-CE2 3.92Å; V917-Y944 HydrophobicContact CG2-CG 3.78Å; V917-Y944 PolarHBondContact N-OH 2.85Å; V917-Y944 PolarHBondContact O-OH 2.84Å
918	Q	85.9	Confident	80.7	Confident	44 Å²	44	53.4 Å²	53.4	21%	0.206	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	150.2	-174.4	-164.3	170.1	35.9	0	0	111.1	T876 A877 I879 L920	T876-Q918 WeakPolarHBondContact CA-O 3.45Å; A877-Q918 PolarHBondContact N-O 2.83Å; A877-Q918 PolarHBondContact O-N 3.35Å; I879-Q918 HydrophobicContact CD1-CB 3.98Å; Q918-L920 HydrophobicContact CB-CD2 4.43Å; Q918-L920 HydrophobicContact CG-CD2 4.39Å
919	K	86.5	Confident	81.1	Confident	153 Å²	153	50.1 Å²	50.1	67%	0.665	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.1	108.5	168.1	-69.6	-177.1	179.3	-179.5	0	108.7
920	L	85.6	Confident	81.6	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	144.5	178.7	-58	178.4	0	0	0	111.1	V851 T874 F875 A877 I879 Q918 D924 I925	V851-L920 HydrophobicContact CB-CD1 4.43Å; V851-L920 HydrophobicContact CG1-CD1 3.93Å; V851-L920 HydrophobicContact CG1-CD2 3.82Å; V851-L920 HydrophobicContact CG2-CD1 3.58Å; T874-L920 WeakPolarHBondContact CA-O 3.21Å; F875-L920 PolarHBondContact N-O 2.91Å; F875-L920 WeakPolarHBondContact O-CB 3.36Å; F875-L920 PolarHBondContact O-N 3.31Å; A877-L920 HydrophobicContact CB-CD1 3.79Å; A877-L920 HydrophobicContact CB-CG 4.44Å; I879-L920 HydrophobicContact CD1-CD1 4.27Å; I879-L920 HydrophobicContact CD1-CD2 4.01Å; I879-L920 HydrophobicContact CD1-CG 4.44Å; Q918-L920 HydrophobicContact CB-CD2 4.43Å; Q918-L920 HydrophobicContact CG-CD2 4.39Å; L920-D924 WeakPolarHBondContact CA-OD2 3.42Å; L920-D924 HydrophobicContact CB-CB 4.24Å; L920-D924 HydrophobicContact CD2-CB 3.92Å; L920-I925 HydrophobicContact CD1-CG1 4.25Å
921	K	83.1	Confident	82.2	Confident	124 Å²	124	49 Å²	49	54%	0.539	26%	0.262	S	S	.	.			trans	-87.5	167.1	158	-63	178.5	-179.9	179.3	0	109.1	Q923 D924	K921-Q923 VanDerWaalsContact C-N 3.27Å; K921-Q923 PolarHBondContact O-N 2.93Å; K921-D924 PolarHBondContact N-OD2 2.95Å; K921-D924 WeakPolarHBondContact O-CB 3.47Å; K921-D924 PolarHBondContact O-N 3.05Å; K921-D924 VanDerWaalsContact O-N 3.11Å
922	L	73.6	Confident	82.9	Confident	35 Å²	35	52 Å²	52	18%	0.183	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-63.8	-32.3	176.1	-80.6	154.3	0	0	0	113.2	M834 L843 F875 D924 I925	M834-L922 HydrophobicContact CB-CD1 3.96Å; M834-L922 HydrophobicContact CE-CD1 4.08Å; M834-L922 HydrophobicContact CG-CD1 3.58Å; M834-L922 HydrophobicContact SD-CD1 3.36Å; M834-L922 WeakPolarHBondContact SD-CD1 3.25Å; L843-L922 HydrophobicContact CD1-CD2 3.71Å; F875-L922 HydrophobicContact CD2-CG 4.37Å; F875-L922 HydrophobicContact CE2-CD1 4.02Å; F875-L922 HydrophobicContact CE2-CD2 3.94Å; F875-L922 HydrophobicContact CE2-CG 3.7Å; F875-L922 HydrophobicContact CZ-CD2 4.33Å; F875-L922 HydrophobicContact CZ-CG 4.48Å; L922-D924 PolarHBondContact O-N 2.97Å; L922-I925 PolarHBondContact O-N 2.57Å
923	Q	75.4	Confident	83.6	Confident	141 Å²	141	49.2 Å²	49.2	66%	0.659	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-60.7	-26.4	173.6	-69	171.1	-28.9	0	0	112.9	K921 I925	K921-Q923 VanDerWaalsContact C-N 3.27Å; K921-Q923 PolarHBondContact O-N 2.93Å; Q923-I925 VanDerWaalsContact C-N 3.29Å
924	D	82.8	Confident	83.9	Confident	24 Å²	24	57.8 Å²	57.8	13%	0.128	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-82.3	-8.6	177.4	-48.4	-41.9	0	0	0	112.1	V851 N852 N853 L920 K921 L922	V851-D924 CarbonylContact C-O 3.59Å; V851-D924 WeakPolarHBondContact CA-O 3.37Å; V851-D924 WeakPolarHBondContact CG1-O 3.27Å; N852-D924 PolarHBondContact N-O 3.34Å; N853-D924 HydrophobicContact CB-CB 4.24Å; N853-D924 PolarHBondContact ND2-OD1 2.82Å; L920-D924 WeakPolarHBondContact CA-OD2 3.42Å; L920-D924 HydrophobicContact CB-CB 4.24Å; L920-D924 HydrophobicContact CD2-CB 3.92Å; K921-D924 PolarHBondContact N-OD2 2.95Å; K921-D924 WeakPolarHBondContact O-CB 3.47Å; K921-D924 PolarHBondContact O-N 3.05Å; K921-D924 VanDerWaalsContact O-N 3.11Å; L922-D924 PolarHBondContact O-N 2.97Å
925	I	83.5	Confident	84.1	Confident	6 Å²	6	58.4 Å²	58.4	3%	0.031	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	103.9	-178.7	-62.2	171.4	0	0	0	108.6	Q830 V849 I850 F875 L920 L922 Q923	Q830-I925 PolarHBondContact NE2-O 3.04Å; V849-I925 HydrophobicContact CB-CG2 4.01Å; V849-I925 HydrophobicContact CG1-CG2 4.16Å; I850-I925 CarbonylContact O-C 3.4Å; F875-I925 HydrophobicContact CB-CD1 4.44Å; F875-I925 HydrophobicContact CD2-CD1 4.33Å; F875-I925 HydrophobicContact CG-CD1 4.35Å; L920-I925 HydrophobicContact CD1-CG1 4.25Å; L922-I925 PolarHBondContact O-N 2.57Å; Q923-I925 VanDerWaalsContact C-N 3.29Å
926	S	79	Confident	84.1	Confident	41 Å²	41	61.5 Å²	61.5	29%	0.287	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	-40.5	-179.5	-170	0	0	0	0	112.4	I850	I850-S926 PolarHBondContact O-N 3.47Å
927	A	82.3	Confident	83.9	Confident	24 Å²	24	61.9 Å²	61.9	20%	0.198	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	154.6	-179.9	0	0	0	0	0	113.7	I850 T981	I850-A927 HydrophobicContact CD1-CB 4.31Å; I850-A927 PolarHBondContact N-O 2.7Å; A927-T981 HydrophobicContact CB-CG2 3.57Å
928	I	87.8	Confident	83.7	Confident	22 Å²	22	66.4 Å²	66.4	11%	0.113	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	123.1	176.5	-48.4	173.9	0	0	0	108.8	I833 L843 R847 T981 L982	I833-I928 HydrophobicContact CG2-CD1 4.22Å; L843-I928 HydrophobicContact CD1-CD1 4.25Å; L843-I928 HydrophobicContact CD2-CD1 3.69Å; L843-I928 HydrophobicContact CD2-CG1 3.81Å; L843-I928 HydrophobicContact CD2-CG2 4.4Å; L843-I928 HydrophobicContact CG-CD1 3.77Å; L843-I928 HydrophobicContact CG-CG1 4.45Å; R847-I928 HydrophobicContact CG-CG2 3.83Å; I928-T981 CarbonylContact O-C 3.58Å; I928-T981 WeakPolarHBondContact O-CA 3.47Å; I928-L982 HydrophobicContact CB-CD1 4.41Å; I928-L982 HydrophobicContact CG2-CD1 3.79Å; I928-L982 PolarHBondContact O-N 2.87Å
929	T	87.9	Confident	83.5	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	158.5	-178.4	78.1	0	0	0	0	112.7	R847 V848 I850 K931 V979 A980	R847-T929 WeakPolarHBondContact CD-O 3.22Å; R847-T929 PolarHBondContact NH1-O 2.85Å; V848-T929 WeakPolarHBondContact CB-OG1 3.43Å; V848-T929 HydrophobicContact CG1-CG2 4.34Å; V848-T929 WeakPolarHBondContact O-CB 3.24Å; V848-T929 PolarHBondContact O-N 3.4Å; V848-T929 VanDerWaalsContact O-N 3.14Å; V848-T929 PolarHBondContact O-OG1 2.9Å; I850-T929 HydrophobicContact CG1-CG2 4.1Å; T929-K931 PolarHBondContact O-N 3.43Å; T929-K931 PolarHBondContact OG1-N 3.03Å; T929-V979 HydrophobicContact CG2-CB 4.3Å; T929-V979 HydrophobicContact CG2-CG1 3.86Å; T929-A980 WeakPolarHBondContact CA-O 3.44Å
930	V	86.2	Confident	83.3	Confident	75 Å²	75	65.3 Å²	65.3	46%	0.455	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	-23.7	173.2	-175.5	0	0	0	0	111.7	R847 A980 L982	R847-V930 VanDerWaalsContact NH1-C 3.3Å; R847-V930 PolarHBondContact NH1-O 3.13Å; V930-A980 HydrophobicContact CG2-CB 4.37Å; V930-A980 PolarHBondContact N-O 3.06Å; V930-L982 HydrophobicContact CB-CD2 4.45Å; V930-L982 HydrophobicContact CG2-CD2 3.92Å; V930-L982 HydrophobicContact CG2-CG 4.29Å
931	K	86.6	Confident	83.2	Confident	115 Å²	115	66.7 Å²	66.7	50%	0.5	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	142.9	-173.7	-61.6	-66.5	-175.8	178	0	113.1	V848 T929 V979	V848-K931 HydrophobicContact CB-CB 4.4Å; V848-K931 HydrophobicContact CG2-CB 4.38Å; V848-K931 PolarHBondContact N-O 2.94Å; V848-K931 VanDerWaalsContact N-O 3.13Å; T929-K931 PolarHBondContact O-N 3.43Å; T929-K931 PolarHBondContact OG1-N 3.03Å; K931-V979 HydrophobicContact CG-CG1 4.32Å
932	T	86.8	Confident	83.1	Confident	88 Å²	88	65 Å²	65	54%	0.54	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	136.6	170.7	55	0	0	0	0	109.9	G846 R847	G846-T932 CarbonylContact O-C 3.52Å; G846-T932 VanDerWaalsContact O-CA 3.29Å; G846-T932 WeakPolarHBondContact O-CA 3.31Å; R847-T932 VanDerWaalsContact CZ-CG2 3.47Å
933	L	86.8	Confident	83.4	Confident	32 Å²	32	65.5 Å²	65.5	17%	0.168	33%	0.33	C	S	.	.			trans	-107.6	134.9	175.8	-67.8	-178.6	0	0	0	109.9	G846 V848 V862 V935 E967 L968 L971	G846-L933 WeakPolarHBondContact CA-O 3.38Å; G846-L933 PolarHBondContact O-N 3.48Å; V848-L933 HydrophobicContact CG2-CD1 3.96Å; V848-L933 HydrophobicContact CG2-CG 3.8Å; V862-L933 HydrophobicContact CG2-CB 4.37Å; V862-L933 HydrophobicContact CG2-CD1 3.76Å; V862-L933 HydrophobicContact CG2-CG 4.47Å; L933-V935 HydrophobicContact CB-CG1 4.28Å; L933-V935 PolarHBondContact O-N 3.02Å; L933-E967 HydrophobicContact CD1-CB 4.06Å; L933-E967 HydrophobicContact CD2-CB 4.19Å; L933-L968 HydrophobicContact CD1-CD2 4.03Å; L933-L968 HydrophobicContact CD1-CG 4.15Å; L933-L971 HydrophobicContact CD1-CD1 4.31Å; L933-L971 HydrophobicContact CD2-CD1 4.27Å
934	K	83.5	Confident	83.7	Confident	223 Å²	223	60.9 Å²	60.9	97%	0.97	31%	0.306	S	S	*	.			trans	-78.5	89.4	176.6	-70	-177.3	178.4	178.6	0	109.7
935	V	84.3	Confident	83.6	Confident	27 Å²	27	64 Å²	64	16%	0.164	32%	0.323	C	S	.	.			trans	-106.4	155.5	177.9	-63.8	0	0	0	0	111.8	V862 L864 L933 I940 A964	V862-V935 HydrophobicContact CG1-CG1 4.15Å; V862-V935 HydrophobicContact CG1-CG2 3.89Å; L864-V935 HydrophobicContact CD2-CG2 4.27Å; L933-V935 HydrophobicContact CB-CG1 4.28Å; L933-V935 PolarHBondContact O-N 3.02Å; V935-I940 HydrophobicContact CB-CD1 3.96Å; V935-I940 HydrophobicContact CG1-CD1 4.31Å; V935-A964 HydrophobicContact CG1-CB 4.08Å
936	I	85.2	Confident	83.4	Confident	86 Å²	86	69.3 Å²	69.3	44%	0.441	35%	0.346	S	S	.	.			trans	-106.1	98.8	171.2	-56.3	175.5	0	0	0	107.1	D938 R939 I940	I936-D938 PolarHBondContact O-N 3.24Å; I936-R939 HydrophobicContact CB-CB 4.47Å; I936-R939 HydrophobicContact CG2-CB 4.08Å; I936-R939 HydrophobicContact CG2-CG 3.81Å; I936-R939 PolarHBondContact O-N 3.01Å; I936-I940 PolarHBondContact O-N 2.77Å
937	P	82.3	Confident	83.2	Confident	21 Å²	21	69.2 Å²	69.2	14%	0.136	34%	0.339	C	S	.	.	H	α-helix	trans	-66	-45.6	-165.6	-17.8	29.2	0	0	0	113.1	V845 L864 R939 I940 I941	V845-P937 HydrophobicContact CG1-CB 4.4Å; V845-P937 HydrophobicContact CG1-CG 3.32Å; L864-P937 HydrophobicContact CB-CB 4.19Å; L864-P937 VanDerWaalsContact O-CB 3.23Å; L864-P937 WeakPolarHBondContact O-CB 3.43Å; P937-R939 VanDerWaalsContact C-N 3.25Å; P937-R939 PolarHBondContact O-N 3.38Å; P937-I940 WeakPolarHBondContact O-CA 3.19Å; P937-I940 WeakPolarHBondContact O-CB 3.49Å; P937-I940 PolarHBondContact O-N 3.45Å; P937-I941 HydrophobicContact CB-CD1 4.49Å; P937-I941 WeakPolarHBondContact O-CG1 3.44Å; P937-I941 PolarHBondContact O-N 2.92Å
938	D	83.1	Confident	82.7	Confident	114 Å²	114	73.1 Å²	73.1	61%	0.61	35%	0.353	S	S	*	.	H	α-helix	trans	-58.4	-40.6	-175.5	-47.7	-42.8	0	0	0	111.1	I936 I940 I941 D942	I936-D938 PolarHBondContact O-N 3.24Å; D938-I940 PolarHBondContact O-N 2.85Å; D938-I941 PolarHBondContact O-N 2.85Å; D938-D942 VanDerWaalsContact O-CB 3.22Å; D938-D942 WeakPolarHBondContact O-CB 3.41Å; D938-D942 VanDerWaalsContact O-CG 3.32Å; D938-D942 PolarHBondContact O-N 3.08Å
939	R	81.3	Confident	82.2	Confident	173 Å²	173	76.9 Å²	76.9	65%	0.653	37%	0.371	S	S	*	.	H	α-helix	trans	-68.1	-32.3	176.5	-69.1	-173.5	-179.9	-172.6	-0.4	113.3	I936 P937 N943	I936-R939 HydrophobicContact CB-CB 4.47Å; I936-R939 HydrophobicContact CG2-CB 4.08Å; I936-R939 HydrophobicContact CG2-CG 3.81Å; I936-R939 PolarHBondContact O-N 3.01Å; P937-R939 VanDerWaalsContact C-N 3.25Å; P937-R939 PolarHBondContact O-N 3.38Å; R939-N943 VanDerWaalsContact O-CB 3.23Å; R939-N943 WeakPolarHBondContact O-CB 3.39Å; R939-N943 PolarHBondContact O-N 2.78Å
940	I	82.6	Confident	81.4	Confident	1 Å²	1	82.9 Å²	82.9	1%	0.005	41%	0.409	C	S	.	.	H	α-helix	trans	-72.8	-48.7	176.6	-70.4	169.2	0	0	0	109.5	L864 L878 V935 I936 P937 D938 N943 Y944 A960 I961	L864-I940 HydrophobicContact CD1-CB 4.37Å; L864-I940 HydrophobicContact CD1-CG2 3.51Å; L864-I940 HydrophobicContact CD2-CB 4.44Å; L864-I940 HydrophobicContact CD2-CD1 3.96Å; L864-I940 HydrophobicContact CD2-CG2 4.1Å; L864-I940 HydrophobicContact CG-CG2 4.48Å; L878-I940 HydrophobicContact CD1-CG2 3.86Å; V935-I940 HydrophobicContact CB-CD1 3.96Å; V935-I940 HydrophobicContact CG1-CD1 4.31Å; I936-I940 PolarHBondContact O-N 2.77Å; P937-I940 WeakPolarHBondContact O-CA 3.19Å; P937-I940 WeakPolarHBondContact O-CB 3.49Å; P937-I940 PolarHBondContact O-N 3.45Å; D938-I940 PolarHBondContact O-N 2.85Å; I940-N943 PolarHBondContact O-N 2.8Å; I940-Y944 WeakPolarHBondContact O-CB 3.45Å; I940-Y944 PolarHBondContact O-N 2.77Å; I940-A960 HydrophobicContact CG1-CB 4.17Å; I940-I961 HydrophobicContact CB-CG1 4.21Å; I940-I961 HydrophobicContact CG1-CG1 3.95Å; I940-I961 HydrophobicContact CG2-CD1 4.35Å; I940-I961 HydrophobicContact CG2-CG1 3.99Å
941	I	83	Confident	80.7	Confident	28 Å²	28	89.5 Å²	89.5	14%	0.144	43%	0.426	C	S	.	.	H	α-helix	trans	-62.9	-45.9	179.4	-65	169.7	0	0	0	110.6	L864 Q865 P937 D938 N943 Y944 N945	L864-I941 HydrophobicContact CB-CD1 4.13Å; L864-I941 HydrophobicContact CB-CG1 4.4Å; L864-I941 HydrophobicContact CD1-CG1 3.99Å; Q865-I941 HydrophobicContact CB-CD1 4.19Å; P937-I941 HydrophobicContact CB-CD1 4.49Å; P937-I941 WeakPolarHBondContact O-CG1 3.44Å; P937-I941 PolarHBondContact O-N 2.92Å; D938-I941 PolarHBondContact O-N 2.85Å; I941-N943 PolarHBondContact O-N 2.78Å; I941-Y944 PolarHBondContact O-N 2.88Å; I941-N945 WeakPolarHBondContact CG2-ND2 3.35Å; I941-N945 WeakPolarHBondContact O-CB 3.42Å; I941-N945 PolarHBondContact O-N 2.99Å; I941-N945 PolarHBondContact O-ND2 2.99Å
942	D	81.7	Confident	79.9	Confident	88 Å²	88	87.4 Å²	87.4	47%	0.471	42%	0.417	S	S	.	.	H	α-helix	trans	-64.4	-39.2	177.2	-81	-9.8	0	0	0	113	D938 K946	D938-D942 VanDerWaalsContact O-CB 3.22Å; D938-D942 WeakPolarHBondContact O-CB 3.41Å; D938-D942 VanDerWaalsContact O-CG 3.32Å; D938-D942 PolarHBondContact O-N 3.08Å; D942-K946 WeakPolarHBondContact O-CB 3.46Å; D942-K946 WeakPolarHBondContact O-CD 3.33Å; D942-K946 VanDerWaalsContact O-CG 3.22Å; D942-K946 WeakPolarHBondContact O-CG 3.11Å; D942-K946 PolarHBondContact O-N 3.35Å
943	N	80.5	Confident	79.1	Confident	47 Å²	47	89.5 Å²	89.5	25%	0.251	42%	0.415	S	S	.	.	H	α-helix	trans	-70.2	-39.5	178.4	-164.6	-91.5	0	0	0	110.9	R939 I940 I941 K946 R947 G958 I961	R939-N943 VanDerWaalsContact O-CB 3.23Å; R939-N943 WeakPolarHBondContact O-CB 3.39Å; R939-N943 PolarHBondContact O-N 2.78Å; I940-N943 PolarHBondContact O-N 2.8Å; I941-N943 PolarHBondContact O-N 2.78Å; N943-K946 PolarHBondContact O-N 3.01Å; N943-R947 WeakPolarHBondContact O-CD 3.5Å; N943-R947 VanDerWaalsContact O-CG 3.28Å; N943-R947 WeakPolarHBondContact O-CG 3.38Å; N943-R947 PolarHBondContact O-N 3Å; N943-R947 PolarHBondContact OD1-NE 2.88Å; N943-G958 PolarHBondContact OD1-N 3.04Å; N943-I961 HydrophobicContact CB-CD1 3.9Å
944	Y	80.4	Confident	78.1	Confident	43 Å²	43	92.8 Å²	92.8	17%	0.169	45%	0.447	C	S	.	.	H	α-helix	trans	-62.6	-50.4	173	-172.3	-99.2	0	0	0	111.8	V917 I940 I941 K946 R947 Q948	V917-Y944 HydrophobicContact CB-CD1 3.84Å; V917-Y944 HydrophobicContact CB-CD2 4Å; V917-Y944 HydrophobicContact CB-CE1 3.73Å; V917-Y944 HydrophobicContact CB-CE2 3.9Å; V917-Y944 HydrophobicContact CB-CG 3.94Å; V917-Y944 HydrophobicContact CG2-CD1 4.21Å; V917-Y944 HydrophobicContact CG2-CD2 3.65Å; V917-Y944 HydrophobicContact CG2-CE1 4.45Å; V917-Y944 HydrophobicContact CG2-CE2 3.92Å; V917-Y944 HydrophobicContact CG2-CG 3.78Å; V917-Y944 PolarHBondContact N-OH 2.85Å; V917-Y944 PolarHBondContact O-OH 2.84Å; I940-Y944 WeakPolarHBondContact O-CB 3.45Å; I940-Y944 PolarHBondContact O-N 2.77Å; I941-Y944 PolarHBondContact O-N 2.88Å; Y944-K946 VanDerWaalsContact C-N 3.27Å; Y944-K946 PolarHBondContact O-N 3.37Å; Y944-R947 WeakPolarHBondContact O-CB 3.12Å; Y944-R947 PolarHBondContact O-N 2.84Å; Y944-Q948 HydrophobicContact CD1-CG 4.32Å; Y944-Q948 HydrophobicContact CE1-CG 4.18Å; Y944-Q948 VanDerWaalsContact CZ-NE2 3.31Å; Y944-Q948 WeakPolarHBondContact O-CG 3.31Å; Y944-Q948 PolarHBondContact O-N 3.2Å; Y944-Q948 VanDerWaalsContact O-N 3.15Å; Y944-Q948 PolarHBondContact OH-NE2 3.33Å
945	N	81.4	Confident	77.7	Confident	89 Å²	89	85.9 Å²	85.9	48%	0.476	42%	0.421	S	S	.	.	H	α-helix	trans	-61.4	-33	179.2	-71.8	-23.1	0	0	0	113	I941	I941-N945 WeakPolarHBondContact CG2-ND2 3.35Å; I941-N945 WeakPolarHBondContact O-CB 3.42Å; I941-N945 PolarHBondContact O-N 2.99Å; I941-N945 PolarHBondContact O-ND2 2.99Å
946	K	79.4	Confident	77.2	Confident	118 Å²	118	89.8 Å²	89.8	51%	0.513	45%	0.447	S	S	.	.	H	α-helix	trans	-65.6	-42.5	172.3	-76.1	167.3	-175.1	172	0	111.9	D942 N943 Y944 Q948 Q949	D942-K946 WeakPolarHBondContact O-CB 3.46Å; D942-K946 WeakPolarHBondContact O-CD 3.33Å; D942-K946 VanDerWaalsContact O-CG 3.22Å; D942-K946 WeakPolarHBondContact O-CG 3.11Å; D942-K946 PolarHBondContact O-N 3.35Å; N943-K946 PolarHBondContact O-N 3.01Å; Y944-K946 VanDerWaalsContact C-N 3.27Å; Y944-K946 PolarHBondContact O-N 3.37Å; K946-Q948 VanDerWaalsContact C-N 3.29Å; K946-Q948 PolarHBondContact O-N 2.91Å; K946-Q949 VanDerWaalsContact O-CB 3.32Å; K946-Q949 WeakPolarHBondContact O-CB 3.47Å; K946-Q949 PolarHBondContact O-N 2.66Å; K946-Q949 VanDerWaalsContact O-N 3.07Å
947	R	73.3	Confident	76.8	Confident	39 Å²	39	88.3 Å²	88.3	15%	0.147	44%	0.443	C	S	.	.	H	α-helix	trans	-63.3	-30.4	177.7	-69.9	163.2	173.1	-61.7	-52	114.1	N943 Y944 Q949 R953 D955 P956 P957	N943-R947 WeakPolarHBondContact O-CD 3.5Å; N943-R947 VanDerWaalsContact O-CG 3.28Å; N943-R947 WeakPolarHBondContact O-CG 3.38Å; N943-R947 PolarHBondContact O-N 3Å; N943-R947 PolarHBondContact OD1-NE 2.88Å; Y944-R947 WeakPolarHBondContact O-CB 3.12Å; Y944-R947 PolarHBondContact O-N 2.84Å; R947-Q949 PolarHBondContact O-N 3.23Å; R947-R953 WeakPolarHBondContact O-CA 3.23Å; R947-R953 WeakPolarHBondContact O-CB 3.3Å; R947-D955 PolarHBondContact NH1-O 3.38Å; R947-D955 PolarHBondContact NH2-O 2.87Å; R947-P956 PolarHBondContact NH2-O 3.41Å; R947-P957 VanDerWaalsContact CZ-CA 3.41Å
948	Q	72.9	Confident	76.6	Confident	106 Å²	106	88.3 Å²	88.3	50%	0.495	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-14.2	174.9	-63	-60	-23.8	0	0	112.7	Y944 K946	Y944-Q948 HydrophobicContact CD1-CG 4.32Å; Y944-Q948 HydrophobicContact CE1-CG 4.18Å; Y944-Q948 VanDerWaalsContact CZ-NE2 3.31Å; Y944-Q948 WeakPolarHBondContact O-CG 3.31Å; Y944-Q948 PolarHBondContact O-N 3.2Å; Y944-Q948 VanDerWaalsContact O-N 3.15Å; Y944-Q948 PolarHBondContact OH-NE2 3.33Å; K946-Q948 VanDerWaalsContact C-N 3.29Å; K946-Q948 PolarHBondContact O-N 2.91Å
949	Q	77.9	Confident	76.5	Confident	102 Å²	102	90.9 Å²	90.9	48%	0.477	45%	0.454	S	S	.	.	S	Bend	trans	-80.1	132.5	171.5	-57	-175.8	-5.1	0	0	110.4	K946 R947 R951 F952 R953	K946-Q949 VanDerWaalsContact O-CB 3.32Å; K946-Q949 WeakPolarHBondContact O-CB 3.47Å; K946-Q949 PolarHBondContact O-N 2.66Å; K946-Q949 VanDerWaalsContact O-N 3.07Å; R947-Q949 PolarHBondContact O-N 3.23Å; Q949-R951 PolarHBondContact O-N 3.36Å; Q949-F952 HydrophobicContact CB-CD2 4.29Å; Q949-F952 PolarHBondContact O-N 3.06Å; Q949-R953 PolarHBondContact O-N 3.09Å
950	P	69.4	Low	76.4	Confident	125 Å²	125	84.4 Å²	84.4	81%	0.812	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-27.4	-176	-29.4	34.8	0	0	0	115.3
951	R	72.3	Confident	76.4	Confident	214 Å²	214	84.4 Å²	84.4	81%	0.808	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-30.8	-178.8	-174.4	176.8	179.9	-177.3	0.5	114.7	Q949	Q949-R951 PolarHBondContact O-N 3.36Å
952	F	70.6	Confident	76.4	Confident	71 Å²	71	84.7 Å²	84.7	31%	0.311	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	6.9	-173.1	-58.2	-70.8	0	0	0	112.8	Q949 A954 D955	Q949-F952 HydrophobicContact CB-CD2 4.29Å; Q949-F952 PolarHBondContact O-N 3.06Å; F952-A954 PolarHBondContact O-N 2.93Å; F952-D955 WeakPolarHBondContact O-CB 3.48Å; F952-D955 PolarHBondContact O-N 3.27Å; F952-D955 VanDerWaalsContact O-N 3.16Å
953	R	70.1	Confident	76.5	Confident	133 Å²	133	84 Å²	84	50%	0.502	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-23.1	-176.7	-175.9	168.6	156.5	138.8	-8	114.1	E887 R947 Q949	E887-R953 IonicContact OE1-CZ 3.64Å; E887-R953 IonicContact OE1-NH1 3.75Å; E887-R953 PolarHBondContact OE1-NH1 2.99Å; E887-R953 IonicContact OE1-NH2 2.7Å; E887-R953 PolarHBondContact OE1-NH2 2.96Å; E887-R953 IonicContact OE2-CZ 3.44Å; E887-R953 IonicContact OE2-NH1 3.56Å; E887-R953 IonicContact OE2-NH2 2.67Å; E887-R953 PolarHBondContact OE2-NH2 3.35Å; R947-R953 WeakPolarHBondContact O-CA 3.23Å; R947-R953 WeakPolarHBondContact O-CB 3.3Å; Q949-R953 PolarHBondContact O-N 3.09Å
954	A	65.5	Low	76.7	Confident	101 Å²	101	82 Å²	82	84%	0.835	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-2.4	176.7	0	0	0	0	0	114.2	F952	F952-A954 PolarHBondContact O-N 2.93Å
955	D	74.8	Confident	77	Confident	78 Å²	78	80.6 Å²	80.6	42%	0.417	43%	0.427	S	S	.	.	S	Bend	trans	-66.8	150.6	-179	-71	-8.3	0	0	0	111.2	R947 F952	R947-D955 PolarHBondContact NH1-O 3.38Å; R947-D955 PolarHBondContact NH2-O 2.87Å; F952-D955 WeakPolarHBondContact O-CB 3.48Å; F952-D955 PolarHBondContact O-N 3.27Å; F952-D955 VanDerWaalsContact O-N 3.16Å
956	P	73.9	Confident	77.2	Confident	109 Å²	109	82.7 Å²	82.7	71%	0.708	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-74.1	140.3	174.9	30.4	-35	0	0	0	112.2	R947 G958	R947-P956 PolarHBondContact NH2-O 3.41Å; P956-G958 PolarHBondContact O-N 3.01Å
957	P	76.8	Confident	77.4	Confident	55 Å²	55	80.1 Å²	80.1	36%	0.357	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-54.9	133.3	-175	19.9	-31.3	0	0	0	112.6	R947 I961 S962	R947-P957 VanDerWaalsContact CZ-CA 3.41Å; P957-I961 HydrophobicContact CB-CG2 4.22Å; P957-S962 PolarHBondContact O-OG 3.18Å
958	G	78.9	Confident	78.1	Confident	20 Å²	20	78.2 Å²	78.2	21%	0.206	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-59.2	143.4	-179.5	0	0	0	0	0	111	N943 P956 A960 I961 S962	N943-G958 PolarHBondContact OD1-N 3.04Å; P956-G958 PolarHBondContact O-N 3.01Å; G958-A960 PolarHBondContact O-N 2.83Å; G958-I961 WeakPolarHBondContact O-CA 3.45Å; G958-I961 WeakPolarHBondContact O-CB 3.25Å; G958-I961 PolarHBondContact O-N 3.06Å; G958-S962 PolarHBondContact O-N 3.38Å
959	Q	79.6	Confident	78.7	Confident	168 Å²	168	74.7 Å²	74.7	79%	0.785	40%	0.402	S	S	*	.	H	α-helix	trans	-46.9	-40.6	-171.7	-170.1	-179.5	9.3	0	0	114.1	I961 S962 T963	Q959-I961 VanDerWaalsContact C-N 3.32Å; Q959-I961 PolarHBondContact O-N 3.12Å; Q959-S962 PolarHBondContact O-N 3.16Å; Q959-T963 PolarHBondContact O-N 3.31Å; Q959-T963 PolarHBondContact O-OG1 2.97Å; Q959-T963 VanDerWaalsContact O-OG1 3.07Å
960	A	79.6	Confident	79.1	Confident	37 Å²	37	77.1 Å²	77.1	31%	0.306	41%	0.406	S	S	.	.	H	α-helix	trans	-62	-34.1	178	0	0	0	0	0	114.1	I940 G958 A964	I940-A960 HydrophobicContact CG1-CB 4.17Å; G958-A960 PolarHBondContact O-N 2.83Å; A960-A964 WeakPolarHBondContact O-CB 3.42Å; A960-A964 PolarHBondContact O-N 3.1Å
961	I	82.6	Confident	79.8	Confident	1 Å²	1	72.3 Å²	72.3	1%	0.005	37%	0.374	C	S	.	.	H	α-helix	trans	-73.2	-48.1	175.5	-67.1	-176.4	0	0	0	110	L878 H915 I940 N943 P957 G958 Q959 T963 A964 T965	L878-I961 HydrophobicContact CD1-CG2 4.12Å; H915-I961 VanDerWaalsContact CD2-CG2 3.46Å; H915-I961 WeakPolarHBondContact CD2-CG2 3.35Å; H915-I961 VanDerWaalsContact NE2-CG2 3.34Å; H915-I961 WeakPolarHBondContact NE2-CG2 3.37Å; I940-I961 HydrophobicContact CB-CG1 4.21Å; I940-I961 HydrophobicContact CG1-CG1 3.95Å; I940-I961 HydrophobicContact CG2-CD1 4.35Å; I940-I961 HydrophobicContact CG2-CG1 3.99Å; N943-I961 HydrophobicContact CB-CD1 3.9Å; P957-I961 HydrophobicContact CB-CG2 4.22Å; G958-I961 WeakPolarHBondContact O-CA 3.45Å; G958-I961 WeakPolarHBondContact O-CB 3.25Å; G958-I961 PolarHBondContact O-N 3.06Å; Q959-I961 VanDerWaalsContact C-N 3.32Å; Q959-I961 PolarHBondContact O-N 3.12Å; I961-T963 VanDerWaalsContact C-N 3.34Å; I961-T963 PolarHBondContact O-N 3.01Å; I961-A964 PolarHBondContact O-N 3.4Å; I961-T965 WeakPolarHBondContact O-CB 3.47Å; I961-T965 PolarHBondContact O-N 3.31Å; I961-T965 PolarHBondContact O-OG1 3.49Å
962	S	82.3	Confident	80.4	Confident	35 Å²	35	62.1 Å²	62.1	25%	0.245	34%	0.335	C	S	.	.	H	α-helix	trans	-60	-43.9	-179.4	-53.2	0	0	0	0	111.5	P957 G958 Q959 T965 Q966	P957-S962 PolarHBondContact O-OG 3.18Å; G958-S962 PolarHBondContact O-N 3.38Å; Q959-S962 PolarHBondContact O-N 3.16Å; S962-T965 PolarHBondContact O-N 3.42Å; S962-Q966 WeakPolarHBondContact O-CB 3.49Å; S962-Q966 VanDerWaalsContact O-CG 3.26Å; S962-Q966 WeakPolarHBondContact O-CG 3.31Å; S962-Q966 PolarHBondContact O-N 3.4Å
963	T	85.3	Confident	81.1	Confident	72 Å²	72	64 Å²	64	44%	0.442	35%	0.345	S	S	.	.	H	α-helix	trans	-64.2	-42.5	175.2	-57.8	0	0	0	0	112.5	Q959 I961 E967	Q959-T963 PolarHBondContact O-N 3.31Å; Q959-T963 PolarHBondContact O-OG1 2.97Å; Q959-T963 VanDerWaalsContact O-OG1 3.07Å; I961-T963 VanDerWaalsContact C-N 3.34Å; I961-T963 PolarHBondContact O-N 3.01Å; T963-E967 PolarHBondContact O-N 2.89Å
964	A	84	Confident	81.8	Confident	7 Å²	7	61 Å²	61	6%	0.058	35%	0.348	C	S	.	.	H	α-helix	trans	-64.8	-41.3	177.4	0	0	0	0	0	112.2	V935 A960 I961 E967 L968	V935-A964 HydrophobicContact CG1-CB 4.08Å; A960-A964 WeakPolarHBondContact O-CB 3.42Å; A960-A964 PolarHBondContact O-N 3.1Å; I961-A964 PolarHBondContact O-N 3.4Å; A964-E967 PolarHBondContact O-N 3.23Å; A964-L968 WeakPolarHBondContact O-CG 3.44Å; A964-L968 PolarHBondContact O-N 2.9Å
965	T	85.8	Confident	82.6	Confident	12 Å²	12	59.2 Å²	59.2	7%	0.074	33%	0.325	C	S	.	.	H	α-helix	trans	-67.1	-41.6	178.9	-48.5	0	0	0	0	111.2	I880 H915 I961 S962 L968 L969	I880-T965 HydrophobicContact CG2-CG2 4.44Å; H915-T965 HydrophobicContact CB-CG2 4.2Å; I961-T965 WeakPolarHBondContact O-CB 3.47Å; I961-T965 PolarHBondContact O-N 3.31Å; I961-T965 PolarHBondContact O-OG1 3.49Å; S962-T965 PolarHBondContact O-N 3.42Å; T965-L968 PolarHBondContact O-N 2.95Å; T965-L969 WeakPolarHBondContact O-CB 3.33Å; T965-L969 PolarHBondContact O-N 3.37Å
966	Q	85.7	Confident	82.5	Confident	133 Å²	133	59 Å²	59	62%	0.621	33%	0.327	S	S	*	.	H	α-helix	trans	-65.6	-40.6	176.3	-75.9	173	-20	0	0	112.8	S962 L969 R970	S962-Q966 WeakPolarHBondContact O-CB 3.49Å; S962-Q966 VanDerWaalsContact O-CG 3.26Å; S962-Q966 WeakPolarHBondContact O-CG 3.31Å; S962-Q966 PolarHBondContact O-N 3.4Å; Q966-L969 PolarHBondContact O-N 3.16Å; Q966-R970 WeakPolarHBondContact O-CB 3.44Å; Q966-R970 PolarHBondContact O-N 3.02Å
967	E	85.4	Confident	82.3	Confident	64 Å²	64	56.7 Å²	56.7	30%	0.299	32%	0.324	S	S	.	.	H	α-helix	trans	-68.1	-36.3	175.2	-77.6	-71.1	-174.7	0	0	112.4	L933 T963 A964 R970 L971	L933-E967 HydrophobicContact CD1-CB 4.06Å; L933-E967 HydrophobicContact CD2-CB 4.19Å; T963-E967 PolarHBondContact O-N 2.89Å; A964-E967 PolarHBondContact O-N 3.23Å; E967-R970 VanDerWaalsContact CD-NH2 3.34Å; E967-R970 IonicContact OE1-CZ 2.85Å; E967-R970 IonicContact OE1-NH2 3.87Å; E967-R970 PolarHBondContact OE1-NH2 3.36Å; E967-R970 VanDerWaalsContact OE1-NH2 3.15Å; E967-R970 IonicContact OE2-CZ 2.8Å; E967-R970 VanDerWaalsContact OE2-CZ 3.25Å; E967-R970 IonicContact OE2-NE 3.19Å; E967-R970 PolarHBondContact OE2-NE 3.33Å; E967-R970 IonicContact OE2-NH2 2.71Å; E967-R970 PolarHBondContact OE2-NH2 3.42Å; E967-L971 WeakPolarHBondContact O-CB 3.13Å; E967-L971 VanDerWaalsContact O-CG 3.24Å; E967-L971 WeakPolarHBondContact O-CG 3.08Å; E967-L971 PolarHBondContact O-N 3.14Å
