A0A3Q0KLG5_SCHMA Loading...

Putative helicase

AlphaFold DB , UniProt , Accession A0A3Q0KLG5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 2,424 aa.

						>A0A3Q0KLG5_SCHMA|A0A3Q0KLG5
MIGIDNTDHTKFEVVPNPSAVNIDRTIAGPHSDLEMRDKVVCYLRELLHVVQSSYHEDVVELNFIQSGSLLIEFYEWRRKKTQELMQALCSGHLDPEDLSLVSDYMSGHVNSDAIFPPNGAFPLCSGSQSVSLDNDSEDDEDERRLDENSLLKYAVDEVNILKRVLELKRDGLWSIDDSSCGTAETGSIDISTSISLVPPSEPTCRTYSDYMFAEINWLAEDFKRERQWKRVSAKKLALTALKCCRDKSERALKIEKEEVVRIRKMCAFIAKMIRDWWRQMDKIVQAKQQVRLTAKRQQAISSHLGQVLETTEEYTRWLTEGITSSKPEKTIVSSIKSSGGNNQNENVSDSGQRILKSPVKELDTSDEEFTADEVALTEVDDEETIEQEEKIATEDQHGSETSTAVELEQLASDADCPLEDLLPPGYLEFITSNSSVIPEAQYSSASEVNDSGEPYNRDRIEAHTCSSEIPKECQYSEKSEETKYEANVSVSEKKELDILKLEVSLSVKETMINSANKDEPNLEIASNTFDVESNSQSLLTKEIDDADNEVDLANSNVNECSSVKNGSVITLKKLMDHEVNASVMEAENNTDVVFTNSKCEETQKSSCQTSAGEPNVESTTNEGKNVSSGVGLATVSSPFLLSGGNLREYQLVGLSWLVATYDKRLNGILADEMGLGKTIQTISLLAYLACERGVWGPHLIVVPTSVILNWEVEFKRWCPSFKILTYFGNMKERKCKRKGWTKTNAFHVCITSYRLAIQDAIAFKRKKWKYLILDEAQNIKNFKSQRWQTLLTFNSQRRLLLTGTPLQNSLMELWSLMHFLMPNIFQSHRDFQEWFASPITGMIEGNTDHNELLVQRLHKVLRPFLLRRLKADVERQLPRKYEHVIMCRLSRRQRFLYDDFMSLGSTQETLKSGQFLSVMNILMQLRKVCNHPNLFETRPIISPFRVADSYLTYSLPRLLVSMSHPFLVFAPSSNGSRSVFGSASAFSDPDLDWLDTAGSVARLLGQTMNLVEMARDLPGFVAKRCRQLCARENLITIIDSSDVIDDVTSQRIQFNEMKKSRKSQGEYLNRSPFFDSKCFVYSDGYYPALSSPTNLEPTIVKVDFPKNSWDIGMPKSCLRRRFVERHNRLLLMSRINERRCDLTFKSHSNDVGTYWDHGTHIGPDLIFLINRLMLEKPSEDLQDVHIYPGLINGTVCCRQSLHTWPVKSSSLSSVISSTVDQISCFEGNIHQMSSLSLESIGSRRTSYLQSSHSLREMLHSPGDYLNDLREILKRFVFVVPAVISSGFTLQVSNHALEHQLINQEIRIRDMLLSSGCLHPSFFPMNSSEYHERKTFNRLTTWSPQMWLMPSKLHQLVMSCRIQFPDPRLIQYDCGKLQRLHSLLRELKSGNHRVLIFTQMARMLDILEQFLAYHGHRYLRLDGTTKVEQRQVLMERFNQDSQIFVFILSTRSGGLGINLTGADTVIFYDSDWNPTMDAQAQDRCHRIGQTRDVHIYRLISERTVEENILRKANQKRFLSDVAIEGGKFTTAFFKQNTITELFAEPSGLQDLAKMKGSATLVETSSLPHSDKKGTDSNFGSVPQSEDRVAVTGIVREIRPAGCMLSSTSASPRDVSANESTGPISNSEAQLEALLDACEEESDRIATRRVLDEAKADLAEFEEKSPYNEDNNDSIIADDNNSSNIPSVTAIEPFSCLRNCLQQSDEVNTASQNTNETLETIEQIVERELLGFESQLKPVERFGVRQVEEQREHMLNEQLDMADAELIESEKVWHLEKLKALHEADERRADLEDDDMFYCCGKYDLSSQLAELERLERIRMEETNDPDASINLLDSGQIFSSGRSKYPRKRPYDSCSTAHKTQARQVVCPGLSRTNKSTRSTSVGKVHKRLRLDKPKKPIDITFVSDSEKDEININQDISKRGKSTNQSTQIDIIESSKTGIEAFVEKMHFPPTVHSKRFHKSGIRNNNLYSRSNNPQSKTGACLQQDVISSRKLEKNYLSSRSYPVPELSEENVSYKGLEEIRHFDQSHYQYNRSTIQTQKRVDRRNTECHLPDKVFRFDEPNSVIFSNHYDPENVAHEEIVEANNLVELPFNQQSNNVLSDAFEVSVGSSIKLQSERIPGFHNDFPASEGLSPTGLSCPKYVGPPTTTTPGIHLQNRYQKSPDIPFRLLSPTTPLVQHPPEPMIPVQSIPDGSHLNLTARQVLASTGQPVFVITRQMKTPSGEIYQQRFTHPVAPPPQFTRMVYRLQKPSGIASRTSTLLETNRIRQPQLPTESSITCRPTVLSNSPTAGTLVMRPATKTINANVSPDPGLQDMATSVQHFAQPPRFSANGIKCATSIPVIRMINCDANKTSPIIRLVTSEINHINNDVTHSHNSQSVSALLTPTNTVRIGNTVRLIPNHISNSNTQVIRLQRVVSNLTHPKNT
					

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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	28	Very low	25.8	Very low	81 Å²	81	126.2 Å²	126.2	40%	0.399	67%	0.674	S	S	.	*				0	161	0	-63.6	178.5	-142.3	0	0	108.2	L1249 Q1250 H1253	M1-L1249 HydrophobicContact CE-CD1 3.72Å; M1-Q1250 VanDerWaalsContact CE-O 3.3Å; M1-Q1250 WeakPolarHBondContact CE-O 3.26Å; M1-H1253 HydrophobicContact CE-CB 3.47Å; M1-H1253 VanDerWaalsContact CE-CB 3.47Å; M1-H1253 VanDerWaalsContact CE-CD2 3.49Å; M1-H1253 WeakPolarHBondContact CE-CD2 3.48Å; M1-H1253 VanDerWaalsContact CE-N 3.29Å; M1-H1253 VanDerWaalsContact CG-CD2 3.45Å; M1-H1253 WeakPolarHBondContact CG-CD2 3.44Å; M1-H1253 HydrophobicContact SD-CB 3.71Å
2	I	23.1	Very low	25.8	Very low	163 Å²	163	129.8 Å²	129.8	84%	0.836	68%	0.679	S	S	*	*			cis	39.9	118	-14.9	-47.8	-178.2	0	0	0	117	I4	I2-I4 HydrophobicContact CG2-CD1 4.13Å
3	G	23.4	Very low	25.9	Very low	35 Å²	35	131.8 Å²	131.8	36%	0.361	68%	0.683	S	S	.	*			trans	108.2	72.4	-149.5	0	0	0	0	0	106.2
4	I	25	Very low	26.1	Very low	117 Å²	117	130.3 Å²	130.3	60%	0.6	68%	0.682	S	S	*	*				58.4	101.1	52.1	-53.2	164.2	0	0	0	110.5	I2	I2-I4 HydrophobicContact CG2-CD1 4.13Å
5	D	24.8	Very low	26.6	Very low	171 Å²	171	128.5 Å²	128.5	91%	0.914	68%	0.679	S	S	*	*				-133	103.4	129.7	-92.3	-42.4	0	0	0	107.2
6	N	26.3	Very low	26.9	Very low	133 Å²	133	127.9 Å²	127.9	71%	0.711	69%	0.685	S	S	*	*			trans	-93.5	124.1	176.4	-71.7	-20.9	0	0	0	108.8
7	T	25.8	Very low	27.1	Very low	138 Å²	138	127.8 Å²	127.8	85%	0.847	68%	0.684	S	S	*	*			trans	-145.7	141.6	147.4	50.2	0	0	0	0	110
8	D	26.5	Very low	27.2	Very low	123 Å²	123	127.5 Å²	127.5	66%	0.658	69%	0.69	S	S	*	*			cis	-157.3	174.1	-36.6	-153.6	-31.6	0	0	0	107.9
9	H	28.1	Very low	27	Very low	155 Å²	155	127.1 Å²	127.1	72%	0.718	70%	0.698	S	S	*	*			trans	83.6	133.2	160.4	-51.3	-20.1	0	0	0	118.6
10	T	27	Very low	26.9	Very low	104 Å²	104	125.1 Å²	125.1	64%	0.638	70%	0.699	S	S	*	*			cis	-160.1	162.6	-20.7	37.5	0	0	0	0	110.5
11	K	25.6	Very low	26.9	Very low	168 Å²	168	125.8 Å²	125.8	73%	0.73	71%	0.706	S	S	*	*			trans	76.2	108.3	166	-59	163.8	-168.1	169	0	115.6
12	F	25.7	Very low	26.8	Very low	169 Å²	169	129.5 Å²	129.5	74%	0.741	73%	0.728	S	S	*	*			cis	-147.6	165.9	0.9	-75.8	-70.1	0	0	0	108.7
13	E	26.9	Very low	26.9	Very low	156 Å²	156	128.8 Å²	128.8	73%	0.729	72%	0.724	S	S	*	*			cis	65.1	138.7	46	-100.4	-161.8	115.5	0	0	114.1
14	V	28.8	Very low	26.9	Very low	111 Å²	111	134.1 Å²	134.1	67%	0.673	74%	0.744	S	S	*	*			cis	-142.6	145.2	-5.4	-124.5	0	0	0	0	106.1
15	V	34.5	Very low	26.8	Very low	103 Å²	103	139 Å²	139	62%	0.624	76%	0.755	S	S	*	*			cis	78.5	125.5	20	-172.3	0	0	0	0	115.3
16	P	31.4	Very low	26.7	Very low	120 Å²	120	136.3 Å²	136.3	78%	0.779	75%	0.745	S	S	*	*				-130.4	118.1	127.2	35.8	-26.1	0	0	0	111.6
17	N	29.3	Very low	26.7	Very low	125 Å²	125	137.3 Å²	137.3	67%	0.668	75%	0.749	S	S	*	*				53.8	136.4	78.8	-74.5	2.2	0	0	0	113.9
18	P	29.4	Very low	26.7	Very low	123 Å²	123	135.7 Å²	135.7	80%	0.799	75%	0.75	S	S	*	*			cis	-145.6	151.7	49	39.7	-20.9	0	0	0	119.2
19	S	23.7	Very low	26.8	Very low	120 Å²	120	132.9 Å²	132.9	84%	0.839	75%	0.749	S	S	*	*			trans	-110	77.1	157.1	44	0	0	0	0	110.6
20	A	25.2	Very low	26.9	Very low	87 Å²	87	131.9 Å²	131.9	72%	0.719	76%	0.756	S	S	*	*			trans	-164.6	91.2	170.6	0	0	0	0	0	113.7
21	V	27.4	Very low	27.1	Very low	140 Å²	140	135 Å²	135	85%	0.848	76%	0.764	S	S	*	*			trans	-138.3	101.8	153.5	-179.3	0	0	0	0	108.6
22	N	25.2	Very low	27.3	Very low	159 Å²	159	130.7 Å²	130.7	85%	0.85	76%	0.755	S	S	*	*			trans	-67.7	136.5	158.9	-82.1	-33.2	0	0	0	108.8
23	I	24.8	Very low	27.6	Very low	148 Å²	148	127.7 Å²	127.7	76%	0.759	75%	0.746	S	S	*	*			trans	-166.3	114.4	135.4	-96	145.8	0	0	0	107.3	R25	I23-R25 WeakPolarHBondContact CG2-O 3.15Å
24	D	23.6	Very low	28	Very low	146 Å²	146	125.4 Å²	125.4	78%	0.781	74%	0.738	S	S	*	*			trans	-64.7	143.2	162.8	-79.4	-64.5	0	0	0	110.1
25	R	22.9	Very low	28.4	Very low	219 Å²	219	126 Å²	126	83%	0.826	73%	0.734	S	S	*	*			trans	73.8	139.6	177.6	-35.5	135.3	-174.5	-165.9	1.3	111.3	I23	I23-R25 WeakPolarHBondContact CG2-O 3.15Å
26	T	23.6	Very low	28.4	Very low	116 Å²	116	127.5 Å²	127.5	71%	0.712	74%	0.736	S	S	*	*			cis	-151.7	138.8	19	40.6	0	0	0	0	113.5
27	I	24.8	Very low	29	Very low	154 Å²	154	129.6 Å²	129.6	79%	0.79	73%	0.728	S	S	*	*			trans	62	109.7	132.2	-54.3	167	0	0	0	120
28	A	26.6	Very low	29.6	Very low	104 Å²	104	128 Å²	128	86%	0.86	72%	0.72	S	S	*	*			trans	66.1	119.5	143.7	0	0	0	0	0	122.6
29	G	29.6	Very low	30.2	Very low	63 Å²	63	129.6 Å²	129.6	65%	0.649	71%	0.714	S	S	*	*			trans	176.7	136.8	160.7	0	0	0	0	0	112
30	P	29.3	Very low	30.9	Very low	134 Å²	134	127.8 Å²	127.8	87%	0.87	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-94.2	120.6	179.6	33.7	-30.4	0	0	0	112.8
31	H	31.7	Very low	31.9	Very low	171 Å²	171	126.6 Å²	126.6	79%	0.792	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-77.2	147.1	164.6	-73.8	-105.8	0	0	0	110.3
32	S	30.1	Very low	32.5	Very low	77 Å²	77	123 Å²	123	54%	0.538	66%	0.661	S	S	.	*	P	Polyproline II helix	trans	-102.5	157.9	-163.3	61.6	0	0	0	0	114.3	L34	S32-L34 PolarHBondContact O-N 3.15Å
33	D	30.6	Very low	33.3	Very low	105 Å²	105	122.4 Å²	122.4	56%	0.561	65%	0.648	S	S	*	*	H	α-helix	trans	-61.5	-4.1	-179.3	-55.2	-46.9	0	0	0	114.9	R37	D33-R37 VanDerWaalsContact O-CB 3.3Å; D33-R37 WeakPolarHBondContact O-CB 3.39Å; D33-R37 WeakPolarHBondContact O-CG 3.47Å; D33-R37 PolarHBondContact O-N 3.11Å; D33-R37 VanDerWaalsContact O-N 3.08Å
34	L	35.7	Very low	34.2	Very low	108 Å²	108	119.8 Å²	119.8	57%	0.565	64%	0.635	S	S	*	*	H	α-helix	trans	-68.1	-47.8	179.7	-106	69.1	0	0	0	112.2	S32 M36 R37 D38	S32-L34 PolarHBondContact O-N 3.15Å; L34-M36 VanDerWaalsContact C-N 3.35Å; L34-M36 PolarHBondContact O-N 3.36Å; L34-R37 CarbonylContact O-C 3.23Å; L34-R37 WeakPolarHBondContact O-CA 2.98Å; L34-R37 WeakPolarHBondContact O-CB 3.44Å; L34-R37 PolarHBondContact O-N 2.72Å; L34-R37 VanDerWaalsContact O-N 3.09Å; L34-D38 PolarHBondContact O-N 2.8Å
35	E	36.7	Very low	35.3	Very low	123 Å²	123	120.1 Å²	120.1	58%	0.575	63%	0.626	S	S	*	*	H	α-helix	trans	-68.3	-33.4	-174.5	-66.3	-172.2	136.5	0	0	113	K39	E35-K39 WeakPolarHBondContact O-CG 3.25Å; E35-K39 PolarHBondContact O-N 2.81Å; E35-K39 VanDerWaalsContact O-N 3.1Å
36	M	35.9	Very low	36.3	Very low	135 Å²	135	115.9 Å²	115.9	67%	0.665	62%	0.615	S	S	*	*	H	α-helix	trans	-72.5	-37.4	170.7	-78.1	-164.1	-71.1	0	0	111.7	L34 V40	L34-M36 VanDerWaalsContact C-N 3.35Å; L34-M36 PolarHBondContact O-N 3.36Å; M36-V40 WeakPolarHBondContact O-CB 3.27Å; M36-V40 VanDerWaalsContact O-CG2 3.3Å; M36-V40 WeakPolarHBondContact O-CG2 3.28Å; M36-V40 PolarHBondContact O-N 3.14Å
37	R	42.2	Very low	37.6	Very low	164 Å²	164	113.8 Å²	113.8	62%	0.619	60%	0.599	S	S	*	*	H	α-helix	trans	-59.6	-45	170.2	-87.9	-177.4	167.6	125.2	0.9	111.6	D33 L34 V40 V41	D33-R37 VanDerWaalsContact O-CB 3.3Å; D33-R37 WeakPolarHBondContact O-CB 3.39Å; D33-R37 WeakPolarHBondContact O-CG 3.47Å; D33-R37 PolarHBondContact O-N 3.11Å; D33-R37 VanDerWaalsContact O-N 3.08Å; L34-R37 CarbonylContact O-C 3.23Å; L34-R37 WeakPolarHBondContact O-CA 2.98Å; L34-R37 WeakPolarHBondContact O-CB 3.44Å; L34-R37 PolarHBondContact O-N 2.72Å; L34-R37 VanDerWaalsContact O-N 3.09Å; R37-V40 PolarHBondContact O-N 3.4Å; R37-V41 WeakPolarHBondContact O-CB 3.12Å; R37-V41 WeakPolarHBondContact O-CG2 3.09Å; R37-V41 PolarHBondContact O-N 3.04Å
38	D	43.4	Very low	38.7	Very low	92 Å²	92	109.8 Å²	109.8	49%	0.492	58%	0.579	S	S	.	*	H	α-helix	trans	-67.8	-39.6	-177.5	-73.3	-30.6	0	0	0	111.8	L34 V41 C42	L34-D38 PolarHBondContact O-N 2.8Å; D38-V41 PolarHBondContact O-N 2.89Å; D38-C42 WeakPolarHBondContact O-CB 3.5Å; D38-C42 PolarHBondContact O-N 3.47Å; D38-C42 PolarHBondContact O-SG 3.1Å
39	K	40.5	Very low	39.9	Very low	156 Å²	156	109.6 Å²	109.6	68%	0.678	56%	0.56	S	S	*	*	H	α-helix	trans	-64.4	-43.8	172.6	-73.7	174.6	-179.9	173.5	0	112.6	E35 V41 C42 Y43	E35-K39 WeakPolarHBondContact O-CG 3.25Å; E35-K39 PolarHBondContact O-N 2.81Å; E35-K39 VanDerWaalsContact O-N 3.1Å; K39-V41 VanDerWaalsContact C-N 3.34Å; K39-C42 PolarHBondContact O-N 2.97Å; K39-Y43 PolarHBondContact O-N 2.75Å
40	V	40.3	Very low	41	Very low	83 Å²	83	111.4 Å²	111.4	50%	0.503	56%	0.558	S	S	.	*	H	α-helix	trans	-66.9	-35.7	174.9	171.5	0	0	0	0	111.3	M36 R37 L44	M36-V40 WeakPolarHBondContact O-CB 3.27Å; M36-V40 VanDerWaalsContact O-CG2 3.3Å; M36-V40 WeakPolarHBondContact O-CG2 3.28Å; M36-V40 PolarHBondContact O-N 3.14Å; R37-V40 PolarHBondContact O-N 3.4Å; V40-L44 HydrophobicContact CG1-CD1 3.82Å; V40-L44 HydrophobicContact CG1-CG 4.25Å; V40-L44 VanDerWaalsContact O-CB 3.24Å; V40-L44 WeakPolarHBondContact O-CB 3.5Å; V40-L44 VanDerWaalsContact O-CG 3.22Å; V40-L44 WeakPolarHBondContact O-CG 3.17Å; V40-L44 PolarHBondContact O-N 3.41Å
41	V	45.3	Very low	41.7	Very low	61 Å²	61	106.6 Å²	106.6	37%	0.37	53%	0.527	S	S	.	.	H	α-helix	trans	-68.3	-36.1	174.5	161.9	0	0	0	0	111.3	R37 D38 K39 R45	R37-V41 WeakPolarHBondContact O-CB 3.12Å; R37-V41 WeakPolarHBondContact O-CG2 3.09Å; R37-V41 PolarHBondContact O-N 3.04Å; D38-V41 PolarHBondContact O-N 2.89Å; K39-V41 VanDerWaalsContact C-N 3.34Å; V41-R45 WeakPolarHBondContact O-CB 2.96Å; V41-R45 PolarHBondContact O-N 2.75Å
42	C	39.7	Very low	42.6	Very low	64 Å²	64	103 Å²	103	43%	0.432	51%	0.51	S	S	.	.	H	α-helix	trans	-65.5	-50.1	172.4	-77.9	0	0	0	0	111.5	D38 K39 L44 R45 E46	D38-C42 WeakPolarHBondContact O-CB 3.5Å; D38-C42 PolarHBondContact O-N 3.47Å; D38-C42 PolarHBondContact O-SG 3.1Å; K39-C42 PolarHBondContact O-N 2.97Å; C42-L44 PolarHBondContact O-N 2.99Å; C42-R45 CarbonylContact O-C 3.45Å; C42-R45 WeakPolarHBondContact O-CA 3.34Å; C42-R45 WeakPolarHBondContact O-CB 3.36Å; C42-R45 PolarHBondContact O-N 2.83Å; C42-E46 PolarHBondContact O-N 2.93Å
43	Y	42.7	Very low	43.3	Very low	147 Å²	147	102.2 Å²	102.2	58%	0.576	51%	0.505	S	S	*	.	H	α-helix	trans	-61.3	-41.6	176.8	179.2	-111.9	0	0	0	112.7	K39 R45 E46 L47	K39-Y43 PolarHBondContact O-N 2.75Å; Y43-R45 VanDerWaalsContact C-N 3.28Å; Y43-R45 PolarHBondContact O-N 3.14Å; Y43-E46 PolarHBondContact O-N 3.22Å; Y43-L47 HydrophobicContact CD1-CD1 4.07Å; Y43-L47 HydrophobicContact CE1-CD1 3.52Å; Y43-L47 HydrophobicContact CE2-CD1 4.32Å; Y43-L47 WeakPolarHBondContact O-CB 3.38Å; Y43-L47 PolarHBondContact O-N 3.41Å
44	L	42.1	Very low	44	Very low	93 Å²	93	99.6 Å²	99.6	49%	0.487	50%	0.495	S	S	.	.	H	α-helix	trans	-67.1	-26.8	172.6	-73.2	174.2	0	0	0	112.8	V40 C42 L48	V40-L44 HydrophobicContact CG1-CD1 3.82Å; V40-L44 HydrophobicContact CG1-CG 4.25Å; V40-L44 VanDerWaalsContact O-CB 3.24Å; V40-L44 WeakPolarHBondContact O-CB 3.5Å; V40-L44 VanDerWaalsContact O-CG 3.22Å; V40-L44 WeakPolarHBondContact O-CG 3.17Å; V40-L44 PolarHBondContact O-N 3.41Å; C42-L44 PolarHBondContact O-N 2.99Å; L44-L48 VanDerWaalsContact O-CB 3.28Å; L44-L48 WeakPolarHBondContact O-CB 3.4Å; L44-L48 PolarHBondContact O-N 2.74Å
45	R	48	Very low	44.4	Very low	154 Å²	154	101 Å²	101	58%	0.581	49%	0.493	S	S	*	.	H	α-helix	trans	-76.6	-37.2	175.1	-171.4	-174.4	-55.7	168.3	5.1	111.3	V41 C42 Y43 L48 H49	V41-R45 WeakPolarHBondContact O-CB 2.96Å; V41-R45 PolarHBondContact O-N 2.75Å; C42-R45 CarbonylContact O-C 3.45Å; C42-R45 WeakPolarHBondContact O-CA 3.34Å; C42-R45 WeakPolarHBondContact O-CB 3.36Å; C42-R45 PolarHBondContact O-N 2.83Å; Y43-R45 VanDerWaalsContact C-N 3.28Å; Y43-R45 PolarHBondContact O-N 3.14Å; R45-L48 PolarHBondContact O-N 3.05Å; R45-H49 WeakPolarHBondContact O-CB 3.09Å; R45-H49 PolarHBondContact O-N 3.29Å
46	E	44	Very low	45.1	Very low	130 Å²	130	97.2 Å²	97.2	61%	0.607	48%	0.476	S	S	*	.	H	α-helix	trans	-64.7	-47	170.4	-70.4	177	131.3	0	0	111	C42 Y43 L48 H49 V50	C42-E46 PolarHBondContact O-N 2.93Å; Y43-E46 PolarHBondContact O-N 3.22Å; E46-L48 VanDerWaalsContact C-N 3.33Å; E46-L48 PolarHBondContact O-N 3.22Å; E46-H49 WeakPolarHBondContact O-CB 3.29Å; E46-H49 PolarHBondContact O-N 3.45Å; E46-V50 WeakPolarHBondContact O-CG2 3.46Å; E46-V50 PolarHBondContact O-N 3.12Å
47	L	49.4	Very low	46	Very low	72 Å²	72	95 Å²	95	38%	0.377	46%	0.464	S	S	.	.	H	α-helix	trans	-59.6	-41.7	172.7	-91.4	164.6	0	0	0	112.4	Y43 H49 V50 V51	Y43-L47 HydrophobicContact CD1-CD1 4.07Å; Y43-L47 HydrophobicContact CE1-CD1 3.52Å; Y43-L47 HydrophobicContact CE2-CD1 4.32Å; Y43-L47 WeakPolarHBondContact O-CB 3.38Å; Y43-L47 PolarHBondContact O-N 3.41Å; L47-H49 VanDerWaalsContact C-N 3.32Å; L47-V50 PolarHBondContact O-N 2.86Å; L47-V51 WeakPolarHBondContact O-CG2 3.45Å; L47-V51 PolarHBondContact O-N 3.45Å
48	L	48.4	Very low	46.6	Very low	69 Å²	69	90 Å²	90	36%	0.361	45%	0.449	S	S	.	.	H	α-helix	trans	-60.9	-41.6	171.2	-104.9	161.8	0	0	0	111.5	L44 R45 E46 V51 Q52 W1342	L44-L48 VanDerWaalsContact O-CB 3.28Å; L44-L48 WeakPolarHBondContact O-CB 3.4Å; L44-L48 PolarHBondContact O-N 2.74Å; R45-L48 PolarHBondContact O-N 3.05Å; E46-L48 VanDerWaalsContact C-N 3.33Å; E46-L48 PolarHBondContact O-N 3.22Å; L48-V51 PolarHBondContact O-N 3Å; L48-Q52 WeakPolarHBondContact O-CA 3.17Å; L48-Q52 WeakPolarHBondContact O-CB 3.28Å; L48-Q52 PolarHBondContact O-N 2.95Å; L48-W1342 HydrophobicContact CD2-CZ2 4.05Å
49	H	52.6	Low	47.3	Very low	101 Å²	101	87.1 Å²	87.1	47%	0.468	44%	0.435	S	S	.	.	H	α-helix	trans	-66.7	-40.4	-179.8	-148.4	-49.1	0	0	0	111.9	R45 E46 L47 Q52 S53	R45-H49 WeakPolarHBondContact O-CB 3.09Å; R45-H49 PolarHBondContact O-N 3.29Å; E46-H49 WeakPolarHBondContact O-CB 3.29Å; E46-H49 PolarHBondContact O-N 3.45Å; L47-H49 VanDerWaalsContact C-N 3.32Å; H49-Q52 PolarHBondContact O-N 3.47Å; H49-S53 WeakPolarHBondContact O-CB 3.4Å; H49-S53 PolarHBondContact O-N 2.91Å; H49-S53 PolarHBondContact O-OG 2.66Å; H49-S53 VanDerWaalsContact O-OG 3.06Å
50	V	52.4	Low	48	Very low	100 Å²	100	81.9 Å²	81.9	61%	0.606	42%	0.416	S	S	*	.	H	α-helix	trans	-64.2	-46	175.6	171.9	0	0	0	0	111.1	E46 L47 S53 S54	E46-V50 WeakPolarHBondContact O-CG2 3.46Å; E46-V50 PolarHBondContact O-N 3.12Å; L47-V50 PolarHBondContact O-N 2.86Å; V50-S53 PolarHBondContact O-N 2.75Å; V50-S54 PolarHBondContact O-N 3.35Å
51	V	44.6	Very low	49	Very low	34 Å²	34	80.7 Å²	80.7	21%	0.206	41%	0.405	C	S	.	.	H	α-helix	trans	-72.7	-33.2	178.1	178.3	0	0	0	0	112	L47 L48 S53 S54 Y55 W1342	L47-V51 WeakPolarHBondContact O-CG2 3.45Å; L47-V51 PolarHBondContact O-N 3.45Å; L48-V51 PolarHBondContact O-N 3Å; V51-S53 VanDerWaalsContact C-N 3.34Å; V51-S54 PolarHBondContact O-N 3.36Å; V51-S54 PolarHBondContact O-OG 3.39Å; V51-Y55 WeakPolarHBondContact O-CB 3.37Å; V51-Y55 PolarHBondContact O-N 2.89Å; V51-W1342 HydrophobicContact CB-CH2 4.14Å; V51-W1342 HydrophobicContact CG1-CH2 3.67Å; V51-W1342 HydrophobicContact CG1-CZ3 3.81Å; V51-W1342 HydrophobicContact CG2-CH2 4.37Å
52	Q	50.1	Low	49.7	Very low	94 Å²	94	82 Å²	82	44%	0.439	41%	0.409	S	S	.	.	H	α-helix	trans	-67.7	-36.2	173.9	-177.2	173.8	-25.3	0	0	110.9	L48 H49 H56	L48-Q52 WeakPolarHBondContact O-CA 3.17Å; L48-Q52 WeakPolarHBondContact O-CB 3.28Å; L48-Q52 PolarHBondContact O-N 2.95Å; H49-Q52 PolarHBondContact O-N 3.47Å; Q52-H56 WeakPolarHBondContact O-CB 3.49Å; Q52-H56 PolarHBondContact O-N 3.04Å
53	S	45.1	Very low	50.4	Low	61 Å²	61	83.5 Å²	83.5	43%	0.427	41%	0.413	S	S	.	.	H	α-helix	trans	-68.5	-44.6	171.5	-69.1	0	0	0	0	112.5	H49 V50 V51 H56 E57	H49-S53 WeakPolarHBondContact O-CB 3.4Å; H49-S53 PolarHBondContact O-N 2.91Å; H49-S53 PolarHBondContact O-OG 2.66Å; H49-S53 VanDerWaalsContact O-OG 3.06Å; V50-S53 PolarHBondContact O-N 2.75Å; V51-S53 VanDerWaalsContact C-N 3.34Å; S53-H56 WeakPolarHBondContact O-CB 3.3Å; S53-H56 PolarHBondContact O-N 3Å; S53-H56 VanDerWaalsContact O-N 3.14Å; S53-E57 PolarHBondContact O-N 3.05Å
54	S	44.6	Very low	51.5	Low	50 Å²	50	76.9 Å²	76.9	35%	0.35	39%	0.387	S	S	.	.	H	α-helix	trans	-63.7	-45.5	176.1	75.4	0	0	0	0	111.2	V50 V51 H56 E57 D58	V50-S54 PolarHBondContact O-N 3.35Å; V51-S54 PolarHBondContact O-N 3.36Å; V51-S54 PolarHBondContact O-OG 3.39Å; S54-H56 PolarHBondContact O-N 2.75Å; S54-E57 CarbonylContact O-C 3.54Å; S54-E57 WeakPolarHBondContact O-CA 3.15Å; S54-E57 WeakPolarHBondContact O-CB 3.5Å; S54-E57 PolarHBondContact O-N 3.02Å; S54-D58 PolarHBondContact O-N 3.26Å
55	Y	44.8	Very low	52.3	Low	138 Å²	138	76.1 Å²	76.1	54%	0.541	38%	0.383	S	S	.	.	H	α-helix	trans	-59.1	-31.2	173.6	-179.3	-100.3	0	0	0	112.4	V51 D58 V59	V51-Y55 WeakPolarHBondContact O-CB 3.37Å; V51-Y55 PolarHBondContact O-N 2.89Å; Y55-D58 WeakPolarHBondContact CA-OD2 3.34Å; Y55-V59 HydrophobicContact CD1-CG2 4.01Å; Y55-V59 HydrophobicContact CD2-CG2 4.22Å; Y55-V59 HydrophobicContact CE1-CG2 3.6Å; Y55-V59 HydrophobicContact CE2-CG2 3.83Å; Y55-V59 HydrophobicContact CG-CG2 4.3Å; Y55-V59 WeakPolarHBondContact O-CB 3.49Å; Y55-V59 WeakPolarHBondContact O-CG2 3.33Å; Y55-V59 PolarHBondContact O-N 2.8Å
56	H	50.5	Low	52.5	Low	44 Å²	44	75.9 Å²	75.9	20%	0.204	39%	0.388	C	S	.	.	H	α-helix	trans	-71.2	-34	172.6	-124.1	-67.4	0	0	0	112.7	Q52 S53 S54 V60	Q52-H56 WeakPolarHBondContact O-CB 3.49Å; Q52-H56 PolarHBondContact O-N 3.04Å; S53-H56 WeakPolarHBondContact O-CB 3.3Å; S53-H56 PolarHBondContact O-N 3Å; S53-H56 VanDerWaalsContact O-N 3.14Å; S54-H56 PolarHBondContact O-N 2.75Å; H56-V60 VanDerWaalsContact O-CB 3.3Å; H56-V60 WeakPolarHBondContact O-CB 3.45Å; H56-V60 WeakPolarHBondContact O-CG2 3.4Å; H56-V60 PolarHBondContact O-N 2.76Å
57	E	55.2	Low	53	Low	89 Å²	89	73.6 Å²	73.6	42%	0.416	39%	0.387	S	S	.	.	H	α-helix	trans	-67.5	-49.5	169.6	-61.9	-165.1	124.5	0	0	110.5	S53 S54 V59 V60 E61 R78	S53-E57 PolarHBondContact O-N 3.05Å; S54-E57 CarbonylContact O-C 3.54Å; S54-E57 WeakPolarHBondContact O-CA 3.15Å; S54-E57 WeakPolarHBondContact O-CB 3.5Å; S54-E57 PolarHBondContact O-N 3.02Å; E57-V59 VanDerWaalsContact C-N 3.32Å; E57-V59 PolarHBondContact O-N 3.3Å; E57-V60 PolarHBondContact O-N 3.38Å; E57-V60 VanDerWaalsContact O-N 3.13Å; E57-E61 WeakPolarHBondContact O-CB 3.37Å; E57-E61 PolarHBondContact O-N 3.33Å; E57-R78 IonicContact OE1-CZ 3.74Å; E57-R78 IonicContact OE1-NH1 2.74Å; E57-R78 PolarHBondContact OE1-NH1 2.94Å; E57-R78 IonicContact OE1-NH2 3.4Å; E57-R78 PolarHBondContact OE1-NH2 3.37Å
58	D	55	Low	52.5	Low	58 Å²	58	70.6 Å²	70.6	31%	0.31	37%	0.373	S	S	.	.	H	α-helix	trans	-56.3	-42.3	177.4	-55.8	-34.9	0	0	0	112.2	S54 Y55 L62	S54-D58 PolarHBondContact O-N 3.26Å; Y55-D58 WeakPolarHBondContact CA-OD2 3.34Å; D58-L62 VanDerWaalsContact O-CB 3.31Å; D58-L62 WeakPolarHBondContact O-CB 3.38Å; D58-L62 VanDerWaalsContact O-CG 3.28Å; D58-L62 WeakPolarHBondContact O-CG 3.37Å; D58-L62 PolarHBondContact O-N 2.86Å
59	V	57.7	Low	52.6	Low	31 Å²	31	68.1 Å²	68.1	19%	0.188	36%	0.361	C	S	.	.	H	α-helix	trans	-72.6	-36.7	178.1	166.2	0	0	0	0	111.8	Y55 E57 E61 N63	Y55-V59 HydrophobicContact CD1-CG2 4.01Å; Y55-V59 HydrophobicContact CD2-CG2 4.22Å; Y55-V59 HydrophobicContact CE1-CG2 3.6Å; Y55-V59 HydrophobicContact CE2-CG2 3.83Å; Y55-V59 HydrophobicContact CG-CG2 4.3Å; Y55-V59 WeakPolarHBondContact O-CB 3.49Å; Y55-V59 WeakPolarHBondContact O-CG2 3.33Å; Y55-V59 PolarHBondContact O-N 2.8Å; E57-V59 VanDerWaalsContact C-N 3.32Å; E57-V59 PolarHBondContact O-N 3.3Å; V59-E61 VanDerWaalsContact C-N 3.35Å; V59-N63 WeakPolarHBondContact CG1-ND2 3.48Å; V59-N63 WeakPolarHBondContact O-CB 3.41Å; V59-N63 PolarHBondContact O-N 3.14Å; V59-N63 PolarHBondContact O-ND2 2.72Å
60	V	55.9	Low	52.7	Low	46 Å²	46	67.2 Å²	67.2	28%	0.279	36%	0.359	S	S	.	.	H	α-helix	trans	-72	-33.8	176.2	172.4	0	0	0	0	110.5	H56 E57 F64 F74 W77	H56-V60 VanDerWaalsContact O-CB 3.3Å; H56-V60 WeakPolarHBondContact O-CB 3.45Å; H56-V60 WeakPolarHBondContact O-CG2 3.4Å; H56-V60 PolarHBondContact O-N 2.76Å; E57-V60 PolarHBondContact O-N 3.38Å; E57-V60 VanDerWaalsContact O-N 3.13Å; V60-F64 WeakPolarHBondContact O-CB 3.23Å; V60-F64 PolarHBondContact O-N 3.29Å; V60-F74 HydrophobicContact CG1-CE2 3.99Å; V60-F74 HydrophobicContact CG1-CZ 4.37Å; V60-W77 HydrophobicContact CG1-CH2 4.23Å; V60-W77 HydrophobicContact CG1-CZ3 3.68Å
61	E	60.4	Low	52.7	Low	59 Å²	59	64.1 Å²	64.1	28%	0.276	34%	0.339	S	S	.	.	H	α-helix	trans	-65.2	-48.9	170.2	-168.8	174.3	132.8	0	0	111.6	E57 V59 N63 F64 I65 L71 F74	E57-E61 WeakPolarHBondContact O-CB 3.37Å; E57-E61 PolarHBondContact O-N 3.33Å; V59-E61 VanDerWaalsContact C-N 3.35Å; E61-N63 PolarHBondContact O-N 2.94Å; E61-F64 WeakPolarHBondContact O-CA 3.49Å; E61-F64 WeakPolarHBondContact O-CB 3.42Å; E61-F64 PolarHBondContact O-N 2.94Å; E61-F64 VanDerWaalsContact O-N 3.07Å; E61-I65 HydrophobicContact CG-CD1 4.22Å; E61-I65 WeakPolarHBondContact O-CG1 3.36Å; E61-I65 PolarHBondContact O-N 2.96Å; E61-L71 HydrophobicContact CG-CD1 3.59Å; E61-F74 VanDerWaalsContact CA-CE2 3.44Å; E61-F74 HydrophobicContact CB-CE1 4.19Å; E61-F74 HydrophobicContact CB-CE2 3.93Å; E61-F74 HydrophobicContact CB-CZ 3.73Å; E61-F74 HydrophobicContact CG-CD1 4.49Å; E61-F74 HydrophobicContact CG-CE1 4.33Å; E61-F74 HydrophobicContact CG-CE2 4.38Å; E61-F74 HydrophobicContact CG-CZ 4.27Å
62	L	61	Low	53	Low	89 Å²	89	68.1 Å²	68.1	47%	0.466	36%	0.359	S	S	.	.	H	α-helix	trans	-60.8	-40.5	175.1	-79.6	167	0	0	0	112.7	D58 F64 I65 Q66	D58-L62 VanDerWaalsContact O-CB 3.31Å; D58-L62 WeakPolarHBondContact O-CB 3.38Å; D58-L62 VanDerWaalsContact O-CG 3.28Å; D58-L62 WeakPolarHBondContact O-CG 3.37Å; D58-L62 PolarHBondContact O-N 2.86Å; L62-F64 VanDerWaalsContact C-N 3.3Å; L62-F64 PolarHBondContact O-N 3.41Å; L62-I65 PolarHBondContact O-N 3.5Å; L62-Q66 VanDerWaalsContact O-CB 3.26Å; L62-Q66 WeakPolarHBondContact O-CB 3.44Å; L62-Q66 WeakPolarHBondContact O-CG 3.44Å; L62-Q66 PolarHBondContact O-N 2.99Å
63	N	54.4	Low	53.4	Low	95 Å²	95	64.3 Å²	64.3	51%	0.508	34%	0.341	S	S	.	.	H	α-helix	trans	-64.1	-37.1	173.6	-86.3	-84.2	0	0	0	111.5	V59 E61 Q66 S67	V59-N63 WeakPolarHBondContact CG1-ND2 3.48Å; V59-N63 WeakPolarHBondContact O-CB 3.41Å; V59-N63 PolarHBondContact O-N 3.14Å; V59-N63 PolarHBondContact O-ND2 2.72Å; E61-N63 PolarHBondContact O-N 2.94Å; N63-Q66 PolarHBondContact O-N 2.95Å; N63-S67 WeakPolarHBondContact O-CB 3.26Å; N63-S67 PolarHBondContact O-N 2.86Å
64	F	65.3	Low	54.2	Low	7 Å²	7	61.6 Å²	61.6	3%	0.031	32%	0.321	C	S	.	.	H	α-helix	trans	-67.5	-43.8	176.4	-172.9	-104.9	0	0	0	111.9	V60 E61 L62 S67 S69 L70 E73 F74 W77	V60-F64 WeakPolarHBondContact O-CB 3.23Å; V60-F64 PolarHBondContact O-N 3.29Å; E61-F64 WeakPolarHBondContact O-CA 3.49Å; E61-F64 WeakPolarHBondContact O-CB 3.42Å; E61-F64 PolarHBondContact O-N 2.94Å; E61-F64 VanDerWaalsContact O-N 3.07Å; L62-F64 VanDerWaalsContact C-N 3.3Å; L62-F64 PolarHBondContact O-N 3.41Å; F64-S67 PolarHBondContact O-N 3.31Å; F64-S67 PolarHBondContact O-OG 3.38Å; F64-S69 VanDerWaalsContact CE1-CB 3.47Å; F64-S69 PolarHBondContact O-N 2.85Å; F64-L70 WeakPolarHBondContact CE1-O 3.14Å; F64-E73 HydrophobicContact CE1-CB 4.3Å; F64-E73 VanDerWaalsContact CZ-C 3.43Å; F64-E73 HydrophobicContact CZ-CB 3.83Å; F64-F74 HydrophobicContact CB-CD2 3.86Å; F64-F74 HydrophobicContact CB-CE2 4.26Å; F64-F74 HydrophobicContact CD1-CB 3.78Å; F64-F74 AromaticContact CD1-CD2 3.82Å; F64-F74 HydrophobicContact CD1-CD2 3.82Å; F64-F74 HydrophobicContact CD1-CG 4.28Å; F64-F74 HydrophobicContact CE1-CB 3.76Å; F64-F74 HydrophobicContact CE1-CD2 4.49Å; F64-F74 AromaticContact CG-CD2 3.83Å; F64-F74 HydrophobicContact CG-CD2 3.83Å; F64-W77 HydrophobicContact CD2-CB 4.25Å; F64-W77 HydrophobicContact CD2-CD2 4.01Å; F64-W77 HydrophobicContact CD2-CE3 4.36Å; F64-W77 AromaticContact CD2-CG 3.96Å; F64-W77 HydrophobicContact CD2-CG 3.96Å; F64-W77 HydrophobicContact CE2-CB 3.55Å; F64-W77 AromaticContact CE2-CD1 3.85Å; F64-W77 HydrophobicContact CE2-CD2 4.12Å; F64-W77 AromaticContact CE2-CG 3.56Å; F64-W77 HydrophobicContact CE2-CG 3.56Å; F64-W77 HydrophobicContact CZ-CB 4.04Å
65	I	58	Low	54.7	Low	78 Å²	78	66.7 Å²	66.7	40%	0.4	33%	0.334	S	S	.	.	H	α-helix	trans	-60.5	-47.8	172.2	-63.3	162.4	0	0	0	110.5	E61 L62 S67 G68 L71	E61-I65 HydrophobicContact CG-CD1 4.22Å; E61-I65 WeakPolarHBondContact O-CG1 3.36Å; E61-I65 PolarHBondContact O-N 2.96Å; L62-I65 PolarHBondContact O-N 3.5Å; I65-S67 VanDerWaalsContact C-N 3.29Å; I65-S67 PolarHBondContact O-N 3.14Å; I65-G68 PolarHBondContact O-N 3.04Å; I65-G68 VanDerWaalsContact O-N 3.09Å; I65-L71 HydrophobicContact CD1-CD1 3.65Å; I65-L71 HydrophobicContact CG1-CD1 3.53Å
66	Q	52.7	Low	55.2	Low	149 Å²	149	63.8 Å²	63.8	70%	0.696	33%	0.325	S	S	*	.	H	α-helix	trans	-65.4	-29.1	180	-74.7	176.9	12.3	0	0	113.1	L62 N63 G68	L62-Q66 VanDerWaalsContact O-CB 3.26Å; L62-Q66 WeakPolarHBondContact O-CB 3.44Å; L62-Q66 WeakPolarHBondContact O-CG 3.44Å; L62-Q66 PolarHBondContact O-N 2.99Å; N63-Q66 PolarHBondContact O-N 2.95Å; Q66-G68 PolarHBondContact O-N 2.9Å; Q66-G68 VanDerWaalsContact O-N 3.16Å
67	S	54.5	Low	55.9	Low	82 Å²	82	65.5 Å²	65.5	57%	0.573	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-18	173.9	80.4	0	0	0	0	113.3	N63 F64 I65 S69	N63-S67 WeakPolarHBondContact O-CB 3.26Å; N63-S67 PolarHBondContact O-N 2.86Å; F64-S67 PolarHBondContact O-N 3.31Å; F64-S67 PolarHBondContact O-OG 3.38Å; I65-S67 VanDerWaalsContact C-N 3.29Å; I65-S67 PolarHBondContact O-N 3.14Å; S67-S69 PolarHBondContact OG-OG 3.37Å
68	G	39.4	Very low	55.8	Low	8 Å²	8	66.7 Å²	66.7	8%	0.082	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.5	57.3	-168.1	0	0	0	0	0	111.6	I65 Q66 F2239 T2240 R2241	I65-G68 PolarHBondContact O-N 3.04Å; I65-G68 VanDerWaalsContact O-N 3.09Å; Q66-G68 PolarHBondContact O-N 2.9Å; Q66-G68 VanDerWaalsContact O-N 3.16Å; G68-F2239 CarbonylContact O-C 3.31Å; G68-F2239 VanDerWaalsContact O-C 3.29Å; G68-T2240 CarbonylContact C-O 3.51Å; G68-T2240 CarbonylContact O-C 3.58Å; G68-T2240 WeakPolarHBondContact O-CA 3.48Å; G68-T2240 PolarHBondContact O-N 3.46Å; G68-R2241 PolarHBondContact O-N 3.3Å
69	S	49.4	Very low	55.8	Low	18 Å²	18	71.6 Å²	71.6	13%	0.126	35%	0.345	C	S	.	.			trans	-126.6	151.3	167.9	-70.1	0	0	0	0	110.7	F64 S67 Q2238 F2239	F64-S69 VanDerWaalsContact CE1-CB 3.47Å; F64-S69 PolarHBondContact O-N 2.85Å; S67-S69 PolarHBondContact OG-OG 3.37Å; S69-Q2238 PolarHBondContact OG-O 2.96Å; S69-F2239 PolarHBondContact OG-N 2.8Å
70	L	56.2	Low	55.6	Low	81 Å²	81	72.1 Å²	72.1	42%	0.424	35%	0.345	S	S	.	.			trans	-82.5	137.7	176.9	-64.9	177.6	0	0	0	109.2	F64 I72 E73	F64-L70 WeakPolarHBondContact CE1-O 3.14Å; L70-I72 PolarHBondContact O-N 3.01Å; L70-E73 PolarHBondContact O-N 2.85Å
71	L	51.2	Low	55.4	Low	35 Å²	35	73.8 Å²	73.8	18%	0.183	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-54.5	-28.3	-174	-148.6	77	0	0	0	114.2	E61 I65 E73 F74 F1364	E61-L71 HydrophobicContact CG-CD1 3.59Å; I65-L71 HydrophobicContact CD1-CD1 3.65Å; I65-L71 HydrophobicContact CG1-CD1 3.53Å; L71-E73 PolarHBondContact O-N 3.45Å; L71-E73 VanDerWaalsContact O-N 3.11Å; L71-F74 WeakPolarHBondContact O-CB 3.46Å; L71-F74 PolarHBondContact O-N 2.87Å; L71-F1364 HydrophobicContact CB-CE1 4.01Å; L71-F1364 HydrophobicContact CB-CZ 4.18Å; L71-F1364 HydrophobicContact CD2-CD2 4.4Å; L71-F1364 HydrophobicContact CD2-CE1 3.81Å; L71-F1364 HydrophobicContact CD2-CE2 3.62Å; L71-F1364 HydrophobicContact CD2-CZ 3.29Å; L71-F1364 HydrophobicContact CG-CZ 4.35Å
72	I	51.1	Low	54.9	Low	119 Å²	119	74.2 Å²	74.2	61%	0.61	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-48.4	-36.1	173	-67.7	172.9	0	0	0	112.1	L70 I941	L70-I72 PolarHBondContact O-N 3.01Å; I72-I941 HydrophobicContact CD1-CD1 4.33Å
73	E	59.2	Low	54.6	Low	13 Å²	13	75.3 Å²	75.3	6%	0.061	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-93.2	-0.2	-175.5	-64.6	153.2	142.9	0	0	112.9	F64 L70 L71 Y75 E76 W77 P2237 Q2238 F2239	F64-E73 HydrophobicContact CE1-CB 4.3Å; F64-E73 VanDerWaalsContact CZ-C 3.43Å; F64-E73 HydrophobicContact CZ-CB 3.83Å; L70-E73 PolarHBondContact O-N 2.85Å; L71-E73 PolarHBondContact O-N 3.45Å; L71-E73 VanDerWaalsContact O-N 3.11Å; E73-Y75 PolarHBondContact O-N 3.24Å; E73-E76 CarbonylContact O-C 3.52Å; E73-E76 WeakPolarHBondContact O-CB 3.33Å; E73-E76 PolarHBondContact O-N 2.67Å; E73-W77 VanDerWaalsContact O-CB 3.32Å; E73-W77 WeakPolarHBondContact O-CB 3.44Å; E73-W77 PolarHBondContact O-N 2.88Å; E73-P2237 HydrophobicContact CB-CB 4.25Å; E73-Q2238 HydrophobicContact CG-CB 4.41Å; E73-Q2238 WeakPolarHBondContact OE1-CB 3.49Å; E73-Q2238 PolarHBondContact OE1-NE2 2.69Å; E73-F2239 WeakPolarHBondContact OE1-CD2 3.18Å; E73-F2239 VanDerWaalsContact OE2-CB 3.23Å; E73-F2239 WeakPolarHBondContact OE2-CB 3.46Å
74	F	62.4	Low	54.5	Low	5 Å²	5	75.5 Å²	75.5	2%	0.022	36%	0.355	C	S	.	.	H	α-helix	trans	-60.5	-46.8	179.5	178.6	-118.1	0	0	0	111.4	V60 E61 F64 L71 E76 W77 R78	V60-F74 HydrophobicContact CG1-CE2 3.99Å; V60-F74 HydrophobicContact CG1-CZ 4.37Å; E61-F74 VanDerWaalsContact CA-CE2 3.44Å; E61-F74 HydrophobicContact CB-CE1 4.19Å; E61-F74 HydrophobicContact CB-CE2 3.93Å; E61-F74 HydrophobicContact CB-CZ 3.73Å; E61-F74 HydrophobicContact CG-CD1 4.49Å; E61-F74 HydrophobicContact CG-CE1 4.33Å; E61-F74 HydrophobicContact CG-CE2 4.38Å; E61-F74 HydrophobicContact CG-CZ 4.27Å; F64-F74 HydrophobicContact CB-CD2 3.86Å; F64-F74 HydrophobicContact CB-CE2 4.26Å; F64-F74 HydrophobicContact CD1-CB 3.78Å; F64-F74 AromaticContact CD1-CD2 3.82Å; F64-F74 HydrophobicContact CD1-CD2 3.82Å; F64-F74 HydrophobicContact CD1-CG 4.28Å; F64-F74 HydrophobicContact CE1-CB 3.76Å; F64-F74 HydrophobicContact CE1-CD2 4.49Å; F64-F74 AromaticContact CG-CD2 3.83Å; F64-F74 HydrophobicContact CG-CD2 3.83Å; L71-F74 WeakPolarHBondContact O-CB 3.46Å; L71-F74 PolarHBondContact O-N 2.87Å; F74-E76 VanDerWaalsContact C-N 3.34Å; F74-W77 PolarHBondContact O-N 2.66Å; F74-R78 VanDerWaalsContact O-CB 3.31Å; F74-R78 WeakPolarHBondContact O-CB 3.31Å; F74-R78 PolarHBondContact O-N 2.85Å
75	Y	55.3	Low	53.7	Low	156 Å²	156	77.8 Å²	77.8	61%	0.612	37%	0.368	S	S	*	.	H	α-helix	trans	-67.8	-33.1	176.3	-70.1	-87.3	0	0	0	112.3	E73 R79	E73-Y75 PolarHBondContact O-N 3.24Å; Y75-R79 WeakPolarHBondContact O-CB 3.43Å; Y75-R79 PolarHBondContact O-N 3.45Å
76	E	53.3	Low	53.4	Low	77 Å²	77	80 Å²	80	36%	0.36	38%	0.377	S	S	.	.	H	α-helix	trans	-68.2	-44.2	171.9	-69.3	-151.1	132.3	0	0	112	E73 F74 R79 K80 P2237	E73-E76 CarbonylContact O-C 3.52Å; E73-E76 WeakPolarHBondContact O-CB 3.33Å; E73-E76 PolarHBondContact O-N 2.67Å; F74-E76 VanDerWaalsContact C-N 3.34Å; E76-R79 PolarHBondContact O-N 3.11Å; E76-K80 HydrophobicContact CB-CD 4.25Å; E76-K80 VanDerWaalsContact O-CB 3.26Å; E76-K80 WeakPolarHBondContact O-CB 3.42Å; E76-K80 WeakPolarHBondContact O-CD 3.42Å; E76-K80 WeakPolarHBondContact O-CG 3.39Å; E76-K80 PolarHBondContact O-N 2.88Å; E76-K80 IonicContact OE1-NZ 3.73Å; E76-K80 PolarHBondContact OE1-NZ 3.41Å; E76-K80 IonicContact OE2-NZ 3.53Å; E76-K80 PolarHBondContact OE2-NZ 3.04Å; E76-P2237 HydrophobicContact CB-CG 4.37Å
77	W	65.1	Low	53.3	Low	81 Å²	81	79.4 Å²	79.4	31%	0.307	38%	0.375	S	S	.	.	H	α-helix	trans	-63.6	-45.9	179.9	-179.2	85.3	0	0	0	110.7	V60 F64 E73 F74 R79 K80 K81 P2237	V60-W77 HydrophobicContact CG1-CH2 4.23Å; V60-W77 HydrophobicContact CG1-CZ3 3.68Å; F64-W77 HydrophobicContact CD2-CB 4.25Å; F64-W77 HydrophobicContact CD2-CD2 4.01Å; F64-W77 HydrophobicContact CD2-CE3 4.36Å; F64-W77 AromaticContact CD2-CG 3.96Å; F64-W77 HydrophobicContact CD2-CG 3.96Å; F64-W77 HydrophobicContact CE2-CB 3.55Å; F64-W77 AromaticContact CE2-CD1 3.85Å; F64-W77 HydrophobicContact CE2-CD2 4.12Å; F64-W77 AromaticContact CE2-CG 3.56Å; F64-W77 HydrophobicContact CE2-CG 3.56Å; F64-W77 HydrophobicContact CZ-CB 4.04Å; E73-W77 VanDerWaalsContact O-CB 3.32Å; E73-W77 WeakPolarHBondContact O-CB 3.44Å; E73-W77 PolarHBondContact O-N 2.88Å; F74-W77 PolarHBondContact O-N 2.66Å; W77-R79 PolarHBondContact O-N 2.95Å; W77-K80 PolarHBondContact O-N 3.21Å; W77-K81 HydrophobicContact CH2-CD 4.17Å; W77-K81 HydrophobicContact CZ2-CD 3.99Å; W77-K81 VanDerWaalsContact O-CB 3.26Å; W77-K81 WeakPolarHBondContact O-CB 3.46Å; W77-K81 PolarHBondContact O-N 3.39Å; W77-P2237 HydrophobicContact CB-CG 3.62Å; W77-P2237 HydrophobicContact CG-CG 4.27Å
78	R	54.8	Low	53.2	Low	113 Å²	113	76.9 Å²	76.9	43%	0.426	36%	0.359	S	S	.	.	H	α-helix	trans	-56.3	-50.2	172.7	-172.8	176.4	-178.5	165.4	3.9	111.1	E57 F74 T82	E57-R78 IonicContact OE1-CZ 3.74Å; E57-R78 IonicContact OE1-NH1 2.74Å; E57-R78 PolarHBondContact OE1-NH1 2.94Å; E57-R78 IonicContact OE1-NH2 3.4Å; E57-R78 PolarHBondContact OE1-NH2 3.37Å; F74-R78 VanDerWaalsContact O-CB 3.31Å; F74-R78 WeakPolarHBondContact O-CB 3.31Å; F74-R78 PolarHBondContact O-N 2.85Å; R78-T82 WeakPolarHBondContact O-CG2 3.39Å; R78-T82 PolarHBondContact O-N 3.22Å; R78-T82 PolarHBondContact O-OG1 3.44Å; R78-T82 VanDerWaalsContact O-OG1 3.09Å
79	R	54.1	Low	53.5	Low	162 Å²	162	80.3 Å²	80.3	61%	0.611	38%	0.375	S	S	*	.	H	α-helix	trans	-60.4	-51.8	175.6	-86.5	-176.3	166.3	-177.6	-2.4	112.3	Y75 E76 W77 T82 Q83	Y75-R79 WeakPolarHBondContact O-CB 3.43Å; Y75-R79 PolarHBondContact O-N 3.45Å; E76-R79 PolarHBondContact O-N 3.11Å; W77-R79 PolarHBondContact O-N 2.95Å; R79-T82 PolarHBondContact O-N 3.28Å; R79-T82 PolarHBondContact O-OG1 2.6Å; R79-Q83 WeakPolarHBondContact O-CG 3.35Å; R79-Q83 PolarHBondContact O-N 3.47Å
80	K	54.6	Low	53.3	Low	42 Å²	42	85 Å²	85	18%	0.183	41%	0.407	C	S	.	.	H	α-helix	trans	-65.1	-42.9	-173.9	-70.8	162.7	-175.6	175.2	0	111.1	E76 W77 T82 Q83 E84 P2236 P2237	E76-K80 HydrophobicContact CB-CD 4.25Å; E76-K80 VanDerWaalsContact O-CB 3.26Å; E76-K80 WeakPolarHBondContact O-CB 3.42Å; E76-K80 WeakPolarHBondContact O-CD 3.42Å; E76-K80 WeakPolarHBondContact O-CG 3.39Å; E76-K80 PolarHBondContact O-N 2.88Å; E76-K80 IonicContact OE1-NZ 3.73Å; E76-K80 PolarHBondContact OE1-NZ 3.41Å; E76-K80 IonicContact OE2-NZ 3.53Å; E76-K80 PolarHBondContact OE2-NZ 3.04Å; W77-K80 PolarHBondContact O-N 3.21Å; K80-T82 PolarHBondContact O-N 3.44Å; K80-Q83 CarbonylContact O-C 2.86Å; K80-Q83 WeakPolarHBondContact O-CA 3.43Å; K80-Q83 WeakPolarHBondContact O-CB 3.35Å; K80-Q83 PolarHBondContact O-N 3.41Å; K80-Q83 VanDerWaalsContact O-N 3.08Å; K80-E84 WeakPolarHBondContact O-CG 3.29Å; K80-E84 PolarHBondContact O-N 3.21Å; K80-P2236 HydrophobicContact CD-CB 4.35Å; K80-P2236 HydrophobicContact CD-CG 4.15Å; K80-P2236 WeakPolarHBondContact CD-O 3.45Å; K80-P2237 HydrophobicContact CD-CG 4.2Å
81	K	51.3	Low	52.8	Low	80 Å²	80	84.3 Å²	84.3	35%	0.348	41%	0.408	S	S	.	.	H	α-helix	trans	-64	-36.1	174.1	-167.3	173.1	-178.3	-178.1	0	113.2	W77 L85 F116	W77-K81 HydrophobicContact CH2-CD 4.17Å; W77-K81 HydrophobicContact CZ2-CD 3.99Å; W77-K81 VanDerWaalsContact O-CB 3.26Å; W77-K81 WeakPolarHBondContact O-CB 3.46Å; W77-K81 PolarHBondContact O-N 3.39Å; K81-L85 PolarHBondContact O-N 3.05Å; K81-F116 HydrophobicContact CD-CE1 4.3Å
82	T	49.5	Very low	52.3	Low	68 Å²	68	85.7 Å²	85.7	42%	0.417	43%	0.431	S	S	.	.	H	α-helix	trans	-71.3	-30.7	171.1	54.9	0	0	0	0	113.3	R78 R79 K80 M86	R78-T82 WeakPolarHBondContact O-CG2 3.39Å; R78-T82 PolarHBondContact O-N 3.22Å; R78-T82 PolarHBondContact O-OG1 3.44Å; R78-T82 VanDerWaalsContact O-OG1 3.09Å; R79-T82 PolarHBondContact O-N 3.28Å; R79-T82 PolarHBondContact O-OG1 2.6Å; K80-T82 PolarHBondContact O-N 3.44Å; T82-M86 PolarHBondContact O-N 3Å
83	Q	55.1	Low	52.1	Low	112 Å²	112	88 Å²	88	52%	0.523	44%	0.439	S	S	.	.	H	α-helix	trans	-70.8	-41.3	173.4	-76.4	177.7	-25.1	0	0	111.7	R79 K80 L85 M86 Q87	R79-Q83 WeakPolarHBondContact O-CG 3.35Å; R79-Q83 PolarHBondContact O-N 3.47Å; K80-Q83 CarbonylContact O-C 2.86Å; K80-Q83 WeakPolarHBondContact O-CA 3.43Å; K80-Q83 WeakPolarHBondContact O-CB 3.35Å; K80-Q83 PolarHBondContact O-N 3.41Å; K80-Q83 VanDerWaalsContact O-N 3.08Å; Q83-L85 VanDerWaalsContact C-N 3.33Å; Q83-L85 PolarHBondContact O-N 3.34Å; Q83-M86 CarbonylContact O-C 3.6Å; Q83-M86 PolarHBondContact O-N 3.11Å; Q83-Q87 WeakPolarHBondContact O-CB 3.29Å; Q83-Q87 PolarHBondContact O-N 3.08Å
84	E	51.9	Low	51.6	Low	99 Å²	99	88.8 Å²	88.8	46%	0.463	44%	0.443	S	S	.	.	H	α-helix	trans	-59.2	-43.4	173.5	-72.6	176.7	147.3	0	0	111.3	K80 Q87 A88	K80-E84 WeakPolarHBondContact O-CG 3.29Å; K80-E84 PolarHBondContact O-N 3.21Å; E84-Q87 PolarHBondContact O-N 2.84Å; E84-A88 WeakPolarHBondContact O-CB 3.46Å; E84-A88 PolarHBondContact O-N 2.88Å
85	L	49.4	Very low	50.9	Low	56 Å²	56	94 Å²	94	29%	0.293	47%	0.471	S	S	.	.	H	α-helix	trans	-60.9	-48.9	173.5	-112.3	164.2	0	0	0	112.1	K81 Q83 Q87 A88 L89 I115 F116	K81-L85 PolarHBondContact O-N 3.05Å; Q83-L85 VanDerWaalsContact C-N 3.33Å; Q83-L85 PolarHBondContact O-N 3.34Å; L85-Q87 VanDerWaalsContact C-N 3.28Å; L85-Q87 PolarHBondContact O-N 3.16Å; L85-A88 PolarHBondContact O-N 3.45Å; L85-L89 WeakPolarHBondContact O-CB 3.36Å; L85-L89 WeakPolarHBondContact O-CD1 3.37Å; L85-L89 VanDerWaalsContact O-CG 3.23Å; L85-L89 WeakPolarHBondContact O-CG 3.33Å; L85-L89 PolarHBondContact O-N 3.09Å; L85-I115 HydrophobicContact CD1-CG2 3.88Å; L85-F116 HydrophobicContact CD1-CZ 4.18Å
86	M	50.8	Low	50.4	Low	123 Å²	123	91.4 Å²	91.4	61%	0.606	47%	0.474	S	S	*	.	H	α-helix	trans	-61.6	-34.7	173.6	-76.7	-145	-57.6	0	0	112.9	T82 Q83 L89 C90	T82-M86 PolarHBondContact O-N 3Å; Q83-M86 CarbonylContact O-C 3.6Å; Q83-M86 PolarHBondContact O-N 3.11Å; M86-L89 WeakPolarHBondContact O-CB 3Å; M86-L89 PolarHBondContact O-N 3.28Å; M86-C90 WeakPolarHBondContact O-CB 3.21Å; M86-C90 PolarHBondContact O-N 2.93Å; M86-C90 PolarHBondContact O-SG 3.06Å
87	Q	51.5	Low	50	Low	138 Å²	138	94.7 Å²	94.7	65%	0.645	49%	0.489	S	S	*	.	H	α-helix	trans	-76.5	-32.7	-177.7	-162.1	163.9	31	0	0	111.6	Q83 E84 L85 S91	Q83-Q87 WeakPolarHBondContact O-CB 3.29Å; Q83-Q87 PolarHBondContact O-N 3.08Å; E84-Q87 PolarHBondContact O-N 2.84Å; L85-Q87 VanDerWaalsContact C-N 3.28Å; L85-Q87 PolarHBondContact O-N 3.16Å; Q87-S91 WeakPolarHBondContact O-CB 3.46Å; Q87-S91 PolarHBondContact O-N 3.27Å; Q87-S91 PolarHBondContact O-OG 3.21Å
88	A	52.1	Low	49.3	Very low	29 Å²	29	94.5 Å²	94.5	24%	0.24	49%	0.494	C	S	.	.	H	α-helix	trans	-65.1	-46.2	167.7	0	0	0	0	0	111.5	E84 L85 C90 S91 G92 L94	E84-A88 WeakPolarHBondContact O-CB 3.46Å; E84-A88 PolarHBondContact O-N 2.88Å; L85-A88 PolarHBondContact O-N 3.45Å; A88-C90 VanDerWaalsContact C-N 3.34Å; A88-C90 PolarHBondContact O-N 3.21Å; A88-S91 PolarHBondContact O-N 3.27Å; A88-S91 PolarHBondContact O-OG 3.29Å; A88-G92 PolarHBondContact O-N 2.93Å; A88-L94 HydrophobicContact CB-CD2 4.03Å; A88-L94 HydrophobicContact CB-CG 4.2Å
89	L	45.9	Very low	49.2	Very low	80 Å²	80	93.4 Å²	93.4	42%	0.419	50%	0.496	S	S	.	.	H	α-helix	trans	-56.9	-43.9	173.3	-72.4	164	0	0	0	112.1	L85 M86 L94 V102	L85-L89 WeakPolarHBondContact O-CB 3.36Å; L85-L89 WeakPolarHBondContact O-CD1 3.37Å; L85-L89 VanDerWaalsContact O-CG 3.23Å; L85-L89 WeakPolarHBondContact O-CG 3.33Å; L85-L89 PolarHBondContact O-N 3.09Å; M86-L89 WeakPolarHBondContact O-CB 3Å; M86-L89 PolarHBondContact O-N 3.28Å; L89-L94 HydrophobicContact CD2-CD1 3.78Å; L89-L94 HydrophobicContact CG-CD1 4.22Å; L89-V102 HydrophobicContact CD2-CB 4.33Å; L89-V102 HydrophobicContact CD2-CG1 3.45Å; L89-V102 VanDerWaalsContact CD2-CG1 3.45Å; L89-V102 HydrophobicContact CD2-CG2 3.9Å
90	C	43.8	Very low	49	Very low	117 Å²	117	88.1 Å²	88.1	79%	0.791	48%	0.484	S	S	*	.	H	α-helix	trans	-79.4	-11.4	179.9	-67.8	0	0	0	0	115	M86 A88	M86-C90 WeakPolarHBondContact O-CB 3.21Å; M86-C90 PolarHBondContact O-N 2.93Å; M86-C90 PolarHBondContact O-SG 3.06Å; A88-C90 VanDerWaalsContact C-N 3.34Å; A88-C90 PolarHBondContact O-N 3.21Å
91	S	46.2	Very low	48.9	Very low	65 Å²	65	89.9 Å²	89.9	46%	0.455	50%	0.495	S	S	.	.	H	α-helix	trans	-109.1	-2.8	-177.4	59.2	0	0	0	0	114.6	Q87 A88 H93	Q87-S91 WeakPolarHBondContact O-CB 3.46Å; Q87-S91 PolarHBondContact O-N 3.27Å; Q87-S91 PolarHBondContact O-OG 3.21Å; A88-S91 PolarHBondContact O-N 3.27Å; A88-S91 PolarHBondContact O-OG 3.29Å; S91-H93 PolarHBondContact O-N 3.28Å; S91-H93 PolarHBondContact O-ND1 3.22Å
92	G	39.9	Very low	48.9	Very low	64 Å²	64	87.1 Å²	87.1	66%	0.66	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	27.5	175.4	0	0	0	0	0	114	A88	A88-G92 PolarHBondContact O-N 2.93Å
93	H	48	Very low	48.9	Very low	169 Å²	169	86.8 Å²	86.8	78%	0.782	49%	0.486	S	S	*	.			trans	-106.5	21.1	-178.2	-88.9	58.9	0	0	0	113.1	S91	S91-H93 PolarHBondContact O-N 3.28Å; S91-H93 PolarHBondContact O-ND1 3.22Å
94	L	48.9	Very low	48.5	Very low	28 Å²	28	84.6 Å²	84.6	15%	0.147	48%	0.477	C	S	.	.			trans	-81.1	134.8	171.7	-70.3	158.2	0	0	0	109.4	A88 L89 D98 L99 V102	A88-L94 HydrophobicContact CB-CD2 4.03Å; A88-L94 HydrophobicContact CB-CG 4.2Å; L89-L94 HydrophobicContact CD2-CD1 3.78Å; L89-L94 HydrophobicContact CG-CD1 4.22Å; L94-D98 HydrophobicContact CB-CB 4.21Å; L94-D98 HydrophobicContact CD2-CB 3.83Å; L94-L99 HydrophobicContact CB-CD1 4.39Å; L94-L99 HydrophobicContact CB-CG 3.89Å; L94-V102 HydrophobicContact CD1-CG2 4.3Å
95	D	46.4	Very low	48.2	Very low	114 Å²	114	85.1 Å²	85.1	61%	0.61	48%	0.476	S	S	*	.			trans	-63.2	156.3	171.2	-88.3	-47.8	0	0	0	110.4	E97 D98 L99	D95-E97 PolarHBondContact O-N 2.94Å; D95-E97 VanDerWaalsContact O-N 3.08Å; D95-D98 PolarHBondContact O-N 3.38Å; D95-L99 PolarHBondContact O-N 3.17Å
96	P	46.6	Very low	47.7	Very low	102 Å²	102	89.8 Å²	89.8	66%	0.662	50%	0.498	S	S	*	.	H	α-helix	trans	-60	-23.8	-177.4	22.9	-33.9	0	0	0	113.7	S100	P96-S100 PolarHBondContact O-N 2.87Å; P96-S100 VanDerWaalsContact O-N 3.07Å
97	E	44.4	Very low	47.1	Very low	147 Å²	147	86.9 Å²	86.9	69%	0.687	49%	0.49	S	S	*	.	H	α-helix	trans	-74.7	-45.5	173.7	-64.9	179.5	-168.3	0	0	111.2	D95 L99 S100 L101	D95-E97 PolarHBondContact O-N 2.94Å; D95-E97 VanDerWaalsContact O-N 3.08Å; E97-L99 VanDerWaalsContact C-N 3.33Å; E97-L99 PolarHBondContact O-N 3.2Å; E97-S100 WeakPolarHBondContact O-CB 3.27Å; E97-S100 PolarHBondContact O-N 3.12Å; E97-S100 VanDerWaalsContact O-N 3.09Å; E97-S100 PolarHBondContact O-OG 2.94Å; E97-L101 PolarHBondContact O-N 2.66Å
98	D	49.4	Very low	46.1	Very low	76 Å²	76	83.5 Å²	83.5	41%	0.406	49%	0.492	S	S	.	.	H	α-helix	trans	-65.4	-36.3	173.6	-69.8	-33.1	0	0	0	111.9	L94 D95 S100 L101 V102	L94-D98 HydrophobicContact CB-CB 4.21Å; L94-D98 HydrophobicContact CD2-CB 3.83Å; D95-D98 PolarHBondContact O-N 3.38Å; D98-S100 VanDerWaalsContact C-N 3.3Å; D98-S100 PolarHBondContact O-N 2.85Å; D98-L101 PolarHBondContact O-N 2.8Å; D98-V102 VanDerWaalsContact O-CB 3.32Å; D98-V102 WeakPolarHBondContact O-CB 3.22Å; D98-V102 VanDerWaalsContact O-CG2 3.28Å; D98-V102 WeakPolarHBondContact O-CG2 3.37Å; D98-V102 PolarHBondContact O-N 3.04Å
99	L	53.1	Low	45.6	Very low	90 Å²	90	89.6 Å²	89.6	47%	0.471	52%	0.515	S	S	.	.	H	α-helix	trans	-62.5	-35.9	170.9	-96.1	162.5	0	0	0	112.1	L94 D95 E97 S103	L94-L99 HydrophobicContact CB-CD1 4.39Å; L94-L99 HydrophobicContact CB-CG 3.89Å; D95-L99 PolarHBondContact O-N 3.17Å; E97-L99 VanDerWaalsContact C-N 3.33Å; E97-L99 PolarHBondContact O-N 3.2Å; L99-S103 VanDerWaalsContact O-CB 3.31Å; L99-S103 WeakPolarHBondContact O-CB 3.18Å; L99-S103 PolarHBondContact O-N 2.82Å; L99-S103 PolarHBondContact O-OG 2.96Å
100	S	51.1	Low	45.1	Very low	52 Å²	52	87.5 Å²	87.5	36%	0.364	51%	0.506	S	S	.	.	H	α-helix	trans	-67.2	-48.5	173.9	76	0	0	0	0	111.2	P96 E97 D98 V102 S103 D104	P96-S100 PolarHBondContact O-N 2.87Å; P96-S100 VanDerWaalsContact O-N 3.07Å; E97-S100 WeakPolarHBondContact O-CB 3.27Å; E97-S100 PolarHBondContact O-N 3.12Å; E97-S100 VanDerWaalsContact O-N 3.09Å; E97-S100 PolarHBondContact O-OG 2.94Å; D98-S100 VanDerWaalsContact C-N 3.3Å; D98-S100 PolarHBondContact O-N 2.85Å; S100-V102 VanDerWaalsContact C-N 3.33Å; S100-V102 PolarHBondContact O-N 2.82Å; S100-S103 WeakPolarHBondContact CA-OG 3.49Å; S100-S103 CarbonylContact O-C 3.49Å; S100-S103 WeakPolarHBondContact O-CA 3.48Å; S100-S103 PolarHBondContact O-N 2.78Å; S100-S103 PolarHBondContact O-OG 3.12Å; S100-D104 WeakPolarHBondContact O-CB 3.45Å; S100-D104 VanDerWaalsContact O-CG 3.27Å; S100-D104 PolarHBondContact O-N 3.22Å
101	L	52	Low	44.9	Very low	78 Å²	78	86.8 Å²	86.8	41%	0.408	49%	0.494	S	S	.	.	H	α-helix	trans	-57.6	-41.8	174.8	-90.3	153.6	0	0	0	112.7	E97 D98 Y105	E97-L101 PolarHBondContact O-N 2.66Å; D98-L101 PolarHBondContact O-N 2.8Å; L101-Y105 WeakPolarHBondContact O-CB 3.49Å; L101-Y105 PolarHBondContact O-N 2.89Å
102	V	51.2	Low	44.5	Very low	23 Å²	23	86.8 Å²	86.8	14%	0.139	49%	0.494	C	S	.	.	H	α-helix	trans	-63.5	-44.2	172	161.5	0	0	0	0	111.1	L89 L94 D98 S100 D104 Y105 M106	L89-V102 HydrophobicContact CD2-CB 4.33Å; L89-V102 HydrophobicContact CD2-CG1 3.45Å; L89-V102 VanDerWaalsContact CD2-CG1 3.45Å; L89-V102 HydrophobicContact CD2-CG2 3.9Å; L94-V102 HydrophobicContact CD1-CG2 4.3Å; D98-V102 VanDerWaalsContact O-CB 3.32Å; D98-V102 WeakPolarHBondContact O-CB 3.22Å; D98-V102 VanDerWaalsContact O-CG2 3.28Å; D98-V102 WeakPolarHBondContact O-CG2 3.37Å; D98-V102 PolarHBondContact O-N 3.04Å; S100-V102 VanDerWaalsContact C-N 3.33Å; S100-V102 PolarHBondContact O-N 2.82Å; V102-D104 VanDerWaalsContact C-N 3.34Å; V102-Y105 PolarHBondContact O-N 2.99Å; V102-M106 HydrophobicContact CG1-CG 4.48Å; V102-M106 WeakPolarHBondContact O-CB 3.33Å; V102-M106 WeakPolarHBondContact O-CG 3.33Å; V102-M106 PolarHBondContact O-N 2.8Å
103	S	48.6	Very low	44.4	Very low	61 Å²	61	86.7 Å²	86.7	43%	0.427	48%	0.478	S	S	.	.	H	α-helix	trans	-69.9	-30.5	179.2	75.5	0	0	0	0	113.1	L99 S100 S107	L99-S103 VanDerWaalsContact O-CB 3.31Å; L99-S103 WeakPolarHBondContact O-CB 3.18Å; L99-S103 PolarHBondContact O-N 2.82Å; L99-S103 PolarHBondContact O-OG 2.96Å; S100-S103 WeakPolarHBondContact CA-OG 3.49Å; S100-S103 CarbonylContact O-C 3.49Å; S100-S103 WeakPolarHBondContact O-CA 3.48Å; S100-S103 PolarHBondContact O-N 2.78Å; S100-S103 PolarHBondContact O-OG 3.12Å; S103-S107 WeakPolarHBondContact O-CB 3.37Å; S103-S107 PolarHBondContact O-N 3.37Å; S103-S107 PolarHBondContact O-OG 3.08Å
104	D	46.4	Very low	44.2	Very low	65 Å²	65	80.9 Å²	80.9	35%	0.348	46%	0.46	S	S	.	.	H	α-helix	trans	-75.9	-33.2	176.5	-69.3	-19	0	0	0	111.1	S100 V102 S107 G108 H109 V110	S100-D104 WeakPolarHBondContact O-CB 3.45Å; S100-D104 VanDerWaalsContact O-CG 3.27Å; S100-D104 PolarHBondContact O-N 3.22Å; V102-D104 VanDerWaalsContact C-N 3.34Å; D104-S107 WeakPolarHBondContact CA-OG 3.49Å; D104-S107 PolarHBondContact O-OG 2.96Å; D104-G108 PolarHBondContact O-N 2.77Å; D104-H109 WeakPolarHBondContact O-CA 3.49Å; D104-H109 PolarHBondContact O-N 2.92Å; D104-V110 HydrophobicContact CB-CB 4.33Å; D104-V110 HydrophobicContact CB-CG2 3.66Å; D104-V110 PolarHBondContact O-N 3.01Å
105	Y	46.9	Very low	43.9	Very low	110 Å²	110	81.8 Å²	81.8	43%	0.431	46%	0.464	S	S	.	.	H	α-helix	trans	-68.3	-48	167.6	-179.8	-109	0	0	0	111.7	L101 V102 S107 G108 I115	L101-Y105 WeakPolarHBondContact O-CB 3.49Å; L101-Y105 PolarHBondContact O-N 2.89Å; V102-Y105 PolarHBondContact O-N 2.99Å; Y105-S107 VanDerWaalsContact C-N 3.26Å; Y105-S107 PolarHBondContact O-N 2.81Å; Y105-G108 PolarHBondContact O-N 3.22Å; Y105-I115 HydrophobicContact CD1-CD1 3.67Å; Y105-I115 HydrophobicContact CD2-CD1 3.55Å; Y105-I115 HydrophobicContact CD2-CG1 4.33Å; Y105-I115 HydrophobicContact CE1-CD1 3.92Å; Y105-I115 HydrophobicContact CE2-CD1 3.81Å; Y105-I115 HydrophobicContact CG-CD1 3.46Å; Y105-I115 VanDerWaalsContact CG-CD1 3.46Å
106	M	38.6	Very low	43.6	Very low	154 Å²	154	79.8 Å²	79.8	76%	0.759	45%	0.45	S	S	*	.	H	α-helix	trans	-70	-18.8	179.1	-70.1	-153	76.4	0	0	114.1	V102	V102-M106 HydrophobicContact CG1-CG 4.48Å; V102-M106 WeakPolarHBondContact O-CB 3.33Å; V102-M106 WeakPolarHBondContact O-CG 3.33Å; V102-M106 PolarHBondContact O-N 2.8Å
107	S	38.8	Very low	43	Very low	63 Å²	63	79 Å²	79	44%	0.441	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	7.3	170.3	62.9	0	0	0	0	113.5	S103 D104 Y105 H109	S103-S107 WeakPolarHBondContact O-CB 3.37Å; S103-S107 PolarHBondContact O-N 3.37Å; S103-S107 PolarHBondContact O-OG 3.08Å; D104-S107 WeakPolarHBondContact CA-OG 3.49Å; D104-S107 PolarHBondContact O-OG 2.96Å; Y105-S107 VanDerWaalsContact C-N 3.26Å; Y105-S107 PolarHBondContact O-N 2.81Å; S107-H109 PolarHBondContact O-N 2.97Å; S107-H109 PolarHBondContact O-ND1 3.18Å
108	G	30.5	Very low	42.2	Very low	67 Å²	67	75.5 Å²	75.5	69%	0.691	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.8	16.7	177.8	0	0	0	0	0	114.6	D104 Y105 V110	D104-G108 PolarHBondContact O-N 2.77Å; Y105-G108 PolarHBondContact O-N 3.22Å; G108-V110 VanDerWaalsContact C-N 3.32Å
109	H	41	Very low	41.2	Very low	157 Å²	157	78.7 Å²	78.7	73%	0.727	45%	0.452	S	S	*	.	S	Bend	trans	-83.5	-11.7	177	-75.9	48	0	0	0	112.4	D104 S107	D104-H109 WeakPolarHBondContact O-CA 3.49Å; D104-H109 PolarHBondContact O-N 2.92Å; S107-H109 PolarHBondContact O-N 2.97Å; S107-H109 PolarHBondContact O-ND1 3.18Å
110	V	34.4	Very low	39.9	Very low	36 Å²	36	78.9 Å²	78.9	22%	0.218	48%	0.476	C	S	.	.	S	Bend	trans	-134.9	126.9	-173.5	168.1	0	0	0	0	111.4	D104 G108 A114	D104-V110 HydrophobicContact CB-CB 4.33Å; D104-V110 HydrophobicContact CB-CG2 3.66Å; D104-V110 PolarHBondContact O-N 3.01Å; G108-V110 VanDerWaalsContact C-N 3.32Å; V110-A114 HydrophobicContact CG1-CB 3.4Å
111	N	39.9	Very low	38.7	Very low	101 Å²	101	80.6 Å²	80.6	54%	0.54	49%	0.493	S	S	.	.			trans	-68.8	160.1	173.5	-80.9	8.1	0	0	0	112.6	D113 A114	N111-D113 HydrophobicContact CB-CB 4.23Å; N111-D113 WeakPolarHBondContact CB-OD2 3.32Å; N111-D113 PolarHBondContact ND2-OD2 2.85Å; N111-D113 PolarHBondContact O-N 3.32Å; N111-A114 PolarHBondContact O-N 2.91Å; N111-A114 VanDerWaalsContact O-N 3.11Å
112	S	39.1	Very low	37.4	Very low	65 Å²	65	86 Å²	86	46%	0.455	51%	0.514	S	S	.	.	G	3₁₀ helix	trans	-50.2	-32.2	170.8	-162.8	0	0	0	0	113.4	A114 I115 F116	S112-A114 PolarHBondContact O-N 3.14Å; S112-I115 PolarHBondContact O-N 3.41Å; S112-I115 VanDerWaalsContact O-N 3.11Å; S112-F116 PolarHBondContact O-N 3.47Å
113	D	37.3	Very low	36.2	Very low	62 Å²	62	90 Å²	90	33%	0.332	54%	0.54	S	S	.	.	G	3₁₀ helix	trans	-52.2	-23.4	177.8	-45	-34.6	0	0	0	114.3	N111	N111-D113 HydrophobicContact CB-CB 4.23Å; N111-D113 WeakPolarHBondContact CB-OD2 3.32Å; N111-D113 PolarHBondContact ND2-OD2 2.85Å; N111-D113 PolarHBondContact O-N 3.32Å
114	A	44.3	Very low	35	Very low	47 Å²	47	95.5 Å²	95.5	39%	0.388	56%	0.564	S	S	.	*	G	3₁₀ helix	trans	-93.3	-24.6	-179.1	0	0	0	0	0	114.5	V110 N111 S112	V110-A114 HydrophobicContact CG1-CB 3.4Å; N111-A114 PolarHBondContact O-N 2.91Å; N111-A114 VanDerWaalsContact O-N 3.11Å; S112-A114 PolarHBondContact O-N 3.14Å
115	I	42	Very low	33.8	Very low	47 Å²	47	96.1 Å²	96.1	24%	0.241	57%	0.573	C	S	.	*	T	Hydrogen-bonded Turn	trans	-77.5	-29.8	173.1	-64.3	-175.8	0	0	0	110.3	L85 Y105 S112 P117	L85-I115 HydrophobicContact CD1-CG2 3.88Å; Y105-I115 HydrophobicContact CD1-CD1 3.67Å; Y105-I115 HydrophobicContact CD2-CD1 3.55Å; Y105-I115 HydrophobicContact CD2-CG1 4.33Å; Y105-I115 HydrophobicContact CE1-CD1 3.92Å; Y105-I115 HydrophobicContact CE2-CD1 3.81Å; Y105-I115 HydrophobicContact CG-CD1 3.46Å; Y105-I115 VanDerWaalsContact CG-CD1 3.46Å; S112-I115 PolarHBondContact O-N 3.41Å; S112-I115 VanDerWaalsContact O-N 3.11Å; I115-P117 WeakPolarHBondContact O-CD 3.29Å
116	F	40	Very low	32.6	Very low	73 Å²	73	96.3 Å²	96.3	32%	0.32	59%	0.59	S	S	.	*	S	Bend	trans	-121.2	65	178.7	-59.7	-76.8	0	0	0	111.2	K81 L85 S112	K81-F116 HydrophobicContact CD-CE1 4.3Å; L85-F116 HydrophobicContact CD1-CZ 4.18Å; S112-F116 PolarHBondContact O-N 3.47Å
117	P	33.9	Very low	31.9	Very low	86 Å²	86	92.8 Å²	92.8	56%	0.558	59%	0.593	S	S	*	*			trans	-61.7	127.2	-172.8	25	-34.6	0	0	0	111.5	I115 N119	I115-P117 WeakPolarHBondContact O-CD 3.29Å; P117-N119 PolarHBondContact O-N 3.14Å
118	P	28	Very low	31.2	Very low	72 Å²	72	94.8 Å²	94.8	47%	0.468	61%	0.607	S	S	.	*	S	Bend	trans	-68.7	127.4	170.7	27.4	-32.1	0	0	0	109.7
119	N	28.5	Very low	30.8	Very low	143 Å²	143	100.5 Å²	100.5	77%	0.765	62%	0.616	S	S	*	*	S	Bend	trans	76.3	132.7	-172.1	-44.7	-82.4	0	0	0	115.4	P117 A121	P117-N119 PolarHBondContact O-N 3.14Å; N119-A121 PolarHBondContact O-N 3.26Å
120	G	26.4	Very low	29.9	Very low	95 Å²	95	97.6 Å²	97.6	98%	0.979	61%	0.613	S	S	*	*	S	Bend	trans	-77.6	83.6	171.5	0	0	0	0	0	112.9
121	A	25.8	Very low	29.5	Very low	88 Å²	88	101.9 Å²	101.9	73%	0.727	64%	0.639	S	S	*	*			trans	-150.4	111	166.8	0	0	0	0	0	112.4	N119	N119-A121 PolarHBondContact O-N 3.26Å
122	F	24.7	Very low	28.8	Very low	190 Å²	190	101.2 Å²	101.2	83%	0.833	64%	0.642	S	S	*	*			trans	-65.5	162.3	164.4	-89.9	-91.5	0	0	0	111.1
123	P	24.9	Very low	28.3	Very low	108 Å²	108	104.4 Å²	104.4	70%	0.701	65%	0.654	S	S	*	*			trans	-72.4	150.5	-147.2	25.9	-35.5	0	0	0	116.1
124	L	23.2	Very low	27.9	Very low	176 Å²	176	107.2 Å²	107.2	92%	0.921	67%	0.669	S	S	*	*			trans	-92.6	103.9	177.8	-166.4	88.9	0	0	0	111.2
125	C	22.1	Very low	27.2	Very low	78 Å²	78	109.5 Å²	109.5	53%	0.527	68%	0.675	S	S	.	*			trans	-93.3	132.5	169.1	-133.5	0	0	0	0	111.6	F223	C125-F223 HydrophobicContact CB-CZ 3.92Å
126	S	21.7	Very low	26.7	Very low	114 Å²	114	113.4 Å²	113.4	80%	0.797	70%	0.696	S	S	*	*			trans	-37.4	144	-175.2	50.8	0	0	0	0	119
127	G	23.6	Very low	26.7	Very low	80 Å²	80	114.1 Å²	114.1	83%	0.825	71%	0.71	S	S	*	*			trans	179.5	62.3	172.4	0	0	0	0	0	116.9
128	S	23.8	Very low	26.5	Very low	106 Å²	106	116 Å²	116	74%	0.741	71%	0.711	S	S	*	*			trans	-26.6	152.5	176.6	-51	0	0	0	0	121.7
129	Q	22.9	Very low	26.5	Very low	187 Å²	187	117.5 Å²	117.5	87%	0.874	72%	0.715	S	S	*	*			trans	70.3	147.2	154.8	-69.9	165.5	9.5	0	0	117.3
130	S	22.4	Very low	26.5	Very low	96 Å²	96	111.8 Å²	111.8	67%	0.671	69%	0.685	S	S	*	*			cis	-171.5	154.5	-11	48.9	0	0	0	0	109.9
131	V	23.9	Very low	26.4	Very low	126 Å²	126	112 Å²	112	76%	0.764	66%	0.66	S	S	*	*			trans	61	132.4	148.9	166.8	0	0	0	0	117
132	S	25.7	Very low	26.4	Very low	86 Å²	86	109.9 Å²	109.9	60%	0.601	64%	0.637	S	S	*	*			cis	-157	170	-4.5	53.2	0	0	0	0	108.8
133	L	28.6	Very low	26.6	Very low	133 Å²	133	106.3 Å²	106.3	70%	0.696	62%	0.622	S	S	*	*				33.9	130.6	101.3	-41.7	168.7	0	0	0	113.9
134	D	28.7	Very low	26.8	Very low	121 Å²	121	108 Å²	108	65%	0.647	62%	0.615	S	S	*	*			cis	-133.7	143.6	26.2	-79.8	-73	0	0	0	110.9
135	N	30.2	Very low	26.9	Very low	95 Å²	95	107.4 Å²	107.4	51%	0.508	60%	0.6	S	S	.	*				68.2	169.7	80.7	-58.3	-48.4	0	0	0	113.5
136	D	31.8	Very low	27.3	Very low	128 Å²	128	108.9 Å²	108.9	68%	0.684	60%	0.603	S	S	*	*			trans	72.7	83.7	-158.1	-46.4	-14.5	0	0	0	111.6
137	S	38.7	Very low	27.5	Very low	88 Å²	88	105 Å²	105	62%	0.615	57%	0.573	S	S	*	*			cis	59.9	61.3	-0.8	88.2	0	0	0	0	117.9
138	E	31.2	Very low	28.5	Very low	125 Å²	125	109.2 Å²	109.2	58%	0.584	57%	0.571	S	S	*	*			trans	-137.2	117.4	146.8	-117.1	169.1	-160.5	0	0	111	K153 I2338	E138-K153 WeakPolarHBondContact O-CE 3.13Å; E138-K153 PolarHBondContact O-NZ 2.89Å; E138-I2338 HydrophobicContact CB-CD1 3.99Å; E138-I2338 WeakPolarHBondContact O-CD1 3.36Å; E138-I2338 VanDerWaalsContact O-CG1 3.28Å; E138-I2338 WeakPolarHBondContact O-CG1 3.48Å
139	D	28.4	Very low	29.2	Very low	105 Å²	105	108.4 Å²	108.4	56%	0.561	56%	0.559	S	S	*	*			trans	61.6	-170.7	163.3	-40.5	-40.6	0	0	0	114.2	K153	D139-K153 VanDerWaalsContact C-CE 3.42Å; D139-K153 WeakPolarHBondContact O-CE 3.48Å; D139-K153 PolarHBondContact O-NZ 2.94Å; D139-K153 VanDerWaalsContact O-NZ 3.11Å
140	D	27.1	Very low	30	Very low	22 Å²	22	100.1 Å²	100.1	12%	0.118	52%	0.521	C	S	.	.			cis	-138.5	163.7	0.5	-93.4	-52.5	0	0	0	107.1	D142 K153 P2339 V2340	D140-D142 VanDerWaalsContact O-CA 3.28Å; D140-D142 WeakPolarHBondContact O-CA 3.38Å; D140-D142 WeakPolarHBondContact O-CB 3.18Å; D140-D142 PolarHBondContact O-N 2.91Å; D140-K153 HydrophobicContact CB-CD 3.72Å; D140-K153 VanDerWaalsContact CB-NZ 3.26Å; D140-K153 IonicContact OD2-NZ 3.97Å; D140-K153 PolarHBondContact OD2-NZ 3.41Å; D140-P2339 WeakPolarHBondContact OD2-CA 3.4Å; D140-P2339 WeakPolarHBondContact OD2-CB 3.32Å; D140-V2340 WeakPolarHBondContact OD1-CG2 3.41Å
141	E	25.8	Very low	31.2	Very low	101 Å²	101	100.8 Å²	100.8	47%	0.472	52%	0.516	S	S	.	.			trans	10.2	100.8	134.2	8.7	-137.5	85.3	0	0	113.8	S150 E2019	E141-S150 PolarHBondContact O-OG 3.43Å; E141-E2019 WeakPolarHBondContact O-CB 3.2Å; E141-E2019 VanDerWaalsContact O-CG 3.26Å; E141-E2019 WeakPolarHBondContact O-CG 3.33Å