968	L	86.1	Confident	82.2	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-64.9	-45.2	172.6	-76	175.1	0	0	0	112.4	V848 L860 V862 L878 I880 L933 A964 T965 L971 A972	V848-L968 HydrophobicContact CG1-CD2 4.12Å; V848-L968 HydrophobicContact CG2-CD2 4.28Å; L860-L968 HydrophobicContact CB-CD2 3.9Å; V862-L968 HydrophobicContact CG2-CD1 3.95Å; V862-L968 HydrophobicContact CG2-CD2 3.78Å; V862-L968 HydrophobicContact CG2-CG 4.02Å; L878-L968 HydrophobicContact CD2-CD1 3.82Å; I880-L968 HydrophobicContact CG2-CB 3.51Å; I880-L968 HydrophobicContact CG2-CD1 3.88Å; I880-L968 HydrophobicContact CG2-CG 4.36Å; L933-L968 HydrophobicContact CD1-CD2 4.03Å; L933-L968 HydrophobicContact CD1-CG 4.15Å; A964-L968 WeakPolarHBondContact O-CG 3.44Å; A964-L968 PolarHBondContact O-N 2.9Å; T965-L968 PolarHBondContact O-N 2.95Å; L968-L971 PolarHBondContact O-N 3.1Å; L968-A972 PolarHBondContact O-N 2.91Å
969	L	86.4	Confident	82.3	Confident	32 Å²	32	55.2 Å²	55.2	17%	0.168	32%	0.316	C	S	.	.	H	α-helix	trans	-59.6	-48.1	176.1	-179.2	63.5	0	0	0	110.9	P909 C913 T965 Q966 L971 A972 E973	P909-L969 HydrophobicContact CG-CD1 3.79Å; C913-L969 HydrophobicContact CB-CD2 4Å; T965-L969 WeakPolarHBondContact O-CB 3.33Å; T965-L969 PolarHBondContact O-N 3.37Å; Q966-L969 PolarHBondContact O-N 3.16Å; L969-L971 VanDerWaalsContact C-N 3.26Å; L969-L971 PolarHBondContact O-N 2.86Å; L969-A972 PolarHBondContact O-N 2.9Å; L969-A972 VanDerWaalsContact O-N 3.08Å; L969-E973 HydrophobicContact CD1-CG 4.26Å; L969-E973 HydrophobicContact CG-CG 4.38Å; L969-E973 WeakPolarHBondContact CG-OE1 3.02Å; L969-E973 WeakPolarHBondContact O-CG 3.44Å; L969-E973 PolarHBondContact O-N 3.04Å
970	R	86	Confident	82.4	Confident	152 Å²	152	50.7 Å²	50.7	57%	0.574	31%	0.307	S	S	*	.	H	α-helix	trans	-58.9	-35.7	176	-171.8	177.6	73.8	131.5	-6.7	112.8	Q966 E967 A974	Q966-R970 WeakPolarHBondContact O-CB 3.44Å; Q966-R970 PolarHBondContact O-N 3.02Å; E967-R970 VanDerWaalsContact CD-NH2 3.34Å; E967-R970 IonicContact OE1-CZ 2.85Å; E967-R970 IonicContact OE1-NH2 3.87Å; E967-R970 PolarHBondContact OE1-NH2 3.36Å; E967-R970 VanDerWaalsContact OE1-NH2 3.15Å; E967-R970 IonicContact OE2-CZ 2.8Å; E967-R970 VanDerWaalsContact OE2-CZ 3.25Å; E967-R970 IonicContact OE2-NE 3.19Å; E967-R970 PolarHBondContact OE2-NE 3.33Å; E967-R970 IonicContact OE2-NH2 2.71Å; E967-R970 PolarHBondContact OE2-NH2 3.42Å; R970-A974 WeakPolarHBondContact O-CB 3.4Å; R970-A974 PolarHBondContact O-N 3.29Å
971	L	85.2	Confident	82.6	Confident	25 Å²	25	52.4 Å²	52.4	13%	0.131	31%	0.314	C	S	.	.	H	α-helix	trans	-71.2	-34.3	176.3	-76.4	170.3	0	0	0	112.8	L860 L933 E967 L968 L969 N975	L860-L971 HydrophobicContact CD1-CB 3.89Å; L933-L971 HydrophobicContact CD1-CD1 4.31Å; L933-L971 HydrophobicContact CD2-CD1 4.27Å; E967-L971 WeakPolarHBondContact O-CB 3.13Å; E967-L971 VanDerWaalsContact O-CG 3.24Å; E967-L971 WeakPolarHBondContact O-CG 3.08Å; E967-L971 PolarHBondContact O-N 3.14Å; L968-L971 PolarHBondContact O-N 3.1Å; L969-L971 VanDerWaalsContact C-N 3.26Å; L969-L971 PolarHBondContact O-N 2.86Å; L971-N975 PolarHBondContact O-N 2.9Å; L971-N975 PolarHBondContact O-ND2 3.26Å
972	A	83.9	Confident	82.7	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-70.3	-51.4	173.9	0	0	0	0	0	111.3	L860 I880 L906 I908 L968 L969 A974 N975	L860-A972 HydrophobicContact CD1-CB 4.01Å; I880-A972 HydrophobicContact CD1-CB 4.23Å; L906-A972 HydrophobicContact CB-CB 4.5Å; I908-A972 HydrophobicContact CG1-CB 4.42Å; L968-A972 PolarHBondContact O-N 2.91Å; L969-A972 PolarHBondContact O-N 2.9Å; L969-A972 VanDerWaalsContact O-N 3.08Å; A972-A974 VanDerWaalsContact C-N 3.3Å; A972-A974 PolarHBondContact O-N 2.9Å; A972-N975 CarbonylContact O-C 3.46Å; A972-N975 VanDerWaalsContact O-C 3.29Å; A972-N975 PolarHBondContact O-N 3.26Å; A972-N975 VanDerWaalsContact O-N 3.09Å
973	E	84.8	Confident	82.7	Confident	111 Å²	111	53.4 Å²	53.4	52%	0.519	32%	0.316	S	S	.	.	H	α-helix	trans	-58.8	-37.9	178.1	-70.6	173.2	174.2	0	0	112.9	L969 N975	L969-E973 HydrophobicContact CD1-CG 4.26Å; L969-E973 HydrophobicContact CG-CG 4.38Å; L969-E973 WeakPolarHBondContact CG-OE1 3.02Å; L969-E973 WeakPolarHBondContact O-CG 3.44Å; L969-E973 PolarHBondContact O-N 3.04Å; E973-N975 VanDerWaalsContact C-N 3.3Å; E973-N975 PolarHBondContact O-N 3.45Å
974	A	84.8	Confident	82.6	Confident	69 Å²	69	50.7 Å²	50.7	57%	0.57	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-16.1	178.9	0	0	0	0	0	114	R970 A972	R970-A974 WeakPolarHBondContact O-CB 3.4Å; R970-A974 PolarHBondContact O-N 3.29Å; A972-A974 VanDerWaalsContact C-N 3.3Å; A972-A974 PolarHBondContact O-N 2.9Å
975	N	82.1	Confident	82.5	Confident	63 Å²	63	51.9 Å²	51.9	34%	0.337	31%	0.307	S	S	.	.			trans	-140.1	61.3	-175.3	-51.1	-89.3	0	0	0	111.1	L971 A972 E973 G977 G978 V979	L971-N975 PolarHBondContact O-N 2.9Å; L971-N975 PolarHBondContact O-ND2 3.26Å; A972-N975 CarbonylContact O-C 3.46Å; A972-N975 VanDerWaalsContact O-C 3.29Å; A972-N975 PolarHBondContact O-N 3.26Å; A972-N975 VanDerWaalsContact O-N 3.09Å; E973-N975 VanDerWaalsContact C-N 3.3Å; E973-N975 PolarHBondContact O-N 3.45Å; N975-G977 PolarHBondContact O-N 2.93Å; N975-G977 VanDerWaalsContact O-N 3.14Å; N975-G978 PolarHBondContact O-N 3.25Å; N975-V979 HydrophobicContact CB-CG2 3.79Å
976	P	74.3	Confident	82.5	Confident	73 Å²	73	56.7 Å²	56.7	47%	0.474	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-29.8	-172.7	23.1	-33.7	0	0	0	113.2	A905 L906 I908 G978	A905-P976 VanDerWaalsContact CA-O 3.22Å; A905-P976 WeakPolarHBondContact CA-O 3.43Å; L906-P976 PolarHBondContact N-O 3.09Å; L906-P976 VanDerWaalsContact N-O 3.12Å; I908-P976 HydrophobicContact CD1-CB 4.11Å; P976-G978 VanDerWaalsContact C-N 3.34Å; P976-G978 PolarHBondContact O-N 3.48Å
977	G	69.4	Low	82.3	Confident	61 Å²	61	54.5 Å²	54.5	63%	0.629	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	9.3	175.9	0	0	0	0	0	116.1	N975	N975-G977 PolarHBondContact O-N 2.93Å; N975-G977 VanDerWaalsContact O-N 3.14Å
978	G	75	Confident	82.2	Confident	30 Å²	30	51.9 Å²	51.9	31%	0.309	31%	0.312	S	S	.	.			trans	115	153.2	178.7	0	0	0	0	0	114.7	N975 P976	N975-G978 PolarHBondContact O-N 3.25Å; P976-G978 VanDerWaalsContact C-N 3.34Å; P976-G978 PolarHBondContact O-N 3.48Å
979	V	79.9	Confident	82.1	Confident	14 Å²	14	58.1 Å²	58.1	9%	0.085	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-102.6	142.1	178.6	167.8	0	0	0	0	110.5	L906 T929 K931 N975 T981	L906-V979 HydrophobicContact CD1-CG2 3.78Å; T929-V979 HydrophobicContact CG2-CB 4.3Å; T929-V979 HydrophobicContact CG2-CG1 3.86Å; K931-V979 HydrophobicContact CG-CG1 4.32Å; N975-V979 HydrophobicContact CB-CG2 3.79Å; V979-T981 PolarHBondContact O-N 2.77Å
980	A	81.9	Confident	81.9	Confident	73 Å²	73	57.6 Å²	57.6	60%	0.603	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-50.4	119.5	177.5	0	0	0	0	0	113.3	T929 V930	T929-A980 WeakPolarHBondContact CA-O 3.44Å; V930-A980 HydrophobicContact CG2-CB 4.37Å; V930-A980 PolarHBondContact N-O 3.06Å
981	T	84.4	Confident	81.7	Confident	73 Å²	73	58.9 Å²	58.9	45%	0.448	35%	0.348	S	S	.	.	B	Isolated β-bridge	trans	-93	153.2	179.1	55.3	0	0	0	0	111.7	A927 I928 V979	A927-T981 HydrophobicContact CB-CG2 3.57Å; I928-T981 CarbonylContact O-C 3.58Å; I928-T981 WeakPolarHBondContact O-CA 3.47Å; V979-T981 PolarHBondContact O-N 2.77Å
982	L	83.8	Confident	81.7	Confident	32 Å²	32	60.5 Å²	60.5	17%	0.168	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-71.9	133.5	173.1	-68.9	166.7	0	0	0	111	A842 I928 V930 D987 L988	A842-L982 HydrophobicContact CB-CD1 4.02Å; I928-L982 HydrophobicContact CB-CD1 4.41Å; I928-L982 HydrophobicContact CG2-CD1 3.79Å; I928-L982 PolarHBondContact O-N 2.87Å; V930-L982 HydrophobicContact CB-CD2 4.45Å; V930-L982 HydrophobicContact CG2-CD2 3.92Å; V930-L982 HydrophobicContact CG2-CG 4.29Å; L982-D987 WeakPolarHBondContact CA-OD2 3.42Å; L982-D987 HydrophobicContact CB-CB 4.27Å; L982-D987 HydrophobicContact CD2-CB 3.77Å; L982-L988 HydrophobicContact CD1-CD2 4.28Å
983	D	83.1	Confident	81.7	Confident	25 Å²	25	65.7 Å²	65.7	13%	0.134	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-78.3	122.8	172.9	-173.1	-29	0	0	0	110.3	V985 N986 D987 L988 R1003	D983-V985 PolarHBondContact O-N 3.16Å; D983-V985 PolarHBondContact OD1-N 3.21Å; D983-N986 HydrophobicContact CB-CB 4.05Å; D983-N986 PolarHBondContact OD1-N 3.09Å; D983-N986 PolarHBondContact OD2-ND2 3.43Å; D983-D987 PolarHBondContact N-OD2 3.3Å; D983-D987 WeakPolarHBondContact O-CA 3.44Å; D983-D987 WeakPolarHBondContact O-CB 3.48Å; D983-D987 PolarHBondContact O-N 3.09Å; D983-L988 PolarHBondContact O-N 3.23Å; D983-L988 VanDerWaalsContact O-N 3.11Å; D983-R1003 IonicContact OD1-NH2 3.61Å; D983-R1003 IonicContact OD2-CZ 3.61Å; D983-R1003 IonicContact OD2-NH2 2.78Å; D983-R1003 PolarHBondContact OD2-NH2 3.07Å
984	P	82.1	Confident	81.6	Confident	15 Å²	15	65.9 Å²	65.9	10%	0.097	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-31.9	178.3	-26.4	37.2	0	0	0	114.2	L829 I833 L988 L990 V995	L829-P984 HydrophobicContact CD1-CB 4.19Å; L829-P984 HydrophobicContact CD1-CG 4.25Å; L829-P984 HydrophobicContact CD2-CG 4.16Å; L829-P984 HydrophobicContact CG-CG 4.26Å; I833-P984 HydrophobicContact CD1-CB 4.24Å; I833-P984 HydrophobicContact CD1-CG 3.88Å; I833-P984 HydrophobicContact CG1-CB 4.43Å; P984-L988 WeakPolarHBondContact O-CB 3.44Å; P984-L990 HydrophobicContact CB-CD1 4.43Å; P984-L990 VanDerWaalsContact O-CB 3.28Å; P984-L990 WeakPolarHBondContact O-CB 3.21Å; P984-L990 WeakPolarHBondContact O-CG 3.39Å; P984-L990 PolarHBondContact O-N 3.02Å; P984-V995 HydrophobicContact CB-CG1 4.35Å
985	V	83.6	Confident	81.6	Confident	33 Å²	33	63 Å²	63	20%	0.2	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-49.6	-177.4	-178	0	0	0	0	110.6	D983 Q989 V996	D983-V985 PolarHBondContact O-N 3.16Å; D983-V985 PolarHBondContact OD1-N 3.21Å; V985-Q989 VanDerWaalsContact O-CA 3.31Å; V985-Q989 WeakPolarHBondContact O-CA 3.2Å; V985-Q989 PolarHBondContact O-N 3.29Å; V985-V996 HydrophobicContact CG1-CG2 4Å; V985-V996 HydrophobicContact CG2-CB 4.42Å; V985-V996 HydrophobicContact CG2-CG2 3.99Å
986	N	83.7	Confident	81.8	Confident	112 Å²	112	62 Å²	62	60%	0.599	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-45.1	-172.7	-67.3	-56.6	0	0	0	113.2	D983	D983-N986 HydrophobicContact CB-CB 4.05Å; D983-N986 PolarHBondContact OD1-N 3.09Å; D983-N986 PolarHBondContact OD2-ND2 3.43Å
987	D	83.6	Confident	82.4	Confident	87 Å²	87	64.8 Å²	64.8	47%	0.465	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-41.9	-175.2	-61.1	-40.7	0	0	0	112.6	L982 D983 Q989	L982-D987 WeakPolarHBondContact CA-OD2 3.42Å; L982-D987 HydrophobicContact CB-CB 4.27Å; L982-D987 HydrophobicContact CD2-CB 3.77Å; D983-D987 PolarHBondContact N-OD2 3.3Å; D983-D987 WeakPolarHBondContact O-CA 3.44Å; D983-D987 WeakPolarHBondContact O-CB 3.48Å; D983-D987 PolarHBondContact O-N 3.09Å; D987-Q989 VanDerWaalsContact C-N 3.34Å
988	L	82.3	Confident	83.2	Confident	10 Å²	10	63.4 Å²	63.4	5%	0.052	36%	0.357	C	S	.	.	S	Bend	trans	-85.2	-8.8	178.1	-56.2	-177.6	0	0	0	113.2	I833 N838 A842 L982 D983 P984 L990	I833-L988 HydrophobicContact CD1-CD1 4.34Å; I833-L988 HydrophobicContact CG1-CD1 4.1Å; I833-L988 HydrophobicContact CG2-CD1 3.97Å; N838-L988 VanDerWaalsContact CB-O 3.31Å; N838-L988 WeakPolarHBondContact CB-O 3.37Å; N838-L988 PolarHBondContact ND2-O 3.27Å; A842-L988 HydrophobicContact CB-CD2 3.63Å; L982-L988 HydrophobicContact CD1-CD2 4.28Å; D983-L988 PolarHBondContact O-N 3.23Å; D983-L988 VanDerWaalsContact O-N 3.11Å; P984-L988 WeakPolarHBondContact O-CB 3.44Å; L988-L990 VanDerWaalsContact C-N 3.29Å; L988-L990 HydrophobicContact CB-CD1 4.38Å; L988-L990 HydrophobicContact CB-CG 4.02Å; L988-L990 PolarHBondContact O-N 3.27Å
989	Q	83.3	Confident	83.7	Confident	131 Å²	131	62.4 Å²	62.4	61%	0.612	35%	0.345	S	S	*	.			trans	59.5	32.1	178.4	-56	-174.1	-11.8	0	0	114.2	V985 D987 K991	V985-Q989 VanDerWaalsContact O-CA 3.31Å; V985-Q989 WeakPolarHBondContact O-CA 3.2Å; V985-Q989 PolarHBondContact O-N 3.29Å; D987-Q989 VanDerWaalsContact C-N 3.34Å; Q989-K991 PolarHBondContact O-N 3.05Å
990	L	82.8	Confident	84	Confident	21 Å²	21	67.5 Å²	67.5	11%	0.11	37%	0.369	C	S	.	.			trans	-81.1	103.6	176.8	-52.8	-177.2	0	0	0	109.6	I833 S836 P984 L988 V995	I833-L990 HydrophobicContact CG1-CD1 3.87Å; S836-L990 VanDerWaalsContact CB-CD2 3.42Å; P984-L990 HydrophobicContact CB-CD1 4.43Å; P984-L990 VanDerWaalsContact O-CB 3.28Å; P984-L990 WeakPolarHBondContact O-CB 3.21Å; P984-L990 WeakPolarHBondContact O-CG 3.39Å; P984-L990 PolarHBondContact O-N 3.02Å; L988-L990 VanDerWaalsContact C-N 3.29Å; L988-L990 HydrophobicContact CB-CD1 4.38Å; L988-L990 HydrophobicContact CB-CG 4.02Å; L988-L990 PolarHBondContact O-N 3.27Å; L990-V995 HydrophobicContact CB-CG1 3.75Å; L990-V995 HydrophobicContact CD1-CG1 4.34Å
991	K	82.4	Confident	84.3	Confident	178 Å²	178	69 Å²	69	77%	0.774	36%	0.359	S	S	*	.			trans	-103.9	13.9	-174.1	-64	-176	177.9	-176.2	0	114.3	Q989	Q989-K991 PolarHBondContact O-N 3.05Å
992	S	84.4	Confident	84.4	Confident	60 Å²	60	66.4 Å²	66.4	42%	0.42	34%	0.343	S	S	.	.			trans	-67	139	170.5	38.1	0	0	0	0	110	D994 V995 V996	S992-D994 VanDerWaalsContact C-N 3.31Å; S992-D994 PolarHBondContact O-N 3.06Å; S992-V995 PolarHBondContact O-N 3.22Å; S992-V995 VanDerWaalsContact O-N 3.1Å; S992-V995 WeakPolarHBondContact OG-CB 3.33Å; S992-V995 WeakPolarHBondContact OG-CG2 3.45Å; S992-V996 PolarHBondContact O-N 3.1Å; S992-V996 VanDerWaalsContact O-N 3.12Å
993	V	84.4	Confident	84.4	Confident	108 Å²	108	70.6 Å²	70.6	66%	0.655	36%	0.356	S	S	*	.	H	α-helix	trans	-53.1	-51.3	-176.1	-179.5	0	0	0	0	110.4	V995 V996 E997	V993-V995 PolarHBondContact O-N 3.26Å; V993-V995 VanDerWaalsContact O-N 3.17Å; V993-V996 PolarHBondContact O-N 3.42Å; V993-V996 VanDerWaalsContact O-N 3.09Å; V993-E997 WeakPolarHBondContact O-CB 3.34Å; V993-E997 PolarHBondContact O-N 3.31Å
994	D	83.5	Confident	84.7	Confident	116 Å²	116	73.2 Å²	73.2	62%	0.62	37%	0.373	S	S	*	.	H	α-helix	trans	-55.9	-35.1	-179.2	-35.7	-19.3	0	0	0	113.2	S992 S998	S992-D994 VanDerWaalsContact C-N 3.31Å; S992-D994 PolarHBondContact O-N 3.06Å; D994-S998 WeakPolarHBondContact O-CB 3.33Å; D994-S998 PolarHBondContact O-N 3.39Å; D994-S998 PolarHBondContact O-OG 3.07Å
995	V	83.7	Confident	84.9	Confident	8 Å²	8	72.6 Å²	72.6	5%	0.048	37%	0.369	C	S	.	.	H	α-helix	trans	-78.6	-37.4	-179.7	169.9	0	0	0	0	111.4	L829 A832 P984 L990 S992 V993 S999	L829-V995 HydrophobicContact CD1-CG1 3.81Å; A832-V995 HydrophobicContact CB-CG2 3.58Å; P984-V995 HydrophobicContact CB-CG1 4.35Å; L990-V995 HydrophobicContact CB-CG1 3.75Å; L990-V995 HydrophobicContact CD1-CG1 4.34Å; S992-V995 PolarHBondContact O-N 3.22Å; S992-V995 VanDerWaalsContact O-N 3.1Å; S992-V995 WeakPolarHBondContact OG-CB 3.33Å; S992-V995 WeakPolarHBondContact OG-CG2 3.45Å; V993-V995 PolarHBondContact O-N 3.26Å; V993-V995 VanDerWaalsContact O-N 3.17Å; V995-S999 WeakPolarHBondContact O-CB 3.3Å; V995-S999 PolarHBondContact O-N 3.37Å
996	V	85.9	Confident	84.7	Confident	42 Å²	42	75 Å²	75	26%	0.255	38%	0.378	S	S	.	.	H	α-helix	trans	-66.4	-47.3	174.7	178.6	0	0	0	0	109.9	V985 S992 V993 S999 M1000	V985-V996 HydrophobicContact CG1-CG2 4Å; V985-V996 HydrophobicContact CG2-CB 4.42Å; V985-V996 HydrophobicContact CG2-CG2 3.99Å; S992-V996 PolarHBondContact O-N 3.1Å; S992-V996 VanDerWaalsContact O-N 3.12Å; V993-V996 PolarHBondContact O-N 3.42Å; V993-V996 VanDerWaalsContact O-N 3.09Å; V996-S999 PolarHBondContact O-N 3.15Å; V996-M1000 HydrophobicContact CG1-CE 3.83Å; V996-M1000 HydrophobicContact CG1-SD 4.37Å; V996-M1000 WeakPolarHBondContact O-CG 3.41Å; V996-M1000 PolarHBondContact O-N 3.21Å
997	E	86.3	Confident	84.7	Confident	132 Å²	132	74.6 Å²	74.6	62%	0.617	38%	0.376	S	S	*	.	H	α-helix	trans	-61.7	-48.4	176.5	-173.8	173.1	-175.8	0	0	111.4	V993 S999 M1000 R1001	V993-E997 WeakPolarHBondContact O-CB 3.34Å; V993-E997 PolarHBondContact O-N 3.31Å; E997-S999 VanDerWaalsContact C-N 3.33Å; E997-S999 PolarHBondContact O-N 2.81Å; E997-M1000 PolarHBondContact O-N 3.43Å; E997-R1001 VanDerWaalsContact O-CB 3.31Å; E997-R1001 WeakPolarHBondContact O-CB 3.43Å; E997-R1001 PolarHBondContact O-N 3.35Å
998	S	86.4	Confident	84.7	Confident	31 Å²	31	72 Å²	72	22%	0.217	36%	0.364	C	S	.	.	H	α-helix	trans	-60.1	-39.7	176.2	-63.6	0	0	0	0	112.7	T825 D994 L1002	T825-S998 VanDerWaalsContact CG2-O 3.3Å; T825-S998 WeakPolarHBondContact CG2-O 3.48Å; D994-S998 WeakPolarHBondContact O-CB 3.33Å; D994-S998 PolarHBondContact O-N 3.39Å; D994-S998 PolarHBondContact O-OG 3.07Å; S998-L1002 VanDerWaalsContact O-CB 3.27Å; S998-L1002 WeakPolarHBondContact O-CB 3.45Å; S998-L1002 PolarHBondContact O-N 2.97Å
999	S	85.6	Confident	84.6	Confident	9 Å²	9	71.9 Å²	71.9	6%	0.063	36%	0.364	C	S	.	.	H	α-helix	trans	-67.2	-40.2	177.7	-173.1	0	0	0	0	112	V995 V996 E997 R1003	V995-S999 WeakPolarHBondContact O-CB 3.3Å; V995-S999 PolarHBondContact O-N 3.37Å; V996-S999 PolarHBondContact O-N 3.15Å; E997-S999 VanDerWaalsContact C-N 3.33Å; E997-S999 PolarHBondContact O-N 2.81Å; S999-R1003 PolarHBondContact O-N 2.94Å
1000	M	86.5	Confident	84.2	Confident	121 Å²	121	70.8 Å²	70.8	60%	0.596	36%	0.362	S	S	*	.	H	α-helix	trans	-67.4	-46.3	173.6	-70.5	-178.3	179.8	0	0	111.6	V996 E997 L1002 R1003 V1004	V996-M1000 HydrophobicContact CG1-CE 3.83Å; V996-M1000 HydrophobicContact CG1-SD 4.37Å; V996-M1000 WeakPolarHBondContact O-CG 3.41Å; V996-M1000 PolarHBondContact O-N 3.21Å; E997-M1000 PolarHBondContact O-N 3.43Å; M1000-L1002 VanDerWaalsContact C-N 3.33Å; M1000-L1002 PolarHBondContact O-N 3.21Å; M1000-R1003 PolarHBondContact O-N 3.38Å; M1000-V1004 PolarHBondContact O-N 3.27Å; M1000-V1004 VanDerWaalsContact O-N 3.12Å
1001	R	88.9	Confident	84.2	Confident	104 Å²	104	76 Å²	76	39%	0.392	39%	0.389	S	S	.	.	H	α-helix	trans	-60.9	-41.1	178.7	-176	59.1	178.2	162.1	2.7	111.6	E821 E997 R1003 V1004 L1005	E821-R1001 IonicContact OE1-CZ 2.75Å; E821-R1001 IonicContact OE1-NE 3.64Å; E821-R1001 PolarHBondContact OE1-NE 2.88Å; E821-R1001 IonicContact OE1-NH2 2.72Å; E821-R1001 PolarHBondContact OE1-NH2 3.04Å; E821-R1001 IonicContact OE2-CZ 3.35Å; E821-R1001 IonicContact OE2-NH2 2.96Å; E821-R1001 PolarHBondContact OE2-NH2 2.98Å; E997-R1001 VanDerWaalsContact O-CB 3.31Å; E997-R1001 WeakPolarHBondContact O-CB 3.43Å; E997-R1001 PolarHBondContact O-N 3.35Å; R1001-R1003 VanDerWaalsContact C-N 3.32Å; R1001-R1003 PolarHBondContact O-N 3.16Å; R1001-V1004 PolarHBondContact O-N 3.28Å; R1001-L1005 HydrophobicContact CG-CD1 3.94Å; R1001-L1005 HydrophobicContact CG-CG 4.38Å; R1001-L1005 WeakPolarHBondContact O-CB 3.38Å; R1001-L1005 VanDerWaalsContact O-CG 3.28Å; R1001-L1005 WeakPolarHBondContact O-CG 3.44Å; R1001-L1005 PolarHBondContact O-N 2.65Å
1002	L	85.9	Confident	84.2	Confident	20 Å²	20	69.1 Å²	69.1	11%	0.105	36%	0.36	C	S	.	.	H	α-helix	trans	-59.8	-39.9	176.6	-170.3	71.3	0	0	0	112.1	M822 T825 R826 L829 S998 M1000 L1005 Q1006	M822-L1002 HydrophobicContact CG-CD1 3.72Å; T825-L1002 HydrophobicContact CG2-CB 4.14Å; T825-L1002 HydrophobicContact CG2-CD1 4.38Å; R826-L1002 HydrophobicContact CB-CD1 4.14Å; L829-L1002 HydrophobicContact CD2-CD2 3.97Å; S998-L1002 VanDerWaalsContact O-CB 3.27Å; S998-L1002 WeakPolarHBondContact O-CB 3.45Å; S998-L1002 PolarHBondContact O-N 2.97Å; M1000-L1002 VanDerWaalsContact C-N 3.33Å; M1000-L1002 PolarHBondContact O-N 3.21Å; L1002-L1005 PolarHBondContact O-N 2.97Å; L1002-Q1006 WeakPolarHBondContact O-CB 3.45Å; L1002-Q1006 VanDerWaalsContact O-CG 3.25Å; L1002-Q1006 WeakPolarHBondContact O-CG 3.39Å; L1002-Q1006 PolarHBondContact O-N 2.97Å
1003	R	84.6	Confident	83.9	Confident	119 Å²	119	71.3 Å²	71.3	45%	0.449	37%	0.367	S	S	.	.	H	α-helix	trans	-65.1	-48.6	175.4	-67.6	175.9	-168.9	-179.6	3.5	111.5	D983 S999 M1000 R1001 L1005 Q1006 D1007	D983-R1003 IonicContact OD1-NH2 3.61Å; D983-R1003 IonicContact OD2-CZ 3.61Å; D983-R1003 IonicContact OD2-NH2 2.78Å; D983-R1003 PolarHBondContact OD2-NH2 3.07Å; S999-R1003 PolarHBondContact O-N 2.94Å; M1000-R1003 PolarHBondContact O-N 3.38Å; R1001-R1003 VanDerWaalsContact C-N 3.32Å; R1001-R1003 PolarHBondContact O-N 3.16Å; R1003-L1005 VanDerWaalsContact C-N 3.27Å; R1003-L1005 PolarHBondContact O-N 3.45Å; R1003-Q1006 WeakPolarHBondContact O-CB 3.31Å; R1003-Q1006 PolarHBondContact O-N 3.36Å; R1003-Q1006 VanDerWaalsContact O-N 3.08Å; R1003-D1007 PolarHBondContact O-N 3.2Å
1004	V	88.1	Confident	83.5	Confident	80 Å²	80	66.1 Å²	66.1	49%	0.485	34%	0.335	S	S	.	.	H	α-helix	trans	-57.9	-40.7	177.3	174.6	0	0	0	0	111.6	M1000 R1001 S1008	M1000-V1004 PolarHBondContact O-N 3.27Å; M1000-V1004 VanDerWaalsContact O-N 3.12Å; R1001-V1004 PolarHBondContact O-N 3.28Å; V1004-S1008 WeakPolarHBondContact O-CB 3.3Å; V1004-S1008 PolarHBondContact O-N 2.66Å; V1004-S1008 PolarHBondContact O-OG 3.45Å
1005	L	86.1	Confident	83.1	Confident	2 Å²	2	63 Å²	63	1%	0.01	32%	0.32	C	S	.	.	H	α-helix	trans	-68	-37.6	176	-69.8	168.7	0	0	0	112.6	T818 E821 M822 R1001 L1002 R1003 S1008 L1009	T818-L1005 HydrophobicContact CG2-CD2 3.82Å; E821-L1005 HydrophobicContact CB-CD1 4.17Å; E821-L1005 HydrophobicContact CB-CD2 4.42Å; E821-L1005 HydrophobicContact CG-CD1 3.85Å; E821-L1005 HydrophobicContact CG-CD2 4.48Å; M822-L1005 HydrophobicContact CB-CB 4.29Å; M822-L1005 HydrophobicContact CB-CD1 4.43Å; R1001-L1005 HydrophobicContact CG-CD1 3.94Å; R1001-L1005 HydrophobicContact CG-CG 4.38Å; R1001-L1005 WeakPolarHBondContact O-CB 3.38Å; R1001-L1005 VanDerWaalsContact O-CG 3.28Å; R1001-L1005 WeakPolarHBondContact O-CG 3.44Å; R1001-L1005 PolarHBondContact O-N 2.65Å; L1002-L1005 PolarHBondContact O-N 2.97Å; R1003-L1005 VanDerWaalsContact C-N 3.27Å; R1003-L1005 PolarHBondContact O-N 3.45Å; L1005-S1008 WeakPolarHBondContact CA-OG 3.49Å; L1005-S1008 PolarHBondContact O-OG 3.31Å; L1005-L1009 VanDerWaalsContact O-CG 3.32Å; L1005-L1009 WeakPolarHBondContact O-CG 3.45Å; L1005-L1009 PolarHBondContact O-N 3.3Å
1006	Q	80.9	Confident	82.8	Confident	83 Å²	83	69.6 Å²	69.6	39%	0.388	35%	0.35	S	S	.	.	H	α-helix	trans	-66.2	-42	175	-76.4	176.7	-55.3	0	0	112	M822 L1002 R1003 L1009	M822-Q1006 HydrophobicContact SD-CG 3.88Å; L1002-Q1006 WeakPolarHBondContact O-CB 3.45Å; L1002-Q1006 VanDerWaalsContact O-CG 3.25Å; L1002-Q1006 WeakPolarHBondContact O-CG 3.39Å; L1002-Q1006 PolarHBondContact O-N 2.97Å; R1003-Q1006 WeakPolarHBondContact O-CB 3.31Å; R1003-Q1006 PolarHBondContact O-N 3.36Å; R1003-Q1006 VanDerWaalsContact O-N 3.08Å; Q1006-L1009 PolarHBondContact O-N 2.94Å
1007	D	83.2	Confident	82.4	Confident	105 Å²	105	68.3 Å²	68.3	56%	0.561	34%	0.343	S	S	*	.	H	α-helix	trans	-65.5	-45.9	176.1	-65.7	-28.9	0	0	0	110.3	R1003 L1009 L1010	R1003-D1007 PolarHBondContact O-N 3.2Å; D1007-L1009 PolarHBondContact O-N 3.05Å; D1007-L1009 VanDerWaalsContact O-N 3.15Å; D1007-L1010 WeakPolarHBondContact O-CB 3.28Å; D1007-L1010 PolarHBondContact O-N 2.85Å; D1007-L1010 VanDerWaalsContact O-N 3.1Å
1008	S	83.9	Confident	81.9	Confident	32 Å²	32	68 Å²	68	22%	0.224	35%	0.352	C	S	.	.	H	α-helix	trans	-64.4	-20.9	179.2	64.7	0	0	0	0	114.3	T818 V1004 L1005 L1010 D1011 F1012	T818-S1008 WeakPolarHBondContact CG2-OG 3.48Å; V1004-S1008 WeakPolarHBondContact O-CB 3.3Å; V1004-S1008 PolarHBondContact O-N 2.66Å; V1004-S1008 PolarHBondContact O-OG 3.45Å; L1005-S1008 WeakPolarHBondContact CA-OG 3.49Å; L1005-S1008 PolarHBondContact O-OG 3.31Å; S1008-L1010 PolarHBondContact O-N 3.03Å; S1008-D1011 PolarHBondContact O-N 3.45Å; S1008-F1012 VanDerWaalsContact O-CD2 3.29Å; S1008-F1012 WeakPolarHBondContact O-CD2 3.43Å; S1008-F1012 WeakPolarHBondContact O-CE2 3.48Å
1009	L	78.9	Confident	81.6	Confident	7 Å²	7	69.2 Å²	69.2	4%	0.037	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-15.7	176.2	-78.3	167.5	0	0	0	113.7	Y815 T818 M822 Y902 L1005 Q1006 D1007 F1012	Y815-L1009 HydrophobicContact CD2-CD2 3.83Å; Y815-L1009 HydrophobicContact CE2-CD2 3.58Å; T818-L1009 HydrophobicContact CG2-CD2 3.83Å; T818-L1009 HydrophobicContact CG2-CG 3.82Å; M822-L1009 HydrophobicContact CE-CD1 3.51Å; M822-L1009 HydrophobicContact SD-CD1 3.56Å; M822-L1009 VanDerWaalsContact SD-CD1 3.56Å; Y902-L1009 HydrophobicContact CD2-CB 4.29Å; Y902-L1009 HydrophobicContact CE2-CB 4.21Å; L1005-L1009 VanDerWaalsContact O-CG 3.32Å; L1005-L1009 WeakPolarHBondContact O-CG 3.45Å; L1005-L1009 PolarHBondContact O-N 3.3Å; Q1006-L1009 PolarHBondContact O-N 2.94Å; D1007-L1009 PolarHBondContact O-N 3.05Å; D1007-L1009 VanDerWaalsContact O-N 3.15Å; L1009-F1012 HydrophobicContact CD2-CD2 4.24Å; L1009-F1012 HydrophobicContact CD2-CE2 4.22Å
1010	L	75.7	Confident	81.3	Confident	109 Å²	109	70.2 Å²	70.2	57%	0.571	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-24.8	173.8	-78.3	153.5	0	0	0	113.4	Y902 D1007 S1008	Y902-L1010 WeakPolarHBondContact OH-CD2 3.31Å; Y902-L1010 WeakPolarHBondContact OH-CG 3.22Å; D1007-L1010 WeakPolarHBondContact O-CB 3.28Å; D1007-L1010 PolarHBondContact O-N 2.85Å; D1007-L1010 VanDerWaalsContact O-N 3.1Å; S1008-L1010 PolarHBondContact O-N 3.03Å
1011	D	82.3	Confident	80.8	Confident	129 Å²	129	67 Å²	67	69%	0.69	36%	0.355	S	S	*	.	S	Bend	trans	-87.6	-4.2	-168.4	-63.1	-34.9	0	0	0	113.7	S1008	S1008-D1011 PolarHBondContact O-N 3.45Å
1012	F	82.3	Confident	80.4	Confident	34 Å²	34	67.4 Å²	67.4	15%	0.149	36%	0.361	C	S	.	.			trans	-88	132.8	-176.5	-67	-69.6	0	0	0	113.2	D811 P814 Y815 T818 S1008 L1009	D811-F1012 HydrophobicContact CB-CD1 4.04Å; D811-F1012 VanDerWaalsContact OD2-CA 3.27Å; D811-F1012 WeakPolarHBondContact OD2-CA 3.33Å; D811-F1012 WeakPolarHBondContact OD2-CB 3.42Å; D811-F1012 WeakPolarHBondContact OD2-CD1 3.34Å; P814-F1012 HydrophobicContact CB-CE1 3.72Å; P814-F1012 HydrophobicContact CB-CZ 4.25Å; Y815-F1012 HydrophobicContact CD2-CB 3.82Å; Y815-F1012 AromaticContact CD2-CD2 3.64Å; Y815-F1012 HydrophobicContact CD2-CD2 3.64Å; Y815-F1012 HydrophobicContact CD2-CE2 4.38Å; Y815-F1012 AromaticContact CD2-CG 3.84Å; Y815-F1012 HydrophobicContact CD2-CG 3.84Å; Y815-F1012 HydrophobicContact CE2-CD2 4.47Å; Y815-F1012 HydrophobicContact CG-CD2 4.47Å; T818-F1012 HydrophobicContact CG2-CE2 4.21Å; S1008-F1012 VanDerWaalsContact O-CD2 3.29Å; S1008-F1012 WeakPolarHBondContact O-CD2 3.43Å; S1008-F1012 WeakPolarHBondContact O-CE2 3.48Å; L1009-F1012 HydrophobicContact CD2-CD2 4.24Å; L1009-F1012 HydrophobicContact CD2-CE2 4.22Å
1013	N	78.8	Confident	80.1	Confident	106 Å²	106	66.7 Å²	66.7	57%	0.567	36%	0.357	S	S	*	.	S	Bend	trans	-85.8	-25.9	-178.1	-66.5	-76.7	0	0	0	113.1	D811 V1015 H1016	D811-N1013 PolarHBondContact OD2-N 2.98Å; N1013-V1015 PolarHBondContact O-N 3.27Å; N1013-V1015 VanDerWaalsContact O-N 3.13Å; N1013-H1016 PolarHBondContact O-N 3.44Å; N1013-H1016 VanDerWaalsContact O-N 3.08Å
1014	C	75.3	Confident	80	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-55.3	-30.7	-179.5	53.2	0	0	0	0	114.6	Q808 L809 D811 I812 H1016 S1017 F1020	Q808-C1014 WeakPolarHBondContact O-CA 3.45Å; Q808-C1014 PolarHBondContact O-N 3.25Å; L809-C1014 HydrophobicContact CD2-CB 4.5Å; D811-C1014 WeakPolarHBondContact OD1-CB 3.39Å; D811-C1014 PolarHBondContact OD1-N 3.47Å; D811-C1014 VanDerWaalsContact OD1-N 3.12Å; D811-C1014 PolarHBondContact OD2-N 3.17Å; I812-C1014 HydrophobicContact CB-CB 4.18Å; C1014-H1016 PolarHBondContact O-N 3.21Å; C1014-H1016 VanDerWaalsContact O-N 3.13Å; C1014-S1017 WeakPolarHBondContact O-CB 3.33Å; C1014-S1017 PolarHBondContact O-N 2.83Å; C1014-S1017 VanDerWaalsContact O-N 3.09Å; C1014-F1020 HydrophobicContact CB-CD2 4.02Å; C1014-F1020 HydrophobicContact CB-CE2 4.09Å; C1014-F1020 WeakPolarHBondContact O-CD2 3.41Å; C1014-F1020 WeakPolarHBondContact O-CG 3.43Å
1015	V	75.8	Confident	79.6	Confident	50 Å²	50	58.9 Å²	58.9	30%	0.303	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-60.5	-22.8	179.5	-173	0	0	0	0	112.5	Y815 N1013	Y815-V1015 HydrophobicContact CD2-CG2 3.93Å; Y815-V1015 HydrophobicContact CE2-CG2 3.39Å; N1013-V1015 PolarHBondContact O-N 3.27Å; N1013-V1015 VanDerWaalsContact O-N 3.13Å
1016	H	77.4	Confident	79.4	Confident	147 Å²	147	62.4 Å²	62.4	68%	0.681	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-89.4	-3.1	-179.8	-60	-50.2	0	0	0	114.4	N1013 C1014	N1013-H1016 PolarHBondContact O-N 3.44Å; N1013-H1016 VanDerWaalsContact O-N 3.08Å; C1014-H1016 PolarHBondContact O-N 3.21Å; C1014-H1016 VanDerWaalsContact O-N 3.13Å
1017	S	76.9	Confident	79.6	Confident	14 Å²	14	58.6 Å²	58.6	10%	0.098	32%	0.321	C	S	.	.			trans	-79.1	136.6	178.7	175.8	0	0	0	0	112.3	C1014 T1019 F1020	C1014-S1017 WeakPolarHBondContact O-CB 3.33Å; C1014-S1017 PolarHBondContact O-N 2.83Å; C1014-S1017 VanDerWaalsContact O-N 3.09Å; S1017-T1019 VanDerWaalsContact C-N 3.26Å; S1017-T1019 PolarHBondContact O-N 3.45Å; S1017-T1019 PolarHBondContact OG-N 3.03Å; S1017-T1019 PolarHBondContact OG-OG1 2.68Å; S1017-F1020 WeakPolarHBondContact O-CB 3.42Å; S1017-F1020 PolarHBondContact O-N 2.92Å
1018	P	77	Confident	79.7	Confident	125 Å²	125	58.1 Å²	58.1	81%	0.812	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-23.4	177.7	28.4	-35.7	0	0	0	113.7
1019	T	78.6	Confident	79.7	Confident	58 Å²	58	61.7 Å²	61.7	36%	0.356	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	1	177.9	52.6	0	0	0	0	113.2	S1017 A1021 E1022 Q1023	S1017-T1019 VanDerWaalsContact C-N 3.26Å; S1017-T1019 PolarHBondContact O-N 3.45Å; S1017-T1019 PolarHBondContact OG-N 3.03Å; S1017-T1019 PolarHBondContact OG-OG1 2.68Å; T1019-A1021 VanDerWaalsContact C-N 3.35Å; T1019-A1021 PolarHBondContact O-N 3.26Å; T1019-E1022 PolarHBondContact O-N 2.96Å; T1019-Q1023 PolarHBondContact O-N 3Å; T1019-Q1023 VanDerWaalsContact O-N 3.1Å
1020	F	79.8	Confident	80.1	Confident	29 Å²	29	64.4 Å²	64.4	13%	0.127	34%	0.337	C	S	.	.	H	α-helix	trans	-51.2	-47.9	-175.9	174.1	-103.5	0	0	0	113.2	I812 Y815 C1014 S1017 E1022 Q1023 F1024	I812-F1020 HydrophobicContact CD1-CD2 4.03Å; I812-F1020 HydrophobicContact CD1-CE2 4.21Å; I812-F1020 HydrophobicContact CG1-CD2 4.49Å; I812-F1020 HydrophobicContact CG1-CE2 4.23Å; Y815-F1020 HydrophobicContact CD1-CE2 4.18Å; Y815-F1020 AromaticContact CD1-CZ 3.95Å; Y815-F1020 HydrophobicContact CD1-CZ 3.95Å; Y815-F1020 HydrophobicContact CE1-CE2 4.25Å; Y815-F1020 AromaticContact CE1-CZ 3.57Å; Y815-F1020 HydrophobicContact CE1-CZ 3.57Å; Y815-F1020 AromaticContact CZ-CZ 4Å; C1014-F1020 HydrophobicContact CB-CD2 4.02Å; C1014-F1020 HydrophobicContact CB-CE2 4.09Å; C1014-F1020 WeakPolarHBondContact O-CD2 3.41Å; C1014-F1020 WeakPolarHBondContact O-CG 3.43Å; S1017-F1020 WeakPolarHBondContact O-CB 3.42Å; S1017-F1020 PolarHBondContact O-N 2.92Å; F1020-E1022 VanDerWaalsContact C-N 3.34Å; F1020-E1022 PolarHBondContact O-N 3.17Å; F1020-Q1023 PolarHBondContact O-N 3.49Å; F1020-F1024 HydrophobicContact CE2-CB 4.47Å; F1020-F1024 HydrophobicContact CE2-CD2 4.23Å; F1020-F1024 HydrophobicContact CZ-CB 4.38Å; F1020-F1024 HydrophobicContact CZ-CD2 4.05Å; F1020-F1024 HydrophobicContact CZ-CG 4.28Å; F1020-F1024 WeakPolarHBondContact O-CB 3.39Å; F1020-F1024 PolarHBondContact O-N 2.87Å
1021	A	77.1	Confident	80.7	Confident	54 Å²	54	60 Å²	60	45%	0.446	31%	0.314	S	S	.	.	H	α-helix	trans	-64.3	-35.7	-175.5	0	0	0	0	0	113.4	T1019 A1025	T1019-A1021 VanDerWaalsContact C-N 3.35Å; T1019-A1021 PolarHBondContact O-N 3.26Å; A1021-A1025 WeakPolarHBondContact O-CB 3.41Å; A1021-A1025 PolarHBondContact O-N 3.23Å
1022	E	80.8	Confident	80.9	Confident	112 Å²	112	56.8 Å²	56.8	52%	0.523	30%	0.301	S	S	.	.	H	α-helix	trans	-74.7	-47.9	177.7	-172.3	-178.3	171.1	0	0	111.1	T1019 F1020 F1024 A1025 R1026	T1019-E1022 PolarHBondContact O-N 2.96Å; F1020-E1022 VanDerWaalsContact C-N 3.34Å; F1020-E1022 PolarHBondContact O-N 3.17Å; E1022-F1024 VanDerWaalsContact C-N 3.33Å; E1022-F1024 PolarHBondContact O-N 3.1Å; E1022-A1025 PolarHBondContact O-N 3.05Å; E1022-R1026 WeakPolarHBondContact O-CG 3.37Å; E1022-R1026 PolarHBondContact O-N 3.38Å; E1022-R1026 VanDerWaalsContact O-N 3.08Å; E1022-R1026 IonicContact OE1-CZ 2.84Å; E1022-R1026 IonicContact OE1-NE 3.71Å; E1022-R1026 IonicContact OE1-NH2 3.36Å; E1022-R1026 PolarHBondContact OE1-NH2 3.19Å
1023	Q	78.9	Confident	81.2	Confident	6 Å²	6	55.7 Å²	55.7	3%	0.028	30%	0.297	C	S	.	.	H	α-helix	trans	-66.4	-36.2	179.7	-63.5	-64.5	-3	0	0	111.6	E804 L809 I812 T1019 F1020 R1026 I1027	E804-Q1023 PolarHBondContact OE1-NE2 2.98Å; E804-Q1023 PolarHBondContact OE2-NE2 3.14Å; L809-Q1023 HydrophobicContact CD1-CG 4.1Å; I812-Q1023 HydrophobicContact CD1-CB 4.1Å; T1019-Q1023 PolarHBondContact O-N 3Å; T1019-Q1023 VanDerWaalsContact O-N 3.1Å; F1020-Q1023 PolarHBondContact O-N 3.49Å; Q1023-R1026 PolarHBondContact O-N 3.27Å; Q1023-I1027 WeakPolarHBondContact O-CB 3.47Å; Q1023-I1027 VanDerWaalsContact O-CG1 3.28Å; Q1023-I1027 WeakPolarHBondContact O-CG1 3.35Å; Q1023-I1027 PolarHBondContact O-N 2.83Å
1024	F	81.4	Confident	81.7	Confident	4 Å²	4	54 Å²	54	2%	0.018	29%	0.286	C	S	.	.	H	α-helix	trans	-65.5	-37.3	174	-170.3	-93.5	0	0	0	112.4	I812 Y815 Y816 F898 L901 F1020 E1022 I1027 K1028	I812-F1024 HydrophobicContact CD1-CB 4.35Å; I812-F1024 HydrophobicContact CG1-CD2 4.33Å; Y815-F1024 HydrophobicContact CD1-CD2 4.17Å; Y815-F1024 AromaticContact CD1-CE2 3.7Å; Y815-F1024 HydrophobicContact CD1-CE2 3.7Å; Y815-F1024 HydrophobicContact CE1-CD2 4.39Å; Y815-F1024 AromaticContact CE1-CE2 3.9Å; Y815-F1024 HydrophobicContact CE1-CE2 3.9Å; Y815-F1024 HydrophobicContact CE1-CZ 4.41Å; Y816-F1024 AromaticContact CD2-CE2 3.95Å; Y816-F1024 HydrophobicContact CD2-CE2 3.95Å; Y816-F1024 AromaticContact CD2-CZ 3.83Å; Y816-F1024 HydrophobicContact CD2-CZ 3.83Å; Y816-F1024 HydrophobicContact CG-CE2 4.46Å; F898-F1024 AromaticContact CD1-CD1 3.9Å; F898-F1024 HydrophobicContact CD1-CD1 3.9Å; F898-F1024 HydrophobicContact CD1-CE1 4.08Å; F898-F1024 AromaticContact CE1-CD1 3.69Å; F898-F1024 HydrophobicContact CE1-CD1 3.69Å; F898-F1024 AromaticContact CE1-CE1 3.55Å; F898-F1024 HydrophobicContact CE1-CE1 3.55Å; F898-F1024 HydrophobicContact CZ-CD1 4.18Å; F898-F1024 HydrophobicContact CZ-CE1 4.18Å; L901-F1024 HydrophobicContact CD1-CE1 3.69Å; L901-F1024 HydrophobicContact CD1-CZ 3.74Å; F1020-F1024 HydrophobicContact CE2-CB 4.47Å; F1020-F1024 HydrophobicContact CE2-CD2 4.23Å; F1020-F1024 HydrophobicContact CZ-CB 4.38Å; F1020-F1024 HydrophobicContact CZ-CD2 4.05Å; F1020-F1024 HydrophobicContact CZ-CG 4.28Å; F1020-F1024 WeakPolarHBondContact O-CB 3.39Å; F1020-F1024 PolarHBondContact O-N 2.87Å; E1022-F1024 VanDerWaalsContact C-N 3.33Å; E1022-F1024 PolarHBondContact O-N 3.1Å; F1024-I1027 PolarHBondContact O-N 3.11Å; F1024-K1028 WeakPolarHBondContact O-CB 3.44Å; F1024-K1028 PolarHBondContact O-N 3.45Å
1025	A	81.2	Confident	82.3	Confident	30 Å²	30	57.9 Å²	57.9	25%	0.248	30%	0.304	C	S	.	.	H	α-helix	trans	-64.1	-44.9	174.2	0	0	0	0	0	111.7	F898 A1021 E1022 I1027 K1028 E1029	F898-A1025 HydrophobicContact CD2-CB 4.42Å; F898-A1025 HydrophobicContact CE2-CB 4.3Å; A1021-A1025 WeakPolarHBondContact O-CB 3.41Å; A1021-A1025 PolarHBondContact O-N 3.23Å; E1022-A1025 PolarHBondContact O-N 3.05Å; A1025-I1027 PolarHBondContact O-N 2.91Å; A1025-K1028 PolarHBondContact O-N 2.98Å; A1025-E1029 PolarHBondContact O-N 3.12Å
1026	R	82.1	Confident	82.9	Confident	77 Å²	77	58.7 Å²	58.7	29%	0.291	31%	0.305	S	S	.	.	H	α-helix	trans	-60.9	-41.7	174.2	-65.8	176.1	-174.5	-174.6	3.2	112.1	E804 E1022 Q1023 E1029 R1030	E804-R1026 IonicContact OE1-NH1 2.72Å; E1022-R1026 WeakPolarHBondContact O-CG 3.37Å; E1022-R1026 PolarHBondContact O-N 3.38Å; E1022-R1026 VanDerWaalsContact O-N 3.08Å; E1022-R1026 IonicContact OE1-CZ 2.84Å; E1022-R1026 IonicContact OE1-NE 3.71Å; E1022-R1026 IonicContact OE1-NH2 3.36Å; E1022-R1026 PolarHBondContact OE1-NH2 3.19Å; Q1023-R1026 PolarHBondContact O-N 3.27Å; R1026-E1029 PolarHBondContact O-N 3.45Å; R1026-R1030 WeakPolarHBondContact O-CB 3.37Å; R1026-R1030 PolarHBondContact O-N 3.48Å
1027	I	84.5	Confident	83.5	Confident	3 Å²	3	52.4 Å²	52.4	2%	0.015	28%	0.276	C	S	.	.	H	α-helix	trans	-62.9	-46.3	175.1	-73.4	166.3	0	0	0	110.7	L803 I812 L813 Y816 Q1023 F1024 A1025 E1029 R1030 M1031	L803-I1027 HydrophobicContact CD1-CD1 4.47Å; L803-I1027 HydrophobicContact CD1-CG1 3.88Å; L803-I1027 HydrophobicContact CD2-CG1 3.57Å; L803-I1027 HydrophobicContact CG-CG1 4.33Å; I812-I1027 HydrophobicContact CB-CD1 4.08Å; I812-I1027 HydrophobicContact CD1-CD1 3.6Å; I812-I1027 HydrophobicContact CG1-CD1 3.57Å; I812-I1027 HydrophobicContact CG2-CD1 3.39Å; L813-I1027 HydrophobicContact CD2-CG2 3.93Å; Y816-I1027 HydrophobicContact CD2-CG2 4.14Å; Y816-I1027 HydrophobicContact CG-CG2 4.1Å; Q1023-I1027 WeakPolarHBondContact O-CB 3.47Å; Q1023-I1027 VanDerWaalsContact O-CG1 3.28Å; Q1023-I1027 WeakPolarHBondContact O-CG1 3.35Å; Q1023-I1027 PolarHBondContact O-N 2.83Å; F1024-I1027 PolarHBondContact O-N 3.11Å; A1025-I1027 PolarHBondContact O-N 2.91Å; I1027-E1029 VanDerWaalsContact C-N 3.32Å; I1027-E1029 PolarHBondContact O-N 3.44Å; I1027-R1030 PolarHBondContact O-N 3.01Å; I1027-M1031 HydrophobicContact CG2-CG 3.85Å; I1027-M1031 VanDerWaalsContact O-CB 3.25Å; I1027-M1031 WeakPolarHBondContact O-CB 3.27Å; I1027-M1031 WeakPolarHBondContact O-CG 3.32Å; I1027-M1031 PolarHBondContact O-N 3.4Å
1028	K	84.2	Confident	84.1	Confident	95 Å²	95	55.5 Å²	55.5	41%	0.413	29%	0.291	S	S	.	.	H	α-helix	trans	-61.6	-39	178.2	-177.2	176.1	-175.4	172.6	0	112.6	Y816 F898 F1024 A1025 S1032	Y816-K1028 HydrophobicContact CE2-CB 4.09Å; Y816-K1028 HydrophobicContact CE2-CG 4.15Å; F898-K1028 HydrophobicContact CE1-CD 4.48Å; F898-K1028 HydrophobicContact CZ-CD 3.68Å; F1024-K1028 WeakPolarHBondContact O-CB 3.44Å; F1024-K1028 PolarHBondContact O-N 3.45Å; A1025-K1028 PolarHBondContact O-N 2.98Å; K1028-S1032 VanDerWaalsContact O-CB 3.27Å; K1028-S1032 WeakPolarHBondContact O-CB 3.32Å; K1028-S1032 PolarHBondContact O-N 3.27Å; K1028-S1032 PolarHBondContact O-OG 2.74Å; K1028-S1032 VanDerWaalsContact O-OG 3.05Å
1029	E	84.6	Confident	84.6	Confident	107 Å²	107	58 Å²	58	50%	0.5	28%	0.284	S	S	.	.	H	α-helix	trans	-62.9	-51.8	173.8	-176.2	172.8	-155.3	0	0	110.6	L800 A1025 R1026 I1027 M1031 S1032 V1033	L800-E1029 HydrophobicContact CD2-CG 4.31Å; A1025-E1029 PolarHBondContact O-N 3.12Å; R1026-E1029 PolarHBondContact O-N 3.45Å; I1027-E1029 VanDerWaalsContact C-N 3.32Å; I1027-E1029 PolarHBondContact O-N 3.44Å; E1029-M1031 PolarHBondContact O-N 2.83Å; E1029-S1032 PolarHBondContact O-N 3.31Å; E1029-S1032 PolarHBondContact O-OG 2.71Å; E1029-V1033 WeakPolarHBondContact O-CG2 3.28Å; E1029-V1033 PolarHBondContact O-N 3.15Å; E1029-V1033 VanDerWaalsContact O-N 3.09Å
1030	R	88.1	Confident	84.9	Confident	63 Å²	63	56 Å²	56	24%	0.238	27%	0.271	C	S	.	.	H	α-helix	trans	-58.5	-45.8	178.4	-170.6	-179.2	-176.4	98.8	9.1	112.8	L800 P801 R1026 I1027 V1033 Q1034	L800-R1030 HydrophobicContact CD1-CB 4.01Å; L800-R1030 HydrophobicContact CD1-CG 4.23Å; P801-R1030 PolarHBondContact O-NH1 3.02Å; R1026-R1030 WeakPolarHBondContact O-CB 3.37Å; R1026-R1030 PolarHBondContact O-N 3.48Å; I1027-R1030 PolarHBondContact O-N 3.01Å; R1030-V1033 PolarHBondContact O-N 3.23Å; R1030-Q1034 WeakPolarHBondContact O-CB 3.45Å; R1030-Q1034 PolarHBondContact O-N 3.46Å
1031	M	87.1	Confident	85.2	Confident	18 Å²	18	57.8 Å²	57.8	9%	0.089	28%	0.282	C	S	.	.	H	α-helix	trans	-69	-37.4	179.1	-69.7	-58.4	-61.3	0	0	111.7	L813 Y816 H817 I1027 E1029 V1033 Q1034 E1035	L813-M1031 HydrophobicContact CD2-SD 4.38Å; Y816-M1031 HydrophobicContact CD1-CB 4.28Å; Y816-M1031 HydrophobicContact CD1-CE 4.25Å; Y816-M1031 HydrophobicContact CD1-CG 3.91Å; Y816-M1031 HydrophobicContact CE1-CB 3.52Å; Y816-M1031 HydrophobicContact CE1-CE 3.92Å; Y816-M1031 HydrophobicContact CE1-CG 3.66Å; Y816-M1031 HydrophobicContact CE2-CB 4.18Å; Y816-M1031 HydrophobicContact CG-CG 4.46Å; Y816-M1031 VanDerWaalsContact CZ-CB 3.47Å; Y816-M1031 WeakPolarHBondContact OH-CB 3.28Å; H817-M1031 VanDerWaalsContact CE1-CE 3.5Å; H817-M1031 WeakPolarHBondContact CE1-CE 3.49Å; I1027-M1031 HydrophobicContact CG2-CG 3.85Å; I1027-M1031 VanDerWaalsContact O-CB 3.25Å; I1027-M1031 WeakPolarHBondContact O-CB 3.27Å; I1027-M1031 WeakPolarHBondContact O-CG 3.32Å; I1027-M1031 PolarHBondContact O-N 3.4Å; E1029-M1031 PolarHBondContact O-N 2.83Å; M1031-V1033 PolarHBondContact O-N 2.72Å; M1031-Q1034 CarbonylContact O-C 3.55Å; M1031-Q1034 PolarHBondContact O-N 3.46Å; M1031-E1035 VanDerWaalsContact O-CB 3.31Å; M1031-E1035 WeakPolarHBondContact O-CB 3.48Å; M1031-E1035 VanDerWaalsContact O-CG 3.22Å; M1031-E1035 WeakPolarHBondContact O-CG 3.5Å; M1031-E1035 PolarHBondContact O-N 3.44Å
1032	S	86.6	Confident	85.7	Confident	60 Å²	60	59.8 Å²	59.8	42%	0.42	28%	0.281	S	S	.	.	H	α-helix	trans	-67.5	-36.7	176.4	66.6	0	0	0	0	112.5	K1028 E1029 E1036	K1028-S1032 VanDerWaalsContact O-CB 3.27Å; K1028-S1032 WeakPolarHBondContact O-CB 3.32Å; K1028-S1032 PolarHBondContact O-N 3.27Å; K1028-S1032 PolarHBondContact O-OG 2.74Å; K1028-S1032 VanDerWaalsContact O-OG 3.05Å; E1029-S1032 PolarHBondContact O-N 3.31Å; E1029-S1032 PolarHBondContact O-OG 2.71Å; S1032-E1036 WeakPolarHBondContact O-CB 3.44Å; S1032-E1036 PolarHBondContact O-N 2.75Å
1033	V	89	Confident	85.7	Confident	11 Å²	11	57.1 Å²	57.1	7%	0.067	27%	0.27	C	S	.	.	H	α-helix	trans	-65.2	-40.6	170.4	172.3	0	0	0	0	111.4	L793 M796 L797 E1029 R1030 M1031 L1037	L793-V1033 HydrophobicContact CB-CG1 4.42Å; L793-V1033 HydrophobicContact CD2-CG1 4.01Å; M796-V1033 HydrophobicContact CB-CG1 4.38Å; M796-V1033 HydrophobicContact CE-CG2 4.29Å; L797-V1033 HydrophobicContact CB-CG1 4Å; L797-V1033 HydrophobicContact CD1-CG1 4.39Å; E1029-V1033 WeakPolarHBondContact O-CG2 3.28Å; E1029-V1033 PolarHBondContact O-N 3.15Å; E1029-V1033 VanDerWaalsContact O-N 3.09Å; R1030-V1033 PolarHBondContact O-N 3.23Å; M1031-V1033 PolarHBondContact O-N 2.72Å; V1033-L1037 VanDerWaalsContact O-CB 3.24Å; V1033-L1037 WeakPolarHBondContact O-CB 3.17Å; V1033-L1037 PolarHBondContact O-N 3.22Å
1034	Q	89.1	Confident	85.8	Confident	70 Å²	70	58.9 Å²	58.9	33%	0.327	28%	0.281	S	S	.	.	H	α-helix	trans	-69.4	-42.8	177.8	-173.9	173	-25.6	0	0	112.3	L797 R1030 M1031 L1037 D1038	L797-Q1034 HydrophobicContact CD1-CB 3.96Å; L797-Q1034 HydrophobicContact CD1-CG 4.4Å; R1030-Q1034 WeakPolarHBondContact O-CB 3.45Å; R1030-Q1034 PolarHBondContact O-N 3.46Å; M1031-Q1034 CarbonylContact O-C 3.55Å; M1031-Q1034 PolarHBondContact O-N 3.46Å; Q1034-L1037 CarbonylContact O-C 3.43Å; Q1034-L1037 WeakPolarHBondContact O-CB 3.11Å; Q1034-L1037 PolarHBondContact O-N 3.19Å; Q1034-D1038 WeakPolarHBondContact O-CB 3.37Å; Q1034-D1038 VanDerWaalsContact O-CG 3.3Å; Q1034-D1038 PolarHBondContact O-N 3.43Å
1035	E	87.9	Confident	85.7	Confident	82 Å²	82	60.6 Å²	60.6	38%	0.383	29%	0.293	S	S	.	.	H	α-helix	trans	-64.5	-39.1	175.4	-72.6	166.7	-149.7	0	0	111.5	Y816 M1031 R1039	Y816-E1035 WeakPolarHBondContact CE1-OE1 3.38Å; Y816-E1035 PolarHBondContact OH-OE1 3.16Å; M1031-E1035 VanDerWaalsContact O-CB 3.31Å; M1031-E1035 WeakPolarHBondContact O-CB 3.48Å; M1031-E1035 VanDerWaalsContact O-CG 3.22Å; M1031-E1035 WeakPolarHBondContact O-CG 3.5Å; M1031-E1035 PolarHBondContact O-N 3.44Å; E1035-R1039 WeakPolarHBondContact O-CB 3.49Å; E1035-R1039 PolarHBondContact O-N 3.22Å
1036	E	89.2	Confident	85.6	Confident	68 Å²	68	61.3 Å²	61.3	32%	0.318	29%	0.293	S	S	.	.	H	α-helix	trans	-64.4	-42.5	171.7	-164.2	-169.7	151.8	0	0	111	R789 L793 S1032 L1040	R789-E1036 IonicContact CZ-OE1 3.43Å; R789-E1036 VanDerWaalsContact CZ-OE1 3.26Å; R789-E1036 IonicContact CZ-OE2 3.84Å; R789-E1036 IonicContact NE-OE1 3.64Å; R789-E1036 PolarHBondContact NE-OE1 3.3Å; R789-E1036 VanDerWaalsContact NH2-CD 3.28Å; R789-E1036 IonicContact NH2-OE1 2.69Å; R789-E1036 PolarHBondContact NH2-OE1 2.79Å; R789-E1036 IonicContact NH2-OE2 3.84Å; R789-E1036 PolarHBondContact NH2-OE2 3.34Å; L793-E1036 HydrophobicContact CD1-CB 4.12Å; L793-E1036 HydrophobicContact CD1-CG 3.88Å; S1032-E1036 WeakPolarHBondContact O-CB 3.44Å; S1032-E1036 PolarHBondContact O-N 2.75Å; E1036-L1040 HydrophobicContact CG-CD1 4.09Å; E1036-L1040 WeakPolarHBondContact O-CB 3.32Å; E1036-L1040 WeakPolarHBondContact O-CG 3.33Å; E1036-L1040 PolarHBondContact O-N 2.94Å
1037	L	90.4	Very high	85.5	Confident	14 Å²	14	64.4 Å²	64.4	7%	0.073	31%	0.311	C	S	.	.	H	α-helix	trans	-63.5	-49.7	177.6	176	62.9	0	0	0	111.9	I790 L793 K794 L797 V1033 Q1034 L1040 L1041	I790-L1037 HydrophobicContact CB-CD1 4.22Å; I790-L1037 HydrophobicContact CG1-CD1 4.19Å; I790-L1037 HydrophobicContact CG2-CD1 3.83Å; L793-L1037 HydrophobicContact CB-CB 4.39Å; L793-L1037 HydrophobicContact CB-CD1 4.32Å; L793-L1037 HydrophobicContact CD1-CB 4.41Å; K794-L1037 HydrophobicContact CG-CD1 3.95Å; K794-L1037 HydrophobicContact CG-CD2 4Å; L797-L1037 HydrophobicContact CD1-CD2 4.48Å; V1033-L1037 VanDerWaalsContact O-CB 3.24Å; V1033-L1037 WeakPolarHBondContact O-CB 3.17Å; V1033-L1037 PolarHBondContact O-N 3.22Å; Q1034-L1037 CarbonylContact O-C 3.43Å; Q1034-L1037 WeakPolarHBondContact O-CB 3.11Å; Q1034-L1037 PolarHBondContact O-N 3.19Å; L1037-L1040 PolarHBondContact O-N 3.48Å; L1037-L1041 HydrophobicContact CD1-CD1 4.08Å; L1037-L1041 HydrophobicContact CD1-CG 4.21Å; L1037-L1041 HydrophobicContact CG-CD1 3.94Å; L1037-L1041 HydrophobicContact CG-CG 4.48Å; L1037-L1041 WeakPolarHBondContact O-CB 3.31Å; L1037-L1041 VanDerWaalsContact O-CG 3.27Å; L1037-L1041 WeakPolarHBondContact O-CG 3.32Å; L1037-L1041 PolarHBondContact O-N 3.33Å
1038	D	88.6	Confident	85.3	Confident	80 Å²	80	65.2 Å²	65.2	43%	0.428	32%	0.317	S	S	.	.	H	α-helix	trans	-65.6	-39.4	-179.8	-70.9	-21.5	0	0	0	111	Q1034 L1041 F1042	Q1034-D1038 WeakPolarHBondContact O-CB 3.37Å; Q1034-D1038 VanDerWaalsContact O-CG 3.3Å; Q1034-D1038 PolarHBondContact O-N 3.43Å; D1038-L1041 PolarHBondContact O-N 2.96Å; D1038-F1042 WeakPolarHBondContact O-CB 3.16Å; D1038-F1042 PolarHBondContact O-N 3.37Å
1039	R	87.4	Confident	85.3	Confident	176 Å²	176	61.1 Å²	61.1	66%	0.664	30%	0.3	S	S	*	.	H	α-helix	trans	-61.4	-43	171.3	-179.6	-178.3	176.4	-166.4	-0.8	112	E1035 F1042 L1043	E1035-R1039 WeakPolarHBondContact O-CB 3.49Å; E1035-R1039 PolarHBondContact O-N 3.22Å; R1039-F1042 PolarHBondContact O-N 3.01Å; R1039-L1043 HydrophobicContact CG-CD1 4.18Å; R1039-L1043 WeakPolarHBondContact O-CB 3.33Å; R1039-L1043 VanDerWaalsContact O-CG 3.25Å; R1039-L1043 WeakPolarHBondContact O-CG 3.48Å; R1039-L1043 PolarHBondContact O-N 3.3Å
1040	L	85.8	Confident	85.3	Confident	16 Å²	16	63.5 Å²	63.5	8%	0.084	31%	0.313	C	S	.	.	H	α-helix	trans	-70.9	-37.9	178.3	-74.1	168.9	0	0	0	112.1	H786 R789 I790 L793 E1036 L1037 L1043 V1044	H786-L1040 HydrophobicContact CB-CD2 4.2Å; H786-L1040 VanDerWaalsContact ND1-CD2 3.29Å; H786-L1040 WeakPolarHBondContact ND1-CD2 3.4Å; R789-L1040 HydrophobicContact CB-CD1 4.11Å; R789-L1040 HydrophobicContact CG-CD1 3.5Å; I790-L1040 HydrophobicContact CD1-CB 4Å; I790-L1040 HydrophobicContact CG1-CB 3.69Å; I790-L1040 HydrophobicContact CG1-CD1 4.48Å; L793-L1040 HydrophobicContact CD1-CD1 3.52Å; E1036-L1040 HydrophobicContact CG-CD1 4.09Å; E1036-L1040 WeakPolarHBondContact O-CB 3.32Å; E1036-L1040 WeakPolarHBondContact O-CG 3.33Å; E1036-L1040 PolarHBondContact O-N 2.94Å; L1037-L1040 PolarHBondContact O-N 3.48Å; L1040-L1043 CarbonylContact O-C 3Å; L1040-L1043 PolarHBondContact O-N 3.28Å; L1040-V1044 WeakPolarHBondContact O-CG2 3.14Å; L1040-V1044 PolarHBondContact O-N 3.24Å
1041	L	86.4	Confident	85.2	Confident	68 Å²	68	62 Å²	62	36%	0.356	31%	0.309	S	S	.	.	H	α-helix	trans	-61.6	-44.1	172.2	-73	168.6	0	0	0	110.7	I790 L1037 D1038 L1043 V1044 S1045	I790-L1041 HydrophobicContact CD1-CD2 4.15Å; I790-L1041 HydrophobicContact CD1-CG 4.48Å; I790-L1041 HydrophobicContact CG2-CD2 4.14Å; L1037-L1041 HydrophobicContact CD1-CD1 4.08Å; L1037-L1041 HydrophobicContact CD1-CG 4.21Å; L1037-L1041 HydrophobicContact CG-CD1 3.94Å; L1037-L1041 HydrophobicContact CG-CG 4.48Å; L1037-L1041 WeakPolarHBondContact O-CB 3.31Å; L1037-L1041 VanDerWaalsContact O-CG 3.27Å; L1037-L1041 WeakPolarHBondContact O-CG 3.32Å; L1037-L1041 PolarHBondContact O-N 3.33Å; D1038-L1041 PolarHBondContact O-N 2.96Å; L1041-L1043 PolarHBondContact O-N 3.28Å; L1041-V1044 PolarHBondContact O-N 3.38Å; L1041-V1044 VanDerWaalsContact O-N 3.16Å; L1041-S1045 WeakPolarHBondContact O-CB 3.46Å; L1041-S1045 PolarHBondContact O-N 3.18Å
1042	F	86.3	Confident	85.3	Confident	95 Å²	95	62 Å²	62	42%	0.417	31%	0.31	S	S	.	.	H	α-helix	trans	-59.5	-44.9	172.7	177	-101.4	0	0	0	112	D1038 R1039 V1044 S1045 Q1047 S1048	D1038-F1042 WeakPolarHBondContact O-CB 3.16Å; D1038-F1042 PolarHBondContact O-N 3.37Å; R1039-F1042 PolarHBondContact O-N 3.01Å; F1042-V1044 PolarHBondContact O-N 3.41Å; F1042-S1045 PolarHBondContact O-N 3.32Å; F1042-S1045 VanDerWaalsContact O-N 3.16Å; F1042-S1045 PolarHBondContact O-OG 3.46Å; F1042-Q1047 HydrophobicContact CD2-CB 4.23Å; F1042-Q1047 HydrophobicContact CE2-CB 3.68Å; F1042-S1048 WeakPolarHBondContact O-CB 3.14Å; F1042-S1048 PolarHBondContact O-OG 2.99Å
1043	L	81.1	Confident	85.5	Confident	56 Å²	56	63 Å²	63	29%	0.293	32%	0.315	S	S	.	.	H	α-helix	trans	-68.9	-11.3	176.4	-72.4	172.3	0	0	0	114.7	R781 R1039 L1040 L1041	R781-L1043 PolarHBondContact NH2-O 2.86Å; R1039-L1043 HydrophobicContact CG-CD1 4.18Å; R1039-L1043 WeakPolarHBondContact O-CB 3.33Å; R1039-L1043 VanDerWaalsContact O-CG 3.25Å; R1039-L1043 WeakPolarHBondContact O-CG 3.48Å; R1039-L1043 PolarHBondContact O-N 3.3Å; L1040-L1043 CarbonylContact O-C 3Å; L1040-L1043 PolarHBondContact O-N 3.28Å; L1041-L1043 PolarHBondContact O-N 3.28Å
1044	V	80	Confident	85.6	Confident	43 Å²	43	65 Å²	65	26%	0.261	32%	0.323	S	S	.	.	H	α-helix	trans	-99.7	-25.9	169.8	171.6	0	0	0	0	111.5	T783 H786 I790 L1040 L1041 F1042	T783-V1044 HydrophobicContact CG2-CB 4.48Å; T783-V1044 HydrophobicContact CG2-CG1 4.01Å; T783-V1044 HydrophobicContact CG2-CG2 4.08Å; H786-V1044 HydrophobicContact CB-CG2 3.7Å; I790-V1044 HydrophobicContact CD1-CB 4.49Å; I790-V1044 HydrophobicContact CD1-CG2 3.86Å; L1040-V1044 WeakPolarHBondContact O-CG2 3.14Å; L1040-V1044 PolarHBondContact O-N 3.24Å; L1041-V1044 PolarHBondContact O-N 3.38Å; L1041-V1044 VanDerWaalsContact O-N 3.16Å; F1042-V1044 PolarHBondContact O-N 3.41Å
1045	S	81.1	Confident	85.8	Confident	40 Å²	40	63.2 Å²	63.2	28%	0.28	31%	0.314	S	S	.	.	S	Bend	trans	-69.1	156.3	177.9	81	0	0	0	0	113.5	L1041 F1042 Q1047 S1048	L1041-S1045 WeakPolarHBondContact O-CB 3.46Å; L1041-S1045 PolarHBondContact O-N 3.18Å; F1042-S1045 PolarHBondContact O-N 3.32Å; F1042-S1045 VanDerWaalsContact O-N 3.16Å; F1042-S1045 PolarHBondContact O-OG 3.46Å; S1045-Q1047 PolarHBondContact O-N 3.12Å; S1045-Q1047 VanDerWaalsContact O-N 3.16Å; S1045-Q1047 PolarHBondContact OG-N 2.91Å; S1045-S1048 PolarHBondContact O-N 3.41Å; S1045-S1048 PolarHBondContact O-OG 3.42Å
1046	D	78	Confident	86	Confident	45 Å²	45	63.9 Å²	63.9	24%	0.241	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-63.1	-21.6	177.8	-63.8	-47.7	0	0	0	113.6	R773 S1048 L1049 L1052	R773-D1046 IonicContact CZ-OD1 2.74Å; R773-D1046 VanDerWaalsContact CZ-OD1 3.28Å; R773-D1046 IonicContact CZ-OD2 3.13Å; R773-D1046 IonicContact NE-OD1 2.91Å; R773-D1046 PolarHBondContact NE-OD1 2.89Å; R773-D1046 IonicContact NH2-OD1 3.68Å; R773-D1046 PolarHBondContact NH2-OD1 3.45Å; R773-D1046 IonicContact NH2-OD2 2.88Å; R773-D1046 PolarHBondContact NH2-OD2 3.11Å; D1046-S1048 PolarHBondContact O-N 3.48Å; D1046-S1048 VanDerWaalsContact O-N 3.1Å; D1046-L1049 HydrophobicContact CB-CD1 3.96Å; D1046-L1049 WeakPolarHBondContact O-CB 3.3Å; D1046-L1049 WeakPolarHBondContact O-CD1 3.44Å; D1046-L1049 VanDerWaalsContact O-CG 3.27Å; D1046-L1049 WeakPolarHBondContact O-CG 3.21Å; D1046-L1049 PolarHBondContact O-N 3.14Å; D1046-L1049 VanDerWaalsContact O-N 3.1Å; D1046-L1052 WeakPolarHBondContact O-CD2 3.23Å
1047	Q	79.6	Confident	86.2	Confident	142 Å²	142	63.3 Å²	63.3	66%	0.664	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-63	-18.9	-178.4	-64.4	-173.3	-5	0	0	113.7	F1042 S1045	F1042-Q1047 HydrophobicContact CD2-CB 4.23Å; F1042-Q1047 HydrophobicContact CE2-CB 3.68Å; S1045-Q1047 PolarHBondContact O-N 3.12Å; S1045-Q1047 VanDerWaalsContact O-N 3.16Å; S1045-Q1047 PolarHBondContact OG-N 2.91Å
1048	S	82	Confident	86.4	Confident	21 Å²	21	64.4 Å²	64.4	15%	0.147	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-101.6	9.7	179.4	59	0	0	0	0	113.7	R781 F1042 S1045 D1046	R781-S1048 PolarHBondContact NH1-O 2.84Å; R781-S1048 PolarHBondContact NH2-OG 2.98Å; F1042-S1048 WeakPolarHBondContact O-CB 3.14Å; F1042-S1048 PolarHBondContact O-OG 2.99Å; S1045-S1048 PolarHBondContact O-N 3.41Å; S1045-S1048 PolarHBondContact O-OG 3.42Å; D1046-S1048 PolarHBondContact O-N 3.48Å; D1046-S1048 VanDerWaalsContact O-N 3.1Å
1049	L	83.4	Confident	86.7	Confident	9 Å²	9	61.8 Å²	61.8	5%	0.047	30%	0.303	C	S	.	.			trans	-65	131.9	169	-67.6	168.5	0	0	0	110.1	M772 R773 E778 D1046 L1051 L1052	M772-L1049 HydrophobicContact CB-CD1 4.07Å; M772-L1049 HydrophobicContact CE-CD1 4.42Å; R773-L1049 HydrophobicContact CB-CD2 4.37Å; E778-L1049 HydrophobicContact CG-CD2 3.99Å; D1046-L1049 HydrophobicContact CB-CD1 3.96Å; D1046-L1049 WeakPolarHBondContact O-CB 3.3Å; D1046-L1049 WeakPolarHBondContact O-CD1 3.44Å; D1046-L1049 VanDerWaalsContact O-CG 3.27Å; D1046-L1049 WeakPolarHBondContact O-CG 3.21Å; D1046-L1049 PolarHBondContact O-N 3.14Å; D1046-L1049 VanDerWaalsContact O-N 3.1Å; L1049-L1051 PolarHBondContact O-N 3.23Å; L1049-L1052 HydrophobicContact CB-CB 4.17Å; L1049-L1052 PolarHBondContact O-N 3.42Å
1050	M	83.6	Confident	87.1	Confident	156 Å²	156	58.9 Å²	58.9	77%	0.768	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-32.3	-171.9	-66.8	-165.7	175.1	0	0	113.2	E778	E778-M1050 WeakPolarHBondContact OE1-CB 3.49Å; E778-M1050 PolarHBondContact OE1-N 2.79Å
1051	L	87.6	Confident	87.5	Confident	32 Å²	32	58.1 Å²	58.1	17%	0.168	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-3.8	-176.8	-61.5	176.5	0	0	0	114	F750 L752 M772 L1049 E1054 Y1055	F750-L1051 HydrophobicContact CD1-CD1 3.54Å; F750-L1051 HydrophobicContact CE1-CD1 3.93Å; L752-L1051 HydrophobicContact CD1-CB 4.19Å; L752-L1051 HydrophobicContact CD2-CD1 4.46Å; L752-L1051 HydrophobicContact CG-CB 4.36Å; L752-L1051 HydrophobicContact CG-CD1 4.49Å; M772-L1051 HydrophobicContact SD-CB 3.96Å; L1049-L1051 PolarHBondContact O-N 3.23Å; L1051-E1054 PolarHBondContact O-N 2.7Å; L1051-Y1055 PolarHBondContact O-N 2.96Å
1052	L	89.4	Confident	88	Confident	19 Å²	19	54.9 Å²	54.9	10%	0.099	27%	0.274	C	S	.	.	H	α-helix	trans	-62.2	-38.3	-179.6	-170.6	73.5	0	0	0	113.7	T769 M772 D1046 L1049 E1054 Y1055 H1056	T769-L1052 HydrophobicContact CG2-CD1 4.29Å; M772-L1052 HydrophobicContact CE-CD1 3.89Å; D1046-L1052 WeakPolarHBondContact O-CD2 3.23Å; L1049-L1052 HydrophobicContact CB-CB 4.17Å; L1049-L1052 PolarHBondContact O-N 3.42Å; L1052-E1054 VanDerWaalsContact C-N 3.34Å; L1052-E1054 PolarHBondContact O-N 3.33Å; L1052-Y1055 HydrophobicContact CD1-CD1 3.94Å; L1052-Y1055 WeakPolarHBondContact O-CB 3.38Å; L1052-Y1055 PolarHBondContact O-N 3.09Å; L1052-H1056 PolarHBondContact O-N 3.3Å