142	D	24.2	Very low	32.4	Very low	43 Å²	43	98.4 Å²	98.4	23%	0.23	50%	0.499	C	S	.	.			trans	-122.2	-59.6	-131.2	-16.9	-148.3	0	0	0	119.9	D140 S150 I2021 R2022	D140-D142 VanDerWaalsContact O-CA 3.28Å; D140-D142 WeakPolarHBondContact O-CA 3.38Å; D140-D142 WeakPolarHBondContact O-CB 3.18Å; D140-D142 PolarHBondContact O-N 2.91Å; D142-S150 WeakPolarHBondContact O-CB 3.49Å; D142-I2021 HydrophobicContact CB-CB 4.02Å; D142-I2021 HydrophobicContact CB-CD1 4.25Å; D142-I2021 HydrophobicContact CB-CG2 3.71Å; D142-I2021 WeakPolarHBondContact OD1-CG2 3.18Å; D142-I2021 WeakPolarHBondContact OD2-CG2 3.18Å; D142-R2022 IonicContact OD1-CZ 3.6Å; D142-R2022 IonicContact OD1-NH2 2.68Å; D142-R2022 PolarHBondContact OD1-NH2 3.05Å; D142-R2022 IonicContact OD2-CZ 2.74Å; D142-R2022 IonicContact OD2-NH1 3.87Å; D142-R2022 IonicContact OD2-NH2 2.72Å; D142-R2022 PolarHBondContact OD2-NH2 3.41Å
143	E	29.6	Very low	33.9	Very low	114 Å²	114	94.6 Å²	94.6	53%	0.533	47%	0.472	S	S	.	.			trans	-112	-44.6	-158.3	173.4	-175.8	58.2	0	0	118.6	R145 L146 E2020 I2021	E143-R145 CarbonylContact C-O 3.52Å; E143-R145 CarbonylContact O-C 3.36Å; E143-L146 PolarHBondContact O-N 2.72Å; E143-E2020 VanDerWaalsContact N-N 3.1Å; E143-I2021 HydrophobicContact CB-CB 3.51Å; E143-I2021 HydrophobicContact CB-CD1 3.91Å; E143-I2021 HydrophobicContact CB-CG1 3.55Å; E143-I2021 HydrophobicContact CG-CG1 4.23Å; E143-I2021 WeakPolarHBondContact OE1-CG1 3.37Å
144	R	29.9	Very low	34.8	Very low	143 Å²	143	96.8 Å²	96.8	54%	0.54	47%	0.472	S	S	.	.	S	Bend	trans	-27.6	-92	-155.4	-142.2	166.7	-103	154.1	-1.6	115.3	L2018 E2019 E2020	R144-L2018 VanDerWaalsContact CB-O 3.27Å; R144-L2018 WeakPolarHBondContact CB-O 2.98Å; R144-L2018 WeakPolarHBondContact CD-O 3.25Å; R144-E2019 WeakPolarHBondContact CD-O 2.99Å; R144-E2019 PolarHBondContact NE-O 3.3Å; R144-E2019 PolarHBondContact NH1-O 3.05Å; R144-E2020 WeakPolarHBondContact CB-O 3.33Å; R144-E2020 VanDerWaalsContact CD-O 3.3Å; R144-E2020 WeakPolarHBondContact CD-O 3.13Å; R144-E2020 WeakPolarHBondContact CG-O 3.23Å; R144-E2020 VanDerWaalsContact CZ-O 3.22Å; R144-E2020 IonicContact CZ-OE2 2.72Å; R144-E2020 PolarHBondContact NE-O 3.19Å; R144-E2020 IonicContact NH1-OE2 3.14Å; R144-E2020 PolarHBondContact NH2-O 2.96Å; R144-E2020 IonicContact NH2-OE2 3.66Å; R144-E2020 PolarHBondContact NH2-OE2 2.86Å
145	R	24.9	Very low	35.9	Very low	164 Å²	164	93 Å²	93	62%	0.619	46%	0.458	S	S	*	.	S	Bend	trans	-63.4	151.7	134.6	-73.9	172.4	155.6	77.3	-0.4	106.7	E143 D147	E143-R145 CarbonylContact C-O 3.52Å; E143-R145 CarbonylContact O-C 3.36Å; R145-D147 WeakPolarHBondContact CB-OD1 3.42Å; R145-D147 WeakPolarHBondContact CD-OD1 3.27Å; R145-D147 PolarHBondContact O-N 3.48Å
146	L	31.2	Very low	37.2	Very low	110 Å²	110	88.6 Å²	88.6	58%	0.576	43%	0.434	S	S	*	.			trans	-63.1	81.3	139.7	-68.2	178.7	0	0	0	106.5	E143 L151	E143-L146 PolarHBondContact O-N 2.72Å; L146-L151 HydrophobicContact CD1-CD1 4.17Å; L146-L151 HydrophobicContact CD1-CD2 4.39Å; L146-L151 HydrophobicContact CD2-CB 4.45Å; L146-L151 HydrophobicContact CD2-CD1 4.11Å
147	D	24.4	Very low	38.1	Very low	33 Å²	33	83.5 Å²	83.5	18%	0.176	41%	0.407	C	S	.	.			trans	-56.4	142.7	155.8	-100.1	47.2	0	0	0	104.8	R145 N149 L2018 E2019	R145-D147 WeakPolarHBondContact CB-OD1 3.42Å; R145-D147 WeakPolarHBondContact CD-OD1 3.27Å; R145-D147 PolarHBondContact O-N 3.48Å; D147-N149 PolarHBondContact O-N 3.29Å; D147-L2018 PolarHBondContact OD1-N 3.28Å; D147-L2018 WeakPolarHBondContact OD2-CA 3.43Å; D147-L2018 PolarHBondContact OD2-N 2.96Å; D147-L2018 VanDerWaalsContact OD2-N 3.13Å; D147-E2019 HydrophobicContact CB-CB 4.24Å; D147-E2019 HydrophobicContact CB-CG 3.63Å; D147-E2019 WeakPolarHBondContact CB-OE1 3.21Å; D147-E2019 VanDerWaalsContact O-OE1 3.06Å
148	E	44.3	Very low	38.9	Very low	168 Å²	168	85.7 Å²	85.7	79%	0.785	41%	0.407	S	S	*	.	H	α-helix	trans	-74.1	0.7	-159.5	-58.5	-175.6	126.4	0	0	111.9	L152	E148-L152 WeakPolarHBondContact O-CB 3.47Å; E148-L152 WeakPolarHBondContact O-CD1 3.19Å
149	N	38.6	Very low	40.2	Very low	89 Å²	89	80.9 Å²	80.9	48%	0.476	39%	0.386	S	S	.	.	H	α-helix	trans	-87.2	-43.5	-176.3	-35.3	-64.8	0	0	0	112.9	D147 L152 K153 E2019	D147-N149 PolarHBondContact O-N 3.29Å; N149-L152 CarbonylContact O-C 3.56Å; N149-L152 VanDerWaalsContact O-C 3.24Å; N149-L152 VanDerWaalsContact O-CA 3.26Å; N149-L152 WeakPolarHBondContact O-CA 3.37Å; N149-L152 WeakPolarHBondContact O-CB 3.3Å; N149-L152 PolarHBondContact O-N 3.21Å; N149-L152 VanDerWaalsContact O-N 3.13Å; N149-K153 PolarHBondContact O-N 3.06Å; N149-E2019 WeakPolarHBondContact CA-OE1 3.44Å; N149-E2019 VanDerWaalsContact CB-OE1 3.27Å; N149-E2019 WeakPolarHBondContact CB-OE1 3.41Å; N149-E2019 PolarHBondContact N-OE1 3.42Å; N149-E2019 PolarHBondContact ND2-OE1 2.69Å; N149-E2019 PolarHBondContact ND2-OE2 3.29Å
150	S	41	Very low	41.7	Very low	12 Å²	12	79.6 Å²	79.6	8%	0.084	38%	0.379	C	S	.	.	H	α-helix	trans	-84.3	-16.9	-176.5	-84.9	0	0	0	0	114.5	E141 D142 K153 E2019	E141-S150 PolarHBondContact O-OG 3.43Å; D142-S150 WeakPolarHBondContact O-CB 3.49Å; S150-K153 WeakPolarHBondContact O-CB 3.43Å; S150-K153 PolarHBondContact O-N 2.99Å; S150-E2019 WeakPolarHBondContact CB-OE1 3.21Å; S150-E2019 PolarHBondContact N-OE1 2.87Å
151	L	46.7	Very low	42.9	Very low	110 Å²	110	82.4 Å²	82.4	58%	0.576	39%	0.394	S	S	*	.	H	α-helix	trans	-76.9	-32.2	157.4	-155.3	79.4	0	0	0	111.8	L146 K153 A155	L146-L151 HydrophobicContact CD1-CD1 4.17Å; L146-L151 HydrophobicContact CD1-CD2 4.39Å; L146-L151 HydrophobicContact CD2-CB 4.45Å; L146-L151 HydrophobicContact CD2-CD1 4.11Å; L151-K153 PolarHBondContact O-N 2.89Å; L151-A155 VanDerWaalsContact O-CB 3.29Å; L151-A155 WeakPolarHBondContact O-CB 3.13Å; L151-A155 PolarHBondContact O-N 3.35Å
152	L	50.6	Low	44.6	Very low	76 Å²	76	81.9 Å²	81.9	40%	0.398	39%	0.394	S	S	.	.	H	α-helix	trans	-64.2	-19.9	165	-102.1	164.6	0	0	0	112.1	E148 N149 A2335 T2336 S2337	E148-L152 WeakPolarHBondContact O-CB 3.47Å; E148-L152 WeakPolarHBondContact O-CD1 3.19Å; N149-L152 CarbonylContact O-C 3.56Å; N149-L152 VanDerWaalsContact O-C 3.24Å; N149-L152 VanDerWaalsContact O-CA 3.26Å; N149-L152 WeakPolarHBondContact O-CA 3.37Å; N149-L152 WeakPolarHBondContact O-CB 3.3Å; N149-L152 PolarHBondContact O-N 3.21Å; N149-L152 VanDerWaalsContact O-N 3.13Å; L152-A2335 HydrophobicContact CD2-CB 3.93Å; L152-T2336 CarbonylContact O-C 3.16Å; L152-T2336 VanDerWaalsContact O-C 3.29Å; L152-S2337 PolarHBondContact O-N 3.03Å
153	K	56.1	Low	46.4	Very low	6 Å²	6	83 Å²	83	3%	0.026	40%	0.396	C	S	.	.	H	α-helix	trans	-62.8	-72.2	178.9	-77.1	-160.2	73.2	147.3	0	112.1	E138 D139 D140 N149 S150 L151 A155 V156 D157 S2337	E138-K153 WeakPolarHBondContact O-CE 3.13Å; E138-K153 PolarHBondContact O-NZ 2.89Å; D139-K153 VanDerWaalsContact C-CE 3.42Å; D139-K153 WeakPolarHBondContact O-CE 3.48Å; D139-K153 PolarHBondContact O-NZ 2.94Å; D139-K153 VanDerWaalsContact O-NZ 3.11Å; D140-K153 HydrophobicContact CB-CD 3.72Å; D140-K153 VanDerWaalsContact CB-NZ 3.26Å; D140-K153 IonicContact OD2-NZ 3.97Å; D140-K153 PolarHBondContact OD2-NZ 3.41Å; N149-K153 PolarHBondContact O-N 3.06Å; S150-K153 WeakPolarHBondContact O-CB 3.43Å; S150-K153 PolarHBondContact O-N 2.99Å; L151-K153 PolarHBondContact O-N 2.89Å; K153-A155 PolarHBondContact O-N 3.06Å; K153-V156 PolarHBondContact O-N 2.79Å; K153-V156 VanDerWaalsContact O-N 3.14Å; K153-D157 PolarHBondContact O-N 3.15Å; K153-S2337 VanDerWaalsContact O-CB 3.29Å; K153-S2337 WeakPolarHBondContact O-CB 3.42Å
154	Y	47.2	Very low	47.5	Very low	180 Å²	180	85.1 Å²	85.1	71%	0.706	40%	0.399	S	S	*	.	H	α-helix	trans	-56.7	-23.1	177.9	-69	-80	0	0	0	113.4	V156 D157 E158	Y154-V156 PolarHBondContact O-N 2.8Å; Y154-D157 PolarHBondContact O-N 3.22Å; Y154-E158 WeakPolarHBondContact O-CB 3.37Å; Y154-E158 PolarHBondContact O-N 3.43Å
155	A	51.5	Low	48.7	Very low	42 Å²	42	81.1 Å²	81.1	35%	0.347	39%	0.391	S	S	.	.	H	α-helix	trans	-71.9	-16.3	179.7	0	0	0	0	0	116	L151 K153 V159 A2335	L151-A155 VanDerWaalsContact O-CB 3.29Å; L151-A155 WeakPolarHBondContact O-CB 3.13Å; L151-A155 PolarHBondContact O-N 3.35Å; K153-A155 PolarHBondContact O-N 3.06Å; A155-V159 VanDerWaalsContact O-CG2 3.32Å; A155-V159 WeakPolarHBondContact O-CG2 3.38Å; A155-A2335 CarbonylContact C-O 3.42Å
156	V	58.4	Low	50.1	Low	1 Å²	1	78.6 Å²	78.6	1%	0.006	39%	0.389	C	S	.	.	H	α-helix	trans	-106.9	-22.9	154.9	139.7	0	0	0	0	114.5	K153 Y154 E158 V159 N160 C2334 A2335 T2336	K153-V156 PolarHBondContact O-N 2.79Å; K153-V156 VanDerWaalsContact O-N 3.14Å; Y154-V156 PolarHBondContact O-N 2.8Å; V156-E158 CarbonylContact O-C 3.54Å; V156-E158 PolarHBondContact O-N 3.32Å; V156-E158 VanDerWaalsContact O-N 3.16Å; V156-V159 HydrophobicContact CG2-CB 4Å; V156-V159 HydrophobicContact CG2-CG1 4.49Å; V156-V159 CarbonylContact O-C 3.4Å; V156-V159 WeakPolarHBondContact O-CA 3.49Å; V156-V159 PolarHBondContact O-N 3.36Å; V156-N160 HydrophobicContact CG1-CB 3.89Å; V156-N160 VanDerWaalsContact CG1-ND2 3.34Å; V156-N160 WeakPolarHBondContact CG1-ND2 3.07Å; V156-N160 WeakPolarHBondContact O-CB 3.44Å; V156-N160 PolarHBondContact O-N 2.93Å; V156-C2334 HydrophobicContact CG2-CB 4.42Å; V156-C2334 WeakPolarHBondContact CG2-O 3.31Å; V156-A2335 VanDerWaalsContact CB-O 3.28Å; V156-A2335 WeakPolarHBondContact CB-O 3.49Å; V156-A2335 VanDerWaalsContact CG2-CA 3.42Å; V156-A2335 VanDerWaalsContact CG2-O 3.31Å; V156-A2335 WeakPolarHBondContact CG2-O 3.23Å; V156-A2335 PolarHBondContact N-O 3.1Å; V156-A2335 VanDerWaalsContact N-O 3.14Å; V156-T2336 HydrophobicContact CB-CG2 3.86Å; V156-T2336 HydrophobicContact CG1-CG2 3.25Å
157	D	50.8	Low	51.4	Low	22 Å²	22	77.2 Å²	77.2	12%	0.118	38%	0.38	C	S	.	.	H	α-helix	trans	-64.3	-32.8	-179.8	-54.8	-35.5	0	0	0	109.7	K153 Y154 V159 I161 S2337	K153-D157 PolarHBondContact O-N 3.15Å; Y154-D157 PolarHBondContact O-N 3.22Å; D157-V159 PolarHBondContact O-N 3.27Å; D157-I161 VanDerWaalsContact O-CB 3.26Å; D157-I161 WeakPolarHBondContact O-CB 3.42Å; D157-I161 VanDerWaalsContact O-CD1 3.3Å; D157-I161 WeakPolarHBondContact O-CD1 2.94Å; D157-I161 WeakPolarHBondContact O-CG1 3.46Å; D157-I161 PolarHBondContact O-N 3.1Å; D157-S2337 PolarHBondContact OD1-OG 3.45Å; D157-S2337 VanDerWaalsContact OD1-OG 3.09Å; D157-S2337 PolarHBondContact OD2-OG 2.82Å
158	E	56.2	Low	52.7	Low	134 Å²	134	78.2 Å²	78.2	63%	0.626	39%	0.385	S	S	*	.	H	α-helix	trans	-63.2	-36.9	163	-168.6	-179.6	-137.9	0	0	114.4	Y154 V156 L162	Y154-E158 WeakPolarHBondContact O-CB 3.37Å; Y154-E158 PolarHBondContact O-N 3.43Å; V156-E158 CarbonylContact O-C 3.54Å; V156-E158 PolarHBondContact O-N 3.32Å; V156-E158 VanDerWaalsContact O-N 3.16Å; E158-L162 HydrophobicContact CG-CD1 4.29Å; E158-L162 WeakPolarHBondContact O-CB 3.43Å; E158-L162 VanDerWaalsContact O-CG 3.23Å; E158-L162 WeakPolarHBondContact O-CG 3.47Å; E158-L162 PolarHBondContact O-N 3.02Å
159	V	58.5	Low	52.8	Low	23 Å²	23	76.7 Å²	76.7	14%	0.139	38%	0.376	C	S	.	.	H	α-helix	trans	-90.9	-21.6	-174.7	-178.1	0	0	0	0	114.7	A155 V156 D157 K163 C2334	A155-V159 VanDerWaalsContact O-CG2 3.32Å; A155-V159 WeakPolarHBondContact O-CG2 3.38Å; V156-V159 HydrophobicContact CG2-CB 4Å; V156-V159 HydrophobicContact CG2-CG1 4.49Å; V156-V159 CarbonylContact O-C 3.4Å; V156-V159 WeakPolarHBondContact O-CA 3.49Å; V156-V159 PolarHBondContact O-N 3.36Å; D157-V159 PolarHBondContact O-N 3.27Å; V159-K163 WeakPolarHBondContact O-CB 3.33Å; V159-K163 VanDerWaalsContact O-CG 3.25Å; V159-K163 WeakPolarHBondContact O-CG 3.5Å; V159-K163 PolarHBondContact O-N 3.14Å; V159-C2334 HydrophobicContact CB-CB 4.09Å; V159-C2334 HydrophobicContact CG1-CB 3.75Å; V159-C2334 HydrophobicContact CG2-CB 3.98Å
160	N	58.3	Low	53.5	Low	78 Å²	78	83 Å²	83	42%	0.417	39%	0.393	S	S	.	.	H	α-helix	trans	-74.2	-41.3	163.2	-91.6	-2.4	0	0	0	108.4	V156 L162 K163 R164	V156-N160 HydrophobicContact CG1-CB 3.89Å; V156-N160 VanDerWaalsContact CG1-ND2 3.34Å; V156-N160 WeakPolarHBondContact CG1-ND2 3.07Å; V156-N160 WeakPolarHBondContact O-CB 3.44Å; V156-N160 PolarHBondContact O-N 2.93Å; N160-L162 PolarHBondContact O-N 2.91Å; N160-K163 CarbonylContact O-C 2.88Å; N160-K163 PolarHBondContact O-N 3.01Å; N160-R164 VanDerWaalsContact O-CB 3.22Å; N160-R164 WeakPolarHBondContact O-CB 3.34Å; N160-R164 PolarHBondContact O-N 2.82Å
161	I	52.7	Low	54	Low	82 Å²	82	87.6 Å²	87.6	42%	0.421	42%	0.417	S	S	.	.	H	α-helix	trans	-58.6	-45.7	167.3	-71.4	167.2	0	0	0	110.6	D157 K163 R164 V165	D157-I161 VanDerWaalsContact O-CB 3.26Å; D157-I161 WeakPolarHBondContact O-CB 3.42Å; D157-I161 VanDerWaalsContact O-CD1 3.3Å; D157-I161 WeakPolarHBondContact O-CD1 2.94Å; D157-I161 WeakPolarHBondContact O-CG1 3.46Å; D157-I161 PolarHBondContact O-N 3.1Å; I161-K163 PolarHBondContact O-N 3.48Å; I161-R164 PolarHBondContact O-N 2.9Å; I161-V165 HydrophobicContact CG2-CG2 4.42Å; I161-V165 WeakPolarHBondContact O-CB 3.3Å; I161-V165 VanDerWaalsContact O-CG2 3.31Å; I161-V165 WeakPolarHBondContact O-CG2 3.33Å; I161-V165 PolarHBondContact O-N 2.74Å
162	L	62.3	Low	53.9	Low	89 Å²	89	84.8 Å²	84.8	47%	0.466	41%	0.414	S	S	.	.	H	α-helix	trans	-66.5	-35.1	175.3	-73.3	165.1	0	0	0	113.2	E158 N160 L166	E158-L162 HydrophobicContact CG-CD1 4.29Å; E158-L162 WeakPolarHBondContact O-CB 3.43Å; E158-L162 VanDerWaalsContact O-CG 3.23Å; E158-L162 WeakPolarHBondContact O-CG 3.47Å; E158-L162 PolarHBondContact O-N 3.02Å; N160-L162 PolarHBondContact O-N 2.91Å; L162-L166 VanDerWaalsContact O-CB 3.25Å; L162-L166 WeakPolarHBondContact O-CB 3.47Å; L162-L166 WeakPolarHBondContact O-CD1 3.27Å; L162-L166 WeakPolarHBondContact O-CG 3.33Å; L162-L166 PolarHBondContact O-N 2.65Å
163	K	60.5	Low	53.2	Low	67 Å²	67	87.1 Å²	87.1	29%	0.291	43%	0.426	S	S	.	.	H	α-helix	trans	-63.9	-43.4	170	-82.5	168.6	177.6	169.3	0	110.7	V159 N160 I161 L166 E167 I2332 K2333	V159-K163 WeakPolarHBondContact O-CB 3.33Å; V159-K163 VanDerWaalsContact O-CG 3.25Å; V159-K163 WeakPolarHBondContact O-CG 3.5Å; V159-K163 PolarHBondContact O-N 3.14Å; N160-K163 CarbonylContact O-C 2.88Å; N160-K163 PolarHBondContact O-N 3.01Å; I161-K163 PolarHBondContact O-N 3.48Å; K163-L166 CarbonylContact O-C 3.56Å; K163-L166 WeakPolarHBondContact O-CA 3.35Å; K163-L166 PolarHBondContact O-N 2.87Å; K163-L166 VanDerWaalsContact O-N 3.11Å; K163-E167 WeakPolarHBondContact O-CB 3.04Å; K163-E167 WeakPolarHBondContact O-CG 3.49Å; K163-E167 PolarHBondContact O-N 3.16Å; K163-I2332 WeakPolarHBondContact CE-O 3.41Å; K163-I2332 PolarHBondContact NZ-O 3.43Å; K163-K2333 WeakPolarHBondContact CE-O 3.07Å
164	R	54.1	Low	52	Low	158 Å²	158	95 Å²	95	60%	0.596	46%	0.456	S	S	*	.	H	α-helix	trans	-66.2	-41	-179.8	-156.6	65.4	164.6	159.9	-3.2	111.5	N160 I161 L166 E167 L168	N160-R164 VanDerWaalsContact O-CB 3.22Å; N160-R164 WeakPolarHBondContact O-CB 3.34Å; N160-R164 PolarHBondContact O-N 2.82Å; I161-R164 PolarHBondContact O-N 2.9Å; R164-L166 VanDerWaalsContact C-N 3.32Å; R164-E167 IonicContact NH1-OE2 2.55Å; R164-E167 PolarHBondContact NH1-OE2 2.84Å; R164-E167 PolarHBondContact O-N 3.04Å; R164-L168 WeakPolarHBondContact O-CB 3.33Å; R164-L168 WeakPolarHBondContact O-CG 3.4Å; R164-L168 PolarHBondContact O-N 3.08Å
165	V	53.5	Low	51.2	Low	60 Å²	60	91 Å²	91	36%	0.364	45%	0.454	S	S	.	.	H	α-helix	trans	-68.9	-29.5	171.8	171.8	0	0	0	0	111.8	I161 K169	I161-V165 HydrophobicContact CG2-CG2 4.42Å; I161-V165 WeakPolarHBondContact O-CB 3.3Å; I161-V165 VanDerWaalsContact O-CG2 3.31Å; I161-V165 WeakPolarHBondContact O-CG2 3.33Å; I161-V165 PolarHBondContact O-N 2.74Å; V165-K169 WeakPolarHBondContact O-CB 3.35Å; V165-K169 WeakPolarHBondContact O-CG 3.49Å; V165-K169 PolarHBondContact O-N 2.85Å
166	L	56.3	Low	50.4	Low	111 Å²	111	97 Å²	97	58%	0.581	48%	0.479	S	S	*	.	H	α-helix	trans	-79.8	-25.7	171.7	-75.3	169.4	0	0	0	113.6	L162 K163 R164 R170	L162-L166 VanDerWaalsContact O-CB 3.25Å; L162-L166 WeakPolarHBondContact O-CB 3.47Å; L162-L166 WeakPolarHBondContact O-CD1 3.27Å; L162-L166 WeakPolarHBondContact O-CG 3.33Å; L162-L166 PolarHBondContact O-N 2.65Å; K163-L166 CarbonylContact O-C 3.56Å; K163-L166 WeakPolarHBondContact O-CA 3.35Å; K163-L166 PolarHBondContact O-N 2.87Å; K163-L166 VanDerWaalsContact O-N 3.11Å; R164-L166 VanDerWaalsContact C-N 3.32Å; L166-R170 WeakPolarHBondContact O-CB 3.47Å; L166-R170 PolarHBondContact O-N 3.31Å
167	E	57.8	Low	48.8	Very low	80 Å²	80	104 Å²	104	37%	0.374	52%	0.516	S	S	.	.	H	α-helix	trans	-74.7	-51.1	170.9	-78.8	173.8	178	0	0	109.7	K163 R164 K169 R170 D171	K163-E167 WeakPolarHBondContact O-CB 3.04Å; K163-E167 WeakPolarHBondContact O-CG 3.49Å; K163-E167 PolarHBondContact O-N 3.16Å; R164-E167 IonicContact NH1-OE2 2.55Å; R164-E167 PolarHBondContact NH1-OE2 2.84Å; R164-E167 PolarHBondContact O-N 3.04Å; E167-K169 PolarHBondContact O-N 2.81Å; E167-R170 CarbonylContact O-C 3.54Å; E167-R170 WeakPolarHBondContact O-CA 3.36Å; E167-R170 PolarHBondContact O-N 2.72Å; E167-D171 WeakPolarHBondContact O-CB 3.18Å; E167-D171 PolarHBondContact O-N 2.99Å
168	L	51.4	Low	47.8	Very low	55 Å²	55	110 Å²	110	29%	0.288	55%	0.548	S	S	.	.	H	α-helix	trans	-57.4	-22.9	171	-67.7	168.6	0	0	0	113.1	R164 L173 W174	R164-L168 WeakPolarHBondContact O-CB 3.33Å; R164-L168 WeakPolarHBondContact O-CG 3.4Å; R164-L168 PolarHBondContact O-N 3.08Å; L168-L173 HydrophobicContact CD2-CB 4.23Å; L168-L173 HydrophobicContact CD2-CD1 3.84Å; L168-L173 PolarHBondContact O-N 3.39Å; L168-W174 PolarHBondContact O-N 2.79Å; L168-W174 VanDerWaalsContact O-N 3.15Å
169	K	47.5	Very low	46.3	Very low	136 Å²	136	109.1 Å²	109.1	59%	0.591	56%	0.557	S	S	*	*	H	α-helix	trans	-87.9	-21.4	168.1	-84.5	-172.7	168.6	-173.6	0	115.8	V165 E167 W174	V165-K169 WeakPolarHBondContact O-CB 3.35Å; V165-K169 WeakPolarHBondContact O-CG 3.49Å; V165-K169 PolarHBondContact O-N 2.85Å; E167-K169 PolarHBondContact O-N 2.81Å; K169-W174 HydrophobicContact CG-CB 4.35Å
170	R	51.5	Low	44.7	Very low	220 Å²	220	113.2 Å²	113.2	83%	0.83	59%	0.586	S	S	*	*	H	α-helix	trans	-83.8	-37.2	173.3	-98	179.7	162.2	165.1	-4.5	112.1	L166 E167 G172	L166-R170 WeakPolarHBondContact O-CB 3.47Å; L166-R170 PolarHBondContact O-N 3.31Å; E167-R170 CarbonylContact O-C 3.54Å; E167-R170 WeakPolarHBondContact O-CA 3.36Å; E167-R170 PolarHBondContact O-N 2.72Å; R170-G172 PolarHBondContact O-N 3.45Å
171	D	52.2	Low	42.9	Very low	110 Å²	110	115.3 Å²	115.3	59%	0.588	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	2.3	-179.8	-54.7	-22.4	0	0	0	111.3	E167 L173	E167-D171 WeakPolarHBondContact O-CB 3.18Å; E167-D171 PolarHBondContact O-N 2.99Å; D171-L173 VanDerWaalsContact C-N 3.29Å; D171-L173 PolarHBondContact O-N 3.49Å
172	G	43.9	Very low	41.5	Very low	50 Å²	50	114.1 Å²	114.1	52%	0.515	61%	0.614	S	S	.	*	T	Hydrogen-bonded Turn	trans	77.8	2.1	169.7	0	0	0	0	0	115.9	R170 W174	R170-G172 PolarHBondContact O-N 3.45Å; G172-W174 VanDerWaalsContact C-N 3.3Å; G172-W174 PolarHBondContact O-N 3.17Å
173	L	36.9	Very low	39.7	Very low	125 Å²	125	116.4 Å²	116.4	65%	0.654	63%	0.632	S	S	*	*			trans	-74.2	-15.8	-173.2	-68.4	169.7	0	0	0	114.2	L168 D171	L168-L173 HydrophobicContact CD2-CB 4.23Å; L168-L173 HydrophobicContact CD2-CD1 3.84Å; L168-L173 PolarHBondContact O-N 3.39Å; D171-L173 VanDerWaalsContact C-N 3.29Å; D171-L173 PolarHBondContact O-N 3.49Å
174	W	30.1	Very low	38	Very low	172 Å²	172	117.6 Å²	117.6	65%	0.652	65%	0.654	S	S	*	*	S	Bend	trans	-115	71.5	173.3	-84.9	49.3	0	0	0	111.4	L168 K169 G172	L168-W174 PolarHBondContact O-N 2.79Å; L168-W174 VanDerWaalsContact O-N 3.15Å; K169-W174 HydrophobicContact CG-CB 4.35Å; G172-W174 VanDerWaalsContact C-N 3.3Å; G172-W174 PolarHBondContact O-N 3.17Å
175	S	30.4	Very low	36.6	Very low	97 Å²	97	118.3 Å²	118.3	68%	0.678	66%	0.664	S	S	*	*			trans	-113.8	128.9	169.5	-163.5	0	0	0	0	110.4
176	I	34.8	Very low	35.3	Very low	167 Å²	167	122.3 Å²	122.3	86%	0.856	69%	0.689	S	S	*	*			trans	-110.8	103.7	169	-63.2	171.9	0	0	0	105.6
177	D	26.1	Very low	33.7	Very low	147 Å²	147	120.1 Å²	120.1	79%	0.786	69%	0.693	S	S	*	*			trans	-164.2	148.9	162.9	-90.3	-36	0	0	0	109.5
178	D	29.2	Very low	32.2	Very low	149 Å²	149	121.6 Å²	121.6	80%	0.797	71%	0.712	S	S	*	*			trans	-61.9	-177	-161.4	-65.4	-49.4	0	0	0	120.1
179	S	24.1	Very low	30.9	Very low	115 Å²	115	125.2 Å²	125.2	80%	0.804	73%	0.731	S	S	*	*			trans	88.7	151	153.1	87.7	0	0	0	0	117.4
180	S	24.4	Very low	30	Very low	109 Å²	109	125.4 Å²	125.4	76%	0.762	74%	0.738	S	S	*	*			cis	-162.6	170.1	-18.4	44.8	0	0	0	0	112.5
181	C	21.1	Very low	28.9	Very low	122 Å²	122	121.5 Å²	121.5	82%	0.824	73%	0.732	S	S	*	*			trans	16.3	139.6	152.1	-154.2	0	0	0	0	121.5
182	G	24.5	Very low	27.8	Very low	57 Å²	57	121.1 Å²	121.1	59%	0.588	74%	0.738	S	S	*	*			trans	-80.8	-169.1	163.5	0	0	0	0	0	114.2
183	T	24.7	Very low	26.9	Very low	138 Å²	138	124.3 Å²	124.3	85%	0.847	75%	0.748	S	S	*	*			trans	60.8	95	173.4	55	0	0	0	0	118.2
184	A	24.4	Very low	26.6	Very low	92 Å²	92	122.9 Å²	122.9	76%	0.76	75%	0.748	S	S	*	*				59	136.6	120.4	0	0	0	0	0	122.9
185	E	24.6	Very low	26.4	Very low	173 Å²	173	121.9 Å²	121.9	81%	0.808	75%	0.754	S	S	*	*			trans	78.4	105.9	150	-74.1	179.3	-159.2	0	0	122.2
186	T	25	Very low	26.3	Very low	144 Å²	144	121.7 Å²	121.7	88%	0.883	75%	0.753	S	S	*	*			trans	71.5	153.1	147.8	70	0	0	0	0	118.9
187	G	23.8	Very low	25.9	Very low	65 Å²	65	121.1 Å²	121.1	67%	0.67	75%	0.751	S	S	*	*			trans	179.4	-75.7	164.6	0	0	0	0	0	119.1
188	S	24.9	Very low	25.8	Very low	110 Å²	110	119.6 Å²	119.6	77%	0.769	75%	0.747	S	S	*	*			trans	68.1	148.4	178.5	78.2	0	0	0	0	119.5
189	I	25.1	Very low	26.2	Very low	132 Å²	132	118.2 Å²	118.2	68%	0.677	75%	0.745	S	S	*	*			trans	77.7	96.5	154	-61.2	158	0	0	0	119
190	D	28.1	Very low	26.4	Very low	139 Å²	139	118.1 Å²	118.1	74%	0.743	74%	0.742	S	S	*	*				52.2	163.6	119.6	-43.7	-25	0	0	0	125
191	I	28.1	Very low	26.5	Very low	138 Å²	138	118.7 Å²	118.7	71%	0.708	75%	0.746	S	S	*	*			trans	83.2	91.5	156.6	-62.1	149	0	0	0	117.6
192	S	29	Very low	27.3	Very low	102 Å²	102	121.5 Å²	121.5	71%	0.713	75%	0.747	S	S	*	*				51.4	164.4	111.8	-50.5	0	0	0	0	123.2
193	T	26.3	Very low	28	Very low	118 Å²	118	123.9 Å²	123.9	72%	0.724	75%	0.752	S	S	*	*			trans	68.5	105	155.6	29	0	0	0	0	116.6
194	S	30.3	Very low	28	Very low	95 Å²	95	123.7 Å²	123.7	66%	0.664	75%	0.751	S	S	*	*				92	177.4	78	76.9	0	0	0	0	112.2
195	I	26.2	Very low	28.1	Very low	150 Å²	150	124.9 Å²	124.9	77%	0.769	75%	0.753	S	S	*	*			trans	72.4	115	-176.9	-55.2	157.6	0	0	0	111.5
196	S	28.2	Very low	28.5	Very low	94 Å²	94	121.9 Å²	121.9	66%	0.657	73%	0.734	S	S	*	*			cis	86.8	136.5	32.9	-164.3	0	0	0	0	114.4
197	L	25.3	Very low	28.6	Very low	154 Å²	154	119.8 Å²	119.8	81%	0.806	72%	0.721	S	S	*	*			trans	67.4	155.1	177.6	-49.2	119.4	0	0	0	114.6
198	V	25.4	Very low	29.4	Very low	116 Å²	116	125 Å²	125	70%	0.703	72%	0.721	S	S	*	*			cis	-157.3	149	-23.9	126.2	0	0	0	0	106.6
199	P	36.7	Very low	30.1	Very low	119 Å²	119	121.7 Å²	121.7	77%	0.773	70%	0.698	S	S	*	*			trans	-82.9	149.5	-170.6	32.7	-37.5	0	0	0	115.5
200	P	28.5	Very low	30.9	Very low	113 Å²	113	116 Å²	116	73%	0.734	67%	0.67	S	S	*	*			trans	-143.5	148.6	146.7	37.5	-21.9	0	0	0	116.7
201	S	26.3	Very low	31.8	Very low	121 Å²	121	113.9 Å²	113.9	85%	0.846	65%	0.652	S	S	*	*			trans	63.9	142.2	152.1	48.1	0	0	0	0	123.2
202	E	38.5	Very low	32.8	Very low	182 Å²	182	110.6 Å²	110.6	85%	0.85	63%	0.634	S	S	*	*			trans	-72.4	177.5	167.2	-51.8	175.4	169.7	0	0	111.9
203	P	38.9	Very low	34	Very low	107 Å²	107	108.7 Å²	108.7	70%	0.695	61%	0.613	S	S	*	*			cis	-128.7	-176.7	1.3	30.1	-6.1	0	0	0	113.9
204	T	24.4	Very low	35.3	Very low	134 Å²	134	104.7 Å²	104.7	82%	0.822	59%	0.592	S	S	*	*				173.8	179.2	95.6	35.9	0	0	0	0	111.6
205	C	26.7	Very low	36.7	Very low	117 Å²	117	105.7 Å²	105.7	79%	0.791	59%	0.586	S	S	*	*			trans	-65.7	147.2	-170.2	-160.4	0	0	0	0	114.5
206	R	31.9	Very low	38.4	Very low	110 Å²	110	102 Å²	102	42%	0.415	57%	0.568	S	S	.	*			trans	-93.1	145	171.5	-77.3	173.1	166.9	178	-4.7	109.9	D210 P2268 Q2269 L2270 P2271	R206-D210 WeakPolarHBondContact CA-OD1 3.46Å; R206-D210 HydrophobicContact CB-CB 4.21Å; R206-D210 WeakPolarHBondContact CB-OD1 3.39Å; R206-D210 VanDerWaalsContact CG-OD1 3.24Å; R206-D210 WeakPolarHBondContact CG-OD1 3.4Å; R206-P2268 PolarHBondContact NH1-O 3Å; R206-Q2269 HydrophobicContact CB-CB 3.98Å; R206-Q2269 VanDerWaalsContact CD-O 3.26Å; R206-Q2269 WeakPolarHBondContact CD-O 3.22Å; R206-Q2269 PolarHBondContact NH1-O 3.26Å; R206-L2270 WeakPolarHBondContact CD-O 3.33Å; R206-P2271 HydrophobicContact CG-CG 4.14Å
207	T	29	Very low	39.9	Very low	99 Å²	99	102 Å²	102	61%	0.607	56%	0.56	S	S	*	*			trans	-90.4	-145.2	-163	-19.3	0	0	0	0	114.3	D210 Y211	T207-D210 WeakPolarHBondContact CA-OD2 3.19Å; T207-D210 WeakPolarHBondContact CB-OD2 3.5Å; T207-D210 VanDerWaalsContact N-CB 3.31Å; T207-D210 PolarHBondContact N-OD1 2.87Å; T207-D210 PolarHBondContact N-OD2 2.93Å; T207-D210 WeakPolarHBondContact O-CB 3.34Å; T207-D210 PolarHBondContact OG1-OD2 3.42Å; T207-Y211 WeakPolarHBondContact O-CD2 3.26Å
208	Y	39.8	Very low	41.5	Very low	174 Å²	174	102.1 Å²	102.1	68%	0.682	55%	0.55	S	S	*	.	S	Bend	trans	-104.6	-33.2	165.1	172.2	-90.3	0	0	0	113.8	D210 Y211 M212	Y208-D210 PolarHBondContact O-N 2.92Å; Y208-Y211 WeakPolarHBondContact O-CA 3.36Å; Y208-Y211 WeakPolarHBondContact O-CB 3.44Å; Y208-Y211 PolarHBondContact O-N 2.81Å; Y208-M212 PolarHBondContact O-N 2.72Å
209	S	38.6	Very low	43.1	Very low	41 Å²	41	99.7 Å²	99.7	29%	0.287	53%	0.532	S	S	.	.	S	Bend	trans	-45.6	-49.5	165.5	43	0	0	0	0	108.5	Y211 M212 T2272	S209-Y211 VanDerWaalsContact C-N 3.34Å; S209-Y211 PolarHBondContact O-N 2.71Å; S209-M212 WeakPolarHBondContact O-CA 3.4Å; S209-M212 WeakPolarHBondContact O-CB 3.34Å; S209-M212 PolarHBondContact O-N 3.04Å; S209-T2272 VanDerWaalsContact C-CB 3.47Å; S209-T2272 WeakPolarHBondContact O-CB 3.14Å; S209-T2272 WeakPolarHBondContact O-CG2 3.13Å
210	D	42.5	Very low	44.2	Very low	13 Å²	13	96.1 Å²	96.1	7%	0.07	51%	0.513	C	S	.	.	H	α-helix	trans	-33.7	-59.4	163.8	-69.2	-119.6	0	0	0	114.5	R206 T207 Y208 M212 F213 L2270 P2271 T2272	R206-D210 WeakPolarHBondContact CA-OD1 3.46Å; R206-D210 HydrophobicContact CB-CB 4.21Å; R206-D210 WeakPolarHBondContact CB-OD1 3.39Å; R206-D210 VanDerWaalsContact CG-OD1 3.24Å; R206-D210 WeakPolarHBondContact CG-OD1 3.4Å; T207-D210 WeakPolarHBondContact CA-OD2 3.19Å; T207-D210 WeakPolarHBondContact CB-OD2 3.5Å; T207-D210 VanDerWaalsContact N-CB 3.31Å; T207-D210 PolarHBondContact N-OD1 2.87Å; T207-D210 PolarHBondContact N-OD2 2.93Å; T207-D210 WeakPolarHBondContact O-CB 3.34Å; T207-D210 PolarHBondContact OG1-OD2 3.42Å; Y208-D210 PolarHBondContact O-N 2.92Å; D210-M212 PolarHBondContact O-N 2.95Å; D210-F213 PolarHBondContact O-N 3.44Å; D210-L2270 WeakPolarHBondContact CB-O 3.25Å; D210-L2270 CarbonylContact O-C 3.59Å; D210-L2270 VanDerWaalsContact O-C 3.24Å; D210-L2270 VanDerWaalsContact O-CA 3.32Å; D210-L2270 WeakPolarHBondContact O-CA 3.3Å; D210-L2270 WeakPolarHBondContact O-CB 3.14Å; D210-P2271 HydrophobicContact CB-CB 3.99Å; D210-P2271 WeakPolarHBondContact O-CA 3.42Å; D210-P2271 WeakPolarHBondContact OD1-CB 3.49Å; D210-P2271 WeakPolarHBondContact OD1-CG 3.31Å; D210-T2272 WeakPolarHBondContact CA-OG1 3.38Å; D210-T2272 PolarHBondContact N-OG1 3.09Å; D210-T2272 VanDerWaalsContact N-OG1 3.16Å
211	Y	47.3	Very low	45.7	Very low	94 Å²	94	94.9 Å²	94.9	37%	0.369	50%	0.498	S	S	.	.	H	α-helix	trans	-66.8	-0.1	-178.8	-82.6	-115.9	0	0	0	114.9	T207 Y208 S209 Q2269 L2270	T207-Y211 WeakPolarHBondContact O-CD2 3.26Å; Y208-Y211 WeakPolarHBondContact O-CA 3.36Å; Y208-Y211 WeakPolarHBondContact O-CB 3.44Å; Y208-Y211 PolarHBondContact O-N 2.81Å; S209-Y211 VanDerWaalsContact C-N 3.34Å; S209-Y211 PolarHBondContact O-N 2.71Å; Y211-Q2269 HydrophobicContact CE2-CB 4.16Å; Y211-Q2269 HydrophobicContact CE2-CG 3.94Å; Y211-Q2269 WeakPolarHBondContact OH-CG 3.5Å; Y211-Q2269 PolarHBondContact OH-NE2 2.98Å; Y211-L2270 HydrophobicContact CD1-CD1 3.4Å; Y211-L2270 VanDerWaalsContact CD1-CD1 3.4Å; Y211-L2270 HydrophobicContact CD2-CB 3.88Å; Y211-L2270 HydrophobicContact CD2-CD1 4.07Å; Y211-L2270 HydrophobicContact CE1-CD1 3.62Å; Y211-L2270 HydrophobicContact CE2-CB 4.23Å; Y211-L2270 HydrophobicContact CE2-CD1 4.27Å; Y211-L2270 HydrophobicContact CG-CB 4.16Å; Y211-L2270 HydrophobicContact CG-CD1 3.64Å; Y211-L2270 HydrophobicContact CG-CG 4.34Å
212	M	49.7	Very low	47.6	Very low	69 Å²	69	91.8 Å²	91.8	34%	0.34	47%	0.471	S	S	.	.	H	α-helix	trans	-106.4	-23.9	179.2	-144.9	-84.1	-66.3	0	0	112.6	Y208 S209 D210 I216	Y208-M212 PolarHBondContact O-N 2.72Å; S209-M212 WeakPolarHBondContact O-CA 3.4Å; S209-M212 WeakPolarHBondContact O-CB 3.34Å; S209-M212 PolarHBondContact O-N 3.04Å; D210-M212 PolarHBondContact O-N 2.95Å; M212-I216 HydrophobicContact CE-CD1 3.73Å; M212-I216 WeakPolarHBondContact O-CG1 3.46Å; M212-I216 PolarHBondContact O-N 3.33Å; M212-I216 HydrophobicContact SD-CD1 3.51Å; M212-I216 VanDerWaalsContact SD-CD1 3.51Å; M212-I216 HydrophobicContact SD-CG1 4.23Å
213	F	53.2	Low	48.7	Very low	63 Å²	63	86.3 Å²	86.3	28%	0.276	45%	0.445	S	S	.	.	H	α-helix	trans	-109.5	-18.2	-173	-105.1	-124.1	0	0	0	117.1	D210 I216 N217 T2272 E2273	D210-F213 PolarHBondContact O-N 3.44Å; F213-I216 HydrophobicContact CD2-CD1 3.8Å; F213-I216 HydrophobicContact CE2-CD1 4.06Å; F213-I216 HydrophobicContact CG-CB 4.46Å; F213-I216 HydrophobicContact CG-CD1 4.42Å; F213-I216 PolarHBondContact O-N 3.49Å; F213-N217 VanDerWaalsContact O-CB 3.27Å; F213-N217 WeakPolarHBondContact O-CB 3.5Å; F213-N217 PolarHBondContact O-N 3.36Å; F213-T2272 VanDerWaalsContact CB-CB 3.47Å; F213-T2272 HydrophobicContact CB-CG2 3.52Å; F213-T2272 HydrophobicContact CD1-CG2 4.3Å; F213-T2272 HydrophobicContact CD2-CG2 3.26Å; F213-T2272 HydrophobicContact CE2-CG2 3.86Å; F213-T2272 VanDerWaalsContact CG-CA 3.46Å; F213-T2272 HydrophobicContact CG-CG2 3.51Å; F213-E2273 HydrophobicContact CE2-CG 3.8Å; F213-E2273 WeakPolarHBondContact CE2-OE1 3.49Å; F213-E2273 HydrophobicContact CZ-CG 3.91Å
214	A	54.2	Low	49.9	Very low	34 Å²	34	87 Å²	87	28%	0.281	44%	0.437	S	S	.	.	H	α-helix	trans	-76.4	-13.6	155.5	0	0	0	0	0	111.1	W218 L2270	A214-W218 WeakPolarHBondContact O-CA 3.45Å; A214-W218 WeakPolarHBondContact O-CB 3.35Å; A214-W218 PolarHBondContact O-N 3.13Å; A214-L2270 VanDerWaalsContact CB-CA 3.44Å; A214-L2270 HydrophobicContact CB-CB 4.21Å; A214-L2270 HydrophobicContact CB-CD2 3.47Å; A214-L2270 VanDerWaalsContact CB-CD2 3.47Å; A214-L2270 HydrophobicContact CB-CG 3.82Å
215	E	60.1	Low	51.7	Low	115 Å²	115	86.1 Å²	86.1	54%	0.537	42%	0.419	S	S	.	.	H	α-helix	trans	-69.7	-50.5	158.4	-74.9	-169.8	172.5	0	0	110.9	N217 W218 L219 L2270	E215-N217 PolarHBondContact O-N 2.9Å; E215-W218 PolarHBondContact O-N 2.9Å; E215-L219 VanDerWaalsContact O-CB 3.3Å; E215-L219 WeakPolarHBondContact O-CB 3.29Å; E215-L219 WeakPolarHBondContact O-CG 3.45Å; E215-L219 PolarHBondContact O-N 3.17Å; E215-L2270 HydrophobicContact CG-CD2 4.19Å
216	I	61.1	Low	53.5	Low	74 Å²	74	82.5 Å²	82.5	38%	0.379	39%	0.39	S	S	.	.	H	α-helix	trans	-62.4	-39.9	175.1	-69.5	164.7	0	0	0	112.7	M212 F213 A220	M212-I216 HydrophobicContact CE-CD1 3.73Å; M212-I216 WeakPolarHBondContact O-CG1 3.46Å; M212-I216 PolarHBondContact O-N 3.33Å; M212-I216 HydrophobicContact SD-CD1 3.51Å; M212-I216 VanDerWaalsContact SD-CD1 3.51Å; M212-I216 HydrophobicContact SD-CG1 4.23Å; F213-I216 HydrophobicContact CD2-CD1 3.8Å; F213-I216 HydrophobicContact CE2-CD1 4.06Å; F213-I216 HydrophobicContact CG-CB 4.46Å; F213-I216 HydrophobicContact CG-CD1 4.42Å; F213-I216 PolarHBondContact O-N 3.49Å; I216-A220 WeakPolarHBondContact O-CB 3.41Å; I216-A220 PolarHBondContact O-N 2.99Å
217	N	59.1	Low	55.1	Low	92 Å²	92	85.2 Å²	85.2	49%	0.492	40%	0.4	S	S	.	.	H	α-helix	trans	-68	-40.7	173.6	-97.3	-17.4	0	0	0	111.1	F213 E215 A220 E221	F213-N217 VanDerWaalsContact O-CB 3.27Å; F213-N217 WeakPolarHBondContact O-CB 3.5Å; F213-N217 PolarHBondContact O-N 3.36Å; E215-N217 PolarHBondContact O-N 2.9Å; N217-A220 PolarHBondContact O-N 3.41Å; N217-E221 WeakPolarHBondContact O-CB 3.27Å; N217-E221 PolarHBondContact O-N 2.9Å
218	W	60	Low	56.6	Low	157 Å²	157	86.1 Å²	86.1	60%	0.595	40%	0.398	S	S	*	.	H	α-helix	trans	-62.1	-46.9	175.4	178.7	85.5	0	0	0	110.6	A214 E215 A220 E221 D222	A214-W218 WeakPolarHBondContact O-CA 3.45Å; A214-W218 WeakPolarHBondContact O-CB 3.35Å; A214-W218 PolarHBondContact O-N 3.13Å; E215-W218 PolarHBondContact O-N 2.9Å; W218-A220 VanDerWaalsContact C-N 3.34Å; W218-A220 PolarHBondContact O-N 3.2Å; W218-E221 CarbonylContact O-C 3.59Å; W218-E221 WeakPolarHBondContact O-CB 3.34Å; W218-E221 PolarHBondContact O-N 3.36Å; W218-D222 VanDerWaalsContact O-CB 3.3Å; W218-D222 WeakPolarHBondContact O-CB 3.41Å; W218-D222 PolarHBondContact O-N 2.77Å
219	L	59.7	Low	57.4	Low	65 Å²	65	85.9 Å²	85.9	34%	0.34	40%	0.396	S	S	.	.	H	α-helix	trans	-59.7	-37.3	171.1	-77.8	167	0	0	0	112.7	E215 D222 F223	E215-L219 VanDerWaalsContact O-CB 3.3Å; E215-L219 WeakPolarHBondContact O-CB 3.29Å; E215-L219 WeakPolarHBondContact O-CG 3.45Å; E215-L219 PolarHBondContact O-N 3.17Å; L219-D222 CarbonylContact O-C 3.59Å; L219-D222 PolarHBondContact O-N 2.71Å; L219-F223 WeakPolarHBondContact O-CB 3.41Å; L219-F223 WeakPolarHBondContact O-CD2 3.41Å; L219-F223 WeakPolarHBondContact O-CG 3.23Å; L219-F223 PolarHBondContact O-N 2.9Å
220	A	58	Low	58.9	Low	44 Å²	44	88.7 Å²	88.7	36%	0.364	40%	0.403	S	S	.	.	H	α-helix	trans	-70.8	-40.1	176	0	0	0	0	0	111.3	I216 N217 W218 D222 K224	I216-A220 WeakPolarHBondContact O-CB 3.41Å; I216-A220 PolarHBondContact O-N 2.99Å; N217-A220 PolarHBondContact O-N 3.41Å; W218-A220 VanDerWaalsContact C-N 3.34Å; W218-A220 PolarHBondContact O-N 3.2Å; A220-D222 VanDerWaalsContact C-N 3.27Å; A220-D222 PolarHBondContact O-N 3.08Å; A220-K224 WeakPolarHBondContact O-CB 3.36Å; A220-K224 PolarHBondContact O-N 3.17Å
221	E	61.4	Low	59.9	Low	88 Å²	88	96.5 Å²	96.5	41%	0.411	43%	0.431	S	S	.	.	H	α-helix	trans	-64.8	-32.9	170.4	-134.8	77.9	-103.2	0	0	111	N217 W218 K224 R225	N217-E221 WeakPolarHBondContact O-CB 3.27Å; N217-E221 PolarHBondContact O-N 2.9Å; W218-E221 CarbonylContact O-C 3.59Å; W218-E221 WeakPolarHBondContact O-CB 3.34Å; W218-E221 PolarHBondContact O-N 3.36Å; E221-K224 WeakPolarHBondContact OE1-CD 3.41Å; E221-K224 WeakPolarHBondContact OE1-CE 3.48Å; E221-K224 IonicContact OE1-NZ 3.17Å; E221-K224 PolarHBondContact OE1-NZ 2.99Å; E221-R225 WeakPolarHBondContact O-CB 3.06Å; E221-R225 VanDerWaalsContact O-CG 3.29Å; E221-R225 WeakPolarHBondContact O-CG 3.33Å; E221-R225 PolarHBondContact O-N 3.35Å; E221-R225 PolarHBondContact O-NE 3.26Å; E221-R225 VanDerWaalsContact O-NE 3.12Å
222	D	65.5	Low	60.5	Low	55 Å²	55	96.5 Å²	96.5	29%	0.294	44%	0.441	S	S	.	.	H	α-helix	trans	-73.7	-52.2	177.8	-140.9	80.7	0	0	0	110.8	W218 L219 A220 K224 R225 E226	W218-D222 VanDerWaalsContact O-CB 3.3Å; W218-D222 WeakPolarHBondContact O-CB 3.41Å; W218-D222 PolarHBondContact O-N 2.77Å; L219-D222 CarbonylContact O-C 3.59Å; L219-D222 PolarHBondContact O-N 2.71Å; A220-D222 VanDerWaalsContact C-N 3.27Å; A220-D222 PolarHBondContact O-N 3.08Å; D222-K224 PolarHBondContact O-N 3.27Å; D222-K224 VanDerWaalsContact O-N 3.16Å; D222-R225 VanDerWaalsContact CA-NH2 3.33Å; D222-R225 CarbonylContact O-C 3.58Å; D222-R225 WeakPolarHBondContact O-CA 3.46Å; D222-R225 WeakPolarHBondContact O-CB 3.41Å; D222-R225 PolarHBondContact O-N 3.01Å; D222-R225 IonicContact OD1-CZ 3.5Å; D222-R225 IonicContact OD1-NH1 2.65Å; D222-R225 PolarHBondContact OD1-NH1 3.3Å; D222-R225 IonicContact OD1-NH2 3.73Å; D222-R225 PolarHBondContact OD1-NH2 3.36Å; D222-E226 VanDerWaalsContact O-CB 3.28Å; D222-E226 WeakPolarHBondContact O-CB 3.2Å; D222-E226 PolarHBondContact O-N 2.98Å
223	F	61.8	Low	60.8	Low	68 Å²	68	94.9 Å²	94.9	30%	0.298	44%	0.436	S	S	.	.	H	α-helix	trans	-58.9	-27.8	169.9	-75.6	-54.2	0	0	0	113.2	C125 L219 R227	C125-F223 HydrophobicContact CB-CZ 3.92Å; L219-F223 WeakPolarHBondContact O-CB 3.41Å; L219-F223 WeakPolarHBondContact O-CD2 3.41Å; L219-F223 WeakPolarHBondContact O-CG 3.23Å; L219-F223 PolarHBondContact O-N 2.9Å; F223-R227 WeakPolarHBondContact O-CB 3.46Å; F223-R227 WeakPolarHBondContact O-CG 3.48Å; F223-R227 PolarHBondContact O-N 3.48Å
224	K	63.7	Low	61.3	Low	121 Å²	121	94.6 Å²	94.6	53%	0.526	45%	0.445	S	S	.	.	H	α-helix	trans	-76	-41.1	174.5	-179.4	175.2	169.9	-166.3	0	111	A220 E221 D222 Q228	A220-K224 WeakPolarHBondContact O-CB 3.36Å; A220-K224 PolarHBondContact O-N 3.17Å; E221-K224 WeakPolarHBondContact OE1-CD 3.41Å; E221-K224 WeakPolarHBondContact OE1-CE 3.48Å; E221-K224 IonicContact OE1-NZ 3.17Å; E221-K224 PolarHBondContact OE1-NZ 2.99Å; D222-K224 PolarHBondContact O-N 3.27Å; D222-K224 VanDerWaalsContact O-N 3.16Å; K224-Q228 WeakPolarHBondContact O-CB 3.48Å; K224-Q228 VanDerWaalsContact O-CG 3.28Å; K224-Q228 WeakPolarHBondContact O-CG 3.32Å; K224-Q228 PolarHBondContact O-N 3.48Å
225	R	63.2	Low	61.8	Low	115 Å²	115	100.1 Å²	100.1	43%	0.434	46%	0.463	S	S	.	.	H	α-helix	trans	-64.6	-39.1	168.4	-79.5	176.5	-76.9	122.4	1.2	111.9	E221 D222 Q228 W229	E221-R225 WeakPolarHBondContact O-CB 3.06Å; E221-R225 VanDerWaalsContact O-CG 3.29Å; E221-R225 WeakPolarHBondContact O-CG 3.33Å; E221-R225 PolarHBondContact O-N 3.35Å; E221-R225 PolarHBondContact O-NE 3.26Å; E221-R225 VanDerWaalsContact O-NE 3.12Å; D222-R225 VanDerWaalsContact CA-NH2 3.33Å; D222-R225 CarbonylContact O-C 3.58Å; D222-R225 WeakPolarHBondContact O-CA 3.46Å; D222-R225 WeakPolarHBondContact O-CB 3.41Å; D222-R225 PolarHBondContact O-N 3.01Å; D222-R225 IonicContact OD1-CZ 3.5Å; D222-R225 IonicContact OD1-NH1 2.65Å; D222-R225 PolarHBondContact OD1-NH1 3.3Å; D222-R225 IonicContact OD1-NH2 3.73Å; D222-R225 PolarHBondContact OD1-NH2 3.36Å; R225-Q228 CarbonylContact O-C 3.5Å; R225-Q228 WeakPolarHBondContact O-CB 3.41Å; R225-Q228 PolarHBondContact O-N 3.45Å; R225-W229 VanDerWaalsContact O-CB 3.3Å; R225-W229 WeakPolarHBondContact O-CB 3.44Å; R225-W229 PolarHBondContact O-N 2.95Å
226	E	64.2	Low	61.9	Low	42 Å²	42	101.7 Å²	101.7	20%	0.196	47%	0.468	C	S	.	.	H	α-helix	trans	-74.7	-38.6	-179.8	-159.2	-134.7	-153.4	0	0	111.4	D222 Q228 W229 K230	D222-E226 VanDerWaalsContact O-CB 3.28Å; D222-E226 WeakPolarHBondContact O-CB 3.2Å; D222-E226 PolarHBondContact O-N 2.98Å; E226-Q228 VanDerWaalsContact C-N 3.34Å; E226-W229 PolarHBondContact O-N 3.09Å; E226-K230 HydrophobicContact CG-CD 4.39Å; E226-K230 VanDerWaalsContact O-CB 3.25Å; E226-K230 WeakPolarHBondContact O-CB 3.41Å; E226-K230 VanDerWaalsContact O-CG 3.32Å; E226-K230 WeakPolarHBondContact O-CG 3.43Å; E226-K230 PolarHBondContact O-N 3.47Å; E226-K230 WeakPolarHBondContact OE1-CE 3.29Å; E226-K230 IonicContact OE1-NZ 2.68Å; E226-K230 PolarHBondContact OE1-NZ 2.84Å; E226-K230 VanDerWaalsContact OE2-CE 3.31Å; E226-K230 WeakPolarHBondContact OE2-CE 3.44Å; E226-K230 IonicContact OE2-NZ 3.35Å; E226-K230 PolarHBondContact OE2-NZ 3.19Å
227	R	65	Low	61.7	Low	167 Å²	167	103.9 Å²	103.9	63%	0.63	48%	0.48	S	S	*	.	H	α-helix	trans	-67.1	-34	168.3	-74.7	174.1	-168.8	-166.8	5.6	111.9	F223 R231	F223-R227 WeakPolarHBondContact O-CB 3.46Å; F223-R227 WeakPolarHBondContact O-CG 3.48Å; F223-R227 PolarHBondContact O-N 3.48Å; R227-R231 VanDerWaalsContact O-CB 3.23Å; R227-R231 WeakPolarHBondContact O-CB 3.45Å; R227-R231 WeakPolarHBondContact O-CD 3.46Å; R227-R231 WeakPolarHBondContact O-CG 3.44Å; R227-R231 PolarHBondContact O-N 2.92Å
228	Q	60.5	Low	61.8	Low	118 Å²	118	102 Å²	102	55%	0.551	48%	0.478	S	S	*	.	H	α-helix	trans	-67.7	-45.4	171.2	-80.6	178.1	-20.5	0	0	111.1	K224 R225 E226 R231 V232	K224-Q228 WeakPolarHBondContact O-CB 3.48Å; K224-Q228 VanDerWaalsContact O-CG 3.28Å; K224-Q228 WeakPolarHBondContact O-CG 3.32Å; K224-Q228 PolarHBondContact O-N 3.48Å; R225-Q228 CarbonylContact O-C 3.5Å; R225-Q228 WeakPolarHBondContact O-CB 3.41Å; R225-Q228 PolarHBondContact O-N 3.45Å; E226-Q228 VanDerWaalsContact C-N 3.34Å; Q228-R231 PolarHBondContact O-N 2.62Å; Q228-V232 WeakPolarHBondContact O-CB 3.3Å; Q228-V232 VanDerWaalsContact O-CG2 3.27Å; Q228-V232 WeakPolarHBondContact O-CG2 3.25Å; Q228-V232 PolarHBondContact O-N 3.17Å
229	W	56.4	Low	61.7	Low	168 Å²	168	99.8 Å²	99.8	64%	0.636	48%	0.476	S	S	*	.	H	α-helix	trans	-62.7	-49.3	176.2	-180	80.6	0	0	0	111.3	R225 E226 R231 V232 S233	R225-W229 VanDerWaalsContact O-CB 3.3Å; R225-W229 WeakPolarHBondContact O-CB 3.44Å; R225-W229 PolarHBondContact O-N 2.95Å; E226-W229 PolarHBondContact O-N 3.09Å; W229-R231 VanDerWaalsContact C-N 3.34Å; W229-R231 PolarHBondContact O-N 3.37Å; W229-V232 CarbonylContact O-C 3.57Å; W229-V232 PolarHBondContact O-N 2.9Å; W229-V232 VanDerWaalsContact O-N 3.15Å; W229-S233 VanDerWaalsContact O-CB 3.24Å; W229-S233 WeakPolarHBondContact O-CB 3.21Å; W229-S233 PolarHBondContact O-N 2.9Å; W229-S233 PolarHBondContact O-OG 2.77Å
230	K	70.6	Confident	61.5	Low	101 Å²	101	100.1 Å²	100.1	44%	0.439	48%	0.481	S	S	.	.	H	α-helix	trans	-59.1	-39.7	173.4	-74.6	174.3	178	165.7	0	112.1	E226 A234	E226-K230 HydrophobicContact CG-CD 4.39Å; E226-K230 VanDerWaalsContact O-CB 3.25Å; E226-K230 WeakPolarHBondContact O-CB 3.41Å; E226-K230 VanDerWaalsContact O-CG 3.32Å; E226-K230 WeakPolarHBondContact O-CG 3.43Å; E226-K230 PolarHBondContact O-N 3.47Å; E226-K230 WeakPolarHBondContact OE1-CE 3.29Å; E226-K230 IonicContact OE1-NZ 2.68Å; E226-K230 PolarHBondContact OE1-NZ 2.84Å; E226-K230 VanDerWaalsContact OE2-CE 3.31Å; E226-K230 WeakPolarHBondContact OE2-CE 3.44Å; E226-K230 IonicContact OE2-NZ 3.35Å; E226-K230 PolarHBondContact OE2-NZ 3.19Å; K230-A234 WeakPolarHBondContact O-CB 3.32Å; K230-A234 PolarHBondContact O-N 2.86Å
231	R	63.8	Low	61.6	Low	177 Å²	177	100.4 Å²	100.4	67%	0.668	48%	0.484	S	S	*	.	H	α-helix	trans	-68.6	-37.9	173.3	-78.1	171.8	175.4	168	-1	113.3	R227 Q228 W229 K235	R227-R231 VanDerWaalsContact O-CB 3.23Å; R227-R231 WeakPolarHBondContact O-CB 3.45Å; R227-R231 WeakPolarHBondContact O-CD 3.46Å; R227-R231 WeakPolarHBondContact O-CG 3.44Å; R227-R231 PolarHBondContact O-N 2.92Å; Q228-R231 PolarHBondContact O-N 2.62Å; W229-R231 VanDerWaalsContact C-N 3.34Å; W229-R231 PolarHBondContact O-N 3.37Å; R231-K235 VanDerWaalsContact O-CB 3.31Å; R231-K235 WeakPolarHBondContact O-CB 3.17Å; R231-K235 VanDerWaalsContact O-CG 3.3Å; R231-K235 WeakPolarHBondContact O-CG 3.48Å; R231-K235 PolarHBondContact O-N 3.08Å
232	V	60.3	Low	61.7	Low	93 Å²	93	100.7 Å²	100.7	56%	0.564	49%	0.488	S	S	*	.	H	α-helix	trans	-72	-45.2	177.8	167.5	0	0	0	0	110.3	Q228 W229 K235 K236	Q228-V232 WeakPolarHBondContact O-CB 3.3Å; Q228-V232 VanDerWaalsContact O-CG2 3.27Å; Q228-V232 WeakPolarHBondContact O-CG2 3.25Å; Q228-V232 PolarHBondContact O-N 3.17Å; W229-V232 CarbonylContact O-C 3.57Å; W229-V232 PolarHBondContact O-N 2.9Å; W229-V232 VanDerWaalsContact O-N 3.15Å; V232-K235 CarbonylContact O-C 3.54Å; V232-K235 PolarHBondContact O-N 3.09Å; V232-K236 WeakPolarHBondContact O-CB 3.12Å; V232-K236 PolarHBondContact O-N 3.47Å
233	S	54.9	Low	61.9	Low	35 Å²	35	101.7 Å²	101.7	25%	0.245	49%	0.489	C	S	.	.	H	α-helix	trans	-64.4	-41.7	174.2	-66.8	0	0	0	0	111.9	W229 K236 L237	W229-S233 VanDerWaalsContact O-CB 3.24Å; W229-S233 WeakPolarHBondContact O-CB 3.21Å; W229-S233 PolarHBondContact O-N 2.9Å; W229-S233 PolarHBondContact O-OG 2.77Å; S233-K236 CarbonylContact O-C 3.39Å; S233-K236 PolarHBondContact O-N 3.44Å; S233-L237 WeakPolarHBondContact O-CB 3.43Å; S233-L237 PolarHBondContact O-N 3.27Å
234	A	63.6	Low	61.9	Low	57 Å²	57	100 Å²	100	47%	0.471	49%	0.485	S	S	.	.	H	α-helix	trans	-65.1	-41.6	172.8	0	0	0	0	0	112	K230 K236 L237 A238	K230-A234 WeakPolarHBondContact O-CB 3.32Å; K230-A234 PolarHBondContact O-N 2.86Å; A234-K236 VanDerWaalsContact C-N 3.33Å; A234-K236 PolarHBondContact O-N 2.71Å; A234-L237 PolarHBondContact O-N 3.01Å; A234-A238 VanDerWaalsContact O-CB 3.26Å; A234-A238 WeakPolarHBondContact O-CB 3.41Å; A234-A238 PolarHBondContact O-N 3.35Å
235	K	65.2	Low	61.7	Low	151 Å²	151	98.1 Å²	98.1	66%	0.657	49%	0.487	S	S	*	.	H	α-helix	trans	-64.8	-35.8	171.6	-78.7	-175	175.2	-166.6	0	112.5	R231 V232 L239	R231-K235 VanDerWaalsContact O-CB 3.31Å; R231-K235 WeakPolarHBondContact O-CB 3.17Å; R231-K235 VanDerWaalsContact O-CG 3.3Å; R231-K235 WeakPolarHBondContact O-CG 3.48Å; R231-K235 PolarHBondContact O-N 3.08Å; V232-K235 CarbonylContact O-C 3.54Å; V232-K235 PolarHBondContact O-N 3.09Å; K235-L239 WeakPolarHBondContact O-CB 3.22Å; K235-L239 WeakPolarHBondContact O-CD1 3.4Å; K235-L239 WeakPolarHBondContact O-CG 3.4Å; K235-L239 PolarHBondContact O-N 3.21Å
236	K	61.5	Low	61.6	Low	147 Å²	147	97.1 Å²	97.1	64%	0.639	48%	0.483	S	S	*	.	H	α-helix	trans	-69.5	-42.4	177.1	-164.8	178.1	-177.8	-172.1	0	110.5	V232 S233 A234 L239 T240	V232-K236 WeakPolarHBondContact O-CB 3.12Å; V232-K236 PolarHBondContact O-N 3.47Å; S233-K236 CarbonylContact O-C 3.39Å; S233-K236 PolarHBondContact O-N 3.44Å; A234-K236 VanDerWaalsContact C-N 3.33Å; A234-K236 PolarHBondContact O-N 2.71Å; K236-L239 PolarHBondContact O-N 3.45Å; K236-T240 WeakPolarHBondContact O-CB 3.19Å; K236-T240 WeakPolarHBondContact O-CG2 3.3Å; K236-T240 PolarHBondContact O-N 2.87Å; K236-T240 PolarHBondContact O-OG1 3.15Å
237	L	58.2	Low	61.4	Low	121 Å²	121	95.5 Å²	95.5	63%	0.634	48%	0.476	S	S	*	.	H	α-helix	trans	-61.9	-51	172	-98.2	166.2	0	0	0	111.6	S233 A234 L239 T240 A241	S233-L237 WeakPolarHBondContact O-CB 3.43Å; S233-L237 PolarHBondContact O-N 3.27Å; A234-L237 PolarHBondContact O-N 3.01Å; L237-L239 VanDerWaalsContact C-N 3.33Å; L237-L239 PolarHBondContact O-N 3.38Å; L237-T240 VanDerWaalsContact CA-OG1 3.31Å; L237-T240 WeakPolarHBondContact CA-OG1 3.46Å; L237-T240 CarbonylContact O-C 3.59Å; L237-T240 WeakPolarHBondContact O-CA 3.16Å; L237-T240 PolarHBondContact O-N 3.32Å; L237-T240 PolarHBondContact O-OG1 3.26Å; L237-A241 WeakPolarHBondContact O-CB 3.47Å; L237-A241 PolarHBondContact O-N 3.26Å
238	A	59.8	Low	61.3	Low	53 Å²	53	94.2 Å²	94.2	44%	0.438	48%	0.475	S	S	.	.	H	α-helix	trans	-59.7	-43.2	176.7	0	0	0	0	0	111.5	A234 T240 A241 L242	A234-A238 VanDerWaalsContact O-CB 3.26Å; A234-A238 WeakPolarHBondContact O-CB 3.41Å; A234-A238 PolarHBondContact O-N 3.35Å; A238-T240 VanDerWaalsContact C-N 3.34Å; A238-T240 PolarHBondContact O-N 3.15Å; A238-A241 PolarHBondContact O-N 3.13Å; A238-L242 VanDerWaalsContact O-CB 3.24Å; A238-L242 WeakPolarHBondContact O-CB 3.14Å; A238-L242 WeakPolarHBondContact O-CG 3.28Å; A238-L242 PolarHBondContact O-N 3.28Å
239	L	58.9	Low	61.2	Low	109 Å²	109	91 Å²	91	57%	0.571	47%	0.465	S	S	*	.	H	α-helix	trans	-66	-32.1	173	-74.2	169	0	0	0	112.6	K235 K236 L237 K243	K235-L239 WeakPolarHBondContact O-CB 3.22Å; K235-L239 WeakPolarHBondContact O-CD1 3.4Å; K235-L239 WeakPolarHBondContact O-CG 3.4Å; K235-L239 PolarHBondContact O-N 3.21Å; K236-L239 PolarHBondContact O-N 3.45Å; L237-L239 VanDerWaalsContact C-N 3.33Å; L237-L239 PolarHBondContact O-N 3.38Å; L239-K243 WeakPolarHBondContact O-CB 3.36Å; L239-K243 PolarHBondContact O-N 3.24Å
240	T	54.3	Low	61.4	Low	72 Å²	72	85.5 Å²	85.5	44%	0.442	45%	0.446	S	S	.	.	H	α-helix	trans	-81.9	-21.2	174.2	49.4	0	0	0	0	114.4	K236 L237 A238 K243 C244	K236-T240 WeakPolarHBondContact O-CB 3.19Å; K236-T240 WeakPolarHBondContact O-CG2 3.3Å; K236-T240 PolarHBondContact O-N 2.87Å; K236-T240 PolarHBondContact O-OG1 3.15Å; L237-T240 VanDerWaalsContact CA-OG1 3.31Å; L237-T240 WeakPolarHBondContact CA-OG1 3.46Å; L237-T240 CarbonylContact O-C 3.59Å; L237-T240 WeakPolarHBondContact O-CA 3.16Å; L237-T240 PolarHBondContact O-N 3.32Å; L237-T240 PolarHBondContact O-OG1 3.26Å; A238-T240 VanDerWaalsContact C-N 3.34Å; A238-T240 PolarHBondContact O-N 3.15Å; T240-K243 WeakPolarHBondContact O-CB 3.4Å; T240-C244 WeakPolarHBondContact O-CB 3.24Å; T240-C244 PolarHBondContact O-N 3.23Å
241	A	60.6	Low	60.6	Low	50 Å²	50	83.8 Å²	83.8	41%	0.413	44%	0.437	S	S	.	.	H	α-helix	trans	-80.6	-45.9	173	0	0	0	0	0	110.3	L237 A238 K243 C244 C245	L237-A241 WeakPolarHBondContact O-CB 3.47Å; L237-A241 PolarHBondContact O-N 3.26Å; A238-A241 PolarHBondContact O-N 3.13Å; A241-K243 PolarHBondContact O-N 2.88Å; A241-C244 WeakPolarHBondContact O-CA 3.33Å; A241-C244 VanDerWaalsContact O-CB 3.32Å; A241-C244 WeakPolarHBondContact O-CB 3.42Å; A241-C244 PolarHBondContact O-N 3.04Å; A241-C244 VanDerWaalsContact O-N 3.09Å; A241-C245 PolarHBondContact O-N 2.93Å; A241-C245 PolarHBondContact O-SG 3.43Å; A241-C245 VanDerWaalsContact O-SG 3.35Å
242	L	64.4	Low	60.5	Low	94 Å²	94	77.9 Å²	77.9	49%	0.492	43%	0.427	S	S	.	.	H	α-helix	trans	-53.5	-41.5	163.4	-78.7	169.4	0	0	0	110.6	A238 C245 R246 L2246	A238-L242 VanDerWaalsContact O-CB 3.24Å; A238-L242 WeakPolarHBondContact O-CB 3.14Å; A238-L242 WeakPolarHBondContact O-CG 3.28Å; A238-L242 PolarHBondContact O-N 3.28Å; L242-C245 PolarHBondContact O-N 2.98Å; L242-R246 PolarHBondContact O-N 3.18Å; L242-L2246 HydrophobicContact CB-CD1 3.81Å; L242-L2246 HydrophobicContact CD2-CD1 4.38Å
243	K	68.6	Low	60.6	Low	76 Å²	76	77.1 Å²	77.1	33%	0.33	42%	0.419	S	S	.	.	H	α-helix	trans	-54.2	-60	171.3	-169.9	151.3	-175.3	-171.1	0	110.2	L239 T240 A241 C245 R246 D247 Y2244 R2245	L239-K243 WeakPolarHBondContact O-CB 3.36Å; L239-K243 PolarHBondContact O-N 3.24Å; T240-K243 WeakPolarHBondContact O-CB 3.4Å; A241-K243 PolarHBondContact O-N 2.88Å; K243-C245 VanDerWaalsContact C-N 3.31Å; K243-C245 PolarHBondContact O-N 2.91Å; K243-R246 PolarHBondContact O-N 3.31Å; K243-D247 PolarHBondContact O-N 3.08Å; K243-Y2244 CarbonylContact C-O 3.43Å; K243-Y2244 WeakPolarHBondContact CG-O 3.36Å; K243-R2245 CarbonylContact C-O 3.13Å; K243-R2245 VanDerWaalsContact CA-C 3.48Å; K243-R2245 WeakPolarHBondContact CA-O 3.48Å; K243-R2245 CarbonylContact O-C 3.48Å
244	C	62.6	Low	61.2	Low	32 Å²	32	78.7 Å²	78.7	22%	0.216	42%	0.421	C	S	.	.	H	α-helix	trans	-47.7	-47.7	177.7	-178.4	0	0	0	0	114.4	T240 A241 D247 K248 V2243	T240-C244 WeakPolarHBondContact O-CB 3.24Å; T240-C244 PolarHBondContact O-N 3.23Å; A241-C244 WeakPolarHBondContact O-CA 3.33Å; A241-C244 VanDerWaalsContact O-CB 3.32Å; A241-C244 WeakPolarHBondContact O-CB 3.42Å; A241-C244 PolarHBondContact O-N 3.04Å; A241-C244 VanDerWaalsContact O-N 3.09Å; C244-D247 PolarHBondContact O-N 3.38Å; C244-K248 WeakPolarHBondContact O-CG 3.49Å; C244-K248 PolarHBondContact O-N 3.17Å; C244-K248 VanDerWaalsContact O-N 3.16Å; C244-V2243 HydrophobicContact CB-CB 4.23Å; C244-V2243 HydrophobicContact CB-CG1 4.17Å; C244-V2243 HydrophobicContact CB-CG2 3.95Å
245	C	58.6	Low	61.2	Low	82 Å²	82	80.8 Å²	80.8	55%	0.554	42%	0.423	S	S	*	.	H	α-helix	trans	-67.2	-46.2	-174.8	-66.2	0	0	0	0	113.3	A241 L242 K243 D247 S249	A241-C245 PolarHBondContact O-N 2.93Å; A241-C245 PolarHBondContact O-SG 3.43Å; A241-C245 VanDerWaalsContact O-SG 3.35Å; L242-C245 PolarHBondContact O-N 2.98Å; K243-C245 VanDerWaalsContact C-N 3.31Å; K243-C245 PolarHBondContact O-N 2.91Å; C245-D247 VanDerWaalsContact C-N 3.29Å; C245-D247 PolarHBondContact O-N 3.45Å; C245-S249 PolarHBondContact O-N 2.98Å
246	R	62.4	Low	61.1	Low	95 Å²	95	79.1 Å²	79.1	36%	0.358	42%	0.418	S	S	.	.	H	α-helix	trans	-69.9	-26.5	-177.4	-151.9	-166.9	158.2	-174.5	-10.5	110.9	L242 K243 S249 E250 R2245 L2246 Q2247	L242-R246 PolarHBondContact O-N 3.18Å; K243-R246 PolarHBondContact O-N 3.31Å; R246-S249 CarbonylContact O-C 3.56Å; R246-S249 WeakPolarHBondContact O-CA 3.5Å; R246-S249 PolarHBondContact O-N 3.38Å; R246-S249 PolarHBondContact O-OG 2.94Å; R246-E250 PolarHBondContact O-N 3.07Å; R246-R2245 HydrophobicContact CB-CB 3.85Å; R246-R2245 VanDerWaalsContact CB-O 3.27Å; R246-R2245 WeakPolarHBondContact CB-O 3.25Å; R246-R2245 HydrophobicContact CG-CB 4.4Å; R246-R2245 VanDerWaalsContact CG-CD 3.47Å; R246-R2245 VanDerWaalsContact O-CD 3.25Å; R246-R2245 WeakPolarHBondContact O-CD 3.22Å; R246-R2245 PolarHBondContact O-NH1 3.21Å; R246-L2246 HydrophobicContact CB-CD1 4.23Å; R246-L2246 HydrophobicContact CB-CG 4.12Å; R246-L2246 HydrophobicContact CG-CG 4.48Å; R246-L2246 VanDerWaalsContact NH1-CD2 3.31Å; R246-Q2247 VanDerWaalsContact CZ-OE1 3.23Å; R246-Q2247 VanDerWaalsContact NH2-OE1 3.09Å
247	D	60.5	Low	61.5	Low	8 Å²	8	79 Å²	79	4%	0.043	42%	0.417	C	S	.	.	H	α-helix	trans	-90.8	-20.9	-177.1	-147.2	-88.4	0	0	0	113.3	K243 C244 C245 S249 E250 R251 V2243 Y2244 R2245	K243-D247 PolarHBondContact O-N 3.08Å; C244-D247 PolarHBondContact O-N 3.38Å; C245-D247 VanDerWaalsContact C-N 3.29Å; C245-D247 PolarHBondContact O-N 3.45Å; D247-S249 PolarHBondContact O-N 2.81Å; D247-E250 HydrophobicContact CB-CB 4.49Å; D247-E250 PolarHBondContact O-N 3.01Å; D247-E250 VanDerWaalsContact O-N 3.12Å; D247-R251 WeakPolarHBondContact O-CB 3.28Å; D247-R251 WeakPolarHBondContact O-CG 3.29Å; D247-R251 PolarHBondContact O-N 2.87Å; D247-R251 IonicContact OD1-CZ 2.77Å; D247-R251 IonicContact OD1-NE 2.71Å; D247-R251 PolarHBondContact OD1-NE 3.03Å; D247-R251 VanDerWaalsContact OD1-NE 3.09Å; D247-R251 IonicContact OD1-NH2 2.91Å; D247-R251 PolarHBondContact OD1-NH2 3.33Å; D247-R251 VanDerWaalsContact OD1-NH2 3.12Å; D247-V2243 HydrophobicContact CB-CG1 4.28Å; D247-Y2244 VanDerWaalsContact CB-O 3.26Å; D247-Y2244 WeakPolarHBondContact CB-O 3.1Å; D247-Y2244 VanDerWaalsContact CG-C 3.42Å; D247-Y2244 VanDerWaalsContact CG-CB 3.46Å; D247-Y2244 VanDerWaalsContact OD2-CB 3.25Å; D247-Y2244 WeakPolarHBondContact OD2-CB 3.42Å; D247-Y2244 WeakPolarHBondContact OD2-CD1 3.45Å; D247-R2245 HydrophobicContact CB-CB 3.55Å; D247-R2245 HydrophobicContact CB-CG 3.95Å; D247-R2245 VanDerWaalsContact CB-N 3.33Å; D247-R2245 WeakPolarHBondContact OD2-CA 3.46Å; D247-R2245 WeakPolarHBondContact OD2-CB 3.3Å; D247-R2245 WeakPolarHBondContact OD2-CG 3.46Å; D247-R2245 PolarHBondContact OD2-N 3.32Å
248	K	63	Low	61.8	Low	140 Å²	140	77.9 Å²	77.9	61%	0.609	41%	0.409	S	S	*	.	H	α-helix	trans	-52.3	-42.4	155.2	-75.8	179.7	175.5	-175.3	0	110	C244 R251 A252	C244-K248 WeakPolarHBondContact O-CG 3.49Å; C244-K248 PolarHBondContact O-N 3.17Å; C244-K248 VanDerWaalsContact O-N 3.16Å; K248-R251 PolarHBondContact O-N 2.78Å; K248-A252 WeakPolarHBondContact O-CB 3.37Å; K248-A252 PolarHBondContact O-N 3.05Å
249	S	56.4	Low	62.2	Low	50 Å²	50	78.7 Å²	78.7	35%	0.35	40%	0.404	S	S	.	.	H	α-helix	trans	-84.1	-8.7	173	66.2	0	0	0	0	115.9	C245 R246 D247 L253 R2245	C245-S249 PolarHBondContact O-N 2.98Å; R246-S249 CarbonylContact O-C 3.56Å; R246-S249 WeakPolarHBondContact O-CA 3.5Å; R246-S249 PolarHBondContact O-N 3.38Å; R246-S249 PolarHBondContact O-OG 2.94Å; D247-S249 PolarHBondContact O-N 2.81Å; S249-L253 WeakPolarHBondContact O-CB 3.16Å; S249-L253 VanDerWaalsContact O-CD1 3.3Å; S249-L253 WeakPolarHBondContact O-CD1 3.39Å; S249-L253 WeakPolarHBondContact O-CG 3.5Å; S249-L253 PolarHBondContact O-N 3.46Å; S249-R2245 VanDerWaalsContact C-NH1 3.33Å; S249-R2245 PolarHBondContact OG-NH1 2.75Å
250	E	60.6	Low	62.7	Low	52 Å²	52	76.6 Å²	76.6	24%	0.243	40%	0.395	C	S	.	.	H	α-helix	trans	-76.2	-38.7	162.8	-162.2	119.3	-94.7	0	0	109.9	R246 D247 K254 R2245	R246-E250 PolarHBondContact O-N 3.07Å; D247-E250 HydrophobicContact CB-CB 4.49Å; D247-E250 PolarHBondContact O-N 3.01Å; D247-E250 VanDerWaalsContact O-N 3.12Å; E250-K254 HydrophobicContact CG-CD 4.31Å; E250-K254 VanDerWaalsContact O-CB 3.23Å; E250-K254 WeakPolarHBondContact O-CB 3.37Å; E250-K254 VanDerWaalsContact O-CG 3.27Å; E250-K254 WeakPolarHBondContact O-CG 3.5Å; E250-K254 PolarHBondContact O-N 2.98Å; E250-R2245 VanDerWaalsContact CA-CZ 3.5Å; E250-R2245 HydrophobicContact CB-CG 3.87Å; E250-R2245 VanDerWaalsContact CB-CZ 3.48Å; E250-R2245 HydrophobicContact CG-CG 4.31Å; E250-R2245 IonicContact OE1-CZ 3.65Å; E250-R2245 IonicContact OE1-NE 2.75Å; E250-R2245 PolarHBondContact OE1-NE 3.21Å; E250-R2245 IonicContact OE1-NH2 2.81Å; E250-R2245 PolarHBondContact OE1-NH2 2.75Å; E250-R2245 WeakPolarHBondContact OE2-CG 3.06Å; E250-R2245 IonicContact OE2-NE 2.83Å; E250-R2245 PolarHBondContact OE2-NE 2.73Å
251	R	54.6	Low	63.4	Low	65 Å²	65	76.3 Å²	76.3	25%	0.245	39%	0.393	C	S	.	.	H	α-helix	trans	-76.2	-35.8	177.3	-70.1	-178.7	-138.6	154	9.5	113	D247 K248 K254 I255 M2242 V2243	D247-R251 WeakPolarHBondContact O-CB 3.28Å; D247-R251 WeakPolarHBondContact O-CG 3.29Å; D247-R251 PolarHBondContact O-N 2.87Å; D247-R251 IonicContact OD1-CZ 2.77Å; D247-R251 IonicContact OD1-NE 2.71Å; D247-R251 PolarHBondContact OD1-NE 3.03Å; D247-R251 VanDerWaalsContact OD1-NE 3.09Å; D247-R251 IonicContact OD1-NH2 2.91Å; D247-R251 PolarHBondContact OD1-NH2 3.33Å; D247-R251 VanDerWaalsContact OD1-NH2 3.12Å; K248-R251 PolarHBondContact O-N 2.78Å; R251-K254 PolarHBondContact O-N 3.3Å; R251-I255 HydrophobicContact CB-CD1 4.5Å; R251-I255 WeakPolarHBondContact O-CB 3.43Å; R251-I255 WeakPolarHBondContact O-CD1 3.31Å; R251-I255 WeakPolarHBondContact O-CG1 3.46Å; R251-I255 PolarHBondContact O-N 2.74Å; R251-M2242 VanDerWaalsContact CZ-O 3.24Å; R251-M2242 PolarHBondContact NH1-O 2.75Å; R251-M2242 PolarHBondContact NH2-O 3.1Å; R251-V2243 VanDerWaalsContact NH2-CA 3.33Å
252	A	62.7	Low	63.8	Low	54 Å²	54	80.2 Å²	80.2	45%	0.446	40%	0.397	S	S	.	.	H	α-helix	trans	-57.6	-54.4	168.5	0	0	0	0	0	109.9	K248 K254 I255 E256	K248-A252 WeakPolarHBondContact O-CB 3.37Å; K248-A252 PolarHBondContact O-N 3.05Å; A252-K254 VanDerWaalsContact C-N 3.28Å; A252-K254 PolarHBondContact O-N 3.44Å; A252-I255 PolarHBondContact O-N 2.88Å; A252-E256 WeakPolarHBondContact O-CB 3.36Å; A252-E256 PolarHBondContact O-N 3.21Å
253	L	61.7	Low	64.3	Low	76 Å²	76	79.3 Å²	79.3	40%	0.398	39%	0.392	S	S	.	.	H	α-helix	trans	-65.3	-24.4	178	-69.9	171.1	0	0	0	114.2	S249 K257	S249-L253 WeakPolarHBondContact O-CB 3.16Å; S249-L253 VanDerWaalsContact O-CD1 3.3Å; S249-L253 WeakPolarHBondContact O-CD1 3.39Å; S249-L253 WeakPolarHBondContact O-CG 3.5Å; S249-L253 PolarHBondContact O-N 3.46Å; L253-K257 VanDerWaalsContact O-CB 3.28Å; L253-K257 WeakPolarHBondContact O-CB 3.5Å; L253-K257 WeakPolarHBondContact O-CD 3.41Å; L253-K257 WeakPolarHBondContact O-CG 3.43Å; L253-K257 PolarHBondContact O-N 3.04Å; L253-K257 VanDerWaalsContact O-N 3.17Å
254	K	68.3	Low	64.2	Low	68 Å²	68	83.1 Å²	83.1	30%	0.296	40%	0.404	S	S	.	.	H	α-helix	trans	-80.8	-44.7	173	-82.2	-178.3	174.5	-177.3	0	111.9	E250 R251 A252 E256 K257 E258	E250-K254 HydrophobicContact CG-CD 4.31Å; E250-K254 VanDerWaalsContact O-CB 3.23Å; E250-K254 WeakPolarHBondContact O-CB 3.37Å; E250-K254 VanDerWaalsContact O-CG 3.27Å; E250-K254 WeakPolarHBondContact O-CG 3.5Å; E250-K254 PolarHBondContact O-N 2.98Å; R251-K254 PolarHBondContact O-N 3.3Å; A252-K254 VanDerWaalsContact C-N 3.28Å; A252-K254 PolarHBondContact O-N 3.44Å; K254-E256 VanDerWaalsContact C-N 3.32Å; K254-E256 PolarHBondContact O-N 2.91Å; K254-K257 CarbonylContact O-C 3.55Å; K254-K257 PolarHBondContact O-N 2.89Å; K254-E258 VanDerWaalsContact O-CB 3.23Å; K254-E258 WeakPolarHBondContact O-CB 3.4Å; K254-E258 WeakPolarHBondContact O-CG 3.2Å; K254-E258 PolarHBondContact O-N 2.89Å