1053	P	90.8	Very high	88.4	Confident	81 Å²	81	54 Å²	54	53%	0.526	27%	0.271	S	S	.	.	H	α-helix	trans	-60	-43.3	173.5	-24.4	35.5	0	0	0	112.3	H1056 Q1057	P1053-H1056 PolarHBondContact O-N 3.39Å; P1053-Q1057 VanDerWaalsContact O-CG 3.32Å; P1053-Q1057 WeakPolarHBondContact O-CG 3.22Å; P1053-Q1057 PolarHBondContact O-N 2.89Å; P1053-Q1057 VanDerWaalsContact O-N 3.07Å
1054	E	90.8	Very high	89	Confident	53 Å²	53	54.7 Å²	54.7	25%	0.248	28%	0.281	C	S	.	.	H	α-helix	trans	-66.1	-38.6	177.1	-166.1	-169.1	151.1	0	0	111.5	L752 L1051 L1052 H1056 Q1057 R1058	L752-E1054 HydrophobicContact CD1-CB 4.39Å; L1051-E1054 PolarHBondContact O-N 2.7Å; L1052-E1054 VanDerWaalsContact C-N 3.34Å; L1052-E1054 PolarHBondContact O-N 3.33Å; E1054-H1056 PolarHBondContact O-N 3.2Å; E1054-Q1057 PolarHBondContact O-N 3.4Å; E1054-R1058 WeakPolarHBondContact O-CG 3.39Å; E1054-R1058 PolarHBondContact O-N 3.02Å; E1054-R1058 IonicContact OE1-CZ 3.63Å; E1054-R1058 IonicContact OE1-NE 2.82Å; E1054-R1058 PolarHBondContact OE1-NE 3.49Å; E1054-R1058 IonicContact OE1-NH2 3.66Å; E1054-R1058 PolarHBondContact OE1-NH2 3.26Å
1055	Y	92.1	Very high	89.7	Confident	32 Å²	32	53.1 Å²	53.1	13%	0.125	27%	0.271	C	S	.	.	H	α-helix	trans	-55.8	-50.6	172.7	174.6	-111.5	0	0	0	111.2	L752 I757 V768 M772 L1051 L1052 Q1057 R1058 I1059	L752-Y1055 HydrophobicContact CD1-CD2 4.44Å; I757-Y1055 HydrophobicContact CD1-CD2 4.03Å; I757-Y1055 HydrophobicContact CD1-CE2 4.35Å; I757-Y1055 HydrophobicContact CG1-CD2 4.2Å; I757-Y1055 HydrophobicContact CG1-CE2 4.19Å; I757-Y1055 HydrophobicContact CG2-CE2 4.09Å; V768-Y1055 HydrophobicContact CB-CD2 4.36Å; V768-Y1055 HydrophobicContact CB-CE2 3.75Å; V768-Y1055 HydrophobicContact CG1-CD2 3.92Å; V768-Y1055 HydrophobicContact CG1-CE2 3.76Å; V768-Y1055 HydrophobicContact CG2-CE2 3.79Å; M772-Y1055 HydrophobicContact CE-CD1 4.47Å; M772-Y1055 HydrophobicContact CE-CG 4.25Å; L1051-Y1055 PolarHBondContact O-N 2.96Å; L1052-Y1055 HydrophobicContact CD1-CD1 3.94Å; L1052-Y1055 WeakPolarHBondContact O-CB 3.38Å; L1052-Y1055 PolarHBondContact O-N 3.09Å; Y1055-Q1057 VanDerWaalsContact C-N 3.33Å; Y1055-Q1057 PolarHBondContact O-N 3.22Å; Y1055-R1058 PolarHBondContact O-N 2.93Å; Y1055-I1059 HydrophobicContact CD1-CG1 4.39Å; Y1055-I1059 HydrophobicContact CD2-CG1 4.15Å; Y1055-I1059 HydrophobicContact CE1-CG1 4.02Å; Y1055-I1059 HydrophobicContact CE2-CD1 3.83Å; Y1055-I1059 HydrophobicContact CE2-CG1 3.73Å; Y1055-I1059 HydrophobicContact CG-CG1 4.46Å; Y1055-I1059 VanDerWaalsContact O-CG1 3.32Å; Y1055-I1059 WeakPolarHBondContact O-CG1 3.48Å; Y1055-I1059 PolarHBondContact O-N 3.07Å
1056	H	92.8	Very high	90.4	Very high	95 Å²	95	57.9 Å²	57.9	44%	0.44	29%	0.289	S	S	.	.	H	α-helix	trans	-63.2	-36.1	178	-66.5	154.7	0	0	0	113.1	L1052 P1053 E1054 K1060	L1052-H1056 PolarHBondContact O-N 3.3Å; P1053-H1056 PolarHBondContact O-N 3.39Å; E1054-H1056 PolarHBondContact O-N 3.2Å; H1056-K1060 WeakPolarHBondContact O-CG 3.28Å; H1056-K1060 PolarHBondContact O-N 3.25Å; H1056-K1060 VanDerWaalsContact O-N 3.09Å
1057	Q	94.2	Very high	91.2	Very high	57 Å²	57	55.7 Å²	55.7	27%	0.266	28%	0.277	S	S	.	.	H	α-helix	trans	-63.7	-44.2	173.5	-67.3	172.3	-13.3	0	0	111.6	P1053 E1054 Y1055 K1060 V1061 C1152 G1153 I1154	P1053-Q1057 VanDerWaalsContact O-CG 3.32Å; P1053-Q1057 WeakPolarHBondContact O-CG 3.22Å; P1053-Q1057 PolarHBondContact O-N 2.89Å; P1053-Q1057 VanDerWaalsContact O-N 3.07Å; E1054-Q1057 PolarHBondContact O-N 3.4Å; Y1055-Q1057 VanDerWaalsContact C-N 3.33Å; Y1055-Q1057 PolarHBondContact O-N 3.22Å; Q1057-K1060 WeakPolarHBondContact O-CB 3.47Å; Q1057-K1060 PolarHBondContact O-N 3.27Å; Q1057-V1061 PolarHBondContact O-N 3Å; Q1057-V1061 VanDerWaalsContact O-N 3.16Å; Q1057-C1152 WeakPolarHBondContact CG-O 3.4Å; Q1057-G1153 PolarHBondContact NE2-O 3.1Å; Q1057-G1153 PolarHBondContact OE1-O 3.23Å; Q1057-I1154 HydrophobicContact CB-CG1 4.18Å
1058	R	94.2	Very high	91.9	Very high	37 Å²	37	49 Å²	49	14%	0.14	25%	0.246	C	C	.	.	H	α-helix	trans	-66.7	-38.2	177.5	-70.7	174.5	179.2	-85.7	2.1	112.6	L752 Y754 I757 E1054 Y1055 V1061 L1062 I1154	L752-R1058 PolarHBondContact O-NE 3.14Å; L752-R1058 PolarHBondContact O-NH1 3.37Å; L752-R1058 PolarHBondContact O-NH2 3.11Å; Y754-R1058 HydrophobicContact CD1-CB 4.21Å; Y754-R1058 HydrophobicContact CD1-CG 4.46Å; Y754-R1058 HydrophobicContact CE1-CB 3.76Å; Y754-R1058 HydrophobicContact CE1-CG 3.8Å; Y754-R1058 VanDerWaalsContact CE2-NH1 3.33Å; I757-R1058 HydrophobicContact CD1-CB 3.88Å; E1054-R1058 WeakPolarHBondContact O-CG 3.39Å; E1054-R1058 PolarHBondContact O-N 3.02Å; E1054-R1058 IonicContact OE1-CZ 3.63Å; E1054-R1058 IonicContact OE1-NE 2.82Å; E1054-R1058 PolarHBondContact OE1-NE 3.49Å; E1054-R1058 IonicContact OE1-NH2 3.66Å; E1054-R1058 PolarHBondContact OE1-NH2 3.26Å; Y1055-R1058 PolarHBondContact O-N 2.93Å; R1058-V1061 PolarHBondContact O-N 3.28Å; R1058-L1062 WeakPolarHBondContact O-CG 3.46Å; R1058-L1062 PolarHBondContact O-N 3.05Å; R1058-I1154 HydrophobicContact CG-CD1 4.3Å
1059	I	94.5	Very high	92.3	Very high	24 Å²	24	49.9 Å²	49.9	12%	0.123	25%	0.249	C	C	.	.	H	α-helix	trans	-60.3	-43.7	172.7	-71.3	-67.7	0	0	0	110.9	I757 L761 Y1055 V1061 L1062 Q1063 I1068	I757-I1059 HydrophobicContact CG2-CD1 3.83Å; L761-I1059 HydrophobicContact CD1-CD1 3.87Å; Y1055-I1059 HydrophobicContact CD1-CG1 4.39Å; Y1055-I1059 HydrophobicContact CD2-CG1 4.15Å; Y1055-I1059 HydrophobicContact CE1-CG1 4.02Å; Y1055-I1059 HydrophobicContact CE2-CD1 3.83Å; Y1055-I1059 HydrophobicContact CE2-CG1 3.73Å; Y1055-I1059 HydrophobicContact CG-CG1 4.46Å; Y1055-I1059 VanDerWaalsContact O-CG1 3.32Å; Y1055-I1059 WeakPolarHBondContact O-CG1 3.48Å; Y1055-I1059 PolarHBondContact O-N 3.07Å; I1059-V1061 VanDerWaalsContact C-N 3.35Å; I1059-V1061 PolarHBondContact O-N 3.45Å; I1059-L1062 PolarHBondContact O-N 2.87Å; I1059-Q1063 HydrophobicContact CG2-CG 4.46Å; I1059-Q1063 WeakPolarHBondContact O-CG 3.27Å; I1059-Q1063 PolarHBondContact O-N 3.17Å; I1059-I1068 HydrophobicContact CD1-CD1 3.75Å; I1059-I1068 HydrophobicContact CG2-CD1 4.05Å
1060	K	95	Very high	92.4	Very high	116 Å²	116	54.8 Å²	54.8	50%	0.504	28%	0.284	S	S	.	.	H	α-helix	trans	-59.3	-41.8	174.3	-71.8	172.4	-178.7	-177.9	0	112.6	H1056 Q1057 Q1063 S1064 C1152	H1056-K1060 WeakPolarHBondContact O-CG 3.28Å; H1056-K1060 PolarHBondContact O-N 3.25Å; H1056-K1060 VanDerWaalsContact O-N 3.09Å; Q1057-K1060 WeakPolarHBondContact O-CB 3.47Å; Q1057-K1060 PolarHBondContact O-N 3.27Å; K1060-Q1063 PolarHBondContact O-N 3.36Å; K1060-S1064 WeakPolarHBondContact O-CB 3.31Å; K1060-S1064 PolarHBondContact O-N 3.34Å; K1060-S1064 PolarHBondContact O-OG 2.98Å; K1060-C1152 HydrophobicContact CB-CB 4.35Å
1061	V	95.1	Very high	92.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60.7	-46.4	174.2	176.4	0	0	0	0	111.2	Y754 Q1057 R1058 I1059 Q1063 S1064 L1065 L1089 Q1149 C1152 I1154	Y754-V1061 HydrophobicContact CE1-CB 4.33Å; Y754-V1061 HydrophobicContact CE1-CG1 4.31Å; Q1057-V1061 PolarHBondContact O-N 3Å; Q1057-V1061 VanDerWaalsContact O-N 3.16Å; R1058-V1061 PolarHBondContact O-N 3.28Å; I1059-V1061 VanDerWaalsContact C-N 3.35Å; I1059-V1061 PolarHBondContact O-N 3.45Å; V1061-Q1063 PolarHBondContact O-N 3.05Å; V1061-S1064 PolarHBondContact O-N 3.37Å; V1061-L1065 HydrophobicContact CG1-CD1 4.02Å; V1061-L1065 WeakPolarHBondContact O-CG 3.28Å; V1061-L1065 PolarHBondContact O-N 3.16Å; V1061-L1089 HydrophobicContact CG1-CD1 4.25Å; V1061-Q1149 HydrophobicContact CG1-CG 4.34Å; V1061-Q1149 HydrophobicContact CG2-CG 4.29Å; V1061-C1152 HydrophobicContact CG2-CB 3.51Å; V1061-I1154 HydrophobicContact CG2-CD1 3.9Å
1062	L	95.6	Very high	92.2	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-65.5	-36.5	180	-68.9	173.2	0	0	0	112.7	Y754 I757 L758 R1058 I1059 Q1066 Y1067 I1068 L1089	Y754-L1062 HydrophobicContact CD1-CD1 4.13Å; Y754-L1062 HydrophobicContact CD1-CD2 3.9Å; Y754-L1062 HydrophobicContact CD1-CG 3.91Å; Y754-L1062 HydrophobicContact CE1-CG 4.48Å; Y754-L1062 HydrophobicContact CG-CD2 4.5Å; I757-L1062 HydrophobicContact CG2-CD1 3.9Å; L758-L1062 HydrophobicContact CD1-CD2 4.2Å; L758-L1062 HydrophobicContact CD2-CD1 4.02Å; L758-L1062 HydrophobicContact CD2-CD2 4.26Å; L758-L1062 HydrophobicContact CG-CD1 4.21Å; L758-L1062 HydrophobicContact CG-CD2 4.41Å; R1058-L1062 WeakPolarHBondContact O-CG 3.46Å; R1058-L1062 PolarHBondContact O-N 3.05Å; I1059-L1062 PolarHBondContact O-N 2.87Å; L1062-Q1066 PolarHBondContact O-N 3.14Å; L1062-Y1067 HydrophobicContact CD2-CD1 3.99Å; L1062-Y1067 HydrophobicContact CD2-CG 4.03Å; L1062-Y1067 PolarHBondContact O-N 3.13Å; L1062-I1068 HydrophobicContact CB-CD1 3.77Å; L1062-I1068 HydrophobicContact CB-CG1 3.85Å; L1062-I1068 HydrophobicContact CD1-CD1 4.46Å; L1062-I1068 PolarHBondContact O-N 3.42Å; L1062-L1089 HydrophobicContact CD2-CD2 3.95Å
1063	Q	94.9	Very high	92.1	Very high	76 Å²	76	52.3 Å²	52.3	36%	0.355	29%	0.292	S	S	.	.	H	α-helix	trans	-66	-48.3	172.9	-75.1	178.1	-30.2	0	0	111.5	I1059 K1060 V1061 L1065 Q1066 I1068 D1069	I1059-Q1063 HydrophobicContact CG2-CG 4.46Å; I1059-Q1063 WeakPolarHBondContact O-CG 3.27Å; I1059-Q1063 PolarHBondContact O-N 3.17Å; K1060-Q1063 PolarHBondContact O-N 3.36Å; V1061-Q1063 PolarHBondContact O-N 3.05Å; Q1063-L1065 VanDerWaalsContact C-N 3.27Å; Q1063-L1065 PolarHBondContact O-N 3.29Å; Q1063-Q1066 PolarHBondContact O-N 3.13Å; Q1063-I1068 HydrophobicContact CG-CD1 3.88Å; Q1063-I1068 HydrophobicContact CG-CG1 3.63Å; Q1063-D1069 PolarHBondContact NE2-O 3.17Å
1064	S	94.8	Very high	92.1	Very high	71 Å²	71	49.3 Å²	49.3	50%	0.497	27%	0.272	S	S	.	.	H	α-helix	trans	-61.4	-32.7	179.5	-65.1	0	0	0	0	113.2	K1060 V1061	K1060-S1064 WeakPolarHBondContact O-CB 3.31Å; K1060-S1064 PolarHBondContact O-N 3.34Å; K1060-S1064 PolarHBondContact O-OG 2.98Å; V1061-S1064 PolarHBondContact O-N 3.37Å
1065	L	94.6	Very high	92.2	Very high	9 Å²	9	50.8 Å²	50.8	5%	0.047	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-2.3	175.5	-66.8	176.2	0	0	0	114.4	V1061 Q1063 Y1067 K1077 L1089 L1148	V1061-L1065 HydrophobicContact CG1-CD1 4.02Å; V1061-L1065 WeakPolarHBondContact O-CG 3.28Å; V1061-L1065 PolarHBondContact O-N 3.16Å; Q1063-L1065 VanDerWaalsContact C-N 3.27Å; Q1063-L1065 PolarHBondContact O-N 3.29Å; L1065-Y1067 HydrophobicContact CB-CD2 3.49Å; L1065-Y1067 VanDerWaalsContact CB-CD2 3.49Å; L1065-Y1067 HydrophobicContact CB-CE2 3.55Å; L1065-Y1067 HydrophobicContact CD1-CE2 4.21Å; L1065-Y1067 HydrophobicContact CG-CE2 4.48Å; L1065-Y1067 WeakPolarHBondContact O-CD2 3.3Å; L1065-K1077 WeakPolarHBondContact O-CD 3.44Å; L1065-K1077 PolarHBondContact O-NZ 3.09Å; L1065-K1077 VanDerWaalsContact O-NZ 3.16Å; L1065-L1089 HydrophobicContact CD1-CD1 4.39Å; L1065-L1089 HydrophobicContact CD1-CD2 4.37Å; L1065-L1148 HydrophobicContact CD1-CD2 4.26Å; L1065-L1148 HydrophobicContact CD2-CD2 3.5Å; L1065-L1148 HydrophobicContact CG-CD2 3.57Å
1066	Q	94.6	Very high	92.2	Very high	140 Å²	140	53.3 Å²	53.3	65%	0.654	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	35.7	-177.2	-52.6	175	-22.1	0	0	114.6	L1062 Q1063	L1062-Q1066 PolarHBondContact O-N 3.14Å; Q1063-Q1066 PolarHBondContact O-N 3.13Å
1067	Y	95.6	Very high	92.2	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.281	C	S	.	.	S	Bend	trans	-84.9	-30.7	174.3	-76.4	-130.5	0	0	0	111.1	L758 L1062 L1065 Q1075 K1077 A1081 L1089 T1092 E1093	L758-Y1067 HydrophobicContact CD1-CD1 4.19Å; L1062-Y1067 HydrophobicContact CD2-CD1 3.99Å; L1062-Y1067 HydrophobicContact CD2-CG 4.03Å; L1062-Y1067 PolarHBondContact O-N 3.13Å; L1065-Y1067 HydrophobicContact CB-CD2 3.49Å; L1065-Y1067 VanDerWaalsContact CB-CD2 3.49Å; L1065-Y1067 HydrophobicContact CB-CE2 3.55Å; L1065-Y1067 HydrophobicContact CD1-CE2 4.21Å; L1065-Y1067 HydrophobicContact CG-CE2 4.48Å; L1065-Y1067 WeakPolarHBondContact O-CD2 3.3Å; Y1067-Q1075 WeakPolarHBondContact O-CB 3.41Å; Y1067-Q1075 PolarHBondContact O-N 2.86Å; Y1067-K1077 HydrophobicContact CD1-CB 4.39Å; Y1067-K1077 HydrophobicContact CD2-CB 3.88Å; Y1067-K1077 HydrophobicContact CD2-CD 3.88Å; Y1067-K1077 HydrophobicContact CE2-CB 4.09Å; Y1067-K1077 HydrophobicContact CE2-CD 3.7Å; Y1067-K1077 HydrophobicContact CE2-CG 4.48Å; Y1067-K1077 HydrophobicContact CG-CB 4.03Å; Y1067-A1081 HydrophobicContact CD1-CB 3.93Å; Y1067-A1081 HydrophobicContact CE1-CB 3.73Å; Y1067-L1089 HydrophobicContact CD1-CD2 4.09Å; Y1067-L1089 HydrophobicContact CE1-CD2 3.61Å; Y1067-L1089 PolarHBondContact OH-O 3.34Å; Y1067-L1089 VanDerWaalsContact OH-O 3.1Å; Y1067-T1092 HydrophobicContact CE1-CG2 3.86Å; Y1067-T1092 VanDerWaalsContact OH-CB 3.24Å; Y1067-T1092 WeakPolarHBondContact OH-CB 3.24Å; Y1067-T1092 WeakPolarHBondContact OH-CG2 3.36Å; Y1067-E1093 WeakPolarHBondContact CE2-OE1 3.4Å; Y1067-E1093 PolarHBondContact OH-OE1 2.8Å
1068	I	94.3	Very high	92.2	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.01	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-129	156.3	168.7	63.7	-175.2	0	0	0	107.9	L758 L761 I1059 L1062 Q1063 A1073 V1074	L758-I1068 HydrophobicContact CD2-CG2 3.79Å; L761-I1068 HydrophobicContact CD1-CD1 4.33Å; L761-I1068 HydrophobicContact CD1-CG2 4.12Å; I1059-I1068 HydrophobicContact CD1-CD1 3.75Å; I1059-I1068 HydrophobicContact CG2-CD1 4.05Å; L1062-I1068 HydrophobicContact CB-CD1 3.77Å; L1062-I1068 HydrophobicContact CB-CG1 3.85Å; L1062-I1068 HydrophobicContact CD1-CD1 4.46Å; L1062-I1068 PolarHBondContact O-N 3.42Å; Q1063-I1068 HydrophobicContact CG-CD1 3.88Å; Q1063-I1068 HydrophobicContact CG-CG1 3.63Å; I1068-A1073 WeakPolarHBondContact CA-O 3.44Å; I1068-V1074 HydrophobicContact CG2-CG2 4.37Å
1069	D	90.1	Very high	92	Very high	39 Å²	39	53.6 Å²	53.6	21%	0.209	29%	0.29	C	S	.	.			trans	-87.4	-168.5	174.9	73.6	-12.7	0	0	0	112.3	Q1063 S1071 G1072 A1073 Q1075	Q1063-D1069 PolarHBondContact NE2-O 3.17Å; D1069-S1071 VanDerWaalsContact C-N 3.28Å; D1069-S1071 VanDerWaalsContact CG-N 3.34Å; D1069-S1071 PolarHBondContact O-N 2.98Å; D1069-S1071 WeakPolarHBondContact OD1-CA 3.47Å; D1069-S1071 PolarHBondContact OD1-N 3.15Å; D1069-S1071 PolarHBondContact OD1-OG 3.4Å; D1069-S1071 PolarHBondContact OD2-OG 2.93Å; D1069-G1072 PolarHBondContact OD1-N 3.47Å; D1069-A1073 PolarHBondContact N-O 2.88Å; D1069-A1073 PolarHBondContact OD1-N 3.18Å; D1069-Q1075 HydrophobicContact CB-CG 4.48Å
1070	S	86.3	Confident	91.8	Very high	111 Å²	111	52.4 Å²	52.4	78%	0.776	28%	0.284	S	S	*	.	S	Bend	trans	-71.6	-16.5	173.6	53.1	0	0	0	0	114.4
1071	S	83.1	Confident	91.7	Very high	90 Å²	90	46.9 Å²	46.9	63%	0.629	26%	0.26	S	S	*	.	S	Bend	trans	-88.9	-18.7	176.6	75.4	0	0	0	0	112.9	D1069	D1069-S1071 VanDerWaalsContact C-N 3.28Å; D1069-S1071 VanDerWaalsContact CG-N 3.34Å; D1069-S1071 PolarHBondContact O-N 2.98Å; D1069-S1071 WeakPolarHBondContact OD1-CA 3.47Å; D1069-S1071 PolarHBondContact OD1-N 3.15Å; D1069-S1071 PolarHBondContact OD1-OG 3.4Å; D1069-S1071 PolarHBondContact OD2-OG 2.93Å
1072	G	83.6	Confident	91.4	Very high	21 Å²	21	47.4 Å²	47.4	22%	0.216	26%	0.264	C	S	.	.			trans	101.6	-1	-175.1	0	0	0	0	0	113.7	D1069	D1069-G1072 PolarHBondContact OD1-N 3.47Å
1073	A	87.5	Confident	91	Very high	45 Å²	45	49.1 Å²	49.1	37%	0.372	27%	0.272	S	S	.	.			trans	-71.7	133.7	-179.6	0	0	0	0	0	112.3	I1068 D1069 Q1075	I1068-A1073 WeakPolarHBondContact CA-O 3.44Å; D1069-A1073 PolarHBondContact N-O 2.88Å; D1069-A1073 PolarHBondContact OD1-N 3.18Å; A1073-Q1075 PolarHBondContact O-N 3.48Å
1074	V	90.9	Very high	90.7	Very high	18 Å²	18	45.6 Å²	45.6	11%	0.109	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-75.3	112.7	-174.6	-173.6	0	0	0	0	112	L758 L761 I1068 R1079	L758-V1074 HydrophobicContact CD2-CG1 4.33Å; L761-V1074 HydrophobicContact CB-CG2 3.68Å; I1068-V1074 HydrophobicContact CG2-CG2 4.37Å; V1074-R1079 HydrophobicContact CG1-CG 4.1Å
1075	Q	92.3	Very high	90	Very high	84 Å²	84	45 Å²	45	39%	0.393	25%	0.251	S	S	.	.			trans	-76.8	173.4	179.4	-64	-61.3	-39.5	0	0	112.2	Y1067 D1069 A1073 K1077 G1078 R1079	Y1067-Q1075 WeakPolarHBondContact O-CB 3.41Å; Y1067-Q1075 PolarHBondContact O-N 2.86Å; D1069-Q1075 HydrophobicContact CB-CG 4.48Å; A1073-Q1075 PolarHBondContact O-N 3.48Å; Q1075-K1077 VanDerWaalsContact C-N 3.3Å; Q1075-K1077 PolarHBondContact O-N 3.4Å; Q1075-G1078 WeakPolarHBondContact O-CA 3.31Å; Q1075-G1078 PolarHBondContact O-N 3.01Å; Q1075-R1079 PolarHBondContact O-N 3.5Å
1076	L	92.1	Very high	89.4	Confident	84 Å²	84	46.8 Å²	46.8	44%	0.44	27%	0.265	S	S	.	.	H	α-helix	trans	-55.5	-42.2	-179.4	-176.5	63.5	0	0	0	112.7	G1078 R1079 V1080 F1096 I1216	L1076-G1078 PolarHBondContact O-N 2.99Å; L1076-R1079 PolarHBondContact O-N 3.13Å; L1076-V1080 WeakPolarHBondContact O-CG2 3.46Å; L1076-V1080 PolarHBondContact O-N 3.33Å; L1076-F1096 HydrophobicContact CD2-CE1 4.4Å; L1076-F1096 HydrophobicContact CD2-CZ 4.35Å; L1076-F1096 HydrophobicContact CG-CZ 4.21Å; L1076-I1216 HydrophobicContact CD1-CG2 4.12Å
1077	K	93.6	Very high	89.1	Confident	39 Å²	39	42.8 Å²	42.8	17%	0.17	25%	0.246	C	C	.	.	H	α-helix	trans	-56.9	-46.4	172.8	-76.7	-168.9	172.9	-166.6	0	112.1	L1065 Y1067 Q1075 V1080 A1081 T1092 E1093 F1096	L1065-K1077 WeakPolarHBondContact O-CD 3.44Å; L1065-K1077 PolarHBondContact O-NZ 3.09Å; L1065-K1077 VanDerWaalsContact O-NZ 3.16Å; Y1067-K1077 HydrophobicContact CD1-CB 4.39Å; Y1067-K1077 HydrophobicContact CD2-CB 3.88Å; Y1067-K1077 HydrophobicContact CD2-CD 3.88Å; Y1067-K1077 HydrophobicContact CE2-CB 4.09Å; Y1067-K1077 HydrophobicContact CE2-CD 3.7Å; Y1067-K1077 HydrophobicContact CE2-CG 4.48Å; Y1067-K1077 HydrophobicContact CG-CB 4.03Å; Q1075-K1077 VanDerWaalsContact C-N 3.3Å; Q1075-K1077 PolarHBondContact O-N 3.4Å; K1077-V1080 PolarHBondContact O-N 3.31Å; K1077-A1081 PolarHBondContact O-N 3.37Å; K1077-T1092 HydrophobicContact CB-CG2 4.37Å; K1077-E1093 IonicContact NZ-OE1 3.07Å; K1077-E1093 PolarHBondContact NZ-OE1 2.71Å; K1077-E1093 IonicContact NZ-OE2 2.68Å; K1077-F1096 HydrophobicContact CB-CE2 4.3Å; K1077-F1096 HydrophobicContact CG-CD1 4.45Å; K1077-F1096 HydrophobicContact CG-CD2 3.9Å; K1077-F1096 HydrophobicContact CG-CE1 4.26Å; K1077-F1096 HydrophobicContact CG-CE2 3.7Å; K1077-F1096 HydrophobicContact CG-CG 4.28Å; K1077-F1096 HydrophobicContact CG-CZ 3.89Å
1078	G	92.9	Very high	88.9	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61.6	-43.7	176.3	0	0	0	0	0	112.7	Q1075 L1076 V1080 A1081 C1082	Q1075-G1078 WeakPolarHBondContact O-CA 3.31Å; Q1075-G1078 PolarHBondContact O-N 3.01Å; L1076-G1078 PolarHBondContact O-N 2.99Å; G1078-V1080 VanDerWaalsContact C-N 3.3Å; G1078-V1080 PolarHBondContact O-N 3.34Å; G1078-A1081 PolarHBondContact O-N 3.35Å; G1078-C1082 PolarHBondContact O-N 2.92Å; G1078-C1082 PolarHBondContact O-SG 3.49Å
1079	R	89.7	Confident	88.8	Confident	156 Å²	156	44.1 Å²	44.1	59%	0.589	25%	0.252	S	S	*	.	H	α-helix	trans	-62.3	-35	176.5	-65.8	-178.5	-174.6	-161.2	-1.5	113	V1074 Q1075 L1076	V1074-R1079 HydrophobicContact CG1-CG 4.1Å; Q1075-R1079 PolarHBondContact O-N 3.5Å; L1076-R1079 PolarHBondContact O-N 3.13Å
1080	V	92.3	Very high	89	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-68	-47.3	172.9	167.2	0	0	0	0	110.6	L1076 K1077 G1078 C1082 Q1083 I1084 T1092 F1096 A1213 I1216 V1217	L1076-V1080 WeakPolarHBondContact O-CG2 3.46Å; L1076-V1080 PolarHBondContact O-N 3.33Å; K1077-V1080 PolarHBondContact O-N 3.31Å; G1078-V1080 VanDerWaalsContact C-N 3.3Å; G1078-V1080 PolarHBondContact O-N 3.34Å; V1080-C1082 VanDerWaalsContact C-N 3.25Å; V1080-C1082 PolarHBondContact O-N 3.41Å; V1080-Q1083 WeakPolarHBondContact O-CB 3.37Å; V1080-Q1083 PolarHBondContact O-N 2.93Å; V1080-I1084 HydrophobicContact CG1-CD1 4.38Å; V1080-T1092 HydrophobicContact CB-CG2 4.41Å; V1080-T1092 HydrophobicContact CG1-CG2 4.05Å; V1080-F1096 HydrophobicContact CB-CE2 4.28Å; V1080-F1096 HydrophobicContact CG1-CE2 4.36Å; V1080-F1096 HydrophobicContact CG2-CE2 4.16Å; V1080-F1096 HydrophobicContact CG2-CZ 4.28Å; V1080-A1213 HydrophobicContact CG1-CB 3.79Å; V1080-I1216 HydrophobicContact CG2-CB 4.47Å; V1080-I1216 HydrophobicContact CG2-CG2 4.12Å; V1080-V1217 HydrophobicContact CG2-CG2 3.48Å; V1080-V1217 VanDerWaalsContact CG2-CG2 3.48Å
1081	A	92.8	Very high	89.4	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.7	-29.8	177.9	0	0	0	0	0	113.2	L758 Y1067 K1077 G1078 Q1083 I1084 E1088	L758-A1081 HydrophobicContact CD1-CB 3.73Å; Y1067-A1081 HydrophobicContact CD1-CB 3.93Å; Y1067-A1081 HydrophobicContact CE1-CB 3.73Å; K1077-A1081 PolarHBondContact O-N 3.37Å; G1078-A1081 PolarHBondContact O-N 3.35Å; A1081-Q1083 PolarHBondContact O-N 3.35Å; A1081-I1084 PolarHBondContact O-N 3.44Å; A1081-E1088 HydrophobicContact CB-CB 4.48Å
1082	C	88.8	Confident	89.9	Confident	11 Å²	11	32.9 Å²	32.9	7%	0.074	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-21.7	171.8	-66.1	0	0	0	0	114.5	L758 G1078 V1080	L758-C1082 VanDerWaalsContact CB-SG 3.53Å; G1078-C1082 PolarHBondContact O-N 2.92Å; G1078-C1082 PolarHBondContact O-SG 3.49Å; V1080-C1082 VanDerWaalsContact C-N 3.25Å; V1080-C1082 PolarHBondContact O-N 3.41Å
1083	Q	86	Confident	90.5	Very high	35 Å²	35	32.2 Å²	32.2	16%	0.164	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-15.7	175	-65.4	-64.3	-32.3	0	0	113.3	N155 V1080 A1081 Q1212 I1216	N155-Q1083 PolarHBondContact ND2-NE2 2.92Å; N155-Q1083 PolarHBondContact OD1-NE2 3.26Å; V1080-Q1083 WeakPolarHBondContact O-CB 3.37Å; V1080-Q1083 PolarHBondContact O-N 2.93Å; A1081-Q1083 PolarHBondContact O-N 3.35Å; Q1083-Q1212 HydrophobicContact CG-CG 4.37Å; Q1083-I1216 HydrophobicContact CG-CD1 3.44Å; Q1083-I1216 VanDerWaalsContact CG-CD1 3.44Å
1084	I	89.3	Confident	90.8	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.01	15%	0.15	C	C	.	.			trans	-101.3	124.9	-169.8	-61.3	167.4	0	0	0	108.9	T755 V1080 A1081 S1086 E1088 L1091 T1092 E1209	T755-I1084 PolarHBondContact OG1-O 3.12Å; T755-I1084 VanDerWaalsContact OG1-O 3.1Å; V1080-I1084 HydrophobicContact CG1-CD1 4.38Å; A1081-I1084 PolarHBondContact O-N 3.44Å; I1084-S1086 WeakPolarHBondContact CG2-O 3.43Å; I1084-E1088 HydrophobicContact CB-CB 4.19Å; I1084-E1088 HydrophobicContact CG2-CB 4.1Å; I1084-L1091 HydrophobicContact CD1-CB 4.12Å; I1084-L1091 HydrophobicContact CD1-CD2 4.13Å; I1084-L1091 HydrophobicContact CD1-CG 3.95Å; I1084-L1091 HydrophobicContact CG1-CD2 4.31Å; I1084-L1091 HydrophobicContact CG2-CB 4.34Å; I1084-L1091 HydrophobicContact CG2-CD2 3.82Å; I1084-T1092 WeakPolarHBondContact CD1-OG1 3.42Å; I1084-E1209 WeakPolarHBondContact CA-OE2 3.35Å
1085	S	80.8	Confident	90.9	Very high	59 Å²	59	30 Å²	30	41%	0.413	15%	0.149	S	C	.	.			trans	-89.8	-23.4	-178	69.2	0	0	0	0	113.3	E1209	S1085-E1209 VanDerWaalsContact CB-OE1 3.26Å; S1085-E1209 WeakPolarHBondContact CB-OE1 3.41Å; S1085-E1209 PolarHBondContact N-OE2 3.37Å; S1085-E1209 VanDerWaalsContact OG-CD 3.32Å; S1085-E1209 PolarHBondContact OG-OE1 2.89Å; S1085-E1209 PolarHBondContact OG-OE2 3.41Å
1086	S	80.8	Confident	90.9	Very high	47 Å²	47	29.5 Å²	29.5	33%	0.329	15%	0.145	S	C	.	.	S	Bend	trans	-132.4	121.8	-168.1	-57.4	0	0	0	0	111.1	I1084 E1088	I1084-S1086 WeakPolarHBondContact CG2-O 3.43Å; S1086-E1088 PolarHBondContact O-N 3.09Å
1087	H	87.6	Confident	90.9	Very high	56 Å²	56	29.6 Å²	29.6	26%	0.259	14%	0.143	S	C	.	.	S	Bend	trans	52.2	49.7	-179.9	-59	-76.3	0	0	0	113.2	L1089 L1090 L1091 L1115 Q1164 F1165	H1087-L1089 VanDerWaalsContact C-N 3.32Å; H1087-L1089 PolarHBondContact O-N 3.43Å; H1087-L1090 PolarHBondContact O-N 2.95Å; H1087-L1090 VanDerWaalsContact O-N 3.16Å; H1087-L1091 PolarHBondContact O-N 3.44Å; H1087-L1091 VanDerWaalsContact O-N 3.09Å; H1087-L1115 HydrophobicContact CB-CD2 4.29Å; H1087-L1115 PolarHBondContact CD2-O 2.91Å; H1087-Q1164 PolarHBondContact CE1-OE1 3.29Å; H1087-F1165 HydrophobicContact CB-CE1 4.28Å; H1087-F1165 AromaticContact CE1-CE1 3.81Å; H1087-F1165 AromaticContact CG-CE1 3.74Å; H1087-F1165 AromaticContact ND1-CE1 3.57Å; H1087-F1165 AromaticContact ND1-CZ 3.8Å
1088	E	91.3	Very high	90.8	Very high	25 Å²	25	32.2 Å²	32.2	12%	0.117	16%	0.159	C	C	.	.	H	α-helix	trans	-55.9	-37.6	-168.2	63.2	-86.8	-147.4	0	0	114.3	Y754 T755 A1081 I1084 S1086 T1092	Y754-E1088 WeakPolarHBondContact CA-OE1 3.26Å; Y754-E1088 VanDerWaalsContact CB-OE1 3.27Å; Y754-E1088 WeakPolarHBondContact CB-OE1 3.37Å; Y754-E1088 PolarHBondContact N-OE1 3.28Å; Y754-E1088 VanDerWaalsContact N-OE1 3.09Å; T755-E1088 PolarHBondContact N-OE1 3.23Å; T755-E1088 VanDerWaalsContact N-OE1 3.16Å; T755-E1088 WeakPolarHBondContact OG1-CG 3.49Å; T755-E1088 PolarHBondContact OG1-OE1 2.79Å; A1081-E1088 HydrophobicContact CB-CB 4.48Å; I1084-E1088 HydrophobicContact CB-CB 4.19Å; I1084-E1088 HydrophobicContact CG2-CB 4.1Å; S1086-E1088 PolarHBondContact O-N 3.09Å; E1088-T1092 VanDerWaalsContact O-CB 3.23Å; E1088-T1092 WeakPolarHBondContact O-CB 3.23Å; E1088-T1092 PolarHBondContact O-N 3.18Å; E1088-T1092 PolarHBondContact O-OG1 3.27Å
1089	L	93.6	Very high	90.7	Very high	5 Å²	5	32.3 Å²	32.3	3%	0.026	16%	0.16	C	C	.	.	H	α-helix	trans	-70.4	-47.8	177.8	-60	-176.9	0	0	0	112.2	Y754 V1061 L1062 L1065 Y1067 H1087 E1093 I1145	Y754-L1089 HydrophobicContact CD1-CD1 4.42Å; Y754-L1089 HydrophobicContact CD2-CD1 3.85Å; Y754-L1089 HydrophobicContact CD2-CG 4.06Å; Y754-L1089 HydrophobicContact CE1-CD1 4.18Å; Y754-L1089 HydrophobicContact CE2-CD1 3.58Å; Y754-L1089 HydrophobicContact CE2-CG 4.29Å; Y754-L1089 HydrophobicContact CG-CD1 4.25Å; Y754-L1089 HydrophobicContact CG-CD2 4.33Å; Y754-L1089 HydrophobicContact CG-CG 4.34Å; V1061-L1089 HydrophobicContact CG1-CD1 4.25Å; L1062-L1089 HydrophobicContact CD2-CD2 3.95Å; L1065-L1089 HydrophobicContact CD1-CD1 4.39Å; L1065-L1089 HydrophobicContact CD1-CD2 4.37Å; Y1067-L1089 HydrophobicContact CD1-CD2 4.09Å; Y1067-L1089 HydrophobicContact CE1-CD2 3.61Å; Y1067-L1089 PolarHBondContact OH-O 3.34Å; Y1067-L1089 VanDerWaalsContact OH-O 3.1Å; H1087-L1089 VanDerWaalsContact C-N 3.32Å; H1087-L1089 PolarHBondContact O-N 3.43Å; L1089-E1093 WeakPolarHBondContact O-CG 3.32Å; L1089-E1093 PolarHBondContact O-N 3.14Å; L1089-I1145 HydrophobicContact CB-CD1 4.36Å; L1089-I1145 HydrophobicContact CD1-CG2 4.28Å
1090	L	94.2	Very high	90.8	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-65.3	-48.3	-177.4	176.8	61	0	0	0	110.6	H1087 T1092 E1093 L1094 L1115 V1138 V1141 A1142 I1145 F1165	H1087-L1090 PolarHBondContact O-N 2.95Å; H1087-L1090 VanDerWaalsContact O-N 3.16Å; L1090-T1092 VanDerWaalsContact C-N 3.3Å; L1090-T1092 PolarHBondContact O-N 3.35Å; L1090-E1093 PolarHBondContact O-N 2.86Å; L1090-L1094 HydrophobicContact CD1-CD1 4.08Å; L1090-L1094 HydrophobicContact CD1-CG 4.07Å; L1090-L1094 HydrophobicContact CG-CD1 3.94Å; L1090-L1094 HydrophobicContact CG-CG 4.37Å; L1090-L1094 VanDerWaalsContact O-CG 3.25Å; L1090-L1094 WeakPolarHBondContact O-CG 3.42Å; L1090-L1094 PolarHBondContact O-N 3.35Å; L1090-L1115 HydrophobicContact CD2-CD2 3.81Å; L1090-V1138 HydrophobicContact CD2-CG1 4.24Å; L1090-V1141 HydrophobicContact CD1-CB 4.02Å; L1090-V1141 HydrophobicContact CD1-CG1 3.64Å; L1090-A1142 HydrophobicContact CD1-CB 4.23Å; L1090-A1142 HydrophobicContact CD2-CB 4.4Å; L1090-I1145 HydrophobicContact CB-CD1 4.24Å; L1090-I1145 HydrophobicContact CD1-CD1 4.25Å; L1090-F1165 HydrophobicContact CD2-CD1 3.99Å; L1090-F1165 HydrophobicContact CD2-CD2 4.21Å; L1090-F1165 HydrophobicContact CD2-CE1 3.48Å; L1090-F1165 VanDerWaalsContact CD2-CE1 3.48Å; L1090-F1165 HydrophobicContact CD2-CE2 3.74Å; L1090-F1165 HydrophobicContact CD2-CG 4.34Å; L1090-F1165 HydrophobicContact CD2-CZ 3.35Å