255	I	62.3	Low	64.6	Low	101 Å²	101	88.1 Å²	88.1	52%	0.518	42%	0.423	S	S	.	.	H	α-helix	trans	-59.7	-45.2	174	-69.9	163.8	0	0	0	109.4	R251 A252 E258 E259	R251-I255 HydrophobicContact CB-CD1 4.5Å; R251-I255 WeakPolarHBondContact O-CB 3.43Å; R251-I255 WeakPolarHBondContact O-CD1 3.31Å; R251-I255 WeakPolarHBondContact O-CG1 3.46Å; R251-I255 PolarHBondContact O-N 2.74Å; A252-I255 PolarHBondContact O-N 2.88Å; I255-E258 CarbonylContact O-C 3.57Å; I255-E258 PolarHBondContact O-N 3Å; I255-E259 VanDerWaalsContact O-CB 3.27Å; I255-E259 WeakPolarHBondContact O-CB 3.33Å; I255-E259 PolarHBondContact O-N 2.8Å
256	E	63	Low	64.9	Low	116 Å²	116	88.7 Å²	88.7	54%	0.542	42%	0.418	S	S	.	.	H	α-helix	trans	-62	-43.5	175.3	-175.2	-179.5	-166.2	0	0	112.3	A252 K254 E259 V260	A252-E256 WeakPolarHBondContact O-CB 3.36Å; A252-E256 PolarHBondContact O-N 3.21Å; K254-E256 VanDerWaalsContact C-N 3.32Å; K254-E256 PolarHBondContact O-N 2.91Å; E256-E259 WeakPolarHBondContact O-CB 3.19Å; E256-E259 PolarHBondContact O-N 2.83Å; E256-V260 WeakPolarHBondContact O-CB 3.33Å; E256-V260 WeakPolarHBondContact O-CG2 3.48Å; E256-V260 PolarHBondContact O-N 3.02Å
257	K	69.8	Low	65.4	Low	144 Å²	144	87.4 Å²	87.4	63%	0.626	42%	0.423	S	S	*	.	H	α-helix	trans	-67.1	-36.2	173.2	-76.8	173	-175.8	-175.8	0	112.7	L253 K254 V261	L253-K257 VanDerWaalsContact O-CB 3.28Å; L253-K257 WeakPolarHBondContact O-CB 3.5Å; L253-K257 WeakPolarHBondContact O-CD 3.41Å; L253-K257 WeakPolarHBondContact O-CG 3.43Å; L253-K257 PolarHBondContact O-N 3.04Å; L253-K257 VanDerWaalsContact O-N 3.17Å; K254-K257 CarbonylContact O-C 3.55Å; K254-K257 PolarHBondContact O-N 2.89Å; K257-V261 WeakPolarHBondContact O-CB 3.18Å; K257-V261 WeakPolarHBondContact O-CG2 3.48Å; K257-V261 PolarHBondContact O-N 3Å
258	E	65.9	Low	66	Low	98 Å²	98	89.5 Å²	89.5	46%	0.458	44%	0.441	S	S	.	.	H	α-helix	trans	-69.5	-34.5	175.1	-76	166.4	-150.2	0	0	111.1	K254 I255 V261 R262	K254-E258 VanDerWaalsContact O-CB 3.23Å; K254-E258 WeakPolarHBondContact O-CB 3.4Å; K254-E258 WeakPolarHBondContact O-CG 3.2Å; K254-E258 PolarHBondContact O-N 2.89Å; I255-E258 CarbonylContact O-C 3.57Å; I255-E258 PolarHBondContact O-N 3Å; E258-V261 CarbonylContact O-C 3.32Å; E258-V261 PolarHBondContact O-N 2.9Å; E258-R262 VanDerWaalsContact O-CB 3.25Å; E258-R262 WeakPolarHBondContact O-CB 3Å; E258-R262 PolarHBondContact O-N 3.24Å
259	E	66.5	Low	66.5	Low	71 Å²	71	84.5 Å²	84.5	33%	0.332	42%	0.42	S	S	.	.	H	α-helix	trans	-66.8	-52.6	173.2	-160.9	62	-118.4	0	0	110.3	I255 E256 V261 R262 I263	I255-E259 VanDerWaalsContact O-CB 3.27Å; I255-E259 WeakPolarHBondContact O-CB 3.33Å; I255-E259 PolarHBondContact O-N 2.8Å; E256-E259 WeakPolarHBondContact O-CB 3.19Å; E256-E259 PolarHBondContact O-N 2.83Å; E259-V261 VanDerWaalsContact C-N 3.25Å; E259-V261 PolarHBondContact O-N 2.86Å; E259-R262 CarbonylContact O-C 3.51Å; E259-R262 WeakPolarHBondContact O-CA 3.39Å; E259-R262 WeakPolarHBondContact O-CB 3.32Å; E259-R262 PolarHBondContact O-N 3.11Å; E259-R262 IonicContact OE1-CZ 3.56Å; E259-R262 IonicContact OE1-NH1 3.71Å; E259-R262 PolarHBondContact OE1-NH1 3.03Å; E259-R262 IonicContact OE1-NH2 3.5Å; E259-R262 IonicContact OE2-CZ 3.88Å; E259-R262 IonicContact OE2-NH1 3.91Å; E259-R262 PolarHBondContact OE2-NH1 3.3Å; E259-R262 IonicContact OE2-NH2 2.65Å; E259-R262 PolarHBondContact OE2-NH2 2.76Å; E259-I263 HydrophobicContact CG-CD1 4.29Å; E259-I263 WeakPolarHBondContact O-CG1 3.46Å; E259-I263 PolarHBondContact O-N 2.93Å
260	V	69.5	Low	67.3	Low	64 Å²	64	85 Å²	85	39%	0.388	42%	0.418	S	S	.	.	H	α-helix	trans	-60.2	-35.2	174.1	171.6	0	0	0	0	111.4	E256 R264	E256-V260 WeakPolarHBondContact O-CB 3.33Å; E256-V260 WeakPolarHBondContact O-CG2 3.48Å; E256-V260 PolarHBondContact O-N 3.02Å; V260-R264 VanDerWaalsContact O-CB 3.23Å; V260-R264 WeakPolarHBondContact O-CB 3.42Å; V260-R264 WeakPolarHBondContact O-CD 3.3Å; V260-R264 WeakPolarHBondContact O-CG 3.42Å; V260-R264 PolarHBondContact O-N 2.88Å
261	V	69.8	Low	68	Low	66 Å²	66	84.4 Å²	84.4	40%	0.4	42%	0.422	S	S	.	.	H	α-helix	trans	-73	-32.3	172.6	165.7	0	0	0	0	112.2	K257 E258 E259 K265	K257-V261 WeakPolarHBondContact O-CB 3.18Å; K257-V261 WeakPolarHBondContact O-CG2 3.48Å; K257-V261 PolarHBondContact O-N 3Å; E258-V261 CarbonylContact O-C 3.32Å; E258-V261 PolarHBondContact O-N 2.9Å; E259-V261 VanDerWaalsContact C-N 3.25Å; E259-V261 PolarHBondContact O-N 2.86Å; V261-K265 HydrophobicContact CG1-CD 4.09Å; V261-K265 HydrophobicContact CG1-CG 4.49Å; V261-K265 VanDerWaalsContact O-CB 3.32Å; V261-K265 WeakPolarHBondContact O-CB 3.32Å; V261-K265 WeakPolarHBondContact O-CG 3.28Å; V261-K265 PolarHBondContact O-N 2.88Å
262	R	69.7	Low	69.2	Low	132 Å²	132	82.4 Å²	82.4	50%	0.498	42%	0.415	S	S	.	.	H	α-helix	trans	-70.8	-47	176	-158.9	-172.6	-43.6	125.5	20.4	110.7	E258 E259 K265 M266	E258-R262 VanDerWaalsContact O-CB 3.25Å; E258-R262 WeakPolarHBondContact O-CB 3Å; E258-R262 PolarHBondContact O-N 3.24Å; E259-R262 CarbonylContact O-C 3.51Å; E259-R262 WeakPolarHBondContact O-CA 3.39Å; E259-R262 WeakPolarHBondContact O-CB 3.32Å; E259-R262 PolarHBondContact O-N 3.11Å; E259-R262 IonicContact OE1-CZ 3.56Å; E259-R262 IonicContact OE1-NH1 3.71Å; E259-R262 PolarHBondContact OE1-NH1 3.03Å; E259-R262 IonicContact OE1-NH2 3.5Å; E259-R262 IonicContact OE2-CZ 3.88Å; E259-R262 IonicContact OE2-NH1 3.91Å; E259-R262 PolarHBondContact OE2-NH1 3.3Å; E259-R262 IonicContact OE2-NH2 2.65Å; E259-R262 PolarHBondContact OE2-NH2 2.76Å; R262-K265 CarbonylContact O-C 2.78Å; R262-K265 WeakPolarHBondContact O-CB 3.43Å; R262-K265 PolarHBondContact O-N 2.97Å; R262-K265 VanDerWaalsContact O-N 3.15Å; R262-M266 WeakPolarHBondContact O-CB 3.39Å; R262-M266 PolarHBondContact O-N 2.87Å
263	I	73	Confident	69.6	Low	75 Å²	75	81.7 Å²	81.7	39%	0.385	40%	0.403	S	S	.	.	H	α-helix	trans	-59.6	-48.1	172.3	-64.3	167.2	0	0	0	109.8	E259 K265 M266 C267	E259-I263 HydrophobicContact CG-CD1 4.29Å; E259-I263 WeakPolarHBondContact O-CG1 3.46Å; E259-I263 PolarHBondContact O-N 2.93Å; I263-K265 VanDerWaalsContact C-N 3.3Å; I263-K265 PolarHBondContact O-N 2.85Å; I263-M266 CarbonylContact O-C 3.16Å; I263-M266 WeakPolarHBondContact O-CA 3.13Å; I263-M266 WeakPolarHBondContact O-CB 3.34Å; I263-M266 PolarHBondContact O-N 3.09Å; I263-C267 PolarHBondContact O-N 2.94Å; I263-C267 PolarHBondContact O-SG 3.17Å
264	R	67.2	Low	70.4	Confident	156 Å²	156	82 Å²	82	59%	0.589	40%	0.404	S	S	*	.	H	α-helix	trans	-60.2	-35.9	174.4	-75.5	172.3	-172.1	-162.8	4	113.1	V260 A268	V260-R264 VanDerWaalsContact O-CB 3.23Å; V260-R264 WeakPolarHBondContact O-CB 3.42Å; V260-R264 WeakPolarHBondContact O-CD 3.3Å; V260-R264 WeakPolarHBondContact O-CG 3.42Å; V260-R264 PolarHBondContact O-N 2.88Å; R264-A268 WeakPolarHBondContact O-CB 3.4Å; R264-A268 PolarHBondContact O-N 3.29Å
265	K	71.7	Confident	70.8	Confident	137 Å²	137	85.9 Å²	85.9	60%	0.596	42%	0.417	S	S	*	.	H	α-helix	trans	-68	-39.1	172.5	-79.3	170	179.9	178.1	0	111.5	V261 R262 I263 A268 F269	V261-K265 HydrophobicContact CG1-CD 4.09Å; V261-K265 HydrophobicContact CG1-CG 4.49Å; V261-K265 VanDerWaalsContact O-CB 3.32Å; V261-K265 WeakPolarHBondContact O-CB 3.32Å; V261-K265 WeakPolarHBondContact O-CG 3.28Å; V261-K265 PolarHBondContact O-N 2.88Å; R262-K265 CarbonylContact O-C 2.78Å; R262-K265 WeakPolarHBondContact O-CB 3.43Å; R262-K265 PolarHBondContact O-N 2.97Å; R262-K265 VanDerWaalsContact O-N 3.15Å; I263-K265 VanDerWaalsContact C-N 3.3Å; I263-K265 PolarHBondContact O-N 2.85Å; K265-A268 CarbonylContact O-C 3.03Å; K265-A268 PolarHBondContact O-N 2.78Å; K265-F269 VanDerWaalsContact O-CB 3.24Å; K265-F269 WeakPolarHBondContact O-CB 3.1Å; K265-F269 PolarHBondContact O-N 2.92Å
266	M	64	Low	71.4	Confident	95 Å²	95	82.7 Å²	82.7	47%	0.468	40%	0.401	S	S	.	.	H	α-helix	trans	-65.5	-51.4	176.6	-158.9	172.2	85.1	0	0	110.7	R262 I263 A268 F269 I270 T2424	R262-M266 WeakPolarHBondContact O-CB 3.39Å; R262-M266 PolarHBondContact O-N 2.87Å; I263-M266 CarbonylContact O-C 3.16Å; I263-M266 WeakPolarHBondContact O-CA 3.13Å; I263-M266 WeakPolarHBondContact O-CB 3.34Å; I263-M266 PolarHBondContact O-N 3.09Å; M266-A268 VanDerWaalsContact C-N 3.28Å; M266-A268 PolarHBondContact O-N 3.24Å; M266-F269 CarbonylContact O-C 3.54Å; M266-F269 WeakPolarHBondContact O-CA 3.47Å; M266-F269 WeakPolarHBondContact O-CB 3.36Å; M266-F269 PolarHBondContact O-N 3.21Å; M266-I270 HydrophobicContact CG-CD1 4.44Å; M266-I270 WeakPolarHBondContact O-CG1 3.09Å; M266-I270 PolarHBondContact O-N 2.89Å; M266-T2424 HydrophobicContact CG-CG2 3.64Å; M266-T2424 HydrophobicContact SD-CG2 4.18Å
267	C	72.7	Confident	72	Confident	67 Å²	67	79.2 Å²	79.2	45%	0.453	38%	0.383	S	S	.	.	H	α-helix	trans	-59.7	-35.7	172.6	-56.9	0	0	0	0	112.6	I263 A271	I263-C267 PolarHBondContact O-N 2.94Å; I263-C267 PolarHBondContact O-SG 3.17Å; C267-A271 VanDerWaalsContact O-CB 3.29Å; C267-A271 WeakPolarHBondContact O-CB 3.32Å; C267-A271 PolarHBondContact O-N 3Å
268	A	73.8	Confident	72.4	Confident	52 Å²	52	79.3 Å²	79.3	43%	0.43	38%	0.379	S	S	.	.	H	α-helix	trans	-73.6	-25.8	174.7	0	0	0	0	0	113.4	R264 K265 M266 K272	R264-A268 WeakPolarHBondContact O-CB 3.4Å; R264-A268 PolarHBondContact O-N 3.29Å; K265-A268 CarbonylContact O-C 3.03Å; K265-A268 PolarHBondContact O-N 2.78Å; M266-A268 VanDerWaalsContact C-N 3.28Å; M266-A268 PolarHBondContact O-N 3.24Å; A268-K272 PolarHBondContact O-N 3.34Å
269	F	72.9	Confident	72.9	Confident	35 Å²	35	81.8 Å²	81.8	15%	0.154	38%	0.384	C	S	.	.	H	α-helix	trans	-75.9	-43.6	172.9	-168.4	-147.8	0	0	0	110	K265 M266 A271 K272 M273 L1993 K1995 N2423 T2424	K265-F269 VanDerWaalsContact O-CB 3.24Å; K265-F269 WeakPolarHBondContact O-CB 3.1Å; K265-F269 PolarHBondContact O-N 2.92Å; M266-F269 CarbonylContact O-C 3.54Å; M266-F269 WeakPolarHBondContact O-CA 3.47Å; M266-F269 WeakPolarHBondContact O-CB 3.36Å; M266-F269 PolarHBondContact O-N 3.21Å; F269-A271 PolarHBondContact O-N 3.12Å; F269-K272 CarbonylContact O-C 3.35Å; F269-K272 VanDerWaalsContact O-CA 3.26Å; F269-K272 WeakPolarHBondContact O-CA 3.49Å; F269-K272 VanDerWaalsContact O-CB 3.29Å; F269-K272 WeakPolarHBondContact O-CB 3.49Å; F269-K272 PolarHBondContact O-N 3.4Å; F269-M273 WeakPolarHBondContact O-CG 3.47Å; F269-M273 PolarHBondContact O-N 3.07Å; F269-L1993 HydrophobicContact CD2-CD1 4.48Å; F269-L1993 HydrophobicContact CD2-CD2 3.34Å; F269-L1993 HydrophobicContact CE2-CD2 3.33Å; F269-L1993 HydrophobicContact CG-CD2 4.38Å; F269-L1993 HydrophobicContact CZ-CD2 4.36Å; F269-K1995 HydrophobicContact CE2-CD 3.91Å; F269-K1995 HydrophobicContact CE2-CG 4.03Å; F269-K1995 HydrophobicContact CZ-CD 3.8Å; F269-K1995 HydrophobicContact CZ-CG 3.7Å; F269-N2423 WeakPolarHBondContact CD1-O 3.48Å; F269-N2423 VanDerWaalsContact CD2-ND2 3.31Å; F269-N2423 WeakPolarHBondContact CD2-ND2 3.47Å; F269-N2423 HydrophobicContact CE1-CB 4.25Å; F269-N2423 HydrophobicContact CE2-CB 4.01Å; F269-N2423 WeakPolarHBondContact CE2-ND2 3.21Å; F269-N2423 HydrophobicContact CZ-CB 3.72Å; F269-T2424 HydrophobicContact CD1-CG2 4.36Å; F269-T2424 WeakPolarHBondContact CE1-OXT 3.23Å
270	I	74.2	Confident	73.2	Confident	61 Å²	61	82.7 Å²	82.7	31%	0.313	39%	0.389	S	S	.	.	H	α-helix	trans	-54.1	-48.5	166.5	-65.5	165.8	0	0	0	110.9	M266 K272 M273 I274 T2424	M266-I270 HydrophobicContact CG-CD1 4.44Å; M266-I270 WeakPolarHBondContact O-CG1 3.09Å; M266-I270 PolarHBondContact O-N 2.89Å; I270-K272 PolarHBondContact O-N 2.87Å; I270-M273 HydrophobicContact CB-SD 4.15Å; I270-M273 HydrophobicContact CG1-SD 3.9Å; I270-M273 HydrophobicContact CG2-SD 4.25Å; I270-M273 WeakPolarHBondContact O-CA 3.34Å; I270-M273 WeakPolarHBondContact O-CB 3.44Å; I270-M273 WeakPolarHBondContact O-CG 3.37Å; I270-M273 PolarHBondContact O-N 2.96Å; I270-I274 HydrophobicContact CG2-CD1 4.01Å; I270-I274 PolarHBondContact O-N 2.91Å; I270-I274 VanDerWaalsContact O-N 3.11Å; I270-T2424 WeakPolarHBondContact CG1-OG1 3.45Å
271	A	75.5	Confident	73.4	Confident	40 Å²	40	82 Å²	82	33%	0.331	38%	0.382	S	S	.	.	H	α-helix	trans	-68.8	-14.8	172.9	0	0	0	0	0	113.7	C267 F269 R275	C267-A271 VanDerWaalsContact O-CB 3.29Å; C267-A271 WeakPolarHBondContact O-CB 3.32Å; C267-A271 PolarHBondContact O-N 3Å; F269-A271 PolarHBondContact O-N 3.12Å; A271-R275 PolarHBondContact O-NE 3.03Å; A271-R275 PolarHBondContact O-NH2 3.08Å; A271-R275 VanDerWaalsContact O-NH2 3.16Å
272	K	78	Confident	73.8	Confident	23 Å²	23	82.8 Å²	82.8	10%	0.1	38%	0.384	C	S	.	.	H	α-helix	trans	-81.6	-39.3	164.3	-154.7	-151	178.2	-163.4	0	110.3	A268 F269 I270 I274 R275 D276 L1993 E1994	A268-K272 PolarHBondContact O-N 3.34Å; F269-K272 CarbonylContact O-C 3.35Å; F269-K272 VanDerWaalsContact O-CA 3.26Å; F269-K272 WeakPolarHBondContact O-CA 3.49Å; F269-K272 VanDerWaalsContact O-CB 3.29Å; F269-K272 WeakPolarHBondContact O-CB 3.49Å; F269-K272 PolarHBondContact O-N 3.4Å; I270-K272 PolarHBondContact O-N 2.87Å; K272-I274 VanDerWaalsContact C-N 3.34Å; K272-I274 PolarHBondContact O-N 2.82Å; K272-R275 PolarHBondContact O-N 3.1Å; K272-D276 VanDerWaalsContact CD-OD2 3.22Å; K272-D276 WeakPolarHBondContact CD-OD2 3.33Å; K272-D276 WeakPolarHBondContact CE-OD2 3.4Å; K272-D276 IonicContact NZ-OD2 3.81Å; K272-D276 PolarHBondContact NZ-OD2 3.49Å; K272-D276 WeakPolarHBondContact O-CB 3.42Å; K272-D276 PolarHBondContact O-N 3.43Å; K272-L1993 HydrophobicContact CD-CD1 4.36Å; K272-L1993 HydrophobicContact CD-CD2 4.5Å; K272-L1993 PolarHBondContact NZ-O 2.69Å; K272-E1994 IonicContact NZ-OE1 3.11Å; K272-E1994 PolarHBondContact NZ-OE1 3.11Å; K272-E1994 IonicContact NZ-OE2 2.77Å; K272-E1994 PolarHBondContact NZ-OE2 3.26Å
273	M	72.8	Confident	74	Confident	38 Å²	38	83 Å²	83	19%	0.187	39%	0.388	C	S	.	.	H	α-helix	trans	-47.5	-58.6	174.7	-52	176.9	55	0	0	110.6	F269 I270 R275 D276 W277 P2421 K2422 N2423	F269-M273 WeakPolarHBondContact O-CG 3.47Å; F269-M273 PolarHBondContact O-N 3.07Å; I270-M273 HydrophobicContact CB-SD 4.15Å; I270-M273 HydrophobicContact CG1-SD 3.9Å; I270-M273 HydrophobicContact CG2-SD 4.25Å; I270-M273 WeakPolarHBondContact O-CA 3.34Å; I270-M273 WeakPolarHBondContact O-CB 3.44Å; I270-M273 WeakPolarHBondContact O-CG 3.37Å; I270-M273 PolarHBondContact O-N 2.96Å; M273-R275 PolarHBondContact O-N 3.08Å; M273-D276 CarbonylContact O-C 3.21Å; M273-D276 PolarHBondContact O-N 3.36Å; M273-W277 WeakPolarHBondContact O-CB 3.33Å; M273-W277 PolarHBondContact O-N 3.03Å; M273-P2421 VanDerWaalsContact CE-O 3.32Å; M273-P2421 WeakPolarHBondContact CE-O 3.47Å; M273-K2422 WeakPolarHBondContact CA-O 3.43Å; M273-K2422 WeakPolarHBondContact CB-O 3.4Å; M273-K2422 WeakPolarHBondContact CG-O 3.35Å; M273-N2423 VanDerWaalsContact CG-C 3.41Å; M273-N2423 WeakPolarHBondContact CG-O 3.11Å; M273-N2423 VanDerWaalsContact SD-O 3.37Å
274	I	77.8	Confident	74.1	Confident	83 Å²	83	83.1 Å²	83.1	43%	0.426	39%	0.389	S	S	.	.	H	α-helix	trans	-67.4	-40.9	-168.9	-65.4	162.6	0	0	0	109.5	I270 K272 W277 W278	I270-I274 HydrophobicContact CG2-CD1 4.01Å; I270-I274 PolarHBondContact O-N 2.91Å; I270-I274 VanDerWaalsContact O-N 3.11Å; K272-I274 VanDerWaalsContact C-N 3.34Å; K272-I274 PolarHBondContact O-N 2.82Å; I274-W277 PolarHBondContact O-N 3.21Å; I274-W278 PolarHBondContact O-N 2.83Å
275	R	77.5	Confident	74.7	Confident	150 Å²	150	79.1 Å²	79.1	57%	0.566	38%	0.382	S	S	*	.	H	α-helix	trans	-72.9	-38.4	175.5	-73.9	-179.3	-65.6	177.9	-2.4	113.6	A271 K272 M273 W277 R279	A271-R275 PolarHBondContact O-NE 3.03Å; A271-R275 PolarHBondContact O-NH2 3.08Å; A271-R275 VanDerWaalsContact O-NH2 3.16Å; K272-R275 PolarHBondContact O-N 3.1Å; M273-R275 PolarHBondContact O-N 3.08Å; R275-W277 PolarHBondContact O-N 3.13Å; R275-R279 VanDerWaalsContact O-CB 3.3Å; R275-R279 WeakPolarHBondContact O-CB 3.37Å; R275-R279 WeakPolarHBondContact O-CG 2.97Å; R275-R279 PolarHBondContact O-N 3Å
276	D	74.5	Confident	74.8	Confident	34 Å²	34	78 Å²	78	18%	0.182	38%	0.379	C	S	.	.	H	α-helix	trans	-68.2	-25	173.9	-76.5	-5.9	0	0	0	110.9	K272 M273 Q280 K2422	K272-D276 VanDerWaalsContact CD-OD2 3.22Å; K272-D276 WeakPolarHBondContact CD-OD2 3.33Å; K272-D276 WeakPolarHBondContact CE-OD2 3.4Å; K272-D276 IonicContact NZ-OD2 3.81Å; K272-D276 PolarHBondContact NZ-OD2 3.49Å; K272-D276 WeakPolarHBondContact O-CB 3.42Å; K272-D276 PolarHBondContact O-N 3.43Å; M273-D276 CarbonylContact O-C 3.21Å; M273-D276 PolarHBondContact O-N 3.36Å; D276-Q280 WeakPolarHBondContact O-CB 3.4Å; D276-Q280 PolarHBondContact O-N 3.43Å; D276-K2422 PolarHBondContact O-NZ 3.04Å
277	W	76.1	Confident	75.2	Confident	43 Å²	43	75.7 Å²	75.7	16%	0.163	38%	0.375	C	S	.	.	H	α-helix	trans	-78.4	-51	169.9	177	55.2	0	0	0	113	M273 I274 R275 R279 Q280 M281 H2420 P2421 K2422	M273-W277 WeakPolarHBondContact O-CB 3.33Å; M273-W277 PolarHBondContact O-N 3.03Å; I274-W277 PolarHBondContact O-N 3.21Å; R275-W277 PolarHBondContact O-N 3.13Å; W277-R279 PolarHBondContact O-N 2.93Å; W277-Q280 CarbonylContact O-C 3.6Å; W277-Q280 WeakPolarHBondContact O-CA 3.3Å; W277-Q280 PolarHBondContact O-N 3.48Å; W277-M281 HydrophobicContact CD2-CG 4.17Å; W277-M281 VanDerWaalsContact CE2-CG 3.43Å; W277-M281 HydrophobicContact CG-CG 4.49Å; W277-M281 HydrophobicContact CZ2-CE 4.03Å; W277-M281 HydrophobicContact CZ2-CG 3.7Å; W277-M281 HydrophobicContact CZ2-SD 4.49Å; W277-M281 VanDerWaalsContact NE1-CG 3.26Å; W277-M281 PolarHBondContact O-N 3.41Å; W277-H2420 HydrophobicContact CD2-CB 4.48Å; W277-H2420 HydrophobicContact CZ2-CB 3.85Å; W277-P2421 HydrophobicContact CB-CG 3.62Å; W277-P2421 VanDerWaalsContact CD2-CD 3.43Å; W277-P2421 HydrophobicContact CD2-CG 4.16Å; W277-P2421 HydrophobicContact CG-CG 3.35Å; W277-K2422 HydrophobicContact CB-CD 4.42Å
278	W	76.8	Confident	75.5	Confident	145 Å²	145	79.3 Å²	79.3	55%	0.549	38%	0.383	S	S	.	.	H	α-helix	trans	-56.5	-40	176.6	-76.7	112	0	0	0	110	I274 Q280 M281 D282	I274-W278 PolarHBondContact O-N 2.83Å; W278-Q280 VanDerWaalsContact C-N 3.31Å; W278-Q280 PolarHBondContact O-N 3.21Å; W278-M281 CarbonylContact O-C 3.59Å; W278-M281 PolarHBondContact O-N 2.82Å; W278-D282 WeakPolarHBondContact O-CB 3.34Å; W278-D282 PolarHBondContact O-N 3.05Å
279	R	77.5	Confident	75.5	Confident	150 Å²	150	82 Å²	82	57%	0.566	39%	0.387	S	S	*	.	H	α-helix	trans	-63	-26.6	169	-76.2	-177	169.2	-155.6	-1.7	115.2	R275 W277 K283	R275-R279 VanDerWaalsContact O-CB 3.3Å; R275-R279 WeakPolarHBondContact O-CB 3.37Å; R275-R279 WeakPolarHBondContact O-CG 2.97Å; R275-R279 PolarHBondContact O-N 3Å; W277-R279 PolarHBondContact O-N 2.93Å; R279-K283 WeakPolarHBondContact O-CB 3.06Å; R279-K283 WeakPolarHBondContact O-CG 3.28Å; R279-K283 PolarHBondContact O-N 3.06Å
280	Q	72.7	Confident	75.6	Confident	91 Å²	91	86.5 Å²	86.5	43%	0.425	41%	0.408	S	S	.	.	H	α-helix	trans	-87.2	-30.5	176.4	-165	165	7.7	0	0	112.2	D276 W277 W278 K283 I284 K2422	D276-Q280 WeakPolarHBondContact O-CB 3.4Å; D276-Q280 PolarHBondContact O-N 3.43Å; W277-Q280 CarbonylContact O-C 3.6Å; W277-Q280 WeakPolarHBondContact O-CA 3.3Å; W277-Q280 PolarHBondContact O-N 3.48Å; W278-Q280 VanDerWaalsContact C-N 3.31Å; W278-Q280 PolarHBondContact O-N 3.21Å; Q280-K283 CarbonylContact O-C 3.48Å; Q280-K283 PolarHBondContact O-N 3.13Å; Q280-I284 HydrophobicContact CG-CD1 4.44Å; Q280-I284 WeakPolarHBondContact O-CB 3.31Å; Q280-I284 WeakPolarHBondContact O-CD1 3.2Å; Q280-I284 WeakPolarHBondContact O-CG1 3.39Å; Q280-I284 PolarHBondContact O-N 2.9Å; Q280-K2422 VanDerWaalsContact OE1-CD 3.28Å
281	M	73.9	Confident	75.6	Confident	50 Å²	50	88.1 Å²	88.1	25%	0.246	42%	0.42	C	S	.	.	H	α-helix	trans	-67.8	-41.8	165.2	-83.5	-65.9	162.3	0	0	110.7	W277 W278 K283 I284 V285	W277-M281 HydrophobicContact CD2-CG 4.17Å; W277-M281 VanDerWaalsContact CE2-CG 3.43Å; W277-M281 HydrophobicContact CG-CG 4.49Å; W277-M281 HydrophobicContact CZ2-CE 4.03Å; W277-M281 HydrophobicContact CZ2-CG 3.7Å; W277-M281 HydrophobicContact CZ2-SD 4.49Å; W277-M281 VanDerWaalsContact NE1-CG 3.26Å; W277-M281 PolarHBondContact O-N 3.41Å; W278-M281 CarbonylContact O-C 3.59Å; W278-M281 PolarHBondContact O-N 2.82Å; M281-K283 VanDerWaalsContact C-N 3.31Å; M281-K283 PolarHBondContact O-N 2.85Å; M281-I284 HydrophobicContact CE-CD1 4.44Å; M281-I284 CarbonylContact O-C 3.18Å; M281-I284 PolarHBondContact O-N 3.3Å; M281-I284 HydrophobicContact SD-CD1 4.5Å; M281-V285 VanDerWaalsContact O-CB 3.3Å; M281-V285 WeakPolarHBondContact O-CB 3.34Å; M281-V285 VanDerWaalsContact O-CG2 3.26Å; M281-V285 WeakPolarHBondContact O-CG2 3.23Å; M281-V285 PolarHBondContact O-N 2.73Å
282	D	76.9	Confident	75.5	Confident	82 Å²	82	94.9 Å²	94.9	44%	0.439	44%	0.437	S	S	.	.	H	α-helix	trans	-57.5	-44.8	168.9	-70.1	-31.4	0	0	0	110.3	W278 I284 V285 Q286	W278-D282 WeakPolarHBondContact O-CB 3.34Å; W278-D282 PolarHBondContact O-N 3.05Å; D282-I284 VanDerWaalsContact C-N 3.35Å; D282-I284 PolarHBondContact O-N 3.33Å; D282-V285 PolarHBondContact O-N 3.12Å; D282-Q286 WeakPolarHBondContact O-CA 3.45Å; D282-Q286 WeakPolarHBondContact O-CB 3.43Å; D282-Q286 WeakPolarHBondContact O-CG 3.31Å; D282-Q286 PolarHBondContact O-N 2.8Å
283	K	75.5	Confident	75.1	Confident	136 Å²	136	98.7 Å²	98.7	59%	0.591	46%	0.459	S	S	*	.	H	α-helix	trans	-65	-32.1	173.2	-78.2	-175.1	177	-165.3	0	113.5	R279 Q280 M281 A287	R279-K283 WeakPolarHBondContact O-CB 3.06Å; R279-K283 WeakPolarHBondContact O-CG 3.28Å; R279-K283 PolarHBondContact O-N 3.06Å; Q280-K283 CarbonylContact O-C 3.48Å; Q280-K283 PolarHBondContact O-N 3.13Å; M281-K283 VanDerWaalsContact C-N 3.31Å; M281-K283 PolarHBondContact O-N 2.85Å; K283-A287 WeakPolarHBondContact O-CB 3.26Å; K283-A287 PolarHBondContact O-N 2.72Å
284	I	74.5	Confident	75.2	Confident	77 Å²	77	99.6 Å²	99.6	40%	0.395	47%	0.466	S	S	.	.	H	α-helix	trans	-77.3	-33.7	175.7	-72	162.6	0	0	0	111.7	Q280 M281 D282 A287 K288	Q280-I284 HydrophobicContact CG-CD1 4.44Å; Q280-I284 WeakPolarHBondContact O-CB 3.31Å; Q280-I284 WeakPolarHBondContact O-CD1 3.2Å; Q280-I284 WeakPolarHBondContact O-CG1 3.39Å; Q280-I284 PolarHBondContact O-N 2.9Å; M281-I284 HydrophobicContact CE-CD1 4.44Å; M281-I284 CarbonylContact O-C 3.18Å; M281-I284 PolarHBondContact O-N 3.3Å; M281-I284 HydrophobicContact SD-CD1 4.5Å; D282-I284 VanDerWaalsContact C-N 3.35Å; D282-I284 PolarHBondContact O-N 3.33Å; I284-A287 PolarHBondContact O-N 3.34Å; I284-K288 WeakPolarHBondContact O-CB 3.25Å; I284-K288 PolarHBondContact O-N 3.19Å
285	V	79.7	Confident	75.2	Confident	73 Å²	73	97.5 Å²	97.5	44%	0.442	46%	0.461	S	S	.	.	H	α-helix	trans	-75	-43.1	175.8	169.1	0	0	0	0	109.7	M281 D282 K288 Q289	M281-V285 VanDerWaalsContact O-CB 3.3Å; M281-V285 WeakPolarHBondContact O-CB 3.34Å; M281-V285 VanDerWaalsContact O-CG2 3.26Å; M281-V285 WeakPolarHBondContact O-CG2 3.23Å; M281-V285 PolarHBondContact O-N 2.73Å; D282-V285 PolarHBondContact O-N 3.12Å; V285-K288 CarbonylContact O-C 3.22Å; V285-K288 PolarHBondContact O-N 3.34Å; V285-Q289 VanDerWaalsContact O-CB 3.27Å; V285-Q289 WeakPolarHBondContact O-CB 3.37Å; V285-Q289 VanDerWaalsContact O-CG 3.32Å; V285-Q289 WeakPolarHBondContact O-CG 3.19Å; V285-Q289 PolarHBondContact O-N 3.41Å
286	Q	74.3	Confident	75.2	Confident	113 Å²	113	97.3 Å²	97.3	53%	0.528	46%	0.464	S	S	.	.	H	α-helix	trans	-62.8	-40.1	168.2	-72.6	174.5	4.6	0	0	110.7	D282 Q289 Q290	D282-Q286 WeakPolarHBondContact O-CA 3.45Å; D282-Q286 WeakPolarHBondContact O-CB 3.43Å; D282-Q286 WeakPolarHBondContact O-CG 3.31Å; D282-Q286 PolarHBondContact O-N 2.8Å; Q286-Q289 PolarHBondContact O-N 3.42Å; Q286-Q290 WeakPolarHBondContact O-CA 3.43Å; Q286-Q290 WeakPolarHBondContact O-CB 3.19Å; Q286-Q290 PolarHBondContact O-N 3.02Å
287	A	72.6	Confident	75	Confident	47 Å²	47	104.3 Å²	104.3	39%	0.388	49%	0.488	S	S	.	.	H	α-helix	trans	-65.9	-40.4	172.6	0	0	0	0	0	112.1	K283 I284 Q290 V291	K283-A287 WeakPolarHBondContact O-CB 3.26Å; K283-A287 PolarHBondContact O-N 2.72Å; I284-A287 PolarHBondContact O-N 3.34Å; A287-Q290 PolarHBondContact O-N 3.32Å; A287-V291 VanDerWaalsContact O-CB 3.24Å; A287-V291 WeakPolarHBondContact O-CB 3.41Å; A287-V291 WeakPolarHBondContact O-CG2 3.38Å; A287-V291 PolarHBondContact O-N 3Å
288	K	77.6	Confident	74.8	Confident	142 Å²	142	108.5 Å²	108.5	62%	0.617	51%	0.509	S	S	*	.	H	α-helix	trans	-68.7	-35.1	173.6	-87	-176.5	172.4	176.4	0	112.6	I284 V285 R292	I284-K288 WeakPolarHBondContact O-CB 3.25Å; I284-K288 PolarHBondContact O-N 3.19Å; V285-K288 CarbonylContact O-C 3.22Å; V285-K288 PolarHBondContact O-N 3.34Å; K288-R292 VanDerWaalsContact O-CB 3.27Å; K288-R292 WeakPolarHBondContact O-CB 3.47Å; K288-R292 WeakPolarHBondContact O-CG 3.43Å; K288-R292 PolarHBondContact O-N 3.23Å
289	Q	74.4	Confident	74.6	Confident	110 Å²	110	107.9 Å²	107.9	51%	0.514	51%	0.513	S	S	.	.	H	α-helix	trans	-71.2	-40.8	173.1	-79.1	-178.3	-14.6	0	0	111	V285 Q286 R292 L293	V285-Q289 VanDerWaalsContact O-CB 3.27Å; V285-Q289 WeakPolarHBondContact O-CB 3.37Å; V285-Q289 VanDerWaalsContact O-CG 3.32Å; V285-Q289 WeakPolarHBondContact O-CG 3.19Å; V285-Q289 PolarHBondContact O-N 3.41Å; Q286-Q289 PolarHBondContact O-N 3.42Å; Q289-R292 CarbonylContact O-C 3.41Å; Q289-R292 PolarHBondContact O-N 3.18Å; Q289-L293 VanDerWaalsContact O-CB 3.27Å; Q289-L293 WeakPolarHBondContact O-CB 3.35Å; Q289-L293 VanDerWaalsContact O-CG 3.22Å; Q289-L293 WeakPolarHBondContact O-CG 3.38Å; Q289-L293 PolarHBondContact O-N 3.12Å
290	Q	74.6	Confident	74.4	Confident	129 Å²	129	103.5 Å²	103.5	60%	0.603	51%	0.509	S	S	*	.	H	α-helix	trans	-70.8	-37.4	177.2	-171.1	169.2	1.8	0	0	110.6	Q286 A287 L293 T294	Q286-Q290 WeakPolarHBondContact O-CA 3.43Å; Q286-Q290 WeakPolarHBondContact O-CB 3.19Å; Q286-Q290 PolarHBondContact O-N 3.02Å; A287-Q290 PolarHBondContact O-N 3.32Å; Q290-L293 CarbonylContact O-C 3.53Å; Q290-L293 PolarHBondContact O-N 3.34Å; Q290-T294 HydrophobicContact CG-CG2 4.32Å; Q290-T294 WeakPolarHBondContact O-CB 3.33Å; Q290-T294 VanDerWaalsContact O-CG2 3.31Å; Q290-T294 WeakPolarHBondContact O-CG2 3.32Å; Q290-T294 PolarHBondContact O-N 2.94Å; Q290-T294 PolarHBondContact O-OG1 3.12Å
291	V	75.4	Confident	74.2	Confident	94 Å²	94	104.1 Å²	104.1	57%	0.57	51%	0.514	S	S	*	.	H	α-helix	trans	-65.6	-39.3	168	167.5	0	0	0	0	111	A287 L293 T294 A295	A287-V291 VanDerWaalsContact O-CB 3.24Å; A287-V291 WeakPolarHBondContact O-CB 3.41Å; A287-V291 WeakPolarHBondContact O-CG2 3.38Å; A287-V291 PolarHBondContact O-N 3Å; V291-L293 VanDerWaalsContact C-N 3.34Å; V291-L293 PolarHBondContact O-N 3.38Å; V291-T294 WeakPolarHBondContact CA-OG1 3.47Å; V291-T294 PolarHBondContact O-OG1 3.35Å; V291-A295 WeakPolarHBondContact O-CA 3.48Å; V291-A295 WeakPolarHBondContact O-CB 3.37Å; V291-A295 PolarHBondContact O-N 2.84Å
292	R	73.4	Confident	73.9	Confident	182 Å²	182	105.3 Å²	105.3	69%	0.687	53%	0.527	S	S	*	.	H	α-helix	trans	-66.7	-33.2	171.9	-78.8	170.9	170.5	-179.8	-3.5	112.6	K288 Q289 K296	K288-R292 VanDerWaalsContact O-CB 3.27Å; K288-R292 WeakPolarHBondContact O-CB 3.47Å; K288-R292 WeakPolarHBondContact O-CG 3.43Å; K288-R292 PolarHBondContact O-N 3.23Å; Q289-R292 CarbonylContact O-C 3.41Å; Q289-R292 PolarHBondContact O-N 3.18Å; R292-K296 VanDerWaalsContact O-CB 3.24Å; R292-K296 WeakPolarHBondContact O-CB 3.47Å; R292-K296 VanDerWaalsContact O-CG 3.26Å; R292-K296 WeakPolarHBondContact O-CG 3.36Å; R292-K296 PolarHBondContact O-N 2.8Å
293	L	69.7	Low	73.7	Confident	104 Å²	104	104.8 Å²	104.8	55%	0.545	53%	0.53	S	S	.	.	H	α-helix	trans	-81.8	-32.9	178	-75.2	168.9	0	0	0	112.3	Q289 Q290 V291 R297	Q289-L293 VanDerWaalsContact O-CB 3.27Å; Q289-L293 WeakPolarHBondContact O-CB 3.35Å; Q289-L293 VanDerWaalsContact O-CG 3.22Å; Q289-L293 WeakPolarHBondContact O-CG 3.38Å; Q289-L293 PolarHBondContact O-N 3.12Å; Q290-L293 CarbonylContact O-C 3.53Å; Q290-L293 PolarHBondContact O-N 3.34Å; V291-L293 VanDerWaalsContact C-N 3.34Å; V291-L293 PolarHBondContact O-N 3.38Å; L293-R297 WeakPolarHBondContact O-CB 3.26Å; L293-R297 WeakPolarHBondContact O-CG 3.47Å; L293-R297 PolarHBondContact O-N 2.69Å
294	T	73.1	Confident	73.6	Confident	57 Å²	57	103.9 Å²	103.9	35%	0.35	53%	0.528	S	S	.	.	H	α-helix	trans	-77.7	-34.1	171.6	57.9	0	0	0	0	110.7	Q290 V291 R297 Q298	Q290-T294 HydrophobicContact CG-CG2 4.32Å; Q290-T294 WeakPolarHBondContact O-CB 3.33Å; Q290-T294 VanDerWaalsContact O-CG2 3.31Å; Q290-T294 WeakPolarHBondContact O-CG2 3.32Å; Q290-T294 PolarHBondContact O-N 2.94Å; Q290-T294 PolarHBondContact O-OG1 3.12Å; V291-T294 WeakPolarHBondContact CA-OG1 3.47Å; V291-T294 PolarHBondContact O-OG1 3.35Å; T294-R297 CarbonylContact O-C 3.58Å; T294-R297 PolarHBondContact O-N 2.83Å; T294-Q298 WeakPolarHBondContact O-CA 3.21Å; T294-Q298 WeakPolarHBondContact O-CB 3.27Å; T294-Q298 WeakPolarHBondContact O-CG 3.48Å; T294-Q298 PolarHBondContact O-N 3.1Å
295	A	78.5	Confident	73.1	Confident	38 Å²	38	104.8 Å²	104.8	31%	0.314	53%	0.533	S	S	.	.	H	α-helix	trans	-65.7	-43.9	168.4	0	0	0	0	0	110.9	V291 Q298 Q299	V291-A295 WeakPolarHBondContact O-CA 3.48Å; V291-A295 WeakPolarHBondContact O-CB 3.37Å; V291-A295 PolarHBondContact O-N 2.84Å; A295-Q298 CarbonylContact O-C 3.24Å; A295-Q298 PolarHBondContact O-N 2.94Å; A295-Q299 WeakPolarHBondContact O-CB 3.21Å; A295-Q299 WeakPolarHBondContact O-CG 3.47Å; A295-Q299 PolarHBondContact O-N 2.69Å
296	K	78	Confident	72.9	Confident	146 Å²	146	102.5 Å²	102.5	64%	0.635	52%	0.524	S	S	*	.	H	α-helix	trans	-64.7	-38	171.8	-80.3	-176.7	174.8	-169.5	0	112.7	R292 A300	R292-K296 VanDerWaalsContact O-CB 3.24Å; R292-K296 WeakPolarHBondContact O-CB 3.47Å; R292-K296 VanDerWaalsContact O-CG 3.26Å; R292-K296 WeakPolarHBondContact O-CG 3.36Å; R292-K296 PolarHBondContact O-N 2.8Å; K296-A300 VanDerWaalsContact O-CB 3.23Å; K296-A300 WeakPolarHBondContact O-CB 3.43Å; K296-A300 PolarHBondContact O-N 3.06Å
297	R	70.2	Confident	73	Confident	181 Å²	181	102.3 Å²	102.3	68%	0.683	52%	0.523	S	S	*	.	H	α-helix	trans	-69.1	-34.5	172.3	-79	175.2	177.2	-175.8	-0	111.8	L293 T294 A300 I301	L293-R297 WeakPolarHBondContact O-CB 3.26Å; L293-R297 WeakPolarHBondContact O-CG 3.47Å; L293-R297 PolarHBondContact O-N 2.69Å; T294-R297 CarbonylContact O-C 3.58Å; T294-R297 PolarHBondContact O-N 2.83Å; R297-A300 PolarHBondContact O-N 2.96Å; R297-I301 WeakPolarHBondContact O-CA 3.35Å; R297-I301 WeakPolarHBondContact O-CB 3.25Å; R297-I301 WeakPolarHBondContact O-CD1 3.25Å; R297-I301 WeakPolarHBondContact O-CG1 3.2Å; R297-I301 PolarHBondContact O-N 3.14Å
298	Q	72.4	Confident	73	Confident	131 Å²	131	102.9 Å²	102.9	61%	0.612	52%	0.521	S	S	*	.	H	α-helix	trans	-74.3	-32.9	175.7	-80.7	174	-24	0	0	111.4	T294 A295 S302	T294-Q298 WeakPolarHBondContact O-CA 3.21Å; T294-Q298 WeakPolarHBondContact O-CB 3.27Å; T294-Q298 WeakPolarHBondContact O-CG 3.48Å; T294-Q298 PolarHBondContact O-N 3.1Å; A295-Q298 CarbonylContact O-C 3.24Å; A295-Q298 PolarHBondContact O-N 2.94Å; Q298-S302 WeakPolarHBondContact O-CA 3.48Å; Q298-S302 WeakPolarHBondContact O-CB 3.47Å; Q298-S302 PolarHBondContact O-N 3.07Å; Q298-S302 PolarHBondContact O-OG 2.94Å; Q298-S302 VanDerWaalsContact O-OG 3.07Å
299	Q	72.3	Confident	72.7	Confident	132 Å²	132	100.8 Å²	100.8	62%	0.617	52%	0.516	S	S	*	.	H	α-helix	trans	-71.2	-39.1	169.2	-75.7	177.7	-25	0	0	111.5	A295 S302 S303	A295-Q299 WeakPolarHBondContact O-CB 3.21Å; A295-Q299 WeakPolarHBondContact O-CG 3.47Å; A295-Q299 PolarHBondContact O-N 2.69Å; Q299-S302 WeakPolarHBondContact CA-OG 3.45Å; Q299-S302 PolarHBondContact O-OG 3.15Å; Q299-S303 WeakPolarHBondContact O-CB 3.16Å; Q299-S303 PolarHBondContact O-N 3.08Å
300	A	72.1	Confident	72.5	Confident	59 Å²	59	101.5 Å²	101.5	49%	0.488	52%	0.52	S	S	.	.	H	α-helix	trans	-67.8	-38.8	172.5	0	0	0	0	0	111.6	K296 R297 H304	K296-A300 VanDerWaalsContact O-CB 3.23Å; K296-A300 WeakPolarHBondContact O-CB 3.43Å; K296-A300 PolarHBondContact O-N 3.06Å; R297-A300 PolarHBondContact O-N 2.96Å; A300-H304 WeakPolarHBondContact O-CB 3.33Å; A300-H304 PolarHBondContact O-N 2.9Å
301	I	69	Low	72.3	Confident	104 Å²	104	98 Å²	98	53%	0.533	51%	0.508	S	S	.	.	H	α-helix	trans	-73.3	-35	174.8	-71.9	163.6	0	0	0	110.7	R297 L305	R297-I301 WeakPolarHBondContact O-CA 3.35Å; R297-I301 WeakPolarHBondContact O-CB 3.25Å; R297-I301 WeakPolarHBondContact O-CD1 3.25Å; R297-I301 WeakPolarHBondContact O-CG1 3.2Å; R297-I301 PolarHBondContact O-N 3.14Å; I301-L305 WeakPolarHBondContact O-CA 3.35Å; I301-L305 WeakPolarHBondContact O-CB 3.22Å; I301-L305 PolarHBondContact O-N 3.31Å
302	S	68.1	Low	72	Confident	74 Å²	74	96.4 Å²	96.4	52%	0.517	50%	0.498	S	S	.	.	H	α-helix	trans	-79.4	-24.3	175.7	73.4	0	0	0	0	112.3	Q298 Q299 G306	Q298-S302 WeakPolarHBondContact O-CA 3.48Å; Q298-S302 WeakPolarHBondContact O-CB 3.47Å; Q298-S302 PolarHBondContact O-N 3.07Å; Q298-S302 PolarHBondContact O-OG 2.94Å; Q298-S302 VanDerWaalsContact O-OG 3.07Å; Q299-S302 WeakPolarHBondContact CA-OG 3.45Å; Q299-S302 PolarHBondContact O-OG 3.15Å; S302-G306 WeakPolarHBondContact O-CA 3.44Å; S302-G306 PolarHBondContact O-N 3.31Å
303	S	72.2	Confident	72	Confident	71 Å²	71	92.5 Å²	92.5	50%	0.497	49%	0.487	S	S	.	.	H	α-helix	trans	-75.9	-41.1	168.5	-176.1	0	0	0	0	111	Q299 G306 Q307	Q299-S303 WeakPolarHBondContact O-CB 3.16Å; Q299-S303 PolarHBondContact O-N 3.08Å; S303-G306 CarbonylContact O-C 3.46Å; S303-G306 PolarHBondContact O-N 3.23Å; S303-Q307 WeakPolarHBondContact O-CB 3.47Å; S303-Q307 WeakPolarHBondContact O-CG 3.46Å; S303-Q307 PolarHBondContact O-N 3.19Å
304	H	73.4	Confident	72.1	Confident	118 Å²	118	93.1 Å²	93.1	55%	0.546	49%	0.487	S	S	.	.	H	α-helix	trans	-75.3	-39.9	176.5	-176.6	52.9	0	0	0	112.6	A300 G306 Q307 V308	A300-H304 WeakPolarHBondContact O-CB 3.33Å; A300-H304 PolarHBondContact O-N 2.9Å; H304-G306 VanDerWaalsContact C-N 3.3Å; H304-Q307 CarbonylContact O-C 3.57Å; H304-Q307 PolarHBondContact O-N 3Å; H304-V308 WeakPolarHBondContact O-CB 3.46Å; H304-V308 VanDerWaalsContact O-CG2 3.26Å; H304-V308 WeakPolarHBondContact O-CG2 3.39Å; H304-V308 PolarHBondContact O-N 3Å
305	L	65	Low	71.6	Confident	95 Å²	95	97.4 Å²	97.4	50%	0.497	50%	0.498	S	S	.	.	H	α-helix	trans	-74.8	-23.7	171.4	-166	141.2	0	0	0	111	I301 L309	I301-L305 WeakPolarHBondContact O-CA 3.35Å; I301-L305 WeakPolarHBondContact O-CB 3.22Å; I301-L305 PolarHBondContact O-N 3.31Å; L305-L309 HydrophobicContact CD2-CD1 3.64Å; L305-L309 HydrophobicContact CD2-CG 4.02Å; L305-L309 WeakPolarHBondContact O-CB 3.4Å; L305-L309 WeakPolarHBondContact O-CG 3.36Å; L305-L309 PolarHBondContact O-N 3.43Å
306	G	75.4	Confident	71.2	Confident	25 Å²	25	99.4 Å²	99.4	26%	0.258	51%	0.507	S	S	.	.	H	α-helix	trans	-61.9	-53.7	161.6	0	0	0	0	0	110.7	S302 S303 H304 V308 L309 E310	S302-G306 WeakPolarHBondContact O-CA 3.44Å; S302-G306 PolarHBondContact O-N 3.31Å; S303-G306 CarbonylContact O-C 3.46Å; S303-G306 PolarHBondContact O-N 3.23Å; H304-G306 VanDerWaalsContact C-N 3.3Å; G306-V308 VanDerWaalsContact C-N 3.32Å; G306-V308 PolarHBondContact O-N 3.09Å; G306-L309 CarbonylContact O-C 3.58Å; G306-L309 PolarHBondContact O-N 2.9Å; G306-L309 VanDerWaalsContact O-N 3.14Å; G306-E310 WeakPolarHBondContact O-CB 3.05Å; G306-E310 WeakPolarHBondContact O-CG 3.27Å; G306-E310 PolarHBondContact O-N 3.28Å
307	Q	74.9	Confident	70.7	Confident	109 Å²	109	98.3 Å²	98.3	51%	0.509	50%	0.499	S	S	.	.	H	α-helix	trans	-64.7	-29.7	174.6	-76	-179.9	-24.6	0	0	113.7	S303 H304 T311	S303-Q307 WeakPolarHBondContact O-CB 3.47Å; S303-Q307 WeakPolarHBondContact O-CG 3.46Å; S303-Q307 PolarHBondContact O-N 3.19Å; H304-Q307 CarbonylContact O-C 3.57Å; H304-Q307 PolarHBondContact O-N 3Å; Q307-T311 VanDerWaalsContact O-CB 3.31Å; Q307-T311 WeakPolarHBondContact O-CB 3.49Å; Q307-T311 VanDerWaalsContact O-CG2 3.31Å; Q307-T311 WeakPolarHBondContact O-CG2 3.33Å; Q307-T311 PolarHBondContact O-N 2.96Å; Q307-T311 PolarHBondContact O-OG1 3.34Å
308	V	73.7	Confident	70.3	Confident	59 Å²	59	98.7 Å²	98.7	36%	0.358	50%	0.5	S	S	.	.	H	α-helix	trans	-78.1	-31.4	173.1	169.8	0	0	0	0	110.5	H304 G306 T311 T312	H304-V308 WeakPolarHBondContact O-CB 3.46Å; H304-V308 VanDerWaalsContact O-CG2 3.26Å; H304-V308 WeakPolarHBondContact O-CG2 3.39Å; H304-V308 PolarHBondContact O-N 3Å; G306-V308 VanDerWaalsContact C-N 3.32Å; G306-V308 PolarHBondContact O-N 3.09Å; V308-T311 WeakPolarHBondContact CA-OG1 3.48Å; V308-T312 HydrophobicContact CG1-CG2 4.26Å; V308-T312 WeakPolarHBondContact O-CA 3.47Å; V308-T312 WeakPolarHBondContact O-CB 3.43Å; V308-T312 WeakPolarHBondContact O-CG2 3.27Å; V308-T312 PolarHBondContact O-N 3.01Å; V308-T312 PolarHBondContact O-OG1 3.03Å
309	L	70.3	Confident	69	Low	98 Å²	98	97.8 Å²	97.8	51%	0.513	50%	0.499	S	S	.	.	H	α-helix	trans	-74	-35.3	169	-77.4	174.5	0	0	0	112	L305 G306 T312 E313	L305-L309 HydrophobicContact CD2-CD1 3.64Å; L305-L309 HydrophobicContact CD2-CG 4.02Å; L305-L309 WeakPolarHBondContact O-CB 3.4Å; L305-L309 WeakPolarHBondContact O-CG 3.36Å; L305-L309 PolarHBondContact O-N 3.43Å; G306-L309 CarbonylContact O-C 3.58Å; G306-L309 PolarHBondContact O-N 2.9Å; G306-L309 VanDerWaalsContact O-N 3.14Å; L309-T312 WeakPolarHBondContact CA-OG1 3.41Å; L309-E313 WeakPolarHBondContact O-CA 3.34Å; L309-E313 WeakPolarHBondContact O-CB 3.47Å; L309-E313 WeakPolarHBondContact O-CG 3.39Å; L309-E313 PolarHBondContact O-N 2.88Å
310	E	70.1	Confident	68.3	Low	126 Å²	126	95.3 Å²	95.3	59%	0.589	49%	0.493	S	S	*	.	H	α-helix	trans	-67.9	-49.3	172.4	-75	177.8	153	0	0	110.1	G306 T312 E313 E314	G306-E310 WeakPolarHBondContact O-CB 3.05Å; G306-E310 WeakPolarHBondContact O-CG 3.27Å; G306-E310 PolarHBondContact O-N 3.28Å; E310-T312 PolarHBondContact O-N 3.06Å; E310-E313 CarbonylContact O-C 3.16Å; E310-E313 PolarHBondContact O-N 2.88Å; E310-E314 WeakPolarHBondContact O-CB 3.32Å; E310-E314 WeakPolarHBondContact O-CG 3.41Å; E310-E314 PolarHBondContact O-N 3.06Å
311	T	70.7	Confident	67.4	Low	56 Å²	56	97.7 Å²	97.7	34%	0.344	49%	0.494	S	S	.	.	H	α-helix	trans	-69.8	-30.7	176.5	54.3	0	0	0	0	112.9	Q307 V308 E314 Y315	Q307-T311 VanDerWaalsContact O-CB 3.31Å; Q307-T311 WeakPolarHBondContact O-CB 3.49Å; Q307-T311 VanDerWaalsContact O-CG2 3.31Å; Q307-T311 WeakPolarHBondContact O-CG2 3.33Å; Q307-T311 PolarHBondContact O-N 2.96Å; Q307-T311 PolarHBondContact O-OG1 3.34Å; V308-T311 WeakPolarHBondContact CA-OG1 3.48Å; T311-E314 PolarHBondContact O-N 2.97Å; T311-Y315 WeakPolarHBondContact O-CB 3.25Å; T311-Y315 WeakPolarHBondContact O-CD2 3.22Å; T311-Y315 PolarHBondContact O-N 2.98Å
312	T	70.4	Confident	66.6	Low	59 Å²	59	95.3 Å²	95.3	36%	0.362	50%	0.495	S	S	.	.	H	α-helix	trans	-79.6	-22.4	170.2	59.3	0	0	0	0	113.3	V308 L309 E310 T316	V308-T312 HydrophobicContact CG1-CG2 4.26Å; V308-T312 WeakPolarHBondContact O-CA 3.47Å; V308-T312 WeakPolarHBondContact O-CB 3.43Å; V308-T312 WeakPolarHBondContact O-CG2 3.27Å; V308-T312 PolarHBondContact O-N 3.01Å; V308-T312 PolarHBondContact O-OG1 3.03Å; L309-T312 WeakPolarHBondContact CA-OG1 3.41Å; E310-T312 PolarHBondContact O-N 3.06Å; T312-T316 WeakPolarHBondContact O-CA 3.48Å; T312-T316 WeakPolarHBondContact O-CB 3.31Å; T312-T316 PolarHBondContact O-N 3.33Å; T312-T316 PolarHBondContact O-OG1 3.08Å
313	E	72.9	Confident	65.4	Low	100 Å²	100	98.6 Å²	98.6	47%	0.467	51%	0.505	S	S	.	.	H	α-helix	trans	-71.9	-34.1	162.8	-86.8	-157.7	175.9	0	0	111.1	L309 E310 T316 R317	L309-E313 WeakPolarHBondContact O-CA 3.34Å; L309-E313 WeakPolarHBondContact O-CB 3.47Å; L309-E313 WeakPolarHBondContact O-CG 3.39Å; L309-E313 PolarHBondContact O-N 2.88Å; E310-E313 CarbonylContact O-C 3.16Å; E310-E313 PolarHBondContact O-N 2.88Å; E313-T316 PolarHBondContact O-N 2.73Å; E313-R317 VanDerWaalsContact O-CB 3.23Å; E313-R317 WeakPolarHBondContact O-CB 3.46Å; E313-R317 VanDerWaalsContact O-CG 3.23Å; E313-R317 WeakPolarHBondContact O-CG 3.46Å; E313-R317 PolarHBondContact O-N 2.66Å; E313-R317 IonicContact OE2-CZ 3.45Å; E313-R317 IonicContact OE2-NH1 2.72Å; E313-R317 PolarHBondContact OE2-NH1 3.24Å; E313-R317 IonicContact OE2-NH2 3.74Å; E313-R317 PolarHBondContact OE2-NH2 3.05Å
314	E	71.4	Confident	63.9	Low	117 Å²	117	100.8 Å²	100.8	55%	0.547	52%	0.516	S	S	.	.	H	α-helix	trans	-68	-44.4	171.7	-75.1	-179.6	155.4	0	0	110.4	E310 T311 T316 R317 W318	E310-E314 WeakPolarHBondContact O-CB 3.32Å; E310-E314 WeakPolarHBondContact O-CG 3.41Å; E310-E314 PolarHBondContact O-N 3.06Å; T311-E314 PolarHBondContact O-N 2.97Å; E314-T316 VanDerWaalsContact C-N 3.33Å; E314-T316 PolarHBondContact O-N 2.79Å; E314-R317 PolarHBondContact O-N 3.04Å; E314-W318 VanDerWaalsContact O-CB 3.28Å; E314-W318 WeakPolarHBondContact O-CB 3.43Å; E314-W318 PolarHBondContact O-N 2.84Å
315	Y	63.6	Low	61.9	Low	148 Å²	148	99.2 Å²	99.2	58%	0.58	52%	0.518	S	S	*	.	H	α-helix	trans	-64.7	-34.2	170.8	-72	-57.9	0	0	0	112.1	T311 L319	T311-Y315 WeakPolarHBondContact O-CB 3.25Å; T311-Y315 WeakPolarHBondContact O-CD2 3.22Å; T311-Y315 PolarHBondContact O-N 2.98Å; Y315-L319 WeakPolarHBondContact O-CB 3.22Å; Y315-L319 WeakPolarHBondContact O-CD1 3Å; Y315-L319 WeakPolarHBondContact O-CG 3.28Å; Y315-L319 PolarHBondContact O-N 3.49Å
316	T	69.2	Low	60.2	Low	79 Å²	79	100.3 Å²	100.3	49%	0.485	53%	0.534	S	S	.	.	H	α-helix	trans	-74.1	-39.4	176.4	-61.6	0	0	0	0	111.3	T312 E313 E314 L319 T320	T312-T316 WeakPolarHBondContact O-CA 3.48Å; T312-T316 WeakPolarHBondContact O-CB 3.31Å; T312-T316 PolarHBondContact O-N 3.33Å; T312-T316 PolarHBondContact O-OG1 3.08Å; E313-T316 PolarHBondContact O-N 2.73Å; E314-T316 VanDerWaalsContact C-N 3.33Å; E314-T316 PolarHBondContact O-N 2.79Å; T316-L319 PolarHBondContact O-N 3.22Å; T316-T320 WeakPolarHBondContact O-CG2 3.42Å; T316-T320 PolarHBondContact O-N 2.84Å; T316-T320 PolarHBondContact O-OG1 2.81Å
317	R	66.6	Low	58	Low	124 Å²	124	109 Å²	109	47%	0.468	56%	0.564	S	S	.	*	H	α-helix	trans	-59.1	-52.3	168.9	-78.1	179.1	-175.3	98.4	15.4	109.5	E313 E314 L319 T320 E321	E313-R317 VanDerWaalsContact O-CB 3.23Å; E313-R317 WeakPolarHBondContact O-CB 3.46Å; E313-R317 VanDerWaalsContact O-CG 3.23Å; E313-R317 WeakPolarHBondContact O-CG 3.46Å; E313-R317 PolarHBondContact O-N 2.66Å; E313-R317 IonicContact OE2-CZ 3.45Å; E313-R317 IonicContact OE2-NH1 2.72Å; E313-R317 PolarHBondContact OE2-NH1 3.24Å; E313-R317 IonicContact OE2-NH2 3.74Å; E313-R317 PolarHBondContact OE2-NH2 3.05Å; E314-R317 PolarHBondContact O-N 3.04Å; R317-L319 VanDerWaalsContact C-N 3.27Å; R317-L319 PolarHBondContact O-N 2.89Å; R317-T320 WeakPolarHBondContact CA-OG1 3.42Å; R317-T320 CarbonylContact O-C 3.49Å; R317-T320 PolarHBondContact O-N 2.86Å; R317-T320 PolarHBondContact O-OG1 2.83Å; R317-E321 WeakPolarHBondContact O-CB 3.48Å; R317-E321 WeakPolarHBondContact O-CG 3.17Å; R317-E321 PolarHBondContact O-N 2.98Å
318	W	62.2	Low	55.6	Low	188 Å²	188	109 Å²	109	71%	0.712	57%	0.574	S	S	*	*	H	α-helix	trans	-55.2	-36.8	172.7	-90.6	33.4	0	0	0	113.6	E314 G322	E314-W318 VanDerWaalsContact O-CB 3.28Å; E314-W318 WeakPolarHBondContact O-CB 3.43Å; E314-W318 PolarHBondContact O-N 2.84Å; W318-G322 VanDerWaalsContact O-CA 3.25Å; W318-G322 WeakPolarHBondContact O-CA 3.43Å; W318-G322 PolarHBondContact O-N 3.08Å
319	L	45.9	Very low	53.2	Low	112 Å²	112	112.3 Å²	112.3	59%	0.586	59%	0.586	S	S	*	*	H	α-helix	trans	-69.3	-40.3	174.4	-76.9	164.1	0	0	0	111.4	Y315 T316 R317 I323	Y315-L319 WeakPolarHBondContact O-CB 3.22Å; Y315-L319 WeakPolarHBondContact O-CD1 3Å; Y315-L319 WeakPolarHBondContact O-CG 3.28Å; Y315-L319 PolarHBondContact O-N 3.49Å; T316-L319 PolarHBondContact O-N 3.22Å; R317-L319 VanDerWaalsContact C-N 3.27Å; R317-L319 PolarHBondContact O-N 2.89Å; L319-I323 WeakPolarHBondContact O-CB 3.4Å; L319-I323 VanDerWaalsContact O-CD1 3.28Å; L319-I323 WeakPolarHBondContact O-CD1 3.4Å; L319-I323 WeakPolarHBondContact O-CG1 3.27Å; L319-I323 PolarHBondContact O-N 3.18Å; L319-I323 VanDerWaalsContact O-N 3.13Å
320	T	57.3	Low	51.2	Low	81 Å²	81	115.5 Å²	115.5	50%	0.497	60%	0.595	S	S	.	*	H	α-helix	trans	-73.3	-41.5	177	57.3	0	0	0	0	113.7	T316 R317 I323 T324	T316-T320 WeakPolarHBondContact O-CG2 3.42Å; T316-T320 PolarHBondContact O-N 2.84Å; T316-T320 PolarHBondContact O-OG1 2.81Å; R317-T320 WeakPolarHBondContact CA-OG1 3.42Å; R317-T320 CarbonylContact O-C 3.49Å; R317-T320 PolarHBondContact O-N 2.86Å; R317-T320 PolarHBondContact O-OG1 2.83Å; T320-I323 PolarHBondContact O-N 2.79Å; T320-T324 PolarHBondContact O-N 3.44Å; T320-T324 PolarHBondContact O-OG1 3.15Å
321	E	53.8	Low	49.7	Very low	109 Å²	109	116.5 Å²	116.5	51%	0.509	61%	0.61	S	S	.	*	H	α-helix	trans	-70.1	-37.8	175.2	-67.1	178.8	158.1	0	0	111.2	R317 I323 T324 S325	R317-E321 WeakPolarHBondContact O-CB 3.48Å; R317-E321 WeakPolarHBondContact O-CG 3.17Å; R317-E321 PolarHBondContact O-N 2.98Å; E321-I323 VanDerWaalsContact C-N 3.29Å; E321-I323 PolarHBondContact O-N 2.96Å; E321-T324 PolarHBondContact O-N 3.45Å; E321-T324 PolarHBondContact O-OG1 2.92Å; E321-S325 PolarHBondContact O-N 3.48Å; E321-S325 VanDerWaalsContact O-N 3.08Å; E321-S325 PolarHBondContact O-OG 2.9Å
322	G	51.5	Low	47.5	Very low	54 Å²	54	118.4 Å²	118.4	56%	0.557	62%	0.617	S	S	*	*	H	α-helix	trans	-72.3	-16.1	175.5	0	0	0	0	0	114.6	W318	W318-G322 VanDerWaalsContact O-CA 3.25Å; W318-G322 WeakPolarHBondContact O-CA 3.43Å; W318-G322 PolarHBondContact O-N 3.08Å
323	I	42.4	Very low	46	Very low	142 Å²	142	123 Å²	123	73%	0.728	65%	0.645	S	S	*	*	H	α-helix	trans	-86.4	-18.2	170.2	-75.4	167.7	0	0	0	111.8	L319 T320 E321	L319-I323 WeakPolarHBondContact O-CB 3.4Å; L319-I323 VanDerWaalsContact O-CD1 3.28Å; L319-I323 WeakPolarHBondContact O-CD1 3.4Å; L319-I323 WeakPolarHBondContact O-CG1 3.27Å; L319-I323 PolarHBondContact O-N 3.18Å; L319-I323 VanDerWaalsContact O-N 3.13Å; T320-I323 PolarHBondContact O-N 2.79Å; E321-I323 VanDerWaalsContact C-N 3.29Å; E321-I323 PolarHBondContact O-N 2.96Å
324	T	41.4	Very low	43.7	Very low	117 Å²	117	122.5 Å²	122.5	72%	0.718	65%	0.652	S	S	*	*	H	α-helix	trans	-117.3	-1.8	-171.3	52.3	0	0	0	0	115.6	T320 E321	T320-T324 PolarHBondContact O-N 3.44Å; T320-T324 PolarHBondContact O-OG1 3.15Å; E321-T324 PolarHBondContact O-N 3.45Å; E321-T324 PolarHBondContact O-OG1 2.92Å
325	S	31.1	Very low	41.6	Very low	86 Å²	86	121.9 Å²	121.9	60%	0.601	66%	0.661	S	S	*	*			trans	-128.8	138.1	178.7	64.4	0	0	0	0	112.9	E321	E321-S325 PolarHBondContact O-N 3.48Å; E321-S325 VanDerWaalsContact O-N 3.08Å; E321-S325 PolarHBondContact O-OG 2.9Å
326	S	29.4	Very low	40.1	Very low	117 Å²	117	121.8 Å²	121.8	82%	0.818	67%	0.669	S	S	*	*			trans	-139.9	108.7	-175.4	56.7	0	0	0	0	114
327	K	28.5	Very low	38.2	Very low	207 Å²	207	126.4 Å²	126.4	90%	0.9	68%	0.683	S	S	*	*			trans	-161	158.2	157.8	-108.4	153.3	-174.4	174.9	0	109.9
328	P	25.5	Very low	36.4	Very low	111 Å²	111	125.3 Å²	125.3	72%	0.721	69%	0.694	S	S	*	*			trans	-105.5	-178.5	-143	40.9	-39.4	0	0	0	115
329	E	24.2	Very low	35	Very low	127 Å²	127	121.6 Å²	121.6	59%	0.593	70%	0.697	S	S	*	*			trans	19.7	113.7	155.4	-77.3	-168.9	-166.1	0	0	117.5	I332	E329-I332 HydrophobicContact CB-CD1 4.33Å; E329-I332 HydrophobicContact CG-CD1 3.71Å
330	K	26.5	Very low	34	Very low	165 Å²	165	120.4 Å²	120.4	72%	0.717	71%	0.712	S	S	*	*	S	Bend	cis	-141.9	156.4	18.8	-59	96.7	172.6	99.5	0	108.9
331	T	40.2	Very low	32.4	Very low	147 Å²	147	119.4 Å²	119.4	90%	0.902	72%	0.717	S	S	*	*	S	Bend	cis	-128.4	129.5	20.5	-55.2	0	0	0	0	109.9
332	I	23.3	Very low	31	Very low	97 Å²	97	121.9 Å²	121.9	50%	0.497	73%	0.734	S	S	.	*			trans	-118	131.3	-156.7	-38.5	165.3	0	0	0	112.2	E329 S334	E329-I332 HydrophobicContact CB-CD1 4.33Å; E329-I332 HydrophobicContact CG-CD1 3.71Å; I332-S334 WeakPolarHBondContact CG2-OG 3.35Å
333	V	39.4	Very low	30	Very low	155 Å²	155	125.6 Å²	125.6	94%	0.939	74%	0.741	S	S	*	*			trans	-136.1	86.6	158.9	-174.8	0	0	0	0	108.4
334	S	24.6	Very low	29.3	Very low	89 Å²	89	127.6 Å²	127.6	62%	0.622	75%	0.747	S	S	*	*			trans	-150.8	156.5	178	64.3	0	0	0	0	112.7	I332	I332-S334 WeakPolarHBondContact CG2-OG 3.35Å
335	S	28.2	Very low	28.6	Very low	105 Å²	105	128.4 Å²	128.4	73%	0.734	75%	0.747	S	S	*	*			trans	66.5	122.7	165.1	-49.7	0	0	0	0	118.2
336	I	30.6	Very low	28.3	Very low	146 Å²	146	131.9 Å²	131.9	75%	0.749	75%	0.754	S	S	*	*				-179.2	122	123.1	-96.8	159.3	0	0	0	112.1
337	K	28.7	Very low	28.2	Very low	176 Å²	176	132.1 Å²	132.1	77%	0.765	75%	0.746	S	S	*	*			trans	60.4	118.5	148.5	-67.1	177.5	-168.4	173.5	0	119
338	S	30.3	Very low	28.3	Very low	100 Å²	100	127.8 Å²	127.8	70%	0.699	74%	0.737	S	S	*	*				67	138	69.1	83.1	0	0	0	0	113.4
339	S	31.8	Very low	27.9	Very low	111 Å²	111	128.2 Å²	128.2	78%	0.776	74%	0.743	S	S	*	*			cis	-177.8	145.3	3.5	37.4	0	0	0	0	109.2
340	G	26.1	Very low	27.7	Very low	87 Å²	87	128.2 Å²	128.2	90%	0.897	75%	0.746	S	S	*	*			trans	77.7	162.2	-167.9	0	0	0	0	0	111.8
341	G	23	Very low	27.4	Very low	60 Å²	60	125.1 Å²	125.1	62%	0.619	75%	0.745	S	S	*	*			cis	171.7	151.1	-5.2	0	0	0	0	0	110.7
342	N	24.8	Very low	26.7	Very low	161 Å²	161	121.6 Å²	121.6	86%	0.861	74%	0.738	S	S	*	*			trans	60.5	-169.3	-177.8	-62.9	-10.9	0	0	0	115.7
343	N	30.9	Very low	27.1	Very low	132 Å²	132	124.4 Å²	124.4	71%	0.706	75%	0.75	S	S	*	*			trans	86.4	126.1	172.5	-53.2	-11.5	0	0	0	113.8
344	Q	26.9	Very low	26.4	Very low	183 Å²	183	128.3 Å²	128.3	86%	0.855	75%	0.747	S	S	*	*			cis	59.3	97.3	22.4	-61	-172.8	-19.6	0	0	115.2
345	N	25.9	Very low	26.8	Very low	134 Å²	134	129.9 Å²	129.9	72%	0.717	75%	0.748	S	S	*	*			trans	-176.7	132.3	159.6	-102.3	-10.2	0	0	0	105.2
346	E	25.8	Very low	26.7	Very low	160 Å²	160	131.5 Å²	131.5	75%	0.748	75%	0.747	S	S	*	*			cis	57.1	145.7	33.8	-59.9	-159.4	158.1	0	0	115.1
347	N	26.4	Very low	26.6	Very low	121 Å²	121	132.9 Å²	132.9	65%	0.647	75%	0.748	S	S	*	*			trans	70.3	107.4	167.5	-53.6	-59.3	0	0	0	115.2
348	V	30.7	Very low	26.4	Very low	117 Å²	117	128.8 Å²	128.8	71%	0.709	74%	0.741	S	S	*	*				82.8	111.1	68.1	167.1	0	0	0	0	112.4	D350	V348-D350 HydrophobicContact CG1-CB 3.77Å
349	S	17.2	Very low	26.4	Very low	120 Å²	120	128.8 Å²	128.8	84%	0.839	74%	0.739	S	S	*	*			trans	-130.1	64.2	154.2	61.5	0	0	0	0	107
350	D	20	Very low	26.1	Very low	126 Å²	126	129 Å²	129	67%	0.674	74%	0.735	S	S	*	*				87	161.4	75.6	-172.6	35.5	0	0	0	111.6	V348 G352	V348-D350 HydrophobicContact CG1-CB 3.77Å; D350-G352 PolarHBondContact O-N 3.41Å
351	S	21.1	Very low	26	Very low	100 Å²	100	131.5 Å²	131.5	70%	0.699	72%	0.721	S	S	*	*			trans	62.6	35.7	163.2	70.7	0	0	0	0	116.7
352	G	25.6	Very low	26	Very low	73 Å²	73	135.1 Å²	135.1	75%	0.753	72%	0.722	S	S	*	*				92.2	-165.1	106.1	0	0	0	0	0	112.9	D350	D350-G352 PolarHBondContact O-N 3.41Å
353	Q	31.8	Very low	26	Very low	157 Å²	157	133.8 Å²	133.8	73%	0.734	72%	0.715	S	S	*	*			cis	-124.4	141.6	0.9	-61.6	174.2	-6.3	0	0	108.2	I355	Q353-I355 VanDerWaalsContact C-N 3.32Å; Q353-I355 HydrophobicContact CB-CD1 4.43Å; Q353-I355 PolarHBondContact O-N 3.02Å
354	R	24.7	Very low	25.7	Very low	237 Å²	237	133.7 Å²	133.7	89%	0.894	71%	0.714	S	S	*	*				42.8	45	78.1	-77.3	-162.1	-174.3	176.6	4.8	116.5
355	I	31.5	Very low	25.5	Very low	122 Å²	122	130.6 Å²	130.6	63%	0.626	71%	0.708	S	S	*	*			trans	-140.6	106.6	144.4	-76.1	102.8	0	0	0	105.5	Q353 K357	Q353-I355 VanDerWaalsContact C-N 3.32Å; Q353-I355 HydrophobicContact CB-CD1 4.43Å; Q353-I355 PolarHBondContact O-N 3.02Å; I355-K357 HydrophobicContact CG2-CB 4.45Å
356	L	27.2	Very low	25.5	Very low	139 Å²	139	128.2 Å²	128.2	73%	0.728	70%	0.702	S	S	*	*			cis	64.6	58.2	25.6	-145.3	-175.8	0	0	0	113.2
357	K	28.3	Very low	25.5	Very low	174 Å²	174	128.2 Å²	128.2	76%	0.757	71%	0.707	S	S	*	*			trans	-177.1	122.4	152	-94.3	139.7	-169.2	176.6	0	107	I355	I355-K357 HydrophobicContact CG2-CB 4.45Å
358	S	24.9	Very low	25.6	Very low	90 Å²	90	130.9 Å²	130.9	63%	0.629	72%	0.715	S	S	*	*			cis	58.8	149.2	11.8	105.1	0	0	0	0	115.6
359	P	29.9	Very low	25.5	Very low	100 Å²	100	133.5 Å²	133.5	65%	0.649	72%	0.72	S	S	*	*			cis	-127.2	-152.9	-23.7	27.2	-4.3	0	0	0	109.3
360	V	24.5	Very low	25.9	Very low	116 Å²	116	135.1 Å²	135.1	70%	0.703	71%	0.712	S	S	*	*			trans	78.1	142.3	136.9	116.4	0	0	0	0	115.2
361	K	25.2	Very low	26.2	Very low	139 Å²	139	134.6 Å²	134.6	60%	0.604	71%	0.714	S	S	*	*			cis	-147.3	146.4	20.3	-113.9	173	-176.9	-74.1	0	108.9
362	E	22.9	Very low	26.5	Very low	137 Å²	137	134.4 Å²	134.4	64%	0.64	72%	0.718	S	S	*	*				61.1	144	107.5	-66.7	168.9	-165.8	0	0	115.4
363	L	25.6	Very low	26.6	Very low	133 Å²	133	136.7 Å²	136.7	70%	0.696	71%	0.713	S	S	*	*			cis	-151.9	179	13.8	-155.3	61.1	0	0	0	111.5
364	D	22.8	Very low	26.3	Very low	130 Å²	130	135.7 Å²	135.7	70%	0.695	71%	0.708	S	S	*	*			trans	-29.4	160.1	153.2	-43.2	-37.8	0	0	0	114.5
365	T	24.3	Very low	26.4	Very low	117 Å²	117	129.3 Å²	129.3	72%	0.718	70%	0.696	S	S	*	*				-163.3	163.5	57.3	53.9	0	0	0	0	115.3
366	S	24.1	Very low	26.2	Very low	85 Å²	85	126.1 Å²	126.1	59%	0.594	69%	0.687	S	S	*	*			trans	49.8	107.7	140.3	65.5	0	0	0	0	119.5
367	D	26.4	Very low	26.3	Very low	159 Å²	159	122.2 Å²	122.2	85%	0.85	67%	0.667	S	S	*	*				98.3	-176.6	87.1	-76.1	-53.8	0	0	0	111.7
368	E	29.6	Very low	26.3	Very low	177 Å²	177	118.7 Å²	118.7	83%	0.827	66%	0.66	S	S	*	*			trans	69.9	102.7	-172.4	-57.4	-160.5	179	0	0	114.7
369	E	28.2	Very low	26.4	Very low	172 Å²	172	117 Å²	117	80%	0.804	64%	0.642	S	S	*	*				84.4	153	75.5	-79.8	-138.8	136.5	0	0	113.4
370	F	25.1	Very low	26.6	Very low	155 Å²	155	116.1 Å²	116.1	68%	0.68	64%	0.635	S	S	*	*			cis	-173.6	119.6	-26.7	171.2	-101	0	0	0	108.3
371	T	26.6	Very low	27.1	Very low	115 Å²	115	115.8 Å²	115.8	71%	0.706	63%	0.629	S	S	*	*			trans	66.6	168.6	170.3	69.6	0	0	0	0	116.4
372	A	27.9	Very low	27.8	Very low	96 Å²	96	112.8 Å²	112.8	79%	0.793	62%	0.619	S	S	*	*			cis	-145.1	163.4	14.6	0	0	0	0	0	117.2
373	D	26.1	Very low	28.9	Very low	121 Å²	121	112.3 Å²	112.3	65%	0.647	62%	0.617	S	S	*	*			trans	-47.8	157	-174.9	-93.6	-75.7	0	0	0	122.4	K735	D373-K735 IonicContact OD1-NZ 2.62Å; D373-K735 PolarHBondContact OD1-NZ 3.26Å
374	E	25.7	Very low	29.7	Very low	135 Å²	135	109 Å²	109	63%	0.631	60%	0.598	S	S	*	*			trans	70.5	152.3	148.1	-69.1	-174.5	173.5	0	0	118.5	K735	E374-K735 IonicContact OE1-NZ 2.76Å; E374-K735 PolarHBondContact OE1-NZ 3.28Å
375	V	27.7	Very low	30.7	Very low	104 Å²	104	104.5 Å²	104.5	63%	0.63	58%	0.576	S	S	*	*			cis	-151.6	150.8	44.6	168.1	0	0	0	0	114.7
376	A	27.8	Very low	31.5	Very low	54 Å²	54	102.5 Å²	102.5	45%	0.446	56%	0.56	S	S	.	*			trans	59.4	102.9	156.6	0	0	0	0	0	123.9	K1978	A376-K1978 PolarHBondContact O-NZ 3.2Å
377	L	28.3	Very low	32.6	Very low	58 Å²	58	99.7 Å²	99.7	30%	0.304	54%	0.537	S	S	.	.				43.8	120.2	109.8	-68.3	159.5	0	0	0	120.2	K732 K1978	L377-K732 HydrophobicContact CD1-CD 4.41Å; L377-K1978 VanDerWaalsContact C-NZ 3.26Å; L377-K1978 PolarHBondContact O-NZ 2.81Å
378	T	28.8	Very low	33.3	Very low	99 Å²	99	97.1 Å²	97.1	61%	0.607	52%	0.52	S	S	*	.				-163	156.7	126.5	23.6	0	0	0	0	107.8	K1978	T378-K1978 PolarHBondContact OG1-NZ 3.18Å
379	E	27.4	Very low	33.9	Very low	55 Å²	55	91.5 Å²	91.5	26%	0.257	49%	0.494	S	S	.	.			trans	-103.9	133.9	-166.8	-62	148.5	179.9	0	0	110.9	N730 V2210 F2211	E379-N730 PolarHBondContact OE1-ND2 3.16Å; E379-V2210 HydrophobicContact CB-CG1 4.23Å; E379-F2211 HydrophobicContact CB-CE1 3.79Å; E379-F2211 HydrophobicContact CB-CE2 3.92Å; E379-F2211 HydrophobicContact CB-CZ 3.32Å; E379-F2211 HydrophobicContact CG-CZ 4.4Å; E379-F2211 WeakPolarHBondContact O-CE1 3.32Å; E379-F2211 WeakPolarHBondContact OE2-CE2 3.36Å
380	V	34.1	Very low	34.5	Very low	82 Å²	82	89.2 Å²	89.2	50%	0.497	48%	0.483	S	S	.	.			trans	-148.4	152.8	178.5	-170.4	0	0	0	0	111	E384	V380-E384 WeakPolarHBondContact CG1-OE2 3.26Å
381	D	35.4	Very low	35.3	Very low	109 Å²	109	85.2 Å²	85.2	58%	0.583	47%	0.465	S	S	*	.			trans	-53.6	170.1	-169.9	-91	-68.7	0	0	0	118.7	R755	D381-R755 PolarHBondContact O-NH1 3Å; D381-R755 PolarHBondContact O-NH2 2.62Å; D381-R755 VanDerWaalsContact O-NH2 3.11Å
382	D	38.7	Very low	36	Very low	75 Å²	75	83.6 Å²	83.6	40%	0.401	45%	0.452	S	S	.	.	S	Bend	trans	-80	-22.8	170.6	-76.2	-38.3	0	0	0	112.7	T385 I386 R755	D382-T385 PolarHBondContact O-N 3.13Å; D382-I386 PolarHBondContact O-N 3.35Å; D382-R755 WeakPolarHBondContact OD1-CD 3.45Å; D382-R755 IonicContact OD1-CZ 3.27Å; D382-R755 VanDerWaalsContact OD1-CZ 3.32Å; D382-R755 IonicContact OD1-NE 2.72Å; D382-R755 PolarHBondContact OD1-NE 3.2Å; D382-R755 IonicContact OD1-NH1 3.03Å; D382-R755 PolarHBondContact OD1-NH1 3.35Å
383	E	47	Very low	36.6	Very low	127 Å²	127	81 Å²	81	59%	0.593	43%	0.431	S	S	*	.	H	α-helix	trans	-69.3	-44.4	-179.9	-67.4	-120.9	137.2	0	0	112.7	T385 I386 E387	E383-T385 PolarHBondContact O-N 2.74Å; E383-I386 CarbonylContact O-C 3.56Å; E383-I386 PolarHBondContact O-N 2.68Å; E383-E387 PolarHBondContact O-N 2.93Å
384	E	41	Very low	37.2	Very low	63 Å²	63	78.8 Å²	78.8	29%	0.294	42%	0.421	S	S	.	.	H	α-helix	trans	-64	-21.9	176.9	-78.1	-168.7	168.8	0	0	112.7	V380 Q388 Q2216	V380-E384 WeakPolarHBondContact CG1-OE2 3.26Å; E384-Q388 VanDerWaalsContact O-CB 3.26Å; E384-Q388 WeakPolarHBondContact O-CB 3.18Å; E384-Q388 WeakPolarHBondContact O-CG 3.47Å; E384-Q388 PolarHBondContact O-N 2.78Å; E384-Q2216 PolarHBondContact OE1-NE2 3.42Å
385	T	45.3	Very low	37.6	Very low	37 Å²	37	77.6 Å²	77.6	23%	0.227	42%	0.416	C	S	.	.	H	α-helix	trans	-81	-25.9	172.9	-52.8	0	0	0	0	112.4	D382 E383 E389 R755	D382-T385 PolarHBondContact O-N 3.13Å; E383-T385 PolarHBondContact O-N 2.74Å; T385-E389 WeakPolarHBondContact O-CB 3.2Å; T385-E389 WeakPolarHBondContact O-CG 3.4Å; T385-E389 PolarHBondContact O-N 3.11Å; T385-R755 PolarHBondContact OG1-NH2 3.25Å
386	I	40.3	Very low	37.9	Very low	74 Å²	74	78.3 Å²	78.3	38%	0.379	42%	0.416	S	S	.	.	H	α-helix	trans	-76.3	-39.9	168.4	-64.5	172.6	0	0	0	109.5	D382 E383 Q388 E389 E390	D382-I386 PolarHBondContact O-N 3.35Å; E383-I386 CarbonylContact O-C 3.56Å; E383-I386 PolarHBondContact O-N 2.68Å; I386-Q388 VanDerWaalsContact C-N 3.27Å; I386-Q388 PolarHBondContact O-N 2.96Å; I386-E389 CarbonylContact O-C 3.47Å; I386-E389 PolarHBondContact O-N 3.42Å; I386-E390 HydrophobicContact CG2-CG 4.17Å; I386-E390 VanDerWaalsContact O-CB 3.22Å; I386-E390 WeakPolarHBondContact O-CB 3.44Å; I386-E390 VanDerWaalsContact O-CG 3.29Å; I386-E390 WeakPolarHBondContact O-CG 3.49Å; I386-E390 PolarHBondContact O-N 2.81Å
387	E	46.2	Very low	38.2	Very low	27 Å²	27	82 Å²	82	13%	0.126	42%	0.424	C	S	.	.	H	α-helix	trans	-64.6	-30.5	171.1	-71.7	-155.5	178.3	0	0	113.1	E383 K391 K2218	E383-E387 PolarHBondContact O-N 2.93Å; E387-K391 WeakPolarHBondContact O-CB 3.45Å; E387-K391 WeakPolarHBondContact O-CD 3.31Å; E387-K391 WeakPolarHBondContact O-CG 3.25Å; E387-K391 PolarHBondContact O-N 2.76Å; E387-K391 IonicContact OE2-NZ 2.79Å; E387-K391 PolarHBondContact OE2-NZ 3.24Å; E387-K2218 WeakPolarHBondContact OE1-CE 3.37Å; E387-K2218 IonicContact OE1-NZ 2.81Å; E387-K2218 PolarHBondContact OE1-NZ 3.17Å
388	Q	41.1	Very low	38.3	Very low	105 Å²	105	84 Å²	84	49%	0.491	43%	0.431	S	S	.	.	H	α-helix	trans	-76.8	-39.1	172.1	-75.5	163.4	11.3	0	0	111.5	E384 I386 E390 I392	E384-Q388 VanDerWaalsContact O-CB 3.26Å; E384-Q388 WeakPolarHBondContact O-CB 3.18Å; E384-Q388 WeakPolarHBondContact O-CG 3.47Å; E384-Q388 PolarHBondContact O-N 2.78Å; I386-Q388 VanDerWaalsContact C-N 3.27Å; I386-Q388 PolarHBondContact O-N 2.96Å; Q388-E390 VanDerWaalsContact C-N 3.28Å; Q388-E390 PolarHBondContact O-N 2.93Å; Q388-I392 WeakPolarHBondContact O-CA 3.48Å; Q388-I392 WeakPolarHBondContact O-CB 3.25Å; Q388-I392 WeakPolarHBondContact O-CD1 3.45Å; Q388-I392 WeakPolarHBondContact O-CG1 3.41Å; Q388-I392 PolarHBondContact O-N 3.24Å
389	E	43.8	Very low	38.3	Very low	59 Å²	59	81 Å²	81	28%	0.276	42%	0.421	S	S	.	.	H	α-helix	trans	-69.2	-22.8	170.3	-79.8	-178.1	143.4	0	0	112.6	T385 I386 A393 R787	T385-E389 WeakPolarHBondContact O-CB 3.2Å; T385-E389 WeakPolarHBondContact O-CG 3.4Å; T385-E389 PolarHBondContact O-N 3.11Å; I386-E389 CarbonylContact O-C 3.47Å; I386-E389 PolarHBondContact O-N 3.42Å; E389-A393 WeakPolarHBondContact O-CB 3.36Å; E389-A393 PolarHBondContact O-N 2.89Å; E389-R787 IonicContact OE1-NE 3.71Å; E389-R787 PolarHBondContact OE1-NE 3.49Å; E389-R787 IonicContact OE2-CZ 2.81Å; E389-R787 IonicContact OE2-NE 2.71Å; E389-R787 PolarHBondContact OE2-NE 3.39Å; E389-R787 IonicContact OE2-NH2 3.6Å; E389-R787 PolarHBondContact OE2-NH2 2.99Å
390	E	41	Very low	38.5	Very low	123 Å²	123	82.2 Å²	82.2	58%	0.575	44%	0.435	S	S	*	.	H	α-helix	trans	-84.2	-42.5	174.2	-77.1	178.4	168.9	0	0	111.5	I386 Q388 A393 T394	I386-E390 HydrophobicContact CG2-CG 4.17Å; I386-E390 VanDerWaalsContact O-CB 3.22Å; I386-E390 WeakPolarHBondContact O-CB 3.44Å; I386-E390 VanDerWaalsContact O-CG 3.29Å; I386-E390 WeakPolarHBondContact O-CG 3.49Å; I386-E390 PolarHBondContact O-N 2.81Å; Q388-E390 VanDerWaalsContact C-N 3.28Å; Q388-E390 PolarHBondContact O-N 2.93Å; E390-A393 CarbonylContact O-C 3.19Å; E390-A393 PolarHBondContact O-N 2.87Å; E390-T394 PolarHBondContact O-N 2.81Å; E390-T394 PolarHBondContact O-OG1 3.11Å
391	K	42.1	Very low	38.3	Very low	71 Å²	71	82.8 Å²	82.8	31%	0.309	43%	0.432	S	S	.	.	H	α-helix	trans	-62.1	-48.2	170.1	-76.7	161.7	-176.2	147.6	0	110.4	E387 A393 T394 E395	E387-K391 WeakPolarHBondContact O-CB 3.45Å; E387-K391 WeakPolarHBondContact O-CD 3.31Å; E387-K391 WeakPolarHBondContact O-CG 3.25Å; E387-K391 PolarHBondContact O-N 2.76Å; E387-K391 IonicContact OE2-NZ 2.79Å; E387-K391 PolarHBondContact OE2-NZ 3.24Å; K391-A393 VanDerWaalsContact C-N 3.29Å; K391-A393 PolarHBondContact O-N 2.92Å; K391-T394 WeakPolarHBondContact CA-OG1 3.38Å; K391-T394 CarbonylContact O-C 3.53Å; K391-T394 PolarHBondContact O-N 3.47Å; K391-T394 PolarHBondContact O-OG1 2.96Å; K391-E395 WeakPolarHBondContact O-CB 3.23Å; K391-E395 VanDerWaalsContact O-CD 3.25Å; K391-E395 WeakPolarHBondContact O-CG 3.46Å; K391-E395 PolarHBondContact O-N 3.3Å
392	I	41.4	Very low	38.1	Very low	81 Å²	81	82.6 Å²	82.6	42%	0.415	44%	0.436	S	S	.	.	H	α-helix	trans	-66.1	-29	173.2	-63.3	165.8	0	0	0	111.2	Q388 E395 D396	Q388-I392 WeakPolarHBondContact O-CA 3.48Å; Q388-I392 WeakPolarHBondContact O-CB 3.25Å; Q388-I392 WeakPolarHBondContact O-CD1 3.45Å; Q388-I392 WeakPolarHBondContact O-CG1 3.41Å; Q388-I392 PolarHBondContact O-N 3.24Å; I392-E395 PolarHBondContact O-N 3.45Å; I392-D396 WeakPolarHBondContact CG2-OD2 3.44Å; I392-D396 WeakPolarHBondContact O-CA 3.28Å; I392-D396 WeakPolarHBondContact O-CB 3.13Å; I392-D396 PolarHBondContact O-N 3.25Å
393	A	40.3	Very low	37.7	Very low	43 Å²	43	82 Å²	82	36%	0.355	44%	0.438	S	S	.	.	H	α-helix	trans	-77.2	-19.2	171.1	0	0	0	0	0	114.2	E389 E390 K391 Q397	E389-A393 WeakPolarHBondContact O-CB 3.36Å; E389-A393 PolarHBondContact O-N 2.89Å; E390-A393 CarbonylContact O-C 3.19Å; E390-A393 PolarHBondContact O-N 2.87Å; K391-A393 VanDerWaalsContact C-N 3.29Å; K391-A393 PolarHBondContact O-N 2.92Å; A393-Q397 WeakPolarHBondContact O-CB 3.48Å; A393-Q397 WeakPolarHBondContact O-CG 3.32Å; A393-Q397 PolarHBondContact O-N 2.93Å; A393-Q397 PolarHBondContact O-NE2 2.73Å
394	T	38.8	Very low	37.4	Very low	74 Å²	74	78.4 Å²	78.4	45%	0.454	42%	0.424	S	S	.	.	H	α-helix	trans	-81.2	-39.8	165	47.1	0	0	0	0	111.2	E390 K391 Q397 H398	E390-T394 PolarHBondContact O-N 2.81Å; E390-T394 PolarHBondContact O-OG1 3.11Å; K391-T394 WeakPolarHBondContact CA-OG1 3.38Å; K391-T394 CarbonylContact O-C 3.53Å; K391-T394 PolarHBondContact O-N 3.47Å; K391-T394 PolarHBondContact O-OG1 2.96Å; T394-Q397 PolarHBondContact O-N 2.87Å; T394-H398 PolarHBondContact O-CD2 3.37Å; T394-H398 PolarHBondContact O-N 3.26Å
395	E	33.8	Very low	37.3	Very low	110 Å²	110	77.8 Å²	77.8	51%	0.514	43%	0.43	S	S	.	.	H	α-helix	trans	-72.4	-32.5	178.8	-65.5	152.7	-170.4	0	0	112.2	K391 I392 H398 G399	K391-E395 WeakPolarHBondContact O-CB 3.23Å; K391-E395 VanDerWaalsContact O-CD 3.25Å; K391-E395 WeakPolarHBondContact O-CG 3.46Å; K391-E395 PolarHBondContact O-N 3.3Å; I392-E395 PolarHBondContact O-N 3.45Å; E395-H398 CarbonylContact O-C 3.57Å; E395-H398 WeakPolarHBondContact O-CA 3.18Å; E395-H398 PolarHBondContact O-N 3.46Å; E395-G399 WeakPolarHBondContact O-CA 3.23Å; E395-G399 PolarHBondContact O-N 2.93Å
396	D	34.3	Very low	37.2	Very low	118 Å²	118	79.7 Å²	79.7	63%	0.631	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-15.2	171.8	-75.4	-15.4	0	0	0	112.2	I392 G399	I392-D396 WeakPolarHBondContact CG2-OD2 3.44Å; I392-D396 WeakPolarHBondContact O-CA 3.28Å; I392-D396 WeakPolarHBondContact O-CB 3.13Å; I392-D396 PolarHBondContact O-N 3.25Å; D396-G399 WeakPolarHBondContact O-CA 3.49Å; D396-G399 PolarHBondContact O-N 2.93Å
397	Q	33.1	Very low	37.3	Very low	131 Å²	131	80.5 Å²	80.5	61%	0.612	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-32.5	165.4	-79.4	176.3	106.1	0	0	111.1	A393 T394 G399	A393-Q397 WeakPolarHBondContact O-CB 3.48Å; A393-Q397 WeakPolarHBondContact O-CG 3.32Å; A393-Q397 PolarHBondContact O-N 2.93Å; A393-Q397 PolarHBondContact O-NE2 2.73Å; T394-Q397 PolarHBondContact O-N 2.87Å; Q397-G399 PolarHBondContact O-N 3.47Å
398	H	31.4	Very low	37.3	Very low	100 Å²	100	83.9 Å²	83.9	46%	0.463	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	7.7	154	-59.4	-61.4	0	0	0	112.7	T394 E395 S400 E401 T402	T394-H398 PolarHBondContact O-CD2 3.37Å; T394-H398 PolarHBondContact O-N 3.26Å; E395-H398 CarbonylContact O-C 3.57Å; E395-H398 WeakPolarHBondContact O-CA 3.18Å; E395-H398 PolarHBondContact O-N 3.46Å; H398-S400 VanDerWaalsContact C-N 3.34Å; H398-S400 PolarHBondContact O-N 2.62Å; H398-E401 HydrophobicContact CB-CB 4.28Å; H398-E401 IonicContact CE1-OE1 2.69Å; H398-E401 IonicContact CE1-OE2 3.34Å; H398-E401 IonicContact CG-OE2 2.67Å; H398-E401 IonicContact ND1-OE1 2.73Å; H398-E401 PolarHBondContact ND1-OE1 3.1Å; H398-E401 IonicContact ND1-OE2 3.63Å; H398-E401 PolarHBondContact ND1-OE2 2.76Å; H398-E401 CarbonylContact O-C 3.59Å; H398-E401 WeakPolarHBondContact O-CA 3.35Å; H398-E401 WeakPolarHBondContact O-CB 3.46Å; H398-E401 PolarHBondContact O-N 3.38Å; H398-T402 PolarHBondContact O-N 3.34Å
399	G	28.1	Very low	37.5	Very low	37 Å²	37	85.8 Å²	85.8	38%	0.381	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-17.7	-179.4	0	0	0	0	0	113.5	E395 D396 Q397	E395-G399 WeakPolarHBondContact O-CA 3.23Å; E395-G399 PolarHBondContact O-N 2.93Å; D396-G399 WeakPolarHBondContact O-CA 3.49Å; D396-G399 PolarHBondContact O-N 2.93Å; Q397-G399 PolarHBondContact O-N 3.47Å
400	S	31	Very low	38	Very low	81 Å²	81	88.3 Å²	88.3	57%	0.566	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-26.1	160.6	-164.5	0	0	0	0	111.4	H398 T402 S403 T404	H398-S400 VanDerWaalsContact C-N 3.34Å; H398-S400 PolarHBondContact O-N 2.62Å; S400-T402 VanDerWaalsContact C-N 3.32Å; S400-T402 PolarHBondContact O-N 3.18Å; S400-S403 PolarHBondContact O-N 3.46Å; S400-T404 PolarHBondContact O-N 3.36Å; S400-T404 VanDerWaalsContact O-N 3.08Å
401	E	29.8	Very low	37.9	Very low	93 Å²	93	86.9 Å²	86.9	44%	0.435	48%	0.478	S	S	.	.	H	α-helix	trans	-82.7	-5.5	-171.4	-62.2	175.3	-149.5	0	0	113.4	H398 T404 A405	H398-E401 HydrophobicContact CB-CB 4.28Å; H398-E401 IonicContact CE1-OE1 2.69Å; H398-E401 IonicContact CE1-OE2 3.34Å; H398-E401 IonicContact CG-OE2 2.67Å; H398-E401 IonicContact ND1-OE1 2.73Å; H398-E401 PolarHBondContact ND1-OE1 3.1Å; H398-E401 IonicContact ND1-OE2 3.63Å; H398-E401 PolarHBondContact ND1-OE2 2.76Å; H398-E401 CarbonylContact O-C 3.59Å; H398-E401 WeakPolarHBondContact O-CA 3.35Å; H398-E401 WeakPolarHBondContact O-CB 3.46Å; H398-E401 PolarHBondContact O-N 3.38Å; E401-T404 WeakPolarHBondContact CA-OG1 3.37Å; E401-A405 WeakPolarHBondContact O-CA 3.45Å; E401-A405 WeakPolarHBondContact O-CB 3.27Å; E401-A405 PolarHBondContact O-N 3.16Å
402	T	31.8	Very low	38	Very low	106 Å²	106	85.8 Å²	85.8	65%	0.65	48%	0.482	S	S	*	.	H	α-helix	trans	-84.1	-17.5	165.1	48.4	0	0	0	0	113.4	H398 S400 V406	H398-T402 PolarHBondContact O-N 3.34Å; S400-T402 VanDerWaalsContact C-N 3.32Å; S400-T402 PolarHBondContact O-N 3.18Å; T402-V406 WeakPolarHBondContact O-CG2 3.25Å
403	S	30.7	Very low	38.7	Very low	63 Å²	63	85.7 Å²	85.7	44%	0.441	49%	0.489	S	S	.	.	H	α-helix	trans	-81.4	-50.5	161.4	-155.1	0	0	0	0	109.4	S400 A405 V406 E407	S400-S403 PolarHBondContact O-N 3.46Å; S403-A405 VanDerWaalsContact C-N 3.33Å; S403-A405 PolarHBondContact O-N 3.11Å; S403-V406 PolarHBondContact O-N 3.38Å; S403-V406 VanDerWaalsContact O-N 3.11Å; S403-E407 WeakPolarHBondContact O-CG 3.42Å; S403-E407 PolarHBondContact O-N 2.89Å; S403-E407 PolarHBondContact OG-OE1 3.03Å
404	T	39.5	Very low	39	Very low	50 Å²	50	88.6 Å²	88.6	31%	0.307	50%	0.498	S	S	.	.	H	α-helix	trans	-71.9	-21.8	-176.9	71.4	0	0	0	0	113.8	S400 E401 L408	S400-T404 PolarHBondContact O-N 3.36Å; S400-T404 VanDerWaalsContact O-N 3.08Å; E401-T404 WeakPolarHBondContact CA-OG1 3.37Å; T404-L408 WeakPolarHBondContact O-CB 3.29Å; T404-L408 WeakPolarHBondContact O-CD1 3.5Å; T404-L408 WeakPolarHBondContact O-CG 3.02Å; T404-L408 PolarHBondContact O-N 3.5Å
405	A	39.4	Very low	39.4	Very low	51 Å²	51	88.8 Å²	88.8	42%	0.421	51%	0.508	S	S	.	.	H	α-helix	trans	-74.5	-34.1	169.1	0	0	0	0	0	111.9	E401 S403 L408 E409	E401-A405 WeakPolarHBondContact O-CA 3.45Å; E401-A405 WeakPolarHBondContact O-CB 3.27Å; E401-A405 PolarHBondContact O-N 3.16Å; S403-A405 VanDerWaalsContact C-N 3.33Å; S403-A405 PolarHBondContact O-N 3.11Å; A405-L408 PolarHBondContact O-N 2.86Å; A405-E409 WeakPolarHBondContact O-CB 3.46Å; A405-E409 PolarHBondContact O-N 2.99Å
406	V	43	Very low	40	Very low	76 Å²	76	90.7 Å²	90.7	46%	0.461	52%	0.521	S	S	.	.	H	α-helix	trans	-69.6	-40.9	171.6	171.6	0	0	0	0	110	T402 S403 E409 Q410	T402-V406 WeakPolarHBondContact O-CG2 3.25Å; S403-V406 PolarHBondContact O-N 3.38Å; S403-V406 VanDerWaalsContact O-N 3.11Å; V406-E409 PolarHBondContact O-N 2.84Å; V406-Q410 VanDerWaalsContact O-CB 3.31Å; V406-Q410 WeakPolarHBondContact O-CB 3.3Å; V406-Q410 VanDerWaalsContact O-CG 3.22Å; V406-Q410 WeakPolarHBondContact O-CG 3.47Å; V406-Q410 PolarHBondContact O-N 2.75Å
407	E	42.1	Very low	40.3	Very low	91 Å²	91	87.5 Å²	87.5	43%	0.425	51%	0.508	S	S	.	.	H	α-helix	trans	-65.7	-36.8	173.3	-67.4	155.1	-160.7	0	0	111.8	S403 L411	S403-E407 WeakPolarHBondContact O-CG 3.42Å; S403-E407 PolarHBondContact O-N 2.89Å; S403-E407 PolarHBondContact OG-OE1 3.03Å; E407-L411 VanDerWaalsContact O-CB 3.24Å; E407-L411 WeakPolarHBondContact O-CB 3.49Å; E407-L411 WeakPolarHBondContact O-CD1 3.43Å; E407-L411 WeakPolarHBondContact O-CG 3.46Å; E407-L411 PolarHBondContact O-N 2.93Å
408	L	47.2	Very low	40.4	Very low	98 Å²	98	84.4 Å²	84.4	51%	0.513	50%	0.499	S	S	.	.	H	α-helix	trans	-76.9	-27.5	174.8	-74.7	166.3	0	0	0	113.3	T404 A405 A412	T404-L408 WeakPolarHBondContact O-CB 3.29Å; T404-L408 WeakPolarHBondContact O-CD1 3.5Å; T404-L408 WeakPolarHBondContact O-CG 3.02Å; T404-L408 PolarHBondContact O-N 3.5Å; A405-L408 PolarHBondContact O-N 2.86Å; L408-A412 WeakPolarHBondContact O-CB 3.06Å; L408-A412 PolarHBondContact O-N 3.41Å
409	E	46.1	Very low	40.8	Very low	146 Å²	146	86.1 Å²	86.1	68%	0.682	51%	0.511	S	S	*	.	H	α-helix	trans	-77.3	-33.8	173	-171.5	167.5	-140.2	0	0	110.4	A405 V406 S413	A405-E409 WeakPolarHBondContact O-CB 3.46Å; A405-E409 PolarHBondContact O-N 2.99Å; V406-E409 PolarHBondContact O-N 2.84Å; E409-S413 WeakPolarHBondContact O-CB 3.49Å; E409-S413 PolarHBondContact O-N 2.76Å; E409-S413 PolarHBondContact O-OG 3.48Å
410	Q	54	Low	41.4	Very low	111 Å²	111	91.7 Å²	91.7	52%	0.519	53%	0.527	S	S	.	.	H	α-helix	trans	-66.7	-49.8	166.5	-72.5	-176.6	-81.7	0	0	111.4	V406 A412 S413 D414	V406-Q410 VanDerWaalsContact O-CB 3.31Å; V406-Q410 WeakPolarHBondContact O-CB 3.3Å; V406-Q410 VanDerWaalsContact O-CG 3.22Å; V406-Q410 WeakPolarHBondContact O-CG 3.47Å; V406-Q410 PolarHBondContact O-N 2.75Å; Q410-A412 VanDerWaalsContact C-N 3.28Å; Q410-A412 PolarHBondContact O-N 2.65Å; Q410-S413 WeakPolarHBondContact CA-OG 3.3Å; Q410-S413 CarbonylContact O-C 3.6Å; Q410-S413 WeakPolarHBondContact O-CA 3.35Å; Q410-S413 PolarHBondContact O-N 3.16Å; Q410-S413 PolarHBondContact O-OG 3.07Å; Q410-D414 PolarHBondContact O-N 2.99Å
411	L	38.4	Very low	42.4	Very low	94 Å²	94	93.6 Å²	93.6	49%	0.492	53%	0.531	S	S	.	.	H	α-helix	trans	-64.7	-29.4	176.2	-73.4	166.8	0	0	0	112.7	E407 D414 A415	E407-L411 VanDerWaalsContact O-CB 3.24Å; E407-L411 WeakPolarHBondContact O-CB 3.49Å; E407-L411 WeakPolarHBondContact O-CD1 3.43Å; E407-L411 WeakPolarHBondContact O-CG 3.46Å; E407-L411 PolarHBondContact O-N 2.93Å; L411-D414 PolarHBondContact O-N 2.89Å; L411-A415 WeakPolarHBondContact O-CB 3.24Å; L411-A415 PolarHBondContact O-N 2.81Å
412	A	44.7	Very low	43	Very low	47 Å²	47	95.2 Å²	95.2	39%	0.388	54%	0.542	S	S	.	.	H	α-helix	trans	-68.7	-40.9	168.8	0	0	0	0	0	111.4	L408 Q410 D414 A415 D416	L408-A412 WeakPolarHBondContact O-CB 3.06Å; L408-A412 PolarHBondContact O-N 3.41Å; Q410-A412 VanDerWaalsContact C-N 3.28Å; Q410-A412 PolarHBondContact O-N 2.65Å; A412-D414 VanDerWaalsContact C-N 3.27Å; A412-D414 PolarHBondContact O-N 3.22Å; A412-A415 PolarHBondContact O-N 3.05Å; A412-D416 PolarHBondContact O-N 2.88Å
413	S	55.1	Low	43.5	Very low	80 Å²	80	93.6 Å²	93.6	56%	0.559	53%	0.529	S	S	*	.	H	α-helix	trans	-67.1	-25.7	173.5	73.9	0	0	0	0	113.7	E409 Q410	E409-S413 WeakPolarHBondContact O-CB 3.49Å; E409-S413 PolarHBondContact O-N 2.76Å; E409-S413 PolarHBondContact O-OG 3.48Å; Q410-S413 WeakPolarHBondContact CA-OG 3.3Å; Q410-S413 CarbonylContact O-C 3.6Å; Q410-S413 WeakPolarHBondContact O-CA 3.35Å; Q410-S413 PolarHBondContact O-N 3.16Å; Q410-S413 PolarHBondContact O-OG 3.07Å
414	D	47.3	Very low	43.9	Very low	103 Å²	103	94.9 Å²	94.9	55%	0.551	54%	0.536	S	S	*	.	H	α-helix	trans	-80.3	-30.6	170.9	-66.3	-29.2	0	0	0	112	Q410 L411 A412 C417	Q410-D414 PolarHBondContact O-N 2.99Å; L411-D414 PolarHBondContact O-N 2.89Å; A412-D414 VanDerWaalsContact C-N 3.27Å; A412-D414 PolarHBondContact O-N 3.22Å; D414-C417 WeakPolarHBondContact O-CB 3.25Å
415	A	46.9	Very low	43.4	Very low	79 Å²	79	99.3 Å²	99.3	65%	0.653	57%	0.565	S	S	*	*	H	α-helix	trans	-84.8	-26	-179	0	0	0	0	0	114.4	L411 A412 C417	L411-A415 WeakPolarHBondContact O-CB 3.24Å; L411-A415 PolarHBondContact O-N 2.81Å; A412-A415 PolarHBondContact O-N 3.05Å; A415-C417 PolarHBondContact O-N 3.36Å
416	D	45.6	Very low	43.6	Very low	149 Å²	149	98.7 Å²	98.7	80%	0.797	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	8.6	168.2	-80.6	-29.3	0	0	0	112.3	A412	A412-D416 PolarHBondContact O-N 2.88Å
417	C	42.1	Very low	43.4	Very low	51 Å²	51	101.7 Å²	101.7	35%	0.345	57%	0.568	S	S	.	*	S	Bend	trans	-70.7	127	168.5	-162.7	0	0	0	0	109.8	D414 A415	D414-C417 WeakPolarHBondContact O-CB 3.25Å; A415-C417 PolarHBondContact O-N 3.36Å
418	P	34.5	Very low	43.1	Very low	66 Å²	66	103 Å²	103	43%	0.429	58%	0.577	S	S	.	*			trans	-65.7	146.5	-171.7	26.7	-35	0	0	0	112.4	E420 D421	P418-E420 PolarHBondContact O-N 3.44Å; P418-E420 VanDerWaalsContact O-N 3.07Å; P418-D421 PolarHBondContact O-N 2.96Å
419	L	39.1	Very low	42.7	Very low	136 Å²	136	105.9 Å²	105.9	71%	0.712	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-20.4	-173.7	-170.3	61.4	0	0	0	113.3	D421	L419-D421 VanDerWaalsContact C-N 3.33Å; L419-D421 PolarHBondContact O-N 3.05Å
420	E	41.3	Very low	42.1	Very low	154 Å²	154	107.1 Å²	107.1	72%	0.72	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	-33.7	169.5	-74.2	77.7	-168.7	0	0	114.1	P418	P418-E420 PolarHBondContact O-N 3.44Å; P418-E420 VanDerWaalsContact O-N 3.07Å
421	D	52.5	Low	41.3	Very low	122 Å²	122	107.1 Å²	107.1	65%	0.652	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-13.7	-171.9	-79.2	-35.1	0	0	0	114.1	P418 L419	P418-D421 PolarHBondContact O-N 2.96Å; L419-D421 VanDerWaalsContact C-N 3.33Å; L419-D421 PolarHBondContact O-N 3.05Å
422	L	42.7	Very low	41	Very low	127 Å²	127	108.3 Å²	108.3	67%	0.665	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	-1.3	179.2	-68.6	175.8	0	0	0	114.1
423	L	42.2	Very low	40.2	Very low	71 Å²	71	109.8 Å²	109.8	37%	0.372	61%	0.613	S	S	.	*	S	Bend	trans	-89	125.5	177.8	-80	167.8	0	0	0	111.6	Y427 L428	L423-Y427 HydrophobicContact CD2-CD1 3.84Å; L423-Y427 HydrophobicContact CD2-CE1 4.49Å; L423-Y427 HydrophobicContact CD2-CG 4.41Å; L423-L428 HydrophobicContact CD1-CD1 4.27Å; L423-L428 HydrophobicContact CD1-CG 4.45Å
424	P	37.5	Very low	38.9	Very low	90 Å²	90	112.8 Å²	112.8	58%	0.584	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-58.2	133.1	174.1	-25.5	34.8	0	0	0	111.7	G426 Y427	P424-G426 PolarHBondContact O-N 2.71Å; P424-G426 VanDerWaalsContact O-N 3.09Å; P424-Y427 PolarHBondContact O-N 3.1Å; P424-Y427 VanDerWaalsContact O-N 3.11Å
425	P	30.4	Very low	38	Very low	143 Å²	143	113.2 Å²	113.2	93%	0.929	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	117.1	-177	22.9	-33	0	0	0	110.7
426	G	44	Very low	37	Very low	38 Å²	38	114.1 Å²	114.1	39%	0.392	64%	0.635	S	S	.	*	T	Hydrogen-bonded Turn	trans	116.1	-13.2	-176.3	0	0	0	0	0	115.3	P424 L428 E429	P424-G426 PolarHBondContact O-N 2.71Å; P424-G426 VanDerWaalsContact O-N 3.09Å; G426-L428 PolarHBondContact O-N 3.02Å; G426-E429 PolarHBondContact O-N 3.3Å
427	Y	38.7	Very low	36.3	Very low	140 Å²	140	113.5 Å²	113.5	55%	0.549	64%	0.636	S	S	.	*	H	α-helix	trans	-63.8	-37.9	-176.5	-169	-102.3	0	0	0	113.8	L423 P424 E429 F430 I431	L423-Y427 HydrophobicContact CD2-CD1 3.84Å; L423-Y427 HydrophobicContact CD2-CE1 4.49Å; L423-Y427 HydrophobicContact CD2-CG 4.41Å; P424-Y427 PolarHBondContact O-N 3.1Å; P424-Y427 VanDerWaalsContact O-N 3.11Å; Y427-E429 VanDerWaalsContact C-N 3.3Å; Y427-E429 PolarHBondContact O-N 3.09Å; Y427-F430 PolarHBondContact O-N 3.16Å; Y427-I431 HydrophobicContact CD1-CD1 4.37Å; Y427-I431 HydrophobicContact CE1-CD1 3.75Å
428	L	35.1	Very low	35.6	Very low	118 Å²	118	118.5 Å²	118.5	62%	0.618	66%	0.658	S	S	*	*	H	α-helix	trans	-73.2	-16.4	179.7	-71.1	170	0	0	0	114	L423 G426 F430 T432	L423-L428 HydrophobicContact CD1-CD1 4.27Å; L423-L428 HydrophobicContact CD1-CG 4.45Å; G426-L428 PolarHBondContact O-N 3.02Å; L428-F430 VanDerWaalsContact C-N 3.32Å; L428-T432 WeakPolarHBondContact O-CG2 2.99Å; L428-T432 PolarHBondContact O-OG1 2.72Å
429	E	38.2	Very low	35.3	Very low	158 Å²	158	120.7 Å²	120.7	74%	0.738	67%	0.672	S	S	*	*	H	α-helix	trans	-77	-17.6	176.6	-63.2	-174.9	120.4	0	0	112.8	G426 Y427 T432	G426-E429 PolarHBondContact O-N 3.3Å; Y427-E429 VanDerWaalsContact C-N 3.3Å; Y427-E429 PolarHBondContact O-N 3.09Å; E429-T432 PolarHBondContact O-OG1 2.74Å
430	F	34.8	Very low	34.7	Very low	172 Å²	172	123.6 Å²	123.6	75%	0.754	68%	0.682	S	S	*	*	H	α-helix	trans	-85.2	-39.3	-177.8	-155.2	-95.9	0	0	0	112.7	Y427 L428 S433	Y427-F430 PolarHBondContact O-N 3.16Å; L428-F430 VanDerWaalsContact C-N 3.32Å; F430-S433 PolarHBondContact O-OG 3.49Å
431	I	36.2	Very low	34.1	Very low	111 Å²	111	120.3 Å²	120.3	57%	0.569	68%	0.681	S	S	*	*	H	α-helix	trans	-78.9	-23.3	-174	-60	176.9	0	0	0	111.9	Y427 S433	Y427-I431 HydrophobicContact CD1-CD1 4.37Å; Y427-I431 HydrophobicContact CE1-CD1 3.75Å; I431-S433 PolarHBondContact O-N 3.33Å
432	T	31.2	Very low	32.6	Very low	119 Å²	119	123 Å²	123	73%	0.73	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	11.8	-178.3	37.6	0	0	0	0	114.8	L428 E429	L428-T432 WeakPolarHBondContact O-CG2 2.99Å; L428-T432 PolarHBondContact O-OG1 2.72Å; E429-T432 PolarHBondContact O-OG1 2.74Å
433	S	28	Very low	31.8	Very low	78 Å²	78	128.5 Å²	128.5	55%	0.545	70%	0.703	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105.3	-8.2	-166.9	62.2	0	0	0	0	116.7	F430 I431	F430-S433 PolarHBondContact O-OG 3.49Å; I431-S433 PolarHBondContact O-N 3.33Å
434	N	29.2	Very low	31.1	Very low	144 Å²	144	129.9 Å²	129.9	77%	0.77	72%	0.719	S	S	*	*	S	Bend	trans	-139.8	102.3	-174.1	-78.3	-73.4	0	0	0	115
435	S	28.2	Very low	30.2	Very low	111 Å²	111	130.9 Å²	130.9	78%	0.776	73%	0.728	S	S	*	*			trans	38.8	116.6	153.8	-154.9	0	0	0	0	120.4
436	S	25.9	Very low	29.8	Very low	99 Å²	99	128.3 Å²	128.3	69%	0.692	72%	0.719	S	S	*	*			cis	101.3	155.1	30.4	85	0	0	0	0	115.3
437	V	30.1	Very low	28.7	Very low	135 Å²	135	131.9 Å²	131.9	82%	0.818	74%	0.738	S	S	*	*			trans	78.7	119.1	-179.5	-173.1	0	0	0	0	113.7
438	I	28.8	Very low	27.9	Very low	157 Å²	157	133.8 Å²	133.8	81%	0.805	75%	0.752	S	S	*	*			cis	-133.3	145.9	10.7	-51.1	175.2	0	0	0	110.7
439	P	27.8	Very low	27.4	Very low	111 Å²	111	133.7 Å²	133.7	72%	0.721	76%	0.756	S	S	*	*			trans	-119.8	166.5	176.8	42.2	-31.8	0	0	0	116.1
440	E	25	Very low	26.6	Very low	197 Å²	197	133.3 Å²	133.3	92%	0.921	76%	0.759	S	S	*	*			trans	158.5	138.9	151.4	-93.6	169.1	-152.6	0	0	108.1
441	A	28.9	Very low	26.1	Very low	85 Å²	85	132.4 Å²	132.4	70%	0.702	76%	0.762	S	S	*	*	S	Bend	cis	-148.9	156.1	-5.7	0	0	0	0	0	107.9
442	Q	22.3	Very low	25.4	Very low	179 Å²	179	132.3 Å²	132.3	84%	0.836	77%	0.771	S	S	*	*			cis	-144.8	126.6	3.7	-127.8	162.2	31	0	0	109.1
443	Y	25.9	Very low	25.2	Very low	242 Å²	242	129.9 Å²	129.9	95%	0.949	77%	0.77	S	S	*	*			trans	-147.9	119.3	178.3	-119.4	-95.1	0	0	0	106.2
444	S	26	Very low	25.1	Very low	101 Å²	101	135.3 Å²	135.3	71%	0.706	79%	0.787	S	S	*	*			trans	-157.9	99.2	-175.5	58.6	0	0	0	0	115.6
445	S	20	Very low	25.2	Very low	110 Å²	110	133.9 Å²	133.9	77%	0.769	79%	0.786	S	S	*	*			trans	29.5	120.4	134.3	61.4	0	0	0	0	122.5
446	A	21.8	Very low	25.1	Very low	89 Å²	89	138.2 Å²	138.2	74%	0.736	79%	0.786	S	S	*	*				77.2	158	121.5	0	0	0	0	0	122.3
447	S	21.7	Very low	25.1	Very low	114 Å²	114	138.6 Å²	138.6	80%	0.797	78%	0.781	S	S	*	*			trans	62.1	146.7	166.2	48.1	0	0	0	0	118.3
448	E	21.6	Very low	24.8	Very low	180 Å²	180	141.4 Å²	141.4	84%	0.841	78%	0.777	S	S	*	*			cis	-174.6	165.7	-26.5	-122.6	-179.8	-173.6	0	0	106.6
449	V	23.4	Very low	24.5	Very low	115 Å²	115	138.5 Å²	138.5	70%	0.697	76%	0.763	S	S	*	*			trans	71.3	115.3	169.5	-165.9	0	0	0	0	118.9
450	N	21.9	Very low	24.4	Very low	150 Å²	150	143.4 Å²	143.4	80%	0.802	77%	0.767	S	S	*	*			trans	36.3	129.2	148.8	-44.6	-18.5	0	0	0	120.3
451	D	24.3	Very low	24.4	Very low	154 Å²	154	139.6 Å²	139.6	82%	0.824	75%	0.752	S	S	*	*				-169.5	173.7	69	-154.2	-26.9	0	0	0	112.5
452	S	22.3	Very low	24.1	Very low	108 Å²	108	143.8 Å²	143.8	76%	0.755	76%	0.756	S	S	*	*			trans	-32	152.5	-178.1	44.6	0	0	0	0	124.4
453	G	26.6	Very low	24.2	Very low	69 Å²	69	138.9 Å²	138.9	71%	0.711	75%	0.747	S	S	*	*			trans	118.1	76.8	157	0	0	0	0	0	115.4
454	E	24.6	Very low	24.1	Very low	191 Å²	191	135.9 Å²	135.9	89%	0.893	74%	0.741	S	S	*	*				47.1	136.1	93.5	-71.2	-157.3	155.8	0	0	116.6
455	P	31.2	Very low	24	Very low	115 Å²	115	137.3 Å²	137.3	75%	0.747	75%	0.745	S	S	*	*			cis	-128.4	-162.2	5.2	45.7	-28.2	0	0	0	111.8
456	Y	26.8	Very low	24.1	Very low	201 Å²	201	137.6 Å²	137.6	79%	0.788	75%	0.746	S	S	*	*			cis	-148.7	-73	1.7	-152.8	3.2	0	0	0	116.4
457	N	26.5	Very low	24.1	Very low	107 Å²	107	138.4 Å²	138.4	57%	0.572	75%	0.747	S	S	*	*			trans	-175.8	166.4	-148.6	-92.6	-33.7	0	0	0	112.5
458	R	23.9	Very low	24.2	Very low	195 Å²	195	138.2 Å²	138.2	74%	0.736	75%	0.745	S	S	*	*			cis	176	150	-32.5	-124.3	-164.6	159.2	106	4.5	111.3
459	D	23.1	Very low	24.3	Very low	96 Å²	96	138 Å²	138	51%	0.513	74%	0.744	S	S	.	*			trans	38.6	131.8	136.6	-61.8	1.1	0	0	0	122.8
460	R	24.3	Very low	24.5	Very low	213 Å²	213	139.8 Å²	139.8	80%	0.804	75%	0.748	S	S	*	*			trans	76.7	157.5	137.1	-75.7	-179.1	168.7	120.2	0.3	120.2
461	I	24.7	Very low	25	Very low	118 Å²	118	138.1 Å²	138.1	61%	0.605	75%	0.745	S	S	*	*			cis	-175.2	145.9	-29.8	-131	175.5	0	0	0	105.9
462	E	22.8	Very low	25	Very low	172 Å²	172	138.4 Å²	138.4	80%	0.804	74%	0.74	S	S	*	*			trans	57.1	149.1	163.4	-70.7	155.1	-133.9	0	0	119.1
463	A	24.9	Very low	25.3	Very low	76 Å²	76	139.7 Å²	139.7	63%	0.628	73%	0.734	S	S	*	*			cis	-160.1	152	-7.8	0	0	0	0	0	111.3
464	H	24.2	Very low	24.9	Very low	179 Å²	179	138.4 Å²	138.4	83%	0.829	71%	0.713	S	S	*	*			trans	20.3	132	159.1	-46.3	-69.1	0	0	0	120
465	T	23.7	Very low	24.9	Very low	131 Å²	131	136 Å²	136	80%	0.804	70%	0.702	S	S	*	*				-167.9	124.2	60.4	-57.1	0	0	0	0	113.9
466	C	21.8	Very low	24.4	Very low	116 Å²	116	139.7 Å²	139.7	78%	0.784	70%	0.702	S	S	*	*			trans	21.6	120.8	150.8	-165.4	0	0	0	0	122.7
467	S	21.5	Very low	24.2	Very low	107 Å²	107	135 Å²	135	75%	0.748	70%	0.699	S	S	*	*			trans	-177.7	155.2	133.5	-80.2	0	0	0	0	113.3
468	S	24.9	Very low	23.9	Very low	109 Å²	109	136.4 Å²	136.4	76%	0.762	70%	0.702	S	S	*	*			trans	60	118.3	172.3	46.6	0	0	0	0	117.9
469	E	23.6	Very low	23.8	Very low	177 Å²	177	134.6 Å²	134.6	83%	0.827	70%	0.699	S	S	*	*				80.3	111.1	52.8	-72.5	-176.1	-147.4	0	0	112.7
470	I	26.4	Very low	23.7	Very low	152 Å²	152	134.4 Å²	134.4	78%	0.779	71%	0.706	S	S	*	*			cis	-163.6	155	44.2	-108.2	152.1	0	0	0	111
471	P	33.6	Very low	23.5	Very low	114 Å²	114	131.9 Å²	131.9	74%	0.74	70%	0.703	S	S	*	*			trans	-119	168.4	-147.4	40.8	-30.2	0	0	0	116.9
472	K	24	Very low	23.4	Very low	161 Å²	161	133.6 Å²	133.6	70%	0.7	71%	0.708	S	S	*	*			trans	-152	147.3	175.7	-63	-177.8	-176.8	162.5	0	110.6	S1989	K472-S1989 WeakPolarHBondContact CG-O 3.29Å
473	E	27.4	Very low	23.3	Very low	135 Å²	135	130.3 Å²	130.3	63%	0.631	70%	0.7	S	S	*	*			trans	121.3	129.6	155.1	-64.9	-160.9	83.1	0	0	120.1	R1991	E473-R1991 VanDerWaalsContact CB-NH1 3.27Å; E473-R1991 VanDerWaalsContact CG-NH1 3.29Å; E473-R1991 IonicContact OE1-CZ 3.32Å; E473-R1991 IonicContact OE1-NH1 3.46Å; E473-R1991 PolarHBondContact OE1-NH1 2.68Å; E473-R1991 IonicContact OE1-NH2 2.67Å; E473-R1991 PolarHBondContact OE1-NH2 3.39Å
474	C	19.6	Very low	23.3	Very low	42 Å²	42	133.5 Å²	133.5	28%	0.284	70%	0.7	S	S	.	*			trans	-37.6	161.4	154.5	-93.1	0	0	0	0	115.2	R1991 K1992	C474-R1991 HydrophobicContact CB-CB 4.29Å; C474-R1991 HydrophobicContact CB-CG 4.37Å; C474-R1991 WeakPolarHBondContact SG-CB 3.35Å; C474-R1991 VanDerWaalsContact SG-CD 3.53Å; C474-K1992 VanDerWaalsContact SG-CD 3.51Å; C474-K1992 WeakPolarHBondContact SG-CE 3.26Å; C474-K1992 VanDerWaalsContact SG-CG 3.54Å
475	Q	24.1	Very low	23.2	Very low	139 Å²	139	134.6 Å²	134.6	65%	0.65	70%	0.698	S	S	*	*				-150.6	-173.7	63.2	-88.7	-168.2	95.6	0	0	116.3
476	Y	20.8	Very low	23.2	Very low	194 Å²	194	136.5 Å²	136.5	76%	0.761	70%	0.698	S	S	*	*			trans	-117.3	132	171.1	-98.4	-141.1	0	0	0	107.2	K1992	Y476-K1992 VanDerWaalsContact CB-NZ 3.3Å; Y476-K1992 HydrophobicContact CD2-CD 4.2Å; Y476-K1992 HydrophobicContact CE2-CD 4.29Å; Y476-K1992 VanDerWaalsContact CG-NZ 3.26Å
477	S	22.1	Very low	23.3	Very low	103 Å²	103	134.6 Å²	134.6	72%	0.72	69%	0.691	S	S	*	*			trans	-165	135.7	159.8	41.3	0	0	0	0	105.2
478	E	21.4	Very low	23.4	Very low	136 Å²	136	137 Å²	137	64%	0.636	70%	0.695	S	S	*	*				55.5	117.5	65.3	-61	-174.6	-142	0	0	109.5
479	K	21.5	Very low	23.4	Very low	156 Å²	156	138.2 Å²	138.2	68%	0.678	70%	0.697	S	S	*	*			cis	-158.4	-177.5	25.5	-113.4	151.1	-177.4	136.4	0	114
480	S	20.1	Very low	23.6	Very low	93 Å²	93	134.1 Å²	134.1	65%	0.65	69%	0.689	S	S	*	*			trans	-38.7	165.4	162.3	51.4	0	0	0	0	115.5
481	E	21.1	Very low	23.5	Very low	159 Å²	159	131.6 Å²	131.6	74%	0.743	68%	0.68	S	S	*	*			cis	-152.6	163.2	45.7	-74.3	176.1	172.1	0	0	115.6
482	E	21.8	Very low	23.2	Very low	154 Å²	154	131.3 Å²	131.3	72%	0.72	68%	0.681	S	S	*	*			trans	27.6	137.5	146.1	-59.2	-168	-176.2	0	0	121.3
483	T	22	Very low	23.2	Very low	103 Å²	103	130.9 Å²	130.9	63%	0.632	68%	0.681	S	S	*	*				-167.1	131.9	76.3	28.5	0	0	0	0	116.8
484	K	22.9	Very low	23.2	Very low	143 Å²	143	133.4 Å²	133.4	62%	0.622	69%	0.69	S	S	*	*			trans	66.5	135	131.2	-62.9	165.2	-176.6	149.3	0	122.3
485	Y	23.5	Very low	23.7	Very low	202 Å²	202	140.9 Å²	140.9	79%	0.792	72%	0.718	S	S	*	*			trans	67.8	134.4	158.6	-50.9	-46.6	0	0	0	116.7
486	E	23.9	Very low	23.7	Very low	172 Å²	172	141.8 Å²	141.8	80%	0.804	72%	0.722	S	S	*	*			cis	-142.2	127.3	-0.5	-105.9	155.9	-151.6	0	0	106.7
487	A	23.9	Very low	24.1	Very low	76 Å²	76	138.5 Å²	138.5	63%	0.628	72%	0.717	S	S	*	*				89.2	129.9	71.4	0	0	0	0	0	114.2
488	N	23.9	Very low	24.3	Very low	158 Å²	158	141 Å²	141	85%	0.845	72%	0.722	S	S	*	*			trans	71.6	144.7	166.5	-52.6	-32.4	0	0	0	117.7
489	V	23.9	Very low	24.6	Very low	133 Å²	133	139.3 Å²	139.3	81%	0.806	72%	0.716	S	S	*	*			cis	-167.6	154.9	-27.4	93.1	0	0	0	0	105.5
490	S	28.2	Very low	24.8	Very low	92 Å²	92	139.8 Å²	139.8	64%	0.643	73%	0.725	S	S	*	*			cis	-143.7	162.3	5.1	63.3	0	0	0	0	107.6
491	V	24.4	Very low	25	Very low	99 Å²	99	144 Å²	144	60%	0.6	73%	0.732	S	S	*	*			cis	78.3	91.6	22.6	-170.3	0	0	0	0	115.4	E493	V491-E493 HydrophobicContact CG1-CG 4.1Å
492	S	26.4	Very low	25.2	Very low	107 Å²	107	143.4 Å²	143.4	75%	0.748	73%	0.734	S	S	*	*			trans	-178.2	95.2	140.5	35.3	0	0	0	0	107.6
493	E	24.1	Very low	25.4	Very low	153 Å²	153	143.8 Å²	143.8	72%	0.715	74%	0.735	S	S	*	*				59.4	107.9	62.1	-52.7	176.7	154.8	0	0	113.5	V491	V491-E493 HydrophobicContact CG1-CG 4.1Å
494	K	27.6	Very low	25.6	Very low	188 Å²	188	145.4 Å²	145.4	82%	0.817	75%	0.745	S	S	*	*				-177.7	151.1	122.4	-99.4	153.2	-173.2	169.9	0	112.1
495	K	29.7	Very low	25.7	Very low	198 Å²	198	144.1 Å²	144.1	86%	0.861	75%	0.753	S	S	*	*			trans	66.9	92.6	-178.2	-52.8	-173.8	-179.2	-172.5	0	113.6
496	E	25.3	Very low	25.8	Very low	158 Å²	158	141.2 Å²	141.2	74%	0.738	75%	0.751	S	S	*	*			cis	67.1	131.7	13.6	-136.5	-174.8	-167	0	0	114.3
497	L	27.4	Very low	26	Very low	125 Å²	125	138.3 Å²	138.3	65%	0.654	75%	0.75	S	S	*	*			trans	61.3	87.3	163.6	-59.4	148	0	0	0	117.7	I499	L497-I499 HydrophobicContact CD2-CD1 3.64Å; L497-I499 HydrophobicContact CD2-CG1 4.09Å
498	D	27.2	Very low	26	Very low	155 Å²	155	141.1 Å²	141.1	83%	0.829	76%	0.759	S	S	*	*				-146.9	121.1	97.5	-93.6	-32.3	0	0	0	107.4
499	I	27.3	Very low	26	Very low	101 Å²	101	140.3 Å²	140.3	52%	0.518	75%	0.748	S	S	.	*				78.5	92.2	55.5	-60.3	174.6	0	0	0	112.9	L497 K501	L497-I499 HydrophobicContact CD2-CD1 3.64Å; L497-I499 HydrophobicContact CD2-CG1 4.09Å; I499-K501 PolarHBondContact O-N 2.92Å
500	L	25.6	Very low	26.1	Very low	166 Å²	166	140.5 Å²	140.5	87%	0.869	74%	0.74	S	S	*	*				22.8	86.4	128.7	-61.1	170.7	0	0	0	117.1
501	K	25.4	Very low	25.9	Very low	181 Å²	181	142.2 Å²	142.2	79%	0.787	75%	0.747	S	S	*	*			trans	-172.3	146.4	154	-94	134.9	-176.1	-175.7	0	107.8	I499	I499-K501 PolarHBondContact O-N 2.92Å
502	L	25.3	Very low	26	Very low	148 Å²	148	145.5 Å²	145.5	78%	0.775	76%	0.758	S	S	*	*			cis	-153.8	158	-11.9	-128.6	175.6	0	0	0	109
503	E	26	Very low	25.9	Very low	161 Å²	161	145.9 Å²	145.9	75%	0.752	75%	0.75	S	S	*	*			trans	-66.1	165.2	156.8	-62.5	153.5	128.9	0	0	109.8
504	V	25	Very low	26.1	Very low	138 Å²	138	141.5 Å²	141.5	84%	0.836	73%	0.731	S	S	*	*			trans	68.3	106.7	171.5	-168.8	0	0	0	0	116.2
505	S	26.2	Very low	26	Very low	115 Å²	115	135.3 Å²	135.3	80%	0.804	71%	0.712	S	S	*	*				-175.4	115.5	110.2	29.7	0	0	0	0	112.3
506	L	25.4	Very low	25.8	Very low	141 Å²	141	129.3 Å²	129.3	74%	0.738	70%	0.699	S	S	*	*	S	Bend	trans	-69.8	162.2	142.7	-105.6	170.4	0	0	0	108.7	V508	L506-V508 PolarHBondContact O-N 2.81Å; L506-V508 VanDerWaalsContact O-N 3.08Å
507	S	27	Very low	25.8	Very low	112 Å²	112	128.9 Å²	128.9	78%	0.783	70%	0.702	S	S	*	*			trans	-44.4	112.2	169.2	-178.9	0	0	0	0	112.7
508	V	24	Very low	25.9	Very low	134 Å²	134	131.6 Å²	131.6	81%	0.812	71%	0.709	S	S	*	*			trans	-112.6	100.7	150.2	178.7	0	0	0	0	107	L506	L506-V508 PolarHBondContact O-N 2.81Å; L506-V508 VanDerWaalsContact O-N 3.08Å
509	K	24.7	Very low	26	Very low	142 Å²	142	130.7 Å²	130.7	62%	0.617	70%	0.704	S	S	*	*			trans	30.5	122.5	137.6	-80.2	173.7	149.1	-74.7	0	119
510	E	25.1	Very low	26	Very low	137 Å²	137	132.7 Å²	132.7	64%	0.64	71%	0.711	S	S	*	*				72.8	105.5	126.3	-65.9	157.1	168.4	0	0	119.4
511	T	25.1	Very low	26.4	Very low	128 Å²	128	129.9 Å²	129.9	79%	0.785	70%	0.702	S	S	*	*			trans	74.6	131.2	132.6	57.1	0	0	0	0	121.1	I513	T511-I513 PolarHBondContact O-N 2.98Å
512	M	25.5	Very low	26.3	Very low	168 Å²	168	126.6 Å²	126.6	83%	0.828	69%	0.693	S	S	*	*			trans	-65.7	116.4	160.9	-62.7	157.3	58.1	0	0	110.7
513	I	25.9	Very low	26.5	Very low	115 Å²	115	127 Å²	127	59%	0.59	70%	0.695	S	S	*	*			trans	-125.8	90.7	146.1	-65.6	-172.6	0	0	0	105.7	T511	T511-I513 PolarHBondContact O-N 2.98Å
514	N	26.5	Very low	26.5	Very low	60 Å²	60	126.2 Å²	126.2	32%	0.321	69%	0.692	S	S	.	*				70.8	132.5	91.4	-71.8	-43.9	0	0	0	112.1	E1705 V1706 N1707	N514-E1705 WeakPolarHBondContact ND2-CA 3.47Å; N514-E1705 PolarHBondContact ND2-N 2.85Å; N514-V1706 HydrophobicContact CB-CG2 4.27Å; N514-N1707 WeakPolarHBondContact O-CA 3.42Å; N514-N1707 PolarHBondContact O-N 3.17Å; N514-N1707 PolarHBondContact O-OD1 3.15Å; N514-N1707 VanDerWaalsContact O-OD1 3.11Å
515	S	25.7	Very low	26.5	Very low	58 Å²	58	126.9 Å²	126.9	41%	0.406	69%	0.689	S	S	.	*			cis	-171.7	-173.4	-0.7	59.7	0	0	0	0	109.4	N1707	S515-N1707 PolarHBondContact N-OD1 2.89Å; S515-N1707 PolarHBondContact OG-OD1 3.16Å
516	A	26.8	Very low	26.5	Very low	73 Å²	73	125 Å²	125	60%	0.603	68%	0.68	S	S	*	*			trans	72.2	140.1	156.1	0	0	0	0	0	118.7
517	N	25.5	Very low	26.4	Very low	149 Å²	149	122.5 Å²	122.5	80%	0.797	68%	0.675	S	S	*	*			cis	-164.3	171.5	-13.8	-111	-25.8	0	0	0	110
518	K	28	Very low	26.2	Very low	182 Å²	182	124 Å²	124	79%	0.791	67%	0.674	S	S	*	*			trans	81.9	127.7	169.1	-55.9	-169.2	-178.1	-177.2	0	116.1
519	D	29.5	Very low	26.2	Very low	135 Å²	135	123.5 Å²	123.5	72%	0.722	67%	0.671	S	S	*	*			cis	-141.1	127.3	-5.6	-76.3	-43	0	0	0	106.2
520	E	28.8	Very low	26.2	Very low	143 Å²	143	125.5 Å²	125.5	67%	0.668	68%	0.68	S	S	*	*				67.1	147.4	81.2	-87.5	-98	114.6	0	0	114.8	N522	E520-N522 PolarHBondContact OE1-ND2 2.79Å
521	P	32.3	Very low	26.1	Very low	107 Å²	107	125.6 Å²	125.6	70%	0.695	69%	0.685	S	S	*	*			cis	-117.9	162.2	-15.6	33.1	-15.6	0	0	0	112.5
522	N	24.8	Very low	26.4	Very low	112 Å²	112	125.4 Å²	125.4	60%	0.599	68%	0.684	S	S	*	*			cis	87.7	115	30.9	-67.9	-22.5	0	0	0	116.3	E520	E520-N522 PolarHBondContact OE1-ND2 2.79Å
523	L	29.4	Very low	26.5	Very low	156 Å²	156	125.6 Å²	125.6	82%	0.817	68%	0.683	S	S	*	*			trans	178.3	92.6	162	-105.6	156.4	0	0	0	105.8
524	E	24.4	Very low	26.6	Very low	146 Å²	146	124.6 Å²	124.6	68%	0.682	69%	0.686	S	S	*	*				72	138.6	55.9	-57.6	-166.7	150.4	0	0	114.9
525	I	26.1	Very low	26.7	Very low	152 Å²	152	129.3 Å²	129.3	78%	0.779	71%	0.711	S	S	*	*			trans	70.4	140.2	163.5	-57.4	144.5	0	0	0	115.4
526	A	25.5	Very low	26.9	Very low	74 Å²	74	132.2 Å²	132.2	61%	0.612	73%	0.732	S	S	*	*			cis	-171.2	178.3	-27.7	0	0	0	0	0	108
527	S	24.3	Very low	26.9	Very low	90 Å²	90	137.5 Å²	137.5	63%	0.629	74%	0.744	S	S	*	*			trans	55.5	111	148.2	63.2	0	0	0	0	120.2
528	N	23.2	Very low	26.7	Very low	144 Å²	144	135.9 Å²	135.9	77%	0.77	74%	0.744	S	S	*	*			trans	70.4	135.3	139.9	-45.7	-21.4	0	0	0	119.2
529	T	22.5	Very low	26.6	Very low	122 Å²	122	133.8 Å²	133.8	75%	0.748	74%	0.741	S	S	*	*			trans	63	118.3	153.6	45.4	0	0	0	0	120.6
530	F	24.9	Very low	26.2	Very low	184 Å²	184	135.1 Å²	135.1	81%	0.807	75%	0.747	S	S	*	*			trans	64.7	136.6	148.7	-75.2	-100.4	0	0	0	121.8
531	D	24.3	Very low	25.9	Very low	139 Å²	139	134.4 Å²	134.4	74%	0.743	75%	0.752	S	S	*	*			trans	71.3	130.5	142.2	-70.1	-29.2	0	0	0	125.7
532	V	30.4	Very low	25.7	Very low	124 Å²	124	137.4 Å²	137.4	75%	0.752	76%	0.755	S	S	*	*			trans	94.4	120.8	133.9	164.8	0	0	0	0	124.4
533	E	26.8	Very low	25.6	Very low	173 Å²	173	140 Å²	140	81%	0.808	76%	0.763	S	S	*	*			trans	58.3	101.1	146.9	-71.8	-171.6	164.2	0	0	127.1
534	S	29.3	Very low	25.5	Very low	94 Å²	94	139.3 Å²	139.3	66%	0.657	76%	0.759	S	S	*	*				97.9	149.8	107.9	83.8	0	0	0	0	124
535	N	27.3	Very low	25.6	Very low	159 Å²	159	139.5 Å²	139.5	85%	0.85	76%	0.764	S	S	*	*			trans	68.3	94.6	161.5	-66.2	-48	0	0	0	119.7
536	S	30	Very low	25.6	Very low	119 Å²	119	140 Å²	140	83%	0.832	77%	0.769	S	S	*	*			trans	-141.2	146.2	179.6	49.3	0	0	0	0	112.2
537	Q	26.8	Very low	25.7	Very low	184 Å²	184	140.5 Å²	140.5	86%	0.86	77%	0.773	S	S	*	*			trans	-148.1	123.4	174.6	-77	-166.8	-11.5	0	0	112.4
538	S	23	Very low	25.8	Very low	115 Å²	115	142.9 Å²	142.9	80%	0.804	78%	0.779	S	S	*	*			trans	64	159.5	173.5	80.4	0	0	0	0	115
539	L	24.2	Very low	26	Very low	138 Å²	138	142.1 Å²	142.1	72%	0.723	77%	0.774	S	S	*	*			cis	-151.8	127.4	9.5	-147.4	153.2	0	0	0	109.7
540	L	21.1	Very low	26.2	Very low	162 Å²	162	144.9 Å²	144.9	85%	0.848	78%	0.779	S	S	*	*			trans	46.9	94	172.4	-72.8	169.6	0	0	0	118.3
541	T	24.1	Very low	26.4	Very low	128 Å²	128	142 Å²	142	79%	0.785	78%	0.776	S	S	*	*			trans	-153.1	144.3	150.1	4.8	0	0	0	0	111.6
542	K	27.2	Very low	26.6	Very low	171 Å²	171	141.9 Å²	141.9	74%	0.743	78%	0.776	S	S	*	*			trans	17.4	120.7	141.7	-60.3	173.8	-175.5	-177.2	0	117.2
543	E	23.7	Very low	26.6	Very low	167 Å²	167	143.5 Å²	143.5	78%	0.78	78%	0.779	S	S	*	*				74.6	122.6	66.2	-71.2	-179.5	143.6	0	0	114.4
544	I	25.9	Very low	26.6	Very low	141 Å²	141	139.5 Å²	139.5	72%	0.723	78%	0.775	S	S	*	*			trans	87.1	150.8	150.2	-65.1	160.5	0	0	0	118.6
545	D	27.1	Very low	26.4	Very low	149 Å²	149	142.5 Å²	142.5	80%	0.797	78%	0.784	S	S	*	*			trans	85	152.9	172.4	-62.6	-28.8	0	0	0	121.9
546	D	25.7	Very low	26.6	Very low	162 Å²	162	139.8 Å²	139.8	87%	0.866	78%	0.778	S	S	*	*			trans	-114.2	179.8	-146.8	-80.3	-65.8	0	0	0	116.5
547	A	27.9	Very low	26.3	Very low	85 Å²	85	141.6 Å²	141.6	70%	0.702	78%	0.778	S	S	*	*			trans	-16.8	147.9	170.8	0	0	0	0	0	122.9
548	D	27	Very low	26.2	Very low	140 Å²	140	139 Å²	139	75%	0.749	78%	0.775	S	S	*	*				-176.5	149.2	117.7	-103.3	-10.2	0	0	0	116
549	N	26	Very low	26.3	Very low	128 Å²	128	140.6 Å²	140.6	68%	0.684	77%	0.774	S	S	*	*			trans	26	154	139.3	-46.9	-42.7	0	0	0	122
550	E	26.8	Very low	26	Very low	180 Å²	180	142.9 Å²	142.9	84%	0.841	78%	0.781	S	S	*	*			cis	-163.2	-156.1	4.8	-135.5	177.9	179.7	0	0	111.8
551	V	29.1	Very low	26.2	Very low	123 Å²	123	140.3 Å²	140.3	75%	0.745	78%	0.776	S	S	*	*			trans	101.8	96.4	158.5	-170.6	0	0	0	0	121.1
552	D	29.1	Very low	26.1	Very low	138 Å²	138	139.1 Å²	139.1	74%	0.738	77%	0.772	S	S	*	*				63.8	127.2	126.7	-64.4	-11.3	0	0	0	129.3
553	L	30.3	Very low	25.9	Very low	158 Å²	158	135.5 Å²	135.5	83%	0.827	77%	0.769	S	S	*	*			trans	63.7	103.4	133.9	-82.6	78.9	0	0	0	124.4
554	A	26.9	Very low	26.1	Very low	88 Å²	88	132.8 Å²	132.8	73%	0.727	76%	0.763	S	S	*	*			trans	-41.3	144.6	159.8	0	0	0	0	0	120.4
555	N	25.6	Very low	26.1	Very low	158 Å²	158	135.1 Å²	135.1	85%	0.845	77%	0.768	S	S	*	*				-174.3	158	120.6	-103.1	-62.1	0	0	0	115.2
556	S	30.3	Very low	25.9	Very low	101 Å²	101	136.1 Å²	136.1	71%	0.706	77%	0.773	S	S	*	*			trans	65.2	86.6	158.9	55.3	0	0	0	0	123.1
557	N	23.6	Very low	25.9	Very low	158 Å²	158	131.5 Å²	131.5	85%	0.845	76%	0.764	S	S	*	*				60.1	131.3	118.8	-70.5	-1	0	0	0	125.1
558	V	25.9	Very low	25.7	Very low	130 Å²	130	133.1 Å²	133.1	79%	0.788	77%	0.77	S	S	*	*			trans	79.6	133	150.8	173.9	0	0	0	0	118.5
559	N	24.6	Very low	25.5	Very low	147 Å²	147	132.2 Å²	132.2	79%	0.786	77%	0.769	S	S	*	*			cis	-179.1	106.4	-43.5	-107.3	9.8	0	0	0	108.1
560	E	19	Very low	25.3	Very low	186 Å²	186	133.1 Å²	133.1	87%	0.869	77%	0.773	S	S	*	*			trans	-170.3	-174.1	148	-128.5	-169.4	-159.9	0	0	114.3
561	C	23.6	Very low	25.1	Very low	109 Å²	109	130.3 Å²	130.3	74%	0.736	77%	0.768	S	S	*	*	S	Bend	trans	-25.5	147.7	161	-166.4	0	0	0	0	117.3
562	S	22.7	Very low	24.8	Very low	103 Å²	103	131.5 Å²	131.5	72%	0.72	77%	0.77	S	S	*	*			trans	63	146.3	-166.1	88.4	0	0	0	0	111.1
563	S	24	Very low	24.6	Very low	95 Å²	95	132.9 Å²	132.9	66%	0.664	77%	0.769	S	S	*	*			cis	174.8	-176.5	-5.9	49.4	0	0	0	0	103.5
564	V	26.4	Very low	24.3	Very low	110 Å²	110	134 Å²	134	67%	0.667	77%	0.767	S	S	*	*			trans	69.1	115.5	166.7	-176.4	0	0	0	0	116.6
565	K	25.8	Very low	24.3	Very low	190 Å²	190	137 Å²	137	83%	0.826	77%	0.77	S	S	*	*			trans	25.1	123.1	141.4	-45.7	171.5	-172.8	-179.2	0	118.5
566	N	22.9	Very low	24.3	Very low	170 Å²	170	136.1 Å²	136.1	91%	0.909	76%	0.763	S	S	*	*			trans	-147.4	151.1	151	-87	-57	0	0	0	109.7
567	G	27.1	Very low	24.1	Very low	65 Å²	65	137.5 Å²	137.5	67%	0.67	76%	0.762	S	S	*	*			trans	-108.9	136.7	-175.7	0	0	0	0	0	113.8
568	S	23.6	Very low	24.2	Very low	119 Å²	119	137 Å²	137	83%	0.832	75%	0.754	S	S	*	*			trans	69.4	169	162.9	77.2	0	0	0	0	119.3
569	V	21.4	Very low	24.2	Very low	120 Å²	120	137 Å²	137	73%	0.727	75%	0.745	S	S	*	*			trans	75.5	104.9	165	-176.7	0	0	0	0	119
570	I	22.5	Very low	24.4	Very low	148 Å²	148	133.8 Å²	133.8	76%	0.759	73%	0.731	S	S	*	*			trans	66.3	100	144.1	-62.1	175.2	0	0	0	117.6
571	T	21.7	Very low	24.7	Very low	121 Å²	121	128.8 Å²	128.8	74%	0.742	71%	0.711	S	S	*	*				80.9	106.5	84.6	-57.9	0	0	0	0	116.4
572	L	23	Very low	24.8	Very low	148 Å²	148	126.8 Å²	126.8	78%	0.775	70%	0.702	S	S	*	*			trans	30.9	137.3	139.6	-80.5	162.2	0	0	0	122.8
573	K	25.5	Very low	25	Very low	166 Å²	166	127.2 Å²	127.2	72%	0.722	71%	0.705	S	S	*	*			trans	91.2	107.8	150	-68.2	161.2	-179.7	172	0	120.6
574	K	24.7	Very low	25	Very low	183 Å²	183	129 Å²	129	80%	0.796	71%	0.711	S	S	*	*			trans	70.2	128.8	134.5	-54.3	173.4	176.7	-174.5	0	120.6
575	L	26.2	Very low	25	Very low	149 Å²	149	131 Å²	131	78%	0.78	72%	0.715	S	S	*	*				163	133.3	104.1	-82.4	-179.3	0	0	0	115.5
576	M	26	Very low	24.8	Very low	141 Å²	141	129.8 Å²	129.8	70%	0.695	71%	0.712	S	S	*	*			trans	77.3	111.5	137.1	-61.9	168.4	70.1	0	0	125.9
577	D	26	Very low	24.8	Very low	130 Å²	130	125.8 Å²	125.8	70%	0.695	70%	0.703	S	S	*	*				72	144.4	112.3	-49	-20.8	0	0	0	126.6
578	H	26.1	Very low	24.6	Very low	148 Å²	148	126.9 Å²	126.9	69%	0.685	69%	0.691	S	S	*	*			trans	66.1	177.9	167.9	-83.1	-122	0	0	0	117.6	K599	H578-K599 PolarHBondContact O-NZ 3.28Å
579	E	25.9	Very low	24.7	Very low	128 Å²	128	125 Å²	125	60%	0.598	67%	0.672	S	S	*	*			cis	-151.3	-179.8	-42.6	-119.4	-173.3	-68.9	0	0	107.5	K599	E579-K599 VanDerWaalsContact O-CD 3.28Å; E579-K599 WeakPolarHBondContact O-CD 3.42Å
580	V	28.5	Very low	24.8	Very low	80 Å²	80	124.7 Å²	124.7	49%	0.485	67%	0.666	S	S	.	*			cis	-154.2	-173.8	-17.2	68.4	0	0	0	0	108.9	S598 K599	V580-S598 CarbonylContact O-C 3.58Å; V580-S598 VanDerWaalsContact O-CB 3.27Å; V580-S598 WeakPolarHBondContact O-CB 3.42Å; V580-S598 PolarHBondContact O-OG 3.14Å; V580-K599 WeakPolarHBondContact O-CB 3.25Å
581	N	25	Very low	26	Very low	82 Å²	82	123 Å²	123	44%	0.439	66%	0.663	S	S	.	*			trans	-131.5	158	-139.7	-63.4	1.9	0	0	0	121.1	C600	N581-C600 WeakPolarHBondContact CB-O 3.43Å; N581-C600 PolarHBondContact ND2-O 3.42Å; N581-C600 PolarHBondContact OD1-N 2.9Å
582	A	26.5	Very low	26.4	Very low	67 Å²	67	123.8 Å²	123.8	55%	0.554	66%	0.662	S	S	*	*			trans	93.9	121.4	139.5	0	0	0	0	0	127.1	K599	A582-K599 PolarHBondContact N-O 3.38Å
583	S	25.7	Very low	26.5	Very low	112 Å²	112	122.6 Å²	122.6	78%	0.783	66%	0.661	S	S	*	*			trans	94.9	154.8	136.7	79.8	0	0	0	0	124.9
584	V	25.1	Very low	26.7	Very low	132 Å²	132	120.2 Å²	120.2	80%	0.8	66%	0.66	S	S	*	*			trans	70.1	122.8	172.4	-172.5	0	0	0	0	115.5
585	M	25.2	Very low	26.6	Very low	151 Å²	151	119.9 Å²	119.9	74%	0.744	66%	0.659	S	S	*	*			cis	94.4	128.3	43.8	-91.8	-167.4	73.8	0	0	115.9
586	E	21.6	Very low	26.6	Very low	165 Å²	165	118.1 Å²	118.1	77%	0.771	66%	0.655	S	S	*	*			trans	47.7	105.7	161.8	-64.9	-179.4	179.8	0	0	119.6
587	A	24.5	Very low	26.4	Very low	87 Å²	87	118.6 Å²	118.6	72%	0.719	66%	0.66	S	S	*	*				51.2	139	123.7	0	0	0	0	0	119.2
588	E	22.8	Very low	26.1	Very low	88 Å²	88	116 Å²	116	41%	0.411	65%	0.652	S	S	.	*				-176.4	153.2	57.1	-79.3	-171.8	106.3	0	0	110.3	S619 T620 T621	E588-S619 VanDerWaalsContact CB-O 3.25Å; E588-S619 WeakPolarHBondContact CB-O 3.36Å; E588-S619 VanDerWaalsContact CD-C 3.44Å; E588-S619 WeakPolarHBondContact OE2-CA 3.4Å; E588-T620 VanDerWaalsContact CB-N 3.33Å; E588-T620 VanDerWaalsContact CD-CA 3.42Å; E588-T620 WeakPolarHBondContact OE1-CA 3.5Å; E588-T620 PolarHBondContact OE1-N 2.91Å; E588-T620 PolarHBondContact OE2-N 2.9Å; E588-T621 PolarHBondContact OE1-N 3.28Å
589	N	24.3	Very low	25.9	Very low	79 Å²	79	114.8 Å²	114.8	42%	0.422	65%	0.645	S	S	.	*			trans	51.4	138.3	165.5	-115.5	6.4	0	0	0	122.4	T620 T621	N589-T620 WeakPolarHBondContact CA-O 3.2Å; N589-T620 WeakPolarHBondContact CB-O 3.42Å; N589-T620 WeakPolarHBondContact CB-OG1 3.36Å; N589-T620 PolarHBondContact N-O 3.2Å; N589-T620 VanDerWaalsContact N-O 3.11Å; N589-T620 WeakPolarHBondContact ND2-CB 3.4Å; N589-T620 PolarHBondContact ND2-OG1 2.91Å; N589-T620 PolarHBondContact OD1-O 3.28Å; N589-T621 PolarHBondContact N-OG1 3.46Å
590	N	23.1	Very low	25.6	Very low	114 Å²	114	111.8 Å²	111.8	61%	0.61	64%	0.637	S	S	*	*	S	Bend	cis	-123.7	-73.8	-7.9	-172.6	-100.3	0	0	0	114.2
591	T	49.5	Very low	25.2	Very low	113 Å²	113	116 Å²	116	69%	0.693	65%	0.651	S	S	*	*	S	Bend	cis	51.3	65.3	-7.4	-30.6	0	0	0	0	118.3
592	D	29	Very low	25	Very low	136 Å²	136	120.2 Å²	120.2	73%	0.727	67%	0.668	S	S	*	*				-166.7	144.5	108.6	-100.1	-7	0	0	0	109.5
593	V	24.4	Very low	24.8	Very low	123 Å²	123	122 Å²	122	75%	0.745	67%	0.673	S	S	*	*			trans	56.9	110.7	162.3	-177.9	0	0	0	0	117.2
594	V	29.7	Very low	24.6	Very low	117 Å²	117	123.5 Å²	123.5	71%	0.709	67%	0.667	S	S	*	*				74.2	132.6	57.4	-169.1	0	0	0	0	115.4
595	F	22.9	Very low	24.5	Very low	176 Å²	176	125.3 Å²	125.3	77%	0.772	66%	0.664	S	S	*	*			trans	112.5	102.5	161.5	-67.7	-73.8	0	0	0	122.7
596	T	26.1	Very low	24.3	Very low	112 Å²	112	122.9 Å²	122.9	69%	0.687	66%	0.662	S	S	*	*				64.9	131.8	129.6	55.8	0	0	0	0	127.7
597	N	22.2	Very low	24.3	Very low	150 Å²	150	120.4 Å²	120.4	80%	0.802	66%	0.663	S	S	*	*			trans	91	124	138.5	-64.4	-4.6	0	0	0	126.4
598	S	21.2	Very low	24.1	Very low	76 Å²	76	122.7 Å²	122.7	53%	0.531	67%	0.672	S	S	.	*			trans	71.1	117.7	133	67.7	0	0	0	0	128.8	V580	V580-S598 CarbonylContact O-C 3.58Å; V580-S598 VanDerWaalsContact O-CB 3.27Å; V580-S598 WeakPolarHBondContact O-CB 3.42Å; V580-S598 PolarHBondContact O-OG 3.14Å
599	K	21.3	Very low	24.1	Very low	123 Å²	123	127.3 Å²	127.3	54%	0.535	69%	0.694	S	S	.	*			trans	60.7	-177.9	131.3	-106.7	172.2	-179.3	178.1	0	125.3	H578 E579 V580 A582	H578-K599 PolarHBondContact O-NZ 3.28Å; E579-K599 VanDerWaalsContact O-CD 3.28Å; E579-K599 WeakPolarHBondContact O-CD 3.42Å; V580-K599 WeakPolarHBondContact O-CB 3.25Å; A582-K599 PolarHBondContact N-O 3.38Å
600	C	19.4	Very low	23.9	Very low	64 Å²	64	129.6 Å²	129.6	43%	0.432	71%	0.711	S	S	.	*			trans	-91.4	178.7	-135.9	-62.1	0	0	0	0	122.7	N581	N581-C600 WeakPolarHBondContact CB-O 3.43Å; N581-C600 PolarHBondContact ND2-O 3.42Å; N581-C600 PolarHBondContact OD1-N 2.9Å
601	E	20.7	Very low	23.9	Very low	169 Å²	169	129.6 Å²	129.6	79%	0.79	72%	0.72	S	S	*	*			trans	63.7	143.4	137.1	-80.4	162.5	170.5	0	0	128.4
602	E	20.8	Very low	22.6	Very low	170 Å²	170	129.3 Å²	129.3	79%	0.794	73%	0.729	S	S	*	*			trans	71.2	114.4	148.2	-71.2	-152.5	143	0	0	128.9
603	T	21.5	Very low	22.5	Very low	105 Å²	105	126.9 Å²	126.9	64%	0.644	74%	0.736	S	S	*	*			trans	68.8	131.7	134.5	58.5	0	0	0	0	128
604	Q	21.9	Very low	22.6	Very low	143 Å²	143	130 Å²	130	67%	0.668	74%	0.742	S	S	*	*			trans	89.7	121.9	135.1	-82.9	179.9	81.4	0	0	124.8
605	K	22.8	Very low	22.6	Very low	170 Å²	170	129 Å²	129	74%	0.739	74%	0.738	S	S	*	*			trans	95.4	111.4	134	-80.5	169.7	175.9	148.9	0	123.7
606	S	21.9	Very low	22.7	Very low	101 Å²	101	127.8 Å²	127.8	71%	0.706	74%	0.739	S	S	*	*				75.4	116.8	129	61.3	0	0	0	0	123.8
607	S	20.7	Very low	22.8	Very low	112 Å²	112	127.3 Å²	127.3	78%	0.783	74%	0.736	S	S	*	*			trans	64.8	123	139.8	62.1	0	0	0	0	121.1
608	C	20.2	Very low	23	Very low	135 Å²	135	128.2 Å²	128.2	91%	0.912	74%	0.736	S	S	*	*			trans	-125.6	128.9	146.7	-89.6	0	0	0	0	110.1
609	Q	22.4	Very low	23.2	Very low	186 Å²	186	127.4 Å²	127.4	87%	0.869	73%	0.73	S	S	*	*			trans	-90.2	178.6	155.4	-69.1	-179.3	-6.1	0	0	108.6
610	T	20.3	Very low	23.4	Very low	127 Å²	127	124.8 Å²	124.8	78%	0.779	73%	0.725	S	S	*	*	S	Bend	trans	-48	141.9	-176.9	44.2	0	0	0	0	117.5
611	S	22.8	Very low	23.9	Very low	113 Å²	113	126.1 Å²	126.1	79%	0.79	73%	0.731	S	S	*	*			trans	97.6	130.8	138.3	73.6	0	0	0	0	122.5
612	A	23.2	Very low	24.2	Very low	108 Å²	108	125 Å²	125	89%	0.893	73%	0.73	S	S	*	*			trans	68.1	124.3	150.8	0	0	0	0	0	121.3
613	G	26.5	Very low	24.7	Very low	84 Å²	84	126.7 Å²	126.7	87%	0.866	74%	0.738	S	S	*	*			trans	156.2	87.7	167.7	0	0	0	0	0	115.4
614	E	25.8	Very low	25.1	Very low	190 Å²	190	125.5 Å²	125.5	89%	0.888	75%	0.747	S	S	*	*			trans	-79.8	173.4	170.9	-99.8	172.5	-164.7	0	0	112.6
615	P	31	Very low	25.3	Very low	95 Å²	95	128.5 Å²	128.5	62%	0.617	76%	0.758	S	S	*	*			cis	-143.3	178.6	-15.9	37.4	-17.5	0	0	0	117
616	N	23.7	Very low	25.3	Very low	150 Å²	150	127.1 Å²	127.1	80%	0.802	76%	0.759	S	S	*	*			trans	69.9	152.4	145.9	-71.3	3.1	0	0	0	120.4
617	V	28.3	Very low	25.6	Very low	103 Å²	103	129.1 Å²	129.1	62%	0.624	77%	0.766	S	S	*	*			cis	-157.6	136.2	8	99.7	0	0	0	0	113.5
618	E	26	Very low	26	Very low	168 Å²	168	128.8 Å²	128.8	79%	0.785	76%	0.764	S	S	*	*			trans	48.1	154.5	132.1	-70	170.4	-171.8	0	0	124.2
619	S	25.6	Very low	26.2	Very low	60 Å²	60	127.5 Å²	127.5	42%	0.42	76%	0.756	S	S	.	*			cis	-170.8	157.5	-8.7	51.1	0	0	0	0	116.8	E588	E588-S619 VanDerWaalsContact CB-O 3.25Å; E588-S619 WeakPolarHBondContact CB-O 3.36Å; E588-S619 VanDerWaalsContact CD-C 3.44Å; E588-S619 WeakPolarHBondContact OE2-CA 3.4Å
620	T	26.3	Very low	26.4	Very low	68 Å²	68	122.4 Å²	122.4	42%	0.417	75%	0.754	S	S	.	*			trans	78.9	94	160.9	45	0	0	0	0	125.3	E588 N589	E588-T620 VanDerWaalsContact CB-N 3.33Å; E588-T620 VanDerWaalsContact CD-CA 3.42Å; E588-T620 WeakPolarHBondContact OE1-CA 3.5Å; E588-T620 PolarHBondContact OE1-N 2.91Å; E588-T620 PolarHBondContact OE2-N 2.9Å; N589-T620 WeakPolarHBondContact CA-O 3.2Å; N589-T620 WeakPolarHBondContact CB-O 3.42Å; N589-T620 WeakPolarHBondContact CB-OG1 3.36Å; N589-T620 PolarHBondContact N-O 3.2Å; N589-T620 VanDerWaalsContact N-O 3.11Å; N589-T620 WeakPolarHBondContact ND2-CB 3.4Å; N589-T620 PolarHBondContact ND2-OG1 2.91Å; N589-T620 PolarHBondContact OD1-O 3.28Å
621	T	29.8	Very low	27.1	Very low	92 Å²	92	121.4 Å²	121.4	56%	0.564	75%	0.747	S	S	*	*			trans	-169.8	131.8	131.4	7.4	0	0	0	0	113.7	E588 N589	E588-T621 PolarHBondContact OE1-N 3.28Å; N589-T621 PolarHBondContact N-OG1 3.46Å
622	N	27.4	Very low	27.6	Very low	145 Å²	145	119.6 Å²	119.6	78%	0.775	75%	0.746	S	S	*	*			trans	-131.4	140.1	-175.3	-71.3	-100.9	0	0	0	111.5
623	E	30.3	Very low	29	Very low	205 Å²	205	119.1 Å²	119.1	96%	0.958	73%	0.728	S	S	*	*			trans	-156.4	149.4	134.6	-77.6	-141.9	143.3	0	0	109.6
624	G	30.2	Very low	30.4	Very low	80 Å²	80	119 Å²	119	83%	0.825	72%	0.719	S	S	*	*			trans	129.2	-26.5	164.3	0	0	0	0	0	118.5	N626	G624-N626 PolarHBondContact O-N 3.41Å; G624-N626 VanDerWaalsContact O-N 3.14Å
625	K	25.5	Very low	32.1	Very low	206 Å²	206	116.7 Å²	116.7	90%	0.896	72%	0.718	S	S	*	*			trans	-78.4	93.2	169.8	-86.1	179.1	179.7	164	0	110
626	N	24.4	Very low	33.9	Very low	142 Å²	142	113.5 Å²	113.5	76%	0.759	70%	0.696	S	S	*	*			trans	172.9	87.3	145.5	-90	-27.2	0	0	0	114.5	G624	G624-N626 PolarHBondContact O-N 3.41Å; G624-N626 VanDerWaalsContact O-N 3.14Å
627	V	28.1	Very low	36.2	Very low	142 Å²	142	110.1 Å²	110.1	86%	0.861	69%	0.685	S	S	*	*			trans	-138.6	63	146.8	-167.6	0	0	0	0	110	S629	V627-S629 VanDerWaalsContact C-N 3.34Å; V627-S629 PolarHBondContact O-N 3.09Å; V627-S629 VanDerWaalsContact O-N 3.1Å
628	S	27.6	Very low	38.4	Very low	105 Å²	105	108.7 Å²	108.7	73%	0.734	68%	0.679	S	S	*	*			trans	-80.8	75.5	172.6	50.6	0	0	0	0	111.1
629	S	24.7	Very low	40.8	Very low	109 Å²	109	101 Å²	101	76%	0.762	64%	0.644	S	S	*	*			trans	-158.8	109.9	173	-84.1	0	0	0	0	114.1	V627	V627-S629 VanDerWaalsContact C-N 3.34Å; V627-S629 PolarHBondContact O-N 3.09Å; V627-S629 VanDerWaalsContact O-N 3.1Å
630	G	26.9	Very low	43.3	Very low	79 Å²	79	106 Å²	106	81%	0.814	66%	0.658	S	S	*	*	S	Bend	trans	75.5	110.7	166.4	0	0	0	0	0	115.3
631	V	35.1	Very low	45.8	Very low	106 Å²	106	103.5 Å²	103.5	64%	0.642	64%	0.643	S	S	*	*			cis	-139.3	133.7	8.9	175.3	0	0	0	0	108	L633	V631-L633 PolarHBondContact O-N 2.83Å; V631-L633 VanDerWaalsContact O-N 3.14Å
632	G	32.7	Very low	48.3	Very low	74 Å²	74	100.4 Å²	100.4	76%	0.763	62%	0.622	S	S	*	*			trans	-63.9	114.3	173.6	0	0	0	0	0	110.9	A634	G632-A634 PolarHBondContact O-N 3.48Å
633	L	52.8	Low	50.4	Low	99 Å²	99	97.6 Å²	97.6	52%	0.518	61%	0.614	S	S	.	*			trans	-70.1	109.7	161.8	-77.5	100.2	0	0	0	107.4	V631 T635	V631-L633 PolarHBondContact O-N 2.83Å; V631-L633 VanDerWaalsContact O-N 3.14Å; L633-T635 PolarHBondContact O-N 2.87Å
634	A	55.5	Low	52.2	Low	81 Å²	81	88.9 Å²	88.9	67%	0.669	58%	0.58	S	S	*	*			trans	-58.9	132.6	168.5	0	0	0	0	0	109	G632 V636	G632-A634 PolarHBondContact O-N 3.48Å; A634-V636 PolarHBondContact O-N 3.34Å
635	T	61.2	Low	54.3	Low	142 Å²	142	86.9 Å²	86.9	87%	0.871	56%	0.558	S	S	*	*			trans	-67.4	99.8	178.9	47.3	0	0	0	0	109.9	L633 S637	L633-T635 PolarHBondContact O-N 2.87Å; T635-S637 PolarHBondContact O-N 2.78Å
636	V	69.6	Low	57.1	Low	27 Å²	27	84.6 Å²	84.6	16%	0.164	56%	0.556	C	S	.	*	P	Polyproline II helix	trans	-71.7	122.2	-179.2	176.1	0	0	0	0	110.2	A634 L655 V659 Y688	A634-V636 PolarHBondContact O-N 3.34Å; V636-L655 HydrophobicContact CG1-CD2 4.15Å; V636-L655 HydrophobicContact CG1-CG 4.32Å; V636-V659 HydrophobicContact CG2-CB 4.46Å; V636-V659 HydrophobicContact CG2-CG1 4.45Å; V636-Y688 HydrophobicContact CG1-CD2 3.7Å; V636-Y688 HydrophobicContact CG1-CE2 3.6Å
637	S	71.7	Confident	60	Low	79 Å²	79	78.8 Å²	78.8	55%	0.552	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-67.6	141.7	169.9	45.6	0	0	0	0	111.4	T635	T635-S637 PolarHBondContact O-N 2.78Å
638	S	74.4	Confident	62.8	Low	73 Å²	73	76.6 Å²	76.6	51%	0.51	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-60.2	123.7	174.7	52	0	0	0	0	111.2
639	P	76.4	Confident	65.6	Low	7 Å²	7	79.4 Å²	79.4	5%	0.045	50%	0.503	C	S	.	.	P	Polyproline II helix	trans	-67	138.7	-176.1	25.3	-35.2	0	0	0	112.6	L641 L642 A687 C691	P639-L641 PolarHBondContact O-N 2.85Å; P639-L642 HydrophobicContact CG-CD1 3.72Å; P639-L642 HydrophobicContact CG-CG 4.17Å; P639-L642 WeakPolarHBondContact O-CB 3.29Å; P639-L642 PolarHBondContact O-N 3.14Å; P639-A687 HydrophobicContact CB-CB 4.37Å; P639-A687 HydrophobicContact CG-CB 3.92Å; P639-C691 HydrophobicContact CB-CB 4.36Å
640	F	78.1	Confident	68.6	Low	165 Å²	165	75.4 Å²	75.4	72%	0.724	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-15.3	-171.8	75	-93	0	0	0	115.5	L642 C691	F640-L642 PolarHBondContact O-N 2.88Å; F640-C691 HydrophobicContact CD1-CB 4.29Å; F640-C691 HydrophobicContact CE1-CB 3.93Å; F640-C691 WeakPolarHBondContact CE1-SG 3.42Å
641	L	80	Confident	71.6	Confident	16 Å²	16	72.2 Å²	72.2	8%	0.084	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-2.4	175.5	-67	177.4	0	0	0	113.8	P639 S643 A687 A690 C691 W696 C719	P639-L641 PolarHBondContact O-N 2.85Å; L641-S643 PolarHBondContact O-N 3.32Å; L641-A687 HydrophobicContact CB-CB 4.31Å; L641-A690 HydrophobicContact CD1-CB 4.23Å; L641-C691 VanDerWaalsContact CD1-SG 3.6Å; L641-W696 HydrophobicContact CD1-CH2 4.05Å; L641-C719 PolarHBondContact O-SG 2.64Å
642	L	82	Confident	74.2	Confident	26 Å²	26	69.7 Å²	69.7	14%	0.136	42%	0.417	C	S	.	.			trans	-83.2	96.4	172.6	-71.5	166.1	0	0	0	110.4	P639 F640 L647 W718	P639-L642 HydrophobicContact CG-CD1 3.72Å; P639-L642 HydrophobicContact CG-CG 4.17Å; P639-L642 WeakPolarHBondContact O-CB 3.29Å; P639-L642 PolarHBondContact O-N 3.14Å; F640-L642 PolarHBondContact O-N 2.88Å; L642-L647 HydrophobicContact CD1-CD1 3.83Å; L642-L647 HydrophobicContact CD1-CG 4.18Å; L642-W718 CarbonylContact C-O 3.29Å; L642-W718 WeakPolarHBondContact CA-O 3.39Å; L642-W718 HydrophobicContact CD2-CB 4.43Å; L642-W718 HydrophobicContact CD2-CE3 4.2Å
643	S	72.1	Confident	76.9	Confident	86 Å²	86	69.9 Å²	69.9	60%	0.601	40%	0.404	S	S	*	.			trans	-91.8	-12	176.2	-50.2	0	0	0	0	113.6	L641 G645 W718	L641-S643 PolarHBondContact O-N 3.32Å; S643-G645 PolarHBondContact O-N 3.25Å; S643-W718 PolarHBondContact N-O 3.07Å
644	G	66.9	Low	78.7	Confident	23 Å²	23	65.2 Å²	65.2	24%	0.237	38%	0.379	C	S	.	.	S	Bend	trans	-79.4	-8.1	-170.7	0	0	0	0	0	116.8	R717	G644-R717 WeakPolarHBondContact CA-O 3.22Å
645	G	74.3	Confident	80.4	Confident	37 Å²	37	61.3 Å²	61.3	38%	0.381	35%	0.347	S	S	.	.			trans	137.9	-178.7	-178.4	0	0	0	0	0	113.2	S643 W718	S643-G645 PolarHBondContact O-N 3.25Å; G645-W718 WeakPolarHBondContact O-CZ3 3.49Å
646	N	84	Confident	81.9	Confident	159 Å²	159	55.2 Å²	55.2	85%	0.85	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-82.3	140.4	176.6	-67.3	-2.5	0	0	0	111
647	L	86	Confident	82.9	Confident	19 Å²	19	55.8 Å²	55.8	10%	0.099	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-73.6	143.1	170.6	-63.6	176.3	0	0	0	110.4	L642 Q651 L652 L655 I680 W718	L642-L647 HydrophobicContact CD1-CD1 3.83Å; L642-L647 HydrophobicContact CD1-CG 4.18Å; L647-Q651 HydrophobicContact CB-CB 4.25Å; L647-L652 HydrophobicContact CB-CD2 3.9Å; L647-L652 HydrophobicContact CB-CG 3.93Å; L647-L652 HydrophobicContact CD1-CD2 3.77Å; L647-L652 HydrophobicContact CG-CD2 4.44Å; L647-L655 HydrophobicContact CD1-CD2 4.2Å; L647-I680 HydrophobicContact CD2-CG2 3.54Å; L647-W718 HydrophobicContact CD2-CZ3 4.39Å
648	R	86.4	Confident	83.9	Confident	96 Å²	96	52.3 Å²	52.3	36%	0.362	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-71.4	156.6	171.7	-63.3	-176.5	174.1	-155.7	-10.5	110.5	Y650 Q651 L652 E875	R648-Y650 HydrophobicContact CB-CD1 3.82Å; R648-Y650 HydrophobicContact CB-CE1 3.63Å; R648-Y650 HydrophobicContact CG-CE1 4.24Å; R648-Y650 PolarHBondContact O-N 3.28Å; R648-Q651 HydrophobicContact CB-CG 4.12Å; R648-Q651 WeakPolarHBondContact O-CA 3.28Å; R648-Q651 VanDerWaalsContact O-CB 3.29Å; R648-Q651 WeakPolarHBondContact O-CB 3.37Å; R648-Q651 PolarHBondContact O-N 3.39Å; R648-L652 PolarHBondContact O-N 3.34Å; R648-E875 IonicContact CZ-OE1 3.76Å; R648-E875 IonicContact CZ-OE2 2.71Å; R648-E875 IonicContact NH1-OE1 3.64Å; R648-E875 PolarHBondContact NH1-OE1 3.11Å; R648-E875 IonicContact NH1-OE2 2.63Å; R648-E875 PolarHBondContact NH1-OE2 3.07Å