1091	L	94	Very high	90.6	Very high	2 Å²	2	26.7 Å²	26.7	1%	0.01	14%	0.144	C	C	.	.	H	α-helix	trans	-66.5	-33.4	-177	-174.2	54.2	0	0	0	112.5	I1084 H1087 L1095 L1112 L1115 V1206 V1210	I1084-L1091 HydrophobicContact CD1-CB 4.12Å; I1084-L1091 HydrophobicContact CD1-CD2 4.13Å; I1084-L1091 HydrophobicContact CD1-CG 3.95Å; I1084-L1091 HydrophobicContact CG1-CD2 4.31Å; I1084-L1091 HydrophobicContact CG2-CB 4.34Å; I1084-L1091 HydrophobicContact CG2-CD2 3.82Å; H1087-L1091 PolarHBondContact O-N 3.44Å; H1087-L1091 VanDerWaalsContact O-N 3.09Å; L1091-L1095 PolarHBondContact O-N 2.91Å; L1091-L1112 HydrophobicContact CD1-CD2 3.5Å; L1091-L1112 VanDerWaalsContact CD1-CD2 3.5Å; L1091-L1115 HydrophobicContact CB-CD1 4.34Å; L1091-L1115 HydrophobicContact CD1-CD1 4Å; L1091-L1115 HydrophobicContact CD2-CD1 4.16Å; L1091-L1115 HydrophobicContact CG-CD1 4.41Å; L1091-V1206 HydrophobicContact CD2-CG1 3.9Å; L1091-V1210 HydrophobicContact CD1-CG2 3.8Å; L1091-V1210 HydrophobicContact CD2-CG2 3.71Å; L1091-V1210 HydrophobicContact CG-CG2 4.04Å
1092	T	94.8	Very high	90.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-68.1	-48.3	172.6	-59.1	0	0	0	0	111.2	Y1067 K1077 V1080 I1084 E1088 L1090 L1094 L1095 F1096	Y1067-T1092 HydrophobicContact CE1-CG2 3.86Å; Y1067-T1092 VanDerWaalsContact OH-CB 3.24Å; Y1067-T1092 WeakPolarHBondContact OH-CB 3.24Å; Y1067-T1092 WeakPolarHBondContact OH-CG2 3.36Å; K1077-T1092 HydrophobicContact CB-CG2 4.37Å; V1080-T1092 HydrophobicContact CB-CG2 4.41Å; V1080-T1092 HydrophobicContact CG1-CG2 4.05Å; I1084-T1092 WeakPolarHBondContact CD1-OG1 3.42Å; E1088-T1092 VanDerWaalsContact O-CB 3.23Å; E1088-T1092 WeakPolarHBondContact O-CB 3.23Å; E1088-T1092 PolarHBondContact O-N 3.18Å; E1088-T1092 PolarHBondContact O-OG1 3.27Å; L1090-T1092 VanDerWaalsContact C-N 3.3Å; L1090-T1092 PolarHBondContact O-N 3.35Å; T1092-L1094 VanDerWaalsContact C-N 3.33Å; T1092-L1094 PolarHBondContact O-N 2.97Å; T1092-L1095 WeakPolarHBondContact O-CB 3.25Å; T1092-L1095 PolarHBondContact O-N 2.9Å; T1092-L1095 VanDerWaalsContact O-N 3.14Å; T1092-F1096 HydrophobicContact CG2-CD2 3.81Å; T1092-F1096 HydrophobicContact CG2-CE2 3.86Å; T1092-F1096 WeakPolarHBondContact O-CD2 3.38Å; T1092-F1096 PolarHBondContact O-N 3.39Å
1093	E	94.9	Very high	90.7	Very high	7 Å²	7	31.3 Å²	31.3	3%	0.033	17%	0.174	C	C	.	.	H	α-helix	trans	-60.2	-40.9	177	-69	-64.3	102.9	0	0	112.1	Y1067 K1077 L1089 L1090 L1095 F1096 E1097 V1141 R1144 I1145	Y1067-E1093 WeakPolarHBondContact CE2-OE1 3.4Å; Y1067-E1093 PolarHBondContact OH-OE1 2.8Å; K1077-E1093 IonicContact NZ-OE1 3.07Å; K1077-E1093 PolarHBondContact NZ-OE1 2.71Å; K1077-E1093 IonicContact NZ-OE2 2.68Å; L1089-E1093 WeakPolarHBondContact O-CG 3.32Å; L1089-E1093 PolarHBondContact O-N 3.14Å; L1090-E1093 PolarHBondContact O-N 2.86Å; E1093-L1095 VanDerWaalsContact C-N 3.26Å; E1093-L1095 PolarHBondContact O-N 2.91Å; E1093-F1096 PolarHBondContact O-N 2.8Å; E1093-E1097 WeakPolarHBondContact O-CB 3.38Å; E1093-E1097 PolarHBondContact O-N 3.34Å; E1093-V1141 HydrophobicContact CB-CG1 3.73Å; E1093-R1144 IonicContact OE2-CZ 3.35Å; E1093-R1144 IonicContact OE2-NH1 2.69Å; E1093-R1144 PolarHBondContact OE2-NH1 2.85Å; E1093-R1144 IonicContact OE2-NH2 3.91Å; E1093-R1144 PolarHBondContact OE2-NH2 3.08Å; E1093-I1145 HydrophobicContact CB-CD1 4.47Å; E1093-I1145 HydrophobicContact CG-CD1 4.08Å
1094	L	93.7	Very high	91.1	Very high	3 Å²	3	31.3 Å²	31.3	2%	0.016	18%	0.179	C	C	.	.	H	α-helix	trans	-61.9	-31.8	176.2	-70	172.8	0	0	0	113.6	L1090 T1092 N1098 V1099 V1138 V1141	L1090-L1094 HydrophobicContact CD1-CD1 4.08Å; L1090-L1094 HydrophobicContact CD1-CG 4.07Å; L1090-L1094 HydrophobicContact CG-CD1 3.94Å; L1090-L1094 HydrophobicContact CG-CG 4.37Å; L1090-L1094 VanDerWaalsContact O-CG 3.25Å; L1090-L1094 WeakPolarHBondContact O-CG 3.42Å; L1090-L1094 PolarHBondContact O-N 3.35Å; T1092-L1094 VanDerWaalsContact C-N 3.33Å; T1092-L1094 PolarHBondContact O-N 2.97Å; L1094-N1098 PolarHBondContact O-N 3.48Å; L1094-V1099 HydrophobicContact CD2-CB 4.24Å; L1094-V1099 HydrophobicContact CD2-CG1 4.35Å; L1094-V1099 HydrophobicContact CD2-CG2 3.97Å; L1094-V1099 PolarHBondContact O-N 3.42Å; L1094-V1099 VanDerWaalsContact O-N 3.1Å; L1094-V1138 HydrophobicContact CD1-CG1 4.48Å; L1094-V1138 HydrophobicContact CD1-CG2 3.92Å; L1094-V1138 HydrophobicContact CD2-CB 4.48Å; L1094-V1138 HydrophobicContact CD2-CG2 3.79Å; L1094-V1141 HydrophobicContact CD2-CB 4.45Å; L1094-V1141 HydrophobicContact CD2-CG2 4.32Å
1095	L	93	Very high	91.4	Very high	14 Å²	14	32.5 Å²	32.5	7%	0.073	19%	0.188	C	C	.	.	H	α-helix	trans	-72.7	-47	175.6	-168.1	158.8	0	0	0	110.5	L1091 T1092 E1093 N1098 V1210 A1213 V1217 L1222	L1091-L1095 PolarHBondContact O-N 2.91Å; T1092-L1095 WeakPolarHBondContact O-CB 3.25Å; T1092-L1095 PolarHBondContact O-N 2.9Å; T1092-L1095 VanDerWaalsContact O-N 3.14Å; E1093-L1095 VanDerWaalsContact C-N 3.26Å; E1093-L1095 PolarHBondContact O-N 2.91Å; L1095-N1098 PolarHBondContact O-N 3.27Å; L1095-N1098 VanDerWaalsContact O-N 3.08Å; L1095-V1210 HydrophobicContact CD1-CG1 4.41Å; L1095-A1213 HydrophobicContact CD1-CB 3.86Å; L1095-V1217 HydrophobicContact CD2-CB 4.39Å; L1095-V1217 HydrophobicContact CD2-CG1 4.34Å; L1095-V1217 HydrophobicContact CD2-CG2 3.8Å; L1095-L1222 HydrophobicContact CD1-CD2 4.21Å; L1095-L1222 HydrophobicContact CG-CD2 3.94Å
1096	F	92.8	Very high	92	Very high	74 Å²	74	32.5 Å²	32.5	33%	0.325	18%	0.181	S	C	.	.	H	α-helix	trans	-72.4	-28.8	179.6	-80.4	-84.4	0	0	0	114	L1076 K1077 V1080 T1092 E1093 N1098 V1217	L1076-F1096 HydrophobicContact CD2-CE1 4.4Å; L1076-F1096 HydrophobicContact CD2-CZ 4.35Å; L1076-F1096 HydrophobicContact CG-CZ 4.21Å; K1077-F1096 HydrophobicContact CB-CE2 4.3Å; K1077-F1096 HydrophobicContact CG-CD1 4.45Å; K1077-F1096 HydrophobicContact CG-CD2 3.9Å; K1077-F1096 HydrophobicContact CG-CE1 4.26Å; K1077-F1096 HydrophobicContact CG-CE2 3.7Å; K1077-F1096 HydrophobicContact CG-CG 4.28Å; K1077-F1096 HydrophobicContact CG-CZ 3.89Å; V1080-F1096 HydrophobicContact CB-CE2 4.28Å; V1080-F1096 HydrophobicContact CG1-CE2 4.36Å; V1080-F1096 HydrophobicContact CG2-CE2 4.16Å; V1080-F1096 HydrophobicContact CG2-CZ 4.28Å; T1092-F1096 HydrophobicContact CG2-CD2 3.81Å; T1092-F1096 HydrophobicContact CG2-CE2 3.86Å; T1092-F1096 WeakPolarHBondContact O-CD2 3.38Å; T1092-F1096 PolarHBondContact O-N 3.39Å; E1093-F1096 PolarHBondContact O-N 2.8Å; F1096-N1098 PolarHBondContact O-N 3.24Å; F1096-V1217 HydrophobicContact CE2-CG2 4.38Å; F1096-V1217 HydrophobicContact CZ-CG2 3.98Å
1097	E	92	Very high	92.7	Very high	85 Å²	85	31.3 Å²	31.3	40%	0.397	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	2.2	168.4	-72.5	-171.1	-163.2	0	0	113.3	E1093 V1099 V1141 R1144	E1093-E1097 WeakPolarHBondContact O-CB 3.38Å; E1093-E1097 PolarHBondContact O-N 3.34Å; E1097-V1099 HydrophobicContact CB-CG2 3.96Å; E1097-V1099 PolarHBondContact O-N 3.37Å; E1097-V1141 WeakPolarHBondContact OE2-CG2 3.46Å; E1097-R1144 IonicContact OE1-CZ 2.75Å; E1097-R1144 IonicContact OE1-NE 3.44Å; E1097-R1144 IonicContact OE1-NH2 3.54Å; E1097-R1144 PolarHBondContact OE1-NH2 3.3Å
1098	N	91.1	Very high	93	Very high	94 Å²	94	28.6 Å²	28.6	50%	0.503	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	24.2	174	-155.1	31.9	0	0	0	114.5	L1094 L1095 F1096 L1100 S1101 P1102	L1094-N1098 PolarHBondContact O-N 3.48Å; L1095-N1098 PolarHBondContact O-N 3.27Å; L1095-N1098 VanDerWaalsContact O-N 3.08Å; F1096-N1098 PolarHBondContact O-N 3.24Å; N1098-L1100 VanDerWaalsContact C-N 3.28Å; N1098-L1100 PolarHBondContact O-N 3.19Å; N1098-S1101 PolarHBondContact O-N 3.4Å; N1098-S1101 WeakPolarHBondContact OD1-CB 3.07Å; N1098-S1101 PolarHBondContact OD1-OG 2.98Å; N1098-P1102 WeakPolarHBondContact O-CD 3.44Å
1099	V	91.4	Very high	93.2	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.012	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-30.6	-174.4	-178.2	0	0	0	0	112.2	L1094 E1097 P1102 L1111 R1137	L1094-V1099 HydrophobicContact CD2-CB 4.24Å; L1094-V1099 HydrophobicContact CD2-CG1 4.35Å; L1094-V1099 HydrophobicContact CD2-CG2 3.97Å; L1094-V1099 PolarHBondContact O-N 3.42Å; L1094-V1099 VanDerWaalsContact O-N 3.1Å; E1097-V1099 HydrophobicContact CB-CG2 3.96Å; E1097-V1099 PolarHBondContact O-N 3.37Å; V1099-P1102 WeakPolarHBondContact O-CD 3.48Å; V1099-L1111 HydrophobicContact CG1-CD2 4.39Å; V1099-R1137 HydrophobicContact CG1-CB 4.47Å
1100	L	91.8	Very high	93.3	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.005	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-16.3	-178.1	-59.1	178.4	0	0	0	113.9	N1098 L1111 L1112 V1210 L1222 K1225	N1098-L1100 VanDerWaalsContact C-N 3.28Å; N1098-L1100 PolarHBondContact O-N 3.19Å; L1100-L1111 HydrophobicContact CD2-CD2 4.06Å; L1100-L1112 HydrophobicContact CD1-CD1 4.44Å; L1100-L1112 HydrophobicContact CD2-CD2 4.44Å; L1100-L1112 HydrophobicContact CD2-CG 4.41Å; L1100-V1210 HydrophobicContact CD1-CG1 4.03Å; L1100-L1222 HydrophobicContact CB-CD1 3.75Å; L1100-K1225 PolarHBondContact O-NZ 3.16Å
1101	S	88.8	Confident	93.3	Very high	37 Å²	37	27.3 Å²	27.3	26%	0.259	15%	0.152	S	C	.	.	S	Bend	trans	-75	-34.4	-176.4	-67.4	0	0	0	0	116.5	N1098 L1103 K1225	N1098-S1101 PolarHBondContact O-N 3.4Å; N1098-S1101 WeakPolarHBondContact OD1-CB 3.07Å; N1098-S1101 PolarHBondContact OD1-OG 2.98Å; S1101-L1103 VanDerWaalsContact C-N 3.33Å; S1101-K1225 PolarHBondContact O-NZ 2.94Å
1102	P	91.3	Very high	93.3	Very high	100 Å²	100	27.3 Å²	27.3	65%	0.649	15%	0.152	S	C	*	.	S	Bend	trans	-73.5	-22.3	172.6	28.2	-35.1	0	0	0	113.8	N1098 V1099	N1098-P1102 WeakPolarHBondContact O-CD 3.44Å; V1099-P1102 WeakPolarHBondContact O-CD 3.48Å
1103	L	92.3	Very high	93.3	Very high	9 Å²	9	27.3 Å²	27.3	5%	0.047	15%	0.152	C	C	.	.	S	Bend	trans	-75.5	150.9	-172.8	-67.9	179	0	0	0	114	S1101 E1107 L1111 S1134 K1225	S1101-L1103 VanDerWaalsContact C-N 3.33Å; L1103-E1107 HydrophobicContact CB-CB 4.1Å; L1103-E1107 HydrophobicContact CD2-CB 4.07Å; L1103-L1111 HydrophobicContact CD1-CD2 3.81Å; L1103-S1134 WeakPolarHBondContact CD2-OG 3.43Å; L1103-K1225 WeakPolarHBondContact O-CD 3.48Å; L1103-K1225 WeakPolarHBondContact O-CE 3.47Å; L1103-K1225 PolarHBondContact O-NZ 2.82Å
1104	A	93.5	Very high	93.1	Very high	34 Å²	34	27.1 Å²	27.1	28%	0.281	15%	0.151	S	C	.	.			trans	-67.2	158.1	166.4	0	0	0	0	0	111.3	E1106 E1107 S1108	A1104-E1106 WeakPolarHBondContact CB-OE2 3.35Å; A1104-E1106 PolarHBondContact O-N 2.94Å; A1104-E1107 HydrophobicContact CB-CB 4.37Å; A1104-E1107 HydrophobicContact CB-CG 4.07Å; A1104-E1107 WeakPolarHBondContact CB-OE2 3.39Å; A1104-E1107 PolarHBondContact N-OE2 3.34Å; A1104-E1107 PolarHBondContact O-N 2.89Å; A1104-E1107 VanDerWaalsContact O-N 3.17Å; A1104-S1108 PolarHBondContact O-N 3.09Å; A1104-S1108 PolarHBondContact O-OG 2.78Å; A1104-S1108 VanDerWaalsContact O-OG 3.05Å
1105	P	95.1	Very high	93	Very high	28 Å²	28	27.4 Å²	27.4	18%	0.182	15%	0.153	C	C	.	.	H	α-helix	trans	-53.2	-39.5	176	-22.2	29.2	0	0	0	113.5	S1108 A1109 K1225 K1228 A1229	P1105-S1108 PolarHBondContact O-N 3.12Å; P1105-A1109 PolarHBondContact O-N 3.4Å; P1105-K1225 HydrophobicContact CB-CG 4.18Å; P1105-K1225 HydrophobicContact CG-CG 3.92Å; P1105-K1228 HydrophobicContact CB-CB 4.3Å; P1105-K1228 HydrophobicContact CG-CB 4.31Å; P1105-A1229 HydrophobicContact CB-CB 4.07Å; P1105-A1229 WeakPolarHBondContact O-CB 3.45Å
1106	E	94.9	Very high	92.9	Very high	58 Å²	58	27.5 Å²	27.5	27%	0.271	15%	0.153	S	C	.	.	H	α-helix	trans	-70.7	-38.4	-179.3	-54.1	84	174.7	0	0	111.5	A1104 A1110 Y1174 A1177 R1178	A1104-E1106 WeakPolarHBondContact CB-OE2 3.35Å; A1104-E1106 PolarHBondContact O-N 2.94Å; E1106-A1110 WeakPolarHBondContact O-CB 3.47Å; E1106-A1110 PolarHBondContact O-N 3.06Å; E1106-Y1174 HydrophobicContact CB-CD2 4.11Å; E1106-Y1174 HydrophobicContact CB-CE2 4.18Å; E1106-A1177 HydrophobicContact CB-CB 3.7Å; E1106-A1177 HydrophobicContact CG-CB 3.79Å; E1106-R1178 HydrophobicContact CB-CG 4.14Å; E1106-R1178 HydrophobicContact CG-CG 3.93Å
1107	E	94.2	Very high	92.8	Very high	22 Å²	22	24.2 Å²	24.2	10%	0.103	14%	0.139	C	C	.	.	H	α-helix	trans	-69.8	-38.4	174.5	-65.1	178.2	135	0	0	111.4	L1103 A1104 A1110 L1111 T1130 L1131 Y1174	L1103-E1107 HydrophobicContact CB-CB 4.1Å; L1103-E1107 HydrophobicContact CD2-CB 4.07Å; A1104-E1107 HydrophobicContact CB-CB 4.37Å; A1104-E1107 HydrophobicContact CB-CG 4.07Å; A1104-E1107 WeakPolarHBondContact CB-OE2 3.39Å; A1104-E1107 PolarHBondContact N-OE2 3.34Å; A1104-E1107 PolarHBondContact O-N 2.89Å; A1104-E1107 VanDerWaalsContact O-N 3.17Å; E1107-A1110 PolarHBondContact O-N 3.23Å; E1107-L1111 WeakPolarHBondContact O-CB 3.38Å; E1107-L1111 PolarHBondContact O-N 3.2Å; E1107-T1130 WeakPolarHBondContact OE1-CB 3.35Å; E1107-T1130 PolarHBondContact OE1-OG1 3.3Å; E1107-L1131 HydrophobicContact CB-CD2 3.74Å; E1107-L1131 HydrophobicContact CB-CG 4.13Å; E1107-L1131 HydrophobicContact CG-CD1 4.33Å; E1107-L1131 HydrophobicContact CG-CD2 4.25Å; E1107-L1131 HydrophobicContact CG-CG 4.06Å; E1107-L1131 WeakPolarHBondContact O-CD2 3.28Å; E1107-Y1174 HydrophobicContact CG-CD2 4.19Å; E1107-Y1174 HydrophobicContact CG-CE2 3.7Å
1108	S	94.5	Very high	92.4	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.4	-43.3	175.3	-59	0	0	0	0	111.9	A1104 P1105 L1111 L1112	A1104-S1108 PolarHBondContact O-N 3.09Å; A1104-S1108 PolarHBondContact O-OG 2.78Å; A1104-S1108 VanDerWaalsContact O-OG 3.05Å; P1105-S1108 PolarHBondContact O-N 3.12Å; S1108-L1111 PolarHBondContact O-N 3.34Å; S1108-L1112 WeakPolarHBondContact O-CB 3.36Å; S1108-L1112 VanDerWaalsContact O-CG 3.32Å; S1108-L1112 WeakPolarHBondContact O-CG 3.43Å; S1108-L1112 PolarHBondContact O-N 2.74Å; S1108-L1112 VanDerWaalsContact O-N 3.07Å
1109	A	95.1	Very high	92.1	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-61.7	-43.9	173.5	0	0	0	0	0	111.8	P1105 S1113 V1173 L1203 L1207 A1229 I1233	P1105-A1109 PolarHBondContact O-N 3.4Å; A1109-S1113 PolarHBondContact O-N 3.41Å; A1109-V1173 HydrophobicContact CB-CG1 4.19Å; A1109-L1203 HydrophobicContact CB-CD2 4.35Å; A1109-L1203 WeakPolarHBondContact O-CD2 3.35Å; A1109-L1207 HydrophobicContact CB-CD1 4.35Å; A1109-A1229 HydrophobicContact CB-CB 4.37Å; A1109-I1233 HydrophobicContact CB-CG2 4.38Å
1110	A	95	Very high	91.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-60.9	-47.6	177.6	0	0	0	0	0	112.2	E1106 E1107 S1113 L1131 T1170 Y1174	E1106-A1110 WeakPolarHBondContact O-CB 3.47Å; E1106-A1110 PolarHBondContact O-N 3.06Å; E1107-A1110 PolarHBondContact O-N 3.23Å; A1110-S1113 VanDerWaalsContact O-CB 3.31Å; A1110-S1113 WeakPolarHBondContact O-CB 3.42Å; A1110-S1113 PolarHBondContact O-N 3.25Å; A1110-S1113 PolarHBondContact O-OG 3.32Å; A1110-L1131 HydrophobicContact CB-CD1 4.26Å; A1110-L1131 HydrophobicContact CB-CD2 4.24Å; A1110-T1170 HydrophobicContact CB-CG2 3.92Å; A1110-T1170 WeakPolarHBondContact CB-O 3.36Å; A1110-Y1174 HydrophobicContact CB-CD2 4.48Å
1111	L	94.4	Very high	91	Very high	3 Å²	3	31.2 Å²	31.2	2%	0.016	18%	0.183	C	C	.	.	H	α-helix	trans	-61.5	-47.4	179	-173.2	70.3	0	0	0	111.7	V1099 L1100 L1103 E1107 S1108 S1113 C1114 L1131 I1135 V1138	V1099-L1111 HydrophobicContact CG1-CD2 4.39Å; L1100-L1111 HydrophobicContact CD2-CD2 4.06Å; L1103-L1111 HydrophobicContact CD1-CD2 3.81Å; E1107-L1111 WeakPolarHBondContact O-CB 3.38Å; E1107-L1111 PolarHBondContact O-N 3.2Å; S1108-L1111 PolarHBondContact O-N 3.34Å; L1111-S1113 PolarHBondContact O-N 3.15Å; L1111-S1113 VanDerWaalsContact O-N 3.16Å; L1111-C1114 PolarHBondContact O-N 3.29Å; L1111-C1114 PolarHBondContact O-SG 3.29Å; L1111-L1131 HydrophobicContact CB-CD2 4.4Å; L1111-I1135 HydrophobicContact CD1-CG1 3.76Å; L1111-V1138 HydrophobicContact CD1-CG2 3.9Å; L1111-V1138 HydrophobicContact CD2-CG2 4.01Å; L1111-V1138 HydrophobicContact CG-CG2 4.08Å
1112	L	94.5	Very high	90.5	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-68.3	-12.1	-178.5	-68.7	172.8	0	0	0	113.8	L1091 L1100 S1108 C1114 L1115 L1203 L1207 V1210 M1226	L1091-L1112 HydrophobicContact CD1-CD2 3.5Å; L1091-L1112 VanDerWaalsContact CD1-CD2 3.5Å; L1100-L1112 HydrophobicContact CD1-CD1 4.44Å; L1100-L1112 HydrophobicContact CD2-CD2 4.44Å; L1100-L1112 HydrophobicContact CD2-CG 4.41Å; S1108-L1112 WeakPolarHBondContact O-CB 3.36Å; S1108-L1112 VanDerWaalsContact O-CG 3.32Å; S1108-L1112 WeakPolarHBondContact O-CG 3.43Å; S1108-L1112 PolarHBondContact O-N 2.74Å; S1108-L1112 VanDerWaalsContact O-N 3.07Å; L1112-C1114 PolarHBondContact O-N 3.16Å; L1112-L1115 HydrophobicContact CD2-CD1 3.81Å; L1112-L1115 PolarHBondContact O-N 2.76Å; L1112-L1203 HydrophobicContact CB-CD1 3.73Å; L1112-L1207 HydrophobicContact CD1-CD2 3.75Å; L1112-V1210 HydrophobicContact CD1-CG2 4.26Å; L1112-M1226 HydrophobicContact CD1-SD 4.26Å
1113	S	94.1	Very high	90.1	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-60.9	-25.4	174.5	75.4	0	0	0	0	113.4	A1109 A1110 L1111 L1115 V1116 F1117	A1109-S1113 PolarHBondContact O-N 3.41Å; A1110-S1113 VanDerWaalsContact O-CB 3.31Å; A1110-S1113 WeakPolarHBondContact O-CB 3.42Å; A1110-S1113 PolarHBondContact O-N 3.25Å; A1110-S1113 PolarHBondContact O-OG 3.32Å; L1111-S1113 PolarHBondContact O-N 3.15Å; L1111-S1113 VanDerWaalsContact O-N 3.16Å; S1113-L1115 PolarHBondContact O-N 2.96Å; S1113-V1116 PolarHBondContact O-N 2.91Å; S1113-V1116 VanDerWaalsContact O-N 3.14Å; S1113-F1117 WeakPolarHBondContact O-CB 3.19Å; S1113-F1117 PolarHBondContact O-N 3.43Å
1114	C	92.3	Very high	89.4	Confident	3 Å²	3	44.3 Å²	44.3	2%	0.02	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-68.6	-19.9	-179.3	75.2	0	0	0	0	114.5	L1111 L1112 V1116 K1166 F1167	L1111-C1114 PolarHBondContact O-N 3.29Å; L1111-C1114 PolarHBondContact O-SG 3.29Å; L1112-C1114 PolarHBondContact O-N 3.16Å; C1114-V1116 VanDerWaalsContact C-N 3.28Å; C1114-K1166 WeakPolarHBondContact CA-O 3.46Å; C1114-K1166 PolarHBondContact O-N 3.03Å; C1114-F1167 HydrophobicContact CB-CD1 3.57Å; C1114-F1167 HydrophobicContact CB-CE1 3.4Å; C1114-F1167 HydrophobicContact CB-CE2 4.46Å; C1114-F1167 HydrophobicContact CB-CG 4.2Å; C1114-F1167 HydrophobicContact CB-CZ 3.89Å; C1114-F1167 VanDerWaalsContact SG-CE1 3.54Å
1115	L	90.9	Very high	88.9	Confident	10 Å²	10	44.3 Å²	44.3	5%	0.052	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-79.3	-13.8	176.1	-55.4	179.2	0	0	0	112.6	H1087 L1090 L1091 L1112 S1113 F1165 V1206	H1087-L1115 HydrophobicContact CB-CD2 4.29Å; H1087-L1115 PolarHBondContact CD2-O 2.91Å; L1090-L1115 HydrophobicContact CD2-CD2 3.81Å; L1091-L1115 HydrophobicContact CB-CD1 4.34Å; L1091-L1115 HydrophobicContact CD1-CD1 4Å; L1091-L1115 HydrophobicContact CD2-CD1 4.16Å; L1091-L1115 HydrophobicContact CG-CD1 4.41Å; L1112-L1115 HydrophobicContact CD2-CD1 3.81Å; L1112-L1115 PolarHBondContact O-N 2.76Å; S1113-L1115 PolarHBondContact O-N 2.96Å; L1115-F1165 HydrophobicContact CD2-CD1 3.78Å; L1115-F1165 HydrophobicContact CD2-CE1 3.72Å; L1115-V1206 HydrophobicContact CD1-CG1 4.48Å
1116	V	90.7	Very high	88.2	Confident	15 Å²	15	50.3 Å²	50.3	9%	0.091	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.4	-30.8	-170.2	173.6	0	0	0	0	111.8	S1113 C1114 R1202 V1206	S1113-V1116 PolarHBondContact O-N 2.91Å; S1113-V1116 VanDerWaalsContact O-N 3.14Å; C1114-V1116 VanDerWaalsContact C-N 3.28Å; V1116-R1202 HydrophobicContact CG1-CB 3.33Å; V1116-R1202 HydrophobicContact CG1-CG 4.29Å; V1116-R1202 HydrophobicContact CG2-CB 4.4Å; V1116-V1206 HydrophobicContact CG2-CG2 3.75Å
1117	F	90.8	Very high	87.8	Confident	6 Å²	6	50.3 Å²	50.3	3%	0.026	26%	0.259	C	S	.	.			trans	-86.3	124.2	-178.1	-176	-119.4	0	0	0	111.8	S1113 Q1119 T1121 K1166 L1169 V1191	S1113-F1117 WeakPolarHBondContact O-CB 3.19Å; S1113-F1117 PolarHBondContact O-N 3.43Å; F1117-Q1119 WeakPolarHBondContact CE1-O 3.35Å; F1117-Q1119 HydrophobicContact CE2-CB 3.82Å; F1117-Q1119 HydrophobicContact CZ-CB 3.8Å; F1117-Q1119 WeakPolarHBondContact CZ-O 3.3Å; F1117-T1121 HydrophobicContact CE1-CG2 3.82Å; F1117-T1121 HydrophobicContact CZ-CG2 3.65Å; F1117-K1166 HydrophobicContact CD1-CB 3.64Å; F1117-K1166 HydrophobicContact CE1-CB 4.15Å; F1117-K1166 WeakPolarHBondContact O-CB 3.27Å; F1117-L1169 HydrophobicContact CD1-CG 4.18Å; F1117-L1169 HydrophobicContact CD2-CD1 3.36Å; F1117-L1169 HydrophobicContact CD2-CG 3.82Å; F1117-L1169 HydrophobicContact CE1-CG 4.13Å; F1117-L1169 HydrophobicContact CE2-CD1 3.54Å; F1117-L1169 HydrophobicContact CE2-CG 3.77Å; F1117-L1169 HydrophobicContact CG-CB 4.43Å; F1117-L1169 HydrophobicContact CG-CD1 3.94Å; F1117-L1169 HydrophobicContact CG-CG 4.04Å; F1117-L1169 HydrophobicContact CZ-CD1 4.24Å; F1117-L1169 HydrophobicContact CZ-CG 3.94Å; F1117-V1191 HydrophobicContact CE2-CG1 4.42Å; F1117-V1191 HydrophobicContact CE2-CG2 4.2Å; F1117-V1191 HydrophobicContact CZ-CG2 3.92Å
1118	T	83.9	Confident	87.5	Confident	102 Å²	102	51.3 Å²	51.3	63%	0.626	27%	0.266	S	S	*	.			trans	-119.3	-4.5	-172.7	58.3	0	0	0	0	114.8
1119	Q	83.9	Confident	87.2	Confident	58 Å²	58	56.2 Å²	56.2	27%	0.271	30%	0.301	S	S	.	.	S	Bend	trans	-90.1	153.2	-179.7	-73.7	169.1	62.9	0	0	110.5	F1117 T1195	F1117-Q1119 WeakPolarHBondContact CE1-O 3.35Å; F1117-Q1119 HydrophobicContact CE2-CB 3.82Å; F1117-Q1119 HydrophobicContact CZ-CB 3.8Å; F1117-Q1119 WeakPolarHBondContact CZ-O 3.3Å; Q1119-T1195 VanDerWaalsContact NE2-CG2 3.25Å
1120	N	80.1	Confident	86.8	Confident	129 Å²	129	59.2 Å²	59.2	69%	0.69	32%	0.319	S	S	*	.			trans	-87.1	137.3	169.4	-62.4	-37.7	0	0	0	108.7	K1166	N1120-K1166 VanDerWaalsContact OD1-CE 3.29Å; N1120-K1166 WeakPolarHBondContact OD1-CE 3.31Å; N1120-K1166 PolarHBondContact OD1-NZ 2.94Å
1121	T	81.6	Confident	86.6	Confident	40 Å²	40	59.3 Å²	59.3	25%	0.245	32%	0.319	C	S	.	.			trans	-104.1	152.2	174.8	55.5	0	0	0	0	110.5	F1117 T1123 D1190 V1191	F1117-T1121 HydrophobicContact CE1-CG2 3.82Å; F1117-T1121 HydrophobicContact CZ-CG2 3.65Å; T1121-T1123 PolarHBondContact OG1-O 3.02Å; T1121-D1190 WeakPolarHBondContact CB-OD1 3.5Å; T1121-V1191 HydrophobicContact CG2-CG2 3.55Å
1122	Q	77.2	Confident	86.4	Confident	186 Å²	186	65.5 Å²	65.5	87%	0.869	35%	0.346	S	S	*	.	S	Bend	trans	-92.5	-21.7	169.5	-59.6	-175.4	13.1	0	0	112.2	D1190	Q1122-D1190 WeakPolarHBondContact CB-OD2 3.48Å; Q1122-D1190 PolarHBondContact N-OD2 3.47Å
1123	T	82.6	Confident	86.3	Confident	54 Å²	54	70.3 Å²	70.3	33%	0.331	37%	0.369	S	S	.	.	S	Bend	trans	-81.9	128.2	174.1	53.3	0	0	0	0	110.8	T1121 D1190	T1121-T1123 PolarHBondContact OG1-O 3.02Å; T1123-D1190 HydrophobicContact CG2-CB 4.34Å; T1123-D1190 PolarHBondContact OG1-OD1 2.92Å
1124	E	78.3	Confident	86.1	Confident	180 Å²	180	70.7 Å²	70.7	84%	0.841	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-82.1	126.3	168.8	-68.3	-171.7	170.8	0	0	110.2
1125	P	82	Confident	86.1	Confident	35 Å²	35	71.2 Å²	71.2	23%	0.227	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-75.7	141.7	-178.4	29.5	-35.8	0	0	0	113	I1127 E1171	P1125-I1127 HydrophobicContact CB-CD1 4.21Å; P1125-I1127 HydrophobicContact CB-CG1 4.08Å; P1125-I1127 HydrophobicContact CG-CD1 3.69Å; P1125-I1127 HydrophobicContact CG-CG1 4.12Å; P1125-I1127 PolarHBondContact O-N 3.49Å; P1125-E1171 WeakPolarHBondContact CA-OE2 3.41Å; P1125-E1171 HydrophobicContact CB-CB 3.77Å
1126	H	81.9	Confident	86.2	Confident	154 Å²	154	75 Å²	75	71%	0.713	39%	0.394	S	S	*	.			trans	-80.5	112.2	168.9	-65.6	-52.8	0	0	0	110.7	E1171	H1126-E1171 PolarHBondContact N-OE2 3.27Å
1127	I	85.6	Confident	86.3	Confident	58 Å²	58	79.4 Å²	79.4	30%	0.297	41%	0.409	S	S	.	.			trans	-118.7	142.2	-170.9	-61.7	169.5	0	0	0	110.3	P1125 L1131 K1132 I1135 T1170	P1125-I1127 HydrophobicContact CB-CD1 4.21Å; P1125-I1127 HydrophobicContact CB-CG1 4.08Å; P1125-I1127 HydrophobicContact CG-CD1 3.69Å; P1125-I1127 HydrophobicContact CG-CG1 4.12Å; P1125-I1127 PolarHBondContact O-N 3.49Å; I1127-L1131 HydrophobicContact CG2-CB 3.29Å; I1127-L1131 HydrophobicContact CG2-CD1 4.27Å; I1127-L1131 HydrophobicContact CG2-CG 4.42Å; I1127-K1132 HydrophobicContact CG2-CB 4.43Å; I1127-I1135 HydrophobicContact CD1-CD1 3.75Å; I1127-I1135 HydrophobicContact CG2-CD1 4.21Å; I1127-T1170 HydrophobicContact CD1-CG2 4.49Å
1128	T	87.8	Confident	86.5	Confident	43 Å²	43	79.1 Å²	79.1	26%	0.264	41%	0.408	S	S	.	.			trans	-67.8	158.1	174.7	58.4	0	0	0	0	111.9	T1130 L1131 K1132 Y1174	T1128-T1130 VanDerWaalsContact C-N 3.29Å; T1128-T1130 PolarHBondContact O-N 3.13Å; T1128-T1130 PolarHBondContact OG1-OG1 2.93Å; T1128-L1131 PolarHBondContact O-N 2.81Å; T1128-L1131 WeakPolarHBondContact OG1-CB 3.37Å; T1128-L1131 WeakPolarHBondContact OG1-CG 3.49Å; T1128-L1131 PolarHBondContact OG1-N 2.8Å; T1128-K1132 PolarHBondContact O-N 2.92Å; T1128-Y1174 HydrophobicContact CG2-CE1 4.33Å
1129	S	87.4	Confident	87	Confident	103 Å²	103	76.8 Å²	76.8	72%	0.72	39%	0.391	S	S	*	.	H	α-helix	trans	-58.9	-39.4	177.3	47.7	0	0	0	0	113	K1132 E1133	S1129-K1132 PolarHBondContact O-N 3.27Å; S1129-E1133 PolarHBondContact O-N 3.28Å
1130	T	88.8	Confident	87.5	Confident	62 Å²	62	77 Å²	77	38%	0.38	40%	0.399	S	S	.	.	H	α-helix	trans	-60.1	-47.2	175.3	44	0	0	0	0	112.7	E1107 T1128 S1134	E1107-T1130 WeakPolarHBondContact OE1-CB 3.35Å; E1107-T1130 PolarHBondContact OE1-OG1 3.3Å; T1128-T1130 VanDerWaalsContact C-N 3.29Å; T1128-T1130 PolarHBondContact O-N 3.13Å; T1128-T1130 PolarHBondContact OG1-OG1 2.93Å; T1130-S1134 WeakPolarHBondContact O-CB 3.39Å; T1130-S1134 PolarHBondContact O-N 2.99Å; T1130-S1134 VanDerWaalsContact O-N 3.16Å; T1130-S1134 PolarHBondContact O-OG 3.03Å
1131	L	88.9	Confident	88.2	Confident	3 Å²	3	70.9 Å²	70.9	2%	0.016	37%	0.366	C	S	.	.	H	α-helix	trans	-67.7	-39.2	176.3	-80.8	172.6	0	0	0	111.6	E1107 A1110 L1111 I1127 T1128 S1134 I1135 T1170 Y1174	E1107-L1131 HydrophobicContact CB-CD2 3.74Å; E1107-L1131 HydrophobicContact CB-CG 4.13Å; E1107-L1131 HydrophobicContact CG-CD1 4.33Å; E1107-L1131 HydrophobicContact CG-CD2 4.25Å; E1107-L1131 HydrophobicContact CG-CG 4.06Å; E1107-L1131 WeakPolarHBondContact O-CD2 3.28Å; A1110-L1131 HydrophobicContact CB-CD1 4.26Å; A1110-L1131 HydrophobicContact CB-CD2 4.24Å; L1111-L1131 HydrophobicContact CB-CD2 4.4Å; I1127-L1131 HydrophobicContact CG2-CB 3.29Å; I1127-L1131 HydrophobicContact CG2-CD1 4.27Å; I1127-L1131 HydrophobicContact CG2-CG 4.42Å; T1128-L1131 PolarHBondContact O-N 2.81Å; T1128-L1131 WeakPolarHBondContact OG1-CB 3.37Å; T1128-L1131 WeakPolarHBondContact OG1-CG 3.49Å; T1128-L1131 PolarHBondContact OG1-N 2.8Å; L1131-S1134 WeakPolarHBondContact O-CB 3.32Å; L1131-S1134 PolarHBondContact O-N 3.19Å; L1131-I1135 VanDerWaalsContact O-CG1 3.28Å; L1131-I1135 WeakPolarHBondContact O-CG1 3.41Å; L1131-I1135 PolarHBondContact O-N 3.34Å; L1131-T1170 HydrophobicContact CD1-CG2 4.44Å; L1131-Y1174 HydrophobicContact CD1-CD2 4.11Å; L1131-Y1174 HydrophobicContact CD1-CG 4.25Å
1132	K	91.1	Very high	88.8	Confident	133 Å²	133	69 Å²	69	58%	0.578	36%	0.355	S	S	*	.	H	α-helix	trans	-61.6	-48.9	177.8	-175	173.2	179.3	175	0	111.9	I1127 T1128 S1129 S1134 I1135 D1136	I1127-K1132 HydrophobicContact CG2-CB 4.43Å; T1128-K1132 PolarHBondContact O-N 2.92Å; S1129-K1132 PolarHBondContact O-N 3.27Å; K1132-S1134 PolarHBondContact O-N 3.46Å; K1132-I1135 WeakPolarHBondContact O-CB 3.28Å; K1132-I1135 PolarHBondContact O-N 3.3Å; K1132-I1135 VanDerWaalsContact O-N 3.14Å; K1132-D1136 PolarHBondContact O-N 2.96Å
1133	E	91.4	Very high	89.6	Confident	103 Å²	103	65 Å²	65	48%	0.481	34%	0.336	S	S	.	.	H	α-helix	trans	-57.8	-37.8	174.8	-168.1	-167.2	149.6	0	0	111.6	S1129 D1136 R1137	S1129-E1133 PolarHBondContact O-N 3.28Å; E1133-D1136 PolarHBondContact O-N 3.34Å; E1133-R1137 WeakPolarHBondContact O-CG 3.01Å; E1133-R1137 PolarHBondContact O-N 2.96Å; E1133-R1137 VanDerWaalsContact O-N 3.07Å; E1133-R1137 IonicContact OE1-CZ 2.71Å; E1133-R1137 IonicContact OE1-NE 3.4Å; E1133-R1137 PolarHBondContact OE1-NE 2.9Å; E1133-R1137 IonicContact OE1-NH2 3.13Å; E1133-R1137 PolarHBondContact OE1-NH2 3.25Å
1134	S	90.6	Very high	90.2	Very high	8 Å²	8	66.8 Å²	66.8	6%	0.056	34%	0.337	C	S	.	.	H	α-helix	trans	-71	-34.1	178.7	-56.4	0	0	0	0	113	L1103 T1130 L1131 K1132 R1137 V1138	L1103-S1134 WeakPolarHBondContact CD2-OG 3.43Å; T1130-S1134 WeakPolarHBondContact O-CB 3.39Å; T1130-S1134 PolarHBondContact O-N 2.99Å; T1130-S1134 VanDerWaalsContact O-N 3.16Å; T1130-S1134 PolarHBondContact O-OG 3.03Å; L1131-S1134 WeakPolarHBondContact O-CB 3.32Å; L1131-S1134 PolarHBondContact O-N 3.19Å; K1132-S1134 PolarHBondContact O-N 3.46Å; S1134-R1137 PolarHBondContact O-N 2.85Å; S1134-V1138 WeakPolarHBondContact O-CG2 3.25Å; S1134-V1138 PolarHBondContact O-N 3.49Å
1135	I	92.8	Very high	91	Very high	14 Å²	14	58.2 Å²	58.2	7%	0.072	30%	0.297	C	S	.	.	H	α-helix	trans	-64.9	-45	172.2	-70.8	167.6	0	0	0	110.2	L1111 I1127 L1131 K1132 R1137 V1138 L1139 F1167 T1170	L1111-I1135 HydrophobicContact CD1-CG1 3.76Å; I1127-I1135 HydrophobicContact CD1-CD1 3.75Å; I1127-I1135 HydrophobicContact CG2-CD1 4.21Å; L1131-I1135 VanDerWaalsContact O-CG1 3.28Å; L1131-I1135 WeakPolarHBondContact O-CG1 3.41Å; L1131-I1135 PolarHBondContact O-N 3.34Å; K1132-I1135 WeakPolarHBondContact O-CB 3.28Å; K1132-I1135 PolarHBondContact O-N 3.3Å; K1132-I1135 VanDerWaalsContact O-N 3.14Å; I1135-R1137 VanDerWaalsContact C-N 3.26Å; I1135-R1137 PolarHBondContact O-N 3.07Å; I1135-V1138 PolarHBondContact O-N 3.46Å; I1135-V1138 VanDerWaalsContact O-N 3.09Å; I1135-L1139 HydrophobicContact CG2-CD1 4.01Å; I1135-L1139 HydrophobicContact CG2-CG 4.44Å; I1135-L1139 WeakPolarHBondContact O-CG 3.3Å; I1135-L1139 PolarHBondContact O-N 2.86Å; I1135-F1167 HydrophobicContact CB-CD1 4.41Å; I1135-F1167 HydrophobicContact CB-CE1 4.21Å; I1135-F1167 HydrophobicContact CD1-CD1 3.84Å; I1135-F1167 HydrophobicContact CD1-CE1 4.42Å; I1135-F1167 HydrophobicContact CD1-CG 4.31Å; I1135-F1167 HydrophobicContact CG1-CD1 3.65Å; I1135-F1167 HydrophobicContact CG1-CE1 3.72Å; I1135-F1167 HydrophobicContact CG1-CG 4.42Å; I1135-F1167 HydrophobicContact CG2-CD1 3.98Å; I1135-F1167 HydrophobicContact CG2-CD2 4.1Å; I1135-F1167 HydrophobicContact CG2-CE1 3.84Å; I1135-F1167 HydrophobicContact CG2-CE2 3.99Å; I1135-F1167 HydrophobicContact CG2-CG 4.11Å; I1135-F1167 HydrophobicContact CG2-CZ 3.85Å; I1135-T1170 HydrophobicContact CD1-CG2 4.42Å
1136	D	92.9	Very high	91.5	Very high	89 Å²	89	56.6 Å²	56.6	48%	0.476	29%	0.286	S	S	.	.	H	α-helix	trans	-60.9	-36.2	177.2	-65.1	-27.9	0	0	0	111.3	K1132 E1133 S1140	K1132-D1136 PolarHBondContact O-N 2.96Å; E1133-D1136 PolarHBondContact O-N 3.34Å; D1136-S1140 PolarHBondContact O-N 2.7Å
1137	R	92.8	Very high	92.1	Very high	107 Å²	107	53.3 Å²	53.3	40%	0.404	27%	0.271	S	S	.	.	H	α-helix	trans	-66.7	-42.5	170.6	-68.3	175.4	-172.8	-142.7	7.8	113.1	V1099 E1133 S1134 I1135 L1139 S1140 V1141	V1099-R1137 HydrophobicContact CG1-CB 4.47Å; E1133-R1137 WeakPolarHBondContact O-CG 3.01Å; E1133-R1137 PolarHBondContact O-N 2.96Å; E1133-R1137 VanDerWaalsContact O-N 3.07Å; E1133-R1137 IonicContact OE1-CZ 2.71Å; E1133-R1137 IonicContact OE1-NE 3.4Å; E1133-R1137 PolarHBondContact OE1-NE 2.9Å; E1133-R1137 IonicContact OE1-NH2 3.13Å; E1133-R1137 PolarHBondContact OE1-NH2 3.25Å; S1134-R1137 PolarHBondContact O-N 2.85Å; I1135-R1137 VanDerWaalsContact C-N 3.26Å; I1135-R1137 PolarHBondContact O-N 3.07Å; R1137-L1139 VanDerWaalsContact C-N 3.3Å; R1137-L1139 PolarHBondContact O-N 3.08Å; R1137-S1140 PolarHBondContact O-N 2.77Å; R1137-S1140 PolarHBondContact O-OG 2.7Å; R1137-V1141 WeakPolarHBondContact O-CG2 3.48Å; R1137-V1141 PolarHBondContact O-N 3.32Å
1138	V	94	Very high	92.5	Very high	1 Å²	1	52 Å²	52	1%	0.006	27%	0.265	C	S	.	.	H	α-helix	trans	-60.9	-42.4	175.5	171.6	0	0	0	0	111	L1090 L1094 L1111 S1134 I1135 A1142 F1167	L1090-V1138 HydrophobicContact CD2-CG1 4.24Å; L1094-V1138 HydrophobicContact CD1-CG1 4.48Å; L1094-V1138 HydrophobicContact CD1-CG2 3.92Å; L1094-V1138 HydrophobicContact CD2-CB 4.48Å; L1094-V1138 HydrophobicContact CD2-CG2 3.79Å; L1111-V1138 HydrophobicContact CD1-CG2 3.9Å; L1111-V1138 HydrophobicContact CD2-CG2 4.01Å; L1111-V1138 HydrophobicContact CG-CG2 4.08Å; S1134-V1138 WeakPolarHBondContact O-CG2 3.25Å; S1134-V1138 PolarHBondContact O-N 3.49Å; I1135-V1138 PolarHBondContact O-N 3.46Å; I1135-V1138 VanDerWaalsContact O-N 3.09Å; V1138-A1142 VanDerWaalsContact O-CB 3.31Å; V1138-A1142 WeakPolarHBondContact O-CB 3.27Å; V1138-A1142 PolarHBondContact O-N 3.37Å; V1138-F1167 HydrophobicContact CB-CZ 4.49Å; V1138-F1167 HydrophobicContact CG1-CZ 4.11Å
1139	L	94.4	Very high	92.8	Very high	53 Å²	53	50.3 Å²	50.3	28%	0.277	25%	0.254	S	S	.	.	H	α-helix	trans	-64.7	-41.2	177.7	-70.2	171.5	0	0	0	112.2	I1135 R1137 A1142 Q1143 V1162 F1167	I1135-L1139 HydrophobicContact CG2-CD1 4.01Å; I1135-L1139 HydrophobicContact CG2-CG 4.44Å; I1135-L1139 WeakPolarHBondContact O-CG 3.3Å; I1135-L1139 PolarHBondContact O-N 2.86Å; R1137-L1139 VanDerWaalsContact C-N 3.3Å; R1137-L1139 PolarHBondContact O-N 3.08Å; L1139-A1142 PolarHBondContact O-N 2.96Å; L1139-Q1143 WeakPolarHBondContact O-CB 3.47Å; L1139-Q1143 PolarHBondContact O-N 3.43Å; L1139-V1162 HydrophobicContact CD2-CG1 3.58Å; L1139-F1167 HydrophobicContact CD2-CE2 3.94Å; L1139-F1167 HydrophobicContact CD2-CZ 4.47Å; L1139-F1167 HydrophobicContact CG-CE2 4.26Å; L1139-F1167 HydrophobicContact CG-CZ 4.5Å
1140	S	95.1	Very high	93	Very high	62 Å²	62	51.1 Å²	51.1	43%	0.434	24%	0.241	S	C	.	.	H	α-helix	trans	-68.8	-39.6	178.6	71.3	0	0	0	0	112.7	D1136 R1137 Q1143 R1144	D1136-S1140 PolarHBondContact O-N 2.7Å; R1137-S1140 PolarHBondContact O-N 2.77Å; R1137-S1140 PolarHBondContact O-OG 2.7Å; S1140-Q1143 PolarHBondContact O-N 3.41Å; S1140-R1144 WeakPolarHBondContact O-CB 3.2Å; S1140-R1144 PolarHBondContact O-N 3.18Å
1141	V	94.6	Very high	93.2	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.006	26%	0.256	C	S	.	.	H	α-helix	trans	-64.7	-43.8	173.1	177.7	0	0	0	0	111	L1090 E1093 L1094 E1097 R1137 Q1143 R1144 I1145	L1090-V1141 HydrophobicContact CD1-CB 4.02Å; L1090-V1141 HydrophobicContact CD1-CG1 3.64Å; E1093-V1141 HydrophobicContact CB-CG1 3.73Å; L1094-V1141 HydrophobicContact CD2-CB 4.45Å; L1094-V1141 HydrophobicContact CD2-CG2 4.32Å; E1097-V1141 WeakPolarHBondContact OE2-CG2 3.46Å; R1137-V1141 WeakPolarHBondContact O-CG2 3.48Å; R1137-V1141 PolarHBondContact O-N 3.32Å; V1141-Q1143 VanDerWaalsContact C-N 3.33Å; V1141-Q1143 PolarHBondContact O-N 2.88Å; V1141-R1144 PolarHBondContact O-N 3.03Å; V1141-I1145 HydrophobicContact CG1-CD1 3.97Å; V1141-I1145 WeakPolarHBondContact O-CG1 3.38Å; V1141-I1145 PolarHBondContact O-N 3.36Å
1142	A	94.4	Very high	93.3	Very high	0 Å²	0	56 Å²	56	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-61.7	-40.8	175.7	0	0	0	0	0	111.9	L1090 V1138 L1139 I1145 G1146 F1161 V1162 F1165	L1090-A1142 HydrophobicContact CD1-CB 4.23Å; L1090-A1142 HydrophobicContact CD2-CB 4.4Å; V1138-A1142 VanDerWaalsContact O-CB 3.31Å; V1138-A1142 WeakPolarHBondContact O-CB 3.27Å; V1138-A1142 PolarHBondContact O-N 3.37Å; L1139-A1142 PolarHBondContact O-N 2.96Å; A1142-I1145 PolarHBondContact O-N 2.94Å; A1142-G1146 PolarHBondContact O-N 3.24Å; A1142-F1161 HydrophobicContact CB-CD1 4.39Å; A1142-F1161 HydrophobicContact CB-CE1 4.17Å; A1142-F1161 VanDerWaalsContact O-CD1 3.3Å; A1142-F1161 WeakPolarHBondContact O-CD1 3.44Å; A1142-V1162 HydrophobicContact CB-CG2 3.95Å; A1142-F1165 HydrophobicContact CB-CD2 4.08Å; A1142-F1165 HydrophobicContact CB-CE2 3.84Å
1143	Q	95.2	Very high	93.2	Very high	102 Å²	102	51.6 Å²	51.6	48%	0.477	25%	0.254	S	S	.	.	H	α-helix	trans	-64.4	-42.8	175.9	-171.6	177.2	12.6	0	0	111.9	L1139 S1140 V1141 G1146 Q1147 V1162	L1139-Q1143 WeakPolarHBondContact O-CB 3.47Å; L1139-Q1143 PolarHBondContact O-N 3.43Å; S1140-Q1143 PolarHBondContact O-N 3.41Å; V1141-Q1143 VanDerWaalsContact C-N 3.33Å; V1141-Q1143 PolarHBondContact O-N 2.88Å; Q1143-G1146 PolarHBondContact O-N 2.96Å; Q1143-Q1147 WeakPolarHBondContact O-CB 3.31Å; Q1143-Q1147 VanDerWaalsContact O-CG 3.32Å; Q1143-Q1147 WeakPolarHBondContact O-CG 3.5Å; Q1143-Q1147 PolarHBondContact O-N 2.75Å; Q1143-V1162 HydrophobicContact CB-CG2 4.09Å
1144	R	95	Very high	93.1	Very high	91 Å²	91	47.7 Å²	47.7	34%	0.343	24%	0.236	S	C	.	.	H	α-helix	trans	-58.2	-47	174.3	176.8	172.4	66.5	86.2	-5.4	111.7	E1093 E1097 S1140 V1141 Q1147 L1148	E1093-R1144 IonicContact OE2-CZ 3.35Å; E1093-R1144 IonicContact OE2-NH1 2.69Å; E1093-R1144 PolarHBondContact OE2-NH1 2.85Å; E1093-R1144 IonicContact OE2-NH2 3.91Å; E1093-R1144 PolarHBondContact OE2-NH2 3.08Å; E1097-R1144 IonicContact OE1-CZ 2.75Å; E1097-R1144 IonicContact OE1-NE 3.44Å; E1097-R1144 IonicContact OE1-NH2 3.54Å; E1097-R1144 PolarHBondContact OE1-NH2 3.3Å; S1140-R1144 WeakPolarHBondContact O-CB 3.2Å; S1140-R1144 PolarHBondContact O-N 3.18Å; V1141-R1144 PolarHBondContact O-N 3.03Å; R1144-Q1147 PolarHBondContact O-N 3.29Å; R1144-L1148 PolarHBondContact O-N 3.26Å; R1144-L1148 VanDerWaalsContact O-N 3.1Å
1145	I	94.3	Very high	92.8	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-64.2	-46	177.3	-65.9	167	0	0	0	110.8	L1089 L1090 E1093 V1141 A1142 Q1147 L1148 Q1149 F1161	L1089-I1145 HydrophobicContact CB-CD1 4.36Å; L1089-I1145 HydrophobicContact CD1-CG2 4.28Å; L1090-I1145 HydrophobicContact CB-CD1 4.24Å; L1090-I1145 HydrophobicContact CD1-CD1 4.25Å; E1093-I1145 HydrophobicContact CB-CD1 4.47Å; E1093-I1145 HydrophobicContact CG-CD1 4.08Å; V1141-I1145 HydrophobicContact CG1-CD1 3.97Å; V1141-I1145 WeakPolarHBondContact O-CG1 3.38Å; V1141-I1145 PolarHBondContact O-N 3.36Å; A1142-I1145 PolarHBondContact O-N 2.94Å; I1145-Q1147 VanDerWaalsContact C-N 3.33Å; I1145-Q1147 PolarHBondContact O-N 2.72Å; I1145-L1148 PolarHBondContact O-N 3.48Å; I1145-Q1149 HydrophobicContact CG2-CG 4.36Å; I1145-Q1149 WeakPolarHBondContact O-CG 3.32Å; I1145-Q1149 PolarHBondContact O-N 3.06Å; I1145-F1161 HydrophobicContact CB-CE1 4.06Å; I1145-F1161 HydrophobicContact CG2-CE1 3.89Å; I1145-F1161 HydrophobicContact CG2-CZ 3.93Å
1146	G	93.2	Very high	92.5	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-64.9	-32.4	179.8	0	0	0	0	0	113.9	A1142 Q1143 R1150	A1142-G1146 PolarHBondContact O-N 3.24Å; Q1143-G1146 PolarHBondContact O-N 2.96Å; G1146-R1150 PolarHBondContact O-N 3.47Å
1147	Q	94.7	Very high	92.1	Very high	85 Å²	85	52.3 Å²	52.3	40%	0.397	27%	0.274	S	S	.	.	H	α-helix	trans	-66.9	-49.7	171.2	-75.1	170.8	-8.5	0	0	111.2	Q1143 R1144 I1145 Q1149 R1150 E1151 A1158	Q1143-Q1147 WeakPolarHBondContact O-CB 3.31Å; Q1143-Q1147 VanDerWaalsContact O-CG 3.32Å; Q1143-Q1147 WeakPolarHBondContact O-CG 3.5Å; Q1143-Q1147 PolarHBondContact O-N 2.75Å; R1144-Q1147 PolarHBondContact O-N 3.29Å; I1145-Q1147 VanDerWaalsContact C-N 3.33Å; I1145-Q1147 PolarHBondContact O-N 2.72Å; Q1147-Q1149 VanDerWaalsContact C-N 3.33Å; Q1147-Q1149 PolarHBondContact O-N 3.32Å; Q1147-R1150 WeakPolarHBondContact O-CB 3.2Å; Q1147-R1150 PolarHBondContact O-N 3.1Å; Q1147-R1150 VanDerWaalsContact O-N 3.13Å; Q1147-E1151 WeakPolarHBondContact O-CG 3.23Å; Q1147-E1151 PolarHBondContact O-N 3.31Å; Q1147-A1158 HydrophobicContact CG-CB 4.27Å
1148	L	93.7	Very high	91.8	Very high	31 Å²	31	47.6 Å²	47.6	16%	0.162	26%	0.258	C	S	.	.	H	α-helix	trans	-61.6	-38	179.1	-178	65.8	0	0	0	112.9	L1065 R1144 I1145 R1150 E1151 C1152	L1065-L1148 HydrophobicContact CD1-CD2 4.26Å; L1065-L1148 HydrophobicContact CD2-CD2 3.5Å; L1065-L1148 HydrophobicContact CG-CD2 3.57Å; R1144-L1148 PolarHBondContact O-N 3.26Å; R1144-L1148 VanDerWaalsContact O-N 3.1Å; I1145-L1148 PolarHBondContact O-N 3.48Å; L1148-R1150 VanDerWaalsContact C-N 3.34Å; L1148-R1150 PolarHBondContact O-N 3.39Å; L1148-E1151 PolarHBondContact O-N 3.22Å; L1148-C1152 WeakPolarHBondContact O-CB 3.39Å; L1148-C1152 PolarHBondContact O-N 3.3Å; L1148-C1152 PolarHBondContact O-SG 2.87Å
1149	Q	93.3	Very high	91.6	Very high	8 Å²	8	55.3 Å²	55.3	4%	0.037	29%	0.294	C	S	.	.	H	α-helix	trans	-60.3	-44.2	174.5	-76.3	-179.4	-16.3	0	0	111.6	Y754 V1061 I1145 Q1147 C1152 G1153 I1154	Y754-Q1149 PolarHBondContact OH-NE2 3.02Å; Y754-Q1149 VanDerWaalsContact OH-NE2 3.15Å; V1061-Q1149 HydrophobicContact CG1-CG 4.34Å; V1061-Q1149 HydrophobicContact CG2-CG 4.29Å; I1145-Q1149 HydrophobicContact CG2-CG 4.36Å; I1145-Q1149 WeakPolarHBondContact O-CG 3.32Å; I1145-Q1149 PolarHBondContact O-N 3.06Å; Q1147-Q1149 VanDerWaalsContact C-N 3.33Å; Q1147-Q1149 PolarHBondContact O-N 3.32Å; Q1149-C1152 PolarHBondContact O-N 3.14Å; Q1149-G1153 PolarHBondContact O-N 2.84Å; Q1149-I1154 HydrophobicContact CB-CB 4.29Å; Q1149-I1154 HydrophobicContact CB-CD1 4.13Å; Q1149-I1154 HydrophobicContact CG-CD1 4.11Å; Q1149-I1154 WeakPolarHBondContact O-CB 3.45Å; Q1149-I1154 PolarHBondContact O-N 3.46Å
1150	R	91.7	Very high	91.2	Very high	119 Å²	119	58.2 Å²	58.2	45%	0.449	31%	0.306	S	S	.	.	H	α-helix	trans	-64.2	-43.6	175.3	-176.2	-169.2	-71.6	157.5	-11.6	111.9	G1146 Q1147 L1148 C1152 G1153	G1146-R1150 PolarHBondContact O-N 3.47Å; Q1147-R1150 WeakPolarHBondContact O-CB 3.2Å; Q1147-R1150 PolarHBondContact O-N 3.1Å; Q1147-R1150 VanDerWaalsContact O-N 3.13Å; L1148-R1150 VanDerWaalsContact C-N 3.34Å; L1148-R1150 PolarHBondContact O-N 3.39Å; R1150-C1152 PolarHBondContact O-N 2.83Å; R1150-G1153 PolarHBondContact O-N 3.33Å
1151	E	92.9	Very high	90.9	Very high	150 Å²	150	56 Å²	56	70%	0.701	29%	0.289	S	S	*	.	H	α-helix	trans	-60.1	-34.4	175.8	-71.8	168.8	-172	0	0	112.3	Q1147 L1148 G1153	Q1147-E1151 WeakPolarHBondContact O-CG 3.23Å; Q1147-E1151 PolarHBondContact O-N 3.31Å; L1148-E1151 PolarHBondContact O-N 3.22Å; E1151-G1153 PolarHBondContact O-N 3.18Å
1152	C	91.8	Very high	90.7	Very high	19 Å²	19	57.5 Å²	57.5	13%	0.128	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-2.6	174.8	-64.8	0	0	0	0	114.2	Q1057 K1060 V1061 L1148 Q1149 R1150	Q1057-C1152 WeakPolarHBondContact CG-O 3.4Å; K1060-C1152 HydrophobicContact CB-CB 4.35Å; V1061-C1152 HydrophobicContact CG2-CB 3.51Å; L1148-C1152 WeakPolarHBondContact O-CB 3.39Å; L1148-C1152 PolarHBondContact O-N 3.3Å; L1148-C1152 PolarHBondContact O-SG 2.87Å; Q1149-C1152 PolarHBondContact O-N 3.14Å; R1150-C1152 PolarHBondContact O-N 2.83Å
1153	G	88.3	Confident	90.4	Very high	40 Å²	40	59.2 Å²	59.2	41%	0.412	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	95	10.4	176.1	0	0	0	0	0	115.9	Q1057 Q1149 R1150 E1151	Q1057-G1153 PolarHBondContact NE2-O 3.1Å; Q1057-G1153 PolarHBondContact OE1-O 3.23Å; Q1149-G1153 PolarHBondContact O-N 2.84Å; R1150-G1153 PolarHBondContact O-N 3.33Å; E1151-G1153 PolarHBondContact O-N 3.18Å
1154	I	89.9	Confident	90.1	Very high	21 Å²	21	58.1 Å²	58.1	11%	0.108	31%	0.31	C	S	.	.			trans	-74.7	134	175.4	-59.6	177.8	0	0	0	109.2	Y754 Q1057 R1058 V1061 Q1149 Q1156	Y754-I1154 VanDerWaalsContact OH-CD1 3.28Å; Y754-I1154 WeakPolarHBondContact OH-CD1 3.5Å; Q1057-I1154 HydrophobicContact CB-CG1 4.18Å; R1058-I1154 HydrophobicContact CG-CD1 4.3Å; V1061-I1154 HydrophobicContact CG2-CD1 3.9Å; Q1149-I1154 HydrophobicContact CB-CB 4.29Å; Q1149-I1154 HydrophobicContact CB-CD1 4.13Å; Q1149-I1154 HydrophobicContact CG-CD1 4.11Å; Q1149-I1154 WeakPolarHBondContact O-CB 3.45Å; Q1149-I1154 PolarHBondContact O-N 3.46Å; I1154-Q1156 VanDerWaalsContact C-N 3.29Å; I1154-Q1156 HydrophobicContact CG2-CB 4.42Å; I1154-Q1156 PolarHBondContact O-N 3.21Å
1155	A	83.3	Confident	89.9	Confident	103 Å²	103	54.2 Å²	54.2	85%	0.851	30%	0.295	S	S	*	.	S	Bend	trans	-69.2	-18.5	-171.3	0	0	0	0	0	115.5
1156	Q	86.2	Confident	89.7	Confident	59 Å²	59	57 Å²	57	28%	0.276	31%	0.308	S	S	.	.	S	Bend	trans	-68.9	137.7	-179.1	-174.7	174.9	6.7	0	0	111.4	I1154 E1160	I1154-Q1156 VanDerWaalsContact C-N 3.29Å; I1154-Q1156 HydrophobicContact CG2-CB 4.42Å; I1154-Q1156 PolarHBondContact O-N 3.21Å; Q1156-E1160 HydrophobicContact CG-CB 4.13Å
1157	T	85.7	Confident	89.6	Confident	46 Å²	46	58.6 Å²	58.6	28%	0.282	32%	0.315	S	S	.	.			trans	-80.5	150.8	174.8	68.2	0	0	0	0	112.3	E1159 E1160 F1161	T1157-E1159 PolarHBondContact O-N 2.66Å; T1157-E1160 WeakPolarHBondContact CB-OE2 3.4Å; T1157-E1160 WeakPolarHBondContact CG2-OE2 3.43Å; T1157-E1160 PolarHBondContact N-OE2 2.94Å; T1157-E1160 PolarHBondContact O-N 2.8Å; T1157-E1160 WeakPolarHBondContact OG1-CB 3.34Å; T1157-E1160 WeakPolarHBondContact OG1-CG 3.44Å; T1157-E1160 PolarHBondContact OG1-N 2.59Å; T1157-E1160 VanDerWaalsContact OG1-N 3.17Å; T1157-E1160 PolarHBondContact OG1-OE2 3.08Å; T1157-F1161 PolarHBondContact O-N 3.21Å
1158	A	86.8	Confident	89.3	Confident	8 Å²	8	55 Å²	55	7%	0.066	30%	0.301	C	S	.	.	H	α-helix	trans	-59.9	-32.8	176	0	0	0	0	0	112.6	Q1147 F1161 V1162	Q1147-A1158 HydrophobicContact CG-CB 4.27Å; A1158-F1161 PolarHBondContact O-N 3.12Å; A1158-V1162 VanDerWaalsContact O-CG2 3.3Å; A1158-V1162 WeakPolarHBondContact O-CG2 3.41Å; A1158-V1162 PolarHBondContact O-N 3.34Å
1159	E	88.5	Confident	89.2	Confident	163 Å²	163	53.6 Å²	53.6	76%	0.762	29%	0.293	S	S	*	.	H	α-helix	trans	-70.3	-42	176.6	-69.3	172.5	-153.1	0	0	111.9	T1157 F1161 G1163	T1157-E1159 PolarHBondContact O-N 2.66Å; E1159-F1161 VanDerWaalsContact C-N 3.31Å; E1159-F1161 PolarHBondContact O-N 2.72Å; E1159-G1163 WeakPolarHBondContact O-CA 3.42Å; E1159-G1163 PolarHBondContact O-N 2.94Å
1160	E	87.7	Confident	89.2	Confident	113 Å²	113	53.2 Å²	53.2	53%	0.528	29%	0.291	S	S	.	.	H	α-helix	trans	-63.2	-37.5	172.2	-73.4	158.9	157.3	0	0	111.9	Q1156 T1157 Q1164	Q1156-E1160 HydrophobicContact CG-CB 4.13Å; T1157-E1160 WeakPolarHBondContact CB-OE2 3.4Å; T1157-E1160 WeakPolarHBondContact CG2-OE2 3.43Å; T1157-E1160 PolarHBondContact N-OE2 2.94Å; T1157-E1160 PolarHBondContact O-N 2.8Å; T1157-E1160 WeakPolarHBondContact OG1-CB 3.34Å; T1157-E1160 WeakPolarHBondContact OG1-CG 3.44Å; T1157-E1160 PolarHBondContact OG1-N 2.59Å; T1157-E1160 VanDerWaalsContact OG1-N 3.17Å; T1157-E1160 PolarHBondContact OG1-OE2 3.08Å; E1160-Q1164 WeakPolarHBondContact O-CG 3.36Å
1161	F	88.6	Confident	89.2	Confident	16 Å²	16	48.9 Å²	48.9	7%	0.07	28%	0.276	C	S	.	.	H	α-helix	trans	-66.9	-50.9	177.3	-175.5	-101.7	0	0	0	111.8	A1142 I1145 T1157 A1158 E1159 G1163 Q1164 F1165	A1142-F1161 HydrophobicContact CB-CD1 4.39Å; A1142-F1161 HydrophobicContact CB-CE1 4.17Å; A1142-F1161 VanDerWaalsContact O-CD1 3.3Å; A1142-F1161 WeakPolarHBondContact O-CD1 3.44Å; I1145-F1161 HydrophobicContact CB-CE1 4.06Å; I1145-F1161 HydrophobicContact CG2-CE1 3.89Å; I1145-F1161 HydrophobicContact CG2-CZ 3.93Å; T1157-F1161 PolarHBondContact O-N 3.21Å; A1158-F1161 PolarHBondContact O-N 3.12Å; E1159-F1161 VanDerWaalsContact C-N 3.31Å; E1159-F1161 PolarHBondContact O-N 2.72Å; F1161-G1163 VanDerWaalsContact C-N 3.26Å; F1161-G1163 PolarHBondContact O-N 2.97Å; F1161-Q1164 WeakPolarHBondContact O-CB 3.37Å; F1161-Q1164 WeakPolarHBondContact O-CG 3.48Å; F1161-Q1164 PolarHBondContact O-N 3.1Å; F1161-F1165 HydrophobicContact CD1-CE2 4.29Å; F1161-F1165 HydrophobicContact CE1-CE2 4.03Å; F1161-F1165 HydrophobicContact CE1-CZ 4.3Å; F1161-F1165 HydrophobicContact CZ-CE2 4.35Å; F1161-F1165 HydrophobicContact CZ-CZ 4.17Å; F1161-F1165 VanDerWaalsContact O-CE2 3.31Å; F1161-F1165 WeakPolarHBondContact O-CE2 3.46Å
1162	V	90.7	Very high	89.3	Confident	33 Å²	33	41.9 Å²	41.9	20%	0.2	24%	0.244	C	C	.	.	H	α-helix	trans	-61.8	-36.8	175.5	174.6	0	0	0	0	111.1	L1139 A1142 Q1143 A1158 Q1164 F1165	L1139-V1162 HydrophobicContact CD2-CG1 3.58Å; A1142-V1162 HydrophobicContact CB-CG2 3.95Å; Q1143-V1162 HydrophobicContact CB-CG2 4.09Å; A1158-V1162 VanDerWaalsContact O-CG2 3.3Å; A1158-V1162 WeakPolarHBondContact O-CG2 3.41Å; A1158-V1162 PolarHBondContact O-N 3.34Å; V1162-Q1164 PolarHBondContact O-N 2.98Å; V1162-Q1164 VanDerWaalsContact O-N 3.09Å; V1162-F1165 WeakPolarHBondContact O-CD2 3.39Å; V1162-F1165 PolarHBondContact O-N 2.94Å
1163	G	86.8	Confident	89.4	Confident	35 Å²	35	41 Å²	41	36%	0.361	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-12.1	178.7	0	0	0	0	0	115.4	E1159 F1161 K1166	E1159-G1163 WeakPolarHBondContact O-CA 3.42Å; E1159-G1163 PolarHBondContact O-N 2.94Å; F1161-G1163 VanDerWaalsContact C-N 3.26Å; F1161-G1163 PolarHBondContact O-N 2.97Å; G1163-K1166 WeakPolarHBondContact O-CE 3.36Å; G1163-K1166 PolarHBondContact O-NZ 3.05Å
1164	Q	88.3	Confident	89.8	Confident	79 Å²	79	41 Å²	41	37%	0.369	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-33.3	174.4	-61.4	-176.9	-5	0	0	112.4	H1087 E1160 F1161 V1162	H1087-Q1164 PolarHBondContact CE1-OE1 3.29Å; E1160-Q1164 WeakPolarHBondContact O-CG 3.36Å; F1161-Q1164 WeakPolarHBondContact O-CB 3.37Å; F1161-Q1164 WeakPolarHBondContact O-CG 3.48Å; F1161-Q1164 PolarHBondContact O-N 3.1Å; V1162-Q1164 PolarHBondContact O-N 2.98Å; V1162-Q1164 VanDerWaalsContact O-N 3.09Å
1165	F	90.9	Very high	90	Very high	9 Å²	9	41 Å²	41	4%	0.039	23%	0.227	C	C	.	.			trans	-84.9	119.4	-172.1	-52	-66.4	0	0	0	111.1	H1087 L1090 L1115 A1142 F1161 V1162 F1167	H1087-F1165 HydrophobicContact CB-CE1 4.28Å; H1087-F1165 AromaticContact CE1-CE1 3.81Å; H1087-F1165 AromaticContact CG-CE1 3.74Å; H1087-F1165 AromaticContact ND1-CE1 3.57Å; H1087-F1165 AromaticContact ND1-CZ 3.8Å; L1090-F1165 HydrophobicContact CD2-CD1 3.99Å; L1090-F1165 HydrophobicContact CD2-CD2 4.21Å; L1090-F1165 HydrophobicContact CD2-CE1 3.48Å; L1090-F1165 VanDerWaalsContact CD2-CE1 3.48Å; L1090-F1165 HydrophobicContact CD2-CE2 3.74Å; L1090-F1165 HydrophobicContact CD2-CG 4.34Å; L1090-F1165 HydrophobicContact CD2-CZ 3.35Å; L1115-F1165 HydrophobicContact CD2-CD1 3.78Å; L1115-F1165 HydrophobicContact CD2-CE1 3.72Å; A1142-F1165 HydrophobicContact CB-CD2 4.08Å; A1142-F1165 HydrophobicContact CB-CE2 3.84Å; F1161-F1165 HydrophobicContact CD1-CE2 4.29Å; F1161-F1165 HydrophobicContact CE1-CE2 4.03Å; F1161-F1165 HydrophobicContact CE1-CZ 4.3Å; F1161-F1165 HydrophobicContact CZ-CE2 4.35Å; F1161-F1165 HydrophobicContact CZ-CZ 4.17Å; F1161-F1165 VanDerWaalsContact O-CE2 3.31Å; F1161-F1165 WeakPolarHBondContact O-CE2 3.46Å; V1162-F1165 WeakPolarHBondContact O-CD2 3.39Å; V1162-F1165 PolarHBondContact O-N 2.94Å; F1165-F1167 HydrophobicContact CB-CE2 4.28Å; F1165-F1167 HydrophobicContact CB-CZ 4.41Å
1166	K	90.6	Very high	90.6	Very high	60 Å²	60	36.1 Å²	36.1	26%	0.261	19%	0.187	S	C	.	.			trans	-116.6	120.1	-175.3	-55.6	-60.1	-179.6	-171.4	0	111.6	C1114 F1117 N1120 G1163	C1114-K1166 WeakPolarHBondContact CA-O 3.46Å; C1114-K1166 PolarHBondContact O-N 3.03Å; F1117-K1166 HydrophobicContact CD1-CB 3.64Å; F1117-K1166 HydrophobicContact CE1-CB 4.15Å; F1117-K1166 WeakPolarHBondContact O-CB 3.27Å; N1120-K1166 VanDerWaalsContact OD1-CE 3.29Å; N1120-K1166 WeakPolarHBondContact OD1-CE 3.31Å; N1120-K1166 PolarHBondContact OD1-NZ 2.94Å; G1163-K1166 WeakPolarHBondContact O-CE 3.36Å; G1163-K1166 PolarHBondContact O-NZ 3.05Å
1167	F	90.9	Very high	91	Very high	34 Å²	34	33.7 Å²	33.7	15%	0.149	18%	0.177	C	C	.	.			trans	-91.3	4.3	-176.1	-61.8	-82.9	0	0	0	114.6	C1114 I1135 V1138 L1139 F1165 L1169 T1170	C1114-F1167 HydrophobicContact CB-CD1 3.57Å; C1114-F1167 HydrophobicContact CB-CE1 3.4Å; C1114-F1167 HydrophobicContact CB-CE2 4.46Å; C1114-F1167 HydrophobicContact CB-CG 4.2Å; C1114-F1167 HydrophobicContact CB-CZ 3.89Å; C1114-F1167 VanDerWaalsContact SG-CE1 3.54Å; I1135-F1167 HydrophobicContact CB-CD1 4.41Å; I1135-F1167 HydrophobicContact CB-CE1 4.21Å; I1135-F1167 HydrophobicContact CD1-CD1 3.84Å; I1135-F1167 HydrophobicContact CD1-CE1 4.42Å; I1135-F1167 HydrophobicContact CD1-CG 4.31Å; I1135-F1167 HydrophobicContact CG1-CD1 3.65Å; I1135-F1167 HydrophobicContact CG1-CE1 3.72Å; I1135-F1167 HydrophobicContact CG1-CG 4.42Å; I1135-F1167 HydrophobicContact CG2-CD1 3.98Å; I1135-F1167 HydrophobicContact CG2-CD2 4.1Å; I1135-F1167 HydrophobicContact CG2-CE1 3.84Å; I1135-F1167 HydrophobicContact CG2-CE2 3.99Å; I1135-F1167 HydrophobicContact CG2-CG 4.11Å; I1135-F1167 HydrophobicContact CG2-CZ 3.85Å; V1138-F1167 HydrophobicContact CB-CZ 4.49Å; V1138-F1167 HydrophobicContact CG1-CZ 4.11Å; L1139-F1167 HydrophobicContact CD2-CE2 3.94Å; L1139-F1167 HydrophobicContact CD2-CZ 4.47Å; L1139-F1167 HydrophobicContact CG-CE2 4.26Å; L1139-F1167 HydrophobicContact CG-CZ 4.5Å; F1165-F1167 HydrophobicContact CB-CE2 4.28Å; F1165-F1167 HydrophobicContact CB-CZ 4.41Å; F1167-L1169 VanDerWaalsContact C-N 3.25Å; F1167-L1169 PolarHBondContact O-N 3.01Å; F1167-L1169 VanDerWaalsContact O-N 3.09Å; F1167-T1170 WeakPolarHBondContact O-CB 3.42Å; F1167-T1170 PolarHBondContact O-N 3.39Å; F1167-T1170 PolarHBondContact O-OG1 3.07Å
1168	G	88.8	Confident	91.4	Very high	10 Å²	10	39.7 Å²	39.7	10%	0.103	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-22.4	-172.1	0	0	0	0	0	116.5
1169	L	91.6	Very high	91.6	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	8.3	176	-67.5	-174.9	0	0	0	114.6	F1117 F1167 E1171 V1172 V1173 T1189 V1191 V1196 C1199	F1117-L1169 HydrophobicContact CD1-CG 4.18Å; F1117-L1169 HydrophobicContact CD2-CD1 3.36Å; F1117-L1169 HydrophobicContact CD2-CG 3.82Å; F1117-L1169 HydrophobicContact CE1-CG 4.13Å; F1117-L1169 HydrophobicContact CE2-CD1 3.54Å; F1117-L1169 HydrophobicContact CE2-CG 3.77Å; F1117-L1169 HydrophobicContact CG-CB 4.43Å; F1117-L1169 HydrophobicContact CG-CD1 3.94Å; F1117-L1169 HydrophobicContact CG-CG 4.04Å; F1117-L1169 HydrophobicContact CZ-CD1 4.24Å; F1117-L1169 HydrophobicContact CZ-CG 3.94Å; F1167-L1169 VanDerWaalsContact C-N 3.25Å; F1167-L1169 PolarHBondContact O-N 3.01Å; F1167-L1169 VanDerWaalsContact O-N 3.09Å; L1169-E1171 PolarHBondContact O-N 3.34Å; L1169-V1172 HydrophobicContact CD2-CB 4.22Å; L1169-V1172 HydrophobicContact CD2-CG1 4.49Å; L1169-V1172 HydrophobicContact CD2-CG2 3.95Å; L1169-V1172 PolarHBondContact O-N 3.03Å; L1169-V1173 WeakPolarHBondContact O-CG2 3.39Å; L1169-V1173 PolarHBondContact O-N 2.96Å; L1169-T1189 HydrophobicContact CD2-CG2 4.18Å; L1169-V1191 HydrophobicContact CD2-CB 4.2Å; L1169-V1191 HydrophobicContact CD2-CG2 4.09Å; L1169-V1196 HydrophobicContact CD2-CG2 4.32Å; L1169-C1199 HydrophobicContact CD1-CB 3.94Å
1170	T	92.6	Very high	91.8	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-58.5	-48.5	-175.7	-53.3	0	0	0	0	111.8	A1110 I1127 L1131 I1135 F1167 V1173 Y1174	A1110-T1170 HydrophobicContact CB-CG2 3.92Å; A1110-T1170 WeakPolarHBondContact CB-O 3.36Å; I1127-T1170 HydrophobicContact CD1-CG2 4.49Å; L1131-T1170 HydrophobicContact CD1-CG2 4.44Å; I1135-T1170 HydrophobicContact CD1-CG2 4.42Å; F1167-T1170 WeakPolarHBondContact O-CB 3.42Å; F1167-T1170 PolarHBondContact O-N 3.39Å; F1167-T1170 PolarHBondContact O-OG1 3.07Å; T1170-V1173 PolarHBondContact O-N 3.02Å; T1170-Y1174 WeakPolarHBondContact O-CB 3.44Å; T1170-Y1174 PolarHBondContact O-N 3.22Å
1171	E	93.6	Very high	92	Very high	28 Å²	28	34 Å²	34	13%	0.131	18%	0.184	C	C	.	.	H	α-helix	trans	-62.1	-45.2	176.7	178.7	-178.6	-172.5	0	0	112	P1125 H1126 L1169 V1173 Y1174 C1175 L1188	P1125-E1171 WeakPolarHBondContact CA-OE2 3.41Å; P1125-E1171 HydrophobicContact CB-CB 3.77Å; H1126-E1171 PolarHBondContact N-OE2 3.27Å; L1169-E1171 PolarHBondContact O-N 3.34Å; E1171-V1173 VanDerWaalsContact C-N 3.32Å; E1171-V1173 PolarHBondContact O-N 3.35Å; E1171-Y1174 PolarHBondContact O-N 3.41Å; E1171-C1175 WeakPolarHBondContact O-CB 3.48Å; E1171-C1175 PolarHBondContact O-N 3.02Å; E1171-L1188 HydrophobicContact CG-CD1 4.39Å