649	E	86.5	Confident	84.7	Confident	164 Å²	164	49.2 Å²	49.2	77%	0.766	26%	0.263	S	S	*	.	H	α-helix	trans	-52.6	-49.4	-176.8	-176.2	177.2	-173.8	0	0	112.7	Q651 L652 V653	E649-Q651 PolarHBondContact O-N 3.17Å; E649-L652 WeakPolarHBondContact O-CA 3.47Å; E649-L652 WeakPolarHBondContact O-CB 3.34Å; E649-L652 PolarHBondContact O-N 2.8Å; E649-V653 PolarHBondContact O-N 3.46Å
650	Y	88.4	Confident	85.4	Confident	26 Å²	26	50.3 Å²	50.3	10%	0.102	27%	0.272	C	S	.	.	H	α-helix	trans	-62	-29	176	73.6	-94.5	0	0	0	113.2	R648 V653 G654 L676 R869 V874	R648-Y650 HydrophobicContact CB-CD1 3.82Å; R648-Y650 HydrophobicContact CB-CE1 3.63Å; R648-Y650 HydrophobicContact CG-CE1 4.24Å; R648-Y650 PolarHBondContact O-N 3.28Å; Y650-V653 PolarHBondContact O-N 3.47Å; Y650-G654 PolarHBondContact O-N 3.12Å; Y650-L676 HydrophobicContact CE2-CB 4.06Å; Y650-L676 HydrophobicContact CE2-CD2 4.14Å; Y650-L676 WeakPolarHBondContact CE2-O 3.4Å; Y650-R869 PolarHBondContact O-NH1 2.73Å; Y650-V874 HydrophobicContact CD1-CG1 3.13Å; Y650-V874 HydrophobicContact CD2-CG1 3.72Å; Y650-V874 HydrophobicContact CE1-CG1 3.37Å; Y650-V874 HydrophobicContact CE2-CG1 3.96Å; Y650-V874 HydrophobicContact CG-CG1 3.29Å
651	Q	90.4	Very high	85.9	Confident	11 Å²	11	43 Å²	43	5%	0.051	24%	0.242	C	C	.	.	H	α-helix	trans	-73.9	-32.9	176.1	-59.5	173.9	-21.2	0	0	111	L647 R648 E649 G654 L655 Q681	L647-Q651 HydrophobicContact CB-CB 4.25Å; R648-Q651 HydrophobicContact CB-CG 4.12Å; R648-Q651 WeakPolarHBondContact O-CA 3.28Å; R648-Q651 VanDerWaalsContact O-CB 3.29Å; R648-Q651 WeakPolarHBondContact O-CB 3.37Å; R648-Q651 PolarHBondContact O-N 3.39Å; E649-Q651 PolarHBondContact O-N 3.17Å; Q651-G654 PolarHBondContact O-N 3.41Å; Q651-L655 WeakPolarHBondContact O-CB 3.33Å; Q651-L655 PolarHBondContact O-N 3.45Å; Q651-Q681 HydrophobicContact CB-CG 4.01Å; Q651-Q681 HydrophobicContact CG-CG 4.18Å
652	L	89.1	Confident	86.4	Confident	53 Å²	53	44.2 Å²	44.2	28%	0.277	25%	0.245	S	C	.	.	H	α-helix	trans	-68.9	-39.3	170.1	-66.6	168.5	0	0	0	111.9	L647 R648 E649 L655 S656	L647-L652 HydrophobicContact CB-CD2 3.9Å; L647-L652 HydrophobicContact CB-CG 3.93Å; L647-L652 HydrophobicContact CD1-CD2 3.77Å; L647-L652 HydrophobicContact CG-CD2 4.44Å; R648-L652 PolarHBondContact O-N 3.34Å; E649-L652 WeakPolarHBondContact O-CA 3.47Å; E649-L652 WeakPolarHBondContact O-CB 3.34Å; E649-L652 PolarHBondContact O-N 2.8Å; L652-L655 PolarHBondContact O-N 3.33Å; L652-S656 WeakPolarHBondContact O-CB 3.2Å; L652-S656 PolarHBondContact O-N 3.24Å; L652-S656 PolarHBondContact O-OG 2.9Å
653	V	89.1	Confident	86.8	Confident	79 Å²	79	46.5 Å²	46.5	48%	0.479	26%	0.257	S	S	.	.	H	α-helix	trans	-63	-42.1	171.5	174.8	0	0	0	0	111	E649 Y650 S656 W657	E649-V653 PolarHBondContact O-N 3.46Å; Y650-V653 PolarHBondContact O-N 3.47Å; V653-S656 PolarHBondContact O-N 2.94Å; V653-W657 PolarHBondContact O-N 3.37Å
654	G	90.4	Very high	87.6	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-64	-44.5	175.9	0	0	0	0	0	112.8	Y650 Q651 S656 W657 L658	Y650-G654 PolarHBondContact O-N 3.12Å; Q651-G654 PolarHBondContact O-N 3.41Å; G654-S656 PolarHBondContact O-N 2.93Å; G654-W657 PolarHBondContact O-N 3.15Å; G654-L658 WeakPolarHBondContact O-CG 3.29Å; G654-L658 PolarHBondContact O-N 3.03Å
655	L	91.7	Very high	88.7	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-58.3	-46.4	171.1	175.7	59.4	0	0	0	111.3	V636 L647 Q651 L652 W657 L658 V659 L685	V636-L655 HydrophobicContact CG1-CD2 4.15Å; V636-L655 HydrophobicContact CG1-CG 4.32Å; L647-L655 HydrophobicContact CD1-CD2 4.2Å; Q651-L655 WeakPolarHBondContact O-CB 3.33Å; Q651-L655 PolarHBondContact O-N 3.45Å; L652-L655 PolarHBondContact O-N 3.33Å; L655-W657 VanDerWaalsContact C-N 3.31Å; L655-W657 PolarHBondContact O-N 3.14Å; L655-L658 PolarHBondContact O-N 3.4Å; L655-L658 VanDerWaalsContact O-N 3.14Å; L655-V659 HydrophobicContact CD1-CG2 4.07Å; L655-V659 HydrophobicContact CG-CG2 4.47Å; L655-V659 WeakPolarHBondContact O-CG2 3.44Å; L655-V659 PolarHBondContact O-N 2.89Å; L655-L685 HydrophobicContact CD1-CB 4.12Å; L655-L685 HydrophobicContact CD1-CD1 4.49Å
656	S	91.4	Very high	89.4	Confident	14 Å²	14	57.7 Å²	57.7	10%	0.098	28%	0.275	C	S	.	.	H	α-helix	trans	-61.2	-38.7	178.9	-56.9	0	0	0	0	112.1	L652 V653 G654 A660	L652-S656 WeakPolarHBondContact O-CB 3.2Å; L652-S656 PolarHBondContact O-N 3.24Å; L652-S656 PolarHBondContact O-OG 2.9Å; V653-S656 PolarHBondContact O-N 2.94Å; G654-S656 PolarHBondContact O-N 2.93Å; S656-A660 WeakPolarHBondContact O-CB 3.26Å; S656-A660 PolarHBondContact O-N 3.48Å
657	W	91.5	Very high	89.8	Confident	39 Å²	39	51.3 Å²	51.3	15%	0.148	24%	0.241	C	C	.	.	H	α-helix	trans	-66.9	-41.8	172.8	179.4	88.2	0	0	0	112.6	V653 G654 L655 A660 T661 L867	V653-W657 PolarHBondContact O-N 3.37Å; G654-W657 PolarHBondContact O-N 3.15Å; L655-W657 VanDerWaalsContact C-N 3.31Å; L655-W657 PolarHBondContact O-N 3.14Å; W657-A660 PolarHBondContact O-N 3.3Å; W657-T661 WeakPolarHBondContact O-CB 3.32Å; W657-T661 PolarHBondContact O-N 2.94Å; W657-T661 PolarHBondContact O-OG1 3.49Å; W657-L867 HydrophobicContact CB-CD2 4.12Å; W657-L867 HydrophobicContact CD2-CB 4.01Å; W657-L867 HydrophobicContact CD2-CD2 3.81Å; W657-L867 HydrophobicContact CD2-CG 4.49Å; W657-L867 HydrophobicContact CE3-CB 4.02Å; W657-L867 HydrophobicContact CE3-CD2 3.78Å; W657-L867 HydrophobicContact CG-CD2 3.96Å; W657-L867 HydrophobicContact CH2-CB 3.95Å; W657-L867 HydrophobicContact CZ2-CB 3.93Å; W657-L867 HydrophobicContact CZ3-CB 4Å; W657-L867 HydrophobicContact CZ3-CD2 4.47Å
658	L	92.5	Very high	89.9	Confident	6 Å²	6	50.5 Å²	50.5	3%	0.031	24%	0.237	C	C	.	.	H	α-helix	trans	-63.9	-40.3	176	-71.9	168.6	0	0	0	112.1	G654 L655 T661 Y662 Q681 L685 L800	G654-L658 WeakPolarHBondContact O-CG 3.29Å; G654-L658 PolarHBondContact O-N 3.03Å; L655-L658 PolarHBondContact O-N 3.4Å; L655-L658 VanDerWaalsContact O-N 3.14Å; L658-T661 PolarHBondContact O-N 2.97Å; L658-Y662 PolarHBondContact O-N 3.38Å; L658-Q681 HydrophobicContact CD1-CB 4.44Å; L658-L685 HydrophobicContact CB-CD1 3.95Å; L658-L685 HydrophobicContact CB-CD2 4.05Å; L658-L685 HydrophobicContact CB-CG 4.42Å; L658-L685 HydrophobicContact CD1-CB 4.35Å; L658-L685 HydrophobicContact CD1-CD2 4.29Å; L658-L685 HydrophobicContact CD2-CD2 4.4Å; L658-L685 HydrophobicContact CG-CD2 4.48Å; L658-L800 HydrophobicContact CD2-CD1 3.73Å; L658-L800 HydrophobicContact CD2-CD2 4.21Å
659	V	91.6	Very high	90.2	Very high	8 Å²	8	46.1 Å²	46.1	5%	0.048	22%	0.221	C	C	.	.	H	α-helix	trans	-64.6	-48.9	174.3	171.6	0	0	0	0	110.8	V636 L655 T661 Y662 D663 L685 Y688	V636-V659 HydrophobicContact CG2-CB 4.46Å; V636-V659 HydrophobicContact CG2-CG1 4.45Å; L655-V659 HydrophobicContact CD1-CG2 4.07Å; L655-V659 HydrophobicContact CG-CG2 4.47Å; L655-V659 WeakPolarHBondContact O-CG2 3.44Å; L655-V659 PolarHBondContact O-N 2.89Å; V659-T661 PolarHBondContact O-N 2.86Å; V659-Y662 WeakPolarHBondContact O-CB 3.26Å; V659-Y662 PolarHBondContact O-N 3.09Å; V659-Y662 VanDerWaalsContact O-N 3.14Å; V659-D663 PolarHBondContact O-N 3.25Å; V659-L685 HydrophobicContact CG2-CD1 4.16Å; V659-Y688 HydrophobicContact CB-CE1 4.19Å; V659-Y688 HydrophobicContact CG1-CD1 4.44Å; V659-Y688 HydrophobicContact CG1-CE1 3.6Å; V659-Y688 HydrophobicContact CG2-CD1 3.44Å; V659-Y688 VanDerWaalsContact CG2-CD1 3.44Å; V659-Y688 HydrophobicContact CG2-CD2 4.29Å; V659-Y688 HydrophobicContact CG2-CE1 3.46Å; V659-Y688 VanDerWaalsContact CG2-CE1 3.46Å; V659-Y688 HydrophobicContact CG2-CE2 4.29Å; V659-Y688 HydrophobicContact CG2-CG 3.92Å
660	A	90.6	Very high	90.5	Very high	29 Å²	29	38.3 Å²	38.3	24%	0.24	19%	0.185	C	C	.	.	H	α-helix	trans	-59.6	-34.3	176.1	0	0	0	0	0	112.6	S656 W657 K664	S656-A660 WeakPolarHBondContact O-CB 3.26Å; S656-A660 PolarHBondContact O-N 3.48Å; W657-A660 PolarHBondContact O-N 3.3Å; A660-K664 VanDerWaalsContact O-CB 3.28Å; A660-K664 WeakPolarHBondContact O-CB 3.41Å; A660-K664 WeakPolarHBondContact O-CD 3.4Å; A660-K664 WeakPolarHBondContact O-CG 3.37Å; A660-K664 PolarHBondContact O-N 3.45Å
661	T	89.5	Confident	90.4	Very high	13 Å²	13	37.1 Å²	37.1	8%	0.08	18%	0.18	C	C	.	.	H	α-helix	trans	-68.4	-44	175.5	-59.6	0	0	0	0	111.6	W657 L658 V659 R665 L666	W657-T661 WeakPolarHBondContact O-CB 3.32Å; W657-T661 PolarHBondContact O-N 2.94Å; W657-T661 PolarHBondContact O-OG1 3.49Å; L658-T661 PolarHBondContact O-N 2.97Å; V659-T661 PolarHBondContact O-N 2.86Å; T661-R665 PolarHBondContact O-N 3.33Å; T661-L666 HydrophobicContact CG2-CB 4Å; T661-L666 PolarHBondContact O-N 3.42Å
662	Y	90.6	Very high	90.3	Very high	41 Å²	41	36.6 Å²	36.6	16%	0.161	18%	0.178	C	C	.	.	H	α-helix	trans	-61.4	-45.8	175.7	178.9	-106.5	0	0	0	112.6	L658 V659 R665 L689 R693 Y771 R798	L658-Y662 PolarHBondContact O-N 3.38Å; V659-Y662 WeakPolarHBondContact O-CB 3.26Å; V659-Y662 PolarHBondContact O-N 3.09Å; V659-Y662 VanDerWaalsContact O-N 3.14Å; Y662-R665 WeakPolarHBondContact O-CA 3.18Å; Y662-R665 PolarHBondContact O-N 2.93Å; Y662-L689 HydrophobicContact CD1-CD2 3.66Å; Y662-L689 HydrophobicContact CD2-CD2 4.4Å; Y662-L689 HydrophobicContact CE1-CD2 3.43Å; Y662-L689 VanDerWaalsContact CE1-CD2 3.43Å; Y662-L689 HydrophobicContact CE2-CD2 4.19Å; Y662-L689 HydrophobicContact CG-CD2 4.13Å; Y662-R693 HydrophobicContact CE1-CG 4.32Å; Y662-Y771 AromaticContact CD2-CE2 3.96Å; Y662-Y771 HydrophobicContact CD2-CE2 3.96Å; Y662-Y771 AromaticContact CD2-CZ 3.79Å; Y662-Y771 WeakPolarHBondContact CD2-OH 3.16Å; Y662-Y771 AromaticContact CE2-CE2 3.83Å; Y662-Y771 HydrophobicContact CE2-CE2 3.83Å; Y662-R798 HydrophobicContact CD2-CG 3.95Å; Y662-R798 HydrophobicContact CE2-CG 3.96Å
663	D	90.4	Very high	89.9	Confident	73 Å²	73	35.9 Å²	35.9	39%	0.39	17%	0.173	S	C	.	.	H	α-helix	trans	-67.9	-41.6	-178.7	-75.8	-7.9	0	0	0	112	V659 R665 R693	V659-D663 PolarHBondContact O-N 3.25Å; D663-R665 PolarHBondContact O-N 3.22Å; D663-R693 IonicContact OD1-CZ 3.88Å; D663-R693 IonicContact OD1-NE 3.73Å; D663-R693 IonicContact OD1-NH2 2.83Å; D663-R693 PolarHBondContact OD1-NH2 3.4Å; D663-R693 IonicContact OD2-CZ 2.68Å; D663-R693 IonicContact OD2-NH2 2.75Å; D663-R693 PolarHBondContact OD2-NH2 2.81Å
664	K	88.3	Confident	89.5	Confident	126 Å²	126	33.4 Å²	33.4	55%	0.548	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-3.6	169.3	-72.3	172.8	-177.5	177.7	0	113.8	A660 L666	A660-K664 VanDerWaalsContact O-CB 3.28Å; A660-K664 WeakPolarHBondContact O-CB 3.41Å; A660-K664 WeakPolarHBondContact O-CD 3.4Å; A660-K664 WeakPolarHBondContact O-CG 3.37Å; A660-K664 PolarHBondContact O-N 3.45Å; K664-L666 VanDerWaalsContact C-N 3.25Å; K664-L666 HydrophobicContact CB-CD1 4.19Å; K664-L666 HydrophobicContact CB-CG 4.07Å; K664-L666 PolarHBondContact O-N 3.46Å
665	R	89.2	Confident	88.9	Confident	199 Å²	199	34.8 Å²	34.8	75%	0.751	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.2	22	-177.5	-54.8	-171.1	172.5	-167.4	0.1	115.4	T661 Y662 D663 R798	T661-R665 PolarHBondContact O-N 3.33Å; Y662-R665 WeakPolarHBondContact O-CA 3.18Å; Y662-R665 PolarHBondContact O-N 2.93Å; D663-R665 PolarHBondContact O-N 3.22Å; R665-R798 VanDerWaalsContact CB-NH2 3.27Å; R665-R798 PolarHBondContact O-NH1 2.83Å
666	L	89.7	Confident	88.6	Confident	56 Å²	56	34.9 Å²	34.9	29%	0.293	17%	0.171	S	C	.	.			trans	-89.4	171.5	178.8	-59	179.4	0	0	0	111.6	T661 K664 F865	T661-L666 HydrophobicContact CG2-CB 4Å; T661-L666 PolarHBondContact O-N 3.42Å; K664-L666 VanDerWaalsContact C-N 3.25Å; K664-L666 HydrophobicContact CB-CD1 4.19Å; K664-L666 HydrophobicContact CB-CG 4.07Å; K664-L666 PolarHBondContact O-N 3.46Å; L666-F865 HydrophobicContact CD1-CE1 4.08Å; L666-F865 HydrophobicContact CD2-CE1 4.29Å
667	N	91.8	Very high	88.3	Confident	25 Å²	25	34.9 Å²	34.9	13%	0.134	17%	0.173	C	C	.	.			trans	-112.9	157.3	167.4	-67.9	-32.4	0	0	0	107.9	R798 R799 L821	N667-R798 WeakPolarHBondContact OD1-CA 3.29Å; N667-R799 HydrophobicContact CB-CB 4.37Å; N667-R799 VanDerWaalsContact CB-O 3.3Å; N667-R799 WeakPolarHBondContact CB-O 3.12Å; N667-R799 PolarHBondContact OD1-N 2.9Å; N667-R799 PolarHBondContact OD1-O 2.99Å; N667-L821 HydrophobicContact CB-CB 4.3Å; N667-L821 HydrophobicContact CB-CD2 3.81Å; N667-L821 PolarHBondContact ND2-O 2.62Å
668	G	89.8	Confident	88.3	Confident	2 Å²	2	33.7 Å²	33.7	2%	0.021	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	166	-174.1	0	0	0	0	0	115.4	L801 F865	G668-L801 PolarHBondContact O-N 2.93Å; G668-L801 VanDerWaalsContact O-N 3.1Å; G668-F865 CarbonylContact C-O 3.36Å; G668-F865 WeakPolarHBondContact CA-O 3.36Å
669	I	91.7	Very high	88.3	Confident	5 Å²	5	34.7 Å²	34.7	3%	0.026	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	123.9	174.1	-48.8	179.8	0	0	0	108.9	A671 L801 T803 L817 L821 F865 L866 L867	I669-A671 HydrophobicContact CG2-CB 4.12Å; I669-L801 CarbonylContact C-O 2.82Å; I669-L801 WeakPolarHBondContact CA-O 3.32Å; I669-L801 HydrophobicContact CG1-CB 4.32Å; I669-L801 HydrophobicContact CG1-CD1 4.43Å; I669-L801 HydrophobicContact CG2-CB 4.37Å; I669-T803 HydrophobicContact CG2-CG2 3.94Å; I669-L817 HydrophobicContact CD1-CB 4.48Å; I669-L821 HydrophobicContact CD1-CD1 3.79Å; I669-L821 HydrophobicContact CG1-CD1 3.5Å; I669-L821 VanDerWaalsContact CG1-CD1 3.5Å; I669-F865 PolarHBondContact N-O 3.39Å; I669-L866 HydrophobicContact CB-CD1 3.77Å; I669-L866 HydrophobicContact CD1-CD1 4.3Å; I669-L866 HydrophobicContact CG2-CD1 3.81Å; I669-L867 PolarHBondContact O-N 2.82Å
670	L	92.3	Very high	88.3	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	99.6	165.7	-170.7	65.5	0	0	0	108.6	K678 Q681 L801 L802 T803 L867	L670-K678 HydrophobicContact CD2-CB 3.98Å; L670-K678 HydrophobicContact CD2-CD 4.44Å; L670-K678 HydrophobicContact CD2-CG 3.86Å; L670-K678 HydrophobicContact CG-CD 4.25Å; L670-K678 HydrophobicContact CG-CG 4.09Å; L670-K678 WeakPolarHBondContact O-CD 3.48Å; L670-Q681 HydrophobicContact CD2-CB 4.24Å; L670-L801 PolarHBondContact N-O 3.22Å; L670-L802 HydrophobicContact CB-CD2 3.83Å; L670-L802 HydrophobicContact CD2-CD2 4.15Å; L670-T803 PolarHBondContact O-N 2.97Å; L670-T803 VanDerWaalsContact O-N 3.16Å; L670-L867 HydrophobicContact CD1-CB 4.34Å; L670-L867 HydrophobicContact CD1-CD2 3.85Å; L670-L867 HydrophobicContact CD1-CG 4.22Å
671	A	87.6	Confident	88.4	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.008	17%	0.168	C	C	.	.			trans	-108.4	38	-176.7	0	0	0	0	0	112	I669 T803 P806 L866 L867 R868	I669-A671 HydrophobicContact CG2-CB 4.12Å; A671-T803 HydrophobicContact CB-CG2 4.01Å; A671-P806 HydrophobicContact CB-CB 4.49Å; A671-P806 HydrophobicContact CB-CG 4.14Å; A671-L866 HydrophobicContact CB-CD1 3.49Å; A671-L866 VanDerWaalsContact CB-CD1 3.49Å; A671-L867 CarbonylContact C-O 3.44Å; A671-L867 WeakPolarHBondContact CA-O 3.07Å; A671-L867 PolarHBondContact N-O 2.99Å; A671-R868 HydrophobicContact CB-CB 4.24Å; A671-R868 WeakPolarHBondContact O-CA 3.46Å; A671-R868 WeakPolarHBondContact O-CB 3.37Å; A671-R868 WeakPolarHBondContact O-CG 3.07Å
672	D	87.7	Confident	88.6	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.164	C	C	.	.	P	Polyproline II helix	trans	-57.5	151.1	166.3	-67.1	-23	0	0	0	110.8	L676 K678 Q681 R869	D672-L676 HydrophobicContact CB-CB 4.04Å; D672-L676 HydrophobicContact CB-CD1 4.03Å; D672-K678 HydrophobicContact CB-CD 4.08Å; D672-K678 HydrophobicContact CB-CG 3.82Å; D672-K678 PolarHBondContact O-NZ 2.85Å; D672-Q681 PolarHBondContact OD2-NE2 3.02Å; D672-R869 IonicContact OD1-CZ 3.97Å; D672-R869 VanDerWaalsContact OD1-CZ 3.23Å; D672-R869 IonicContact OD1-NE 2.8Å; D672-R869 PolarHBondContact OD1-NE 3.16Å; D672-R869 IonicContact OD1-NH2 3.79Å; D672-R869 PolarHBondContact OD1-NH2 2.91Å; D672-R869 IonicContact OD2-CZ 3.23Å; D672-R869 IonicContact OD2-NH2 2.86Å; D672-R869 PolarHBondContact OD2-NH2 3.26Å
673	E	81	Confident	88.7	Confident	37 Å²	37	31.6 Å²	31.6	17%	0.173	16%	0.157	C	C	.	.	P	Polyproline II helix	trans	-56.7	162.3	169.5	-158.2	178	154.3	0	0	112.2	G675 L676 K678 R869 K871 K881	E673-G675 PolarHBondContact O-N 3.06Å; E673-L676 HydrophobicContact CB-CD1 4.21Å; E673-K678 PolarHBondContact O-NZ 3.1Å; E673-R869 PolarHBondContact N-O 3.48Å; E673-R869 VanDerWaalsContact N-O 3.12Å; E673-K871 HydrophobicContact CB-CG 4.29Å; E673-K871 HydrophobicContact CG-CD 4.35Å; E673-K871 HydrophobicContact CG-CG 4.25Å; E673-K871 WeakPolarHBondContact OE1-CD 3.24Å; E673-K871 WeakPolarHBondContact OE1-CE 3.45Å; E673-K871 IonicContact OE1-NZ 2.68Å; E673-K871 PolarHBondContact OE1-NZ 3.32Å; E673-K871 WeakPolarHBondContact OE2-CB 3.16Å; E673-K871 WeakPolarHBondContact OE2-CG 3.29Å; E673-K871 PolarHBondContact OE2-N 3.45Å; E673-K881 IonicContact OE1-NZ 3.85Å
674	M	80.4	Confident	88.9	Confident	28 Å²	28	28.1 Å²	28.1	14%	0.138	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	134	177.8	-54.2	-154	75.2	0	0	110.6	E776 K871 Q1479 D1482	M674-E776 WeakPolarHBondContact CE-OE1 3.42Å; M674-K871 WeakPolarHBondContact O-CE 3.24Å; M674-Q1479 HydrophobicContact SD-CB 4.46Å; M674-Q1479 HydrophobicContact SD-CG 3.78Å; M674-Q1479 PolarHBondContact SD-NE2 3.05Å; M674-D1482 HydrophobicContact CB-CB 4.33Å; M674-D1482 WeakPolarHBondContact CB-OD2 3.36Å
675	G	77.5	Confident	89.1	Confident	28 Å²	28	22.2 Å²	22.2	29%	0.289	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	103.2	-21.9	-179.4	0	0	0	0	0	115.7	E673 G677	E673-G675 PolarHBondContact O-N 3.06Å; G675-G677 PolarHBondContact O-N 3.11Å
676	L	84.9	Confident	89.3	Confident	2 Å²	2	12.8 Å²	12.8	1%	0.01	8%	0.077	C	C	.	.	S	Bend	trans	-70.3	12.6	179.3	-65.6	-179.9	0	0	0	115.1	Y650 D672 E673 Q681 R869 K871 V874	Y650-L676 HydrophobicContact CE2-CB 4.06Å; Y650-L676 HydrophobicContact CE2-CD2 4.14Å; Y650-L676 WeakPolarHBondContact CE2-O 3.4Å; D672-L676 HydrophobicContact CB-CB 4.04Å; D672-L676 HydrophobicContact CB-CD1 4.03Å; E673-L676 HydrophobicContact CB-CD1 4.21Å; L676-Q681 PolarHBondContact O-NE2 3.31Å; L676-R869 HydrophobicContact CD1-CB 4.41Å; L676-K871 HydrophobicContact CD2-CG 4.46Å; L676-V874 HydrophobicContact CD1-CG2 4.48Å; L676-V874 HydrophobicContact CD2-CB 4.27Å; L676-V874 HydrophobicContact CD2-CG1 3.94Å
677	G	85.7	Confident	89.4	Confident	15 Å²	15	10.1 Å²	10.1	16%	0.155	6%	0.063	C	C	.	.			trans	73.2	34.8	171.2	0	0	0	0	0	115.7	G675 T679 I680 Q681	G675-G677 PolarHBondContact O-N 3.11Å; G677-T679 PolarHBondContact O-N 2.92Å; G677-T679 VanDerWaalsContact O-N 3.14Å; G677-I680 WeakPolarHBondContact O-CB 3.24Å; G677-I680 PolarHBondContact O-N 2.89Å; G677-Q681 PolarHBondContact O-N 3.2Å
678	K	91.1	Very high	89.4	Confident	14 Å²	14	9.5 Å²	9.5	6%	0.061	6%	0.059	C	C	.	.	H	α-helix	trans	-46.6	-40.6	173.1	-68.2	-168.2	-76.4	-91.5	0	113.3	L670 D672 E673 Q681 T682 L802 T803	L670-K678 HydrophobicContact CD2-CB 3.98Å; L670-K678 HydrophobicContact CD2-CD 4.44Å; L670-K678 HydrophobicContact CD2-CG 3.86Å; L670-K678 HydrophobicContact CG-CD 4.25Å; L670-K678 HydrophobicContact CG-CG 4.09Å; L670-K678 WeakPolarHBondContact O-CD 3.48Å; D672-K678 HydrophobicContact CB-CD 4.08Å; D672-K678 HydrophobicContact CB-CG 3.82Å; D672-K678 PolarHBondContact O-NZ 2.85Å; E673-K678 PolarHBondContact O-NZ 3.1Å; K678-Q681 PolarHBondContact O-N 3.48Å; K678-T682 WeakPolarHBondContact O-CB 3.15Å; K678-T682 PolarHBondContact O-N 3.41Å; K678-T682 PolarHBondContact O-OG1 3.38Å; K678-L802 HydrophobicContact CD-CB 4.43Å; K678-T803 WeakPolarHBondContact CD-O 3.13Å; K678-T803 WeakPolarHBondContact CE-O 3.08Å; K678-T803 PolarHBondContact NZ-O 3.38Å
679	T	92.1	Very high	89.5	Confident	26 Å²	26	9.4 Å²	9.4	16%	0.16	6%	0.058	C	C	.	.	H	α-helix	trans	-58.1	-48.6	173.8	-48.6	0	0	0	0	112.1	G677 T682 I683 W711 E714	G677-T679 PolarHBondContact O-N 2.92Å; G677-T679 VanDerWaalsContact O-N 3.14Å; T679-T682 WeakPolarHBondContact O-CB 3.48Å; T679-T682 PolarHBondContact O-N 2.96Å; T679-I683 HydrophobicContact CG2-CD1 4.05Å; T679-I683 WeakPolarHBondContact O-CG1 3.37Å; T679-I683 PolarHBondContact O-N 2.83Å; T679-W711 HydrophobicContact CG2-CD2 3.78Å; T679-W711 HydrophobicContact CG2-CE3 3.7Å; T679-W711 HydrophobicContact CG2-CG 4.49Å; T679-W711 HydrophobicContact CG2-CH2 3.96Å; T679-W711 HydrophobicContact CG2-CZ2 3.99Å; T679-W711 HydrophobicContact CG2-CZ3 3.8Å; T679-E714 HydrophobicContact CG2-CB 4.47Å
680	I	91.8	Very high	89.5	Confident	26 Å²	26	9.5 Å²	9.5	13%	0.133	6%	0.059	C	C	.	.	H	α-helix	trans	-66.8	-42.9	-178.8	-57	167.4	0	0	0	110.3	L647 G677 T682 I683 S684 W718	L647-I680 HydrophobicContact CD2-CG2 3.54Å; G677-I680 WeakPolarHBondContact O-CB 3.24Å; G677-I680 PolarHBondContact O-N 2.89Å; I680-T682 VanDerWaalsContact C-N 3.26Å; I680-T682 PolarHBondContact O-N 3.25Å; I680-I683 PolarHBondContact O-N 2.81Å; I680-S684 PolarHBondContact O-N 3.45Å; I680-S684 PolarHBondContact O-OG 3.24Å; I680-W718 HydrophobicContact CD1-CH2 4.47Å; I680-W718 HydrophobicContact CD1-CZ2 3.67Å; I680-W718 HydrophobicContact CG1-CZ2 4.16Å; I680-W718 HydrophobicContact CG2-CD2 4.11Å; I680-W718 HydrophobicContact CG2-CE3 4.18Å; I680-W718 HydrophobicContact CG2-CH2 4.1Å; I680-W718 HydrophobicContact CG2-CZ2 4.03Å; I680-W718 HydrophobicContact CG2-CZ3 4.16Å
681	Q	92.9	Very high	89.3	Confident	0 Å²	0	11.2 Å²	11.2	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-59.9	-36.6	173.5	-65.5	177.6	64.1	0	0	112	Q651 L658 L670 D672 L676 G677 K678 S684 L685	Q651-Q681 HydrophobicContact CB-CG 4.01Å; Q651-Q681 HydrophobicContact CG-CG 4.18Å; L658-Q681 HydrophobicContact CD1-CB 4.44Å; L670-Q681 HydrophobicContact CD2-CB 4.24Å; D672-Q681 PolarHBondContact OD2-NE2 3.02Å; L676-Q681 PolarHBondContact O-NE2 3.31Å; G677-Q681 PolarHBondContact O-N 3.2Å; K678-Q681 PolarHBondContact O-N 3.48Å; Q681-S684 WeakPolarHBondContact CA-OG 3.37Å; Q681-S684 PolarHBondContact O-OG 3.01Å; Q681-L685 PolarHBondContact O-N 2.97Å; Q681-L685 VanDerWaalsContact O-N 3.08Å
682	T	94.1	Very high	89.2	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-72.6	-39.9	176.4	-56.3	0	0	0	0	112.1	K678 T679 I680 L685 L686 W711 I773 L800	K678-T682 WeakPolarHBondContact O-CB 3.15Å; K678-T682 PolarHBondContact O-N 3.41Å; K678-T682 PolarHBondContact O-OG1 3.38Å; T679-T682 WeakPolarHBondContact O-CB 3.48Å; T679-T682 PolarHBondContact O-N 2.96Å; I680-T682 VanDerWaalsContact C-N 3.26Å; I680-T682 PolarHBondContact O-N 3.25Å; T682-L685 PolarHBondContact O-N 3.42Å; T682-L686 WeakPolarHBondContact O-CG 3.36Å; T682-L686 PolarHBondContact O-N 2.95Å; T682-L686 VanDerWaalsContact O-N 3.14Å; T682-W711 HydrophobicContact CG2-CH2 4.11Å; T682-W711 HydrophobicContact CG2-CZ3 4.39Å; T682-I773 HydrophobicContact CG2-CD1 3.69Å; T682-I773 HydrophobicContact CG2-CG1 4.32Å; T682-I773 HydrophobicContact CG2-CG2 4.18Å; T682-L800 HydrophobicContact CG2-CD2 4.11Å
683	I	93.7	Very high	89.2	Confident	0 Å²	0	21 Å²	21	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-64.6	-42	174.5	-68.3	168.3	0	0	0	110.4	T679 I680 L685 L686 A687 W711 E714 F715 W718 C719	T679-I683 HydrophobicContact CG2-CD1 4.05Å; T679-I683 WeakPolarHBondContact O-CG1 3.37Å; T679-I683 PolarHBondContact O-N 2.83Å; I680-I683 PolarHBondContact O-N 2.81Å; I683-L685 VanDerWaalsContact C-N 3.35Å; I683-L685 PolarHBondContact O-N 2.87Å; I683-L686 PolarHBondContact O-N 3.41Å; I683-A687 PolarHBondContact O-N 2.8Å; I683-W711 HydrophobicContact CG1-CZ3 4.49Å; I683-E714 HydrophobicContact CD1-CB 4.16Å; I683-F715 HydrophobicContact CD1-CD1 4.36Å; I683-F715 HydrophobicContact CD1-CD2 4.48Å; I683-F715 HydrophobicContact CD1-CG 4.33Å; I683-F715 HydrophobicContact CG1-CD1 4.13Å; I683-F715 HydrophobicContact CG1-CE1 3.83Å; I683-F715 HydrophobicContact CG1-CE2 4.31Å; I683-F715 HydrophobicContact CG1-CG 4.49Å; I683-F715 HydrophobicContact CG1-CZ 3.92Å; I683-F715 HydrophobicContact CG2-CD1 4.38Å; I683-F715 HydrophobicContact CG2-CE1 4.32Å; I683-W718 HydrophobicContact CG2-CB 4.05Å; I683-C719 HydrophobicContact CG2-CB 4.13Å
684	S	92.6	Very high	89.4	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-66.7	-33.7	177.4	68.3	0	0	0	0	112.8	I680 Q681 A687 Y688	I680-S684 PolarHBondContact O-N 3.45Å; I680-S684 PolarHBondContact O-OG 3.24Å; Q681-S684 WeakPolarHBondContact CA-OG 3.37Å; Q681-S684 PolarHBondContact O-OG 3.01Å; S684-A687 PolarHBondContact O-N 3.44Å; S684-Y688 VanDerWaalsContact O-CB 3.23Å; S684-Y688 WeakPolarHBondContact O-CB 3.45Å; S684-Y688 PolarHBondContact O-N 3.13Å
685	L	92.9	Very high	89.9	Confident	3 Å²	3	21.2 Å²	21.2	2%	0.016	13%	0.127	C	C	.	.	H	α-helix	trans	-61	-46	169.4	176.4	66.3	0	0	0	111.8	L655 L658 V659 Q681 T682 I683 Y688 L689 Y771 L800	L655-L685 HydrophobicContact CD1-CB 4.12Å; L655-L685 HydrophobicContact CD1-CD1 4.49Å; L658-L685 HydrophobicContact CB-CD1 3.95Å; L658-L685 HydrophobicContact CB-CD2 4.05Å; L658-L685 HydrophobicContact CB-CG 4.42Å; L658-L685 HydrophobicContact CD1-CB 4.35Å; L658-L685 HydrophobicContact CD1-CD2 4.29Å; L658-L685 HydrophobicContact CD2-CD2 4.4Å; L658-L685 HydrophobicContact CG-CD2 4.48Å; V659-L685 HydrophobicContact CG2-CD1 4.16Å; Q681-L685 PolarHBondContact O-N 2.97Å; Q681-L685 VanDerWaalsContact O-N 3.08Å; T682-L685 PolarHBondContact O-N 3.42Å; I683-L685 VanDerWaalsContact C-N 3.35Å; I683-L685 PolarHBondContact O-N 2.87Å; L685-Y688 PolarHBondContact O-N 3Å; L685-L689 HydrophobicContact CD1-CD1 4.19Å; L685-L689 HydrophobicContact CD1-CG 4.33Å; L685-L689 HydrophobicContact CG-CD1 4.04Å; L685-L689 WeakPolarHBondContact O-CB 3.08Å; L685-L689 WeakPolarHBondContact O-CG 3.3Å; L685-L689 PolarHBondContact O-N 2.93Å; L685-Y771 HydrophobicContact CD2-CE1 4Å; L685-L800 HydrophobicContact CD2-CD2 4.2Å
686	L	93.8	Very high	90.4	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-65.1	-41	178	-65.9	176.1	0	0	0	111.7	T682 I683 L689 A690 H699 I701 F715 F722 V749 I773	T682-L686 WeakPolarHBondContact O-CG 3.36Å; T682-L686 PolarHBondContact O-N 2.95Å; T682-L686 VanDerWaalsContact O-N 3.14Å; I683-L686 PolarHBondContact O-N 3.41Å; L686-L689 PolarHBondContact O-N 2.81Å; L686-A690 PolarHBondContact O-N 3.08Å; L686-H699 HydrophobicContact CD2-CB 4.42Å; L686-H699 VanDerWaalsContact CD2-CE1 3.49Å; L686-H699 WeakPolarHBondContact CD2-CE1 3.49Å; L686-H699 VanDerWaalsContact CD2-ND1 3.33Å; L686-H699 WeakPolarHBondContact CD2-ND1 3.43Å; L686-I701 HydrophobicContact CD1-CD1 4.43Å; L686-F715 HydrophobicContact CD1-CE1 4.2Å; L686-F715 HydrophobicContact CD1-CZ 3.86Å; L686-F722 HydrophobicContact CB-CE2 4.5Å; L686-F722 HydrophobicContact CB-CZ 4.3Å; L686-F722 WeakPolarHBondContact O-CZ 3.43Å; L686-V749 HydrophobicContact CD1-CG2 4.39Å; L686-I773 HydrophobicContact CD1-CD1 4.25Å; L686-I773 HydrophobicContact CD2-CD1 4.46Å
687	A	92.1	Very high	90.4	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-61.1	-46.9	173.9	0	0	0	0	0	112	P639 L641 I683 S684 L689 A690 C691 F722	P639-A687 HydrophobicContact CB-CB 4.37Å; P639-A687 HydrophobicContact CG-CB 3.92Å; L641-A687 HydrophobicContact CB-CB 4.31Å; I683-A687 PolarHBondContact O-N 2.8Å; S684-A687 PolarHBondContact O-N 3.44Å; A687-L689 PolarHBondContact O-N 2.77Å; A687-A690 PolarHBondContact O-N 2.85Å; A687-C691 PolarHBondContact O-N 3.23Å; A687-C691 PolarHBondContact O-SG 3.42Å; A687-F722 HydrophobicContact CB-CE2 4.4Å
688	Y	91.6	Very high	90.7	Very high	11 Å²	11	26.5 Å²	26.5	4%	0.043	15%	0.146	C	C	.	.	H	α-helix	trans	-56.7	-47	175.7	175	-88.7	0	0	0	111.8	V636 V659 S684 L685 A690 C691 E692	V636-Y688 HydrophobicContact CG1-CD2 3.7Å; V636-Y688 HydrophobicContact CG1-CE2 3.6Å; V659-Y688 HydrophobicContact CB-CE1 4.19Å; V659-Y688 HydrophobicContact CG1-CD1 4.44Å; V659-Y688 HydrophobicContact CG1-CE1 3.6Å; V659-Y688 HydrophobicContact CG2-CD1 3.44Å; V659-Y688 VanDerWaalsContact CG2-CD1 3.44Å; V659-Y688 HydrophobicContact CG2-CD2 4.29Å; V659-Y688 HydrophobicContact CG2-CE1 3.46Å; V659-Y688 VanDerWaalsContact CG2-CE1 3.46Å; V659-Y688 HydrophobicContact CG2-CE2 4.29Å; V659-Y688 HydrophobicContact CG2-CG 3.92Å; S684-Y688 VanDerWaalsContact O-CB 3.23Å; S684-Y688 WeakPolarHBondContact O-CB 3.45Å; S684-Y688 PolarHBondContact O-N 3.13Å; L685-Y688 PolarHBondContact O-N 3Å; Y688-A690 VanDerWaalsContact C-N 3.34Å; Y688-A690 PolarHBondContact O-N 2.87Å; Y688-C691 PolarHBondContact O-N 2.83Å; Y688-E692 HydrophobicContact CE2-CB 4.29Å; Y688-E692 HydrophobicContact CE2-CG 4.07Å; Y688-E692 WeakPolarHBondContact CE2-OE1 3.35Å; Y688-E692 WeakPolarHBondContact CE2-OE2 3.35Å; Y688-E692 PolarHBondContact O-N 3.22Å; Y688-E692 PolarHBondContact OH-OE2 2.72Å
689	L	91.9	Very high	90.9	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.005	14%	0.143	C	C	.	.	H	α-helix	trans	-63.4	-36	177.9	-71.5	168.7	0	0	0	113	Y662 L685 L686 A687 R693 G694 V695 Y771	Y662-L689 HydrophobicContact CD1-CD2 3.66Å; Y662-L689 HydrophobicContact CD2-CD2 4.4Å; Y662-L689 HydrophobicContact CE1-CD2 3.43Å; Y662-L689 VanDerWaalsContact CE1-CD2 3.43Å; Y662-L689 HydrophobicContact CE2-CD2 4.19Å; Y662-L689 HydrophobicContact CG-CD2 4.13Å; L685-L689 HydrophobicContact CD1-CD1 4.19Å; L685-L689 HydrophobicContact CD1-CG 4.33Å; L685-L689 HydrophobicContact CG-CD1 4.04Å; L685-L689 WeakPolarHBondContact O-CB 3.08Å; L685-L689 WeakPolarHBondContact O-CG 3.3Å; L685-L689 PolarHBondContact O-N 2.93Å; L686-L689 PolarHBondContact O-N 2.81Å; A687-L689 PolarHBondContact O-N 2.77Å; L689-R693 HydrophobicContact CD2-CB 4.29Å; L689-R693 HydrophobicContact CD2-CG 4Å; L689-R693 CarbonylContact O-C 3.49Å; L689-R693 WeakPolarHBondContact O-CA 2.95Å; L689-R693 WeakPolarHBondContact O-CB 3.46Å; L689-R693 PolarHBondContact O-N 3.3Å; L689-G694 PolarHBondContact O-N 2.76Å; L689-V695 HydrophobicContact CB-CB 4.42Å; L689-V695 PolarHBondContact O-N 3.11Å; L689-Y771 HydrophobicContact CD1-CD2 4.33Å; L689-Y771 HydrophobicContact CD1-CE2 3.45Å; L689-Y771 VanDerWaalsContact CD1-CE2 3.45Å
690	A	91.4	Very high	91	Very high	6 Å²	6	24.6 Å²	24.6	5%	0.05	14%	0.135	C	C	.	.	H	α-helix	trans	-70.6	-37.9	174.2	0	0	0	0	0	112.5	L641 L686 A687 Y688 W696 F722	L641-A690 HydrophobicContact CD1-CB 4.23Å; L686-A690 PolarHBondContact O-N 3.08Å; A687-A690 PolarHBondContact O-N 2.85Å; Y688-A690 VanDerWaalsContact C-N 3.34Å; Y688-A690 PolarHBondContact O-N 2.87Å; A690-W696 HydrophobicContact CB-CD2 3.93Å; A690-W696 HydrophobicContact CB-CE3 4.11Å; A690-W696 HydrophobicContact CB-CG 4.42Å; A690-W696 HydrophobicContact CB-CH2 4.41Å; A690-W696 HydrophobicContact CB-CZ2 4.22Å; A690-W696 HydrophobicContact CB-CZ3 4.35Å; A690-F722 HydrophobicContact CB-CE1 4.16Å; A690-F722 HydrophobicContact CB-CZ 3.78Å
691	C	88.4	Confident	91.3	Very high	36 Å²	36	23.3 Å²	23.3	24%	0.243	13%	0.129	C	C	.	.	H	α-helix	trans	-72.2	-60.9	179.5	-63.4	0	0	0	0	112.8	P639 F640 L641 A687 Y688	P639-C691 HydrophobicContact CB-CB 4.36Å; F640-C691 HydrophobicContact CD1-CB 4.29Å; F640-C691 HydrophobicContact CE1-CB 3.93Å; F640-C691 WeakPolarHBondContact CE1-SG 3.42Å; L641-C691 VanDerWaalsContact CD1-SG 3.6Å; A687-C691 PolarHBondContact O-N 3.23Å; A687-C691 PolarHBondContact O-SG 3.42Å; Y688-C691 PolarHBondContact O-N 2.83Å
692	E	85.8	Confident	91.4	Very high	94 Å²	94	23.3 Å²	23.3	44%	0.439	13%	0.129	S	C	.	.	H	α-helix	trans	-96.5	-25.1	-166.8	-69.2	-174.3	-151	0	0	113.8	Y688	Y688-E692 HydrophobicContact CE2-CB 4.29Å; Y688-E692 HydrophobicContact CE2-CG 4.07Å; Y688-E692 WeakPolarHBondContact CE2-OE1 3.35Å; Y688-E692 WeakPolarHBondContact CE2-OE2 3.35Å; Y688-E692 PolarHBondContact O-N 3.22Å; Y688-E692 PolarHBondContact OH-OE2 2.72Å
693	R	86.9	Confident	91.3	Very high	114 Å²	114	23.3 Å²	23.3	43%	0.43	13%	0.129	S	C	.	.	S	Bend	trans	-105.2	-6.7	178.1	-56.5	-58.1	-163.5	-148.3	2.3	113.2	Y662 D663 L689 V695	Y662-R693 HydrophobicContact CE1-CG 4.32Å; D663-R693 IonicContact OD1-CZ 3.88Å; D663-R693 IonicContact OD1-NE 3.73Å; D663-R693 IonicContact OD1-NH2 2.83Å; D663-R693 PolarHBondContact OD1-NH2 3.4Å; D663-R693 IonicContact OD2-CZ 2.68Å; D663-R693 IonicContact OD2-NH2 2.75Å; D663-R693 PolarHBondContact OD2-NH2 2.81Å; L689-R693 HydrophobicContact CD2-CB 4.29Å; L689-R693 HydrophobicContact CD2-CG 4Å; L689-R693 CarbonylContact O-C 3.49Å; L689-R693 WeakPolarHBondContact O-CA 2.95Å; L689-R693 WeakPolarHBondContact O-CB 3.46Å; L689-R693 PolarHBondContact O-N 3.3Å; R693-V695 HydrophobicContact CB-CG2 4.11Å; R693-V695 PolarHBondContact O-N 3.33Å
694	G	86.7	Confident	91.1	Very high	50 Å²	50	24.4 Å²	24.4	52%	0.515	14%	0.136	S	C	.	.			trans	63.6	17.4	-176.2	0	0	0	0	0	114.6	L689 W696	L689-G694 PolarHBondContact O-N 2.76Å; G694-W696 PolarHBondContact O-N 3.1Å
695	V	89.1	Confident	90.7	Very high	18 Å²	18	26.9 Å²	26.9	11%	0.109	15%	0.151	C	C	.	.			trans	-95.4	98.2	-174.7	178.1	0	0	0	0	110.1	L689 R693 K770	L689-V695 HydrophobicContact CB-CB 4.42Å; L689-V695 PolarHBondContact O-N 3.11Å; R693-V695 HydrophobicContact CB-CG2 4.11Å; R693-V695 PolarHBondContact O-N 3.33Å; V695-K770 HydrophobicContact CG1-CD 3.68Å; V695-K770 HydrophobicContact CG1-CG 3.98Å
696	W	88.8	Confident	90	Very high	98 Å²	98	28.7 Å²	28.7	37%	0.371	16%	0.164	S	C	.	.			trans	-90.4	-16.3	-178.8	-70.7	83.8	0	0	0	115.2	L641 A690 G694 F722 H748	L641-W696 HydrophobicContact CD1-CH2 4.05Å; A690-W696 HydrophobicContact CB-CD2 3.93Å; A690-W696 HydrophobicContact CB-CE3 4.11Å; A690-W696 HydrophobicContact CB-CG 4.42Å; A690-W696 HydrophobicContact CB-CH2 4.41Å; A690-W696 HydrophobicContact CB-CZ2 4.22Å; A690-W696 HydrophobicContact CB-CZ3 4.35Å; G694-W696 PolarHBondContact O-N 3.1Å; W696-F722 HydrophobicContact CE3-CD1 4.24Å; W696-F722 AromaticContact CE3-CE1 3.92Å; W696-F722 HydrophobicContact CE3-CE1 3.92Å; W696-F722 HydrophobicContact CZ3-CD1 4.45Å; W696-F722 HydrophobicContact CZ3-CE1 4.27Å; W696-H748 AromaticContact CE3-CE1 3.7Å; W696-H748 AromaticContact CE3-ND1 3.54Å; W696-H748 WeakPolarHBondContact O-CB 3.35Å
697	G	85.4	Confident	89.6	Confident	26 Å²	26	29.4 Å²	29.4	27%	0.268	17%	0.168	S	C	.	.			trans	143.3	-160.9	177	0	0	0	0	0	115.5	H699	G697-H699 WeakPolarHBondContact CA-CD2 3.48Å; G697-H699 VanDerWaalsContact CA-NE2 3.33Å; G697-H699 WeakPolarHBondContact CA-NE2 3.13Å; G697-H699 PolarHBondContact N-NE2 3.11Å
698	P	92.3	Very high	89.4	Confident	32 Å²	32	29.6 Å²	29.6	21%	0.208	17%	0.169	C	C	.	.			cis	-77.5	139	2.4	33	-35.8	0	0	0	112.7	H748 K767 K768 W769 K770	P698-H748 WeakPolarHBondContact CA-O 3.23Å; P698-K767 HydrophobicContact CG-CG 4.43Å; P698-K768 WeakPolarHBondContact CG-O 3.16Å; P698-W769 HydrophobicContact CB-CE3 3.88Å; P698-W769 HydrophobicContact CB-CZ3 3.9Å; P698-W769 HydrophobicContact CG-CE3 4.18Å; P698-K770 WeakPolarHBondContact O-CB 3.49Å; P698-K770 PolarHBondContact O-N 2.76Å
699	H	94.6	Very high	89.1	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	140.3	174	-55.9	-91.3	0	0	0	110.4	L686 G697 H748 V749 C750 Y771	L686-H699 HydrophobicContact CD2-CB 4.42Å; L686-H699 VanDerWaalsContact CD2-CE1 3.49Å; L686-H699 WeakPolarHBondContact CD2-CE1 3.49Å; L686-H699 VanDerWaalsContact CD2-ND1 3.33Å; L686-H699 WeakPolarHBondContact CD2-ND1 3.43Å; G697-H699 WeakPolarHBondContact CA-CD2 3.48Å; G697-H699 VanDerWaalsContact CA-NE2 3.33Å; G697-H699 WeakPolarHBondContact CA-NE2 3.13Å; G697-H699 PolarHBondContact N-NE2 3.11Å; H699-H748 PolarHBondContact N-O 2.99Å; H699-V749 HydrophobicContact CB-CG2 4.48Å; H699-C750 PolarHBondContact O-N 3.19Å; H699-Y771 AromaticContact CE1-CD2 3.85Å; H699-Y771 AromaticContact ND1-CD2 3.66Å; H699-Y771 AromaticContact ND1-CG 3.97Å
700	L	95.2	Very high	88.8	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	130.9	174.2	-176.4	58.4	0	0	0	109.8	V702 C750 T752 F764 W769 Y771 L772 I773 F794	L700-V702 HydrophobicContact CD2-CG2 4.49Å; L700-V702 HydrophobicContact CG-CG2 4.26Å; L700-C750 HydrophobicContact CD1-CB 4.2Å; L700-T752 HydrophobicContact CD1-CG2 3.85Å; L700-F764 HydrophobicContact CD1-CD1 4.08Å; L700-F764 HydrophobicContact CD1-CE1 3.78Å; L700-F764 HydrophobicContact CD2-CD1 3.88Å; L700-F764 HydrophobicContact CD2-CE1 4.38Å; L700-W769 HydrophobicContact CB-CD2 3.71Å; L700-W769 HydrophobicContact CB-CE3 3.56Å; L700-W769 HydrophobicContact CB-CG 4.22Å; L700-W769 HydrophobicContact CB-CH2 4.29Å; L700-W769 HydrophobicContact CB-CZ2 4.47Å; L700-W769 HydrophobicContact CB-CZ3 3.84Å; L700-W769 HydrophobicContact CD1-CH2 4.17Å; L700-W769 HydrophobicContact CD1-CZ2 4.43Å; L700-W769 HydrophobicContact CD1-CZ3 4.41Å; L700-W769 HydrophobicContact CD2-CD2 4.28Å; L700-W769 HydrophobicContact CD2-CZ2 4.2Å; L700-Y771 PolarHBondContact N-O 3.28Å; L700-L772 HydrophobicContact CB-CD1 4.3Å; L700-L772 HydrophobicContact CD2-CD1 3.95Å; L700-L772 HydrophobicContact CG-CD1 4.11Å; L700-I773 PolarHBondContact O-N 2.68Å; L700-F794 HydrophobicContact CD2-CD2 4.02Å; L700-F794 HydrophobicContact CD2-CE2 4.07Å
701	I	96.4	Very high	88.8	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	121.3	176	-47.1	-178.1	0	0	0	107.6	L686 V703 W711 F715 V749 C750 I751 T752 I773	L686-I701 HydrophobicContact CD1-CD1 4.43Å; I701-V703 HydrophobicContact CB-CG2 4.49Å; I701-V703 HydrophobicContact CG2-CG2 3.63Å; I701-W711 HydrophobicContact CD1-CE3 4.17Å; I701-W711 HydrophobicContact CD1-CZ3 3.95Å; I701-W711 HydrophobicContact CG2-CD2 4.49Å; I701-W711 HydrophobicContact CG2-CE3 4.37Å; I701-W711 HydrophobicContact CG2-CH2 4.24Å; I701-W711 HydrophobicContact CG2-CZ2 4.37Å; I701-W711 HydrophobicContact CG2-CZ3 4.25Å; I701-F715 HydrophobicContact CD1-CE2 3.57Å; I701-F715 HydrophobicContact CD1-CZ 3.67Å; I701-V749 HydrophobicContact CD1-CG1 3.53Å; I701-V749 HydrophobicContact CG1-CG1 3.97Å; I701-C750 PolarHBondContact N-O 3.31Å; I701-I751 WeakPolarHBondContact O-CA 2.96Å; I701-T752 PolarHBondContact O-N 2.71Å; I701-I773 WeakPolarHBondContact CA-O 3.16Å; I701-I773 HydrophobicContact CB-CB 4.48Å; I701-I773 HydrophobicContact CD1-CD1 4.25Å; I701-I773 HydrophobicContact CG1-CB 4.24Å; I701-I773 HydrophobicContact CG1-CD1 3.99Å; I701-I773 HydrophobicContact CG2-CB 4.17Å; I701-I773 HydrophobicContact CG2-CG2 4.01Å
702	V	95.1	Very high	88.9	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	124.8	177.7	-169.6	0	0	0	0	108.3	L700 T752 Y754 A757 L772 I773 L774 D775 L791	L700-V702 HydrophobicContact CD2-CG2 4.49Å; L700-V702 HydrophobicContact CG-CG2 4.26Å; V702-T752 WeakPolarHBondContact CA-O 3.46Å; V702-T752 HydrophobicContact CB-CG2 4.49Å; V702-T752 HydrophobicContact CG1-CG2 4.43Å; V702-T752 HydrophobicContact CG2-CG2 4.02Å; V702-Y754 HydrophobicContact CB-CE1 4.49Å; V702-Y754 HydrophobicContact CG1-CD1 3.59Å; V702-Y754 HydrophobicContact CG1-CD2 4.04Å; V702-Y754 HydrophobicContact CG1-CE1 3.83Å; V702-Y754 HydrophobicContact CG1-CE2 4.26Å; V702-Y754 HydrophobicContact CG1-CG 3.71Å; V702-A757 HydrophobicContact CG1-CB 4.38Å; V702-L772 HydrophobicContact CG2-CD1 3.96Å; V702-I773 PolarHBondContact N-O 3.47Å; V702-L774 HydrophobicContact CB-CD2 3.64Å; V702-L774 HydrophobicContact CG1-CD2 4.47Å; V702-L774 HydrophobicContact CG2-CD2 3.72Å; V702-D775 PolarHBondContact O-N 2.77Å; V702-L791 HydrophobicContact CG2-CD2 4.25Å
703	V	92.5	Very high	89	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	150.5	-164.5	-175.3	0	0	0	0	109.4	I701 V707 I708 W711 I751 T752 S753 D775	I701-V703 HydrophobicContact CB-CG2 4.49Å; I701-V703 HydrophobicContact CG2-CG2 3.63Å; V703-V707 HydrophobicContact CG1-CB 3.71Å; V703-V707 HydrophobicContact CG1-CG1 4.46Å; V703-I708 HydrophobicContact CB-CG1 4.21Å; V703-I708 HydrophobicContact CG1-CG1 4.38Å; V703-W711 HydrophobicContact CG1-CG 4.49Å; V703-W711 HydrophobicContact CG2-CG 4.28Å; V703-I751 HydrophobicContact CG2-CG2 3.95Å; V703-T752 PolarHBondContact N-O 3.47Å; V703-S753 WeakPolarHBondContact O-CA 3.49Å; V703-D775 HydrophobicContact CG2-CB 4.3Å
704	P	89	Confident	89.2	Confident	22 Å²	22	32.8 Å²	32.8	14%	0.143	20%	0.195	C	C	.	.			trans	-58.7	141.5	166.6	-22.3	34.1	0	0	0	111.4	S706 V707 Y754 E776	P704-S706 PolarHBondContact O-N 3.46Å; P704-V707 HydrophobicContact CB-CG2 4.34Å; P704-V707 PolarHBondContact O-N 3.46Å; P704-Y754 HydrophobicContact CG-CE2 4.37Å; P704-E776 HydrophobicContact CG-CB 3.84Å; P704-E776 HydrophobicContact CG-CG 3.96Å
705	T	85	Confident	89.4	Confident	52 Å²	52	30.4 Å²	30.4	32%	0.319	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-52.3	-36.1	-170.8	-49.8	0	0	0	0	113.6	V707 F728	T705-V707 VanDerWaalsContact C-N 3.34Å; T705-V707 PolarHBondContact O-N 3.46Å; T705-F728 HydrophobicContact CG2-CD2 4.44Å; T705-F728 HydrophobicContact CG2-CE2 3.85Å
706	S	77.9	Confident	89.5	Confident	41 Å²	41	35.1 Å²	35.1	29%	0.287	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-67.4	-24.8	179.1	48.6	0	0	0	0	115	P704	P704-S706 PolarHBondContact O-N 3.46Å
707	V	84.6	Confident	89.6	Confident	16 Å²	16	37.6 Å²	37.6	10%	0.097	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-101.5	-4	-172.5	-156.8	0	0	0	0	112.2	V703 P704 T705 L709 N710 W711	V703-V707 HydrophobicContact CG1-CB 3.71Å; V703-V707 HydrophobicContact CG1-CG1 4.46Å; P704-V707 HydrophobicContact CB-CG2 4.34Å; P704-V707 PolarHBondContact O-N 3.46Å; T705-V707 VanDerWaalsContact C-N 3.34Å; T705-V707 PolarHBondContact O-N 3.46Å; V707-L709 VanDerWaalsContact C-N 3.34Å; V707-L709 PolarHBondContact O-N 2.86Å; V707-N710 HydrophobicContact CG1-CB 3.95Å; V707-N710 WeakPolarHBondContact O-CB 3.19Å; V707-N710 PolarHBondContact O-N 3.3Å; V707-N710 VanDerWaalsContact O-N 3.13Å; V707-W711 PolarHBondContact O-N 2.79Å
708	I	88.1	Confident	89.8	Confident	5 Å²	5	37.3 Å²	37.3	3%	0.026	19%	0.19	C	C	.	.	H	α-helix	trans	-57	-44.5	179.6	-66.7	175.5	0	0	0	111.9	V703 W711 E712 T726 I751	V703-I708 HydrophobicContact CB-CG1 4.21Å; V703-I708 HydrophobicContact CG1-CG1 4.38Å; I708-W711 PolarHBondContact O-N 3.18Å; I708-E712 PolarHBondContact O-N 3.1Å; I708-T726 HydrophobicContact CG2-CG2 4.03Å; I708-I751 HydrophobicContact CG1-CG2 4.37Å; I708-I751 HydrophobicContact CG2-CG2 4.05Å
709	L	85.2	Confident	89.6	Confident	115 Å²	115	35.8 Å²	35.8	60%	0.602	18%	0.18	S	C	*	.	H	α-helix	trans	-66.6	-38.7	178.1	-64.3	176.1	0	0	0	111.7	V707 E712 V713	V707-L709 VanDerWaalsContact C-N 3.34Å; V707-L709 PolarHBondContact O-N 2.86Å; L709-E712 PolarHBondContact O-N 3.13Å; L709-V713 WeakPolarHBondContact O-CG2 3.21Å; L709-V713 PolarHBondContact O-N 2.77Å
710	N	86.2	Confident	89.3	Confident	62 Å²	62	39.5 Å²	39.5	33%	0.332	20%	0.204	S	C	.	.	H	α-helix	trans	-64.1	-42.6	176.4	-178.7	68.3	0	0	0	111.7	V707 E712 V713 E714	V707-N710 HydrophobicContact CG1-CB 3.95Å; V707-N710 WeakPolarHBondContact O-CB 3.19Å; V707-N710 PolarHBondContact O-N 3.3Å; V707-N710 VanDerWaalsContact O-N 3.13Å; N710-E712 PolarHBondContact O-N 3.16Å; N710-V713 PolarHBondContact O-N 2.77Å; N710-E714 WeakPolarHBondContact O-CB 3.46Å; N710-E714 WeakPolarHBondContact O-CG 3.45Å; N710-E714 PolarHBondContact O-N 2.77Å
711	W	91.5	Very high	88.9	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62.2	-39.9	171.7	-83.9	88	0	0	0	112.1	T679 T682 I683 I701 V703 V707 I708 F715 I751 D775 L802	T679-W711 HydrophobicContact CG2-CD2 3.78Å; T679-W711 HydrophobicContact CG2-CE3 3.7Å; T679-W711 HydrophobicContact CG2-CG 4.49Å; T679-W711 HydrophobicContact CG2-CH2 3.96Å; T679-W711 HydrophobicContact CG2-CZ2 3.99Å; T679-W711 HydrophobicContact CG2-CZ3 3.8Å; T682-W711 HydrophobicContact CG2-CH2 4.11Å; T682-W711 HydrophobicContact CG2-CZ3 4.39Å; I683-W711 HydrophobicContact CG1-CZ3 4.49Å; I701-W711 HydrophobicContact CD1-CE3 4.17Å; I701-W711 HydrophobicContact CD1-CZ3 3.95Å; I701-W711 HydrophobicContact CG2-CD2 4.49Å; I701-W711 HydrophobicContact CG2-CE3 4.37Å; I701-W711 HydrophobicContact CG2-CH2 4.24Å; I701-W711 HydrophobicContact CG2-CZ2 4.37Å; I701-W711 HydrophobicContact CG2-CZ3 4.25Å; V703-W711 HydrophobicContact CG1-CG 4.49Å; V703-W711 HydrophobicContact CG2-CG 4.28Å; V707-W711 PolarHBondContact O-N 2.79Å; I708-W711 PolarHBondContact O-N 3.18Å; W711-F715 HydrophobicContact CE3-CD2 4.26Å; W711-F715 AromaticContact CE3-CE2 3.7Å; W711-F715 HydrophobicContact CE3-CE2 3.7Å; W711-F715 HydrophobicContact CZ3-CE2 4.15Å; W711-F715 WeakPolarHBondContact O-CB 3.21Å; W711-F715 VanDerWaalsContact O-CD2 3.29Å; W711-F715 WeakPolarHBondContact O-CD2 3.39Å; W711-F715 PolarHBondContact O-N 3.2Å; W711-I751 HydrophobicContact CB-CD1 4.05Å; W711-D775 HydrophobicContact CZ2-CB 4.08Å; W711-D775 PolarHBondContact NE1-OD2 2.82Å; W711-L802 HydrophobicContact CH2-CD1 3.91Å; W711-L802 HydrophobicContact CZ2-CD1 3.87Å
712	E	90.5	Very high	88.7	Confident	43 Å²	43	42.8 Å²	42.8	20%	0.201	23%	0.226	C	C	.	.	H	α-helix	trans	-63.5	-41.6	176	-167.7	-178.4	149.1	0	0	112.2	I708 L709 N710 K716 T726	I708-E712 PolarHBondContact O-N 3.1Å; L709-E712 PolarHBondContact O-N 3.13Å; N710-E712 PolarHBondContact O-N 3.16Å; E712-K716 HydrophobicContact CG-CD 4.49Å; E712-K716 WeakPolarHBondContact O-CG 3.47Å; E712-K716 PolarHBondContact O-N 3.43Å; E712-K716 VanDerWaalsContact O-N 3.13Å; E712-K716 WeakPolarHBondContact OE1-CE 3.2Å; E712-K716 IonicContact OE1-NZ 2.74Å; E712-K716 PolarHBondContact OE1-NZ 3.17Å; E712-T726 HydrophobicContact CB-CG2 3.98Å; E712-T726 HydrophobicContact CG-CG2 4.02Å; E712-T726 WeakPolarHBondContact OE2-CG2 3.48Å; E712-T726 PolarHBondContact OE2-OG1 3.03Å
713	V	88.7	Confident	88.5	Confident	84 Å²	84	48 Å²	48	51%	0.509	25%	0.249	S	C	.	.	H	α-helix	trans	-66.1	-48.2	176.4	170.2	0	0	0	0	111.4	L709 N710 F715 K716 R717	L709-V713 WeakPolarHBondContact O-CG2 3.21Å; L709-V713 PolarHBondContact O-N 2.77Å; N710-V713 PolarHBondContact O-N 2.77Å; V713-F715 VanDerWaalsContact C-N 3.35Å; V713-F715 PolarHBondContact O-N 3.26Å; V713-K716 PolarHBondContact O-N 3.49Å; V713-R717 WeakPolarHBondContact O-CB 3.34Å; V713-R717 PolarHBondContact O-N 3.14Å
714	E	90.2	Very high	88.5	Confident	25 Å²	25	50.1 Å²	50.1	12%	0.117	26%	0.26	C	S	.	.	H	α-helix	trans	-66.1	-35.2	179.7	-71.8	-70.1	123.7	0	0	111.8	T679 I683 N710 R717 W718	T679-E714 HydrophobicContact CG2-CB 4.47Å; I683-E714 HydrophobicContact CD1-CB 4.16Å; N710-E714 WeakPolarHBondContact O-CB 3.46Å; N710-E714 WeakPolarHBondContact O-CG 3.45Å; N710-E714 PolarHBondContact O-N 2.77Å; E714-R717 PolarHBondContact O-N 3.41Å; E714-R717 WeakPolarHBondContact OE1-CD 3.31Å; E714-R717 IonicContact OE1-NH1 2.78Å; E714-R717 PolarHBondContact OE1-NH1 2.77Å; E714-W718 VanDerWaalsContact O-CD1 3.26Å; E714-W718 PolarHBondContact O-N 2.76Å; E714-W718 PolarHBondContact OE2-NE1 2.9Å
715	F	91.7	Very high	88.7	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.1	-45.6	170.5	-95.1	-67.7	0	0	0	112.8	I683 L686 I701 W711 V713 R717 C719 I724 V749 I751	I683-F715 HydrophobicContact CD1-CD1 4.36Å; I683-F715 HydrophobicContact CD1-CD2 4.48Å; I683-F715 HydrophobicContact CD1-CG 4.33Å; I683-F715 HydrophobicContact CG1-CD1 4.13Å; I683-F715 HydrophobicContact CG1-CE1 3.83Å; I683-F715 HydrophobicContact CG1-CE2 4.31Å; I683-F715 HydrophobicContact CG1-CG 4.49Å; I683-F715 HydrophobicContact CG1-CZ 3.92Å; I683-F715 HydrophobicContact CG2-CD1 4.38Å; I683-F715 HydrophobicContact CG2-CE1 4.32Å; L686-F715 HydrophobicContact CD1-CE1 4.2Å; L686-F715 HydrophobicContact CD1-CZ 3.86Å; I701-F715 HydrophobicContact CD1-CE2 3.57Å; I701-F715 HydrophobicContact CD1-CZ 3.67Å; W711-F715 HydrophobicContact CE3-CD2 4.26Å; W711-F715 AromaticContact CE3-CE2 3.7Å; W711-F715 HydrophobicContact CE3-CE2 3.7Å; W711-F715 HydrophobicContact CZ3-CE2 4.15Å; W711-F715 WeakPolarHBondContact O-CB 3.21Å; W711-F715 VanDerWaalsContact O-CD2 3.29Å; W711-F715 WeakPolarHBondContact O-CD2 3.39Å; W711-F715 PolarHBondContact O-N 3.2Å; V713-F715 VanDerWaalsContact C-N 3.35Å; V713-F715 PolarHBondContact O-N 3.26Å; F715-R717 VanDerWaalsContact C-N 3.27Å; F715-R717 PolarHBondContact O-N 2.94Å; F715-C719 CarbonylContact O-C 3.58Å; F715-C719 PolarHBondContact O-N 2.79Å; F715-I724 HydrophobicContact CB-CD1 3.73Å; F715-I724 HydrophobicContact CB-CG1 3.88Å; F715-I724 HydrophobicContact CD1-CG1 4.28Å; F715-I724 HydrophobicContact CG-CD1 4.33Å; F715-I724 HydrophobicContact CG-CG1 4Å; F715-V749 HydrophobicContact CE1-CG2 4.23Å; F715-V749 HydrophobicContact CE2-CG1 4.04Å; F715-V749 HydrophobicContact CZ-CG1 3.9Å; F715-V749 HydrophobicContact CZ-CG2 4.22Å; F715-I751 HydrophobicContact CD2-CD1 3.99Å; F715-I751 HydrophobicContact CE2-CD1 4.27Å
716	K	91.3	Very high	89.1	Confident	117 Å²	117	50 Å²	50	51%	0.509	26%	0.256	S	S	.	.	H	α-helix	trans	-62.7	-34.5	176.6	-73.1	170.8	-175.8	171.1	0	112.2	E712 V713	E712-K716 HydrophobicContact CG-CD 4.49Å; E712-K716 WeakPolarHBondContact O-CG 3.47Å; E712-K716 PolarHBondContact O-N 3.43Å; E712-K716 VanDerWaalsContact O-N 3.13Å; E712-K716 WeakPolarHBondContact OE1-CE 3.2Å; E712-K716 IonicContact OE1-NZ 2.74Å; E712-K716 PolarHBondContact OE1-NZ 3.17Å; V713-K716 PolarHBondContact O-N 3.49Å
717	R	90	Very high	89.8	Confident	149 Å²	149	48.1 Å²	48.1	56%	0.562	24%	0.243	S	C	*	.	H	α-helix	trans	-73.1	-49.2	179.2	-177.6	-175.3	-176.8	175.1	5.3	113	G644 V713 E714 F715	G644-R717 WeakPolarHBondContact CA-O 3.22Å; V713-R717 WeakPolarHBondContact O-CB 3.34Å; V713-R717 PolarHBondContact O-N 3.14Å; E714-R717 PolarHBondContact O-N 3.41Å; E714-R717 WeakPolarHBondContact OE1-CD 3.31Å; E714-R717 IonicContact OE1-NH1 2.78Å; E714-R717 PolarHBondContact OE1-NH1 2.77Å; F715-R717 VanDerWaalsContact C-N 3.27Å; F715-R717 PolarHBondContact O-N 2.94Å
718	W	89.3	Confident	90	Very high	21 Å²	21	52.7 Å²	52.7	8%	0.08	26%	0.262	C	S	.	.	H	α-helix	trans	-90.4	-41	-171.4	-70.6	93.4	0	0	0	113.7	L642 S643 G645 L647 I680 I683 E714	L642-W718 CarbonylContact C-O 3.29Å; L642-W718 WeakPolarHBondContact CA-O 3.39Å; L642-W718 HydrophobicContact CD2-CB 4.43Å; L642-W718 HydrophobicContact CD2-CE3 4.2Å; S643-W718 PolarHBondContact N-O 3.07Å; G645-W718 WeakPolarHBondContact O-CZ3 3.49Å; L647-W718 HydrophobicContact CD2-CZ3 4.39Å; I680-W718 HydrophobicContact CD1-CH2 4.47Å; I680-W718 HydrophobicContact CD1-CZ2 3.67Å; I680-W718 HydrophobicContact CG1-CZ2 4.16Å; I680-W718 HydrophobicContact CG2-CD2 4.11Å; I680-W718 HydrophobicContact CG2-CE3 4.18Å; I680-W718 HydrophobicContact CG2-CH2 4.1Å; I680-W718 HydrophobicContact CG2-CZ2 4.03Å; I680-W718 HydrophobicContact CG2-CZ3 4.16Å; I683-W718 HydrophobicContact CG2-CB 4.05Å; E714-W718 VanDerWaalsContact O-CD1 3.26Å; E714-W718 PolarHBondContact O-N 2.76Å; E714-W718 PolarHBondContact OE2-NE1 2.9Å
719	C	88.1	Confident	89.9	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.268	C	S	.	.			trans	-139.1	67.8	-175.7	-66.3	0	0	0	0	112.2	L641 I683 F715 S721 F722	L641-C719 PolarHBondContact O-SG 2.64Å; I683-C719 HydrophobicContact CG2-CB 4.13Å; F715-C719 CarbonylContact O-C 3.58Å; F715-C719 PolarHBondContact O-N 2.79Å; C719-S721 PolarHBondContact O-N 3.28Å; C719-F722 HydrophobicContact CB-CD2 3.7Å; C719-F722 HydrophobicContact CB-CE2 4.11Å; C719-F722 PolarHBondContact O-N 3.13Å; C719-F722 VanDerWaalsContact O-N 3.17Å
720	P	89.2	Confident	90	Very high	77 Å²	77	50.7 Å²	50.7	50%	0.5	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-14.9	-178.5	24.1	-34.6	0	0	0	114.6	F722	P720-F722 VanDerWaalsContact C-N 3.26Å; P720-F722 PolarHBondContact O-N 3.04Å
721	S	87.2	Confident	90.1	Very high	61 Å²	61	51.5 Å²	51.5	43%	0.427	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-13.1	176.5	-45.9	0	0	0	0	114.6	C719	C719-S721 PolarHBondContact O-N 3.28Å
722	F	90.5	Very high	90.1	Very high	8 Å²	8	57.5 Å²	57.5	4%	0.035	28%	0.284	C	S	.	.	S	Bend	trans	-82.5	135.1	176.5	-80	-71.3	0	0	0	112.5	L686 A687 A690 W696 C719 P720 I724 H748 V749	L686-F722 HydrophobicContact CB-CE2 4.5Å; L686-F722 HydrophobicContact CB-CZ 4.3Å; L686-F722 WeakPolarHBondContact O-CZ 3.43Å; A687-F722 HydrophobicContact CB-CE2 4.4Å; A690-F722 HydrophobicContact CB-CE1 4.16Å; A690-F722 HydrophobicContact CB-CZ 3.78Å; W696-F722 HydrophobicContact CE3-CD1 4.24Å; W696-F722 AromaticContact CE3-CE1 3.92Å; W696-F722 HydrophobicContact CE3-CE1 3.92Å; W696-F722 HydrophobicContact CZ3-CD1 4.45Å; W696-F722 HydrophobicContact CZ3-CE1 4.27Å; C719-F722 HydrophobicContact CB-CD2 3.7Å; C719-F722 HydrophobicContact CB-CE2 4.11Å; C719-F722 PolarHBondContact O-N 3.13Å; C719-F722 VanDerWaalsContact O-N 3.17Å; P720-F722 VanDerWaalsContact C-N 3.26Å; P720-F722 PolarHBondContact O-N 3.04Å; F722-I724 HydrophobicContact CB-CD1 4.41Å; F722-I724 HydrophobicContact CB-CG1 4.38Å; F722-I724 WeakPolarHBondContact O-CD1 3.44Å; F722-I724 PolarHBondContact O-N 3.44Å; F722-I724 VanDerWaalsContact O-N 3.13Å; F722-H748 HydrophobicContact CD1-CB 3.78Å; F722-H748 AromaticContact CD1-ND1 3.88Å; F722-V749 HydrophobicContact CD1-CG2 4.32Å
723	K	92.1	Very high	90.1	Very high	111 Å²	111	60.3 Å²	60.3	48%	0.483	30%	0.298	S	S	.	.			trans	-77.2	95.7	167.1	-64.2	-179	-175.6	175.8	0	109.6	N745 H748 V749	K723-N745 PolarHBondContact NZ-O 3.02Å; K723-H748 HydrophobicContact CB-CB 4.47Å; K723-H748 PolarHBondContact N-ND1 2.87Å; K723-H748 PolarHBondContact O-N 3.41Å; K723-V749 PolarHBondContact O-N 2.91Å
724	I	93.2	Very high	90.1	Very high	44 Å²	44	57.3 Å²	57.3	23%	0.226	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	141	175.7	-50.6	109.7	0	0	0	110	F715 F722 V749 I751	F715-I724 HydrophobicContact CB-CD1 3.73Å; F715-I724 HydrophobicContact CB-CG1 3.88Å; F715-I724 HydrophobicContact CD1-CG1 4.28Å; F715-I724 HydrophobicContact CG-CD1 4.33Å; F715-I724 HydrophobicContact CG-CG1 4Å; F722-I724 HydrophobicContact CB-CD1 4.41Å; F722-I724 HydrophobicContact CB-CG1 4.38Å; F722-I724 WeakPolarHBondContact O-CD1 3.44Å; F722-I724 PolarHBondContact O-N 3.44Å; F722-I724 VanDerWaalsContact O-N 3.13Å; I724-V749 CarbonylContact C-O 3.2Å; I724-V749 WeakPolarHBondContact CA-O 3.09Å; I724-I751 HydrophobicContact CG2-CD1 3.56Å; I724-I751 HydrophobicContact CG2-CG1 4.13Å
725	L	92.6	Very high	90.1	Very high	42 Å²	42	59.8 Å²	59.8	22%	0.22	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	112.3	170.1	-177.4	135.6	0	0	0	110.8	Y727 W741 F747 V749 C750 I751	L725-Y727 HydrophobicContact CD2-CD2 4.16Å; L725-Y727 PolarHBondContact O-N 3.26Å; L725-W741 HydrophobicContact CD2-CZ3 3.83Å; L725-F747 HydrophobicContact CB-CB 3.84Å; L725-F747 HydrophobicContact CB-CD1 4.23Å; L725-F747 HydrophobicContact CB-CG 4.04Å; L725-F747 HydrophobicContact CD1-CD1 4.07Å; L725-F747 HydrophobicContact CD2-CD1 4.47Å; L725-F747 HydrophobicContact CG-CD1 4.49Å; L725-V749 PolarHBondContact N-O 2.99Å; L725-C750 WeakPolarHBondContact O-CA 3.36Å; L725-C750 PolarHBondContact O-SG 3.14Å; L725-I751 PolarHBondContact O-N 3.21Å; L725-I751 VanDerWaalsContact O-N 3.11Å
726	T	93.2	Very high	90	Very high	28 Å²	28	63 Å²	63	17%	0.172	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	112.2	175.9	39.2	0	0	0	0	111.6	I708 E712 F728 K737 I751	I708-T726 HydrophobicContact CG2-CG2 4.03Å; E712-T726 HydrophobicContact CB-CG2 3.98Å; E712-T726 HydrophobicContact CG-CG2 4.02Å; E712-T726 WeakPolarHBondContact OE2-CG2 3.48Å; E712-T726 PolarHBondContact OE2-OG1 3.03Å; T726-F728 PolarHBondContact O-N 3.16Å; T726-K737 PolarHBondContact O-NZ 3.21Å; T726-I751 HydrophobicContact CG2-CB 4.23Å; T726-I751 HydrophobicContact CG2-CD1 4.16Å
727	Y	92.1	Very high	89.9	Confident	2 Å²	2	60.9 Å²	60.9	1%	0.008	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	75.9	-179.3	-156.2	-98.6	0	0	0	110.9	L725 R734 K737 R738 W741 I751 L756 D760 F764	L725-Y727 HydrophobicContact CD2-CD2 4.16Å; L725-Y727 PolarHBondContact O-N 3.26Å; Y727-R734 HydrophobicContact CE1-CG 4.01Å; Y727-R734 WeakPolarHBondContact OH-CB 3.37Å; Y727-R734 PolarHBondContact OH-O 3.42Å; Y727-K737 HydrophobicContact CD2-CB 4.22Å; Y727-K737 HydrophobicContact CE2-CB 3.93Å; Y727-R738 PolarHBondContact OH-NE 2.87Å; Y727-R738 PolarHBondContact OH-NH2 3.28Å; Y727-W741 HydrophobicContact CD2-CH2 4.21Å; Y727-W741 AromaticContact CD2-CZ3 3.82Å; Y727-W741 HydrophobicContact CD2-CZ3 3.82Å; Y727-W741 HydrophobicContact CE2-CZ3 4.09Å; Y727-I751 WeakPolarHBondContact CB-O 3.4Å; Y727-I751 PolarHBondContact N-O 3.41Å; Y727-L756 WeakPolarHBondContact O-CD1 3.17Å; Y727-D760 HydrophobicContact CE1-CB 4.47Å; Y727-D760 WeakPolarHBondContact CE1-OD2 3.48Å; Y727-F764 HydrophobicContact CD1-CE2 4.18Å; Y727-F764 AromaticContact CD1-CZ 3.69Å; Y727-F764 HydrophobicContact CD1-CZ 3.69Å; Y727-F764 HydrophobicContact CE1-CE2 4.24Å; Y727-F764 HydrophobicContact CE1-CZ 4.12Å; Y727-F764 HydrophobicContact CG-CZ 4.15Å
728	F	88.5	Confident	89.9	Confident	112 Å²	112	57.2 Å²	57.2	49%	0.491	29%	0.286	S	S	.	.			trans	-134	161.1	174.4	-175.6	-102.8	0	0	0	109.7	T705 T726 K737 L756	T705-F728 HydrophobicContact CG2-CD2 4.44Å; T705-F728 HydrophobicContact CG2-CE2 3.85Å; T726-F728 PolarHBondContact O-N 3.16Å; F728-K737 PolarHBondContact O-NZ 2.69Å; F728-L756 HydrophobicContact CD2-CD1 4.05Å
729	G	86.2	Confident	89.7	Confident	16 Å²	16	64.2 Å²	64.2	17%	0.165	32%	0.317	C	S	.	.	S	Bend	trans	118.4	-179.9	173.4	0	0	0	0	0	115.2	E733 R734	G729-E733 WeakPolarHBondContact CA-OE2 3.33Å; G729-R734 PolarHBondContact O-NE 3.5Å; G729-R734 VanDerWaalsContact O-NE 3.1Å
730	N	88	Confident	89.4	Confident	63 Å²	63	65.7 Å²	65.7	34%	0.337	33%	0.332	S	S	.	.			trans	-67.1	158.7	-176.5	-108	-35.1	0	0	0	112.3	E379 K732 E733 R734	E379-N730 PolarHBondContact OE1-ND2 3.16Å; N730-K732 PolarHBondContact O-N 2.67Å; N730-K732 VanDerWaalsContact O-N 3.09Å; N730-E733 HydrophobicContact CB-CG 4.32Å; N730-E733 PolarHBondContact N-OE2 2.96Å; N730-E733 CarbonylContact O-C 2.97Å; N730-E733 WeakPolarHBondContact O-CA 3.5Å; N730-E733 WeakPolarHBondContact O-CB 3.41Å; N730-E733 PolarHBondContact O-N 3.46Å; N730-R734 PolarHBondContact O-N 3.04Å
731	M	88.5	Confident	89.2	Confident	79 Å²	79	62.9 Å²	62.9	39%	0.389	31%	0.312	S	S	.	.	H	α-helix	trans	-57.4	-33.1	-173.7	-173.6	57.1	75.9	0	0	113.3	R734 K735	M731-R734 PolarHBondContact O-N 2.65Å; M731-R734 HydrophobicContact SD-CB 4.48Å; M731-K735 PolarHBondContact O-N 2.83Å
732	K	90.4	Very high	88.9	Confident	125 Å²	125	66.5 Å²	66.5	54%	0.543	33%	0.331	S	S	.	.	H	α-helix	trans	-62.8	-46.3	172	-69.4	175.6	176.2	169.8	0	112.1	L377 N730 R734 K735 C736 Q2208	L377-K732 HydrophobicContact CD1-CD 4.41Å; N730-K732 PolarHBondContact O-N 2.67Å; N730-K732 VanDerWaalsContact O-N 3.09Å; K732-R734 VanDerWaalsContact C-N 3.34Å; K732-K735 PolarHBondContact O-N 3.48Å; K732-C736 PolarHBondContact O-N 3.27Å; K732-Q2208 VanDerWaalsContact NZ-OE1 3.12Å
733	E	90.3	Very high	88.6	Confident	102 Å²	102	73.3 Å²	73.3	48%	0.477	36%	0.361	S	S	.	.	H	α-helix	trans	-66.9	-37.9	177.9	-54.3	179.6	123.3	0	0	110.9	G729 N730 C736 K737	G729-E733 WeakPolarHBondContact CA-OE2 3.33Å; N730-E733 HydrophobicContact CB-CG 4.32Å; N730-E733 PolarHBondContact N-OE2 2.96Å; N730-E733 CarbonylContact O-C 2.97Å; N730-E733 WeakPolarHBondContact O-CA 3.5Å; N730-E733 WeakPolarHBondContact O-CB 3.41Å; N730-E733 PolarHBondContact O-N 3.46Å; E733-C736 CarbonylContact O-C 3.51Å; E733-C736 WeakPolarHBondContact O-CA 3.36Å; E733-C736 WeakPolarHBondContact O-CB 3.38Å; E733-C736 PolarHBondContact O-N 2.87Å; E733-C736 VanDerWaalsContact O-N 3.16Å; E733-K737 WeakPolarHBondContact O-CG 3.29Å; E733-K737 PolarHBondContact O-N 2.81Å