1172	V	93.8	Very high	92.2	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.012	18%	0.181	C	C	.	.	H	α-helix	trans	-58	-45.4	-179.7	179.1	0	0	0	0	110.7	L1169 W1176 I1185 L1188 T1189 V1196	L1169-V1172 HydrophobicContact CD2-CB 4.22Å; L1169-V1172 HydrophobicContact CD2-CG1 4.49Å; L1169-V1172 HydrophobicContact CD2-CG2 3.95Å; L1169-V1172 PolarHBondContact O-N 3.03Å; V1172-W1176 VanDerWaalsContact O-CB 3.28Å; V1172-W1176 WeakPolarHBondContact O-CB 3.48Å; V1172-W1176 PolarHBondContact O-N 3.16Å; V1172-I1185 HydrophobicContact CG1-CB 4.14Å; V1172-I1185 HydrophobicContact CG1-CD1 3.96Å; V1172-I1185 HydrophobicContact CG1-CG1 4.32Å; V1172-L1188 HydrophobicContact CG2-CB 4.35Å; V1172-T1189 HydrophobicContact CG2-CG2 3.91Å; V1172-V1196 HydrophobicContact CG1-CG1 3.75Å
1173	V	95	Very high	92.1	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.006	19%	0.187	C	C	.	.	H	α-helix	trans	-70.5	-39.5	178	174.9	0	0	0	0	111.7	A1109 L1169 T1170 E1171 W1176 A1177 I1200 L1203	A1109-V1173 HydrophobicContact CB-CG1 4.19Å; L1169-V1173 WeakPolarHBondContact O-CG2 3.39Å; L1169-V1173 PolarHBondContact O-N 2.96Å; T1170-V1173 PolarHBondContact O-N 3.02Å; E1171-V1173 VanDerWaalsContact C-N 3.32Å; E1171-V1173 PolarHBondContact O-N 3.35Å; V1173-W1176 PolarHBondContact O-N 3.15Å; V1173-A1177 WeakPolarHBondContact O-CB 3.42Å; V1173-A1177 PolarHBondContact O-N 3.42Å; V1173-I1200 HydrophobicContact CG2-CG1 4.3Å; V1173-L1203 HydrophobicContact CG1-CD2 3.51Å; V1173-L1203 HydrophobicContact CG2-CD2 4.41Å
1174	Y	95.1	Very high	92.3	Very high	40 Å²	40	36.7 Å²	36.7	16%	0.157	19%	0.192	C	C	.	.	H	α-helix	trans	-60.1	-51.5	175.5	178.9	-113.2	0	0	0	111.9	E1106 E1107 A1110 T1128 L1131 T1170 E1171 W1176 A1177 R1178	E1106-Y1174 HydrophobicContact CB-CD2 4.11Å; E1106-Y1174 HydrophobicContact CB-CE2 4.18Å; E1107-Y1174 HydrophobicContact CG-CD2 4.19Å; E1107-Y1174 HydrophobicContact CG-CE2 3.7Å; A1110-Y1174 HydrophobicContact CB-CD2 4.48Å; T1128-Y1174 HydrophobicContact CG2-CE1 4.33Å; L1131-Y1174 HydrophobicContact CD1-CD2 4.11Å; L1131-Y1174 HydrophobicContact CD1-CG 4.25Å; T1170-Y1174 WeakPolarHBondContact O-CB 3.44Å; T1170-Y1174 PolarHBondContact O-N 3.22Å; E1171-Y1174 PolarHBondContact O-N 3.41Å; Y1174-W1176 VanDerWaalsContact C-N 3.31Å; Y1174-W1176 PolarHBondContact O-N 3.24Å; Y1174-A1177 PolarHBondContact O-N 3.1Å; Y1174-R1178 HydrophobicContact CE2-CG 4.47Å; Y1174-R1178 WeakPolarHBondContact O-CG 3.2Å; Y1174-R1178 PolarHBondContact O-N 2.95Å; Y1174-R1178 PolarHBondContact OH-NH1 3.37Å
1175	C	94.5	Very high	92.4	Very high	21 Å²	21	33 Å²	33	14%	0.142	18%	0.175	C	C	.	.	H	α-helix	trans	-62.7	-37.7	176.7	-72	0	0	0	0	111.9	E1171 R1178 G1179 M1180 I1185 L1188	E1171-C1175 WeakPolarHBondContact O-CB 3.48Å; E1171-C1175 PolarHBondContact O-N 3.02Å; C1175-R1178 PolarHBondContact O-N 2.88Å; C1175-G1179 PolarHBondContact O-N 3.31Å; C1175-M1180 HydrophobicContact CB-CB 4.23Å; C1175-M1180 HydrophobicContact CB-CE 4.23Å; C1175-M1180 HydrophobicContact CB-SD 3.83Å; C1175-M1180 WeakPolarHBondContact O-CB 3.48Å; C1175-M1180 PolarHBondContact O-N 3.11Å; C1175-M1180 VanDerWaalsContact O-N 3.07Å; C1175-I1185 HydrophobicContact CB-CG2 4.15Å; C1175-L1188 HydrophobicContact CB-CD1 4.39Å
1176	W	95.3	Very high	92.2	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.7	-47.2	173.3	-175.8	-109.7	0	0	0	112.6	V1172 V1173 Y1174 R1178 G1179 F1182 I1185 I1200 I1233 R1235 D1236 I1237 V1238	V1172-W1176 VanDerWaalsContact O-CB 3.28Å; V1172-W1176 WeakPolarHBondContact O-CB 3.48Å; V1172-W1176 PolarHBondContact O-N 3.16Å; V1173-W1176 PolarHBondContact O-N 3.15Å; Y1174-W1176 VanDerWaalsContact C-N 3.31Å; Y1174-W1176 PolarHBondContact O-N 3.24Å; W1176-R1178 VanDerWaalsContact C-N 3.25Å; W1176-R1178 PolarHBondContact O-N 3.01Å; W1176-G1179 PolarHBondContact O-N 3.12Å; W1176-F1182 HydrophobicContact CE3-CD2 4.46Å; W1176-F1182 HydrophobicContact CH2-CB 4.21Å; W1176-F1182 HydrophobicContact CH2-CD2 4.11Å; W1176-F1182 HydrophobicContact CZ3-CB 3.79Å; W1176-F1182 AromaticContact CZ3-CD2 3.92Å; W1176-F1182 HydrophobicContact CZ3-CD2 3.92Å; W1176-F1182 HydrophobicContact CZ3-CG 4.36Å; W1176-I1185 HydrophobicContact CB-CD1 4.17Å; W1176-I1185 HydrophobicContact CD2-CD1 4.11Å; W1176-I1185 HydrophobicContact CE3-CD1 3.6Å; W1176-I1185 HydrophobicContact CE3-CG1 4.49Å; W1176-I1185 HydrophobicContact CG-CD1 4.39Å; W1176-I1185 HydrophobicContact CZ3-CD1 4.29Å; W1176-I1200 HydrophobicContact CG-CD1 4.08Å; W1176-I1233 PolarHBondContact NE1-O 3.3Å; W1176-R1235 HydrophobicContact CH2-CG 4.22Å; W1176-R1235 HydrophobicContact CZ2-CG 3.58Å; W1176-R1235 PolarHBondContact O-NE 2.89Å; W1176-R1235 PolarHBondContact O-NH2 2.86Å; W1176-D1236 HydrophobicContact CH2-CB 3.89Å; W1176-D1236 HydrophobicContact CZ2-CB 4.34Å; W1176-I1237 HydrophobicContact CH2-CG2 4.43Å; W1176-V1238 HydrophobicContact CH2-CG2 3.94Å; W1176-V1238 HydrophobicContact CZ2-CB 4.04Å; W1176-V1238 HydrophobicContact CZ2-CG2 3.33Å
1177	A	94.9	Very high	92.1	Very high	8 Å²	8	38.1 Å²	38.1	7%	0.066	21%	0.209	C	C	.	.	H	α-helix	trans	-62.8	-32.5	178.5	0	0	0	0	0	112.2	E1106 V1173 Y1174 G1179 A1232 I1233	E1106-A1177 HydrophobicContact CB-CB 3.7Å; E1106-A1177 HydrophobicContact CG-CB 3.79Å; V1173-A1177 WeakPolarHBondContact O-CB 3.42Å; V1173-A1177 PolarHBondContact O-N 3.42Å; Y1174-A1177 PolarHBondContact O-N 3.1Å; A1177-G1179 PolarHBondContact O-N 3.43Å; A1177-A1232 HydrophobicContact CB-CB 4.49Å; A1177-I1233 HydrophobicContact CB-CG2 4.11Å
1178	R	94.2	Very high	92.1	Very high	173 Å²	173	39.3 Å²	39.3	65%	0.653	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-1.2	174	-67.3	-171.9	73.8	-177.9	2.5	115.4	E1106 Y1174 C1175 W1176	E1106-R1178 HydrophobicContact CB-CG 4.14Å; E1106-R1178 HydrophobicContact CG-CG 3.93Å; Y1174-R1178 HydrophobicContact CE2-CG 4.47Å; Y1174-R1178 WeakPolarHBondContact O-CG 3.2Å; Y1174-R1178 PolarHBondContact O-N 2.95Å; Y1174-R1178 PolarHBondContact OH-NH1 3.37Å; C1175-R1178 PolarHBondContact O-N 2.88Å; W1176-R1178 VanDerWaalsContact C-N 3.25Å; W1176-R1178 PolarHBondContact O-N 3.01Å
1179	G	92	Very high	92.1	Very high	43 Å²	43	39.5 Å²	39.5	44%	0.443	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	98.6	7.6	174.9	0	0	0	0	0	116.3	C1175 W1176 A1177 R1235	C1175-G1179 PolarHBondContact O-N 3.31Å; W1176-G1179 PolarHBondContact O-N 3.12Å; A1177-G1179 PolarHBondContact O-N 3.43Å; G1179-R1235 VanDerWaalsContact CA-NH2 3.29Å
1180	M	92.8	Very high	92	Very high	59 Å²	59	43 Å²	43	29%	0.291	23%	0.234	S	C	.	.			trans	-60.3	139	179.1	-173.4	175.2	-81.7	0	0	112.1	C1175 E1184 I1185 L1188 R1235	C1175-M1180 HydrophobicContact CB-CB 4.23Å; C1175-M1180 HydrophobicContact CB-CE 4.23Å; C1175-M1180 HydrophobicContact CB-SD 3.83Å; C1175-M1180 WeakPolarHBondContact O-CB 3.48Å; C1175-M1180 PolarHBondContact O-N 3.11Å; C1175-M1180 VanDerWaalsContact O-N 3.07Å; M1180-E1184 HydrophobicContact CG-CB 3.74Å; M1180-E1184 WeakPolarHBondContact CG-OE2 3.31Å; M1180-E1184 HydrophobicContact SD-CB 3.81Å; M1180-I1185 HydrophobicContact CB-CG2 3.93Å; M1180-I1185 HydrophobicContact CG-CG2 3.8Å; M1180-I1185 HydrophobicContact SD-CG2 3.66Å; M1180-L1188 HydrophobicContact SD-CD1 4.24Å; M1180-R1235 PolarHBondContact O-NH1 3.48Å; M1180-R1235 PolarHBondContact O-NH2 3.43Å
1181	P	91.9	Very high	91.9	Very high	63 Å²	63	43.6 Å²	43.6	41%	0.409	24%	0.238	S	C	.	.			trans	-59.7	149.7	176.5	-25.5	35.9	0	0	0	113.4	A1183 E1184 I1185	P1181-A1183 PolarHBondContact O-N 3.4Å; P1181-E1184 PolarHBondContact O-N 3.35Å; P1181-E1184 VanDerWaalsContact O-N 3.11Å; P1181-I1185 PolarHBondContact O-N 3.49Å
1182	F	91.9	Very high	91.7	Very high	1 Å²	1	44.1 Å²	44.1	0%	0.004	24%	0.24	C	C	.	.	H	α-helix	trans	-63.9	-31.6	-176	-168.3	-90.8	0	0	0	112.7	L624 L646 W1176 E1184 I1185 A1186 E1193 V1196 V1197 I1237 V1238	L624-F1182 HydrophobicContact CD1-CD1 3.71Å; L624-F1182 HydrophobicContact CD1-CE1 4.28Å; L624-F1182 HydrophobicContact CD2-CD1 3.92Å; L646-F1182 HydrophobicContact CD2-CE1 4.11Å; L646-F1182 HydrophobicContact CD2-CZ 4.12Å; W1176-F1182 HydrophobicContact CE3-CD2 4.46Å; W1176-F1182 HydrophobicContact CH2-CB 4.21Å; W1176-F1182 HydrophobicContact CH2-CD2 4.11Å; W1176-F1182 HydrophobicContact CZ3-CB 3.79Å; W1176-F1182 AromaticContact CZ3-CD2 3.92Å; W1176-F1182 HydrophobicContact CZ3-CD2 3.92Å; W1176-F1182 HydrophobicContact CZ3-CG 4.36Å; F1182-E1184 VanDerWaalsContact C-N 3.27Å; F1182-E1184 PolarHBondContact O-N 3.48Å; F1182-I1185 HydrophobicContact CD2-CD1 3.82Å; F1182-I1185 HydrophobicContact CD2-CG1 4.23Å; F1182-I1185 HydrophobicContact CE2-CD1 4.08Å; F1182-I1185 WeakPolarHBondContact O-CG1 3.36Å; F1182-A1186 HydrophobicContact CE1-CB 4.43Å; F1182-A1186 WeakPolarHBondContact O-CB 3.17Å; F1182-A1186 PolarHBondContact O-N 3.25Å; F1182-A1186 VanDerWaalsContact O-N 3.14Å; F1182-E1193 HydrophobicContact CE1-CB 3.89Å; F1182-E1193 HydrophobicContact CE1-CG 4.07Å; F1182-E1193 HydrophobicContact CZ-CB 4.02Å; F1182-V1196 HydrophobicContact CE2-CG1 4.48Å; F1182-V1197 HydrophobicContact CE2-CG2 3.83Å; F1182-V1197 HydrophobicContact CZ-CG2 3.83Å; F1182-I1237 HydrophobicContact CB-CG2 3.64Å; F1182-I1237 HydrophobicContact CD1-CG2 3.96Å; F1182-I1237 HydrophobicContact CD2-CG2 3.4Å; F1182-I1237 HydrophobicContact CE2-CG2 4.02Å; F1182-I1237 HydrophobicContact CG-CG2 3.37Å; F1182-V1238 HydrophobicContact CD2-CG2 4.2Å; F1182-V1238 HydrophobicContact CE2-CG2 4.17Å
1183	A	89.1	Confident	91.6	Very high	40 Å²	40	45.9 Å²	45.9	33%	0.331	25%	0.248	S	C	.	.	H	α-helix	trans	-64.8	-28.2	177.6	0	0	0	0	0	113.6	L624 P1181	L624-A1183 HydrophobicContact CD2-CB 3.67Å; P1181-A1183 PolarHBondContact O-N 3.4Å
1184	E	90	Very high	91.4	Very high	99 Å²	99	45.9 Å²	45.9	46%	0.463	25%	0.248	S	C	.	.	H	α-helix	trans	-82.9	-45.8	178.6	-71	167.8	-144.3	0	0	110.7	M1180 P1181 F1182 A1186 L1187	M1180-E1184 HydrophobicContact CG-CB 3.74Å; M1180-E1184 WeakPolarHBondContact CG-OE2 3.31Å; M1180-E1184 HydrophobicContact SD-CB 3.81Å; P1181-E1184 PolarHBondContact O-N 3.35Å; P1181-E1184 VanDerWaalsContact O-N 3.11Å; F1182-E1184 VanDerWaalsContact C-N 3.27Å; F1182-E1184 PolarHBondContact O-N 3.48Å; E1184-A1186 PolarHBondContact O-N 2.74Å; E1184-L1187 WeakPolarHBondContact O-CB 3.35Å; E1184-L1187 PolarHBondContact O-N 2.98Å
1185	I	91.1	Very high	91.2	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-63.5	-28.9	178.4	74.1	169	0	0	0	112.6	V1172 C1175 W1176 M1180 P1181 F1182 L1187 L1188 V1196	V1172-I1185 HydrophobicContact CG1-CB 4.14Å; V1172-I1185 HydrophobicContact CG1-CD1 3.96Å; V1172-I1185 HydrophobicContact CG1-CG1 4.32Å; C1175-I1185 HydrophobicContact CB-CG2 4.15Å; W1176-I1185 HydrophobicContact CB-CD1 4.17Å; W1176-I1185 HydrophobicContact CD2-CD1 4.11Å; W1176-I1185 HydrophobicContact CE3-CD1 3.6Å; W1176-I1185 HydrophobicContact CE3-CG1 4.49Å; W1176-I1185 HydrophobicContact CG-CD1 4.39Å; W1176-I1185 HydrophobicContact CZ3-CD1 4.29Å; M1180-I1185 HydrophobicContact CB-CG2 3.93Å; M1180-I1185 HydrophobicContact CG-CG2 3.8Å; M1180-I1185 HydrophobicContact SD-CG2 3.66Å; P1181-I1185 PolarHBondContact O-N 3.49Å; F1182-I1185 HydrophobicContact CD2-CD1 3.82Å; F1182-I1185 HydrophobicContact CD2-CG1 4.23Å; F1182-I1185 HydrophobicContact CE2-CD1 4.08Å; F1182-I1185 WeakPolarHBondContact O-CG1 3.36Å; I1185-L1187 PolarHBondContact O-N 2.71Å; I1185-L1188 PolarHBondContact O-N 2.86Å; I1185-V1196 HydrophobicContact CD1-CG1 4.43Å
1186	A	87.6	Confident	91.1	Very high	28 Å²	28	43.5 Å²	43.5	23%	0.231	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-12.6	176.7	0	0	0	0	0	113.4	F1182 E1184 E1193	F1182-A1186 HydrophobicContact CE1-CB 4.43Å; F1182-A1186 WeakPolarHBondContact O-CB 3.17Å; F1182-A1186 PolarHBondContact O-N 3.25Å; F1182-A1186 VanDerWaalsContact O-N 3.14Å; E1184-A1186 PolarHBondContact O-N 2.74Å; A1186-E1193 HydrophobicContact CB-CG 4.25Å
1187	L	88.4	Confident	91	Very high	150 Å²	150	43.5 Å²	43.5	79%	0.785	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-14.1	173.6	-61.6	171.3	0	0	0	112.8	E1184 I1185 T1189	E1184-L1187 WeakPolarHBondContact O-CB 3.35Å; E1184-L1187 PolarHBondContact O-N 2.98Å; I1185-L1187 PolarHBondContact O-N 2.71Å; L1187-T1189 VanDerWaalsContact C-N 3.34Å
1188	L	89.4	Confident	90.8	Very high	58 Å²	58	46.9 Å²	46.9	30%	0.304	25%	0.248	S	C	.	.	S	Bend	trans	-82.4	-8.8	-178.4	-59.2	177.4	0	0	0	113.4	E1171 V1172 C1175 M1180 I1185	E1171-L1188 HydrophobicContact CG-CD1 4.39Å; V1172-L1188 HydrophobicContact CG2-CB 4.35Å; C1175-L1188 HydrophobicContact CB-CD1 4.39Å; M1180-L1188 HydrophobicContact SD-CD1 4.24Å; I1185-L1188 PolarHBondContact O-N 2.86Å
1189	T	90.4	Very high	90.7	Very high	15 Å²	15	39 Å²	39	9%	0.092	22%	0.219	C	C	.	.			trans	-142.8	150.6	-174.3	-175.8	0	0	0	0	112.4	L1169 V1172 L1187 V1191 V1196	L1169-T1189 HydrophobicContact CD2-CG2 4.18Å; V1172-T1189 HydrophobicContact CG2-CG2 3.91Å; L1187-T1189 VanDerWaalsContact C-N 3.34Å; T1189-V1191 HydrophobicContact CG2-CB 4.12Å; T1189-V1191 WeakPolarHBondContact OG1-CB 3.49Å; T1189-V1191 WeakPolarHBondContact OG1-CG2 3.42Å; T1189-V1191 PolarHBondContact OG1-N 2.65Å; T1189-V1191 VanDerWaalsContact OG1-N 3.17Å; T1189-V1196 HydrophobicContact CG2-CG2 4.22Å
1190	D	89.1	Confident	90.8	Very high	73 Å²	73	36.9 Å²	36.9	39%	0.39	20%	0.198	S	C	.	.	S	Bend	trans	-75.8	-8.6	169	62	-24.6	0	0	0	113.6	T1121 Q1122 T1123	T1121-D1190 WeakPolarHBondContact CB-OD1 3.5Å; Q1122-D1190 WeakPolarHBondContact CB-OD2 3.48Å; Q1122-D1190 PolarHBondContact N-OD2 3.47Å; T1123-D1190 HydrophobicContact CG2-CB 4.34Å; T1123-D1190 PolarHBondContact OG1-OD1 2.92Å
1191	V	90.2	Very high	90.7	Very high	14 Å²	14	36.3 Å²	36.3	9%	0.085	20%	0.195	C	C	.	.	S	Bend	trans	-76	123.3	-177	178.6	0	0	0	0	111.9	F1117 T1121 L1169 T1189 T1195 V1196	F1117-V1191 HydrophobicContact CE2-CG1 4.42Å; F1117-V1191 HydrophobicContact CE2-CG2 4.2Å; F1117-V1191 HydrophobicContact CZ-CG2 3.92Å; T1121-V1191 HydrophobicContact CG2-CG2 3.55Å; L1169-V1191 HydrophobicContact CD2-CB 4.2Å; L1169-V1191 HydrophobicContact CD2-CG2 4.09Å; T1189-V1191 HydrophobicContact CG2-CB 4.12Å; T1189-V1191 WeakPolarHBondContact OG1-CB 3.49Å; T1189-V1191 WeakPolarHBondContact OG1-CG2 3.42Å; T1189-V1191 PolarHBondContact OG1-N 2.65Å; T1189-V1191 VanDerWaalsContact OG1-N 3.17Å; V1191-T1195 HydrophobicContact CG1-CG2 3.62Å; V1191-V1196 HydrophobicContact CB-CG2 4.24Å; V1191-V1196 HydrophobicContact CG1-CG2 3.93Å
1192	Q	89.8	Confident	90.6	Very high	39 Å²	39	38.9 Å²	38.9	18%	0.182	20%	0.196	C	C	.	.			trans	-52.7	139.5	176.8	-64.8	-170.5	-45.3	0	0	113.1	D586 H642 G1194 T1195 V1196	D586-Q1192 PolarHBondContact OD2-NE2 2.85Å; H642-Q1192 PolarHBondContact CE1-OE1 3.49Å; H642-Q1192 PolarHBondContact ND1-OE1 3.41Å; Q1192-G1194 VanDerWaalsContact C-N 3.33Å; Q1192-G1194 PolarHBondContact O-N 3.16Å; Q1192-G1194 VanDerWaalsContact O-N 3.16Å; Q1192-T1195 WeakPolarHBondContact O-CA 3.27Å; Q1192-T1195 VanDerWaalsContact O-CB 3.28Å; Q1192-T1195 WeakPolarHBondContact O-CB 3.45Å; Q1192-T1195 PolarHBondContact O-N 3.36Å; Q1192-V1196 PolarHBondContact O-N 3.35Å
1193	E	91.6	Very high	90.7	Very high	39 Å²	39	38.8 Å²	38.8	18%	0.182	20%	0.196	C	C	.	.	H	α-helix	trans	-57.1	-39.4	-165.9	-58	97.4	128.1	0	0	113.7	Q626 L646 F1182 A1186 T1195 V1196 V1197	Q626-E1193 WeakPolarHBondContact CB-OE1 3.33Å; Q626-E1193 PolarHBondContact NE2-OE1 3.01Å; Q626-E1193 PolarHBondContact NE2-OE2 3.43Å; L646-E1193 HydrophobicContact CD2-CB 3.9Å; L646-E1193 HydrophobicContact CG-CB 4.22Å; F1182-E1193 HydrophobicContact CE1-CB 3.89Å; F1182-E1193 HydrophobicContact CE1-CG 4.07Å; F1182-E1193 HydrophobicContact CZ-CB 4.02Å; A1186-E1193 HydrophobicContact CB-CG 4.25Å; E1193-T1195 PolarHBondContact O-N 2.68Å; E1193-V1196 PolarHBondContact O-N 2.89Å; E1193-V1197 WeakPolarHBondContact O-CG2 3.42Å; E1193-V1197 PolarHBondContact O-N 3.4Å
1194	G	90.8	Very high	90.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-69.3	-18.2	177.2	0	0	0	0	0	114.5	G644 Q1192 R1198	G644-G1194 WeakPolarHBondContact O-CA 3.36Å; G644-G1194 PolarHBondContact O-N 3.3Å; Q1192-G1194 VanDerWaalsContact C-N 3.33Å; Q1192-G1194 PolarHBondContact O-N 3.16Å; Q1192-G1194 VanDerWaalsContact O-N 3.16Å; G1194-R1198 PolarHBondContact O-N 2.88Å
1195	T	90.8	Very high	90.9	Very high	7 Å²	7	34.4 Å²	34.4	4%	0.043	17%	0.168	C	C	.	.	H	α-helix	trans	-78.4	-42.9	169.1	-59.4	0	0	0	0	110.5	Q1119 V1191 Q1192 E1193 V1197 R1198 C1199	Q1119-T1195 VanDerWaalsContact NE2-CG2 3.25Å; V1191-T1195 HydrophobicContact CG1-CG2 3.62Å; Q1192-T1195 WeakPolarHBondContact O-CA 3.27Å; Q1192-T1195 VanDerWaalsContact O-CB 3.28Å; Q1192-T1195 WeakPolarHBondContact O-CB 3.45Å; Q1192-T1195 PolarHBondContact O-N 3.36Å; E1193-T1195 PolarHBondContact O-N 2.68Å; T1195-V1197 PolarHBondContact O-N 3Å; T1195-R1198 PolarHBondContact O-N 3Å; T1195-C1199 PolarHBondContact O-N 2.91Å
1196	V	93.1	Very high	90.9	Very high	4 Å²	4	34.7 Å²	34.7	2%	0.024	17%	0.17	C	C	.	.	H	α-helix	trans	-58.2	-48.4	175	-179.6	0	0	0	0	110.4	L1169 V1172 F1182 I1185 T1189 V1191 Q1192 E1193 R1198 C1199 I1200	L1169-V1196 HydrophobicContact CD2-CG2 4.32Å; V1172-V1196 HydrophobicContact CG1-CG1 3.75Å; F1182-V1196 HydrophobicContact CE2-CG1 4.48Å; I1185-V1196 HydrophobicContact CD1-CG1 4.43Å; T1189-V1196 HydrophobicContact CG2-CG2 4.22Å; V1191-V1196 HydrophobicContact CB-CG2 4.24Å; V1191-V1196 HydrophobicContact CG1-CG2 3.93Å; Q1192-V1196 PolarHBondContact O-N 3.35Å; E1193-V1196 PolarHBondContact O-N 2.89Å; V1196-R1198 PolarHBondContact O-N 2.9Å; V1196-C1199 WeakPolarHBondContact O-CB 3.44Å; V1196-C1199 PolarHBondContact O-N 3.36Å; V1196-C1199 VanDerWaalsContact O-N 3.14Å; V1196-I1200 HydrophobicContact CG1-CD1 3.92Å; V1196-I1200 WeakPolarHBondContact O-CG1 3.48Å; V1196-I1200 PolarHBondContact O-N 3.42Å
1197	V	92.5	Very high	91.2	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-56.3	-46.8	175.5	171.7	0	0	0	0	111.8	L646 P647 F1182 E1193 T1195 C1199 I1200 Q1201 V1238	L646-V1197 HydrophobicContact CD2-CG2 3.73Å; P647-V1197 HydrophobicContact CG-CB 4.47Å; P647-V1197 HydrophobicContact CG-CG1 3.72Å; F1182-V1197 HydrophobicContact CE2-CG2 3.83Å; F1182-V1197 HydrophobicContact CZ-CG2 3.83Å; E1193-V1197 WeakPolarHBondContact O-CG2 3.42Å; E1193-V1197 PolarHBondContact O-N 3.4Å; T1195-V1197 PolarHBondContact O-N 3Å; V1197-C1199 VanDerWaalsContact C-N 3.31Å; V1197-C1199 PolarHBondContact O-N 2.85Å; V1197-I1200 PolarHBondContact O-N 3.18Å; V1197-Q1201 HydrophobicContact CG1-CG 4.32Å; V1197-Q1201 WeakPolarHBondContact O-CB 3.46Å; V1197-Q1201 VanDerWaalsContact O-CG 3.31Å; V1197-Q1201 WeakPolarHBondContact O-CG 3.2Å; V1197-Q1201 PolarHBondContact O-N 3.41Å; V1197-V1238 HydrophobicContact CG1-CG1 4.24Å; V1197-V1238 HydrophobicContact CG2-CG2 4.29Å
1198	R	89.4	Confident	91.3	Very high	80 Å²	80	28.1 Å²	28.1	30%	0.302	13%	0.13	S	C	.	.	H	α-helix	trans	-63.7	-36.6	178.3	-171.8	-177.9	-55.2	106.9	25.9	112.5	S643 G1194 T1195 V1196 R1202	S643-R1198 PolarHBondContact O-NH1 3.47Å; S643-R1198 PolarHBondContact O-NH2 2.85Å; G1194-R1198 PolarHBondContact O-N 2.88Å; T1195-R1198 PolarHBondContact O-N 3Å; V1196-R1198 PolarHBondContact O-N 2.9Å; R1198-R1202 WeakPolarHBondContact O-CB 3.29Å; R1198-R1202 PolarHBondContact O-N 3.32Å
1199	C	92.4	Very high	91.3	Very high	6 Å²	6	27 Å²	27	4%	0.041	12%	0.123	C	C	.	.	H	α-helix	trans	-62.7	-46.6	176.8	-166.6	0	0	0	0	110.9	L1169 T1195 V1196 V1197 R1202 L1203	L1169-C1199 HydrophobicContact CD1-CB 3.94Å; T1195-C1199 PolarHBondContact O-N 2.91Å; V1196-C1199 WeakPolarHBondContact O-CB 3.44Å; V1196-C1199 PolarHBondContact O-N 3.36Å; V1196-C1199 VanDerWaalsContact O-N 3.14Å; V1197-C1199 VanDerWaalsContact C-N 3.31Å; V1197-C1199 PolarHBondContact O-N 2.85Å; C1199-R1202 PolarHBondContact O-N 2.87Å; C1199-L1203 VanDerWaalsContact O-CB 3.29Å; C1199-L1203 WeakPolarHBondContact O-CB 3.32Å; C1199-L1203 PolarHBondContact O-N 3.44Å
1200	I	94.1	Very high	91.5	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-69.5	-36.2	179.8	-57.5	164.6	0	0	0	111.4	V1173 W1176 V1196 V1197 L1203 D1204 I1233 V1238 F1239	V1173-I1200 HydrophobicContact CG2-CG1 4.3Å; W1176-I1200 HydrophobicContact CG-CD1 4.08Å; V1196-I1200 HydrophobicContact CG1-CD1 3.92Å; V1196-I1200 WeakPolarHBondContact O-CG1 3.48Å; V1196-I1200 PolarHBondContact O-N 3.42Å; V1197-I1200 PolarHBondContact O-N 3.18Å; I1200-L1203 PolarHBondContact O-N 3.47Å; I1200-D1204 PolarHBondContact O-N 3.4Å; I1200-D1204 VanDerWaalsContact O-N 3.08Å; I1200-I1233 HydrophobicContact CG2-CB 3.83Å; I1200-I1233 HydrophobicContact CG2-CD1 3.98Å; I1200-I1233 HydrophobicContact CG2-CG1 4.29Å; I1200-I1233 HydrophobicContact CG2-CG2 4.5Å; I1200-V1238 HydrophobicContact CB-CG1 3.74Å; I1200-V1238 HydrophobicContact CD1-CG2 4.09Å; I1200-V1238 HydrophobicContact CG2-CG1 3.71Å; I1200-F1239 HydrophobicContact CG2-CE2 4.18Å
1201	Q	91.1	Very high	91.6	Very high	47 Å²	47	25.8 Å²	25.8	22%	0.22	11%	0.112	C	C	.	.	H	α-helix	trans	-61.9	-46.9	173.8	-74.4	174.1	-15.2	0	0	112.5	V1197 D1204 E1205 V1238 F1239	V1197-Q1201 HydrophobicContact CG1-CG 4.32Å; V1197-Q1201 WeakPolarHBondContact O-CB 3.46Å; V1197-Q1201 VanDerWaalsContact O-CG 3.31Å; V1197-Q1201 WeakPolarHBondContact O-CG 3.2Å; V1197-Q1201 PolarHBondContact O-N 3.41Å; Q1201-D1204 WeakPolarHBondContact O-CB 3.38Å; Q1201-D1204 PolarHBondContact O-N 3.34Å; Q1201-E1205 PolarHBondContact O-N 3.28Å; Q1201-V1238 HydrophobicContact CG-CG1 4.2Å; Q1201-V1238 PolarHBondContact NE2-O 3.42Å; Q1201-F1239 HydrophobicContact CG-CE1 4.18Å; Q1201-F1239 HydrophobicContact CG-CZ 4.27Å
1202	R	90.6	Very high	91.5	Very high	116 Å²	116	28.5 Å²	28.5	44%	0.438	12%	0.123	S	C	.	.	H	α-helix	trans	-68	-34.6	175.3	-77.9	177.8	171.6	-167.9	-7.9	112.6	V1116 R1198 C1199 D1204 E1205 V1206	V1116-R1202 HydrophobicContact CG1-CB 3.33Å; V1116-R1202 HydrophobicContact CG1-CG 4.29Å; V1116-R1202 HydrophobicContact CG2-CB 4.4Å; R1198-R1202 WeakPolarHBondContact O-CB 3.29Å; R1198-R1202 PolarHBondContact O-N 3.32Å; C1199-R1202 PolarHBondContact O-N 2.87Å; R1202-D1204 VanDerWaalsContact C-N 3.26Å; R1202-D1204 PolarHBondContact O-N 3.46Å; R1202-E1205 WeakPolarHBondContact O-CA 3.22Å; R1202-E1205 WeakPolarHBondContact O-CB 3.18Å; R1202-E1205 PolarHBondContact O-N 3.3Å; R1202-V1206 PolarHBondContact O-N 3.42Å; R1202-V1206 VanDerWaalsContact O-N 3.08Å
1203	L	94	Very high	91.6	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-60.9	-35.4	173.3	176.3	63.5	0	0	0	111.9	A1109 L1112 V1173 C1199 I1200 E1205 V1206 L1207 I1233	A1109-L1203 HydrophobicContact CB-CD2 4.35Å; A1109-L1203 WeakPolarHBondContact O-CD2 3.35Å; L1112-L1203 HydrophobicContact CB-CD1 3.73Å; V1173-L1203 HydrophobicContact CG1-CD2 3.51Å; V1173-L1203 HydrophobicContact CG2-CD2 4.41Å; C1199-L1203 VanDerWaalsContact O-CB 3.29Å; C1199-L1203 WeakPolarHBondContact O-CB 3.32Å; C1199-L1203 PolarHBondContact O-N 3.44Å; I1200-L1203 PolarHBondContact O-N 3.47Å; L1203-E1205 VanDerWaalsContact C-N 3.31Å; L1203-E1205 PolarHBondContact O-N 2.77Å; L1203-V1206 PolarHBondContact O-N 2.82Å; L1203-L1207 HydrophobicContact CD1-CG 4.3Å; L1203-L1207 HydrophobicContact CG-CD1 4.15Å; L1203-L1207 HydrophobicContact CG-CG 4.4Å; L1203-L1207 WeakPolarHBondContact O-CB 3.42Å; L1203-L1207 WeakPolarHBondContact O-CG 3.46Å; L1203-L1207 PolarHBondContact O-N 3.21Å; L1203-I1233 HydrophobicContact CB-CD1 4.5Å; L1203-I1233 HydrophobicContact CD2-CD1 4.23Å; L1203-I1233 HydrophobicContact CG-CD1 4.16Å
1204	D	92.9	Very high	91.6	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-66.7	-29.1	172.3	178.9	62	0	0	0	113.2	I1200 Q1201 R1202 K1208 S1230 I1233 R1234 F1239	I1200-D1204 PolarHBondContact O-N 3.4Å; I1200-D1204 VanDerWaalsContact O-N 3.08Å; Q1201-D1204 WeakPolarHBondContact O-CB 3.38Å; Q1201-D1204 PolarHBondContact O-N 3.34Å; R1202-D1204 VanDerWaalsContact C-N 3.26Å; R1202-D1204 PolarHBondContact O-N 3.46Å; D1204-K1208 VanDerWaalsContact O-CD 3.26Å; D1204-K1208 WeakPolarHBondContact O-CD 3.43Å; D1204-K1208 WeakPolarHBondContact O-CE 2.99Å; D1204-K1208 WeakPolarHBondContact O-CG 3.25Å; D1204-K1208 PolarHBondContact O-N 3.12Å; D1204-K1208 WeakPolarHBondContact OD2-CE 3.2Å; D1204-K1208 IonicContact OD2-NZ 2.65Å; D1204-K1208 PolarHBondContact OD2-NZ 3.16Å; D1204-S1230 PolarHBondContact OD1-OG 2.94Å; D1204-I1233 HydrophobicContact CB-CD1 3.95Å; D1204-R1234 WeakPolarHBondContact OD1-CD 3.17Å; D1204-R1234 IonicContact OD1-CZ 3.09Å; D1204-R1234 IonicContact OD1-NE 3.73Å; D1204-R1234 PolarHBondContact OD1-NE 3.34Å; D1204-R1234 IonicContact OD1-NH2 3.52Å; D1204-R1234 IonicContact OD2-CZ 3.69Å; D1204-R1234 VanDerWaalsContact OD2-CZ 3.29Å; D1204-R1234 IonicContact OD2-NE 2.84Å; D1204-R1234 PolarHBondContact OD2-NE 3.13Å; D1204-R1234 IonicContact OD2-NH2 3.58Å; D1204-R1234 PolarHBondContact OD2-NH2 2.82Å; D1204-F1239 HydrophobicContact CB-CE1 4.07Å; D1204-F1239 HydrophobicContact CB-CZ 3.6Å
1205	E	89.2	Confident	91.6	Very high	46 Å²	46	31.1 Å²	31.1	22%	0.215	13%	0.13	C	C	.	.	H	α-helix	trans	-65.8	-50.6	169.2	-62.8	174.3	141.7	0	0	109.8	K369 Q1201 R1202 L1203 L1207 K1208 E1209	K369-E1205 IonicContact NZ-OE1 2.82Å; K369-E1205 PolarHBondContact NZ-OE1 3.3Å; K369-E1205 IonicContact NZ-OE2 3.22Å; Q1201-E1205 PolarHBondContact O-N 3.28Å; R1202-E1205 WeakPolarHBondContact O-CA 3.22Å; R1202-E1205 WeakPolarHBondContact O-CB 3.18Å; R1202-E1205 PolarHBondContact O-N 3.3Å; L1203-E1205 VanDerWaalsContact C-N 3.31Å; L1203-E1205 PolarHBondContact O-N 2.77Å; E1205-L1207 PolarHBondContact O-N 3.4Å; E1205-K1208 WeakPolarHBondContact O-CB 3.44Å; E1205-K1208 PolarHBondContact O-N 2.84Å; E1205-K1208 VanDerWaalsContact O-N 3.16Å; E1205-E1209 PolarHBondContact O-N 3.23Å; E1205-E1209 VanDerWaalsContact O-N 3.12Å
1206	V	92.4	Very high	91.5	Very high	6 Å²	6	33.6 Å²	33.6	4%	0.036	14%	0.142	C	C	.	.	H	α-helix	trans	-59.3	-44.1	176.7	177.7	0	0	0	0	112.6	L1091 L1115 V1116 R1202 L1203 K1208 E1209 V1210	L1091-V1206 HydrophobicContact CD2-CG1 3.9Å; L1115-V1206 HydrophobicContact CD1-CG1 4.48Å; V1116-V1206 HydrophobicContact CG2-CG2 3.75Å; R1202-V1206 PolarHBondContact O-N 3.42Å; R1202-V1206 VanDerWaalsContact O-N 3.08Å; L1203-V1206 PolarHBondContact O-N 2.82Å; V1206-K1208 VanDerWaalsContact C-N 3.28Å; V1206-K1208 PolarHBondContact O-N 3.28Å; V1206-E1209 WeakPolarHBondContact O-CB 3.41Å; V1206-E1209 PolarHBondContact O-N 3.14Å; V1206-E1209 VanDerWaalsContact O-N 3.1Å; V1206-V1210 HydrophobicContact CG1-CG2 4.32Å; V1206-V1210 WeakPolarHBondContact O-CG2 3.45Å; V1206-V1210 PolarHBondContact O-N 3.16Å
1207	L	93.7	Very high	91.4	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-62.8	-32.4	178.4	-72.9	170.9	0	0	0	112.6	A1109 L1112 L1203 E1205 R1211 M1226 A1229 I1233	A1109-L1207 HydrophobicContact CB-CD1 4.35Å; L1112-L1207 HydrophobicContact CD1-CD2 3.75Å; L1203-L1207 HydrophobicContact CD1-CG 4.3Å; L1203-L1207 HydrophobicContact CG-CD1 4.15Å; L1203-L1207 HydrophobicContact CG-CG 4.4Å; L1203-L1207 WeakPolarHBondContact O-CB 3.42Å; L1203-L1207 WeakPolarHBondContact O-CG 3.46Å; L1203-L1207 PolarHBondContact O-N 3.21Å; E1205-L1207 PolarHBondContact O-N 3.4Å; L1207-R1211 VanDerWaalsContact O-CB 3.31Å; L1207-R1211 WeakPolarHBondContact O-CB 3.43Å; L1207-R1211 PolarHBondContact O-N 3.16Å; L1207-M1226 HydrophobicContact CD2-SD 3.65Å; L1207-A1229 HydrophobicContact CD1-CB 4.14Å; L1207-A1229 HydrophobicContact CD2-CB 4.16Å; L1207-I1233 HydrophobicContact CD1-CD1 3.67Å; L1207-I1233 HydrophobicContact CD1-CG1 4.45Å