734	R	90.4	Very high	88	Confident	22 Å²	22	74.3 Å²	74.3	8%	0.083	38%	0.377	C	S	.	.	H	α-helix	trans	-63.9	-42.1	172.2	-77	-164.6	-87.1	158.3	-13.9	112.7	Y727 G729 N730 M731 K732 C736 K737 R738 D760	Y727-R734 HydrophobicContact CE1-CG 4.01Å; Y727-R734 WeakPolarHBondContact OH-CB 3.37Å; Y727-R734 PolarHBondContact OH-O 3.42Å; G729-R734 PolarHBondContact O-NE 3.5Å; G729-R734 VanDerWaalsContact O-NE 3.1Å; N730-R734 PolarHBondContact O-N 3.04Å; M731-R734 PolarHBondContact O-N 2.65Å; M731-R734 HydrophobicContact SD-CB 4.48Å; K732-R734 VanDerWaalsContact C-N 3.34Å; R734-C736 VanDerWaalsContact C-N 3.32Å; R734-K737 PolarHBondContact O-N 3.17Å; R734-R738 VanDerWaalsContact O-CG 3.32Å; R734-R738 WeakPolarHBondContact O-CG 3.37Å; R734-R738 PolarHBondContact O-N 2.77Å; R734-R738 VanDerWaalsContact O-N 3.14Å; R734-D760 VanDerWaalsContact CD-OD2 3.27Å; R734-D760 WeakPolarHBondContact CD-OD2 3.27Å; R734-D760 IonicContact CZ-OD2 2.64Å; R734-D760 IonicContact NE-OD2 2.68Å; R734-D760 IonicContact NH1-OD1 3.01Å; R734-D760 PolarHBondContact NH1-OD1 3.38Å; R734-D760 IonicContact NH1-OD2 3.14Å; R734-D760 PolarHBondContact NH1-OD2 2.77Å
735	K	89.3	Confident	87.3	Confident	76 Å²	76	77.8 Å²	77.8	33%	0.33	40%	0.396	S	S	.	.	H	α-helix	trans	-60.3	-39.7	168.5	-80.1	-166.3	174.7	-168	0	111	D373 E374 M731 K732 R738	D373-K735 IonicContact OD1-NZ 2.62Å; D373-K735 PolarHBondContact OD1-NZ 3.26Å; E374-K735 IonicContact OE1-NZ 2.76Å; E374-K735 PolarHBondContact OE1-NZ 3.28Å; M731-K735 PolarHBondContact O-N 2.83Å; K732-K735 PolarHBondContact O-N 3.48Å; K735-R738 PolarHBondContact O-N 2.91Å
736	C	90.1	Very high	87	Confident	68 Å²	68	78.1 Å²	78.1	46%	0.459	40%	0.404	S	S	.	.	H	α-helix	trans	-67.9	-44.7	175.4	-78.5	0	0	0	0	113.7	K732 E733 R734 R738 K739	K732-C736 PolarHBondContact O-N 3.27Å; E733-C736 CarbonylContact O-C 3.51Å; E733-C736 WeakPolarHBondContact O-CA 3.36Å; E733-C736 WeakPolarHBondContact O-CB 3.38Å; E733-C736 PolarHBondContact O-N 2.87Å; E733-C736 VanDerWaalsContact O-N 3.16Å; R734-C736 VanDerWaalsContact C-N 3.32Å; C736-R738 PolarHBondContact O-N 3.1Å; C736-K739 VanDerWaalsContact O-CB 3.25Å; C736-K739 WeakPolarHBondContact O-CB 3.23Å; C736-K739 WeakPolarHBondContact O-CG 3.42Å; C736-K739 PolarHBondContact O-N 3.32Å
737	K	89.4	Confident	86.9	Confident	72 Å²	72	77.2 Å²	77.2	31%	0.313	40%	0.398	S	S	.	.	H	α-helix	trans	-64.5	-18.5	175.5	-71.5	177.6	-179.7	-178.1	0	112.9	T726 Y727 F728 E733 R734	T726-K737 PolarHBondContact O-NZ 3.21Å; Y727-K737 HydrophobicContact CD2-CB 4.22Å; Y727-K737 HydrophobicContact CE2-CB 3.93Å; F728-K737 PolarHBondContact O-NZ 2.69Å; E733-K737 WeakPolarHBondContact O-CG 3.29Å; E733-K737 PolarHBondContact O-N 2.81Å; R734-K737 PolarHBondContact O-N 3.17Å
738	R	88.7	Confident	86.9	Confident	73 Å²	73	78.1 Å²	78.1	28%	0.275	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-16.2	169.6	-71.3	172.7	-156	160.1	21.1	113.9	Y727 R734 K735 C736 G740 W741 D760	Y727-R738 PolarHBondContact OH-NE 2.87Å; Y727-R738 PolarHBondContact OH-NH2 3.28Å; R734-R738 VanDerWaalsContact O-CG 3.32Å; R734-R738 WeakPolarHBondContact O-CG 3.37Å; R734-R738 PolarHBondContact O-N 2.77Å; R734-R738 VanDerWaalsContact O-N 3.14Å; K735-R738 PolarHBondContact O-N 2.91Å; C736-R738 PolarHBondContact O-N 3.1Å; R738-G740 PolarHBondContact O-N 2.98Å; R738-W741 VanDerWaalsContact O-CB 3.27Å; R738-W741 WeakPolarHBondContact O-CB 3.21Å; R738-W741 PolarHBondContact O-N 3.1Å; R738-D760 IonicContact CZ-OD1 2.82Å; R738-D760 IonicContact NH1-OD1 2.67Å; R738-D760 IonicContact NH2-OD1 2.62Å; R738-D760 PolarHBondContact NH2-OD1 3.48Å; R738-D760 IonicContact NH2-OD2 3.34Å; R738-D760 PolarHBondContact NH2-OD2 2.8Å
739	K	86.2	Confident	87.2	Confident	167 Å²	167	72.8 Å²	72.8	73%	0.726	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	103.6	180	-66.5	177.3	177.9	175.5	0	110.2	C736	C736-K739 VanDerWaalsContact O-CB 3.25Å; C736-K739 WeakPolarHBondContact O-CB 3.23Å; C736-K739 WeakPolarHBondContact O-CG 3.42Å; C736-K739 PolarHBondContact O-N 3.32Å
740	G	81.6	Confident	87.6	Confident	31 Å²	31	72 Å²	72	32%	0.32	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.8	8.5	-175.8	0	0	0	0	0	115.5	R738 T742 K743	R738-G740 PolarHBondContact O-N 2.98Å; G740-T742 PolarHBondContact O-N 3.23Å; G740-T742 VanDerWaalsContact O-N 3.1Å; G740-K743 VanDerWaalsContact O-CB 3.32Å; G740-K743 WeakPolarHBondContact O-CB 3.46Å; G740-K743 PolarHBondContact O-N 3.43Å
741	W	84	Confident	87.9	Confident	19 Å²	19	69 Å²	69	7%	0.072	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-35	179.5	-176.4	-100.2	0	0	0	114.8	L725 Y727 R738 F747 A763 F764 K767 W769	L725-W741 HydrophobicContact CD2-CZ3 3.83Å; Y727-W741 HydrophobicContact CD2-CH2 4.21Å; Y727-W741 AromaticContact CD2-CZ3 3.82Å; Y727-W741 HydrophobicContact CD2-CZ3 3.82Å; Y727-W741 HydrophobicContact CE2-CZ3 4.09Å; R738-W741 VanDerWaalsContact O-CB 3.27Å; R738-W741 WeakPolarHBondContact O-CB 3.21Å; R738-W741 PolarHBondContact O-N 3.1Å; W741-F747 AromaticContact CD2-CE1 3.89Å; W741-F747 HydrophobicContact CD2-CE1 3.89Å; W741-F747 AromaticContact CD2-CZ 3.9Å; W741-F747 HydrophobicContact CD2-CZ 3.9Å; W741-F747 AromaticContact CE3-CE1 3.44Å; W741-F747 HydrophobicContact CE3-CE1 3.44Å; W741-F747 VanDerWaalsContact CE3-CE1 3.44Å; W741-F747 AromaticContact CE3-CZ 3.67Å; W741-F747 HydrophobicContact CE3-CZ 3.67Å; W741-F747 HydrophobicContact CH2-CE1 4.33Å; W741-F747 AromaticContact CH2-CZ 3.77Å; W741-F747 HydrophobicContact CH2-CZ 3.77Å; W741-F747 AromaticContact CZ2-CZ 4Å; W741-F747 HydrophobicContact CZ2-CZ 4Å; W741-F747 AromaticContact CZ3-CE1 3.68Å; W741-F747 HydrophobicContact CZ3-CE1 3.68Å; W741-F747 AromaticContact CZ3-CZ 3.6Å; W741-F747 HydrophobicContact CZ3-CZ 3.6Å; W741-A763 PolarHBondContact NE1-O 3.07Å; W741-F764 HydrophobicContact CH2-CD1 4.4Å; W741-F764 AromaticContact CH2-CE1 3.79Å; W741-F764 HydrophobicContact CH2-CE1 3.79Å; W741-F764 HydrophobicContact CH2-CZ 4.36Å; W741-F764 HydrophobicContact CZ2-CD1 4.01Å; W741-F764 AromaticContact CZ2-CE1 3.87Å; W741-F764 HydrophobicContact CZ2-CE1 3.87Å; W741-K767 PolarHBondContact O-NZ 2.8Å; W741-W769 HydrophobicContact CH2-CH2 4.39Å; W741-W769 AromaticContact CZ2-CH2 3.95Å; W741-W769 HydrophobicContact CZ2-CH2 3.95Å; W741-W769 AromaticContact CZ2-CZ2 3.97Å; W741-W769 HydrophobicContact CZ2-CZ2 3.97Å
742	T	82	Confident	88.2	Confident	136 Å²	136	65.2 Å²	65.2	83%	0.834	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-10.5	-179.2	-34.5	0	0	0	0	113.5	G740	G740-T742 PolarHBondContact O-N 3.23Å; G740-T742 VanDerWaalsContact O-N 3.1Å
743	K	83	Confident	88.3	Confident	152 Å²	152	59.4 Å²	59.4	66%	0.661	31%	0.311	S	S	*	.	S	Bend	trans	-66.1	139.2	177.5	-66.8	-177	176.7	-174.8	0	110.2	G740 A746	G740-K743 VanDerWaalsContact O-CB 3.32Å; G740-K743 WeakPolarHBondContact O-CB 3.46Å; G740-K743 PolarHBondContact O-N 3.43Å; K743-A746 HydrophobicContact CB-CB 4.27Å
744	T	80.4	Confident	88.4	Confident	132 Å²	132	55.3 Å²	55.3	81%	0.81	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	139.6	170.4	44.2	0	0	0	0	110.1	A746	T744-A746 PolarHBondContact O-N 2.85Å
745	N	79.2	Confident	88.5	Confident	117 Å²	117	57.7 Å²	57.7	63%	0.626	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	22.8	175.9	-53.3	-9.1	0	0	0	116	K723	K723-N745 PolarHBondContact NZ-O 3.02Å
746	A	85.2	Confident	88.6	Confident	48 Å²	48	54.7 Å²	54.7	40%	0.397	29%	0.288	S	S	.	.	S	Bend	trans	-62.3	-42.3	172.7	0	0	0	0	0	112	K743 T744	K743-A746 HydrophobicContact CB-CB 4.27Å; T744-A746 PolarHBondContact O-N 2.85Å
747	F	90.7	Very high	88.7	Confident	10 Å²	10	51.6 Å²	51.6	4%	0.044	27%	0.267	C	S	.	.			trans	-146.5	152.5	169.3	55.4	-97.3	0	0	0	109	L725 W741 C750 K767 W769	L725-F747 HydrophobicContact CB-CB 3.84Å; L725-F747 HydrophobicContact CB-CD1 4.23Å; L725-F747 HydrophobicContact CB-CG 4.04Å; L725-F747 HydrophobicContact CD1-CD1 4.07Å; L725-F747 HydrophobicContact CD2-CD1 4.47Å; L725-F747 HydrophobicContact CG-CD1 4.49Å; W741-F747 AromaticContact CD2-CE1 3.89Å; W741-F747 HydrophobicContact CD2-CE1 3.89Å; W741-F747 AromaticContact CD2-CZ 3.9Å; W741-F747 HydrophobicContact CD2-CZ 3.9Å; W741-F747 AromaticContact CE3-CE1 3.44Å; W741-F747 HydrophobicContact CE3-CE1 3.44Å; W741-F747 VanDerWaalsContact CE3-CE1 3.44Å; W741-F747 AromaticContact CE3-CZ 3.67Å; W741-F747 HydrophobicContact CE3-CZ 3.67Å; W741-F747 HydrophobicContact CH2-CE1 4.33Å; W741-F747 AromaticContact CH2-CZ 3.77Å; W741-F747 HydrophobicContact CH2-CZ 3.77Å; W741-F747 AromaticContact CZ2-CZ 4Å; W741-F747 HydrophobicContact CZ2-CZ 4Å; W741-F747 AromaticContact CZ3-CE1 3.68Å; W741-F747 HydrophobicContact CZ3-CE1 3.68Å; W741-F747 AromaticContact CZ3-CZ 3.6Å; W741-F747 HydrophobicContact CZ3-CZ 3.6Å; F747-C750 HydrophobicContact CD2-CB 3.92Å; F747-C750 HydrophobicContact CE2-CB 3.57Å; F747-C750 HydrophobicContact CZ-CB 4.22Å; F747-K767 HydrophobicContact CZ-CD 4.21Å; F747-W769 AromaticContact CE2-CH2 3.89Å; F747-W769 HydrophobicContact CE2-CH2 3.89Å; F747-W769 AromaticContact CE2-CZ3 3.91Å; F747-W769 HydrophobicContact CE2-CZ3 3.91Å; F747-W769 HydrophobicContact CZ-CH2 4.15Å
748	H	92.9	Very high	88.8	Confident	20 Å²	20	49.8 Å²	49.8	9%	0.093	26%	0.261	C	S	.	.	S	Bend	trans	-94.9	-44.1	178.1	-60.9	171.3	0	0	0	110	W696 P698 H699 F722 K723	W696-H748 AromaticContact CE3-CE1 3.7Å; W696-H748 AromaticContact CE3-ND1 3.54Å; W696-H748 WeakPolarHBondContact O-CB 3.35Å; P698-H748 WeakPolarHBondContact CA-O 3.23Å; H699-H748 PolarHBondContact N-O 2.99Å; F722-H748 HydrophobicContact CD1-CB 3.78Å; F722-H748 AromaticContact CD1-ND1 3.88Å; K723-H748 HydrophobicContact CB-CB 4.47Å; K723-H748 PolarHBondContact N-ND1 2.87Å; K723-H748 PolarHBondContact O-N 3.41Å
749	V	94.2	Very high	88.9	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	133.7	178.5	-176.9	0	0	0	0	109.3	L686 H699 I701 F715 F722 K723 I724 L725 I751	L686-V749 HydrophobicContact CD1-CG2 4.39Å; H699-V749 HydrophobicContact CB-CG2 4.48Å; I701-V749 HydrophobicContact CD1-CG1 3.53Å; I701-V749 HydrophobicContact CG1-CG1 3.97Å; F715-V749 HydrophobicContact CE1-CG2 4.23Å; F715-V749 HydrophobicContact CE2-CG1 4.04Å; F715-V749 HydrophobicContact CZ-CG1 3.9Å; F715-V749 HydrophobicContact CZ-CG2 4.22Å; F722-V749 HydrophobicContact CD1-CG2 4.32Å; K723-V749 PolarHBondContact O-N 2.91Å; I724-V749 CarbonylContact C-O 3.2Å; I724-V749 WeakPolarHBondContact CA-O 3.09Å; L725-V749 PolarHBondContact N-O 2.99Å; V749-I751 HydrophobicContact CG1-CG1 4.32Å
750	C	94.4	Very high	89.2	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	132.9	167.3	-175.5	0	0	0	0	110	H699 L700 I701 L725 F747 W769	H699-C750 PolarHBondContact O-N 3.19Å; L700-C750 HydrophobicContact CD1-CB 4.2Å; I701-C750 PolarHBondContact N-O 3.31Å; L725-C750 WeakPolarHBondContact O-CA 3.36Å; L725-C750 PolarHBondContact O-SG 3.14Å; F747-C750 HydrophobicContact CD2-CB 3.92Å; F747-C750 HydrophobicContact CE2-CB 3.57Å; F747-C750 HydrophobicContact CZ-CB 4.22Å; C750-W769 HydrophobicContact CB-CH2 4.19Å; C750-W769 HydrophobicContact CB-CZ3 4.26Å
751	I	95.6	Very high	89.6	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	127.8	177.4	-53.4	167.7	0	0	0	107.4	I701 V703 I708 W711 F715 I724 L725 T726 Y727 V749	I701-I751 WeakPolarHBondContact O-CA 2.96Å; V703-I751 HydrophobicContact CG2-CG2 3.95Å; I708-I751 HydrophobicContact CG1-CG2 4.37Å; I708-I751 HydrophobicContact CG2-CG2 4.05Å; W711-I751 HydrophobicContact CB-CD1 4.05Å; F715-I751 HydrophobicContact CD2-CD1 3.99Å; F715-I751 HydrophobicContact CE2-CD1 4.27Å; I724-I751 HydrophobicContact CG2-CD1 3.56Å; I724-I751 HydrophobicContact CG2-CG1 4.13Å; L725-I751 PolarHBondContact O-N 3.21Å; L725-I751 VanDerWaalsContact O-N 3.11Å; T726-I751 HydrophobicContact CG2-CB 4.23Å; T726-I751 HydrophobicContact CG2-CD1 4.16Å; Y727-I751 WeakPolarHBondContact CB-O 3.4Å; Y727-I751 PolarHBondContact N-O 3.41Å; V749-I751 HydrophobicContact CG1-CG1 4.32Å
752	T	94.7	Very high	89.9	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	160	-178.9	-171	0	0	0	0	111.5	L700 I701 V702 V703 A757 F764	L700-T752 HydrophobicContact CD1-CG2 3.85Å; I701-T752 PolarHBondContact O-N 2.71Å; V702-T752 WeakPolarHBondContact CA-O 3.46Å; V702-T752 HydrophobicContact CB-CG2 4.49Å; V702-T752 HydrophobicContact CG1-CG2 4.43Å; V702-T752 HydrophobicContact CG2-CG2 4.02Å; V703-T752 PolarHBondContact N-O 3.47Å; T752-A757 HydrophobicContact CG2-CB 4.25Å; T752-F764 HydrophobicContact CG2-CE1 4.23Å; T752-F764 HydrophobicContact CG2-CZ 4.02Å
753	S	93	Very high	90.2	Very high	3 Å²	3	42 Å²	42	2%	0.021	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	157.7	169.9	87	0	0	0	0	112.4	V703 R755 L756 A757	V703-S753 WeakPolarHBondContact O-CA 3.49Å; S753-R755 PolarHBondContact OG-N 2.92Å; S753-L756 PolarHBondContact O-N 2.76Å; S753-L756 WeakPolarHBondContact OG-CB 3.5Å; S753-L756 WeakPolarHBondContact OG-CG 3.41Å; S753-L756 PolarHBondContact OG-N 3.45Å; S753-L756 VanDerWaalsContact OG-N 3.09Å; S753-A757 WeakPolarHBondContact O-CB 3.43Å; S753-A757 PolarHBondContact O-N 3.16Å
754	Y	92.2	Very high	90.7	Very high	15 Å²	15	34.7 Å²	34.7	6%	0.059	19%	0.19	C	C	.	.	H	α-helix	trans	-54.9	-50	170.2	-75.1	-83.8	0	0	0	112.2	V702 P704 L756 A757 I758 D775 N779 I780 L791	V702-Y754 HydrophobicContact CB-CE1 4.49Å; V702-Y754 HydrophobicContact CG1-CD1 3.59Å; V702-Y754 HydrophobicContact CG1-CD2 4.04Å; V702-Y754 HydrophobicContact CG1-CE1 3.83Å; V702-Y754 HydrophobicContact CG1-CE2 4.26Å; V702-Y754 HydrophobicContact CG1-CG 3.71Å; P704-Y754 HydrophobicContact CG-CE2 4.37Å; Y754-L756 VanDerWaalsContact C-N 3.3Å; Y754-L756 PolarHBondContact O-N 2.85Å; Y754-A757 PolarHBondContact O-N 2.95Å; Y754-I758 WeakPolarHBondContact O-CG1 3.47Å; Y754-I758 PolarHBondContact O-N 3.4Å; Y754-D775 WeakPolarHBondContact CE2-O 3.45Å; Y754-D775 PolarHBondContact OH-O 3.04Å; Y754-N779 HydrophobicContact CE1-CB 4.34Å; Y754-N779 HydrophobicContact CE2-CB 4.17Å; Y754-I780 HydrophobicContact CE1-CG2 3.95Å; Y754-L791 HydrophobicContact CD1-CD1 4.12Å; Y754-L791 HydrophobicContact CE1-CD1 4.08Å
755	R	90.9	Very high	91.2	Very high	73 Å²	73	32.7 Å²	32.7	28%	0.275	17%	0.169	S	C	.	.	H	α-helix	trans	-59.3	-38.5	178.9	-167.8	174.4	-178.1	-154.2	2.8	112.1	D381 D382 T385 S753 Q759	D381-R755 PolarHBondContact O-NH1 3Å; D381-R755 PolarHBondContact O-NH2 2.62Å; D381-R755 VanDerWaalsContact O-NH2 3.11Å; D382-R755 WeakPolarHBondContact OD1-CD 3.45Å; D382-R755 IonicContact OD1-CZ 3.27Å; D382-R755 VanDerWaalsContact OD1-CZ 3.32Å; D382-R755 IonicContact OD1-NE 2.72Å; D382-R755 PolarHBondContact OD1-NE 3.2Å; D382-R755 IonicContact OD1-NH1 3.03Å; D382-R755 PolarHBondContact OD1-NH1 3.35Å; T385-R755 PolarHBondContact OG1-NH2 3.25Å; S753-R755 PolarHBondContact OG-N 2.92Å; R755-Q759 WeakPolarHBondContact O-CG 3.42Å; R755-Q759 PolarHBondContact O-N 3.43Å; R755-Q759 VanDerWaalsContact O-N 3.16Å
756	L	92.6	Very high	91.7	Very high	13 Å²	13	37.2 Å²	37.2	7%	0.068	18%	0.178	C	C	.	.	H	α-helix	trans	-74.5	-32.4	177.9	-67.9	176.7	0	0	0	113.3	Y727 F728 S753 Y754 I758 D760	Y727-L756 WeakPolarHBondContact O-CD1 3.17Å; F728-L756 HydrophobicContact CD2-CD1 4.05Å; S753-L756 PolarHBondContact O-N 2.76Å; S753-L756 WeakPolarHBondContact OG-CB 3.5Å; S753-L756 WeakPolarHBondContact OG-CG 3.41Å; S753-L756 PolarHBondContact OG-N 3.45Å; S753-L756 VanDerWaalsContact OG-N 3.09Å; Y754-L756 VanDerWaalsContact C-N 3.3Å; Y754-L756 PolarHBondContact O-N 2.85Å; L756-I758 VanDerWaalsContact C-N 3.28Å; L756-I758 PolarHBondContact O-N 3.22Å; L756-D760 PolarHBondContact O-N 2.71Å
757	A	92.3	Very high	91.8	Very high	2 Å²	2	36.2 Å²	36.2	2%	0.017	17%	0.165	C	C	.	.	H	α-helix	trans	-64.3	-32.7	174.5	0	0	0	0	0	112.3	V702 T752 S753 Y754 A761 L791 F794	V702-A757 HydrophobicContact CG1-CB 4.38Å; T752-A757 HydrophobicContact CG2-CB 4.25Å; S753-A757 WeakPolarHBondContact O-CB 3.43Å; S753-A757 PolarHBondContact O-N 3.16Å; Y754-A757 PolarHBondContact O-N 2.95Å; A757-A761 VanDerWaalsContact O-CA 3.31Å; A757-A761 WeakPolarHBondContact O-CA 3.41Å; A757-A761 WeakPolarHBondContact O-CB 3.34Å; A757-A761 PolarHBondContact O-N 2.81Å; A757-L791 HydrophobicContact CB-CD2 4.38Å; A757-F794 HydrophobicContact CB-CE2 4.36Å; A757-F794 HydrophobicContact CB-CZ 4.43Å
758	I	91.8	Very high	91.9	Very high	35 Å²	35	43.4 Å²	43.4	18%	0.179	20%	0.196	C	C	.	.	H	α-helix	trans	-70.9	-59.6	172.1	-52.7	159.1	0	0	0	110.1	Y754 L756 D760 A761 R787	Y754-I758 WeakPolarHBondContact O-CG1 3.47Å; Y754-I758 PolarHBondContact O-N 3.4Å; L756-I758 VanDerWaalsContact C-N 3.28Å; L756-I758 PolarHBondContact O-N 3.22Å; I758-D760 PolarHBondContact O-N 2.78Å; I758-D760 VanDerWaalsContact O-N 3.13Å; I758-A761 WeakPolarHBondContact O-CB 3.44Å; I758-A761 PolarHBondContact O-N 2.71Å; I758-R787 HydrophobicContact CD1-CG 3.78Å
759	Q	90.8	Very high	91.9	Very high	99 Å²	99	42.6 Å²	42.6	46%	0.463	19%	0.192	S	C	.	.	H	α-helix	trans	-53.8	-39.5	-174.9	-74.1	-178.6	6.6	0	0	112.9	R755	R755-Q759 WeakPolarHBondContact O-CG 3.42Å; R755-Q759 PolarHBondContact O-N 3.43Å; R755-Q759 VanDerWaalsContact O-N 3.16Å
760	D	91.7	Very high	91.8	Very high	11 Å²	11	45.5 Å²	45.5	6%	0.059	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.5	23.2	-177.2	-64.1	-42.6	0	0	0	113	Y727 R734 R738 L756 I758 I762 A763 F764	Y727-D760 HydrophobicContact CE1-CB 4.47Å; Y727-D760 WeakPolarHBondContact CE1-OD2 3.48Å; R734-D760 VanDerWaalsContact CD-OD2 3.27Å; R734-D760 WeakPolarHBondContact CD-OD2 3.27Å; R734-D760 IonicContact CZ-OD2 2.64Å; R734-D760 IonicContact NE-OD2 2.68Å; R734-D760 IonicContact NH1-OD1 3.01Å; R734-D760 PolarHBondContact NH1-OD1 3.38Å; R734-D760 IonicContact NH1-OD2 3.14Å; R734-D760 PolarHBondContact NH1-OD2 2.77Å; R738-D760 IonicContact CZ-OD1 2.82Å; R738-D760 IonicContact NH1-OD1 2.67Å; R738-D760 IonicContact NH2-OD1 2.62Å; R738-D760 PolarHBondContact NH2-OD1 3.48Å; R738-D760 IonicContact NH2-OD2 3.34Å; R738-D760 PolarHBondContact NH2-OD2 2.8Å; L756-D760 PolarHBondContact O-N 2.71Å; I758-D760 PolarHBondContact O-N 2.78Å; I758-D760 VanDerWaalsContact O-N 3.13Å; D760-I762 PolarHBondContact O-N 3.28Å; D760-A763 WeakPolarHBondContact O-CA 3.37Å; D760-A763 WeakPolarHBondContact O-CB 3.41Å; D760-A763 PolarHBondContact O-N 3.43Å; D760-F764 HydrophobicContact CB-CD2 4.17Å; D760-F764 HydrophobicContact CB-CE2 3.98Å; D760-F764 WeakPolarHBondContact O-CD2 3.34Å; D760-F764 PolarHBondContact O-N 3.32Å
761	A	91.3	Very high	91.8	Very high	11 Å²	11	46 Å²	46	9%	0.091	21%	0.206	C	C	.	.	H	α-helix	trans	-50.5	-35.3	-177.2	0	0	0	0	0	113.3	A757 I758 A763 F764 K765 T790 F794	A757-A761 VanDerWaalsContact O-CA 3.31Å; A757-A761 WeakPolarHBondContact O-CA 3.41Å; A757-A761 WeakPolarHBondContact O-CB 3.34Å; A757-A761 PolarHBondContact O-N 2.81Å; I758-A761 WeakPolarHBondContact O-CB 3.44Å; I758-A761 PolarHBondContact O-N 2.71Å; A761-A763 VanDerWaalsContact C-N 3.31Å; A761-A763 PolarHBondContact O-N 2.64Å; A761-F764 PolarHBondContact O-N 3.24Å; A761-K765 VanDerWaalsContact O-CB 3.26Å; A761-K765 WeakPolarHBondContact O-CB 3.11Å; A761-K765 WeakPolarHBondContact O-CG 3.07Å; A761-K765 PolarHBondContact O-N 2.87Å; A761-T790 HydrophobicContact CB-CG2 3.54Å; A761-F794 HydrophobicContact CB-CE1 4.21Å
762	I	90.1	Very high	91.8	Very high	120 Å²	120	46.1 Å²	46.1	62%	0.615	21%	0.207	S	C	*	.	H	α-helix	trans	-61.1	-37.8	176.4	-57.5	174.3	0	0	0	111.6	D760 R766	D760-I762 PolarHBondContact O-N 3.28Å; I762-R766 WeakPolarHBondContact O-CD 3.39Å; I762-R766 VanDerWaalsContact O-CG 3.25Å; I762-R766 WeakPolarHBondContact O-CG 3.46Å; I762-R766 PolarHBondContact O-N 3.44Å
763	A	88.3	Confident	91.9	Very high	20 Å²	20	46.1 Å²	46.1	17%	0.165	21%	0.207	C	C	.	.	H	α-helix	trans	-76	-33.6	177.8	0	0	0	0	0	112.6	W741 D760 A761	W741-A763 PolarHBondContact NE1-O 3.07Å; D760-A763 WeakPolarHBondContact O-CA 3.37Å; D760-A763 WeakPolarHBondContact O-CB 3.41Å; D760-A763 PolarHBondContact O-N 3.43Å; A761-A763 VanDerWaalsContact C-N 3.31Å; A761-A763 PolarHBondContact O-N 2.64Å
764	F	92	Very high	91.9	Very high	0 Å²	0	46 Å²	46	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-75.3	-42	176	-71.7	-73.8	0	0	0	112.7	L700 Y727 W741 T752 D760 A761 R766 K767 W769 F794	L700-F764 HydrophobicContact CD1-CD1 4.08Å; L700-F764 HydrophobicContact CD1-CE1 3.78Å; L700-F764 HydrophobicContact CD2-CD1 3.88Å; L700-F764 HydrophobicContact CD2-CE1 4.38Å; Y727-F764 HydrophobicContact CD1-CE2 4.18Å; Y727-F764 AromaticContact CD1-CZ 3.69Å; Y727-F764 HydrophobicContact CD1-CZ 3.69Å; Y727-F764 HydrophobicContact CE1-CE2 4.24Å; Y727-F764 HydrophobicContact CE1-CZ 4.12Å; Y727-F764 HydrophobicContact CG-CZ 4.15Å; W741-F764 HydrophobicContact CH2-CD1 4.4Å; W741-F764 AromaticContact CH2-CE1 3.79Å; W741-F764 HydrophobicContact CH2-CE1 3.79Å; W741-F764 HydrophobicContact CH2-CZ 4.36Å; W741-F764 HydrophobicContact CZ2-CD1 4.01Å; W741-F764 AromaticContact CZ2-CE1 3.87Å; W741-F764 HydrophobicContact CZ2-CE1 3.87Å; T752-F764 HydrophobicContact CG2-CE1 4.23Å; T752-F764 HydrophobicContact CG2-CZ 4.02Å; D760-F764 HydrophobicContact CB-CD2 4.17Å; D760-F764 HydrophobicContact CB-CE2 3.98Å; D760-F764 WeakPolarHBondContact O-CD2 3.34Å; D760-F764 PolarHBondContact O-N 3.32Å; A761-F764 PolarHBondContact O-N 3.24Å; F764-R766 VanDerWaalsContact C-N 3.29Å; F764-R766 PolarHBondContact O-N 2.94Å; F764-K767 PolarHBondContact O-N 3.48Å; F764-W769 AromaticContact CD1-CZ2 3.88Å; F764-W769 HydrophobicContact CD1-CZ2 3.88Å; F764-W769 PolarHBondContact O-NE1 3.49Å; F764-W769 VanDerWaalsContact O-NE1 3.08Å; F764-F794 HydrophobicContact CB-CD2 4.49Å; F764-F794 HydrophobicContact CB-CE1 4.01Å; F764-F794 HydrophobicContact CB-CE2 3.83Å; F764-F794 HydrophobicContact CB-CZ 3.55Å; F764-F794 HydrophobicContact CG-CE2 4.32Å; F764-F794 HydrophobicContact CG-CZ 4.23Å
765	K	91.4	Very high	91.9	Very high	89 Å²	89	45.6 Å²	45.6	39%	0.387	21%	0.205	S	C	.	.	H	α-helix	trans	-59.5	-34.1	176.3	-75	175.4	-175	-169.8	0	112.8	A761 K767 T793 F794	A761-K765 VanDerWaalsContact O-CB 3.26Å; A761-K765 WeakPolarHBondContact O-CB 3.11Å; A761-K765 WeakPolarHBondContact O-CG 3.07Å; A761-K765 PolarHBondContact O-N 2.87Å; K765-K767 VanDerWaalsContact C-N 3.25Å; K765-K767 PolarHBondContact O-N 3.27Å; K765-T793 HydrophobicContact CD-CG2 3.98Å; K765-T793 VanDerWaalsContact CE-CG2 3.47Å; K765-T793 HydrophobicContact CG-CG2 4.47Å; K765-F794 HydrophobicContact CG-CD1 3.78Å; K765-F794 HydrophobicContact CG-CE1 3.92Å
766	R	89.1	Confident	91.8	Very high	212 Å²	212	43.3 Å²	43.3	80%	0.8	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-16.4	178.1	-76	173	-174.6	-164.2	2.1	114.4	I762 F764	I762-R766 WeakPolarHBondContact O-CD 3.39Å; I762-R766 VanDerWaalsContact O-CG 3.25Å; I762-R766 WeakPolarHBondContact O-CG 3.46Å; I762-R766 PolarHBondContact O-N 3.44Å; F764-R766 VanDerWaalsContact C-N 3.29Å; F764-R766 PolarHBondContact O-N 2.94Å
767	K	88.9	Confident	91.5	Very high	28 Å²	28	42.8 Å²	42.8	12%	0.122	20%	0.195	C	C	.	.	S	Bend	trans	-105.6	133.8	179.4	-166.3	158.2	-174.8	166.5	0	109.6	P698 W741 F747 F764 K765 W769	P698-K767 HydrophobicContact CG-CG 4.43Å; W741-K767 PolarHBondContact O-NZ 2.8Å; F747-K767 HydrophobicContact CZ-CD 4.21Å; F764-K767 PolarHBondContact O-N 3.48Å; K765-K767 VanDerWaalsContact C-N 3.25Å; K765-K767 PolarHBondContact O-N 3.27Å; K767-W769 HydrophobicContact CB-CZ2 3.84Å; K767-W769 HydrophobicContact CD-CH2 3.91Å; K767-W769 HydrophobicContact CD-CZ2 3.92Å; K767-W769 HydrophobicContact CD-CZ3 4.42Å; K767-W769 HydrophobicContact CG-CH2 4.36Å; K767-W769 HydrophobicContact CG-CZ2 3.98Å; K767-W769 PolarHBondContact O-NE1 3.5Å
768	K	91.3	Very high	91	Very high	160 Å²	160	43.9 Å²	43.9	70%	0.696	20%	0.2	S	C	*	.			trans	-86.4	127.2	175.1	-61	-175.8	-179.4	180	0	109	P698	P698-K768 WeakPolarHBondContact CG-O 3.16Å
769	W	93.3	Very high	90.7	Very high	4 Å²	4	45.2 Å²	45.2	2%	0.015	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	137.6	-171.8	-58.9	97.2	0	0	0	112.2	P698 L700 W741 F747 C750 F764 K767 N795 S796 Q797	P698-W769 HydrophobicContact CB-CE3 3.88Å; P698-W769 HydrophobicContact CB-CZ3 3.9Å; P698-W769 HydrophobicContact CG-CE3 4.18Å; L700-W769 HydrophobicContact CB-CD2 3.71Å; L700-W769 HydrophobicContact CB-CE3 3.56Å; L700-W769 HydrophobicContact CB-CG 4.22Å; L700-W769 HydrophobicContact CB-CH2 4.29Å; L700-W769 HydrophobicContact CB-CZ2 4.47Å; L700-W769 HydrophobicContact CB-CZ3 3.84Å; L700-W769 HydrophobicContact CD1-CH2 4.17Å; L700-W769 HydrophobicContact CD1-CZ2 4.43Å; L700-W769 HydrophobicContact CD1-CZ3 4.41Å; L700-W769 HydrophobicContact CD2-CD2 4.28Å; L700-W769 HydrophobicContact CD2-CZ2 4.2Å; W741-W769 HydrophobicContact CH2-CH2 4.39Å; W741-W769 AromaticContact CZ2-CH2 3.95Å; W741-W769 HydrophobicContact CZ2-CH2 3.95Å; W741-W769 AromaticContact CZ2-CZ2 3.97Å; W741-W769 HydrophobicContact CZ2-CZ2 3.97Å; F747-W769 AromaticContact CE2-CH2 3.89Å; F747-W769 HydrophobicContact CE2-CH2 3.89Å; F747-W769 AromaticContact CE2-CZ3 3.91Å; F747-W769 HydrophobicContact CE2-CZ3 3.91Å; F747-W769 HydrophobicContact CZ-CH2 4.15Å; C750-W769 HydrophobicContact CB-CH2 4.19Å; C750-W769 HydrophobicContact CB-CZ3 4.26Å; F764-W769 AromaticContact CD1-CZ2 3.88Å; F764-W769 HydrophobicContact CD1-CZ2 3.88Å; F764-W769 PolarHBondContact O-NE1 3.49Å; F764-W769 VanDerWaalsContact O-NE1 3.08Å; K767-W769 HydrophobicContact CB-CZ2 3.84Å; K767-W769 HydrophobicContact CD-CH2 3.91Å; K767-W769 HydrophobicContact CD-CZ2 3.92Å; K767-W769 HydrophobicContact CD-CZ3 4.42Å; K767-W769 HydrophobicContact CG-CH2 4.36Å; K767-W769 HydrophobicContact CG-CZ2 3.98Å; K767-W769 PolarHBondContact O-NE1 3.5Å; W769-N795 PolarHBondContact N-O 3.21Å; W769-S796 WeakPolarHBondContact O-CA 3.41Å; W769-Q797 PolarHBondContact O-N 2.68Å
770	K	92.7	Very high	90.4	Very high	60 Å²	60	40.5 Å²	40.5	26%	0.261	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	-52.5	174.5	-86.6	-75	-175.6	177	0	111.1	V695 P698 R798	V695-K770 HydrophobicContact CG1-CD 3.68Å; V695-K770 HydrophobicContact CG1-CG 3.98Å; P698-K770 WeakPolarHBondContact O-CB 3.49Å; P698-K770 PolarHBondContact O-N 2.76Å; K770-R798 PolarHBondContact O-N 3.42Å; K770-R798 VanDerWaalsContact O-N 3.08Å
771	Y	94.6	Very high	90	Very high	11 Å²	11	42.4 Å²	42.4	4%	0.043	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	142.5	170.6	-85.4	-108.6	0	0	0	109.9	Y662 L685 L689 H699 L700 I773 R798 L800	Y662-Y771 AromaticContact CD2-CE2 3.96Å; Y662-Y771 HydrophobicContact CD2-CE2 3.96Å; Y662-Y771 AromaticContact CD2-CZ 3.79Å; Y662-Y771 WeakPolarHBondContact CD2-OH 3.16Å; Y662-Y771 AromaticContact CE2-CE2 3.83Å; Y662-Y771 HydrophobicContact CE2-CE2 3.83Å; L685-Y771 HydrophobicContact CD2-CE1 4Å; L689-Y771 HydrophobicContact CD1-CD2 4.33Å; L689-Y771 HydrophobicContact CD1-CE2 3.45Å; L689-Y771 VanDerWaalsContact CD1-CE2 3.45Å; H699-Y771 AromaticContact CE1-CD2 3.85Å; H699-Y771 AromaticContact ND1-CD2 3.66Å; H699-Y771 AromaticContact ND1-CG 3.97Å; L700-Y771 PolarHBondContact N-O 3.28Å; Y771-I773 HydrophobicContact CD1-CG1 4.38Å; Y771-R798 WeakPolarHBondContact CA-O 3.37Å; Y771-R798 HydrophobicContact CD1-CB 3.71Å; Y771-R798 HydrophobicContact CD2-CB 3.98Å; Y771-R798 HydrophobicContact CD2-CG 4.31Å; Y771-R798 HydrophobicContact CE1-CB 3.77Å; Y771-R798 HydrophobicContact CE1-CG 4.33Å; Y771-R798 HydrophobicContact CE2-CB 4.02Å; Y771-R798 HydrophobicContact CE2-CG 3.98Å; Y771-R798 HydrophobicContact CG-CB 3.84Å; Y771-L800 HydrophobicContact CD1-CB 4.46Å
772	L	95	Very high	89.7	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.01	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	115.2	155.7	177.3	62.8	0	0	0	107.4	L700 V702 L774 F794 R798 R799 L800 F820	L700-L772 HydrophobicContact CB-CD1 4.3Å; L700-L772 HydrophobicContact CD2-CD1 3.95Å; L700-L772 HydrophobicContact CG-CD1 4.11Å; V702-L772 HydrophobicContact CG2-CD1 3.96Å; L772-L774 HydrophobicContact CD1-CD2 3.94Å; L772-L774 HydrophobicContact CD2-CD2 4.46Å; L772-L774 HydrophobicContact CG-CD2 4.04Å; L772-F794 HydrophobicContact CD1-CD2 4.49Å; L772-F794 HydrophobicContact CD2-CB 4.48Å; L772-R798 PolarHBondContact N-O 3.25Å; L772-R799 HydrophobicContact CB-CG 4.48Å; L772-R799 WeakPolarHBondContact O-CA 3.37Å; L772-L800 PolarHBondContact O-N 3.4Å; L772-F820 HydrophobicContact CD2-CE1 4.41Å; L772-F820 HydrophobicContact CD2-CZ 3.95Å
773	I	95.9	Very high	89.4	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	126.8	175.4	-64.1	154.5	0	0	0	107.4	T682 L686 L700 I701 V702 Y771 L800 L802	T682-I773 HydrophobicContact CG2-CD1 3.69Å; T682-I773 HydrophobicContact CG2-CG1 4.32Å; T682-I773 HydrophobicContact CG2-CG2 4.18Å; L686-I773 HydrophobicContact CD1-CD1 4.25Å; L686-I773 HydrophobicContact CD2-CD1 4.46Å; L700-I773 PolarHBondContact O-N 2.68Å; I701-I773 WeakPolarHBondContact CA-O 3.16Å; I701-I773 HydrophobicContact CB-CB 4.48Å; I701-I773 HydrophobicContact CD1-CD1 4.25Å; I701-I773 HydrophobicContact CG1-CB 4.24Å; I701-I773 HydrophobicContact CG1-CD1 3.99Å; I701-I773 HydrophobicContact CG2-CB 4.17Å; I701-I773 HydrophobicContact CG2-CG2 4.01Å; V702-I773 PolarHBondContact N-O 3.47Å; Y771-I773 HydrophobicContact CD1-CG1 4.38Å; I773-L800 WeakPolarHBondContact CA-O 3.49Å; I773-L800 HydrophobicContact CG1-CB 4.21Å; I773-L800 HydrophobicContact CG1-CD2 4.37Å; I773-L802 HydrophobicContact CG2-CD1 4.02Å; I773-L802 HydrophobicContact CG2-CG 4.3Å
774	L	94.4	Very high	89.3	Confident	0 Å²	0	49 Å²	49	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	121.9	173.2	-55.2	-171.6	0	0	0	109.2	V702 L772 I780 L791 L800 L801 L802 F820	V702-L774 HydrophobicContact CB-CD2 3.64Å; V702-L774 HydrophobicContact CG1-CD2 4.47Å; V702-L774 HydrophobicContact CG2-CD2 3.72Å; L772-L774 HydrophobicContact CD1-CD2 3.94Å; L772-L774 HydrophobicContact CD2-CD2 4.46Å; L772-L774 HydrophobicContact CG-CD2 4.04Å; L774-I780 HydrophobicContact CD1-CD1 3.63Å; L774-I780 HydrophobicContact CD1-CG1 4.35Å; L774-I780 HydrophobicContact CD1-CG2 4.42Å; L774-L791 HydrophobicContact CD1-CD1 4.13Å; L774-L791 HydrophobicContact CD2-CD1 4.2Å; L774-L791 HydrophobicContact CD2-CD2 4.39Å; L774-L800 PolarHBondContact N-O 2.85Å; L774-L801 HydrophobicContact CB-CD2 3.79Å; L774-L801 HydrophobicContact CD1-CD2 3.7Å; L774-L801 HydrophobicContact CG-CD2 3.88Å; L774-L802 PolarHBondContact O-N 3.36Å; L774-F820 HydrophobicContact CD1-CD1 4.35Å; L774-F820 HydrophobicContact CD1-CE1 3.58Å; L774-F820 HydrophobicContact CD1-CE2 4.45Å; L774-F820 HydrophobicContact CD1-CZ 3.66Å; L774-F820 HydrophobicContact CG-CE1 4.35Å
775	D	92.3	Very high	89	Confident	7 Å²	7	50 Å²	50	4%	0.037	22%	0.223	C	C	.	.	S	Bend	trans	-98.1	143.8	176.7	-165.7	29.3	0	0	0	111.4	V702 V703 W711 Y754	V702-D775 PolarHBondContact O-N 2.77Å; V703-D775 HydrophobicContact CG2-CB 4.3Å; W711-D775 HydrophobicContact CZ2-CB 4.08Å; W711-D775 PolarHBondContact NE1-OD2 2.82Å; Y754-D775 WeakPolarHBondContact CE2-O 3.45Å; Y754-D775 PolarHBondContact OH-O 3.04Å
776	E	87.3	Confident	88.9	Confident	25 Å²	25	51 Å²	51	12%	0.117	23%	0.229	C	C	.	.	S	Bend	trans	48.4	58	-167.8	-59.2	-63.3	159.1	0	0	112.1	M674 P704 Q778 N779 L802	M674-E776 WeakPolarHBondContact CE-OE1 3.42Å; P704-E776 HydrophobicContact CG-CB 3.84Å; P704-E776 HydrophobicContact CG-CG 3.96Å; E776-Q778 PolarHBondContact O-N 3.47Å; E776-Q778 PolarHBondContact O-OE1 2.96Å; E776-Q778 PolarHBondContact OE2-NE2 3.41Å; E776-Q778 PolarHBondContact OE2-OE1 2.76Å; E776-N779 WeakPolarHBondContact O-CB 3.32Å; E776-N779 PolarHBondContact O-N 3.23Å; E776-N779 VanDerWaalsContact O-N 3.08Å; E776-N779 PolarHBondContact O-ND2 2.91Å; E776-L802 PolarHBondContact N-O 3.35Å
777	A	87.1	Confident	88.9	Confident	1 Å²	1	44 Å²	44	1%	0.008	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-61.6	-10.2	-171.2	0	0	0	0	0	115.6	N779 I780 L801 L802 L817	A777-N779 PolarHBondContact O-N 3.34Å; A777-N779 VanDerWaalsContact O-N 3.09Å; A777-I780 WeakPolarHBondContact O-CG1 3.11Å; A777-I780 PolarHBondContact O-N 3.49Å; A777-L801 HydrophobicContact CB-CB 4.11Å; A777-L801 HydrophobicContact CB-CD2 4.32Å; A777-L802 WeakPolarHBondContact CB-O 3.2Å; A777-L802 PolarHBondContact N-O 3.38Å; A777-L817 HydrophobicContact CB-CD2 4.36Å
778	Q	82.4	Confident	89.1	Confident	26 Å²	26	43.5 Å²	43.5	12%	0.121	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-57.6	-19.4	167.7	67.3	-84.1	18.3	0	0	112.9	E776 I780 K781 T803	E776-Q778 PolarHBondContact O-N 3.47Å; E776-Q778 PolarHBondContact O-OE1 2.96Å; E776-Q778 PolarHBondContact OE2-NE2 3.41Å; E776-Q778 PolarHBondContact OE2-OE1 2.76Å; Q778-I780 PolarHBondContact O-N 2.93Å; Q778-K781 WeakPolarHBondContact O-CB 3.4Å; Q778-K781 WeakPolarHBondContact O-CD 3.48Å; Q778-K781 WeakPolarHBondContact O-CG 3.36Å; Q778-K781 PolarHBondContact O-N 3Å; Q778-T803 PolarHBondContact OE1-OG1 2.86Å
779	N	84	Confident	89	Confident	63 Å²	63	40.6 Å²	40.6	34%	0.337	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-63.1	-13.7	171.3	-75.2	-74.5	0	0	0	114.6	Y754 E776 A777	Y754-N779 HydrophobicContact CE1-CB 4.34Å; Y754-N779 HydrophobicContact CE2-CB 4.17Å; E776-N779 WeakPolarHBondContact O-CB 3.32Å; E776-N779 PolarHBondContact O-N 3.23Å; E776-N779 VanDerWaalsContact O-N 3.08Å; E776-N779 PolarHBondContact O-ND2 2.91Å; A777-N779 PolarHBondContact O-N 3.34Å; A777-N779 VanDerWaalsContact O-N 3.09Å
780	I	86	Confident	88.9	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-114.7	14.1	176.3	64.4	153.3	0	0	0	113.5	Y754 L774 A777 Q778 N782 L791 L801 L817 F820	Y754-I780 HydrophobicContact CE1-CG2 3.95Å; L774-I780 HydrophobicContact CD1-CD1 3.63Å; L774-I780 HydrophobicContact CD1-CG1 4.35Å; L774-I780 HydrophobicContact CD1-CG2 4.42Å; A777-I780 WeakPolarHBondContact O-CG1 3.11Å; A777-I780 PolarHBondContact O-N 3.49Å; Q778-I780 PolarHBondContact O-N 2.93Å; I780-N782 PolarHBondContact O-N 3.37Å; I780-N782 VanDerWaalsContact O-N 3.1Å; I780-L791 HydrophobicContact CG2-CD1 3.84Å; I780-L801 HydrophobicContact CD1-CD2 4.44Å; I780-L817 HydrophobicContact CD1-CD2 4.16Å; I780-L817 HydrophobicContact CG1-CD2 4.05Å; I780-F820 HydrophobicContact CD1-CB 4.35Å; I780-F820 HydrophobicContact CD1-CD1 4.06Å; I780-F820 HydrophobicContact CD1-CD2 4.01Å; I780-F820 HydrophobicContact CD1-CE1 4.42Å; I780-F820 HydrophobicContact CD1-CE2 4.38Å; I780-F820 HydrophobicContact CD1-CG 3.85Å
781	K	83.3	Confident	88.9	Confident	51 Å²	51	38.7 Å²	38.7	22%	0.222	18%	0.182	C	C	.	.			trans	-65.3	-12.4	-173.5	74.8	-174	-166.3	154.4	0	116.2	Q778 N809 E813 S816	Q778-K781 WeakPolarHBondContact O-CB 3.4Å; Q778-K781 WeakPolarHBondContact O-CD 3.48Å; Q778-K781 WeakPolarHBondContact O-CG 3.36Å; Q778-K781 PolarHBondContact O-N 3Å; K781-N809 PolarHBondContact NZ-ND2 2.96Å; K781-E813 HydrophobicContact CB-CB 4.14Å; K781-E813 HydrophobicContact CB-CG 4.19Å; K781-E813 HydrophobicContact CD-CG 4.3Å; K781-E813 VanDerWaalsContact CD-OE1 3.28Å; K781-E813 WeakPolarHBondContact CD-OE1 3.37Å; K781-E813 WeakPolarHBondContact CE-OE1 3.19Å; K781-E813 HydrophobicContact CG-CG 4.34Å; K781-E813 IonicContact NZ-OE1 2.8Å; K781-E813 PolarHBondContact NZ-OE1 3.48Å; K781-S816 PolarHBondContact O-OG 2.61Å; K781-S816 VanDerWaalsContact O-OG 3.06Å
782	N	83.5	Confident	88.6	Confident	84 Å²	84	40.3 Å²	40.3	45%	0.449	19%	0.191	S	C	.	.			trans	-103.9	110.9	174.7	-178.2	1.4	0	0	0	109.6	I780 K784 S785	I780-N782 PolarHBondContact O-N 3.37Å; I780-N782 VanDerWaalsContact O-N 3.1Å; N782-K784 PolarHBondContact O-N 2.9Å; N782-K784 WeakPolarHBondContact OD1-CB 2.87Å; N782-K784 PolarHBondContact OD1-N 2.86Å; N782-S785 VanDerWaalsContact O-CB 3.3Å; N782-S785 WeakPolarHBondContact O-CB 3.47Å; N782-S785 PolarHBondContact O-N 3.2Å; N782-S785 PolarHBondContact O-OG 3.48Å
783	F	83.8	Confident	88.4	Confident	71 Å²	71	44 Å²	44	31%	0.311	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-25.4	178.5	71	-90.6	0	0	0	113.5	S785 W788 W815	F783-S785 PolarHBondContact O-N 2.87Å; F783-W788 HydrophobicContact CB-CD2 4.27Å; F783-W788 HydrophobicContact CB-CE3 4.45Å; F783-W788 HydrophobicContact CB-CH2 4.21Å; F783-W788 HydrophobicContact CB-CZ2 4.01Å; F783-W788 HydrophobicContact CB-CZ3 4.44Å; F783-W788 VanDerWaalsContact O-CE3 3.3Å; F783-W815 HydrophobicContact CB-CZ3 3.89Å; F783-W815 HydrophobicContact CD1-CE3 4.33Å; F783-W815 AromaticContact CD1-CZ3 4Å; F783-W815 HydrophobicContact CD1-CZ3 4Å; F783-W815 HydrophobicContact CD2-CZ3 4.19Å; F783-W815 HydrophobicContact CG-CE3 4.48Å; F783-W815 AromaticContact CG-CZ3 3.77Å; F783-W815 HydrophobicContact CG-CZ3 3.77Å
784	K	86.3	Confident	88.2	Confident	134 Å²	134	44 Å²	44	58%	0.583	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-16.6	174.1	-61.5	-170	177.5	-171.9	0	112.7	N782 Q789	N782-K784 PolarHBondContact O-N 2.9Å; N782-K784 WeakPolarHBondContact OD1-CB 2.87Å; N782-K784 PolarHBondContact OD1-N 2.86Å; K784-Q789 PolarHBondContact O-NE2 2.96Å
785	S	86.9	Confident	88	Confident	22 Å²	22	48 Å²	48	15%	0.154	24%	0.236	C	C	.	.	S	Bend	trans	-69.8	136.3	-174	68.6	0	0	0	0	113.3	N782 F783 R787 W788 Q789	N782-S785 VanDerWaalsContact O-CB 3.3Å; N782-S785 WeakPolarHBondContact O-CB 3.47Å; N782-S785 PolarHBondContact O-N 3.2Å; N782-S785 PolarHBondContact O-OG 3.48Å; F783-S785 PolarHBondContact O-N 2.87Å; S785-R787 PolarHBondContact O-N 2.68Å; S785-R787 VanDerWaalsContact O-N 3.09Å; S785-W788 PolarHBondContact O-N 3.11Å; S785-W788 WeakPolarHBondContact OG-CB 3.26Å; S785-W788 PolarHBondContact OG-N 3.23Å; S785-Q789 PolarHBondContact O-N 2.9Å; S785-Q789 VanDerWaalsContact O-N 3.16Å
786	Q	87.6	Confident	87.9	Confident	110 Å²	110	49 Å²	49	51%	0.514	24%	0.243	S	C	.	.	H	α-helix	trans	-53.5	-31.6	171.9	-170.3	-171.9	88.5	0	0	111.8	T790	Q786-T790 WeakPolarHBondContact O-CB 3.09Å; Q786-T790 PolarHBondContact O-N 3.37Å; Q786-T790 PolarHBondContact O-OG1 2.7Å
787	R	90.8	Very high	88.1	Confident	63 Å²	63	53.5 Å²	53.5	24%	0.238	26%	0.264	C	S	.	.	H	α-helix	trans	-56.1	-54.5	173.8	-52	-179	-178.9	-165.5	0.4	111.6	E389 I758 S785 L791	E389-R787 IonicContact OE1-NE 3.71Å; E389-R787 PolarHBondContact OE1-NE 3.49Å; E389-R787 IonicContact OE2-CZ 2.81Å; E389-R787 IonicContact OE2-NE 2.71Å; E389-R787 PolarHBondContact OE2-NE 3.39Å; E389-R787 IonicContact OE2-NH2 3.6Å; E389-R787 PolarHBondContact OE2-NH2 2.99Å; I758-R787 HydrophobicContact CD1-CG 3.78Å; S785-R787 PolarHBondContact O-N 2.68Å; S785-R787 VanDerWaalsContact O-N 3.09Å; R787-L791 WeakPolarHBondContact O-CB 3.28Å; R787-L791 VanDerWaalsContact O-CG 3.28Å; R787-L791 WeakPolarHBondContact O-CG 3.14Å; R787-L791 PolarHBondContact O-N 2.85Å; R787-L791 VanDerWaalsContact O-N 3.14Å
788	W	91.7	Very high	88.3	Confident	19 Å²	19	55.7 Å²	55.7	7%	0.072	27%	0.272	C	S	.	.	H	α-helix	trans	-64.2	-47.7	179.7	-177.5	100.3	0	0	0	111.5	F783 S785 T790 L791 L792 S816 H819	F783-W788 HydrophobicContact CB-CD2 4.27Å; F783-W788 HydrophobicContact CB-CE3 4.45Å; F783-W788 HydrophobicContact CB-CH2 4.21Å; F783-W788 HydrophobicContact CB-CZ2 4.01Å; F783-W788 HydrophobicContact CB-CZ3 4.44Å; F783-W788 VanDerWaalsContact O-CE3 3.3Å; S785-W788 PolarHBondContact O-N 3.11Å; S785-W788 WeakPolarHBondContact OG-CB 3.26Å; S785-W788 PolarHBondContact OG-N 3.23Å; W788-T790 PolarHBondContact O-N 3.05Å; W788-L791 PolarHBondContact O-N 3.46Å; W788-L792 HydrophobicContact CE3-CD2 4.26Å; W788-L792 HydrophobicContact CH2-CD2 3.94Å; W788-L792 HydrophobicContact CZ3-CD2 3.74Å; W788-L792 WeakPolarHBondContact O-CB 3.15Å; W788-L792 PolarHBondContact O-N 2.84Å; W788-S816 PolarHBondContact NE1-O 2.84Å; W788-H819 AromaticContact CH2-CE1 3.67Å; W788-H819 AromaticContact CH2-ND1 3.19Å; W788-H819 WeakPolarHBondContact CH2-ND1 2.98Å; W788-H819 HydrophobicContact CZ2-CB 4.3Å; W788-H819 AromaticContact CZ2-ND1 3.16Å; W788-H819 WeakPolarHBondContact CZ2-ND1 3.48Å
789	Q	90.6	Very high	88.8	Confident	98 Å²	98	55.7 Å²	55.7	46%	0.458	27%	0.271	S	S	.	.	H	α-helix	trans	-59.9	-44.2	179.1	-63.1	173.8	1.9	0	0	112.4	K784 S785 L792 T793	K784-Q789 PolarHBondContact O-NE2 2.96Å; S785-Q789 PolarHBondContact O-N 2.9Å; S785-Q789 VanDerWaalsContact O-N 3.16Å; Q789-L792 PolarHBondContact O-N 2.91Å; Q789-T793 PolarHBondContact O-N 3.14Å; Q789-T793 PolarHBondContact O-OG1 3.34Å
790	T	91.1	Very high	89.3	Confident	19 Å²	19	53 Å²	53	12%	0.117	26%	0.256	C	S	.	.	H	α-helix	trans	-66.4	-44	-179.3	-61.5	0	0	0	0	111.7	A761 Q786 W788 T793 F794	A761-T790 HydrophobicContact CB-CG2 3.54Å; Q786-T790 WeakPolarHBondContact O-CB 3.09Å; Q786-T790 PolarHBondContact O-N 3.37Å; Q786-T790 PolarHBondContact O-OG1 2.7Å; W788-T790 PolarHBondContact O-N 3.05Å; T790-T793 WeakPolarHBondContact O-CB 2.98Å; T790-T793 PolarHBondContact O-N 3.35Å; T790-F794 HydrophobicContact CG2-CE1 4.05Å; T790-F794 HydrophobicContact CG2-CZ 4.4Å; T790-F794 VanDerWaalsContact O-CD1 3.31Å; T790-F794 WeakPolarHBondContact O-CD1 3.38Å
791	L	91.6	Very high	89.7	Confident	5 Å²	5	53 Å²	53	3%	0.026	26%	0.256	C	S	.	.	H	α-helix	trans	-68.3	-35.8	177.4	-70	171	0	0	0	112.3	V702 Y754 A757 L774 I780 R787 W788 T793 F794 F820	V702-L791 HydrophobicContact CG2-CD2 4.25Å; Y754-L791 HydrophobicContact CD1-CD1 4.12Å; Y754-L791 HydrophobicContact CE1-CD1 4.08Å; A757-L791 HydrophobicContact CB-CD2 4.38Å; L774-L791 HydrophobicContact CD1-CD1 4.13Å; L774-L791 HydrophobicContact CD2-CD1 4.2Å; L774-L791 HydrophobicContact CD2-CD2 4.39Å; I780-L791 HydrophobicContact CG2-CD1 3.84Å; R787-L791 WeakPolarHBondContact O-CB 3.28Å; R787-L791 VanDerWaalsContact O-CG 3.28Å; R787-L791 WeakPolarHBondContact O-CG 3.14Å; R787-L791 PolarHBondContact O-N 2.85Å; R787-L791 VanDerWaalsContact O-N 3.14Å; W788-L791 PolarHBondContact O-N 3.46Å; L791-T793 PolarHBondContact O-N 3.37Å; L791-F794 HydrophobicContact CD2-CD2 3.98Å; L791-F794 HydrophobicContact CD2-CE2 3.71Å; L791-F794 HydrophobicContact CD2-CZ 4.36Å; L791-F794 WeakPolarHBondContact O-CB 3.17Å; L791-F794 PolarHBondContact O-N 3.26Å; L791-F820 HydrophobicContact CB-CE2 3.75Å; L791-F820 HydrophobicContact CB-CZ 3.98Å
792	L	89.3	Confident	90.2	Very high	45 Å²	45	50.6 Å²	50.6	24%	0.236	25%	0.246	C	C	.	.	H	α-helix	trans	-58.9	-34.3	174.3	176.8	56.1	0	0	0	111.4	W788 Q789 F794 R799 F820 P823	W788-L792 HydrophobicContact CE3-CD2 4.26Å; W788-L792 HydrophobicContact CH2-CD2 3.94Å; W788-L792 HydrophobicContact CZ3-CD2 3.74Å; W788-L792 WeakPolarHBondContact O-CB 3.15Å; W788-L792 PolarHBondContact O-N 2.84Å; Q789-L792 PolarHBondContact O-N 2.91Å; L792-F794 VanDerWaalsContact C-N 3.26Å; L792-F794 PolarHBondContact O-N 2.95Å; L792-R799 VanDerWaalsContact CD1-NH1 3.3Å; L792-R799 PolarHBondContact O-NH2 3.28Å; L792-F820 HydrophobicContact CB-CE2 4.41Å; L792-P823 HydrophobicContact CD1-CB 4.4Å; L792-P823 HydrophobicContact CD1-CG 4.35Å
793	T	90	Very high	90.4	Very high	80 Å²	80	46.7 Å²	46.7	49%	0.491	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-9.6	177.8	-45.2	0	0	0	0	113.9	K765 Q789 T790 L791 N795	K765-T793 HydrophobicContact CD-CG2 3.98Å; K765-T793 VanDerWaalsContact CE-CG2 3.47Å; K765-T793 HydrophobicContact CG-CG2 4.47Å; Q789-T793 PolarHBondContact O-N 3.14Å; Q789-T793 PolarHBondContact O-OG1 3.34Å; T790-T793 WeakPolarHBondContact O-CB 2.98Å; T790-T793 PolarHBondContact O-N 3.35Å; L791-T793 PolarHBondContact O-N 3.37Å; T793-N795 PolarHBondContact O-N 2.84Å
794	F	91.8	Very high	90.2	Very high	2 Å²	2	44 Å²	44	1%	0.009	22%	0.217	C	C	.	.	S	Bend	trans	-76.8	121.9	-177.5	-73.1	4	0	0	0	112.2	L700 A757 A761 F764 K765 L772 T790 L791 L792 S796	L700-F794 HydrophobicContact CD2-CD2 4.02Å; L700-F794 HydrophobicContact CD2-CE2 4.07Å; A757-F794 HydrophobicContact CB-CE2 4.36Å; A757-F794 HydrophobicContact CB-CZ 4.43Å; A761-F794 HydrophobicContact CB-CE1 4.21Å; F764-F794 HydrophobicContact CB-CD2 4.49Å; F764-F794 HydrophobicContact CB-CE1 4.01Å; F764-F794 HydrophobicContact CB-CE2 3.83Å; F764-F794 HydrophobicContact CB-CZ 3.55Å; F764-F794 HydrophobicContact CG-CE2 4.32Å; F764-F794 HydrophobicContact CG-CZ 4.23Å; K765-F794 HydrophobicContact CG-CD1 3.78Å; K765-F794 HydrophobicContact CG-CE1 3.92Å; L772-F794 HydrophobicContact CD1-CD2 4.49Å; L772-F794 HydrophobicContact CD2-CB 4.48Å; T790-F794 HydrophobicContact CG2-CE1 4.05Å; T790-F794 HydrophobicContact CG2-CZ 4.4Å; T790-F794 VanDerWaalsContact O-CD1 3.31Å; T790-F794 WeakPolarHBondContact O-CD1 3.38Å; L791-F794 HydrophobicContact CD2-CD2 3.98Å; L791-F794 HydrophobicContact CD2-CE2 3.71Å; L791-F794 HydrophobicContact CD2-CZ 4.36Å; L791-F794 WeakPolarHBondContact O-CB 3.17Å; L791-F794 PolarHBondContact O-N 3.26Å; L792-F794 VanDerWaalsContact C-N 3.26Å; L792-F794 PolarHBondContact O-N 2.95Å; F794-S796 PolarHBondContact O-N 3.21Å; F794-S796 PolarHBondContact O-OG 2.93Å
795	N	90.7	Very high	89.7	Confident	84 Å²	84	39.3 Å²	39.3	45%	0.449	20%	0.2	S	C	.	.			trans	-64	100.2	178.4	-168	-48.5	0	0	0	110.8	W769 T793	W769-N795 PolarHBondContact N-O 3.21Å; T793-N795 PolarHBondContact O-N 2.84Å
796	S	90.9	Very high	88.9	Confident	26 Å²	26	38.5 Å²	38.5	18%	0.182	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	130.2	-169.2	41.8	0	0	0	0	110.7	W769 F794 R799	W769-S796 WeakPolarHBondContact O-CA 3.41Å; F794-S796 PolarHBondContact O-N 3.21Å; F794-S796 PolarHBondContact O-OG 2.93Å; S796-R799 PolarHBondContact OG-NE 3.17Å
797	Q	90.4	Very high	88.2	Confident	121 Å²	121	33.6 Å²	33.6	57%	0.565	17%	0.171	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-81.2	-29.2	179.6	-64.3	-170.2	-25.6	0	0	113.4	W769	W769-Q797 PolarHBondContact O-N 2.68Å
798	R	91.9	Very high	87	Confident	46 Å²	46	31.4 Å²	31.4	17%	0.174	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	145.6	177.3	-65.5	-69.1	168.5	-127	-1.5	110.3	Y662 R665 N667 K770 Y771 L772	Y662-R798 HydrophobicContact CD2-CG 3.95Å; Y662-R798 HydrophobicContact CE2-CG 3.96Å; R665-R798 VanDerWaalsContact CB-NH2 3.27Å; R665-R798 PolarHBondContact O-NH1 2.83Å; N667-R798 WeakPolarHBondContact OD1-CA 3.29Å; K770-R798 PolarHBondContact O-N 3.42Å; K770-R798 VanDerWaalsContact O-N 3.08Å; Y771-R798 WeakPolarHBondContact CA-O 3.37Å; Y771-R798 HydrophobicContact CD1-CB 3.71Å; Y771-R798 HydrophobicContact CD2-CB 3.98Å; Y771-R798 HydrophobicContact CD2-CG 4.31Å; Y771-R798 HydrophobicContact CE1-CB 3.77Å; Y771-R798 HydrophobicContact CE1-CG 4.33Å; Y771-R798 HydrophobicContact CE2-CB 4.02Å; Y771-R798 HydrophobicContact CE2-CG 3.98Å; Y771-R798 HydrophobicContact CG-CB 3.84Å; L772-R798 PolarHBondContact N-O 3.25Å
799	R	93.7	Very high	85.8	Confident	26 Å²	26	34 Å²	34	10%	0.098	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	130.3	174.1	-64.8	179.9	177.6	-177.5	-2.9	108.9	N667 L772 L792 S796 F820	N667-R799 HydrophobicContact CB-CB 4.37Å; N667-R799 VanDerWaalsContact CB-O 3.3Å; N667-R799 WeakPolarHBondContact CB-O 3.12Å; N667-R799 PolarHBondContact OD1-N 2.9Å; N667-R799 PolarHBondContact OD1-O 2.99Å; L772-R799 HydrophobicContact CB-CG 4.48Å; L772-R799 WeakPolarHBondContact O-CA 3.37Å; L792-R799 VanDerWaalsContact CD1-NH1 3.3Å; L792-R799 PolarHBondContact O-NH2 3.28Å; S796-R799 PolarHBondContact OG-NE 3.17Å; R799-F820 VanDerWaalsContact CD-O 3.23Å; R799-F820 WeakPolarHBondContact CD-O 3.42Å; R799-F820 HydrophobicContact CG-CE1 4.49Å; R799-F820 PolarHBondContact NH1-O 2.77Å
800	L	94.5	Very high	84.9	Confident	6 Å²	6	31.7 Å²	31.7	3%	0.031	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	124	175.3	174.8	60.4	0	0	0	108	L658 T682 L685 Y771 L772 I773 L774 L802	L658-L800 HydrophobicContact CD2-CD1 3.73Å; L658-L800 HydrophobicContact CD2-CD2 4.21Å; T682-L800 HydrophobicContact CG2-CD2 4.11Å; L685-L800 HydrophobicContact CD2-CD2 4.2Å; Y771-L800 HydrophobicContact CD1-CB 4.46Å; L772-L800 PolarHBondContact O-N 3.4Å; I773-L800 WeakPolarHBondContact CA-O 3.49Å; I773-L800 HydrophobicContact CG1-CB 4.21Å; I773-L800 HydrophobicContact CG1-CD2 4.37Å; L774-L800 PolarHBondContact N-O 2.85Å; L800-L802 HydrophobicContact CD1-CD2 4.25Å; L800-L802 HydrophobicContact CD2-CD2 4.14Å; L800-L802 HydrophobicContact CG-CD2 3.93Å
801	L	93.9	Very high	84.1	Confident	1 Å²	1	31.3 Å²	31.3	1%	0.005	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	128.6	177.6	-58.8	-177.4	0	0	0	109.4	G668 I669 L670 L774 A777 I780 L817 F820 L821	G668-L801 PolarHBondContact O-N 2.93Å; G668-L801 VanDerWaalsContact O-N 3.1Å; I669-L801 CarbonylContact C-O 2.82Å; I669-L801 WeakPolarHBondContact CA-O 3.32Å; I669-L801 HydrophobicContact CG1-CB 4.32Å; I669-L801 HydrophobicContact CG1-CD1 4.43Å; I669-L801 HydrophobicContact CG2-CB 4.37Å; L670-L801 PolarHBondContact N-O 3.22Å; L774-L801 HydrophobicContact CB-CD2 3.79Å; L774-L801 HydrophobicContact CD1-CD2 3.7Å; L774-L801 HydrophobicContact CG-CD2 3.88Å; A777-L801 HydrophobicContact CB-CB 4.11Å; A777-L801 HydrophobicContact CB-CD2 4.32Å; I780-L801 HydrophobicContact CD1-CD2 4.44Å; L801-L817 HydrophobicContact CD1-CB 4.27Å; L801-L817 HydrophobicContact CD1-CD2 4Å; L801-F820 HydrophobicContact CD1-CD1 4.31Å; L801-F820 HydrophobicContact CD2-CD1 3.9Å; L801-F820 HydrophobicContact CD2-CE1 4Å; L801-L821 HydrophobicContact CD1-CD1 4.15Å; L801-L821 HydrophobicContact CD1-CD2 3.94Å; L801-L821 HydrophobicContact CD1-CG 3.82Å; L801-L821 HydrophobicContact CG-CD2 3.91Å; L801-L821 HydrophobicContact CG-CG 4.35Å
802	L	93	Very high	83.3	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	129.5	173.5	-46	178.3	0	0	0	108.2	L670 K678 W711 I773 L774 E776 A777 L800	L670-L802 HydrophobicContact CB-CD2 3.83Å; L670-L802 HydrophobicContact CD2-CD2 4.15Å; K678-L802 HydrophobicContact CD-CB 4.43Å; W711-L802 HydrophobicContact CH2-CD1 3.91Å; W711-L802 HydrophobicContact CZ2-CD1 3.87Å; I773-L802 HydrophobicContact CG2-CD1 4.02Å; I773-L802 HydrophobicContact CG2-CG 4.3Å; L774-L802 PolarHBondContact O-N 3.36Å; E776-L802 PolarHBondContact N-O 3.35Å; A777-L802 WeakPolarHBondContact CB-O 3.2Å; A777-L802 PolarHBondContact N-O 3.38Å; L800-L802 HydrophobicContact CD1-CD2 4.25Å; L800-L802 HydrophobicContact CD2-CD2 4.14Å; L800-L802 HydrophobicContact CG-CD2 3.93Å
803	T	87.9	Confident	82.9	Confident	2 Å²	2	31.7 Å²	31.7	1%	0.012	17%	0.172	C	C	.	.			trans	-146.7	156.7	175.5	-179.3	0	0	0	0	110.7	I669 L670 A671 K678 Q778 T805 P806	I669-T803 HydrophobicContact CG2-CG2 3.94Å; L670-T803 PolarHBondContact O-N 2.97Å; L670-T803 VanDerWaalsContact O-N 3.16Å; A671-T803 HydrophobicContact CB-CG2 4.01Å; K678-T803 WeakPolarHBondContact CD-O 3.13Å; K678-T803 WeakPolarHBondContact CE-O 3.08Å; K678-T803 PolarHBondContact NZ-O 3.38Å; Q778-T803 PolarHBondContact OE1-OG1 2.86Å; T803-T805 PolarHBondContact OG1-N 3.38Å; T803-T805 PolarHBondContact OG1-O 3.14Å; T803-P806 HydrophobicContact CG2-CB 4.02Å
804	G	79.3	Confident	82.4	Confident	14 Å²	14	28.1 Å²	28.1	14%	0.144	15%	0.15	C	C	.	.	S	Bend	trans	-91.4	-24	162.6	0	0	0	0	0	113.5
805	T	76.7	Confident	82	Confident	36 Å²	36	28.6 Å²	28.6	22%	0.221	15%	0.152	C	C	.	.			trans	-141	103.3	-175.5	48.6	0	0	0	0	110	T803 Q808 T1475	T803-T805 PolarHBondContact OG1-N 3.38Å; T803-T805 PolarHBondContact OG1-O 3.14Å; T805-Q808 PolarHBondContact OG1-NE2 2.73Å; T805-T1475 HydrophobicContact CG2-CG2 4.08Å
806	P	69.2	Low	81.8	Confident	6 Å²	6	24.6 Å²	24.6	4%	0.039	13%	0.13	C	C	.	.	S	Bend	trans	-83.1	-11.1	-177.1	32.4	-34.2	0	0	0	114	A671 T803 I1523	A671-P806 HydrophobicContact CB-CB 4.49Å; A671-P806 HydrophobicContact CB-CG 4.14Å; T803-P806 HydrophobicContact CG2-CB 4.02Å; P806-I1523 HydrophobicContact CG-CD1 3.71Å
807	L	72.9	Confident	81.6	Confident	6 Å²	6	23.6 Å²	23.6	3%	0.031	12%	0.123	C	C	.	.			trans	-132.9	139.5	168.5	-76	168.3	0	0	0	109.2	S810 L811 L814 S1519 A1522 I1523	L807-S810 WeakPolarHBondContact CD2-O 3.36Å; L807-L811 HydrophobicContact CD1-CD2 4.08Å; L807-L811 HydrophobicContact CD2-CD2 4.22Å; L807-L814 HydrophobicContact CD2-CB 3.68Å; L807-L814 HydrophobicContact CG-CB 4.39Å; L807-S1519 PolarHBondContact O-OG 3.38Å; L807-A1522 HydrophobicContact CD1-CB 3.7Å; L807-I1523 HydrophobicContact CB-CD1 4.12Å; L807-I1523 HydrophobicContact CD1-CD1 4.07Å; L807-I1523 HydrophobicContact CD1-CG1 4.01Å; L807-I1523 HydrophobicContact CG-CD1 4.35Å
808	Q	65.5	Low	81.2	Confident	18 Å²	18	18.2 Å²	18.2	8%	0.084	10%	0.098	C	C	.	.	S	Bend	trans	-130.4	-50.6	177.6	-57.2	-170.6	-26.2	0	0	113	T805 E813 T1475	T805-Q808 PolarHBondContact OG1-NE2 2.73Å; Q808-E813 WeakPolarHBondContact CA-OE2 3.27Å; Q808-E813 PolarHBondContact N-OE2 3.11Å; Q808-T1475 HydrophobicContact CB-CG2 4.21Å; Q808-T1475 HydrophobicContact CG-CG2 4.02Å; Q808-T1475 PolarHBondContact NE2-OG1 2.81Å
809	N	67.1	Low	81	Confident	73 Å²	73	17.2 Å²	17.2	39%	0.39	10%	0.095	S	C	.	.	S	Bend	trans	-126.3	-27.3	-176.3	-69.4	-53	0	0	0	114	K781 E813 K1515	K781-N809 PolarHBondContact NZ-ND2 2.96Å; N809-E813 PolarHBondContact N-OE2 3.29Å; N809-K1515 PolarHBondContact OD1-NZ 3.07Å
810	S	71.9	Confident	80.7	Confident	50 Å²	50	16 Å²	16	35%	0.35	9%	0.09	S	C	.	.			trans	-157.8	147	-172.5	179	0	0	0	0	112.7	L807 M812 E813	L807-S810 WeakPolarHBondContact CD2-O 3.36Å; S810-M812 PolarHBondContact O-N 3.42Å; S810-M812 PolarHBondContact OG-N 3.44Å; S810-E813 PolarHBondContact N-OE2 3.17Å; S810-E813 VanDerWaalsContact O-CB 3.22Å; S810-E813 WeakPolarHBondContact O-CB 3.48Å; S810-E813 WeakPolarHBondContact O-CG 3.33Å; S810-E813 PolarHBondContact O-N 2.88Å
811	L	73.3	Confident	80.4	Confident	11 Å²	11	15.9 Å²	15.9	6%	0.058	9%	0.09	C	C	.	.	H	α-helix	trans	-60.8	-20.5	171.9	-68.2	163.9	0	0	0	113.2	L807 E813 L814 W815 F836 I840 L858	L807-L811 HydrophobicContact CD1-CD2 4.08Å; L807-L811 HydrophobicContact CD2-CD2 4.22Å; L811-E813 PolarHBondContact O-N 3.24Å; L811-L814 WeakPolarHBondContact O-CB 3.28Å; L811-L814 PolarHBondContact O-N 2.92Å; L811-L814 VanDerWaalsContact O-N 3.15Å; L811-W815 PolarHBondContact O-N 3.2Å; L811-F836 WeakPolarHBondContact CD1-O 3.32Å; L811-I840 HydrophobicContact CD1-CB 3.79Å; L811-I840 HydrophobicContact CD1-CD1 3.65Å; L811-I840 HydrophobicContact CD1-CG1 4.25Å; L811-I840 HydrophobicContact CD1-CG2 3.87Å; L811-L858 HydrophobicContact CD2-CD1 4.28Å
812	M	75.5	Confident	79.9	Confident	38 Å²	38	17 Å²	17	19%	0.187	10%	0.095	C	C	.	.	H	α-helix	trans	-67.5	-23.5	173.4	-56	-52.8	-74.7	0	0	112.5	S810 L814 W815 S816 Q833 A837	S810-M812 PolarHBondContact O-N 3.42Å; S810-M812 PolarHBondContact OG-N 3.44Å; M812-L814 VanDerWaalsContact C-N 3.34Å; M812-W815 PolarHBondContact O-N 3.23Å; M812-S816 PolarHBondContact O-N 2.83Å; M812-S816 VanDerWaalsContact O-N 3.12Å; M812-Q833 HydrophobicContact CE-CB 4.23Å; M812-Q833 HydrophobicContact SD-CB 4.25Å; M812-Q833 HydrophobicContact SD-CG 4.4Å; M812-A837 HydrophobicContact SD-CB 4.17Å
813	E	80.7	Confident	79.3	Confident	19 Å²	19	18.7 Å²	18.7	9%	0.089	11%	0.106	C	C	.	.	H	α-helix	trans	-64.1	-41.4	171.8	-60.9	176.1	146.5	0	0	110.1	K781 Q808 N809 S810 L811 S816 L817	K781-E813 HydrophobicContact CB-CB 4.14Å; K781-E813 HydrophobicContact CB-CG 4.19Å; K781-E813 HydrophobicContact CD-CG 4.3Å; K781-E813 VanDerWaalsContact CD-OE1 3.28Å; K781-E813 WeakPolarHBondContact CD-OE1 3.37Å; K781-E813 WeakPolarHBondContact CE-OE1 3.19Å; K781-E813 HydrophobicContact CG-CG 4.34Å; K781-E813 IonicContact NZ-OE1 2.8Å; K781-E813 PolarHBondContact NZ-OE1 3.48Å; Q808-E813 WeakPolarHBondContact CA-OE2 3.27Å; Q808-E813 PolarHBondContact N-OE2 3.11Å; N809-E813 PolarHBondContact N-OE2 3.29Å; S810-E813 PolarHBondContact N-OE2 3.17Å; S810-E813 VanDerWaalsContact O-CB 3.22Å; S810-E813 WeakPolarHBondContact O-CB 3.48Å; S810-E813 WeakPolarHBondContact O-CG 3.33Å; S810-E813 PolarHBondContact O-N 2.88Å; L811-E813 PolarHBondContact O-N 3.24Å; E813-S816 PolarHBondContact O-N 3.17Å; E813-S816 PolarHBondContact O-OG 2.86Å; E813-L817 WeakPolarHBondContact O-CG 3.27Å; E813-L817 PolarHBondContact O-N 3.34Å
814	L	80.4	Confident	78.6	Confident	5 Å²	5	25 Å²	25	3%	0.026	14%	0.14	C	C	.	.	H	α-helix	trans	-66	-42.7	175.8	173.4	67.9	0	0	0	112.1	L807 L811 M812 S816 L817 M818 F832 L862	L807-L814 HydrophobicContact CD2-CB 3.68Å; L807-L814 HydrophobicContact CG-CB 4.39Å; L811-L814 WeakPolarHBondContact O-CB 3.28Å; L811-L814 PolarHBondContact O-N 2.92Å; L811-L814 VanDerWaalsContact O-N 3.15Å; M812-L814 VanDerWaalsContact C-N 3.34Å; L814-S816 VanDerWaalsContact C-N 3.3Å; L814-S816 PolarHBondContact O-N 2.72Å; L814-L817 PolarHBondContact O-N 2.89Å; L814-M818 HydrophobicContact CD1-CG 4.29Å; L814-M818 HydrophobicContact CG-CG 4.49Å; L814-M818 HydrophobicContact CG-SD 4.49Å; L814-M818 WeakPolarHBondContact O-CG 3.34Å; L814-M818 PolarHBondContact O-N 3.19Å; L814-F832 HydrophobicContact CD2-CZ 4.4Å; L814-L862 HydrophobicContact CD1-CD1 4.36Å; L814-L862 HydrophobicContact CD1-CD2 3.99Å; L814-L862 HydrophobicContact CD2-CD1 3.94Å; L814-L862 HydrophobicContact CD2-CD2 4.2Å; L814-L862 HydrophobicContact CG-CD2 4.45Å
815	W	83.4	Confident	78.4	Confident	13 Å²	13	29.3 Å²	29.3	5%	0.049	16%	0.159	C	C	.	.	H	α-helix	trans	-56.5	-44.1	173.3	177.8	86.1	0	0	0	111.7	F783 L811 M812 L817 M818 H819 S828 H829 F832	F783-W815 HydrophobicContact CB-CZ3 3.89Å; F783-W815 HydrophobicContact CD1-CE3 4.33Å; F783-W815 AromaticContact CD1-CZ3 4Å; F783-W815 HydrophobicContact CD1-CZ3 4Å; F783-W815 HydrophobicContact CD2-CZ3 4.19Å; F783-W815 HydrophobicContact CG-CE3 4.48Å; F783-W815 AromaticContact CG-CZ3 3.77Å; F783-W815 HydrophobicContact CG-CZ3 3.77Å; L811-W815 PolarHBondContact O-N 3.2Å; M812-W815 PolarHBondContact O-N 3.23Å; W815-L817 VanDerWaalsContact C-N 3.26Å; W815-L817 PolarHBondContact O-N 3.38Å; W815-M818 PolarHBondContact O-N 2.86Å; W815-M818 VanDerWaalsContact O-N 3.15Å; W815-H819 HydrophobicContact CZ2-CB 4.33Å; W815-H819 PolarHBondContact O-N 3.22Å; W815-S828 PolarHBondContact NE1-O 2.81Å; W815-S828 VanDerWaalsContact NE1-O 3.09Å; W815-H829 HydrophobicContact CH2-CB 3.99Å; W815-H829 HydrophobicContact CZ2-CB 3.74Å; W815-H829 HydrophobicContact CZ3-CB 4.47Å; W815-F832 HydrophobicContact CB-CD1 3.75Å; W815-F832 HydrophobicContact CB-CE1 3.81Å; W815-F832 HydrophobicContact CB-CG 4.13Å; W815-F832 HydrophobicContact CB-CZ 4.23Å; W815-F832 AromaticContact CD1-CD2 3.83Å; W815-F832 AromaticContact CD1-CG 3.52Å; W815-F832 HydrophobicContact CG-CB 4.4Å; W815-F832 HydrophobicContact CG-CD1 4.18Å; W815-F832 HydrophobicContact CG-CG 4.14Å
816	S	85.1	Confident	77.8	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-60.2	-34.7	179.4	83.1	0	0	0	0	113	K781 W788 M812 E813 L814 F820	K781-S816 PolarHBondContact O-OG 2.61Å; K781-S816 VanDerWaalsContact O-OG 3.06Å; W788-S816 PolarHBondContact NE1-O 2.84Å; M812-S816 PolarHBondContact O-N 2.83Å; M812-S816 VanDerWaalsContact O-N 3.12Å; E813-S816 PolarHBondContact O-N 3.17Å; E813-S816 PolarHBondContact O-OG 2.86Å; L814-S816 VanDerWaalsContact C-N 3.3Å; L814-S816 PolarHBondContact O-N 2.72Å; S816-F820 WeakPolarHBondContact O-CB 3.4Å; S816-F820 PolarHBondContact O-N 2.74Å
817	L	87	Confident	77.9	Confident	5 Å²	5	36 Å²	36	3%	0.026	19%	0.186	C	C	.	.	H	α-helix	trans	-75.5	-40.9	176.2	-63.3	170.2	0	0	0	111.2	I669 A777 I780 L801 E813 L814 W815 F820 L821	I669-L817 HydrophobicContact CD1-CB 4.48Å; A777-L817 HydrophobicContact CB-CD2 4.36Å; I780-L817 HydrophobicContact CD1-CD2 4.16Å; I780-L817 HydrophobicContact CG1-CD2 4.05Å; L801-L817 HydrophobicContact CD1-CB 4.27Å; L801-L817 HydrophobicContact CD1-CD2 4Å; E813-L817 WeakPolarHBondContact O-CG 3.27Å; E813-L817 PolarHBondContact O-N 3.34Å; L814-L817 PolarHBondContact O-N 2.89Å; W815-L817 VanDerWaalsContact C-N 3.26Å; W815-L817 PolarHBondContact O-N 3.38Å; L817-F820 PolarHBondContact O-N 2.9Å; L817-L821 WeakPolarHBondContact O-CD1 3.44Å; L817-L821 WeakPolarHBondContact O-CG 3.16Å; L817-L821 PolarHBondContact O-N 3.32Å; L817-L821 VanDerWaalsContact O-N 3.08Å
818	M	83.4	Confident	77.8	Confident	7 Å²	7	37.9 Å²	37.9	3%	0.034	20%	0.2	C	C	.	.	H	α-helix	trans	-65.3	-45.5	177	-69.5	-163.7	80.3	0	0	112.6	L814 W815 F820 L821 M822 F826 F832 V861 L862 F865	L814-M818 HydrophobicContact CD1-CG 4.29Å; L814-M818 HydrophobicContact CG-CG 4.49Å; L814-M818 HydrophobicContact CG-SD 4.49Å; L814-M818 WeakPolarHBondContact O-CG 3.34Å; L814-M818 PolarHBondContact O-N 3.19Å; W815-M818 PolarHBondContact O-N 2.86Å; W815-M818 VanDerWaalsContact O-N 3.15Å; M818-F820 VanDerWaalsContact C-N 3.31Å; M818-F820 PolarHBondContact O-N 3.09Å; M818-L821 PolarHBondContact O-N 2.85Å; M818-M822 PolarHBondContact O-N 2.75Å; M818-F826 HydrophobicContact CB-CD2 4.21Å; M818-F826 HydrophobicContact CB-CE2 4.43Å; M818-F826 HydrophobicContact CE-CD2 4.48Å; M818-F826 HydrophobicContact CE-CE1 4.35Å; M818-F826 HydrophobicContact CE-CE2 3.6Å; M818-F826 HydrophobicContact CE-CZ 3.52Å; M818-F826 HydrophobicContact SD-CZ 4.46Å; M818-F832 HydrophobicContact SD-CE2 4.46Å; M818-V861 HydrophobicContact CE-CG1 4.04Å; M818-L862 HydrophobicContact CE-CD2 3.92Å; M818-L862 HydrophobicContact CG-CD2 4.45Å; M818-L862 HydrophobicContact SD-CD2 3.51Å; M818-L862 VanDerWaalsContact SD-CD2 3.51Å; M818-F865 HydrophobicContact CE-CD2 4.33Å
819	H	86.6	Confident	78.3	Confident	25 Å²	25	41 Å²	41	12%	0.116	21%	0.214	C	C	.	.	H	α-helix	trans	-63.4	-36.7	173.7	-179.1	-95.8	0	0	0	111.6	W788 W815 L821 M822 P823 F826	W788-H819 AromaticContact CH2-CE1 3.67Å; W788-H819 AromaticContact CH2-ND1 3.19Å; W788-H819 WeakPolarHBondContact CH2-ND1 2.98Å; W788-H819 HydrophobicContact CZ2-CB 4.3Å; W788-H819 AromaticContact CZ2-ND1 3.16Å; W788-H819 WeakPolarHBondContact CZ2-ND1 3.48Å; W815-H819 HydrophobicContact CZ2-CB 4.33Å; W815-H819 PolarHBondContact O-N 3.22Å; H819-L821 VanDerWaalsContact C-N 3.3Å; H819-L821 PolarHBondContact O-N 3.18Å; H819-M822 CarbonylContact O-C 3.49Å; H819-M822 PolarHBondContact O-N 2.82Å; H819-P823 WeakPolarHBondContact O-CA 3.49Å; H819-P823 VanDerWaalsContact O-CD 3.29Å; H819-P823 WeakPolarHBondContact O-CD 3.2Å; H819-F826 PolarHBondContact CD2-O 3.45Å; H819-F826 VanDerWaalsContact CD2-O 3.26Å
820	F	88.1	Confident	78.7	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.4	-34.6	175.1	-170.6	-89.1	0	0	0	113.1	L772 L774 I780 L791 L792 R799 L801 S816 L817 M818	L772-F820 HydrophobicContact CD2-CE1 4.41Å; L772-F820 HydrophobicContact CD2-CZ 3.95Å; L774-F820 HydrophobicContact CD1-CD1 4.35Å; L774-F820 HydrophobicContact CD1-CE1 3.58Å; L774-F820 HydrophobicContact CD1-CE2 4.45Å; L774-F820 HydrophobicContact CD1-CZ 3.66Å; L774-F820 HydrophobicContact CG-CE1 4.35Å; I780-F820 HydrophobicContact CD1-CB 4.35Å; I780-F820 HydrophobicContact CD1-CD1 4.06Å; I780-F820 HydrophobicContact CD1-CD2 4.01Å; I780-F820 HydrophobicContact CD1-CE1 4.42Å; I780-F820 HydrophobicContact CD1-CE2 4.38Å; I780-F820 HydrophobicContact CD1-CG 3.85Å; L791-F820 HydrophobicContact CB-CE2 3.75Å; L791-F820 HydrophobicContact CB-CZ 3.98Å; L792-F820 HydrophobicContact CB-CE2 4.41Å; R799-F820 VanDerWaalsContact CD-O 3.23Å; R799-F820 WeakPolarHBondContact CD-O 3.42Å; R799-F820 HydrophobicContact CG-CE1 4.49Å; R799-F820 PolarHBondContact NH1-O 2.77Å; L801-F820 HydrophobicContact CD1-CD1 4.31Å; L801-F820 HydrophobicContact CD2-CD1 3.9Å; L801-F820 HydrophobicContact CD2-CE1 4Å; S816-F820 WeakPolarHBondContact O-CB 3.4Å; S816-F820 PolarHBondContact O-N 2.74Å; L817-F820 PolarHBondContact O-N 2.9Å; M818-F820 VanDerWaalsContact C-N 3.31Å; M818-F820 PolarHBondContact O-N 3.09Å
821	L	86.9	Confident	78.9	Confident	5 Å²	5	45.7 Å²	45.7	3%	0.026	22%	0.223	C	C	.	.	H	α-helix	trans	-73.4	-42.9	175.3	-69.2	159.3	0	0	0	112.6	N667 I669 L801 L817 M818 H819	N667-L821 HydrophobicContact CB-CB 4.3Å; N667-L821 HydrophobicContact CB-CD2 3.81Å; N667-L821 PolarHBondContact ND2-O 2.62Å; I669-L821 HydrophobicContact CD1-CD1 3.79Å; I669-L821 HydrophobicContact CG1-CD1 3.5Å; I669-L821 VanDerWaalsContact CG1-CD1 3.5Å; L801-L821 HydrophobicContact CD1-CD1 4.15Å; L801-L821 HydrophobicContact CD1-CD2 3.94Å; L801-L821 HydrophobicContact CD1-CG 3.82Å; L801-L821 HydrophobicContact CG-CD2 3.91Å; L801-L821 HydrophobicContact CG-CG 4.35Å; L817-L821 WeakPolarHBondContact O-CD1 3.44Å; L817-L821 WeakPolarHBondContact O-CG 3.16Å; L817-L821 PolarHBondContact O-N 3.32Å; L817-L821 VanDerWaalsContact O-N 3.08Å; M818-L821 PolarHBondContact O-N 2.85Å; H819-L821 VanDerWaalsContact C-N 3.3Å; H819-L821 PolarHBondContact O-N 3.18Å
822	M	84	Confident	78.9	Confident	23 Å²	23	45.7 Å²	45.7	11%	0.113	22%	0.223	C	C	.	.			trans	-143.4	74.3	-170.8	-62.5	-169.2	-62	0	0	111.6	M818 H819 N824 I825 F826 F865	M818-M822 PolarHBondContact O-N 2.75Å; H819-M822 CarbonylContact O-C 3.49Å; H819-M822 PolarHBondContact O-N 2.82Å; M822-N824 PolarHBondContact O-N 3.16Å; M822-N824 VanDerWaalsContact O-N 3.13Å; M822-I825 HydrophobicContact CB-CD1 4.27Å; M822-I825 HydrophobicContact CB-CG1 4.41Å; M822-I825 HydrophobicContact CE-CD1 3.95Å; M822-I825 PolarHBondContact O-N 3.36Å; M822-I825 VanDerWaalsContact O-N 3.14Å; M822-I825 HydrophobicContact SD-CD1 3.78Å; M822-F826 HydrophobicContact CE-CE2 4.02Å; M822-F865 HydrophobicContact CE-CD1 3.89Å; M822-F865 HydrophobicContact CE-CD2 4.1Å; M822-F865 HydrophobicContact CE-CE1 3.45Å; M822-F865 VanDerWaalsContact CE-CE1 3.45Å; M822-F865 HydrophobicContact CE-CE2 3.69Å; M822-F865 HydrophobicContact CE-CG 4.21Å; M822-F865 HydrophobicContact CE-CZ 3.36Å; M822-F865 HydrophobicContact SD-CD1 4.35Å; M822-F865 HydrophobicContact SD-CE1 3.75Å; M822-F865 HydrophobicContact SD-CZ 4.11Å
823	P	79.8	Confident	78.9	Confident	36 Å²	36	48.2 Å²	48.2	23%	0.234	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-25.3	-176.8	25	-34.4	0	0	0	112.7	L792 H819 I825 Q827	L792-P823 HydrophobicContact CD1-CB 4.4Å; L792-P823 HydrophobicContact CD1-CG 4.35Å; H819-P823 WeakPolarHBondContact O-CA 3.49Å; H819-P823 VanDerWaalsContact O-CD 3.29Å; H819-P823 WeakPolarHBondContact O-CD 3.2Å; P823-I825 PolarHBondContact O-N 3.25Å; P823-Q827 VanDerWaalsContact O-CG 3.26Å; P823-Q827 WeakPolarHBondContact O-CG 3.5Å
824	N	74.1	Confident	78.6	Confident	135 Å²	135	53 Å²	53	72%	0.722	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-21.8	179.2	-60.6	26.3	0	0	0	113.9	M822 Q827	M822-N824 PolarHBondContact O-N 3.16Å; M822-N824 VanDerWaalsContact O-N 3.13Å; N824-Q827 PolarHBondContact O-NE2 3.5Å
825	I	73.9	Confident	78.1	Confident	104 Å²	104	59.9 Å²	59.9	53%	0.533	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-40.6	-172.1	-58.6	-179.2	0	0	0	112	M822 P823	M822-I825 HydrophobicContact CB-CD1 4.27Å; M822-I825 HydrophobicContact CB-CG1 4.41Å; M822-I825 HydrophobicContact CE-CD1 3.95Å; M822-I825 PolarHBondContact O-N 3.36Å; M822-I825 VanDerWaalsContact O-N 3.14Å; M822-I825 HydrophobicContact SD-CD1 3.78Å; P823-I825 PolarHBondContact O-N 3.25Å
826	F	66	Low	77.5	Confident	35 Å²	35	60.1 Å²	60.1	15%	0.154	28%	0.284	C	S	.	.			trans	-109.1	46.8	-169.6	-65.1	-75.2	0	0	0	112.8	M818 H819 M822 S828 V861	M818-F826 HydrophobicContact CB-CD2 4.21Å; M818-F826 HydrophobicContact CB-CE2 4.43Å; M818-F826 HydrophobicContact CE-CD2 4.48Å; M818-F826 HydrophobicContact CE-CE1 4.35Å; M818-F826 HydrophobicContact CE-CE2 3.6Å; M818-F826 HydrophobicContact CE-CZ 3.52Å; M818-F826 HydrophobicContact SD-CZ 4.46Å; H819-F826 PolarHBondContact CD2-O 3.45Å; H819-F826 VanDerWaalsContact CD2-O 3.26Å; M822-F826 HydrophobicContact CE-CE2 4.02Å; F826-S828 VanDerWaalsContact C-N 3.33Å; F826-S828 PolarHBondContact O-N 2.77Å; F826-V861 HydrophobicContact CZ-CG1 4.28Å
827	Q	70.8	Confident	76.6	Confident	147 Å²	147	60.7 Å²	60.7	69%	0.687	29%	0.289	S	S	*	.			trans	-66.5	-35	-174.9	-62.4	179.7	32.6	0	0	112.5	P823 N824	P823-Q827 VanDerWaalsContact O-CG 3.26Å; P823-Q827 WeakPolarHBondContact O-CG 3.5Å; N824-Q827 PolarHBondContact O-NE2 3.5Å
828	S	69.9	Low	75.6	Confident	46 Å²	46	63.7 Å²	63.7	32%	0.322	31%	0.31	S	S	.	.			trans	-81.9	128.3	176.6	36.8	0	0	0	0	112	W815 F826 D831	W815-S828 PolarHBondContact NE1-O 2.81Å; W815-S828 VanDerWaalsContact NE1-O 3.09Å; F826-S828 VanDerWaalsContact C-N 3.33Å; F826-S828 PolarHBondContact O-N 2.77Å; S828-D831 WeakPolarHBondContact CB-OD1 3.5Å; S828-D831 WeakPolarHBondContact CB-OD2 3.46Å; S828-D831 PolarHBondContact OG-OD2 2.72Å
829	H	75.7	Confident	74.6	Confident	83 Å²	83	64.9 Å²	64.9	38%	0.384	32%	0.318	S	S	.	.	S	Bend	trans	-88.6	-32.9	170.1	59.8	-88.3	0	0	0	111.9	W815 Q833	W815-H829 HydrophobicContact CH2-CB 3.99Å; W815-H829 HydrophobicContact CZ2-CB 3.74Å; W815-H829 HydrophobicContact CZ3-CB 4.47Å; H829-Q833 WeakPolarHBondContact O-CB 3.23Å; H829-Q833 PolarHBondContact O-N 2.56Å; H829-Q833 VanDerWaalsContact O-N 3.08Å
830	R	75.7	Confident	73.4	Confident	164 Å²	164	64.3 Å²	64.3	62%	0.619	32%	0.316	S	S	*	.	H	α-helix	trans	-64.9	-51.8	-178.3	-61.7	-170	179.2	-174.1	-2.8	111.6	F832 Q833 E834	R830-F832 VanDerWaalsContact C-N 3.25Å; R830-F832 PolarHBondContact O-N 3.23Å; R830-Q833 CarbonylContact O-C 3.51Å; R830-Q833 WeakPolarHBondContact O-CA 3.44Å; R830-Q833 WeakPolarHBondContact O-CB 3.34Å; R830-Q833 PolarHBondContact O-N 1.76Å; R830-E834 WeakPolarHBondContact O-CG 3.19Å; R830-E834 PolarHBondContact O-N 2.54Å
831	D	76.7	Confident	72.4	Confident	58 Å²	58	67.6 Å²	67.6	31%	0.31	34%	0.336	S	S	.	.	H	α-helix	trans	-53.2	-43.7	178.9	-42.9	12.7	0	0	0	111.4	S828 E834 W835	S828-D831 WeakPolarHBondContact CB-OD1 3.5Å; S828-D831 WeakPolarHBondContact CB-OD2 3.46Å; S828-D831 PolarHBondContact OG-OD2 2.72Å; D831-E834 PolarHBondContact O-N 2.62Å; D831-W835 HydrophobicContact CB-CD2 4.39Å; D831-W835 HydrophobicContact CB-CH2 4.02Å; D831-W835 HydrophobicContact CB-CZ2 3.78Å; D831-W835 HydrophobicContact CB-CZ3 4.43Å; D831-W835 VanDerWaalsContact O-CB 3.32Å; D831-W835 WeakPolarHBondContact O-CB 3.24Å; D831-W835 VanDerWaalsContact O-CD1 3.24Å; D831-W835 VanDerWaalsContact O-CD2 3.25Å; D831-W835 PolarHBondContact O-N 3.44Å
832	F	73.8	Confident	71.2	Confident	11 Å²	11	68 Å²	68	5%	0.048	34%	0.342	C	S	.	.	H	α-helix	trans	-68.5	-37.6	177.1	-170.3	-81.7	0	0	0	112.6	L814 W815 M818 R830 F836	L814-F832 HydrophobicContact CD2-CZ 4.4Å; W815-F832 HydrophobicContact CB-CD1 3.75Å; W815-F832 HydrophobicContact CB-CE1 3.81Å; W815-F832 HydrophobicContact CB-CG 4.13Å; W815-F832 HydrophobicContact CB-CZ 4.23Å; W815-F832 AromaticContact CD1-CD2 3.83Å; W815-F832 AromaticContact CD1-CG 3.52Å; W815-F832 HydrophobicContact CG-CB 4.4Å; W815-F832 HydrophobicContact CG-CD1 4.18Å; W815-F832 HydrophobicContact CG-CG 4.14Å; M818-F832 HydrophobicContact SD-CE2 4.46Å; R830-F832 VanDerWaalsContact C-N 3.25Å; R830-F832 PolarHBondContact O-N 3.23Å; F832-F836 HydrophobicContact CD1-CD2 4.14Å; F832-F836 AromaticContact CD2-CD2 3.6Å; F832-F836 HydrophobicContact CD2-CD2 3.6Å; F832-F836 AromaticContact CD2-CE2 3.8Å; F832-F836 HydrophobicContact CD2-CE2 3.8Å; F832-F836 HydrophobicContact CE1-CB 4.32Å; F832-F836 HydrophobicContact CE1-CD2 4.1Å; F832-F836 AromaticContact CE2-CD2 3.56Å; F832-F836 HydrophobicContact CE2-CD2 3.56Å; F832-F836 AromaticContact CE2-CE2 3.8Å; F832-F836 HydrophobicContact CE2-CE2 3.8Å; F832-F836 AromaticContact CG-CD2 3.89Å; F832-F836 HydrophobicContact CG-CD2 3.89Å; F832-F836 HydrophobicContact CG-CE2 4.47Å; F832-F836 AromaticContact CZ-CD2 3.82Å; F832-F836 HydrophobicContact CZ-CD2 3.82Å; F832-F836 HydrophobicContact CZ-CE2 4.46Å; F832-F836 HydrophobicContact CZ-CG 4.45Å; F832-F836 PolarHBondContact O-N 3.42Å; F832-F836 VanDerWaalsContact O-N 3.09Å
833	Q	74.3	Confident	70.1	Confident	92 Å²	92	68.9 Å²	68.9	43%	0.43	35%	0.346	S	S	.	.	I	π-helix	trans	-64	-45.2	175.4	-173.4	178.9	-25	0	0	110.9	M812 H829 R830 A837 S838	M812-Q833 HydrophobicContact CE-CB 4.23Å; M812-Q833 HydrophobicContact SD-CB 4.25Å; M812-Q833 HydrophobicContact SD-CG 4.4Å; H829-Q833 WeakPolarHBondContact O-CB 3.23Å; H829-Q833 PolarHBondContact O-N 2.56Å; H829-Q833 VanDerWaalsContact O-N 3.08Å; R830-Q833 CarbonylContact O-C 3.51Å; R830-Q833 WeakPolarHBondContact O-CA 3.44Å; R830-Q833 WeakPolarHBondContact O-CB 3.34Å; R830-Q833 PolarHBondContact O-N 1.76Å; Q833-A837 HydrophobicContact CB-CB 4.41Å; Q833-A837 HydrophobicContact CG-CB 3.95Å; Q833-A837 WeakPolarHBondContact O-CA 3.21Å; Q833-A837 WeakPolarHBondContact O-CB 2.93Å; Q833-A837 PolarHBondContact O-N 3.22Å; Q833-S838 PolarHBondContact O-N 2.74Å; Q833-S838 PolarHBondContact O-OG 2.99Å
834	E	75.5	Confident	69.2	Low	118 Å²	118	70.2 Å²	70.2	55%	0.551	35%	0.35	S	S	*	.	I	π-helix	trans	-65	-44.7	176.4	-70.2	167	-152.1	0	0	112.5	R830 D831 P839	R830-E834 WeakPolarHBondContact O-CG 3.19Å; R830-E834 PolarHBondContact O-N 2.54Å; D831-E834 PolarHBondContact O-N 2.62Å; E834-P839 WeakPolarHBondContact O-CD 3.45Å
835	W	69.3	Low	68.5	Low	150 Å²	150	71 Å²	71	57%	0.568	35%	0.35	S	S	*	.	I	π-helix	trans	-75.2	-25.1	-176.1	-59.8	-10.7	0	0	0	114.1	D831	D831-W835 HydrophobicContact CB-CD2 4.39Å; D831-W835 HydrophobicContact CB-CH2 4.02Å; D831-W835 HydrophobicContact CB-CZ2 3.78Å; D831-W835 HydrophobicContact CB-CZ3 4.43Å; D831-W835 VanDerWaalsContact O-CB 3.32Å; D831-W835 WeakPolarHBondContact O-CB 3.24Å; D831-W835 VanDerWaalsContact O-CD1 3.24Å; D831-W835 VanDerWaalsContact O-CD2 3.25Å; D831-W835 PolarHBondContact O-N 3.44Å
836	F	70.3	Confident	67.7	Low	19 Å²	19	68.5 Å²	68.5	8%	0.083	35%	0.349	C	S	.	.	I	π-helix	trans	-134.7	-40.4	-171.5	-55.7	-65.2	0	0	0	115.3	L811 F832 I840 L858	L811-F836 WeakPolarHBondContact CD1-O 3.32Å; F832-F836 HydrophobicContact CD1-CD2 4.14Å; F832-F836 AromaticContact CD2-CD2 3.6Å; F832-F836 HydrophobicContact CD2-CD2 3.6Å; F832-F836 AromaticContact CD2-CE2 3.8Å; F832-F836 HydrophobicContact CD2-CE2 3.8Å; F832-F836 HydrophobicContact CE1-CB 4.32Å; F832-F836 HydrophobicContact CE1-CD2 4.1Å; F832-F836 AromaticContact CE2-CD2 3.56Å; F832-F836 HydrophobicContact CE2-CD2 3.56Å; F832-F836 AromaticContact CE2-CE2 3.8Å; F832-F836 HydrophobicContact CE2-CE2 3.8Å; F832-F836 AromaticContact CG-CD2 3.89Å; F832-F836 HydrophobicContact CG-CD2 3.89Å; F832-F836 HydrophobicContact CG-CE2 4.47Å; F832-F836 AromaticContact CZ-CD2 3.82Å; F832-F836 HydrophobicContact CZ-CD2 3.82Å; F832-F836 HydrophobicContact CZ-CE2 4.46Å; F832-F836 HydrophobicContact CZ-CG 4.45Å; F832-F836 PolarHBondContact O-N 3.42Å; F832-F836 VanDerWaalsContact O-N 3.09Å; F836-I840 WeakPolarHBondContact O-CB 3.12Å; F836-I840 WeakPolarHBondContact O-CD1 3.33Å; F836-I840 WeakPolarHBondContact O-CG1 3.25Å; F836-I840 PolarHBondContact O-N 2.72Å; F836-L858 HydrophobicContact CB-CD1 4.42Å; F836-L858 HydrophobicContact CD1-CB 3.98Å; F836-L858 HydrophobicContact CD1-CD1 3.85Å; F836-L858 HydrophobicContact CD1-CG 4.36Å; F836-L858 HydrophobicContact CE1-CB 3.74Å; F836-L858 HydrophobicContact CE1-CD1 4.37Å; F836-L858 HydrophobicContact CE1-CG 4.39Å; F836-L858 HydrophobicContact CG-CD1 4.18Å
837	A	66.7	Low	67.3	Low	12 Å²	12	72.6 Å²	72.6	10%	0.099	37%	0.373	C	S	.	.	I	π-helix	trans	-77.8	-49.5	-173.6	0	0	0	0	0	112.3	M812 Q833 T841	M812-A837 HydrophobicContact SD-CB 4.17Å; Q833-A837 HydrophobicContact CB-CB 4.41Å; Q833-A837 HydrophobicContact CG-CB 3.95Å; Q833-A837 WeakPolarHBondContact O-CA 3.21Å; Q833-A837 WeakPolarHBondContact O-CB 2.93Å; Q833-A837 PolarHBondContact O-N 3.22Å; A837-T841 WeakPolarHBondContact O-CB 3.39Å; A837-T841 PolarHBondContact O-N 3.23Å; A837-T841 PolarHBondContact O-OG1 2.85Å
838	S	65.4	Low	66.8	Low	67 Å²	67	69.4 Å²	69.4	47%	0.469	36%	0.364	S	S	.	.	H	α-helix	trans	-61.1	-47.4	-179.9	-47.1	0	0	0	0	113	Q833 I840 T841 G842	Q833-S838 PolarHBondContact O-N 2.74Å; Q833-S838 PolarHBondContact O-OG 2.99Å; S838-I840 PolarHBondContact O-N 3.39Å; S838-T841 PolarHBondContact O-N 3.48Å; S838-G842 PolarHBondContact O-N 2.6Å
839	P	63.1	Low	66.2	Low	33 Å²	33	73.9 Å²	73.9	21%	0.214	38%	0.384	C	S	.	.	H	α-helix	trans	-66	-40	-179.6	-22.2	35.8	0	0	0	113.2	E834 T841 G842 M843 N851 L854	E834-P839 WeakPolarHBondContact O-CD 3.45Å; P839-T841 VanDerWaalsContact C-N 3.29Å; P839-T841 PolarHBondContact O-N 2.7Å; P839-G842 PolarHBondContact O-N 2.82Å; P839-M843 PolarHBondContact O-N 2.71Å; P839-N851 PolarHBondContact O-OD1 3.17Å; P839-L854 HydrophobicContact CB-CD1 3.39Å; P839-L854 HydrophobicContact CG-CD1 3.69Å
840	I	62.2	Low	65.3	Low	13 Å²	13	77.4 Å²	77.4	7%	0.067	40%	0.4	C	S	.	.	H	α-helix	trans	-74.1	-22.1	178.9	-65.1	173.4	0	0	0	111.6	L811 F836 S838 M843 I844 V855	L811-I840 HydrophobicContact CD1-CB 3.79Å; L811-I840 HydrophobicContact CD1-CD1 3.65Å; L811-I840 HydrophobicContact CD1-CG1 4.25Å; L811-I840 HydrophobicContact CD1-CG2 3.87Å; F836-I840 WeakPolarHBondContact O-CB 3.12Å; F836-I840 WeakPolarHBondContact O-CD1 3.33Å; F836-I840 WeakPolarHBondContact O-CG1 3.25Å; F836-I840 PolarHBondContact O-N 2.72Å; S838-I840 PolarHBondContact O-N 3.39Å; I840-M843 HydrophobicContact CG2-CE 4.26Å; I840-M843 WeakPolarHBondContact O-CB 3.21Å; I840-I844 WeakPolarHBondContact O-CG1 3.47Å; I840-V855 HydrophobicContact CD1-CG2 4.34Å
841	T	66.3	Low	64.7	Low	69 Å²	69	70.1 Å²	70.1	42%	0.423	37%	0.373	S	S	.	.	H	α-helix	trans	-73.5	-47	169.7	-52.7	0	0	0	0	110.4	A837 S838 P839 M843 I844 E845	A837-T841 WeakPolarHBondContact O-CB 3.39Å; A837-T841 PolarHBondContact O-N 3.23Å; A837-T841 PolarHBondContact O-OG1 2.85Å; S838-T841 PolarHBondContact O-N 3.48Å; P839-T841 VanDerWaalsContact C-N 3.29Å; P839-T841 PolarHBondContact O-N 2.7Å; T841-M843 PolarHBondContact O-N 3.14Å; T841-M843 VanDerWaalsContact O-N 3.17Å; T841-I844 WeakPolarHBondContact O-CB 3.38Å; T841-I844 PolarHBondContact O-N 2.76Å; T841-E845 PolarHBondContact O-N 2.79Å
842	G	62.3	Low	64.2	Low	14 Å²	14	71.2 Å²	71.2	14%	0.144	38%	0.377	C	S	.	.	H	α-helix	trans	-61	-24	173.8	0	0	0	0	0	114.3	S838 P839 I844 E845 G846 N847	S838-G842 PolarHBondContact O-N 2.6Å; P839-G842 PolarHBondContact O-N 2.82Å; G842-I844 VanDerWaalsContact C-N 3.32Å; G842-E845 PolarHBondContact O-N 2.68Å; G842-G846 PolarHBondContact O-N 3.08Å; G842-N847 PolarHBondContact O-N 3.28Å; G842-N847 VanDerWaalsContact O-N 3.08Å
843	M	61.3	Low	64.2	Low	41 Å²	41	75.9 Å²	75.9	20%	0.202	40%	0.401	C	S	.	.	H	α-helix	trans	-67.4	-29.2	171	-165.6	178.9	74.6	0	0	113.1	P839 I840 T841 E845 N851 F1528	P839-M843 PolarHBondContact O-N 2.71Å; I840-M843 HydrophobicContact CG2-CE 4.26Å; I840-M843 WeakPolarHBondContact O-CB 3.21Å; T841-M843 PolarHBondContact O-N 3.14Å; T841-M843 VanDerWaalsContact O-N 3.17Å; M843-E845 VanDerWaalsContact C-N 3.34Å; M843-N851 WeakPolarHBondContact CB-ND2 3.4Å; M843-N851 HydrophobicContact CG-CB 4.33Å; M843-N851 HydrophobicContact SD-CB 3.71Å; M843-F1528 HydrophobicContact SD-CE2 4.34Å; M843-F1528 HydrophobicContact SD-CZ 3.8Å
844	I	59.4	Low	64	Low	63 Å²	63	73 Å²	73	32%	0.323	39%	0.389	S	S	.	.	H	α-helix	trans	-76.2	-29.2	174.7	-58.3	166.9	0	0	0	110.5	I840 T841 G842 G846 Q1514 L1518	I840-I844 WeakPolarHBondContact O-CG1 3.47Å; T841-I844 WeakPolarHBondContact O-CB 3.38Å; T841-I844 PolarHBondContact O-N 2.76Å; G842-I844 VanDerWaalsContact C-N 3.32Å; I844-G846 VanDerWaalsContact C-N 3.32Å; I844-Q1514 VanDerWaalsContact CG2-NE2 3.3Å; I844-L1518 HydrophobicContact CD1-CD1 3.75Å
845	E	59.5	Low	63.8	Low	153 Å²	153	68 Å²	68	72%	0.715	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	1.4	-179.2	-64.8	166.7	171.4	0	0	113.2	T841 G842 M843	T841-E845 PolarHBondContact O-N 2.79Å; G842-E845 PolarHBondContact O-N 2.68Å; M843-E845 VanDerWaalsContact C-N 3.34Å
846	G	56.9	Low	64.1	Low	51 Å²	51	65.6 Å²	65.6	53%	0.526	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	112.5	-4.5	167.8	0	0	0	0	0	116.6	G842 I844 T848	G842-G846 PolarHBondContact O-N 3.08Å; I844-G846 VanDerWaalsContact C-N 3.32Å; G846-T848 PolarHBondContact O-N 2.98Å
847	N	59	Low	64.5	Low	121 Å²	121	72.1 Å²	72.1	65%	0.647	39%	0.385	S	S	*	.			trans	-79.1	103.3	178.5	-80.6	-39.9	0	0	0	111.5	G842 N851	G842-N847 PolarHBondContact O-N 3.28Å; G842-N847 VanDerWaalsContact O-N 3.08Å; N847-N851 PolarHBondContact O-ND2 2.82Å
848	T	59.9	Low	65	Low	80 Å²	80	71.9 Å²	71.9	49%	0.491	38%	0.383	S	S	.	.			trans	-82.4	-32.6	-169.7	39	0	0	0	0	115.7	G846 H850	G846-T848 PolarHBondContact O-N 2.98Å; T848-H850 PolarHBondContact O-N 3.47Å
849	D	58	Low	65.5	Low	139 Å²	139	70.9 Å²	70.9	74%	0.743	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-17.7	-144.7	-62.5	-6.6	0	0	0	116.9
850	H	55.5	Low	66.4	Low	158 Å²	158	77.5 Å²	77.5	73%	0.731	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.3	-5.6	-168.8	-75.4	63.7	0	0	0	114.7	T848	T848-H850 PolarHBondContact O-N 3.47Å
851	N	63	Low	67.4	Low	10 Å²	10	79.8 Å²	79.8	5%	0.053	41%	0.41	C	S	.	.			trans	-88.5	-25.6	-156.8	-68.3	-49.2	0	0	0	115.8	P839 M843 N847 L853 L854 V855	P839-N851 PolarHBondContact O-OD1 3.17Å; M843-N851 WeakPolarHBondContact CB-ND2 3.4Å; M843-N851 HydrophobicContact CG-CB 4.33Å; M843-N851 HydrophobicContact SD-CB 3.71Å; N847-N851 PolarHBondContact O-ND2 2.82Å; N851-L853 VanDerWaalsContact C-N 3.34Å; N851-L853 PolarHBondContact O-N 3.43Å; N851-L854 WeakPolarHBondContact O-CB 3.31Å; N851-L854 PolarHBondContact O-N 2.86Å; N851-L854 VanDerWaalsContact O-N 3.08Å; N851-V855 PolarHBondContact O-N 3.33Å; N851-V855 VanDerWaalsContact O-N 3.11Å
852	E	67.6	Low	68.1	Low	81 Å²	81	77.1 Å²	77.1	38%	0.379	39%	0.394	S	S	.	.	H	α-helix	trans	-60.5	-43.1	-176.8	-166.9	-169	160.3	0	0	112	L854 V855 Q856 F1528	E852-L854 PolarHBondContact O-N 3.46Å; E852-V855 PolarHBondContact O-N 3.32Å; E852-V855 VanDerWaalsContact O-N 3.16Å; E852-Q856 HydrophobicContact CG-CG 4.32Å; E852-Q856 WeakPolarHBondContact O-CG 3.32Å; E852-Q856 PolarHBondContact O-N 2.87Å; E852-Q856 PolarHBondContact OE1-NE2 3.13Å; E852-F1528 HydrophobicContact CB-CD1 3.8Å; E852-F1528 HydrophobicContact CB-CE1 4.1Å; E852-F1528 HydrophobicContact CG-CB 4.18Å; E852-F1528 HydrophobicContact CG-CD1 3.63Å; E852-F1528 HydrophobicContact CG-CE1 4.42Å; E852-F1528 HydrophobicContact CG-CG 4.16Å
853	L	73.4	Confident	69	Low	109 Å²	109	86.6 Å²	86.6	57%	0.571	43%	0.425	S	S	*	.	H	α-helix	trans	-61.1	-29.8	178.4	-68.3	175.8	0	0	0	112.7	N851 R857	N851-L853 VanDerWaalsContact C-N 3.34Å; N851-L853 PolarHBondContact O-N 3.43Å; L853-R857 WeakPolarHBondContact O-CB 3.45Å; L853-R857 WeakPolarHBondContact O-CD 3.49Å; L853-R857 WeakPolarHBondContact O-CG 3.47Å; L853-R857 PolarHBondContact O-N 2.88Å; L853-R857 VanDerWaalsContact O-N 3.09Å
854	L	70.6	Confident	70.1	Confident	33 Å²	33	87.5 Å²	87.5	17%	0.173	43%	0.434	C	S	.	.	H	α-helix	trans	-76	-41.6	176.4	-61.1	176.1	0	0	0	111.3	P839 N851 E852 R857 L858	P839-L854 HydrophobicContact CB-CD1 3.39Å; P839-L854 HydrophobicContact CG-CD1 3.69Å; N851-L854 WeakPolarHBondContact O-CB 3.31Å; N851-L854 PolarHBondContact O-N 2.86Å; N851-L854 VanDerWaalsContact O-N 3.08Å; E852-L854 PolarHBondContact O-N 3.46Å; L854-R857 WeakPolarHBondContact O-CB 3.26Å; L854-R857 PolarHBondContact O-N 2.66Å; L854-L858 WeakPolarHBondContact O-CB 3.14Å; L854-L858 PolarHBondContact O-N 3.29Å
855	V	70.6	Confident	71.4	Confident	11 Å²	11	86 Å²	86	7%	0.067	43%	0.425	C	S	.	.	H	α-helix	trans	-63.3	-43.3	173.9	175.8	0	0	0	0	111.1	I840 N851 E852 R857 L858 H859	I840-V855 HydrophobicContact CD1-CG2 4.34Å; N851-V855 PolarHBondContact O-N 3.33Å; N851-V855 VanDerWaalsContact O-N 3.11Å; E852-V855 PolarHBondContact O-N 3.32Å; E852-V855 VanDerWaalsContact O-N 3.16Å; V855-R857 PolarHBondContact O-N 3.37Å; V855-L858 PolarHBondContact O-N 2.92Å; V855-H859 PolarHBondContact O-CD2 3.49Å; V855-H859 PolarHBondContact O-N 3.24Å
856	Q	75.6	Confident	72.7	Confident	101 Å²	101	80 Å²	80	47%	0.472	40%	0.398	S	S	.	.	H	α-helix	trans	-61	-41.4	173.4	-70	-176.6	15.1	0	0	112.3	E852 K860	E852-Q856 HydrophobicContact CG-CG 4.32Å; E852-Q856 WeakPolarHBondContact O-CG 3.32Å; E852-Q856 PolarHBondContact O-N 2.87Å; E852-Q856 PolarHBondContact OE1-NE2 3.13Å; Q856-K860 WeakPolarHBondContact O-CB 3.21Å; Q856-K860 PolarHBondContact O-N 3.2Å
857	R	79.4	Confident	74.2	Confident	155 Å²	155	79 Å²	79	59%	0.585	38%	0.38	S	S	*	.	H	α-helix	trans	-62.6	-45.3	173.9	-75.6	165.9	-172.4	-167	4.1	111.6	L853 L854 V855 K860 V861	L853-R857 WeakPolarHBondContact O-CB 3.45Å; L853-R857 WeakPolarHBondContact O-CD 3.49Å; L853-R857 WeakPolarHBondContact O-CG 3.47Å; L853-R857 PolarHBondContact O-N 2.88Å; L853-R857 VanDerWaalsContact O-N 3.09Å; L854-R857 WeakPolarHBondContact O-CB 3.26Å; L854-R857 PolarHBondContact O-N 2.66Å; V855-R857 PolarHBondContact O-N 3.37Å; R857-K860 WeakPolarHBondContact O-CB 2.9Å; R857-K860 PolarHBondContact O-N 2.75Å; R857-V861 WeakPolarHBondContact O-CG2 3.47Å; R857-V861 PolarHBondContact O-N 3.26Å
858	L	76.5	Confident	75.5	Confident	8 Å²	8	76.3 Å²	76.3	4%	0.042	36%	0.361	C	S	.	.	H	α-helix	trans	-58.2	-50.8	176.7	-177.9	152.4	0	0	0	110.8	L811 F836 L854 V855 K860 V861 L862	L811-L858 HydrophobicContact CD2-CD1 4.28Å; F836-L858 HydrophobicContact CB-CD1 4.42Å; F836-L858 HydrophobicContact CD1-CB 3.98Å; F836-L858 HydrophobicContact CD1-CD1 3.85Å; F836-L858 HydrophobicContact CD1-CG 4.36Å; F836-L858 HydrophobicContact CE1-CB 3.74Å; F836-L858 HydrophobicContact CE1-CD1 4.37Å; F836-L858 HydrophobicContact CE1-CG 4.39Å; F836-L858 HydrophobicContact CG-CD1 4.18Å; L854-L858 WeakPolarHBondContact O-CB 3.14Å; L854-L858 PolarHBondContact O-N 3.29Å; V855-L858 PolarHBondContact O-N 2.92Å; L858-K860 VanDerWaalsContact C-N 3.31Å; L858-K860 PolarHBondContact O-N 3.24Å; L858-V861 PolarHBondContact O-N 3.43Å; L858-V861 VanDerWaalsContact O-N 3.12Å; L858-L862 HydrophobicContact CD2-CD1 3.53Å; L858-L862 HydrophobicContact CD2-CG 4.11Å; L858-L862 HydrophobicContact CG-CD1 4.43Å; L858-L862 WeakPolarHBondContact O-CG 3.2Å; L858-L862 PolarHBondContact O-N 3.33Å
859	H	76	Confident	76.7	Confident	45 Å²	45	73.7 Å²	73.7	21%	0.208	34%	0.342	C	S	.	.	H	α-helix	trans	-59.8	-39.5	176.1	-71.9	-55.4	0	0	0	112.7	V855 V861 L862 R863 A1522	V855-H859 PolarHBondContact O-CD2 3.49Å; V855-H859 PolarHBondContact O-N 3.24Å; H859-V861 VanDerWaalsContact C-N 3.28Å; H859-V861 PolarHBondContact O-N 2.71Å; H859-L862 PolarHBondContact O-N 3.13Å; H859-R863 VanDerWaalsContact O-CB 3.31Å; H859-R863 WeakPolarHBondContact O-CB 3.47Å; H859-R863 PolarHBondContact O-N 3.5Å; H859-A1522 PolarHBondContact CE1-O 3.27Å; H859-A1522 VanDerWaalsContact CE1-O 3.29Å
860	K	82.5	Confident	77.9	Confident	172 Å²	172	68.9 Å²	68.9	75%	0.748	32%	0.316	S	S	*	.	H	α-helix	trans	-61.9	-34.5	176.4	-172	175.5	-178.7	176.9	0	112.5	Q856 R857 L858	Q856-K860 WeakPolarHBondContact O-CB 3.21Å; Q856-K860 PolarHBondContact O-N 3.2Å; R857-K860 WeakPolarHBondContact O-CB 2.9Å; R857-K860 PolarHBondContact O-N 2.75Å; L858-K860 VanDerWaalsContact C-N 3.31Å; L858-K860 PolarHBondContact O-N 3.24Å
861	V	81.4	Confident	79.1	Confident	62 Å²	62	61.9 Å²	61.9	38%	0.376	28%	0.283	S	S	.	.	H	α-helix	trans	-76.8	-37.2	175.4	172.9	0	0	0	0	112.2	M818 F826 R857 L858 H859 P864 F865	M818-V861 HydrophobicContact CE-CG1 4.04Å; F826-V861 HydrophobicContact CZ-CG1 4.28Å; R857-V861 WeakPolarHBondContact O-CG2 3.47Å; R857-V861 PolarHBondContact O-N 3.26Å; L858-V861 PolarHBondContact O-N 3.43Å; L858-V861 VanDerWaalsContact O-N 3.12Å; H859-V861 VanDerWaalsContact C-N 3.28Å; H859-V861 PolarHBondContact O-N 2.71Å; V861-P864 WeakPolarHBondContact O-CD 3.08Å; V861-F865 WeakPolarHBondContact O-CD2 3.13Å
862	L	81.8	Confident	79.8	Confident	13 Å²	13	65.2 Å²	65.2	7%	0.068	31%	0.312	C	S	.	.	H	α-helix	trans	-76.8	-36.9	-179.1	-67.6	-172.6	0	0	0	114.5	L814 M818 L858 H859 P864 F865 L866	L814-L862 HydrophobicContact CD1-CD1 4.36Å; L814-L862 HydrophobicContact CD1-CD2 3.99Å; L814-L862 HydrophobicContact CD2-CD1 3.94Å; L814-L862 HydrophobicContact CD2-CD2 4.2Å; L814-L862 HydrophobicContact CG-CD2 4.45Å; M818-L862 HydrophobicContact CE-CD2 3.92Å; M818-L862 HydrophobicContact CG-CD2 4.45Å; M818-L862 HydrophobicContact SD-CD2 3.51Å; M818-L862 VanDerWaalsContact SD-CD2 3.51Å; L858-L862 HydrophobicContact CD2-CD1 3.53Å; L858-L862 HydrophobicContact CD2-CG 4.11Å; L858-L862 HydrophobicContact CG-CD1 4.43Å; L858-L862 WeakPolarHBondContact O-CG 3.2Å; L858-L862 PolarHBondContact O-N 3.33Å; H859-L862 PolarHBondContact O-N 3.13Å; L862-P864 VanDerWaalsContact C-CD 3.4Å; L862-P864 VanDerWaalsContact C-N 3.35Å; L862-P864 VanDerWaalsContact O-N 3.13Å; L862-F865 PolarHBondContact O-N 2.82Å; L862-L866 HydrophobicContact CB-CB 4.44Å; L862-L866 HydrophobicContact CB-CD2 4.44Å; L862-L866 HydrophobicContact CD1-CD2 4.13Å; L862-L866 PolarHBondContact O-N 2.84Å
863	R	82.1	Confident	80.2	Confident	212 Å²	212	66.4 Å²	66.4	80%	0.8	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	-34.2	-171.9	-168.8	169.8	-175.6	159.3	1.3	116.6	H859	H859-R863 VanDerWaalsContact O-CB 3.31Å; H859-R863 WeakPolarHBondContact O-CB 3.47Å; H859-R863 PolarHBondContact O-N 3.5Å
864	P	83.7	Confident	80.2	Confident	61 Å²	61	62.9 Å²	62.9	40%	0.396	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-15.2	174.2	28.3	-34.8	0	0	0	115.1	V861 L862	V861-P864 WeakPolarHBondContact O-CD 3.08Å; L862-P864 VanDerWaalsContact C-CD 3.4Å; L862-P864 VanDerWaalsContact C-N 3.35Å; L862-P864 VanDerWaalsContact O-N 3.13Å
865	F	85.8	Confident	80.2	Confident	30 Å²	30	62.2 Å²	62.2	13%	0.132	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.8	-22.1	-174.7	-52.2	-63.2	0	0	0	114.1	L666 G668 I669 M818 M822 V861 L862	L666-F865 HydrophobicContact CD1-CE1 4.08Å; L666-F865 HydrophobicContact CD2-CE1 4.29Å; G668-F865 CarbonylContact C-O 3.36Å; G668-F865 WeakPolarHBondContact CA-O 3.36Å; I669-F865 PolarHBondContact N-O 3.39Å; M818-F865 HydrophobicContact CE-CD2 4.33Å; M822-F865 HydrophobicContact CE-CD1 3.89Å; M822-F865 HydrophobicContact CE-CD2 4.1Å; M822-F865 HydrophobicContact CE-CE1 3.45Å; M822-F865 VanDerWaalsContact CE-CE1 3.45Å; M822-F865 HydrophobicContact CE-CE2 3.69Å; M822-F865 HydrophobicContact CE-CG 4.21Å; M822-F865 HydrophobicContact CE-CZ 3.36Å; M822-F865 HydrophobicContact SD-CD1 4.35Å; M822-F865 HydrophobicContact SD-CE1 3.75Å; M822-F865 HydrophobicContact SD-CZ 4.11Å; V861-F865 WeakPolarHBondContact O-CD2 3.13Å; L862-F865 PolarHBondContact O-N 2.82Å
866	L	87.7	Confident	80.3	Confident	27 Å²	27	73 Å²	73	14%	0.141	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	124	-174.8	-179.5	66.6	0	0	0	111.2	I669 A671 L862 I1523	I669-L866 HydrophobicContact CB-CD1 3.77Å; I669-L866 HydrophobicContact CD1-CD1 4.3Å; I669-L866 HydrophobicContact CG2-CD1 3.81Å; A671-L866 HydrophobicContact CB-CD1 3.49Å; A671-L866 VanDerWaalsContact CB-CD1 3.49Å; L862-L866 HydrophobicContact CB-CB 4.44Å; L862-L866 HydrophobicContact CB-CD2 4.44Å; L862-L866 HydrophobicContact CD1-CD2 4.13Å; L862-L866 PolarHBondContact O-N 2.84Å; L866-I1523 HydrophobicContact CD2-CG2 4.41Å
867	L	88.4	Confident	80.4	Confident	31 Å²	31	76 Å²	76	16%	0.162	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	106.5	165.8	179.5	60.8	0	0	0	109.2	W657 I669 L670 A671 R869	W657-L867 HydrophobicContact CB-CD2 4.12Å; W657-L867 HydrophobicContact CD2-CB 4.01Å; W657-L867 HydrophobicContact CD2-CD2 3.81Å; W657-L867 HydrophobicContact CD2-CG 4.49Å; W657-L867 HydrophobicContact CE3-CB 4.02Å; W657-L867 HydrophobicContact CE3-CD2 3.78Å; W657-L867 HydrophobicContact CG-CD2 3.96Å; W657-L867 HydrophobicContact CH2-CB 3.95Å; W657-L867 HydrophobicContact CZ2-CB 3.93Å; W657-L867 HydrophobicContact CZ3-CB 4Å; W657-L867 HydrophobicContact CZ3-CD2 4.47Å; I669-L867 PolarHBondContact O-N 2.82Å; L670-L867 HydrophobicContact CD1-CB 4.34Å; L670-L867 HydrophobicContact CD1-CD2 3.85Å; L670-L867 HydrophobicContact CD1-CG 4.22Å; A671-L867 CarbonylContact C-O 3.44Å; A671-L867 WeakPolarHBondContact CA-O 3.07Å; A671-L867 PolarHBondContact N-O 2.99Å; L867-R869 HydrophobicContact CD1-CG 4.36Å
868	R	85.4	Confident	80.4	Confident	64 Å²	64	70.2 Å²	70.2	24%	0.242	33%	0.334	C	S	.	.			trans	-108.5	142.8	166.8	171.7	169.5	167.8	165.7	-4.9	109.4	A671 D1520 I1523 E1524	A671-R868 HydrophobicContact CB-CB 4.24Å; A671-R868 WeakPolarHBondContact O-CA 3.46Å; A671-R868 WeakPolarHBondContact O-CB 3.37Å; A671-R868 WeakPolarHBondContact O-CG 3.07Å; R868-D1520 IonicContact NH2-OD1 2.71Å; R868-I1523 VanDerWaalsContact CD-CG2 3.48Å; R868-E1524 IonicContact CZ-OE1 3.46Å; R868-E1524 IonicContact NE-OE1 3.8Å; R868-E1524 IonicContact NH2-OE1 2.81Å; R868-E1524 PolarHBondContact NH2-OE1 3.43Å
869	R	85.7	Confident	80.8	Confident	26 Å²	26	70.9 Å²	70.9	10%	0.098	34%	0.339	C	S	.	.			trans	-146.3	139.2	173.7	-68	172.8	-70.3	-166.8	3.8	108.4	Y650 D672 E673 L676 L867 V874	Y650-R869 PolarHBondContact O-NH1 2.73Å; D672-R869 IonicContact OD1-CZ 3.97Å; D672-R869 VanDerWaalsContact OD1-CZ 3.23Å; D672-R869 IonicContact OD1-NE 2.8Å; D672-R869 PolarHBondContact OD1-NE 3.16Å; D672-R869 IonicContact OD1-NH2 3.79Å; D672-R869 PolarHBondContact OD1-NH2 2.91Å; D672-R869 IonicContact OD2-CZ 3.23Å; D672-R869 IonicContact OD2-NH2 2.86Å; D672-R869 PolarHBondContact OD2-NH2 3.26Å; E673-R869 PolarHBondContact N-O 3.48Å; E673-R869 VanDerWaalsContact N-O 3.12Å; L676-R869 HydrophobicContact CD1-CB 4.41Å; L867-R869 HydrophobicContact CD1-CG 4.36Å; R869-V874 HydrophobicContact CB-CG2 3.94Å
870	L	84.1	Confident	81.4	Confident	37 Å²	37	77 Å²	77	19%	0.194	36%	0.361	C	S	.	.			trans	-94.2	157.6	179	-51.3	175.5	0	0	0	110.6	A872 D873 V874 E1524	L870-A872 PolarHBondContact O-N 2.98Å; L870-D873 VanDerWaalsContact CB-OD2 3.3Å; L870-D873 WeakPolarHBondContact CB-OD2 3.35Å; L870-D873 PolarHBondContact N-OD2 2.87Å; L870-D873 PolarHBondContact O-N 3.02Å; L870-V874 WeakPolarHBondContact O-CB 3.37Å; L870-V874 WeakPolarHBondContact O-CG2 3.44Å; L870-V874 PolarHBondContact O-N 3.08Å; L870-E1524 VanDerWaalsContact CD1-OE1 3.29Å; L870-E1524 WeakPolarHBondContact CD1-OE1 3Å; L870-E1524 WeakPolarHBondContact CD2-OE1 2.88Å
871	K	80.9	Confident	81.8	Confident	11 Å²	11	72.5 Å²	72.5	5%	0.048	34%	0.341	C	S	.	.	H	α-helix	trans	-56.6	-37.3	169.4	-74.1	170.5	-162.3	144.6	0	111.4	E673 M674 L676 V874 E875 L878 D1482	E673-K871 HydrophobicContact CB-CG 4.29Å; E673-K871 HydrophobicContact CG-CD 4.35Å; E673-K871 HydrophobicContact CG-CG 4.25Å; E673-K871 WeakPolarHBondContact OE1-CD 3.24Å; E673-K871 WeakPolarHBondContact OE1-CE 3.45Å; E673-K871 IonicContact OE1-NZ 2.68Å; E673-K871 PolarHBondContact OE1-NZ 3.32Å; E673-K871 WeakPolarHBondContact OE2-CB 3.16Å; E673-K871 WeakPolarHBondContact OE2-CG 3.29Å; E673-K871 PolarHBondContact OE2-N 3.45Å; M674-K871 WeakPolarHBondContact O-CE 3.24Å; L676-K871 HydrophobicContact CD2-CG 4.46Å; K871-V874 PolarHBondContact O-N 2.65Å; K871-E875 WeakPolarHBondContact O-CA 3.39Å; K871-E875 PolarHBondContact O-N 3.07Å; K871-L878 HydrophobicContact CB-CD1 3.88Å; K871-L878 HydrophobicContact CD-CD1 3.87Å; K871-L878 HydrophobicContact CG-CD1 3.85Å; K871-D1482 IonicContact NZ-OD1 2.66Å; K871-D1482 PolarHBondContact NZ-OD1 2.88Å; K871-D1482 IonicContact NZ-OD2 2.87Å; K871-D1482 PolarHBondContact NZ-OD2 2.76Å
872	A	76.6	Confident	82.3	Confident	80 Å²	80	73.4 Å²	73.4	66%	0.661	34%	0.338	S	S	*	.	H	α-helix	trans	-63.3	-41	-178.6	0	0	0	0	0	113.3	L870 V874	L870-A872 PolarHBondContact O-N 2.98Å; A872-V874 VanDerWaalsContact C-N 3.34Å
873	D	76.8	Confident	82.7	Confident	106 Å²	106	75.9 Å²	75.9	57%	0.567	35%	0.35	S	S	*	.	H	α-helix	trans	-69.1	-37.3	179	-42.6	-43.4	0	0	0	111.5	L870	L870-D873 VanDerWaalsContact CB-OD2 3.3Å; L870-D873 WeakPolarHBondContact CB-OD2 3.35Å; L870-D873 PolarHBondContact N-OD2 2.87Å; L870-D873 PolarHBondContact O-N 3.02Å
874	V	72.8	Confident	83.2	Confident	35 Å²	35	69.9 Å²	69.9	21%	0.212	33%	0.33	C	S	.	.	H	α-helix	trans	-97	-39.1	-162.9	173.2	0	0	0	0	113.2	Y650 L676 R869 L870 K871 A872	Y650-V874 HydrophobicContact CD1-CG1 3.13Å; Y650-V874 HydrophobicContact CD2-CG1 3.72Å; Y650-V874 HydrophobicContact CE1-CG1 3.37Å; Y650-V874 HydrophobicContact CE2-CG1 3.96Å; Y650-V874 HydrophobicContact CG-CG1 3.29Å; L676-V874 HydrophobicContact CD1-CG2 4.48Å; L676-V874 HydrophobicContact CD2-CB 4.27Å; L676-V874 HydrophobicContact CD2-CG1 3.94Å; R869-V874 HydrophobicContact CB-CG2 3.94Å; L870-V874 WeakPolarHBondContact O-CB 3.37Å; L870-V874 WeakPolarHBondContact O-CG2 3.44Å; L870-V874 PolarHBondContact O-N 3.08Å; K871-V874 PolarHBondContact O-N 2.65Å; A872-V874 VanDerWaalsContact C-N 3.34Å
875	E	70.1	Confident	83.6	Confident	20 Å²	20	70.3 Å²	70.3	9%	0.093	33%	0.332	C	S	.	.			trans	-134.4	68.6	-159.2	-165.3	71.4	-143.5	0	0	111.2	R648 K871 Q877 L878	R648-E875 IonicContact CZ-OE1 3.76Å; R648-E875 IonicContact CZ-OE2 2.71Å; R648-E875 IonicContact NH1-OE1 3.64Å; R648-E875 PolarHBondContact NH1-OE1 3.11Å; R648-E875 IonicContact NH1-OE2 2.63Å; R648-E875 PolarHBondContact NH1-OE2 3.07Å; K871-E875 WeakPolarHBondContact O-CA 3.39Å; K871-E875 PolarHBondContact O-N 3.07Å; E875-Q877 PolarHBondContact O-N 3.29Å; E875-L878 HydrophobicContact CB-CD1 3.99Å; E875-L878 HydrophobicContact CB-CG 4.33Å; E875-L878 HydrophobicContact CG-CD1 3.85Å; E875-L878 HydrophobicContact CG-CG 3.76Å; E875-L878 PolarHBondContact O-N 3.11Å
876	R	74.2	Confident	84	Confident	237 Å²	237	70.9 Å²	70.9	89%	0.894	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-2.7	176.9	-58	-176.7	-174.8	-179.9	1.1	114.9
877	Q	76.2	Confident	84.2	Confident	164 Å²	164	73.2 Å²	73.2	77%	0.766	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-10.2	175.3	-62.1	-173.6	-2.7	0	0	113.3	E875	E875-Q877 PolarHBondContact O-N 3.29Å
878	L	80.8	Confident	84.3	Confident	33 Å²	33	71.8 Å²	71.8	17%	0.173	34%	0.339	C	S	.	.	S	Bend	trans	-74.1	138.8	176.7	-77.4	168.4	0	0	0	111.1	K871 E875 I1487	K871-L878 HydrophobicContact CB-CD1 3.88Å; K871-L878 HydrophobicContact CD-CD1 3.87Å; K871-L878 HydrophobicContact CG-CD1 3.85Å; E875-L878 HydrophobicContact CB-CD1 3.99Å; E875-L878 HydrophobicContact CB-CG 4.33Å; E875-L878 HydrophobicContact CG-CD1 3.85Å; E875-L878 HydrophobicContact CG-CG 3.76Å; E875-L878 PolarHBondContact O-N 3.11Å; L878-I1487 HydrophobicContact CD2-CG1 4.32Å
879	P	85.2	Confident	84.6	Confident	22 Å²	22	73.9 Å²	73.9	14%	0.143	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-66.3	162.3	174.1	28	-32.4	0	0	0	111.1	H1485 Q1489 R1491 D1492	P879-H1485 PolarHBondContact O-NE2 3.02Å; P879-Q1489 HydrophobicContact CG-CB 4.33Å; P879-Q1489 HydrophobicContact CG-CG 3.76Å; P879-R1491 WeakPolarHBondContact CB-O 3.21Å; P879-R1491 WeakPolarHBondContact CG-O 3.04Å; P879-D1492 VanDerWaalsContact CB-OD1 3.27Å; P879-D1492 WeakPolarHBondContact CB-OD1 3.43Å
880	R	88.3	Confident	84.9	Confident	174 Å²	174	73.6 Å²	73.6	66%	0.657	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-73.5	161.6	-177.4	-65.3	177.7	173	-172	0.4	110.8	Y882 D1492 V1493	R880-Y882 HydrophobicContact CB-CE1 4.49Å; R880-Y882 HydrophobicContact CB-CE2 4.02Å; R880-Y882 WeakPolarHBondContact CD-OH 3.11Å; R880-D1492 PolarHBondContact N-OD1 2.79Å; R880-D1492 WeakPolarHBondContact O-CA 3.39Å; R880-V1493 PolarHBondContact O-N 2.83Å
881	K	89.6	Confident	85.1	Confident	78 Å²	78	72.9 Å²	72.9	34%	0.339	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	132.5	170.7	63.6	-176.4	178.5	-174.6	0	109.4	E673 D1482 V1493 I1495	E673-K881 IonicContact OE1-NZ 3.85Å; K881-D1482 IonicContact NZ-OD1 2.67Å; K881-V1493 VanDerWaalsContact CA-O 3.31Å; K881-V1493 WeakPolarHBondContact CA-O 3.45Å; K881-V1493 HydrophobicContact CB-CB 4.37Å; K881-I1495 HydrophobicContact CB-CD1 4.16Å
882	Y	91.7	Very high	85.4	Confident	80 Å²	80	79.1 Å²	79.1	31%	0.314	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	130	-179.5	-56	-77.4	0	0	0	109.3	R880 H884 D1492 V1493 I1495	R880-Y882 HydrophobicContact CB-CE1 4.49Å; R880-Y882 HydrophobicContact CB-CE2 4.02Å; R880-Y882 WeakPolarHBondContact CD-OH 3.11Å; Y882-H884 WeakPolarHBondContact CB-NE2 3.33Å; Y882-H884 AromaticContact CG-NE2 3.82Å; Y882-D1492 HydrophobicContact CE2-CB 4.01Å; Y882-D1492 VanDerWaalsContact CE2-OD2 3.29Å; Y882-D1492 WeakPolarHBondContact CE2-OD2 3.14Å; Y882-D1492 PolarHBondContact OH-OD2 2.88Å; Y882-V1493 PolarHBondContact N-O 3.3Å; Y882-I1495 WeakPolarHBondContact O-CB 3.41Å; Y882-I1495 PolarHBondContact O-N 3.43Å
883	E	91.3	Very high	86	Confident	66 Å²	66	77.1 Å²	77.1	31%	0.308	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	111.2	177.6	-173.4	167.2	-164.3	0	0	109.3	I1495 R1497 R1516	E883-I1495 CarbonylContact C-O 3.6Å; E883-I1495 WeakPolarHBondContact CA-O 3.16Å; E883-I1495 HydrophobicContact CG-CG2 4.45Å; E883-R1497 IonicContact OE1-CZ 3.37Å; E883-R1497 IonicContact OE1-NE 2.63Å; E883-R1497 PolarHBondContact OE1-NE 3.26Å; E883-R1497 IonicContact OE1-NH2 3.32Å; E883-R1497 PolarHBondContact OE1-NH2 2.71Å; E883-R1516 IonicContact OE1-NH1 3.99Å; E883-R1516 IonicContact OE2-CZ 3.52Å; E883-R1516 IonicContact OE2-NH1 2.66Å; E883-R1516 PolarHBondContact OE2-NH1 2.82Å; E883-R1516 IonicContact OE2-NH2 3.59Å
884	H	92.3	Very high	86.8	Confident	86 Å²	86	72.1 Å²	72.1	40%	0.398	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	112.8	-177.1	-61.5	-83.2	0	0	0	109.1	Y882 H1494 I1495 Y1496 R1497	Y882-H884 WeakPolarHBondContact CB-NE2 3.33Å; Y882-H884 AromaticContact CG-NE2 3.82Å; H884-H1494 AromaticContact NE2-CE1 3.31Å; H884-H1494 PolarHBondContact NE2-CE1 3.42Å; H884-H1494 VanDerWaalsContact NE2-CE1 3.31Å; H884-H1494 AromaticContact NE2-CG 3.56Å; H884-H1494 AromaticContact NE2-ND1 2.72Å; H884-H1494 PolarHBondContact NE2-ND1 2.89Å; H884-I1495 PolarHBondContact N-O 2.84Å; H884-Y1496 HydrophobicContact CB-CD1 3.53Å; H884-Y1496 HydrophobicContact CB-CE1 3.78Å; H884-Y1496 HydrophobicContact CB-CG 4.49Å; H884-Y1496 AromaticContact CD2-CE1 3.72Å; H884-Y1496 AromaticContact CG-CE1 3.77Å; H884-Y1496 CarbonylContact O-C 3.52Å; H884-Y1496 WeakPolarHBondContact O-CA 3.21Å; H884-R1497 PolarHBondContact O-N 3.31Å
885	V	92.5	Very high	87.6	Confident	70 Å²	70	74.5 Å²	74.5	42%	0.424	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	115	174.4	-178.8	0	0	0	0	108.6	M887 I1499 L1509	V885-M887 HydrophobicContact CG1-SD 4.03Å; V885-I1499 HydrophobicContact CG1-CD1 3.71Å; V885-I1499 HydrophobicContact CG1-CG1 4.29Å; V885-L1509 HydrophobicContact CG1-CD2 4.41Å
886	I	93.2	Very high	88.6	Confident	42 Å²	42	79.9 Å²	79.9	22%	0.215	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	112.4	175.6	-60	176.9	0	0	0	107.6	L1383 Y1496 R1497 L1498 I1499	I886-L1383 HydrophobicContact CD1-CD2 4.02Å; I886-Y1496 HydrophobicContact CD1-CD1 3.75Å; I886-Y1496 HydrophobicContact CD1-CG 4.37Å; I886-Y1496 HydrophobicContact CG1-CD1 4.38Å; I886-R1497 PolarHBondContact N-O 3.1Å; I886-L1498 HydrophobicContact CB-CD2 3.89Å; I886-L1498 HydrophobicContact CD1-CD2 4.05Å; I886-L1498 HydrophobicContact CG1-CD2 4.47Å; I886-L1498 HydrophobicContact CG2-CD2 4.14Å; I886-I1499 PolarHBondContact O-N 2.87Å
887	M	91.7	Very high	89.4	Confident	76 Å²	76	69.2 Å²	69.2	37%	0.374	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	136.3	170.2	-59	-55.8	-69.9	0	0	109.4	V885 I1499 E1501 E1506	V885-M887 HydrophobicContact CG1-SD 4.03Å; M887-I1499 HydrophobicContact CE-CG2 4.35Å; M887-I1499 HydrophobicContact SD-CB 4.2Å; M887-I1499 HydrophobicContact SD-CG2 4.37Å; M887-E1501 HydrophobicContact CB-CG 3.81Å; M887-E1501 HydrophobicContact CE-CG 3.92Å; M887-E1506 HydrophobicContact CE-CG 4.45Å
888	C	92.1	Very high	90.1	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	123.8	-176.3	-66.8	0	0	0	0	110	K1376 I1499 S1500 E1501	C888-K1376 HydrophobicContact CB-CG 4.18Å; C888-I1499 PolarHBondContact N-O 2.91Å; C888-S1500 CarbonylContact O-C 3.26Å; C888-S1500 VanDerWaalsContact O-CA 3.31Å; C888-S1500 WeakPolarHBondContact O-CA 3.34Å; C888-E1501 PolarHBondContact O-N 3.32Å
889	R	91.2	Very high	90.6	Very high	108 Å²	108	65.4 Å²	65.4	41%	0.408	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-61.4	147.8	167.9	-66.5	171.9	170.4	-160.9	-13	110.9	E1501 E1639	R889-E1501 WeakPolarHBondContact CG-OE2 3.47Å; R889-E1639 IonicContact CZ-OE1 2.71Å; R889-E1639 IonicContact NH1-OE1 3.45Å; R889-E1639 PolarHBondContact NH1-OE1 2.78Å; R889-E1639 IonicContact NH2-OE1 2.77Å; R889-E1639 PolarHBondContact NH2-OE1 2.79Å
890	L	90.7	Very high	90.8	Very high	21 Å²	21	66.6 Å²	66.6	11%	0.11	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-79.5	133.1	168.7	-71.6	-176.7	0	0	0	110.6	Q894 R895 T1503	L890-Q894 HydrophobicContact CB-CB 4.25Å; L890-Q894 HydrophobicContact CD2-CB 4.14Å; L890-R895 HydrophobicContact CB-CB 4.48Å; L890-R895 PolarHBondContact O-NH2 3.19Å; L890-T1503 HydrophobicContact CD1-CG2 3.75Å; L890-T1503 HydrophobicContact CD2-CG2 4.18Å; L890-T1503 HydrophobicContact CG-CG2 4.02Å
891	S	89.8	Confident	90.9	Very high	21 Å²	21	59 Å²	59	15%	0.147	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-60.7	148.7	169.6	173.7	0	0	0	0	110.4	R893 Q894 R895 Y1372	S891-R893 PolarHBondContact O-N 3.41Å; S891-R893 VanDerWaalsContact O-N 3.11Å; S891-Q894 WeakPolarHBondContact O-CA 2.91Å; S891-Q894 WeakPolarHBondContact O-CB 3.4Å; S891-Q894 PolarHBondContact O-N 2.89Å; S891-R895 PolarHBondContact O-N 3.36Å; S891-Y1372 PolarHBondContact OG-O 3.1Å
892	R	87.6	Confident	90.7	Very high	142 Å²	142	58.3 Å²	58.3	54%	0.536	27%	0.265	S	S	.	.	H	α-helix	trans	-51.5	-37.4	-178.6	-179.2	176.1	169	172.6	-4.3	113.2	F896 D1642 A1645	R892-F896 WeakPolarHBondContact O-CB 3.23Å; R892-F896 PolarHBondContact O-N 2.85Å; R892-D1642 WeakPolarHBondContact CD-OD1 3.47Å; R892-A1645 VanDerWaalsContact CZ-CB 3.41Å
893	R	88.8	Confident	90.4	Very high	39 Å²	39	57.6 Å²	57.6	15%	0.147	27%	0.272	C	S	.	.	H	α-helix	trans	-68.5	-37.6	174.8	-173.1	177.8	179.1	-129.9	-15.5	112.6	S891 L897 N934 E937 D1373	S891-R893 PolarHBondContact O-N 3.41Å; S891-R893 VanDerWaalsContact O-N 3.11Å; R893-L897 HydrophobicContact CG-CD1 4.22Å; R893-L897 WeakPolarHBondContact O-CG 3.32Å; R893-L897 PolarHBondContact O-N 3.48Å; R893-N934 PolarHBondContact NH1-OD1 3.04Å; R893-E937 PolarHBondContact NH2-O 2.89Å; R893-E937 IonicContact NH2-OE2 3.9Å; R893-E937 PolarHBondContact NH2-OE2 3.4Å; R893-D1373 WeakPolarHBondContact CD-OD2 3.32Å; R893-D1373 IonicContact CZ-OD2 3.55Å; R893-D1373 IonicContact NE-OD2 3.26Å; R893-D1373 IonicContact NH1-OD2 3.11Å; R893-D1373 PolarHBondContact NH1-OD2 3.36Å
894	Q	92.2	Very high	90.2	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-68.3	-42.9	175.5	-62.4	178.2	-77.7	0	0	111.2	L890 S891 L897 Y898 V929 C930 P933 D1373 G1375	L890-Q894 HydrophobicContact CB-CB 4.25Å; L890-Q894 HydrophobicContact CD2-CB 4.14Å; S891-Q894 WeakPolarHBondContact O-CA 2.91Å; S891-Q894 WeakPolarHBondContact O-CB 3.4Å; S891-Q894 PolarHBondContact O-N 2.89Å; Q894-L897 PolarHBondContact O-N 3.38Å; Q894-Y898 VanDerWaalsContact O-CB 3.24Å; Q894-Y898 WeakPolarHBondContact O-CB 3.34Å; Q894-Y898 PolarHBondContact O-N 2.74Å; Q894-V929 HydrophobicContact CB-CG1 4.33Å; Q894-V929 PolarHBondContact NE2-O 3.36Å; Q894-V929 WeakPolarHBondContact O-CG1 3.45Å; Q894-C930 PolarHBondContact NE2-O 3.04Å; Q894-C930 VanDerWaalsContact NE2-O 3.07Å; Q894-P933 HydrophobicContact CG-CB 4.47Å; Q894-P933 HydrophobicContact CG-CG 4.21Å; Q894-D1373 WeakPolarHBondContact CG-O 3.34Å; Q894-G1375 VanDerWaalsContact OE1-N 3.08Å
895	R	91.3	Very high	89.5	Confident	85 Å²	85	52.2 Å²	52.2	32%	0.321	25%	0.252	S	S	.	.	H	α-helix	trans	-60.7	-51.1	178.9	-162.4	-177.7	-51.4	139.6	11.5	110.9	L890 S891 L897 Y898 D899 D1642	L890-R895 HydrophobicContact CB-CB 4.48Å; L890-R895 PolarHBondContact O-NH2 3.19Å; S891-R895 PolarHBondContact O-N 3.36Å; R895-L897 PolarHBondContact O-N 3.08Å; R895-Y898 WeakPolarHBondContact O-CB 3.48Å; R895-Y898 PolarHBondContact O-N 3.05Å; R895-Y898 VanDerWaalsContact O-N 3.1Å; R895-D899 WeakPolarHBondContact CG-OD2 3.44Å; R895-D899 WeakPolarHBondContact O-CB 3.38Å; R895-D899 VanDerWaalsContact O-CG 3.27Å; R895-D899 PolarHBondContact O-N 2.68Å; R895-D1642 IonicContact CZ-OD2 3.65Å; R895-D1642 IonicContact NH1-OD2 2.7Å; R895-D1642 PolarHBondContact NH1-OD2 3.4Å; R895-D1642 IonicContact NH2-OD2 3.58Å; R895-D1642 PolarHBondContact NH2-OD2 2.74Å; R895-D1642 VanDerWaalsContact NH2-OD2 3.1Å
896	F	90.4	Very high	89	Confident	134 Å²	134	49.8 Å²	49.8	59%	0.588	24%	0.238	S	C	*	.	H	α-helix	trans	-53.1	-51.3	174.3	179.9	-96.6	0	0	0	112.5	R892 Y898 D899 D900	R892-F896 WeakPolarHBondContact O-CB 3.23Å; R892-F896 PolarHBondContact O-N 2.85Å; F896-Y898 VanDerWaalsContact C-N 3.29Å; F896-Y898 PolarHBondContact O-N 2.79Å; F896-D899 PolarHBondContact O-N 3.07Å; F896-D900 WeakPolarHBondContact O-CB 3.4Å; F896-D900 PolarHBondContact O-N 2.87Å
897	L	90.7	Very high	88.4	Confident	13 Å²	13	48.2 Å²	48.2	7%	0.068	23%	0.23	C	C	.	.	H	α-helix	trans	-68.3	-24.1	179.5	-70.7	171.9	0	0	0	114.1	R893 Q894 R895 F901 V929 P933 F936	R893-L897 HydrophobicContact CG-CD1 4.22Å; R893-L897 WeakPolarHBondContact O-CG 3.32Å; R893-L897 PolarHBondContact O-N 3.48Å; Q894-L897 PolarHBondContact O-N 3.38Å; R895-L897 PolarHBondContact O-N 3.08Å; L897-F901 VanDerWaalsContact O-CB 3.27Å; L897-F901 WeakPolarHBondContact O-CB 3.13Å; L897-F901 PolarHBondContact O-N 3.14Å; L897-V929 HydrophobicContact CB-CG1 4.15Å; L897-P933 HydrophobicContact CD1-CB 3.85Å; L897-F936 HydrophobicContact CD2-CD1 4.45Å; L897-F936 HydrophobicContact CD2-CE1 4.39Å
898	Y	91.7	Very high	87.9	Confident	28 Å²	28	48.5 Å²	48.5	11%	0.11	23%	0.231	C	C	.	.	H	α-helix	trans	-77.4	-46	176.1	-170	-80.2	0	0	0	110.5	Q894 R895 F896 M902 L926 T1503 V1504	Q894-Y898 VanDerWaalsContact O-CB 3.24Å; Q894-Y898 WeakPolarHBondContact O-CB 3.34Å; Q894-Y898 PolarHBondContact O-N 2.74Å; R895-Y898 WeakPolarHBondContact O-CB 3.48Å; R895-Y898 PolarHBondContact O-N 3.05Å; R895-Y898 VanDerWaalsContact O-N 3.1Å; F896-Y898 VanDerWaalsContact C-N 3.29Å; F896-Y898 PolarHBondContact O-N 2.79Å; Y898-M902 HydrophobicContact CD1-CG 4.32Å; Y898-M902 HydrophobicContact CE1-CG 4.27Å; Y898-M902 VanDerWaalsContact O-CG 3.27Å; Y898-M902 WeakPolarHBondContact O-CG 3.12Å; Y898-M902 PolarHBondContact O-N 2.87Å; Y898-M902 VanDerWaalsContact O-N 3.08Å; Y898-L926 HydrophobicContact CD1-CD2 4.43Å; Y898-L926 HydrophobicContact CD2-CD2 3.79Å; Y898-L926 HydrophobicContact CE1-CD2 4.32Å; Y898-L926 HydrophobicContact CE2-CB 3.99Å; Y898-L926 HydrophobicContact CE2-CD2 3.68Å; Y898-L926 HydrophobicContact CE2-CG 4.31Å; Y898-L926 HydrophobicContact CG-CD2 4.18Å; Y898-T1503 HydrophobicContact CE2-CG2 4.3Å; Y898-V1504 PolarHBondContact OH-N 2.89Å
899	D	90.6	Very high	87.4	Confident	88 Å²	88	52.5 Å²	52.5	47%	0.471	25%	0.25	S	C	.	.	H	α-helix	trans	-72.8	-42.2	-178.2	-61.7	-21.9	0	0	0	111.2	R895 F896 F901 M902 S903	R895-D899 WeakPolarHBondContact CG-OD2 3.44Å; R895-D899 WeakPolarHBondContact O-CB 3.38Å; R895-D899 VanDerWaalsContact O-CG 3.27Å; R895-D899 PolarHBondContact O-N 2.68Å; F896-D899 PolarHBondContact O-N 3.07Å; D899-F901 PolarHBondContact O-N 3.19Å; D899-M902 CarbonylContact O-C 3.53Å; D899-M902 PolarHBondContact O-N 2.81Å; D899-M902 VanDerWaalsContact O-N 3.16Å; D899-S903 WeakPolarHBondContact O-CB 3.36Å; D899-S903 PolarHBondContact O-N 2.88Å
900	D	89.7	Confident	86.9	Confident	48 Å²	48	49.4 Å²	49.4	26%	0.257	24%	0.243	S	C	.	.	H	α-helix	trans	-53.7	-52.8	171.1	178.6	77.5	0	0	0	110.7	F896 M902 S903 L904	F896-D900 WeakPolarHBondContact O-CB 3.4Å; F896-D900 PolarHBondContact O-N 2.87Å; D900-M902 VanDerWaalsContact C-N 3.28Å; D900-M902 PolarHBondContact O-N 2.63Å; D900-S903 WeakPolarHBondContact O-CB 3.49Å; D900-S903 PolarHBondContact O-N 2.71Å; D900-S903 PolarHBondContact O-OG 3.46Å; D900-L904 PolarHBondContact O-N 3.02Å; D900-L904 VanDerWaalsContact O-N 3.14Å
901	F	89.5	Confident	86.3	Confident	13 Å²	13	51.6 Å²	51.6	6%	0.057	25%	0.254	C	S	.	.	H	α-helix	trans	-63.7	-28.2	178.3	-176	-103.5	0	0	0	114	L897 D899 L904 T907 I922 Q925 L926 F936	L897-F901 VanDerWaalsContact O-CB 3.27Å; L897-F901 WeakPolarHBondContact O-CB 3.13Å; L897-F901 PolarHBondContact O-N 3.14Å; D899-F901 PolarHBondContact O-N 3.19Å; F901-L904 HydrophobicContact CD2-CD1 3.92Å; F901-T907 HydrophobicContact CD1-CG2 4.34Å; F901-T907 HydrophobicContact CD2-CG2 4.17Å; F901-T907 HydrophobicContact CE1-CG2 4.02Å; F901-T907 HydrophobicContact CE2-CG2 3.82Å; F901-T907 HydrophobicContact CG-CG2 4.42Å; F901-T907 HydrophobicContact CZ-CG2 3.74Å; F901-T907 WeakPolarHBondContact O-CB 3.22Å; F901-T907 WeakPolarHBondContact O-CG2 3.2Å; F901-T907 PolarHBondContact O-OG1 2.73Å; F901-I922 HydrophobicContact CE1-CG2 3.95Å; F901-Q925 HydrophobicContact CE1-CB 3.9Å; F901-Q925 HydrophobicContact CE2-CB 4.44Å; F901-Q925 HydrophobicContact CZ-CB 3.71Å; F901-Q925 HydrophobicContact CZ-CG 4.28Å; F901-L926 HydrophobicContact CD1-CD2 3.69Å; F901-L926 HydrophobicContact CD1-CG 4.26Å; F901-L926 HydrophobicContact CE1-CD2 4.17Å; F901-L926 HydrophobicContact CE1-CG 4.24Å; F901-F936 HydrophobicContact CD2-CE2 4.09Å; F901-F936 AromaticContact CD2-CZ 3.91Å; F901-F936 HydrophobicContact CD2-CZ 3.91Å; F901-F936 HydrophobicContact CE2-CE2 4.28Å; F901-F936 HydrophobicContact CE2-CZ 4.48Å; F901-F936 HydrophobicContact CG-CZ 4.48Å
902	M	85.6	Confident	85.9	Confident	65 Å²	65	58.5 Å²	58.5	32%	0.32	28%	0.281	S	S	.	.	H	α-helix	trans	-82.3	-21.3	172.5	-71.1	-65.6	-60.2	0	0	113.3	Y898 D899 D900 Q908 L911 L926	Y898-M902 HydrophobicContact CD1-CG 4.32Å; Y898-M902 HydrophobicContact CE1-CG 4.27Å; Y898-M902 VanDerWaalsContact O-CG 3.27Å; Y898-M902 WeakPolarHBondContact O-CG 3.12Å; Y898-M902 PolarHBondContact O-N 2.87Å; Y898-M902 VanDerWaalsContact O-N 3.08Å; D899-M902 CarbonylContact O-C 3.53Å; D899-M902 PolarHBondContact O-N 2.81Å; D899-M902 VanDerWaalsContact O-N 3.16Å; D900-M902 VanDerWaalsContact C-N 3.28Å; D900-M902 PolarHBondContact O-N 2.63Å; M902-Q908 PolarHBondContact O-NE2 3.28Å; M902-L911 HydrophobicContact CE-CD1 4.19Å; M902-L926 HydrophobicContact CG-CD2 4.16Å; M902-L926 HydrophobicContact SD-CD1 3.92Å; M902-L926 HydrophobicContact SD-CD2 4.09Å
903	S	85.5	Confident	85.4	Confident	64 Å²	64	55.1 Å²	55.1	45%	0.448	28%	0.279	S	S	.	.	H	α-helix	trans	-77.8	-28	175.1	81.1	0	0	0	0	112.7	D899 D900 G905	D899-S903 WeakPolarHBondContact O-CB 3.36Å; D899-S903 PolarHBondContact O-N 2.88Å; D900-S903 WeakPolarHBondContact O-CB 3.49Å; D900-S903 PolarHBondContact O-N 2.71Å; D900-S903 PolarHBondContact O-OG 3.46Å; S903-G905 PolarHBondContact O-N 3.27Å; S903-G905 VanDerWaalsContact O-N 3.08Å
904	L	86.3	Confident	84.8	Confident	23 Å²	23	55.9 Å²	55.9	12%	0.12	30%	0.299	C	S	.	.	S	Bend	trans	-51.6	115.9	175.8	-67.1	176.8	0	0	0	110.8	D900 F901 S906 T907 Q908 S1999	D900-L904 PolarHBondContact O-N 3.02Å; D900-L904 VanDerWaalsContact O-N 3.14Å; F901-L904 HydrophobicContact CD2-CD1 3.92Å; L904-S906 PolarHBondContact O-N 2.89Å; L904-T907 HydrophobicContact CB-CG2 4.19Å; L904-T907 HydrophobicContact CD1-CG2 4.42Å; L904-T907 PolarHBondContact O-N 2.81Å; L904-T907 PolarHBondContact O-OG1 3.44Å; L904-Q908 PolarHBondContact O-N 3.03Å; L904-S1999 VanDerWaalsContact CD2-N 3.33Å; L904-S1999 VanDerWaalsContact CD2-O 3.23Å; L904-S1999 WeakPolarHBondContact CD2-O 3.3Å
905	G	79.3	Confident	84.2	Confident	16 Å²	16	61.5 Å²	61.5	17%	0.165	33%	0.326	C	S	.	.	H	α-helix	trans	-56.9	-21.1	-179.2	0	0	0	0	0	113.7	S903 Q908 E909	S903-G905 PolarHBondContact O-N 3.27Å; S903-G905 VanDerWaalsContact O-N 3.08Å; G905-Q908 PolarHBondContact O-N 2.9Å; G905-E909 WeakPolarHBondContact O-CB 3.32Å; G905-E909 WeakPolarHBondContact O-CG 3.4Å; G905-E909 PolarHBondContact O-N 3.2Å
906	S	81.6	Confident	83.5	Confident	20 Å²	20	64.4 Å²	64.4	14%	0.14	34%	0.341	C	S	.	.	H	α-helix	trans	-76.4	-33.9	177.3	52.5	0	0	0	0	113.2	L904 Q908 T910 N1996 Y1997	L904-S906 PolarHBondContact O-N 2.89Å; S906-Q908 VanDerWaalsContact C-N 3.35Å; S906-T910 WeakPolarHBondContact O-CB 3.42Å; S906-T910 WeakPolarHBondContact O-CG2 3.42Å; S906-T910 PolarHBondContact O-N 2.87Å; S906-T910 PolarHBondContact O-OG1 2.84Å; S906-N1996 VanDerWaalsContact CB-C 3.47Å; S906-N1996 WeakPolarHBondContact CB-O 3.04Å; S906-N1996 PolarHBondContact OG-O 2.89Å; S906-Y1997 VanDerWaalsContact N-CD2 3.3Å; S906-Y1997 PolarHBondContact OG-O 3.03Å
907	T	79.8	Confident	83	Confident	8 Å²	8	63.6 Å²	63.6	5%	0.049	34%	0.342	C	S	.	.	H	α-helix	trans	-71.1	-36.6	170.4	64.4	0	0	0	0	109.7	F901 L904 T910 L911	F901-T907 HydrophobicContact CD1-CG2 4.34Å; F901-T907 HydrophobicContact CD2-CG2 4.17Å; F901-T907 HydrophobicContact CE1-CG2 4.02Å; F901-T907 HydrophobicContact CE2-CG2 3.82Å; F901-T907 HydrophobicContact CG-CG2 4.42Å; F901-T907 HydrophobicContact CZ-CG2 3.74Å; F901-T907 WeakPolarHBondContact O-CB 3.22Å; F901-T907 WeakPolarHBondContact O-CG2 3.2Å; F901-T907 PolarHBondContact O-OG1 2.73Å; L904-T907 HydrophobicContact CB-CG2 4.19Å; L904-T907 HydrophobicContact CD1-CG2 4.42Å; L904-T907 PolarHBondContact O-N 2.81Å; L904-T907 PolarHBondContact O-OG1 3.44Å; T907-T910 WeakPolarHBondContact CA-OG1 3.26Å; T907-T910 PolarHBondContact O-N 2.71Å; T907-T910 PolarHBondContact O-OG1 2.68Å; T907-L911 WeakPolarHBondContact O-CB 3.26Å; T907-L911 WeakPolarHBondContact O-CD1 3.36Å; T907-L911 WeakPolarHBondContact O-CG 3.43Å; T907-L911 PolarHBondContact O-N 2.79Å
908	Q	81.5	Confident	82.5	Confident	82 Å²	82	64.6 Å²	64.6	38%	0.383	35%	0.35	S	S	.	.	H	α-helix	trans	-66.5	-43.7	172.8	-59.8	-167.5	13.5	0	0	113.3	M902 L904 G905 S906 L911 K912	M902-Q908 PolarHBondContact O-NE2 3.28Å; L904-Q908 PolarHBondContact O-N 3.03Å; G905-Q908 PolarHBondContact O-N 2.9Å; S906-Q908 VanDerWaalsContact C-N 3.35Å; Q908-L911 PolarHBondContact O-N 3.05Å; Q908-K912 WeakPolarHBondContact O-CB 3.45Å; Q908-K912 WeakPolarHBondContact O-CD 3.43Å; Q908-K912 WeakPolarHBondContact O-CG 3.44Å; Q908-K912 PolarHBondContact O-N 3.32Å