1208	K	90.2	Very high	91.3	Very high	41 Å²	41	38.5 Å²	38.5	18%	0.178	18%	0.184	C	C	.	.	H	α-helix	trans	-70.1	-39.1	172.5	-66.5	158.2	-166.2	150.1	0	111.8	G391 D1204 E1205 V1206 R1211 Q1212 R1234	G391-K1208 PolarHBondContact O-NZ 2.9Å; D1204-K1208 VanDerWaalsContact O-CD 3.26Å; D1204-K1208 WeakPolarHBondContact O-CD 3.43Å; D1204-K1208 WeakPolarHBondContact O-CE 2.99Å; D1204-K1208 WeakPolarHBondContact O-CG 3.25Å; D1204-K1208 PolarHBondContact O-N 3.12Å; D1204-K1208 WeakPolarHBondContact OD2-CE 3.2Å; D1204-K1208 IonicContact OD2-NZ 2.65Å; D1204-K1208 PolarHBondContact OD2-NZ 3.16Å; E1205-K1208 WeakPolarHBondContact O-CB 3.44Å; E1205-K1208 PolarHBondContact O-N 2.84Å; E1205-K1208 VanDerWaalsContact O-N 3.16Å; V1206-K1208 VanDerWaalsContact C-N 3.28Å; V1206-K1208 PolarHBondContact O-N 3.28Å; K1208-R1211 PolarHBondContact O-N 3.36Å; K1208-Q1212 PolarHBondContact O-N 3.1Å; K1208-R1234 VanDerWaalsContact CE-NH2 3.28Å
1209	E	90.2	Very high	91.4	Very high	33 Å²	33	36.8 Å²	36.8	15%	0.154	18%	0.18	C	C	.	.	H	α-helix	trans	-61.8	-49.8	175	-67.3	177.8	-169.6	0	0	110.2	I1084 S1085 E1205 V1206 R1211 Q1212 A1213	I1084-E1209 WeakPolarHBondContact CA-OE2 3.35Å; S1085-E1209 VanDerWaalsContact CB-OE1 3.26Å; S1085-E1209 WeakPolarHBondContact CB-OE1 3.41Å; S1085-E1209 PolarHBondContact N-OE2 3.37Å; S1085-E1209 VanDerWaalsContact OG-CD 3.32Å; S1085-E1209 PolarHBondContact OG-OE1 2.89Å; S1085-E1209 PolarHBondContact OG-OE2 3.41Å; E1205-E1209 PolarHBondContact O-N 3.23Å; E1205-E1209 VanDerWaalsContact O-N 3.12Å; V1206-E1209 WeakPolarHBondContact O-CB 3.41Å; V1206-E1209 PolarHBondContact O-N 3.14Å; V1206-E1209 VanDerWaalsContact O-N 3.1Å; E1209-R1211 VanDerWaalsContact C-N 3.33Å; E1209-R1211 PolarHBondContact O-N 3.38Å; E1209-Q1212 PolarHBondContact O-N 3.15Å; E1209-A1213 WeakPolarHBondContact O-CB 3.37Å; E1209-A1213 PolarHBondContact O-N 2.98Å
1210	V	92.8	Very high	91.3	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.2	-39.6	175.7	-175.5	0	0	0	0	111.7	L1091 L1095 L1100 L1112 V1206 Q1212 A1213 A1214 M1226	L1091-V1210 HydrophobicContact CD1-CG2 3.8Å; L1091-V1210 HydrophobicContact CD2-CG2 3.71Å; L1091-V1210 HydrophobicContact CG-CG2 4.04Å; L1095-V1210 HydrophobicContact CD1-CG1 4.41Å; L1100-V1210 HydrophobicContact CD1-CG1 4.03Å; L1112-V1210 HydrophobicContact CD1-CG2 4.26Å; V1206-V1210 HydrophobicContact CG1-CG2 4.32Å; V1206-V1210 WeakPolarHBondContact O-CG2 3.45Å; V1206-V1210 PolarHBondContact O-N 3.16Å; V1210-Q1212 VanDerWaalsContact C-N 3.3Å; V1210-Q1212 PolarHBondContact O-N 2.68Å; V1210-A1213 PolarHBondContact O-N 3.14Å; V1210-A1214 WeakPolarHBondContact O-CB 3.45Å; V1210-A1214 PolarHBondContact O-N 2.94Å; V1210-M1226 HydrophobicContact CB-CG 4.05Å; V1210-M1226 HydrophobicContact CB-SD 4.22Å; V1210-M1226 HydrophobicContact CG1-CG 3.67Å; V1210-M1226 HydrophobicContact CG1-SD 3.83Å
1211	R	92.3	Very high	91.3	Very high	64 Å²	64	46.1 Å²	46.1	24%	0.242	24%	0.241	C	C	.	.	H	α-helix	trans	-60.1	-39.7	173.9	-177	-173.7	65.2	167.3	-3.7	111.8	L1207 K1208 E1209 R1215 M1226 E1227	L1207-R1211 VanDerWaalsContact O-CB 3.31Å; L1207-R1211 WeakPolarHBondContact O-CB 3.43Å; L1207-R1211 PolarHBondContact O-N 3.16Å; K1208-R1211 PolarHBondContact O-N 3.36Å; E1209-R1211 VanDerWaalsContact C-N 3.33Å; E1209-R1211 PolarHBondContact O-N 3.38Å; R1211-R1215 WeakPolarHBondContact O-CG 3.4Å; R1211-R1215 PolarHBondContact O-N 3.48Å; R1211-M1226 HydrophobicContact CB-CB 3.93Å; R1211-E1227 IonicContact CZ-OE1 3.65Å; R1211-E1227 IonicContact NH1-OE1 3.6Å; R1211-E1227 PolarHBondContact NH1-OE1 2.91Å
1212	Q	88.8	Confident	91.4	Very high	70 Å²	70	44 Å²	44	33%	0.327	23%	0.231	S	C	.	.	H	α-helix	trans	-75.6	-38.4	178.9	-169.8	62.4	14.8	0	0	111.9	Q1083 K1208 E1209 V1210 R1215 I1216	Q1083-Q1212 HydrophobicContact CG-CG 4.37Å; K1208-Q1212 PolarHBondContact O-N 3.1Å; E1209-Q1212 PolarHBondContact O-N 3.15Å; V1210-Q1212 VanDerWaalsContact C-N 3.3Å; V1210-Q1212 PolarHBondContact O-N 2.68Å; Q1212-R1215 WeakPolarHBondContact O-CB 3.36Å; Q1212-R1215 PolarHBondContact O-N 2.69Å; Q1212-I1216 PolarHBondContact O-N 3.37Å
1213	A	91.1	Very high	91.5	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-56.9	-48.6	170	0	0	0	0	0	112.1	V1080 L1095 E1209 V1210 R1215 I1216 V1217	V1080-A1213 HydrophobicContact CG1-CB 3.79Å; L1095-A1213 HydrophobicContact CD1-CB 3.86Å; E1209-A1213 WeakPolarHBondContact O-CB 3.37Å; E1209-A1213 PolarHBondContact O-N 2.98Å; V1210-A1213 PolarHBondContact O-N 3.14Å; A1213-R1215 VanDerWaalsContact C-N 3.27Å; A1213-R1215 PolarHBondContact O-N 2.97Å; A1213-I1216 WeakPolarHBondContact O-CB 3.41Å; A1213-I1216 PolarHBondContact O-N 2.94Å; A1213-V1217 PolarHBondContact O-N 3.42Å
1214	A	92	Very high	91.6	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-58.8	-37.2	177.8	0	0	0	0	0	112.5	V1210 I1216 V1217 G1218 D1219 L1222	V1210-A1214 WeakPolarHBondContact O-CB 3.45Å; V1210-A1214 PolarHBondContact O-N 2.94Å; A1214-I1216 PolarHBondContact O-N 3.12Å; A1214-V1217 PolarHBondContact O-N 2.75Å; A1214-G1218 PolarHBondContact O-N 2.87Å; A1214-D1219 PolarHBondContact O-N 2.81Å; A1214-L1222 HydrophobicContact CB-CB 4.16Å; A1214-L1222 HydrophobicContact CB-CD2 4.03Å; A1214-L1222 HydrophobicContact CB-CG 4.07Å
1215	R	89.9	Confident	91.6	Very high	134 Å²	134	42.3 Å²	42.3	51%	0.506	24%	0.235	S	C	.	.	H	α-helix	trans	-64.6	-35	173.7	-71.1	167.6	175.9	-175.9	-5.5	113.2	R1211 Q1212 A1213 G1218	R1211-R1215 WeakPolarHBondContact O-CG 3.4Å; R1211-R1215 PolarHBondContact O-N 3.48Å; Q1212-R1215 WeakPolarHBondContact O-CB 3.36Å; Q1212-R1215 PolarHBondContact O-N 2.69Å; A1213-R1215 VanDerWaalsContact C-N 3.27Å; A1213-R1215 PolarHBondContact O-N 2.97Å; R1215-G1218 PolarHBondContact O-N 2.83Å
1216	I	89.4	Confident	91.9	Very high	59 Å²	59	40.1 Å²	40.1	30%	0.303	22%	0.224	S	C	.	.	H	α-helix	trans	-72.3	-36.1	176.2	-65.8	175.5	0	0	0	111.2	L1076 V1080 Q1083 Q1212 A1213 A1214 G1218	L1076-I1216 HydrophobicContact CD1-CG2 4.12Å; V1080-I1216 HydrophobicContact CG2-CB 4.47Å; V1080-I1216 HydrophobicContact CG2-CG2 4.12Å; Q1083-I1216 HydrophobicContact CG-CD1 3.44Å; Q1083-I1216 VanDerWaalsContact CG-CD1 3.44Å; Q1212-I1216 PolarHBondContact O-N 3.37Å; A1213-I1216 WeakPolarHBondContact O-CB 3.41Å; A1213-I1216 PolarHBondContact O-N 2.94Å; A1214-I1216 PolarHBondContact O-N 3.12Å; I1216-G1218 VanDerWaalsContact C-N 3.29Å
1217	V	91	Very high	92.1	Very high	49 Å²	49	43.4 Å²	43.4	30%	0.297	24%	0.239	S	C	.	.	H	α-helix	trans	-72	-24.3	174.1	176.4	0	0	0	0	112.3	V1080 L1095 F1096 A1213 A1214	V1080-V1217 HydrophobicContact CG2-CG2 3.48Å; V1080-V1217 VanDerWaalsContact CG2-CG2 3.48Å; L1095-V1217 HydrophobicContact CD2-CB 4.39Å; L1095-V1217 HydrophobicContact CD2-CG1 4.34Å; L1095-V1217 HydrophobicContact CD2-CG2 3.8Å; F1096-V1217 HydrophobicContact CE2-CG2 4.38Å; F1096-V1217 HydrophobicContact CZ-CG2 3.98Å; A1213-V1217 PolarHBondContact O-N 3.42Å; A1214-V1217 PolarHBondContact O-N 2.75Å
1218	G	89.9	Confident	92.1	Very high	58 Å²	58	49.4 Å²	49.4	60%	0.598	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.2	4.7	-177.1	0	0	0	0	0	114.3	A1214 R1215 I1216 S1220	A1214-G1218 PolarHBondContact O-N 2.87Å; R1215-G1218 PolarHBondContact O-N 2.83Å; I1216-G1218 VanDerWaalsContact C-N 3.29Å; G1218-S1220 PolarHBondContact O-N 3.06Å; G1218-S1220 VanDerWaalsContact O-N 3.13Å
1219	D	92.1	Very high	92.4	Very high	44 Å²	44	47.4 Å²	47.4	24%	0.235	26%	0.257	C	S	.	.			trans	-82	91.5	176.4	-169.9	-15.7	0	0	0	111.2	A1214 V1221 L1222 G1223	A1214-D1219 PolarHBondContact O-N 2.81Å; D1219-V1221 VanDerWaalsContact C-N 3.28Å; D1219-V1221 PolarHBondContact O-N 3.36Å; D1219-V1221 WeakPolarHBondContact OD1-CA 3.48Å; D1219-V1221 WeakPolarHBondContact OD1-CB 3Å; D1219-V1221 PolarHBondContact OD1-N 2.95Å; D1219-L1222 HydrophobicContact CB-CB 4.07Å; D1219-L1222 PolarHBondContact OD1-N 3.18Å; D1219-L1222 VanDerWaalsContact OD2-CB 3.25Å; D1219-L1222 WeakPolarHBondContact OD2-CB 3.16Å; D1219-G1223 PolarHBondContact O-N 3.03Å
1220	S	90.9	Very high	92.6	Very high	97 Å²	97	46.4 Å²	46.4	68%	0.678	25%	0.254	S	S	*	.	H	α-helix	trans	-67.6	-25.6	175.3	62.7	0	0	0	0	113.6	G1218 S1224	G1218-S1220 PolarHBondContact O-N 3.06Å; G1218-S1220 VanDerWaalsContact O-N 3.13Å; S1220-S1224 WeakPolarHBondContact O-CB 3.14Å; S1220-S1224 PolarHBondContact O-N 3.4Å
1221	V	93.1	Very high	92.7	Very high	104 Å²	104	52 Å²	52	63%	0.63	28%	0.283	S	S	*	.	H	α-helix	trans	-75.4	-47.8	-179	-179.7	0	0	0	0	109.9	D1219 G1223 S1224 K1225	D1219-V1221 VanDerWaalsContact C-N 3.28Å; D1219-V1221 PolarHBondContact O-N 3.36Å; D1219-V1221 WeakPolarHBondContact OD1-CA 3.48Å; D1219-V1221 WeakPolarHBondContact OD1-CB 3Å; D1219-V1221 PolarHBondContact OD1-N 2.95Å; V1221-G1223 VanDerWaalsContact C-N 3.34Å; V1221-S1224 PolarHBondContact O-N 3.09Å; V1221-K1225 WeakPolarHBondContact O-CB 3.35Å; V1221-K1225 PolarHBondContact O-N 2.76Å
1222	L	93.5	Very high	92.7	Very high	4 Å²	4	50.1 Å²	50.1	2%	0.021	28%	0.281	C	S	.	.	H	α-helix	trans	-62.1	-42.4	172.8	-176.4	65.4	0	0	0	111	L1095 L1100 A1214 D1219 S1224 K1225 M1226	L1095-L1222 HydrophobicContact CD1-CD2 4.21Å; L1095-L1222 HydrophobicContact CG-CD2 3.94Å; L1100-L1222 HydrophobicContact CB-CD1 3.75Å; A1214-L1222 HydrophobicContact CB-CB 4.16Å; A1214-L1222 HydrophobicContact CB-CD2 4.03Å; A1214-L1222 HydrophobicContact CB-CG 4.07Å; D1219-L1222 HydrophobicContact CB-CB 4.07Å; D1219-L1222 PolarHBondContact OD1-N 3.18Å; D1219-L1222 VanDerWaalsContact OD2-CB 3.25Å; D1219-L1222 WeakPolarHBondContact OD2-CB 3.16Å; L1222-S1224 PolarHBondContact O-N 2.76Å; L1222-K1225 WeakPolarHBondContact O-CB 3.49Å; L1222-K1225 PolarHBondContact O-N 2.73Å; L1222-K1225 VanDerWaalsContact O-N 3.14Å; L1222-M1226 HydrophobicContact CD1-CE 3.77Å; L1222-M1226 WeakPolarHBondContact O-CG 3.4Å; L1222-M1226 PolarHBondContact O-N 3.48Å
1223	G	93.3	Very high	93	Very high	6 Å²	6	46.8 Å²	46.8	6%	0.062	27%	0.266	C	S	.	.	H	α-helix	trans	-55.9	-48.5	173.9	0	0	0	0	0	112.8	D1219 V1221 K1225 M1226 E1227	D1219-G1223 PolarHBondContact O-N 3.03Å; V1221-G1223 VanDerWaalsContact C-N 3.34Å; G1223-K1225 VanDerWaalsContact C-N 3.34Å; G1223-K1225 PolarHBondContact O-N 3.32Å; G1223-M1226 PolarHBondContact O-N 3.31Å; G1223-E1227 PolarHBondContact O-N 3.34Å; G1223-E1227 VanDerWaalsContact O-N 3.12Å
1224	S	94.3	Very high	93.1	Very high	49 Å²	49	51.5 Å²	51.5	34%	0.343	28%	0.284	S	S	.	.	H	α-helix	trans	-65.2	-35.5	175.4	-172.8	0	0	0	0	112.6	S1220 V1221 L1222 E1227 K1228	S1220-S1224 WeakPolarHBondContact O-CB 3.14Å; S1220-S1224 PolarHBondContact O-N 3.4Å; V1221-S1224 PolarHBondContact O-N 3.09Å; L1222-S1224 PolarHBondContact O-N 2.76Å; S1224-E1227 PolarHBondContact O-N 2.89Å; S1224-K1228 WeakPolarHBondContact O-CG 3.49Å; S1224-K1228 PolarHBondContact O-N 3.2Å
1225	K	94.8	Very high	93	Very high	24 Å²	24	53.6 Å²	53.6	10%	0.104	29%	0.291	C	S	.	.	H	α-helix	trans	-64.1	-47.2	176.3	-168.5	-169.2	-59.3	-169.1	0	111.8	L1100 S1101 L1103 P1105 V1221 L1222 G1223 E1227 K1228 A1229	L1100-K1225 PolarHBondContact O-NZ 3.16Å; S1101-K1225 PolarHBondContact O-NZ 2.94Å; L1103-K1225 WeakPolarHBondContact O-CD 3.48Å; L1103-K1225 WeakPolarHBondContact O-CE 3.47Å; L1103-K1225 PolarHBondContact O-NZ 2.82Å; P1105-K1225 HydrophobicContact CB-CG 4.18Å; P1105-K1225 HydrophobicContact CG-CG 3.92Å; V1221-K1225 WeakPolarHBondContact O-CB 3.35Å; V1221-K1225 PolarHBondContact O-N 2.76Å; L1222-K1225 WeakPolarHBondContact O-CB 3.49Å; L1222-K1225 PolarHBondContact O-N 2.73Å; L1222-K1225 VanDerWaalsContact O-N 3.14Å; G1223-K1225 VanDerWaalsContact C-N 3.34Å; G1223-K1225 PolarHBondContact O-N 3.32Å; K1225-E1227 VanDerWaalsContact C-N 3.27Å; K1225-E1227 PolarHBondContact O-N 3.21Å; K1225-K1228 PolarHBondContact O-N 3.43Å; K1225-A1229 WeakPolarHBondContact O-CB 3.29Å; K1225-A1229 PolarHBondContact O-N 3.03Å
1226	M	95.4	Very high	92.9	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-64.3	-34.3	178	-65.7	-54.2	103.9	0	0	111.8	L1112 L1207 V1210 R1211 L1222 G1223 A1229 S1230	L1112-M1226 HydrophobicContact CD1-SD 4.26Å; L1207-M1226 HydrophobicContact CD2-SD 3.65Å; V1210-M1226 HydrophobicContact CB-CG 4.05Å; V1210-M1226 HydrophobicContact CB-SD 4.22Å; V1210-M1226 HydrophobicContact CG1-CG 3.67Å; V1210-M1226 HydrophobicContact CG1-SD 3.83Å; R1211-M1226 HydrophobicContact CB-CB 3.93Å; L1222-M1226 HydrophobicContact CD1-CE 3.77Å; L1222-M1226 WeakPolarHBondContact O-CG 3.4Å; L1222-M1226 PolarHBondContact O-N 3.48Å; G1223-M1226 PolarHBondContact O-N 3.31Å; M1226-A1229 PolarHBondContact O-N 2.81Å; M1226-S1230 WeakPolarHBondContact O-CB 3.37Å; M1226-S1230 PolarHBondContact O-N 3.09Å
1227	E	94.6	Very high	92.9	Very high	75 Å²	75	46.1 Å²	46.1	35%	0.35	26%	0.262	S	S	.	.	H	α-helix	trans	-65.6	-44.3	173.2	-172.7	151	-108.7	0	0	112.4	R1211 G1223 S1224 K1225 A1229 S1230 L1231	R1211-E1227 IonicContact CZ-OE1 3.65Å; R1211-E1227 IonicContact NH1-OE1 3.6Å; R1211-E1227 PolarHBondContact NH1-OE1 2.91Å; G1223-E1227 PolarHBondContact O-N 3.34Å; G1223-E1227 VanDerWaalsContact O-N 3.12Å; S1224-E1227 PolarHBondContact O-N 2.89Å; K1225-E1227 VanDerWaalsContact C-N 3.27Å; K1225-E1227 PolarHBondContact O-N 3.21Å; E1227-A1229 PolarHBondContact O-N 3.5Å; E1227-S1230 PolarHBondContact O-N 2.8Å; E1227-L1231 HydrophobicContact CG-CD1 4.38Å; E1227-L1231 WeakPolarHBondContact O-CB 3.33Å; E1227-L1231 VanDerWaalsContact O-CG 3.3Å; E1227-L1231 WeakPolarHBondContact O-CG 3.47Å; E1227-L1231 PolarHBondContact O-N 3.02Å
1228	K	95.3	Very high	92.8	Very high	126 Å²	126	43.8 Å²	43.8	55%	0.548	25%	0.248	S	C	.	.	H	α-helix	trans	-61.2	-42.2	172.4	-70.6	171.5	-174.4	177.2	0	112.1	P1105 S1224 K1225 L1231 A1232	P1105-K1228 HydrophobicContact CB-CB 4.3Å; P1105-K1228 HydrophobicContact CG-CB 4.31Å; S1224-K1228 WeakPolarHBondContact O-CG 3.49Å; S1224-K1228 PolarHBondContact O-N 3.2Å; K1225-K1228 PolarHBondContact O-N 3.43Å; K1228-L1231 PolarHBondContact O-N 3.18Å; K1228-A1232 WeakPolarHBondContact O-CB 3.31Å; K1228-A1232 PolarHBondContact O-N 3.47Å
1229	A	95.6	Very high	92.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-62	-46.6	176.8	0	0	0	0	0	112	P1105 A1109 L1207 K1225 M1226 E1227 A1232 I1233	P1105-A1229 HydrophobicContact CB-CB 4.07Å; P1105-A1229 WeakPolarHBondContact O-CB 3.45Å; A1109-A1229 HydrophobicContact CB-CB 4.37Å; L1207-A1229 HydrophobicContact CD1-CB 4.14Å; L1207-A1229 HydrophobicContact CD2-CB 4.16Å; K1225-A1229 WeakPolarHBondContact O-CB 3.29Å; K1225-A1229 PolarHBondContact O-N 3.03Å; M1226-A1229 PolarHBondContact O-N 2.81Å; E1227-A1229 PolarHBondContact O-N 3.5Å; A1229-A1232 PolarHBondContact O-N 3.45Å; A1229-I1233 PolarHBondContact O-N 3.1Å
1230	S	94.5	Very high	92.4	Very high	12 Å²	12	43.5 Å²	43.5	8%	0.084	23%	0.231	C	C	.	.	H	α-helix	trans	-58.8	-47.2	174.3	170	0	0	0	0	111.1	D1204 M1226 E1227 A1232 I1233 R1234	D1204-S1230 PolarHBondContact OD1-OG 2.94Å; M1226-S1230 WeakPolarHBondContact O-CB 3.37Å; M1226-S1230 PolarHBondContact O-N 3.09Å; E1227-S1230 PolarHBondContact O-N 2.8Å; S1230-A1232 VanDerWaalsContact C-N 3.34Å; S1230-A1232 PolarHBondContact O-N 3.23Å; S1230-I1233 VanDerWaalsContact O-CG1 3.29Å; S1230-I1233 WeakPolarHBondContact O-CG1 3.46Å; S1230-I1233 PolarHBondContact O-N 2.92Å; S1230-R1234 VanDerWaalsContact O-CB 3.22Å; S1230-R1234 WeakPolarHBondContact O-CB 3.35Å; S1230-R1234 WeakPolarHBondContact O-CD 3.46Å; S1230-R1234 WeakPolarHBondContact O-CG 3.39Å; S1230-R1234 PolarHBondContact O-N 2.79Å; S1230-R1234 WeakPolarHBondContact OG-CD 3.28Å; S1230-R1234 PolarHBondContact OG-NE 3.4Å
1231	L	94.1	Very high	92	Very high	116 Å²	116	41.3 Å²	41.3	61%	0.607	22%	0.22	S	C	*	.	H	α-helix	trans	-62.8	-36.6	176.9	-70.6	171	0	0	0	113.1	E1227 K1228 R1234	E1227-L1231 HydrophobicContact CG-CD1 4.38Å; E1227-L1231 WeakPolarHBondContact O-CB 3.33Å; E1227-L1231 VanDerWaalsContact O-CG 3.3Å; E1227-L1231 WeakPolarHBondContact O-CG 3.47Å; E1227-L1231 PolarHBondContact O-N 3.02Å; K1228-L1231 PolarHBondContact O-N 3.18Å; L1231-R1234 PolarHBondContact O-N 3.07Å
1232	A	94.1	Very high	91.7	Very high	26 Å²	26	37 Å²	37	22%	0.215	19%	0.194	C	C	.	.	H	α-helix	trans	-66.4	-38.2	178.9	0	0	0	0	0	113	A1177 K1228 A1229 S1230	A1177-A1232 HydrophobicContact CB-CB 4.49Å; K1228-A1232 WeakPolarHBondContact O-CB 3.31Å; K1228-A1232 PolarHBondContact O-N 3.47Å; A1229-A1232 PolarHBondContact O-N 3.45Å; S1230-A1232 VanDerWaalsContact C-N 3.34Å; S1230-A1232 PolarHBondContact O-N 3.23Å
1233	I	94.8	Very high	91.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-81.8	-22.5	177.1	67.8	171.3	0	0	0	113.4	A1109 W1176 A1177 I1200 L1203 D1204 L1207 A1229 S1230 R1235 F1239	A1109-I1233 HydrophobicContact CB-CG2 4.38Å; W1176-I1233 PolarHBondContact NE1-O 3.3Å; A1177-I1233 HydrophobicContact CB-CG2 4.11Å; I1200-I1233 HydrophobicContact CG2-CB 3.83Å; I1200-I1233 HydrophobicContact CG2-CD1 3.98Å; I1200-I1233 HydrophobicContact CG2-CG1 4.29Å; I1200-I1233 HydrophobicContact CG2-CG2 4.5Å; L1203-I1233 HydrophobicContact CB-CD1 4.5Å; L1203-I1233 HydrophobicContact CD2-CD1 4.23Å; L1203-I1233 HydrophobicContact CG-CD1 4.16Å; D1204-I1233 HydrophobicContact CB-CD1 3.95Å; L1207-I1233 HydrophobicContact CD1-CD1 3.67Å; L1207-I1233 HydrophobicContact CD1-CG1 4.45Å; A1229-I1233 PolarHBondContact O-N 3.1Å; S1230-I1233 VanDerWaalsContact O-CG1 3.29Å; S1230-I1233 WeakPolarHBondContact O-CG1 3.46Å; S1230-I1233 PolarHBondContact O-N 2.92Å; I1233-R1235 VanDerWaalsContact C-N 3.31Å; I1233-R1235 PolarHBondContact O-N 3.42Å; I1233-F1239 WeakPolarHBondContact O-CE2 3.38Å
1234	R	91.9	Very high	90.9	Very high	99 Å²	99	37.4 Å²	37.4	37%	0.374	19%	0.194	S	C	.	.	S	Bend	trans	-76.4	66.8	-178.3	-81.6	172.8	160.6	-114	-28.6	113.7	D1204 K1208 S1230 L1231 F1239	D1204-R1234 WeakPolarHBondContact OD1-CD 3.17Å; D1204-R1234 IonicContact OD1-CZ 3.09Å; D1204-R1234 IonicContact OD1-NE 3.73Å; D1204-R1234 PolarHBondContact OD1-NE 3.34Å; D1204-R1234 IonicContact OD1-NH2 3.52Å; D1204-R1234 IonicContact OD2-CZ 3.69Å; D1204-R1234 VanDerWaalsContact OD2-CZ 3.29Å; D1204-R1234 IonicContact OD2-NE 2.84Å; D1204-R1234 PolarHBondContact OD2-NE 3.13Å; D1204-R1234 IonicContact OD2-NH2 3.58Å; D1204-R1234 PolarHBondContact OD2-NH2 2.82Å; K1208-R1234 VanDerWaalsContact CE-NH2 3.28Å; S1230-R1234 VanDerWaalsContact O-CB 3.22Å; S1230-R1234 WeakPolarHBondContact O-CB 3.35Å; S1230-R1234 WeakPolarHBondContact O-CD 3.46Å; S1230-R1234 WeakPolarHBondContact O-CG 3.39Å; S1230-R1234 PolarHBondContact O-N 2.79Å; S1230-R1234 WeakPolarHBondContact OG-CD 3.28Å; S1230-R1234 PolarHBondContact OG-NE 3.4Å; L1231-R1234 PolarHBondContact O-N 3.07Å; R1234-F1239 HydrophobicContact CB-CD2 4.39Å; R1234-F1239 HydrophobicContact CG-CD1 4.46Å; R1234-F1239 HydrophobicContact CG-CD2 4.27Å; R1234-F1239 HydrophobicContact CG-CE1 4.31Å; R1234-F1239 HydrophobicContact CG-CE2 4.09Å; R1234-F1239 HydrophobicContact CG-CG 4.44Å; R1234-F1239 HydrophobicContact CG-CZ 4.12Å
1235	R	89.9	Confident	90.1	Very high	44 Å²	44	36.4 Å²	36.4	17%	0.166	19%	0.186	C	C	.	.			trans	-143.5	165.2	178.5	63	-175.1	-178.7	86.7	-0	114.1	W1176 G1179 M1180 I1233 V1238	W1176-R1235 HydrophobicContact CH2-CG 4.22Å; W1176-R1235 HydrophobicContact CZ2-CG 3.58Å; W1176-R1235 PolarHBondContact O-NE 2.89Å; W1176-R1235 PolarHBondContact O-NH2 2.86Å; G1179-R1235 VanDerWaalsContact CA-NH2 3.29Å; M1180-R1235 PolarHBondContact O-NH1 3.48Å; M1180-R1235 PolarHBondContact O-NH2 3.43Å; I1233-R1235 VanDerWaalsContact C-N 3.31Å; I1233-R1235 PolarHBondContact O-N 3.42Å; R1235-V1238 PolarHBondContact O-N 3.3Å
1236	D	88.5	Confident	88.6	Confident	30 Å²	30	42.7 Å²	42.7	16%	0.16	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	53.9	-145.4	162.1	-56.5	-38	0	0	0	114.6	R618 W1176 V1238 F1239 T1240	R618-D1236 WeakPolarHBondContact CD-OD1 3.38Å; R618-D1236 IonicContact CZ-OD1 3.89Å; R618-D1236 IonicContact NE-OD1 3.35Å; R618-D1236 PolarHBondContact NE-OD1 3.37Å; R618-D1236 IonicContact NH1-OD1 3.79Å; R618-D1236 PolarHBondContact NH1-OD1 3.39Å; R618-D1236 IonicContact NH1-OD2 2.77Å; R618-D1236 PolarHBondContact NH1-OD2 3.21Å; R618-D1236 IonicContact NH2-OD1 3.07Å; W1176-D1236 HydrophobicContact CH2-CB 3.89Å; W1176-D1236 HydrophobicContact CZ2-CB 4.34Å; D1236-V1238 PolarHBondContact O-N 3.04Å; D1236-V1238 VanDerWaalsContact O-N 3.1Å; D1236-F1239 PolarHBondContact O-N 3.38Å; D1236-T1240 PolarHBondContact O-N 3.34Å; D1236-T1240 PolarHBondContact O-OG1 3.32Å
1237	I	89.3	Confident	88.3	Confident	6 Å²	6	44.9 Å²	44.9	3%	0.031	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-53.2	-27.6	-178.4	-174.4	61.4	0	0	0	114.4	L617 D621 L646 I648 W1176 F1182 T1240	L617-I1237 HydrophobicContact CD1-CD1 3.87Å; L617-I1237 HydrophobicContact CD2-CD1 3.55Å; L617-I1237 HydrophobicContact CG-CD1 4.38Å; D621-I1237 HydrophobicContact CB-CB 4.47Å; L646-I1237 HydrophobicContact CD1-CD1 4.35Å; L646-I1237 HydrophobicContact CD1-CG1 4.32Å; L646-I1237 HydrophobicContact CD2-CG1 3.99Å; I648-I1237 HydrophobicContact CG2-CD1 3.67Å; W1176-I1237 HydrophobicContact CH2-CG2 4.43Å; F1182-I1237 HydrophobicContact CB-CG2 3.64Å; F1182-I1237 HydrophobicContact CD1-CG2 3.96Å; F1182-I1237 HydrophobicContact CD2-CG2 3.4Å; F1182-I1237 HydrophobicContact CE2-CG2 4.02Å; F1182-I1237 HydrophobicContact CG-CG2 3.37Å; I1237-T1240 WeakPolarHBondContact CA-OG1 3.37Å
1238	V	89.3	Confident	88	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-70.9	-38.8	-175.6	-178.6	0	0	0	0	112.1	W1176 F1182 V1197 I1200 Q1201 R1235 D1236	W1176-V1238 HydrophobicContact CH2-CG2 3.94Å; W1176-V1238 HydrophobicContact CZ2-CB 4.04Å; W1176-V1238 HydrophobicContact CZ2-CG2 3.33Å; F1182-V1238 HydrophobicContact CD2-CG2 4.2Å; F1182-V1238 HydrophobicContact CE2-CG2 4.17Å; V1197-V1238 HydrophobicContact CG1-CG1 4.24Å; V1197-V1238 HydrophobicContact CG2-CG2 4.29Å; I1200-V1238 HydrophobicContact CB-CG1 3.74Å; I1200-V1238 HydrophobicContact CD1-CG2 4.09Å; I1200-V1238 HydrophobicContact CG2-CG1 3.71Å; Q1201-V1238 HydrophobicContact CG-CG1 4.2Å; Q1201-V1238 PolarHBondContact NE2-O 3.42Å; R1235-V1238 PolarHBondContact O-N 3.3Å; D1236-V1238 PolarHBondContact O-N 3.04Å; D1236-V1238 VanDerWaalsContact O-N 3.1Å
1239	F	88	Confident	87.6	Confident	55 Å²	55	38.7 Å²	38.7	24%	0.241	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-117	29.4	-178.9	-69.1	-89.8	0	0	0	112.5	I1200 Q1201 D1204 I1233 R1234 D1236 A1241	I1200-F1239 HydrophobicContact CG2-CE2 4.18Å; Q1201-F1239 HydrophobicContact CG-CE1 4.18Å; Q1201-F1239 HydrophobicContact CG-CZ 4.27Å; D1204-F1239 HydrophobicContact CB-CE1 4.07Å; D1204-F1239 HydrophobicContact CB-CZ 3.6Å; I1233-F1239 WeakPolarHBondContact O-CE2 3.38Å; R1234-F1239 HydrophobicContact CB-CD2 4.39Å; R1234-F1239 HydrophobicContact CG-CD1 4.46Å; R1234-F1239 HydrophobicContact CG-CD2 4.27Å; R1234-F1239 HydrophobicContact CG-CE1 4.31Å; R1234-F1239 HydrophobicContact CG-CE2 4.09Å; R1234-F1239 HydrophobicContact CG-CG 4.44Å; R1234-F1239 HydrophobicContact CG-CZ 4.12Å; D1236-F1239 PolarHBondContact O-N 3.38Å; F1239-A1241 PolarHBondContact O-N 2.75Å
1240	T	85.9	Confident	87.1	Confident	40 Å²	40	40.9 Å²	40.9	25%	0.245	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-64.4	130.6	174.3	-64.9	0	0	0	0	110.7	R616 L617 I648 D1236 I1237	R616-T1240 HydrophobicContact CB-CG2 4.45Å; L617-T1240 HydrophobicContact CD2-CG2 3.84Å; L617-T1240 WeakPolarHBondContact CD2-OG1 3.43Å; I648-T1240 HydrophobicContact CD1-CG2 4.04Å; D1236-T1240 PolarHBondContact O-N 3.34Å; D1236-T1240 PolarHBondContact O-OG1 3.32Å; I1237-T1240 WeakPolarHBondContact CA-OG1 3.37Å
1241	A	82.3	Confident	86.6	Confident	52 Å²	52	42.8 Å²	42.8	43%	0.43	22%	0.221	S	C	.	.	P	Polyproline II helix	trans	-60.1	136	-179.5	0	0	0	0	0	112.3	R616 F1239	R616-A1241 PolarHBondContact NH1-O 2.84Å; F1239-A1241 PolarHBondContact O-N 2.75Å
1242	S	85.8	Confident	86.1	Confident	13 Å²	13	37.9 Å²	37.9	9%	0.091	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-53.3	147	179.6	179.4	0	0	0	0	112.2	N373 R616 E651 Y1244 T1245	N373-S1242 PolarHBondContact ND2-OG 3.25Å; R616-S1242 PolarHBondContact NH1-O 2.68Å; E651-S1242 VanDerWaalsContact CD-OG 3.22Å; E651-S1242 WeakPolarHBondContact OE1-CB 2.99Å; E651-S1242 PolarHBondContact OE1-OG 2.99Å; E651-S1242 WeakPolarHBondContact OE2-CA 3.48Å; E651-S1242 PolarHBondContact OE2-OG 2.91Å; S1242-Y1244 VanDerWaalsContact C-N 3.25Å; S1242-Y1244 PolarHBondContact OG-N 2.91Å; S1242-Y1244 VanDerWaalsContact OG-N 3.1Å; S1242-T1245 PolarHBondContact O-OG1 3.14Å
1243	L	86.9	Confident	85.6	Confident	7 Å²	7	38.7 Å²	38.7	4%	0.037	19%	0.194	C	C	.	.	S	Bend	trans	-74	-17.2	171	-59.2	-174.6	0	0	0	112.3	I648 E651 V652 M655	I648-L1243 HydrophobicContact CG1-CD1 4.31Å; I648-L1243 HydrophobicContact CG1-CD2 4.49Å; I648-L1243 HydrophobicContact CG1-CG 4.37Å; E651-L1243 HydrophobicContact CB-CB 4.21Å; E651-L1243 HydrophobicContact CB-CD1 4.1Å; E651-L1243 HydrophobicContact CB-CG 4.28Å; E651-L1243 PolarHBondContact OE2-N 2.73Å; V652-L1243 HydrophobicContact CB-CD1 4.38Å; V652-L1243 HydrophobicContact CG2-CD1 3.38Å; M655-L1243 HydrophobicContact CE-CB 3.48Å; M655-L1243 VanDerWaalsContact CE-CB 3.48Å; M655-L1243 WeakPolarHBondContact CE-O 3.3Å; M655-L1243 HydrophobicContact SD-CB 4.12Å
1244	Y	84.1	Confident	84.8	Confident	12 Å²	12	41.7 Å²	41.7	5%	0.047	21%	0.209	C	C	.	.	S	Bend	trans	-85.6	-21.4	179.3	-70.9	-79.6	0	0	0	113.6	N373 Q374 R377 E651 E654 M655 S1242 H1246	N373-Y1244 HydrophobicContact CB-CD2 4.24Å; N373-Y1244 HydrophobicContact CB-CG 4.34Å; N373-Y1244 WeakPolarHBondContact O-CB 3.29Å; Q374-Y1244 HydrophobicContact CB-CE1 4.34Å; Q374-Y1244 HydrophobicContact CG-CE1 4.36Å; R377-Y1244 HydrophobicContact CB-CD1 4.36Å; E651-Y1244 HydrophobicContact CB-CD2 4.35Å; E651-Y1244 HydrophobicContact CB-CE2 4.01Å; E651-Y1244 HydrophobicContact CG-CD2 4Å; E651-Y1244 HydrophobicContact CG-CE2 3.81Å; E654-Y1244 WeakPolarHBondContact CB-OH 3.35Å; E654-Y1244 WeakPolarHBondContact OE2-CE2 3.31Å; E654-Y1244 PolarHBondContact OE2-OH 3.28Å; M655-Y1244 HydrophobicContact CE-CD1 3.56Å; M655-Y1244 HydrophobicContact CE-CD2 3.88Å; M655-Y1244 HydrophobicContact CE-CE1 3.63Å; M655-Y1244 HydrophobicContact CE-CE2 3.98Å; M655-Y1244 HydrophobicContact CE-CG 3.67Å; M655-Y1244 HydrophobicContact CG-CE1 4.48Å; S1242-Y1244 VanDerWaalsContact C-N 3.25Å; S1242-Y1244 PolarHBondContact OG-N 2.91Å; S1242-Y1244 VanDerWaalsContact OG-N 3.1Å; Y1244-H1246 VanDerWaalsContact C-N 3.27Å; Y1244-H1246 PolarHBondContact O-N 3.46Å
1245	T	77.9	Confident	84.2	Confident	28 Å²	28	36.9 Å²	36.9	17%	0.172	20%	0.195	C	C	.	.			trans	-85.9	6.6	-178.3	55.9	0	0	0	0	113.9	F376 L388 L395 S1242	F376-T1245 HydrophobicContact CD1-CG2 4.45Å; L388-T1245 HydrophobicContact CD2-CG2 3.95Å; L395-T1245 HydrophobicContact CD1-CG2 3.66Å; S1242-T1245 PolarHBondContact O-OG1 3.14Å
1246	H	63.3	Low	83.7	Confident	156 Å²	156	36.3 Å²	36.3	72%	0.722	20%	0.198	S	C	*	.			trans	-145.4	0	-177.1	-63.7	-67.7	0	0	0	111.3	Y1244	Y1244-H1246 VanDerWaalsContact C-N 3.27Å; Y1244-H1246 PolarHBondContact O-N 3.46Å

Retrieved 1,246 of 1,246 residues in 502.1 ms (Link to these results)

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