909	E	81.7	Confident	82	Confident	85 Å²	85	64.9 Å²	64.9	40%	0.397	36%	0.355	S	S	.	.	H	α-helix	trans	-62.2	-43	174.7	-79.3	168.6	175.1	0	0	111.7	G905 K912 S913 N1996	G905-E909 WeakPolarHBondContact O-CB 3.32Å; G905-E909 WeakPolarHBondContact O-CG 3.4Å; G905-E909 PolarHBondContact O-N 3.2Å; E909-K912 CarbonylContact O-C 3.55Å; E909-K912 PolarHBondContact O-N 3.17Å; E909-S913 WeakPolarHBondContact O-CB 3.31Å; E909-S913 PolarHBondContact O-N 3Å; E909-N1996 VanDerWaalsContact CD-ND2 3.28Å; E909-N1996 PolarHBondContact OE1-ND2 3.42Å; E909-N1996 VanDerWaalsContact OE2-CB 3.29Å; E909-N1996 WeakPolarHBondContact OE2-CB 3.19Å; E909-N1996 PolarHBondContact OE2-ND2 2.79Å
910	T	80.5	Confident	81.6	Confident	43 Å²	43	63.4 Å²	63.4	26%	0.264	35%	0.346	S	S	.	.	H	α-helix	trans	-72.8	-30.5	178.3	48.2	0	0	0	0	113	S906 T907 S913 S918 I922	S906-T910 WeakPolarHBondContact O-CB 3.42Å; S906-T910 WeakPolarHBondContact O-CG2 3.42Å; S906-T910 PolarHBondContact O-N 2.87Å; S906-T910 PolarHBondContact O-OG1 2.84Å; T907-T910 WeakPolarHBondContact CA-OG1 3.26Å; T907-T910 PolarHBondContact O-N 2.71Å; T907-T910 PolarHBondContact O-OG1 2.68Å; T910-S913 PolarHBondContact O-N 2.66Å; T910-S913 PolarHBondContact O-OG 3.3Å; T910-S918 WeakPolarHBondContact CB-OG 3.18Å; T910-S918 WeakPolarHBondContact CG2-OG 3.42Å; T910-I922 VanDerWaalsContact OG1-CD1 3.23Å; T910-I922 WeakPolarHBondContact OG1-CD1 3.49Å
911	L	77.9	Confident	81.4	Confident	66 Å²	66	64.8 Å²	64.8	35%	0.346	35%	0.353	S	S	.	.	H	α-helix	trans	-65.1	-47.2	166.5	-73	167.5	0	0	0	111.4	M902 T907 Q908 S913 G914 V919 I922	M902-L911 HydrophobicContact CE-CD1 4.19Å; T907-L911 WeakPolarHBondContact O-CB 3.26Å; T907-L911 WeakPolarHBondContact O-CD1 3.36Å; T907-L911 WeakPolarHBondContact O-CG 3.43Å; T907-L911 PolarHBondContact O-N 2.79Å; Q908-L911 PolarHBondContact O-N 3.05Å; L911-S913 PolarHBondContact O-N 3.08Å; L911-G914 PolarHBondContact O-N 3.11Å; L911-G914 VanDerWaalsContact O-N 3.13Å; L911-V919 HydrophobicContact CD2-CG1 4.27Å; L911-V919 HydrophobicContact CD2-CG2 4.43Å; L911-I922 HydrophobicContact CD2-CD1 4.07Å; L911-I922 HydrophobicContact CG-CD1 3.89Å
912	K	81.5	Confident	81.3	Confident	166 Å²	166	64.5 Å²	64.5	72%	0.722	35%	0.352	S	S	*	.	H	α-helix	trans	-60.8	-28.6	175.4	-73.6	165.4	-176.5	169.7	0	112.9	Q908 E909 G914	Q908-K912 WeakPolarHBondContact O-CB 3.45Å; Q908-K912 WeakPolarHBondContact O-CD 3.43Å; Q908-K912 WeakPolarHBondContact O-CG 3.44Å; Q908-K912 PolarHBondContact O-N 3.32Å; E909-K912 CarbonylContact O-C 3.55Å; E909-K912 PolarHBondContact O-N 3.17Å; K912-G914 PolarHBondContact O-N 3.27Å
913	S	78.3	Confident	81.4	Confident	71 Å²	71	63.2 Å²	63.2	50%	0.497	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-17.4	176.7	81.5	0	0	0	0	114.3	E909 T910 L911 Q915	E909-S913 WeakPolarHBondContact O-CB 3.31Å; E909-S913 PolarHBondContact O-N 3Å; T910-S913 PolarHBondContact O-N 2.66Å; T910-S913 PolarHBondContact O-OG 3.3Å; L911-S913 PolarHBondContact O-N 3.08Å; S913-Q915 PolarHBondContact O-N 2.96Å; S913-Q915 PolarHBondContact OG-N 3.19Å
914	G	75.7	Confident	81.5	Confident	55 Å²	55	63.6 Å²	63.6	57%	0.567	34%	0.342	S	S	*	.			trans	66.6	-5.8	-176.8	0	0	0	0	0	115.9	L911 K912 F916	L911-G914 PolarHBondContact O-N 3.11Å; L911-G914 VanDerWaalsContact O-N 3.13Å; K912-G914 PolarHBondContact O-N 3.27Å; G914-F916 PolarHBondContact O-N 2.77Å; G914-F916 VanDerWaalsContact O-N 3.07Å
915	Q	79	Confident	81.7	Confident	119 Å²	119	65 Å²	65	56%	0.556	35%	0.348	S	S	*	.			trans	-67.4	110.5	-169.1	-178.6	62.2	-20.9	0	0	111.9	S913 L917 S918 V919	S913-Q915 PolarHBondContact O-N 2.96Å; S913-Q915 PolarHBondContact OG-N 3.19Å; Q915-L917 VanDerWaalsContact C-N 3.3Å; Q915-L917 PolarHBondContact O-N 2.81Å; Q915-L917 VanDerWaalsContact O-N 3.11Å; Q915-S918 WeakPolarHBondContact O-CA 3.43Å; Q915-S918 WeakPolarHBondContact O-CB 3.28Å; Q915-S918 PolarHBondContact O-N 3.31Å; Q915-V919 PolarHBondContact O-N 2.87Å; Q915-V919 VanDerWaalsContact O-N 3.07Å
916	F	76.5	Confident	82.2	Confident	146 Å²	146	64.5 Å²	64.5	64%	0.64	34%	0.341	S	S	*	.	H	α-helix	trans	-52.4	-41.3	-166.3	-179.9	-96.8	0	0	0	114.4	G914 S918 V919 M920	G914-F916 PolarHBondContact O-N 2.77Å; G914-F916 VanDerWaalsContact O-N 3.07Å; F916-S918 VanDerWaalsContact C-N 3.34Å; F916-S918 PolarHBondContact O-N 2.98Å; F916-V919 PolarHBondContact O-N 2.9Å; F916-M920 HydrophobicContact CE1-CE 4.17Å; F916-M920 HydrophobicContact CE2-CE 4.28Å; F916-M920 HydrophobicContact CZ-CE 3.67Å; F916-M920 VanDerWaalsContact O-CB 3.29Å; F916-M920 WeakPolarHBondContact O-CB 3.43Å; F916-M920 PolarHBondContact O-N 2.82Å
917	L	79.8	Confident	82.7	Confident	116 Å²	116	64 Å²	64	61%	0.607	34%	0.337	S	S	*	.	H	α-helix	trans	-65.2	-36.5	178	-65.5	177	0	0	0	112.6	Q915 N921	Q915-L917 VanDerWaalsContact C-N 3.3Å; Q915-L917 PolarHBondContact O-N 2.81Å; Q915-L917 VanDerWaalsContact O-N 3.11Å; L917-N921 PolarHBondContact O-N 3.27Å; L917-N921 VanDerWaalsContact O-N 3.11Å; L917-N921 PolarHBondContact O-ND2 2.89Å
918	S	80.4	Confident	83.3	Confident	35 Å²	35	66.9 Å²	66.9	25%	0.245	35%	0.348	C	S	.	.	H	α-helix	trans	-71.4	-47.9	177.5	-154.9	0	0	0	0	110.6	T910 Q915 F916 M920 N921 I922	T910-S918 WeakPolarHBondContact CB-OG 3.18Å; T910-S918 WeakPolarHBondContact CG2-OG 3.42Å; Q915-S918 WeakPolarHBondContact O-CA 3.43Å; Q915-S918 WeakPolarHBondContact O-CB 3.28Å; Q915-S918 PolarHBondContact O-N 3.31Å; F916-S918 VanDerWaalsContact C-N 3.34Å; F916-S918 PolarHBondContact O-N 2.98Å; S918-M920 VanDerWaalsContact C-N 3.29Å; S918-M920 PolarHBondContact O-N 3.46Å; S918-N921 WeakPolarHBondContact O-CA 3.48Å; S918-N921 WeakPolarHBondContact O-CB 3.37Å; S918-N921 PolarHBondContact O-N 3.09Å; S918-I922 WeakPolarHBondContact O-CG1 3.45Å; S918-I922 PolarHBondContact O-N 2.74Å
919	V	82.1	Confident	83.8	Confident	34 Å²	34	63 Å²	63	21%	0.206	33%	0.33	C	S	.	.	H	α-helix	trans	-57	-42.5	174.7	-178.9	0	0	0	0	111.2	L911 Q915 F916 N921 I922 L923	L911-V919 HydrophobicContact CD2-CG1 4.27Å; L911-V919 HydrophobicContact CD2-CG2 4.43Å; Q915-V919 PolarHBondContact O-N 2.87Å; Q915-V919 VanDerWaalsContact O-N 3.07Å; F916-V919 PolarHBondContact O-N 2.9Å; V919-N921 VanDerWaalsContact C-N 3.35Å; V919-N921 PolarHBondContact O-N 3.08Å; V919-I922 PolarHBondContact O-N 3.03Å; V919-L923 HydrophobicContact CG1-CD1 3.97Å; V919-L923 HydrophobicContact CG1-CG 4.36Å; V919-L923 VanDerWaalsContact O-CG 3.25Å; V919-L923 WeakPolarHBondContact O-CG 3.38Å; V919-L923 PolarHBondContact O-N 3.22Å
920	M	81.3	Confident	84.3	Confident	56 Å²	56	59 Å²	59	28%	0.276	31%	0.311	S	S	.	.	H	α-helix	trans	-62	-39.1	175.2	-173.6	60.4	64.9	0	0	112.6	F916 S918 M924	F916-M920 HydrophobicContact CE1-CE 4.17Å; F916-M920 HydrophobicContact CE2-CE 4.28Å; F916-M920 HydrophobicContact CZ-CE 3.67Å; F916-M920 VanDerWaalsContact O-CB 3.29Å; F916-M920 WeakPolarHBondContact O-CB 3.43Å; F916-M920 PolarHBondContact O-N 2.82Å; S918-M920 VanDerWaalsContact C-N 3.29Å; S918-M920 PolarHBondContact O-N 3.46Å; M920-M924 VanDerWaalsContact O-CB 3.25Å; M920-M924 WeakPolarHBondContact O-CB 3.38Å; M920-M924 PolarHBondContact O-N 2.85Å
921	N	86.6	Confident	84.9	Confident	77 Å²	77	56.9 Å²	56.9	41%	0.412	30%	0.299	S	S	.	.	H	α-helix	trans	-67.5	-36.2	175.7	-77.8	-29.5	0	0	0	112.8	L917 S918 V919 M924 Q925	L917-N921 PolarHBondContact O-N 3.27Å; L917-N921 VanDerWaalsContact O-N 3.11Å; L917-N921 PolarHBondContact O-ND2 2.89Å; S918-N921 WeakPolarHBondContact O-CA 3.48Å; S918-N921 WeakPolarHBondContact O-CB 3.37Å; S918-N921 PolarHBondContact O-N 3.09Å; V919-N921 VanDerWaalsContact C-N 3.35Å; V919-N921 PolarHBondContact O-N 3.08Å; N921-M924 PolarHBondContact O-N 3.37Å; N921-Q925 WeakPolarHBondContact O-CG 3.32Å; N921-Q925 PolarHBondContact O-N 2.77Å; N921-Q925 VanDerWaalsContact O-N 3.08Å; N921-Q925 PolarHBondContact O-NE2 3.22Å
922	I	87.6	Confident	85.6	Confident	7 Å²	7	53.8 Å²	53.8	4%	0.036	28%	0.283	C	S	.	.	H	α-helix	trans	-65.3	-52.2	173.8	-62.3	164.3	0	0	0	109.6	F901 T910 L911 S918 V919 M924 Q925 L926	F901-I922 HydrophobicContact CE1-CG2 3.95Å; T910-I922 VanDerWaalsContact OG1-CD1 3.23Å; T910-I922 WeakPolarHBondContact OG1-CD1 3.49Å; L911-I922 HydrophobicContact CD2-CD1 4.07Å; L911-I922 HydrophobicContact CG-CD1 3.89Å; S918-I922 WeakPolarHBondContact O-CG1 3.45Å; S918-I922 PolarHBondContact O-N 2.74Å; V919-I922 PolarHBondContact O-N 3.03Å; I922-M924 PolarHBondContact O-N 3.27Å; I922-Q925 WeakPolarHBondContact O-CA 3.31Å; I922-Q925 PolarHBondContact O-N 3.4Å; I922-L926 HydrophobicContact CG2-CD1 4.12Å; I922-L926 WeakPolarHBondContact O-CG 3.36Å; I922-L926 PolarHBondContact O-N 3.45Å
923	L	87.4	Confident	86.1	Confident	39 Å²	39	45.9 Å²	45.9	20%	0.204	25%	0.248	C	C	.	.	H	α-helix	trans	-58.1	-34.9	176.8	-65.8	169.6	0	0	0	112.3	V919 R927 W1472 V1504	V919-L923 HydrophobicContact CG1-CD1 3.97Å; V919-L923 HydrophobicContact CG1-CG 4.36Å; V919-L923 VanDerWaalsContact O-CG 3.25Å; V919-L923 WeakPolarHBondContact O-CG 3.38Å; V919-L923 PolarHBondContact O-N 3.22Å; L923-R927 WeakPolarHBondContact O-CB 3.43Å; L923-R927 WeakPolarHBondContact O-CG 3.49Å; L923-R927 PolarHBondContact O-N 3.4Å; L923-W1472 HydrophobicContact CD1-CH2 4.32Å; L923-W1472 HydrophobicContact CD1-CZ2 4.24Å; L923-V1504 HydrophobicContact CD2-CB 4.4Å; L923-V1504 HydrophobicContact CD2-CG1 3.66Å; L923-V1504 HydrophobicContact CD2-CG2 3.74Å
924	M	86.6	Confident	86.6	Confident	72 Å²	72	45 Å²	45	36%	0.355	24%	0.238	S	C	.	.	H	α-helix	trans	-71.6	-28.8	175.1	-171.7	57.9	63.6	0	0	113.1	M920 N921 I922 K928 M1400	M920-M924 VanDerWaalsContact O-CB 3.25Å; M920-M924 WeakPolarHBondContact O-CB 3.38Å; M920-M924 PolarHBondContact O-N 2.85Å; N921-M924 PolarHBondContact O-N 3.37Å; I922-M924 PolarHBondContact O-N 3.27Å; M924-K928 WeakPolarHBondContact O-CG 3.06Å; M924-K928 PolarHBondContact O-N 3.32Å; M924-M1400 HydrophobicContact SD-CE 3.99Å
925	Q	90.2	Very high	87.3	Confident	52 Å²	52	43.3 Å²	43.3	24%	0.243	22%	0.216	C	C	.	.	H	α-helix	trans	-76.4	-44.9	173.2	-74	177.6	86.4	0	0	111.3	F901 N921 I922 R927 K928 V929	F901-Q925 HydrophobicContact CE1-CB 3.9Å; F901-Q925 HydrophobicContact CE2-CB 4.44Å; F901-Q925 HydrophobicContact CZ-CB 3.71Å; F901-Q925 HydrophobicContact CZ-CG 4.28Å; N921-Q925 WeakPolarHBondContact O-CG 3.32Å; N921-Q925 PolarHBondContact O-N 2.77Å; N921-Q925 VanDerWaalsContact O-N 3.08Å; N921-Q925 PolarHBondContact O-NE2 3.22Å; I922-Q925 WeakPolarHBondContact O-CA 3.31Å; I922-Q925 PolarHBondContact O-N 3.4Å; Q925-R927 VanDerWaalsContact C-N 3.31Å; Q925-R927 PolarHBondContact O-N 2.99Å; Q925-K928 WeakPolarHBondContact O-CA 3.11Å; Q925-K928 WeakPolarHBondContact O-CB 3.34Å; Q925-K928 PolarHBondContact O-N 3.06Å; Q925-V929 PolarHBondContact O-N 3.24Å; Q925-V929 VanDerWaalsContact O-N 3.14Å
926	L	91.1	Very high	87.6	Confident	5 Å²	5	41.2 Å²	41.2	3%	0.026	21%	0.205	C	C	.	.	H	α-helix	trans	-56.6	-43.6	173	-64.3	172.7	0	0	0	111.6	Y898 F901 M902 I922 K928 V929 C930 V1504	Y898-L926 HydrophobicContact CD1-CD2 4.43Å; Y898-L926 HydrophobicContact CD2-CD2 3.79Å; Y898-L926 HydrophobicContact CE1-CD2 4.32Å; Y898-L926 HydrophobicContact CE2-CB 3.99Å; Y898-L926 HydrophobicContact CE2-CD2 3.68Å; Y898-L926 HydrophobicContact CE2-CG 4.31Å; Y898-L926 HydrophobicContact CG-CD2 4.18Å; F901-L926 HydrophobicContact CD1-CD2 3.69Å; F901-L926 HydrophobicContact CD1-CG 4.26Å; F901-L926 HydrophobicContact CE1-CD2 4.17Å; F901-L926 HydrophobicContact CE1-CG 4.24Å; M902-L926 HydrophobicContact CG-CD2 4.16Å; M902-L926 HydrophobicContact SD-CD1 3.92Å; M902-L926 HydrophobicContact SD-CD2 4.09Å; I922-L926 HydrophobicContact CG2-CD1 4.12Å; I922-L926 WeakPolarHBondContact O-CG 3.36Å; I922-L926 PolarHBondContact O-N 3.45Å; L926-K928 VanDerWaalsContact C-N 3.32Å; L926-K928 PolarHBondContact O-N 2.87Å; L926-V929 PolarHBondContact O-N 3.23Å; L926-C930 PolarHBondContact O-N 3.24Å; L926-C930 PolarHBondContact O-SG 3.19Å; L926-V1504 HydrophobicContact CD1-CG2 3.83Å
927	R	91.2	Very high	88	Confident	11 Å²	11	39 Å²	39	4%	0.042	20%	0.196	C	C	.	.	H	α-helix	trans	-56.8	-37.8	171.6	-81.8	177.6	173.9	-105.8	10.5	113.3	L923 Q925 N931 M1400 S1470 I1508	L923-R927 WeakPolarHBondContact O-CB 3.43Å; L923-R927 WeakPolarHBondContact O-CG 3.49Å; L923-R927 PolarHBondContact O-N 3.4Å; Q925-R927 VanDerWaalsContact C-N 3.31Å; Q925-R927 PolarHBondContact O-N 2.99Å; R927-N931 WeakPolarHBondContact O-CB 3.23Å; R927-N931 PolarHBondContact O-N 2.66Å; R927-M1400 HydrophobicContact CB-CE 3.79Å; R927-S1470 PolarHBondContact NH1-O 3.35Å; R927-S1470 PolarHBondContact NH2-O 3.33Å; R927-I1508 HydrophobicContact CG-CD1 4.31Å; R927-I1508 VanDerWaalsContact NE-CD1 3.33Å
928	K	92.8	Very high	88.2	Confident	68 Å²	68	38.3 Å²	38.3	30%	0.296	20%	0.197	S	C	.	.	H	α-helix	trans	-65.8	-45.3	177	-70.8	166.4	-169.2	171.3	0	111	M924 Q925 L926 N931 H932 L935 M1400	M924-K928 WeakPolarHBondContact O-CG 3.06Å; M924-K928 PolarHBondContact O-N 3.32Å; Q925-K928 WeakPolarHBondContact O-CA 3.11Å; Q925-K928 WeakPolarHBondContact O-CB 3.34Å; Q925-K928 PolarHBondContact O-N 3.06Å; L926-K928 VanDerWaalsContact C-N 3.32Å; L926-K928 PolarHBondContact O-N 2.87Å; K928-N931 PolarHBondContact O-N 3.26Å; K928-H932 CarbonylContact O-C 3.53Å; K928-H932 PolarHBondContact O-N 2.79Å; K928-H932 VanDerWaalsContact O-O 3.06Å; K928-L935 HydrophobicContact CB-CB 4.03Å; K928-L935 HydrophobicContact CG-CB 4.39Å; K928-M1400 HydrophobicContact CG-CE 3.89Å; K928-M1400 HydrophobicContact CG-SD 3.77Å
929	V	92.1	Very high	88.1	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62.2	-44.2	178.6	-179.9	0	0	0	0	111	Q894 L897 Q925 L926 N931 F936	Q894-V929 HydrophobicContact CB-CG1 4.33Å; Q894-V929 PolarHBondContact NE2-O 3.36Å; Q894-V929 WeakPolarHBondContact O-CG1 3.45Å; L897-V929 HydrophobicContact CB-CG1 4.15Å; Q925-V929 PolarHBondContact O-N 3.24Å; Q925-V929 VanDerWaalsContact O-N 3.14Å; L926-V929 PolarHBondContact O-N 3.23Å; V929-N931 VanDerWaalsContact C-N 3.32Å; V929-N931 PolarHBondContact O-N 2.58Å; V929-F936 HydrophobicContact CG2-CB 3.95Å; V929-F936 HydrophobicContact CG2-CD1 4.39Å; V929-F936 HydrophobicContact CG2-CD2 4.07Å; V929-F936 HydrophobicContact CG2-CG 3.9Å
930	C	92.3	Very high	87.9	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-61.4	-38.3	175.5	-60.7	0	0	0	0	112.6	Q894 L926 E1505	Q894-C930 PolarHBondContact NE2-O 3.04Å; Q894-C930 VanDerWaalsContact NE2-O 3.07Å; L926-C930 PolarHBondContact O-N 3.24Å; L926-C930 PolarHBondContact O-SG 3.19Å; C930-E1505 HydrophobicContact CB-CG 4.3Å
931	N	92.1	Very high	87.8	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-72.4	-51.6	178.6	-86.2	-11.7	0	0	0	113.4	R927 K928 V929 L935 C1374 K1376 M1403 Y1468 D1469	R927-N931 WeakPolarHBondContact O-CB 3.23Å; R927-N931 PolarHBondContact O-N 2.66Å; K928-N931 PolarHBondContact O-N 3.26Å; V929-N931 VanDerWaalsContact C-N 3.32Å; V929-N931 PolarHBondContact O-N 2.58Å; N931-L935 HydrophobicContact CB-CD1 3.98Å; N931-C1374 PolarHBondContact O-SG 3.05Å; N931-K1376 PolarHBondContact OD1-NZ 2.8Å; N931-M1403 HydrophobicContact CB-SD 4.48Å; N931-Y1468 HydrophobicContact CB-CE1 4Å; N931-Y1468 WeakPolarHBondContact O-CE1 3.15Å; N931-Y1468 PolarHBondContact O-OH 2.77Å; N931-D1469 PolarHBondContact ND2-OD2 2.84Å
932	H	93	Very high	87.3	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.005	23%	0.228	C	C	.	.			trans	-169.9	131	175.4	-167.8	-83.7	0	0	0	111	K928 N934 L935 I1370 M1403 I1406	K928-H932 CarbonylContact O-C 3.53Å; K928-H932 PolarHBondContact O-N 2.79Å; K928-H932 VanDerWaalsContact O-O 3.06Å; H932-N934 VanDerWaalsContact C-N 3.32Å; H932-N934 WeakPolarHBondContact ND1-CB 3.03Å; H932-N934 PolarHBondContact ND1-N 3.33Å; H932-N934 VanDerWaalsContact ND1-N 3.14Å; H932-N934 PolarHBondContact O-N 3.14Å; H932-L935 HydrophobicContact CB-CD1 4.17Å; H932-L935 HydrophobicContact CB-CG 4.21Å; H932-L935 WeakPolarHBondContact O-CB 3.46Å; H932-L935 PolarHBondContact O-N 3.27Å; H932-I1370 PolarHBondContact NE2-O 3.47Å; H932-M1403 HydrophobicContact CB-CE 4.32Å; H932-M1403 HydrophobicContact CB-SD 3.97Å; H932-I1406 HydrophobicContact CB-CD1 4.14Å
933	P	92.5	Very high	86.9	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-62	-34.7	-173.5	24.1	-33.1	0	0	0	113.4	Q894 L897 L935 F936 E937 D1373	Q894-P933 HydrophobicContact CG-CB 4.47Å; Q894-P933 HydrophobicContact CG-CG 4.21Å; L897-P933 HydrophobicContact CD1-CB 3.85Å; P933-L935 PolarHBondContact O-N 3.41Å; P933-F936 WeakPolarHBondContact O-CA 3.48Å; P933-F936 WeakPolarHBondContact O-CB 3.2Å; P933-F936 PolarHBondContact O-N 3.39Å; P933-E937 CarbonylContact C-O 3.01Å; P933-E937 PolarHBondContact O-N 2.84Å; P933-D1373 WeakPolarHBondContact CD-O 3.28Å; P933-D1373 HydrophobicContact CG-CB 3.87Å; P933-D1373 VanDerWaalsContact CG-O 3.28Å; P933-D1373 WeakPolarHBondContact CG-O 3.12Å
934	N	89	Confident	86.4	Confident	51 Å²	51	48.5 Å²	48.5	27%	0.273	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-63.6	-5.9	174.4	-62.2	-12.4	0	0	0	115.1	R893 H932 F936 E937 T938	R893-N934 PolarHBondContact NH1-OD1 3.04Å; H932-N934 VanDerWaalsContact C-N 3.32Å; H932-N934 WeakPolarHBondContact ND1-CB 3.03Å; H932-N934 PolarHBondContact ND1-N 3.33Å; H932-N934 VanDerWaalsContact ND1-N 3.14Å; H932-N934 PolarHBondContact O-N 3.14Å; N934-F936 VanDerWaalsContact C-N 3.35Å; N934-E937 WeakPolarHBondContact CA-O 3.2Å; N934-E937 PolarHBondContact OD1-O 3.32Å; N934-T938 HydrophobicContact CB-CG2 4.28Å
935	L	89	Confident	85.8	Confident	21 Å²	21	51.7 Å²	51.7	11%	0.11	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-81	-17.2	167.8	-66.3	173.7	0	0	0	113	K928 N931 H932 P933 M1400 R1402 M1403 I1406	K928-L935 HydrophobicContact CB-CB 4.03Å; K928-L935 HydrophobicContact CG-CB 4.39Å; N931-L935 HydrophobicContact CB-CD1 3.98Å; H932-L935 HydrophobicContact CB-CD1 4.17Å; H932-L935 HydrophobicContact CB-CG 4.21Å; H932-L935 WeakPolarHBondContact O-CB 3.46Å; H932-L935 PolarHBondContact O-N 3.27Å; P933-L935 PolarHBondContact O-N 3.41Å; L935-M1400 HydrophobicContact CD1-SD 4.22Å; L935-R1402 HydrophobicContact CD2-CB 3.61Å; L935-M1403 HydrophobicContact CD1-CB 4.44Å; L935-M1403 HydrophobicContact CD1-SD 3.88Å; L935-I1406 HydrophobicContact CD2-CD1 3.65Å; L935-I1406 HydrophobicContact CG-CD1 3.79Å
936	F	86.3	Confident	84.8	Confident	75 Å²	75	57.2 Å²	57.2	33%	0.329	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-57.6	174.4	-175.7	-99.5	0	0	0	109.7	L897 F901 V929 P933 N934	L897-F936 HydrophobicContact CD2-CD1 4.45Å; L897-F936 HydrophobicContact CD2-CE1 4.39Å; F901-F936 HydrophobicContact CD2-CE2 4.09Å; F901-F936 AromaticContact CD2-CZ 3.91Å; F901-F936 HydrophobicContact CD2-CZ 3.91Å; F901-F936 HydrophobicContact CE2-CE2 4.28Å; F901-F936 HydrophobicContact CE2-CZ 4.48Å; F901-F936 HydrophobicContact CG-CZ 4.48Å; V929-F936 HydrophobicContact CG2-CB 3.95Å; V929-F936 HydrophobicContact CG2-CD1 4.39Å; V929-F936 HydrophobicContact CG2-CD2 4.07Å; V929-F936 HydrophobicContact CG2-CG 3.9Å; P933-F936 WeakPolarHBondContact O-CA 3.48Å; P933-F936 WeakPolarHBondContact O-CB 3.2Å; P933-F936 PolarHBondContact O-N 3.39Å; N934-F936 VanDerWaalsContact C-N 3.35Å
937	E	85.4	Confident	83.7	Confident	99 Å²	99	58.6 Å²	58.6	46%	0.463	29%	0.292	S	S	.	.			trans	-142.2	127	-179.4	-170.7	-154.1	-147.1	0	0	111.8	R893 P933 N934	R893-E937 PolarHBondContact NH2-O 2.89Å; R893-E937 IonicContact NH2-OE2 3.9Å; R893-E937 PolarHBondContact NH2-OE2 3.4Å; P933-E937 CarbonylContact C-O 3.01Å; P933-E937 PolarHBondContact O-N 2.84Å; N934-E937 WeakPolarHBondContact CA-O 3.2Å; N934-E937 PolarHBondContact OD1-O 3.32Å
938	T	84	Confident	82.2	Confident	101 Å²	101	60.2 Å²	60.2	62%	0.62	31%	0.308	S	S	*	.	P	Polyproline II helix	trans	-80.1	133	175.4	49.8	0	0	0	0	112.1	N934	N934-T938 HydrophobicContact CB-CG2 4.28Å
939	R	78.6	Confident	80.5	Confident	99 Å²	99	59 Å²	59	37%	0.374	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-54.2	125.6	175.8	-176	177.9	-77.7	-94	11.3	111.4	D1373	R939-D1373 IonicContact CZ-OD1 2.88Å; R939-D1373 IonicContact CZ-OD2 2.73Å; R939-D1373 IonicContact NE-OD1 2.68Å; R939-D1373 IonicContact NE-OD2 3.65Å; R939-D1373 PolarHBondContact NE-OD2 2.93Å; R939-D1373 IonicContact NH2-OD1 2.73Å; R939-D1373 PolarHBondContact NH2-OD1 3.3Å; R939-D1373 IonicContact NH2-OD2 2.76Å; R939-D1373 PolarHBondContact NH2-OD2 2.91Å
940	P	77.2	Confident	78.7	Confident	88 Å²	88	62.4 Å²	62.4	57%	0.571	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-72.6	161	-178.8	29.5	-35.5	0	0	0	112.8
941	I	78.8	Confident	76.8	Confident	75 Å²	75	71.4 Å²	71.4	39%	0.385	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-84.6	130.1	169.2	-59.1	170	0	0	0	107.7	I72 I1362 F1364	I72-I941 HydrophobicContact CD1-CD1 4.33Å; I941-I1362 HydrophobicContact CG2-CG2 3.71Å; I941-F1364 HydrophobicContact CD1-CD1 4.15Å; I941-F1364 HydrophobicContact CD1-CE1 4.02Å; I941-F1364 HydrophobicContact CG1-CD1 4.37Å; I941-F1364 HydrophobicContact CG2-CD1 4.19Å; I941-F1364 HydrophobicContact CG2-CE1 4.16Å
942	I	76.3	Confident	75	Confident	89 Å²	89	74.5 Å²	74.5	46%	0.456	38%	0.38	S	S	.	.	B	Isolated β-bridge	trans	-94.3	125.5	-179	-62.2	171.3	0	0	0	109.4	V1280 Q1363	I942-V1280 HydrophobicContact CG2-CB 4.36Å; I942-Q1363 HydrophobicContact CB-CB 4.27Å; I942-Q1363 PolarHBondContact N-O 3.03Å; I942-Q1363 PolarHBondContact O-N 2.88Å
943	S	79.1	Confident	72.9	Confident	80 Å²	80	77.9 Å²	77.9	56%	0.559	40%	0.4	S	S	*	.			trans	-133.9	146.7	177.1	59.6	0	0	0	0	110.2
944	P	77.5	Confident	71.1	Confident	31 Å²	31	85.2 Å²	85.2	20%	0.201	43%	0.429	C	S	.	.			trans	-60	136.9	177.6	25.6	-34.6	0	0	0	111.2	R946 V1280 P1281 I1284 R1361	P944-R946 PolarHBondContact O-N 3.2Å; P944-V1280 HydrophobicContact CB-CG1 4.4Å; P944-V1280 HydrophobicContact CG-CG1 4.47Å; P944-P1281 WeakPolarHBondContact CA-O 3.33Å; P944-P1281 VanDerWaalsContact CB-O 3.31Å; P944-P1281 WeakPolarHBondContact CB-O 3.38Å; P944-I1284 HydrophobicContact CB-CB 4.4Å; P944-I1284 HydrophobicContact CB-CD1 3.63Å; P944-I1284 HydrophobicContact CB-CG1 3.74Å; P944-I1284 HydrophobicContact CG-CD1 3.6Å; P944-I1284 HydrophobicContact CG-CG1 4.27Å; P944-R1361 WeakPolarHBondContact CD-O 3.47Å
945	F	73.8	Confident	69.4	Low	139 Å²	139	86.6 Å²	86.6	61%	0.61	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.6	127.4	171.8	-179.1	-100.1	0	0	0	109.8	V947 A1282 V1283 I1284	F945-V947 HydrophobicContact CD1-CG2 4.06Å; F945-V947 HydrophobicContact CE1-CG2 3.93Å; F945-A1282 WeakPolarHBondContact CB-O 3.4Å; F945-A1282 PolarHBondContact N-O 3.07Å; F945-V1283 HydrophobicContact CB-CG2 4.46Å; F945-V1283 HydrophobicContact CD1-CG1 4.48Å; F945-V1283 CarbonylContact O-C 3.18Å; F945-V1283 WeakPolarHBondContact O-CA 3.21Å; F945-I1284 PolarHBondContact O-N 2.78Å
946	R	69.7	Low	67.4	Low	168 Å²	168	87.6 Å²	87.6	63%	0.634	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.1	109.7	176.6	-173.1	177.9	179.2	-162.3	-3.7	110.3	P944 D949 I1284 S1286	P944-R946 PolarHBondContact O-N 3.2Å; R946-D949 IonicContact NH2-OD2 3.72Å; R946-I1284 WeakPolarHBondContact CA-O 3.32Å; R946-S1286 PolarHBondContact NE-OG 3.19Å; R946-S1286 PolarHBondContact NH2-OG 3.19Å
947	V	66.2	Low	65.7	Low	35 Å²	35	87.4 Å²	87.4	21%	0.212	45%	0.454	C	S	.	.			trans	-68	131.6	166.4	171.3	0	0	0	0	108.5	F945 Y951 L952 V1283 I1284	F945-V947 HydrophobicContact CD1-CG2 4.06Å; F945-V947 HydrophobicContact CE1-CG2 3.93Å; V947-Y951 HydrophobicContact CG1-CD2 4.47Å; V947-L952 HydrophobicContact CG1-CD1 4.35Å; V947-L952 HydrophobicContact CG1-CG 4.45Å; V947-V1283 HydrophobicContact CG2-CG1 3.59Å; V947-I1284 PolarHBondContact N-O 3.4Å
948	A	59.9	Low	63.5	Low	44 Å²	44	91.5 Å²	91.5	36%	0.364	47%	0.466	S	S	.	.			trans	-75.1	140.5	175.5	0	0	0	0	0	110.7	S950 Y951	A948-S950 PolarHBondContact O-N 2.77Å; A948-Y951 HydrophobicContact CB-CD2 3.95Å; A948-Y951 HydrophobicContact CB-CE2 4.03Å; A948-Y951 WeakPolarHBondContact O-CD2 3.31Å; A948-Y951 PolarHBondContact O-N 3.37Å
949	D	57.1	Low	61.6	Low	42 Å²	42	92.8 Å²	92.8	23%	0.225	47%	0.468	C	S	.	.	G	3₁₀ helix	trans	-68.6	-9.3	-171	-47.6	-61.3	0	0	0	113.4	R946 L952 S1286 T1289	R946-D949 IonicContact NH2-OD2 3.72Å; D949-L952 CarbonylContact O-C 3.47Å; D949-L952 PolarHBondContact O-N 2.71Å; D949-S1286 WeakPolarHBondContact OD1-CA 3.44Å; D949-S1286 WeakPolarHBondContact OD1-CB 3.48Å; D949-S1286 PolarHBondContact OD1-N 2.82Å; D949-S1286 VanDerWaalsContact OD1-N 3.11Å; D949-S1286 PolarHBondContact OD1-OG 2.79Å; D949-S1286 WeakPolarHBondContact OD2-CB 3.33Å; D949-S1286 PolarHBondContact OD2-OG 3.02Å; D949-T1289 HydrophobicContact CB-CG2 4.16Å; D949-T1289 PolarHBondContact O-OG1 3.3Å; D949-T1289 VanDerWaalsContact O-OG1 3.11Å
950	S	54.9	Low	60	Low	72 Å²	72	92.9 Å²	92.9	50%	0.503	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-65.8	-33.9	169.8	51.8	0	0	0	0	113.6	A948 L952 T953	A948-S950 PolarHBondContact O-N 2.77Å; S950-L952 PolarHBondContact O-N 3.29Å; S950-T953 VanDerWaalsContact O-CG2 3.3Å; S950-T953 WeakPolarHBondContact O-CG2 3.41Å; S950-T953 PolarHBondContact O-OG1 2.86Å
951	Y	51.4	Low	58.4	Low	189 Å²	189	89.3 Å²	89.3	74%	0.741	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-77.5	-4.6	176.2	-60.1	-76.1	0	0	0	112.8	V947 A948	V947-Y951 HydrophobicContact CG1-CD2 4.47Å; A948-Y951 HydrophobicContact CB-CD2 3.95Å; A948-Y951 HydrophobicContact CB-CE2 4.03Å; A948-Y951 WeakPolarHBondContact O-CD2 3.31Å; A948-Y951 PolarHBondContact O-N 3.37Å
952	L	54.4	Low	56.6	Low	66 Å²	66	89.6 Å²	89.6	35%	0.346	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-117.5	39.5	177.2	-62.8	174	0	0	0	110.2	V947 D949 S950 G1287 F1288 T1289	V947-L952 HydrophobicContact CG1-CD1 4.35Å; V947-L952 HydrophobicContact CG1-CG 4.45Å; D949-L952 CarbonylContact O-C 3.47Å; D949-L952 PolarHBondContact O-N 2.71Å; S950-L952 PolarHBondContact O-N 3.29Å; L952-G1287 VanDerWaalsContact CD1-O 3.27Å; L952-G1287 WeakPolarHBondContact CD1-O 3.39Å; L952-F1288 HydrophobicContact CB-CB 4.29Å; L952-F1288 WeakPolarHBondContact O-CA 3.43Å; L952-T1289 PolarHBondContact O-N 3.42Å
953	T	50.4	Low	54.7	Low	71 Å²	71	92.7 Å²	92.7	44%	0.436	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	123.6	174	38.3	0	0	0	0	110.5	S950 T1289	S950-T953 VanDerWaalsContact O-CG2 3.3Å; S950-T953 WeakPolarHBondContact O-CG2 3.41Å; S950-T953 PolarHBondContact O-OG1 2.86Å; T953-T1289 WeakPolarHBondContact CA-O 3.18Å; T953-T1289 WeakPolarHBondContact CG2-OG1 3.3Å
954	Y	54.8	Low	52.7	Low	154 Å²	154	92.8 Å²	92.8	60%	0.604	48%	0.476	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.2	105.9	172	-164	-94.3	0	0	0	109.7	L956 T1289 Q1291	Y954-L956 HydrophobicContact CD1-CD2 4.02Å; Y954-L956 HydrophobicContact CD1-CG 4.05Å; Y954-L956 HydrophobicContact CE1-CD2 3.78Å; Y954-L956 HydrophobicContact CE1-CG 4.32Å; Y954-L956 PolarHBondContact O-N 2.8Å; Y954-T1289 PolarHBondContact N-O 3.38Å; Y954-Q1291 PolarHBondContact O-N 2.8Å; Y954-Q1291 VanDerWaalsContact O-N 3.16Å
955	S	52.7	Low	50.7	Low	80 Å²	80	96 Å²	96	56%	0.559	49%	0.488	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73	118.8	177.9	-177.4	0	0	0	0	110.2	P957	S955-P957 WeakPolarHBondContact O-CD 3.21Å
956	L	47.5	Very low	48.6	Very low	42 Å²	42	94.8 Å²	94.8	22%	0.22	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	114	176.9	-80	170.2	0	0	0	111	Y954 R958 V961 L1290 Q1291	Y954-L956 HydrophobicContact CD1-CD2 4.02Å; Y954-L956 HydrophobicContact CD1-CG 4.05Å; Y954-L956 HydrophobicContact CE1-CD2 3.78Å; Y954-L956 HydrophobicContact CE1-CG 4.32Å; Y954-L956 PolarHBondContact O-N 2.8Å; L956-R958 PolarHBondContact O-N 3.07Å; L956-V961 HydrophobicContact CB-CG2 3.61Å; L956-V961 HydrophobicContact CD1-CG2 4.19Å; L956-V961 HydrophobicContact CG-CG2 4.43Å; L956-L1290 HydrophobicContact CD1-CD2 4.06Å; L956-Q1291 PolarHBondContact N-O 3.46Å; L956-Q1291 VanDerWaalsContact N-O 3.08Å
957	P	50.2	Low	46.8	Very low	71 Å²	71	95.8 Å²	95.8	46%	0.461	50%	0.503	S	S	.	.			trans	-54.9	134.3	172	-27.5	35.6	0	0	0	111.3	S955 L959 L960 V961	S955-P957 WeakPolarHBondContact O-CD 3.21Å; P957-L959 PolarHBondContact O-N 2.68Å; P957-L960 HydrophobicContact CB-CD1 4.48Å; P957-L960 HydrophobicContact CG-CD1 4.15Å; P957-L960 WeakPolarHBondContact O-CB 3.14Å; P957-L960 PolarHBondContact O-N 3.4Å; P957-V961 PolarHBondContact O-N 3.35Å
958	R	39.9	Very low	45.1	Very low	185 Å²	185	99.9 Å²	99.9	70%	0.698	52%	0.523	S	S	*	.	H	α-helix	trans	-47.5	-36.3	-178.6	171.2	176.4	151.1	162.2	-6.7	113.8	L956 S962	L956-R958 PolarHBondContact O-N 3.07Å; R958-S962 PolarHBondContact O-N 2.94Å; R958-S962 VanDerWaalsContact O-N 3.17Å; R958-S962 PolarHBondContact O-OG 2.79Å
959	L	43.8	Very low	43.5	Very low	129 Å²	129	103.3 Å²	103.3	68%	0.675	54%	0.539	S	S	*	.	H	α-helix	trans	-62.8	-48.7	175.1	-96.1	159.9	0	0	0	112.5	P957 V961 S962 M963	P957-L959 PolarHBondContact O-N 2.68Å; L959-V961 PolarHBondContact O-N 2.8Å; L959-S962 WeakPolarHBondContact CA-OG 3.14Å; L959-S962 CarbonylContact O-C 3.57Å; L959-S962 PolarHBondContact O-N 3.17Å; L959-S962 VanDerWaalsContact O-N 3.13Å; L959-S962 PolarHBondContact O-OG 2.69Å; L959-M963 WeakPolarHBondContact O-CB 3.42Å; L959-M963 WeakPolarHBondContact O-CG 3.17Å; L959-M963 PolarHBondContact O-N 2.83Å
960	L	43.4	Very low	42.1	Very low	100 Å²	100	111.5 Å²	111.5	52%	0.524	57%	0.573	S	S	.	*	H	α-helix	trans	-61.4	-39.3	-179.9	-91.1	162.8	0	0	0	112.8	P957 M963 S964	P957-L960 HydrophobicContact CB-CD1 4.48Å; P957-L960 HydrophobicContact CG-CD1 4.15Å; P957-L960 WeakPolarHBondContact O-CB 3.14Å; P957-L960 PolarHBondContact O-N 3.4Å; L960-M963 PolarHBondContact O-N 3.33Å; L960-S964 WeakPolarHBondContact O-CB 3.24Å; L960-S964 PolarHBondContact O-N 3.08Å; L960-S964 PolarHBondContact O-OG 3.11Å
961	V	44.5	Very low	40.8	Very low	14 Å²	14	113 Å²	113	9%	0.085	59%	0.59	C	S	.	*	H	α-helix	trans	-67.6	-39	175	-169.9	0	0	0	0	111.2	L956 P957 L959 M963 L1297	L956-V961 HydrophobicContact CB-CG2 3.61Å; L956-V961 HydrophobicContact CD1-CG2 4.19Å; L956-V961 HydrophobicContact CG-CG2 4.43Å; P957-V961 PolarHBondContact O-N 3.35Å; L959-V961 PolarHBondContact O-N 2.8Å; V961-M963 VanDerWaalsContact C-N 3.27Å; V961-M963 PolarHBondContact O-N 2.77Å; V961-L1297 HydrophobicContact CG1-CD1 4.14Å
962	S	40.3	Very low	39.6	Very low	80 Å²	80	109.7 Å²	109.7	56%	0.559	59%	0.592	S	S	*	*	H	α-helix	trans	-71.4	-19	176.4	66.9	0	0	0	0	114.4	R958 L959	R958-S962 PolarHBondContact O-N 2.94Å; R958-S962 VanDerWaalsContact O-N 3.17Å; R958-S962 PolarHBondContact O-OG 2.79Å; L959-S962 WeakPolarHBondContact CA-OG 3.14Å; L959-S962 CarbonylContact O-C 3.57Å; L959-S962 PolarHBondContact O-N 3.17Å; L959-S962 VanDerWaalsContact O-N 3.13Å; L959-S962 PolarHBondContact O-OG 2.69Å
963	M	36.9	Very low	38.3	Very low	155 Å²	155	112.2 Å²	112.2	76%	0.764	62%	0.615	S	S	*	*	H	α-helix	trans	-91	-22.7	179.1	-73.8	-75.3	-67.3	0	0	113.6	L959 L960 V961	L959-M963 WeakPolarHBondContact O-CB 3.42Å; L959-M963 WeakPolarHBondContact O-CG 3.17Å; L959-M963 PolarHBondContact O-N 2.83Å; L960-M963 PolarHBondContact O-N 3.33Å; V961-M963 VanDerWaalsContact C-N 3.27Å; V961-M963 PolarHBondContact O-N 2.77Å
964	S	37.7	Very low	37.1	Very low	82 Å²	82	114 Å²	114	57%	0.573	63%	0.631	S	S	*	*	H	α-helix	trans	-107.5	-9.5	-165	55.5	0	0	0	0	116.1	L960 P966	L960-S964 WeakPolarHBondContact O-CB 3.24Å; L960-S964 PolarHBondContact O-N 3.08Å; L960-S964 PolarHBondContact O-OG 3.11Å; S964-P966 WeakPolarHBondContact O-CD 3.44Å
965	H	35.4	Very low	35.7	Very low	99 Å²	99	114.6 Å²	114.6	46%	0.458	64%	0.644	S	S	.	*			trans	-100.2	106.1	-179	-100.6	-61.2	0	0	0	113.5	F967	H965-F967 PolarHBondContact O-N 3.04Å
966	P	29.4	Very low	34.4	Very low	112 Å²	112	114.6 Å²	114.6	73%	0.727	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	18	-171.2	30.6	-36.8	0	0	0	116.3	S964	S964-P966 WeakPolarHBondContact O-CD 3.44Å
967	F	31.9	Very low	33.3	Very low	189 Å²	189	118 Å²	118	83%	0.829	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.1	-0.5	-172	-83.9	-72.8	0	0	0	118.1	H965	H965-F967 PolarHBondContact O-N 3.04Å
968	L	30.4	Very low	31.9	Very low	122 Å²	122	125.7 Å²	125.7	64%	0.639	70%	0.704	S	S	*	*			trans	-131.2	56.2	-176.8	-77.6	177.9	0	0	0	115.4
969	V	26.7	Very low	31.1	Very low	116 Å²	116	121.6 Å²	121.6	70%	0.703	70%	0.704	S	S	*	*			trans	-123	57.9	170.7	-167.3	0	0	0	0	111.9
970	F	26.8	Very low	30.2	Very low	214 Å²	214	121.7 Å²	121.7	94%	0.939	71%	0.709	S	S	*	*			trans	-158.3	83.8	169.7	-84.2	-61.8	0	0	0	114.5
971	A	28.5	Very low	29.2	Very low	102 Å²	102	126.6 Å²	126.6	84%	0.843	73%	0.726	S	S	*	*			trans	-178.7	99.3	150.8	0	0	0	0	0	113.8
972	P	25	Very low	28.3	Very low	121 Å²	121	129.2 Å²	129.2	79%	0.786	76%	0.757	S	S	*	*			trans	-102.3	124.3	179.2	34.9	-30.9	0	0	0	116
973	S	27.6	Very low	27.6	Very low	118 Å²	118	130.8 Å²	130.8	83%	0.825	77%	0.767	S	S	*	*			trans	44.3	121.7	139.4	65.7	0	0	0	0	123.3
974	S	26.6	Very low	27.1	Very low	110 Å²	110	128.3 Å²	128.3	77%	0.769	77%	0.772	S	S	*	*			trans	-162.4	142.2	137	65	0	0	0	0	109
975	N	24.1	Very low	26.6	Very low	166 Å²	166	128.1 Å²	128.1	89%	0.888	77%	0.771	S	S	*	*	S	Bend	cis	-120.2	139.6	13.4	-71.5	-52	0	0	0	112.7
976	G	25.7	Very low	26.2	Very low	80 Å²	80	127 Å²	127	83%	0.825	78%	0.778	S	S	*	*	S	Bend	trans	-177.2	29.3	179.6	0	0	0	0	0	115.4
977	S	23.6	Very low	26	Very low	113 Å²	113	132.5 Å²	132.5	79%	0.79	79%	0.791	S	S	*	*			trans	46	111.3	172.5	-71.9	0	0	0	0	120.7
978	R	22.2	Very low	25.8	Very low	232 Å²	232	126.9 Å²	126.9	88%	0.875	78%	0.775	S	S	*	*			trans	63.2	100.2	145	-72.9	-179.2	170.2	177.8	-4.4	117.5
979	S	22.5	Very low	25.8	Very low	100 Å²	100	126.4 Å²	126.4	70%	0.699	77%	0.773	S	S	*	*				81.3	140.3	95.2	70.4	0	0	0	0	114
980	V	25.1	Very low	25.9	Very low	130 Å²	130	126.5 Å²	126.5	79%	0.788	78%	0.776	S	S	*	*			cis	-141.4	154.4	42.7	175.9	0	0	0	0	113.4
981	F	22.6	Very low	26	Very low	203 Å²	203	122.4 Å²	122.4	89%	0.89	76%	0.764	S	S	*	*			trans	-47.4	148.5	170.7	-64.3	-108.2	0	0	0	116.3
982	G	24.5	Very low	26.2	Very low	70 Å²	70	125.7 Å²	125.7	72%	0.722	77%	0.766	S	S	*	*			trans	-172.9	139.9	164.2	0	0	0	0	0	112.8
983	S	27.2	Very low	26.7	Very low	112 Å²	112	125.1 Å²	125.1	78%	0.783	76%	0.757	S	S	*	*			trans	12.1	112.7	167	52.2	0	0	0	0	119.5
984	A	25.3	Very low	27	Very low	104 Å²	104	128.5 Å²	128.5	86%	0.86	75%	0.752	S	S	*	*			trans	-95.9	106.7	160.1	0	0	0	0	0	110
985	S	27.2	Very low	27.4	Very low	78 Å²	78	128.5 Å²	128.5	55%	0.545	74%	0.742	S	S	.	*			trans	-156.8	125.7	-179.9	46.4	0	0	0	0	106	S988	S985-S988 WeakPolarHBondContact CA-OG 3.15Å; S985-S988 WeakPolarHBondContact CB-OG 3.13Å
986	A	26.3	Very low	28.1	Very low	74 Å²	74	125.5 Å²	125.5	61%	0.612	73%	0.726	S	S	*	*	S	Bend	cis	-134.3	57.7	47.5	0	0	0	0	0	114.5	S988	A986-S988 VanDerWaalsContact C-N 3.26Å
987	F	25.8	Very low	28.6	Very low	229 Å²	229	126 Å²	126	100%	1.004	71%	0.714	S	S	*	*	S	Bend	trans	-102.3	38.5	151.7	-90.7	-76.3	0	0	0	109.7
988	S	29	Very low	29.1	Very low	70 Å²	70	122.9 Å²	122.9	49%	0.49	69%	0.694	S	S	.	*	S	Bend	trans	-137.7	-13.9	-175.4	55.5	0	0	0	0	113.2	S985 A986	S985-S988 WeakPolarHBondContact CA-OG 3.15Å; S985-S988 WeakPolarHBondContact CB-OG 3.13Å; A986-S988 VanDerWaalsContact C-N 3.26Å
989	D	28.6	Very low	29.8	Very low	112 Å²	112	112.9 Å²	112.9	60%	0.599	66%	0.664	S	S	*	*			trans	-93	118.5	167.4	-58.8	-57.6	0	0	0	107.1	D991	D989-D991 PolarHBondContact O-N 3.21Å
990	P	30.2	Very low	30.6	Very low	118 Å²	118	110.4 Å²	110.4	77%	0.766	65%	0.646	S	S	*	*			trans	-73.6	-10.5	179.2	-17.5	32.8	0	0	0	113.9
991	D	29.4	Very low	31.1	Very low	128 Å²	128	108 Å²	108	68%	0.684	63%	0.632	S	S	*	*			trans	-119.9	88.3	-155.3	-53.7	-56.2	0	0	0	112.2	D989	D989-D991 PolarHBondContact O-N 3.21Å
992	L	31.3	Very low	31.7	Very low	171 Å²	171	101.2 Å²	101.2	90%	0.895	61%	0.614	S	S	*	*			trans	173.6	120.4	138.4	-114.2	64.6	0	0	0	110.3	W994	L992-W994 PolarHBondContact O-N 3.28Å; L992-W994 VanDerWaalsContact O-N 3.11Å
993	D	36.5	Very low	32.3	Very low	109 Å²	109	106.6 Å²	106.6	58%	0.583	61%	0.612	S	S	*	*			trans	-72.7	106.1	-173.3	-86.6	-67.6	0	0	0	114.2	L995 D996 T997	D993-L995 PolarHBondContact O-N 2.95Å; D993-D996 HydrophobicContact CB-CB 4.12Å; D993-D996 PolarHBondContact O-N 2.8Å; D993-T997 PolarHBondContact O-N 2.86Å; D993-T997 PolarHBondContact O-OG1 2.79Å
994	W	34	Very low	32.8	Very low	190 Å²	190	108.3 Å²	108.3	72%	0.72	61%	0.611	S	S	*	*	H	α-helix	trans	-59.9	-21.5	164.8	77.7	-80	0	0	0	112.4	L992 T997 A998	L992-W994 PolarHBondContact O-N 3.28Å; L992-W994 VanDerWaalsContact O-N 3.11Å; W994-T997 WeakPolarHBondContact CA-OG1 3.22Å; W994-T997 PolarHBondContact O-OG1 2.76Å; W994-A998 HydrophobicContact CE3-CB 4.47Å; W994-A998 WeakPolarHBondContact O-CB 3.31Å; W994-A998 PolarHBondContact O-N 2.77Å
995	L	33.7	Very low	33.2	Very low	109 Å²	109	109.7 Å²	109.7	57%	0.571	60%	0.604	S	S	*	*	H	α-helix	trans	-67.9	-32.4	172.8	-80	162.8	0	0	0	112.9	D993 G999	D993-L995 PolarHBondContact O-N 2.95Å; L995-G999 WeakPolarHBondContact O-CA 3.42Å; L995-G999 PolarHBondContact O-N 2.7Å
996	D	38.6	Very low	33.1	Very low	103 Å²	103	109.1 Å²	109.1	55%	0.551	61%	0.61	S	S	*	*	H	α-helix	trans	-84.7	-30	-179.3	-129.2	4.9	0	0	0	111.8	D993 S1000	D993-D996 HydrophobicContact CB-CB 4.12Å; D993-D996 PolarHBondContact O-N 2.8Å; D996-S1000 VanDerWaalsContact O-CB 3.26Å; D996-S1000 WeakPolarHBondContact O-CB 3.24Å; D996-S1000 PolarHBondContact O-N 2.92Å; D996-S1000 PolarHBondContact O-OG 2.86Å
997	T	37.7	Very low	33.2	Very low	91 Å²	91	114.6 Å²	114.6	56%	0.558	62%	0.623	S	S	*	*	H	α-helix	trans	-74.5	-42.8	168.9	44.2	0	0	0	0	112	D993 W994 G999 S1000 V1001	D993-T997 PolarHBondContact O-N 2.86Å; D993-T997 PolarHBondContact O-OG1 2.79Å; W994-T997 WeakPolarHBondContact CA-OG1 3.22Å; W994-T997 PolarHBondContact O-OG1 2.76Å; T997-G999 VanDerWaalsContact C-N 3.32Å; T997-G999 PolarHBondContact O-N 3.08Å; T997-S1000 PolarHBondContact O-N 2.97Å; T997-S1000 VanDerWaalsContact O-N 3.12Å; T997-V1001 WeakPolarHBondContact O-CG2 3.46Å; T997-V1001 PolarHBondContact O-N 3.22Å
998	A	34.3	Very low	33.3	Very low	47 Å²	47	109.4 Å²	109.4	39%	0.388	61%	0.61	S	S	.	*	H	α-helix	trans	-61.4	-41.2	169.5	0	0	0	0	0	111.6	W994 S1000 V1001 A1002	W994-A998 HydrophobicContact CE3-CB 4.47Å; W994-A998 WeakPolarHBondContact O-CB 3.31Å; W994-A998 PolarHBondContact O-N 2.77Å; A998-S1000 PolarHBondContact O-N 3.14Å; A998-V1001 PolarHBondContact O-N 2.95Å; A998-A1002 VanDerWaalsContact O-CB 3.24Å; A998-A1002 WeakPolarHBondContact O-CB 3.44Å; A998-A1002 PolarHBondContact O-N 3.37Å
999	G	36.5	Very low	33.4	Very low	22 Å²	22	113.8 Å²	113.8	23%	0.227	63%	0.625	C	S	.	*	H	α-helix	trans	-65.6	-21.2	173.5	0	0	0	0	0	114.4	L995 T997 R1003	L995-G999 WeakPolarHBondContact O-CA 3.42Å; L995-G999 PolarHBondContact O-N 2.7Å; T997-G999 VanDerWaalsContact C-N 3.32Å; T997-G999 PolarHBondContact O-N 3.08Å; G999-R1003 VanDerWaalsContact O-CD 3.27Å; G999-R1003 WeakPolarHBondContact O-CD 3.42Å; G999-R1003 VanDerWaalsContact O-CG 3.23Å; G999-R1003 WeakPolarHBondContact O-CG 3.41Å; G999-R1003 PolarHBondContact O-NE 2.79Å
1000	S	39.7	Very low	33.6	Very low	48 Å²	48	114.3 Å²	114.3	34%	0.336	63%	0.628	S	S	.	*	H	α-helix	trans	-91.5	-36.5	174.6	-62.7	0	0	0	0	112.6	D996 T997 A998 A1002 R1003 L1004	D996-S1000 VanDerWaalsContact O-CB 3.26Å; D996-S1000 WeakPolarHBondContact O-CB 3.24Å; D996-S1000 PolarHBondContact O-N 2.92Å; D996-S1000 PolarHBondContact O-OG 2.86Å; T997-S1000 PolarHBondContact O-N 2.97Å; T997-S1000 VanDerWaalsContact O-N 3.12Å; A998-S1000 PolarHBondContact O-N 3.14Å; S1000-A1002 VanDerWaalsContact C-N 3.31Å; S1000-A1002 PolarHBondContact O-N 2.96Å; S1000-R1003 CarbonylContact O-C 3.59Å; S1000-R1003 WeakPolarHBondContact O-CA 3.47Å; S1000-R1003 WeakPolarHBondContact O-CB 3.08Å; S1000-R1003 PolarHBondContact O-N 3.23Å; S1000-L1004 PolarHBondContact O-N 3.32Å
1001	V	35.5	Very low	33.7	Very low	79 Å²	79	114.5 Å²	114.5	48%	0.479	62%	0.621	S	S	.	*	H	α-helix	trans	-63.6	-38.7	169.7	171.5	0	0	0	0	110.5	T997 A998 R1003 L1004 L1005	T997-V1001 WeakPolarHBondContact O-CG2 3.46Å; T997-V1001 PolarHBondContact O-N 3.22Å; A998-V1001 PolarHBondContact O-N 2.95Å; V1001-R1003 PolarHBondContact O-N 2.78Å; V1001-L1004 PolarHBondContact O-N 3.16Å; V1001-L1004 VanDerWaalsContact O-N 3.1Å; V1001-L1005 HydrophobicContact CG1-CD1 3.69Å; V1001-L1005 HydrophobicContact CG1-CG 4.21Å; V1001-L1005 PolarHBondContact O-N 2.87Å
1002	A	35.6	Very low	33.7	Very low	62 Å²	62	112.3 Å²	112.3	51%	0.512	61%	0.613	S	S	.	*	H	α-helix	trans	-67	-10.5	170.6	0	0	0	0	0	114.5	A998 S1000	A998-A1002 VanDerWaalsContact O-CB 3.24Å; A998-A1002 WeakPolarHBondContact O-CB 3.44Å; A998-A1002 PolarHBondContact O-N 3.37Å; S1000-A1002 VanDerWaalsContact C-N 3.31Å; S1000-A1002 PolarHBondContact O-N 2.96Å
1003	R	36.9	Very low	33.9	Very low	183 Å²	183	111.3 Å²	111.3	69%	0.691	60%	0.604	S	S	*	*	H	α-helix	trans	-98.9	-19.7	170	-69.2	166	-167.5	148.5	6.3	113	G999 S1000 V1001	G999-R1003 VanDerWaalsContact O-CD 3.27Å; G999-R1003 WeakPolarHBondContact O-CD 3.42Å; G999-R1003 VanDerWaalsContact O-CG 3.23Å; G999-R1003 WeakPolarHBondContact O-CG 3.41Å; G999-R1003 PolarHBondContact O-NE 2.79Å; S1000-R1003 CarbonylContact O-C 3.59Å; S1000-R1003 WeakPolarHBondContact O-CA 3.47Å; S1000-R1003 WeakPolarHBondContact O-CB 3.08Å; S1000-R1003 PolarHBondContact O-N 3.23Å; V1001-R1003 PolarHBondContact O-N 2.78Å
1004	L	37.4	Very low	33.6	Very low	147 Å²	147	113.1 Å²	113.1	77%	0.77	61%	0.61	S	S	*	*	H	α-helix	trans	-94.3	-27.7	179.7	-76.8	163.5	0	0	0	113.3	S1000 V1001 G1006	S1000-L1004 PolarHBondContact O-N 3.32Å; V1001-L1004 PolarHBondContact O-N 3.16Å; V1001-L1004 VanDerWaalsContact O-N 3.1Å; L1004-G1006 PolarHBondContact O-N 2.89Å
1005	L	32.4	Very low	33.6	Very low	134 Å²	134	107.7 Å²	107.7	70%	0.702	61%	0.606	S	S	*	*	S	Bend	trans	-89	40	175.2	-64.3	176.8	0	0	0	113	V1001 Q1007	V1001-L1005 HydrophobicContact CG1-CD1 3.69Å; V1001-L1005 HydrophobicContact CG1-CG 4.21Å; V1001-L1005 PolarHBondContact O-N 2.87Å; L1005-Q1007 VanDerWaalsContact C-N 3.34Å; L1005-Q1007 PolarHBondContact O-N 3.01Å
1006	G	26.8	Very low	33.6	Very low	65 Å²	65	111.3 Å²	111.3	67%	0.67	61%	0.612	S	S	*	*			trans	-77.7	63.1	-171	0	0	0	0	0	115.6	L1004	L1004-G1006 PolarHBondContact O-N 2.89Å
1007	Q	27.6	Very low	33.6	Very low	189 Å²	189	113.1 Å²	113.1	88%	0.883	62%	0.622	S	S	*	*			trans	-152.6	28.4	174.1	-130.5	167	75	0	0	117.1	L1005	L1005-Q1007 VanDerWaalsContact C-N 3.34Å; L1005-Q1007 PolarHBondContact O-N 3.01Å
1008	T	28.7	Very low	33.4	Very low	121 Å²	121	113.5 Å²	113.5	74%	0.742	62%	0.62	S	S	*	*	S	Bend	trans	-133	157	167.7	55.2	0	0	0	0	112.1	N1010	T1008-N1010 VanDerWaalsContact C-N 3.33Å; T1008-N1010 PolarHBondContact O-N 3.41Å; T1008-N1010 VanDerWaalsContact O-N 3.1Å
1009	M	29.7	Very low	33.4	Very low	162 Å²	162	114.8 Å²	114.8	80%	0.798	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-72.4	-8.6	-151.4	-64.8	-177.3	69.5	0	0	117.6	L1011 V1012	M1009-L1011 PolarHBondContact O-N 3.21Å; M1009-V1012 PolarHBondContact O-N 3.19Å
1010	N	33.9	Very low	33.3	Very low	123 Å²	123	116.4 Å²	116.4	66%	0.658	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-73.7	3.6	-160.9	-64	-6.1	0	0	0	116.4	T1008	T1008-N1010 VanDerWaalsContact C-N 3.33Å; T1008-N1010 PolarHBondContact O-N 3.41Å; T1008-N1010 VanDerWaalsContact O-N 3.1Å
1011	L	31.2	Very low	33.1	Very low	121 Å²	121	120.5 Å²	120.5	63%	0.634	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-104.3	-11	176.1	-88.2	163.2	0	0	0	114.4	M1009	M1009-L1011 PolarHBondContact O-N 3.21Å
1012	V	30.3	Very low	33	Very low	82 Å²	82	118.9 Å²	118.9	50%	0.497	64%	0.643	S	S	.	*	S	Bend	trans	-78.5	-27.4	178.2	177.7	0	0	0	0	111.9	M1009	M1009-V1012 PolarHBondContact O-N 3.19Å
1013	E	34.9	Very low	33	Very low	151 Å²	151	117.5 Å²	117.5	71%	0.706	63%	0.632	S	S	*	*	S	Bend	trans	-82.7	-35.4	178.9	-59.8	-168.6	144.2	0	0	112.3	A1015 R1016	E1013-A1015 PolarHBondContact O-N 3.2Å; E1013-A1015 VanDerWaalsContact O-N 3.12Å; E1013-R1016 PolarHBondContact O-N 3.06Å
1014	M	30.8	Very low	33	Very low	146 Å²	146	115.8 Å²	115.8	72%	0.719	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	-12.9	172	-62.2	-169.6	-170.5	0	0	113.8
1015	A	32.6	Very low	32.8	Very low	77 Å²	77	116 Å²	116	64%	0.636	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-2.1	-175.3	0	0	0	0	0	114.7	E1013	E1013-A1015 PolarHBondContact O-N 3.2Å; E1013-A1015 VanDerWaalsContact O-N 3.12Å
1016	R	34.1	Very low	32.8	Very low	185 Å²	185	112.4 Å²	112.4	70%	0.698	61%	0.605	S	S	*	*	S	Bend	trans	-102.8	-21.9	-167.8	-73	178.8	173.2	165.4	-1	116.4	E1013	E1013-R1016 PolarHBondContact O-N 3.06Å
1017	D	38.8	Very low	33.1	Very low	141 Å²	141	119.3 Å²	119.3	75%	0.754	61%	0.611	S	S	*	*	S	Bend	trans	-110.8	14.8	-171.9	-72.4	-34	0	0	0	115.9
1018	L	34.1	Very low	33.6	Very low	99 Å²	99	117.2 Å²	117.2	52%	0.518	60%	0.601	S	S	.	*	S	Bend	trans	-107.4	115	167.2	-93	82.3	0	0	0	111.5	G1020 A1023	L1018-G1020 PolarHBondContact O-N 2.84Å; L1018-A1023 HydrophobicContact CB-CB 4.31Å; L1018-A1023 HydrophobicContact CD2-CB 4.29Å
1019	P	34.2	Very low	33.8	Very low	73 Å²	73	117.8 Å²	117.8	47%	0.474	60%	0.599	S	S	.	*			trans	-55	138.3	168.5	-25	33.5	0	0	0	111.1	F1021 V1022 A1023	P1019-F1021 HydrophobicContact CB-CD1 4.26Å; P1019-F1021 HydrophobicContact CB-CE1 4.43Å; P1019-F1021 PolarHBondContact O-N 2.83Å; P1019-V1022 HydrophobicContact CB-CB 4.32Å; P1019-V1022 HydrophobicContact CB-CG2 4.05Å; P1019-V1022 HydrophobicContact CG-CG2 4.15Å; P1019-V1022 CarbonylContact O-C 2.94Å; P1019-V1022 WeakPolarHBondContact O-CA 3.35Å; P1019-V1022 WeakPolarHBondContact O-CB 3.29Å; P1019-V1022 PolarHBondContact O-N 2.94Å; P1019-A1023 PolarHBondContact O-N 2.79Å
1020	G	33.2	Very low	33.8	Very low	56 Å²	56	115.5 Å²	115.5	58%	0.577	60%	0.597	S	S	*	*	H	α-helix	trans	-56.8	-28.3	-172.7	0	0	0	0	0	115.2	L1018 K1024	L1018-G1020 PolarHBondContact O-N 2.84Å; G1020-K1024 PolarHBondContact O-N 3.43Å
1021	F	35.6	Very low	33.5	Very low	134 Å²	134	113 Å²	113	59%	0.588	59%	0.594	S	S	*	*	H	α-helix	trans	-76.1	-33.5	172.4	96.7	-95	0	0	0	112.7	P1019 K1024 R1025	P1019-F1021 HydrophobicContact CB-CD1 4.26Å; P1019-F1021 HydrophobicContact CB-CE1 4.43Å; P1019-F1021 PolarHBondContact O-N 2.83Å; F1021-K1024 PolarHBondContact O-N 3.43Å; F1021-R1025 WeakPolarHBondContact O-CB 3.35Å; F1021-R1025 PolarHBondContact O-N 3.32Å
1022	V	34.3	Very low	33.5	Very low	46 Å²	46	118.3 Å²	118.3	28%	0.279	61%	0.606	S	S	.	*	H	α-helix	trans	-71.1	-40.4	173.2	179.1	0	0	0	0	109.9	P1019 K1024 R1025 C1026	P1019-V1022 HydrophobicContact CB-CB 4.32Å; P1019-V1022 HydrophobicContact CB-CG2 4.05Å; P1019-V1022 HydrophobicContact CG-CG2 4.15Å; P1019-V1022 CarbonylContact O-C 2.94Å; P1019-V1022 WeakPolarHBondContact O-CA 3.35Å; P1019-V1022 WeakPolarHBondContact O-CB 3.29Å; P1019-V1022 PolarHBondContact O-N 2.94Å; V1022-K1024 VanDerWaalsContact C-N 3.33Å; V1022-K1024 PolarHBondContact O-N 3.19Å; V1022-R1025 PolarHBondContact O-N 3.05Å; V1022-R1025 VanDerWaalsContact O-N 3.14Å; V1022-C1026 WeakPolarHBondContact O-CB 3.03Å; V1022-C1026 PolarHBondContact O-N 2.82Å; V1022-C1026 PolarHBondContact O-SG 3.08Å; V1022-C1026 VanDerWaalsContact O-SG 3.38Å
1023	A	35.6	Very low	33.3	Very low	33 Å²	33	122.9 Å²	122.9	27%	0.273	62%	0.622	S	S	.	*	H	α-helix	trans	-58.6	-43	170.2	0	0	0	0	0	112	L1018 P1019 R1027	L1018-A1023 HydrophobicContact CB-CB 4.31Å; L1018-A1023 HydrophobicContact CD2-CB 4.29Å; P1019-A1023 PolarHBondContact O-N 2.79Å; A1023-R1027 VanDerWaalsContact O-CB 3.29Å; A1023-R1027 WeakPolarHBondContact O-CB 3.15Å; A1023-R1027 WeakPolarHBondContact O-CG 3.22Å; A1023-R1027 PolarHBondContact O-N 3.13Å
1024	K	36.6	Very low	32.9	Very low	146 Å²	146	122.7 Å²	122.7	64%	0.635	63%	0.626	S	S	*	*	H	α-helix	trans	-64.3	-42.3	171	-86.5	-177.8	174.2	176.2	0	112.7	G1020 F1021 V1022 R1027 Q1028	G1020-K1024 PolarHBondContact O-N 3.43Å; F1021-K1024 PolarHBondContact O-N 3.43Å; V1022-K1024 VanDerWaalsContact C-N 3.33Å; V1022-K1024 PolarHBondContact O-N 3.19Å; K1024-R1027 CarbonylContact O-C 3.55Å; K1024-R1027 PolarHBondContact O-N 3.46Å; K1024-Q1028 WeakPolarHBondContact O-CB 2.86Å; K1024-Q1028 VanDerWaalsContact O-CG 3.23Å; K1024-Q1028 WeakPolarHBondContact O-CG 3.38Å; K1024-Q1028 PolarHBondContact O-N 2.63Å
1025	R	32.8	Very low	32.9	Very low	153 Å²	153	122.5 Å²	122.5	58%	0.577	63%	0.627	S	S	*	*	H	α-helix	trans	-74.6	-37	-174.6	-156.7	165.8	-170	153.8	-0.9	112	F1021 V1022 Q1028 L1029	F1021-R1025 WeakPolarHBondContact O-CB 3.35Å; F1021-R1025 PolarHBondContact O-N 3.32Å; V1022-R1025 PolarHBondContact O-N 3.05Å; V1022-R1025 VanDerWaalsContact O-N 3.14Å; R1025-Q1028 CarbonylContact O-C 3.46Å; R1025-Q1028 PolarHBondContact O-N 2.71Å; R1025-L1029 HydrophobicContact CG-CD1 4.15Å; R1025-L1029 VanDerWaalsContact O-CB 3.31Å; R1025-L1029 WeakPolarHBondContact O-CB 3.13Å; R1025-L1029 WeakPolarHBondContact O-CG 3.37Å; R1025-L1029 PolarHBondContact O-N 2.83Å
1026	C	33.3	Very low	32.6	Very low	57 Å²	57	127.2 Å²	127.2	39%	0.385	64%	0.639	S	S	.	*	H	α-helix	trans	-65.8	-43.4	167.4	-65.5	0	0	0	0	110.9	V1022 Q1028 L1029 C1030	V1022-C1026 WeakPolarHBondContact O-CB 3.03Å; V1022-C1026 PolarHBondContact O-N 2.82Å; V1022-C1026 PolarHBondContact O-SG 3.08Å; V1022-C1026 VanDerWaalsContact O-SG 3.38Å; C1026-Q1028 PolarHBondContact O-N 3.05Å; C1026-L1029 PolarHBondContact O-N 3.5Å; C1026-L1029 VanDerWaalsContact O-N 3.15Å; C1026-C1030 VanDerWaalsContact O-CB 3.31Å; C1026-C1030 WeakPolarHBondContact O-CB 3.36Å; C1026-C1030 PolarHBondContact O-N 3.32Å; C1026-C1030 PolarHBondContact O-SG 3.25Å; C1026-C1030 VanDerWaalsContact O-SG 3.4Å
1027	R	32.5	Very low	32.1	Very low	210 Å²	210	122.3 Å²	122.3	79%	0.792	63%	0.63	S	S	*	*	H	α-helix	trans	-61.7	-26.4	170.5	-81	-177.9	167.5	172.6	-2.6	113.9	A1023 K1024 A1031	A1023-R1027 VanDerWaalsContact O-CB 3.29Å; A1023-R1027 WeakPolarHBondContact O-CB 3.15Å; A1023-R1027 WeakPolarHBondContact O-CG 3.22Å; A1023-R1027 PolarHBondContact O-N 3.13Å; K1024-R1027 CarbonylContact O-C 3.55Å; K1024-R1027 PolarHBondContact O-N 3.46Å; R1027-A1031 WeakPolarHBondContact O-CB 3.49Å
1028	Q	37.8	Very low	31.5	Very low	145 Å²	145	122.9 Å²	122.9	68%	0.678	63%	0.631	S	S	*	*	H	α-helix	trans	-88.5	-15.1	175.9	-75.2	170.8	-23.8	0	0	113.8	K1024 R1025 C1026	K1024-Q1028 WeakPolarHBondContact O-CB 2.86Å; K1024-Q1028 VanDerWaalsContact O-CG 3.23Å; K1024-Q1028 WeakPolarHBondContact O-CG 3.38Å; K1024-Q1028 PolarHBondContact O-N 2.63Å; R1025-Q1028 CarbonylContact O-C 3.46Å; R1025-Q1028 PolarHBondContact O-N 2.71Å; C1026-Q1028 PolarHBondContact O-N 3.05Å
1029	L	34.1	Very low	31.2	Very low	134 Å²	134	124.9 Å²	124.9	70%	0.702	64%	0.641	S	S	*	*	H	α-helix	trans	-102.5	-27.5	178.1	-71.1	169.7	0	0	0	112.7	R1025 C1026 A1031	R1025-L1029 HydrophobicContact CG-CD1 4.15Å; R1025-L1029 VanDerWaalsContact O-CB 3.31Å; R1025-L1029 WeakPolarHBondContact O-CB 3.13Å; R1025-L1029 WeakPolarHBondContact O-CG 3.37Å; R1025-L1029 PolarHBondContact O-N 2.83Å; C1026-L1029 PolarHBondContact O-N 3.5Å; C1026-L1029 VanDerWaalsContact O-N 3.15Å; L1029-A1031 VanDerWaalsContact C-N 3.34Å
1030	C	29.8	Very low	30.8	Very low	113 Å²	113	128.8 Å²	128.8	76%	0.764	66%	0.658	S	S	*	*	S	Bend	trans	-88.3	3.3	172.7	-59.9	0	0	0	0	113.3	C1026 R1032	C1026-C1030 VanDerWaalsContact O-CB 3.31Å; C1026-C1030 WeakPolarHBondContact O-CB 3.36Å; C1026-C1030 PolarHBondContact O-N 3.32Å; C1026-C1030 PolarHBondContact O-SG 3.25Å; C1026-C1030 VanDerWaalsContact O-SG 3.4Å; C1030-R1032 PolarHBondContact O-N 2.91Å
1031	A	27.9	Very low	30.6	Very low	72 Å²	72	129.6 Å²	129.6	60%	0.595	66%	0.655	S	S	*	*			trans	-99.8	50	179	0	0	0	0	0	112.5	R1027 L1029	R1027-A1031 WeakPolarHBondContact O-CB 3.49Å; L1029-A1031 VanDerWaalsContact C-N 3.34Å
1032	R	30.2	Very low	30.5	Very low	231 Å²	231	127.7 Å²	127.7	87%	0.872	66%	0.658	S	S	*	*			trans	-142.1	100.4	168.1	-82	-166.6	166.7	146.4	-0.9	111	C1030	C1030-R1032 PolarHBondContact O-N 2.91Å
1033	E	26.6	Very low	30.5	Very low	178 Å²	178	130.9 Å²	130.9	83%	0.832	67%	0.674	S	S	*	*			trans	-55.7	145.2	159.7	-66	137.8	-146.4	0	0	110
1034	N	26.9	Very low	30.4	Very low	148 Å²	148	133.7 Å²	133.7	79%	0.791	69%	0.687	S	S	*	*			trans	59.9	79.3	166.2	-55.3	-37.4	0	0	0	117.9
1035	L	30.4	Very low	30.4	Very low	142 Å²	142	132.4 Å²	132.4	74%	0.743	69%	0.686	S	S	*	*			trans	-175.2	101.8	151.3	-101.9	149.7	0	0	0	108.6	T1037	L1035-T1037 HydrophobicContact CD2-CG2 3.88Å; L1035-T1037 WeakPolarHBondContact CD2-OG1 3.23Å; L1035-T1037 HydrophobicContact CG-CG2 4.21Å
1036	I	25.5	Very low	30.8	Very low	175 Å²	175	130.6 Å²	130.6	90%	0.897	69%	0.688	S	S	*	*				-106.3	117.6	75.5	-64.1	174.5	0	0	0	112.5
1037	T	24.6	Very low	31	Very low	83 Å²	83	132.1 Å²	132.1	51%	0.509	69%	0.692	S	S	.	*			trans	-86	-168.4	164.1	54.3	0	0	0	0	110.6	L1035	L1035-T1037 HydrophobicContact CD2-CG2 3.88Å; L1035-T1037 WeakPolarHBondContact CD2-OG1 3.23Å; L1035-T1037 HydrophobicContact CG-CG2 4.21Å
1038	I	26.5	Very low	31.1	Very low	152 Å²	152	126.1 Å²	126.1	78%	0.779	68%	0.679	S	S	*	*			trans	86.3	96.1	-177.7	-51.6	164.1	0	0	0	110.6
1039	I	26.3	Very low	31.4	Very low	142 Å²	142	121.9 Å²	121.9	73%	0.728	66%	0.663	S	S	*	*			cis	-140.5	141.1	15.5	-81.8	143.5	0	0	0	111.1	S1041	I1039-S1041 PolarHBondContact O-N 3.33Å
1040	D	26.3	Very low	32.1	Very low	155 Å²	155	118 Å²	118	83%	0.829	65%	0.647	S	S	*	*			trans	-71.6	114.1	165.5	-48.4	-83.6	0	0	0	111.1
1041	S	28.3	Very low	32.4	Very low	73 Å²	73	117.9 Å²	117.9	51%	0.51	64%	0.635	S	S	.	*			trans	-165.8	131.3	162.1	-74.4	0	0	0	0	109.7	I1039 D1043	I1039-S1041 PolarHBondContact O-N 3.33Å; S1041-D1043 PolarHBondContact O-N 2.78Å
1042	S	34.4	Very low	32.8	Very low	93 Å²	93	123 Å²	123	65%	0.65	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.8	-25.7	174.3	31.2	0	0	0	0	113.5	V1044	S1042-V1044 PolarHBondContact O-N 3.38Å
1043	D	34.6	Very low	33.5	Very low	113 Å²	113	116.3 Å²	116.3	60%	0.604	62%	0.62	S	S	*	*	H	α-helix	trans	-86.2	-14.5	-153	-46.7	-11.1	0	0	0	113.5	S1041	S1041-D1043 PolarHBondContact O-N 2.78Å
1044	V	32.4	Very low	34.2	Very low	92 Å²	92	113.2 Å²	113.2	56%	0.558	61%	0.605	S	S	*	*	H	α-helix	trans	-86.6	-20.6	-178.9	-175	0	0	0	0	111.9	S1042 D1046 D1047 V1048	S1042-V1044 PolarHBondContact O-N 3.38Å; V1044-D1046 VanDerWaalsContact C-N 3.35Å; V1044-D1047 PolarHBondContact O-N 2.88Å; V1044-V1048 HydrophobicContact CG1-CG2 4.13Å; V1044-V1048 WeakPolarHBondContact O-CB 3.02Å; V1044-V1048 WeakPolarHBondContact O-CG2 3.42Å; V1044-V1048 PolarHBondContact O-N 2.96Å
1045	I	38.4	Very low	34.5	Very low	119 Å²	119	112.1 Å²	112.1	61%	0.61	59%	0.594	S	S	*	*	H	α-helix	trans	-67.3	-39.9	174.8	-63.2	177.3	0	0	0	109.8	T1049	I1045-T1049 HydrophobicContact CG2-CG2 4.37Å; I1045-T1049 VanDerWaalsContact O-CB 3.31Å; I1045-T1049 WeakPolarHBondContact O-CB 3.32Å; I1045-T1049 VanDerWaalsContact O-CG2 3.25Å; I1045-T1049 WeakPolarHBondContact O-CG2 3.33Å; I1045-T1049 PolarHBondContact O-N 2.58Å; I1045-T1049 PolarHBondContact O-OG1 2.93Å
1046	D	39.6	Very low	34.9	Very low	115 Å²	115	109.2 Å²	109.2	62%	0.615	58%	0.579	S	S	*	*	H	α-helix	trans	-65.5	-36	173.8	-81.9	-7.1	0	0	0	112.5	V1044 T1049 S1050	V1044-D1046 VanDerWaalsContact C-N 3.35Å; D1046-T1049 WeakPolarHBondContact CA-OG1 3.44Å; D1046-T1049 PolarHBondContact O-OG1 2.68Å; D1046-S1050 WeakPolarHBondContact O-CA 3.41Å; D1046-S1050 WeakPolarHBondContact O-CB 3.46Å; D1046-S1050 PolarHBondContact O-N 2.69Å; D1046-S1050 PolarHBondContact O-OG 3.18Å
1047	D	38.8	Very low	35.5	Very low	90 Å²	90	106.2 Å²	106.2	48%	0.481	56%	0.561	S	S	.	*	H	α-helix	trans	-77.1	-38.8	-179.4	-156	23.7	0	0	0	112	V1044 S1050 Q1051	V1044-D1047 PolarHBondContact O-N 2.88Å; D1047-S1050 PolarHBondContact O-N 3.17Å; D1047-Q1051 WeakPolarHBondContact O-CB 3.41Å; D1047-Q1051 VanDerWaalsContact O-CG 3.28Å; D1047-Q1051 WeakPolarHBondContact O-CG 3.41Å; D1047-Q1051 PolarHBondContact O-N 2.87Å
1048	V	34.4	Very low	35.9	Very low	83 Å²	83	108 Å²	108	50%	0.503	57%	0.565	S	S	.	*	H	α-helix	trans	-71.4	-37.1	173.7	174.7	0	0	0	0	111.5	V1044 R1052	V1044-V1048 HydrophobicContact CG1-CG2 4.13Å; V1044-V1048 WeakPolarHBondContact O-CB 3.02Å; V1044-V1048 WeakPolarHBondContact O-CG2 3.42Å; V1044-V1048 PolarHBondContact O-N 2.96Å; V1048-R1052 VanDerWaalsContact O-CB 3.31Å; V1048-R1052 WeakPolarHBondContact O-CB 3.15Å; V1048-R1052 PolarHBondContact O-N 3.27Å
1049	T	42.9	Very low	36.3	Very low	56 Å²	56	107.9 Å²	107.9	34%	0.344	56%	0.559	S	S	.	*	H	α-helix	trans	-70.2	-38.3	171.6	56.4	0	0	0	0	111.7	I1045 D1046 Q1051 R1052 I1053	I1045-T1049 HydrophobicContact CG2-CG2 4.37Å; I1045-T1049 VanDerWaalsContact O-CB 3.31Å; I1045-T1049 WeakPolarHBondContact O-CB 3.32Å; I1045-T1049 VanDerWaalsContact O-CG2 3.25Å; I1045-T1049 WeakPolarHBondContact O-CG2 3.33Å; I1045-T1049 PolarHBondContact O-N 2.58Å; I1045-T1049 PolarHBondContact O-OG1 2.93Å; D1046-T1049 WeakPolarHBondContact CA-OG1 3.44Å; D1046-T1049 PolarHBondContact O-OG1 2.68Å; T1049-Q1051 PolarHBondContact O-N 2.8Å; T1049-R1052 CarbonylContact O-C 2.98Å; T1049-R1052 WeakPolarHBondContact O-CA 3.33Å; T1049-R1052 WeakPolarHBondContact O-CB 3.22Å; T1049-R1052 PolarHBondContact O-N 3.45Å; T1049-R1052 VanDerWaalsContact O-N 3.09Å; T1049-I1053 WeakPolarHBondContact O-CB 3.24Å; T1049-I1053 VanDerWaalsContact O-CG1 3.23Å; T1049-I1053 WeakPolarHBondContact O-CG1 3.28Å; T1049-I1053 PolarHBondContact O-N 3.33Å
1050	S	48.5	Very low	36.7	Very low	53 Å²	53	109.2 Å²	109.2	37%	0.371	56%	0.56	S	S	.	*	H	α-helix	trans	-60.9	-42.6	172.6	-69	0	0	0	0	112.1	D1046 D1047 R1052 I1053 Q1054	D1046-S1050 WeakPolarHBondContact O-CA 3.41Å; D1046-S1050 WeakPolarHBondContact O-CB 3.46Å; D1046-S1050 PolarHBondContact O-N 2.69Å; D1046-S1050 PolarHBondContact O-OG 3.18Å; D1047-S1050 PolarHBondContact O-N 3.17Å; S1050-R1052 VanDerWaalsContact C-N 3.35Å; S1050-I1053 PolarHBondContact O-N 2.98Å; S1050-Q1054 WeakPolarHBondContact O-CG 3.5Å; S1050-Q1054 PolarHBondContact O-N 3.42Å
1051	Q	36	Very low	37	Very low	110 Å²	110	106 Å²	106	51%	0.514	55%	0.549	S	S	.	.	H	α-helix	trans	-65.4	-36.9	172.2	-72.2	175.3	42.8	0	0	111.7	D1047 T1049 Q1054 F1055	D1047-Q1051 WeakPolarHBondContact O-CB 3.41Å; D1047-Q1051 VanDerWaalsContact O-CG 3.28Å; D1047-Q1051 WeakPolarHBondContact O-CG 3.41Å; D1047-Q1051 PolarHBondContact O-N 2.87Å; T1049-Q1051 PolarHBondContact O-N 2.8Å; Q1051-Q1054 PolarHBondContact O-N 2.83Å; Q1051-F1055 VanDerWaalsContact O-CB 3.24Å; Q1051-F1055 WeakPolarHBondContact O-CB 3.32Å; Q1051-F1055 PolarHBondContact O-N 2.77Å
1052	R	38.1	Very low	37.1	Very low	180 Å²	180	113.3 Å²	113.3	68%	0.679	57%	0.565	S	S	*	*	H	α-helix	trans	-68.8	-32.4	174.8	-149.6	173.8	-158.9	177.1	4.7	112.2	V1048 T1049 S1050 N1056	V1048-R1052 VanDerWaalsContact O-CB 3.31Å; V1048-R1052 WeakPolarHBondContact O-CB 3.15Å; V1048-R1052 PolarHBondContact O-N 3.27Å; T1049-R1052 CarbonylContact O-C 2.98Å; T1049-R1052 WeakPolarHBondContact O-CA 3.33Å; T1049-R1052 WeakPolarHBondContact O-CB 3.22Å; T1049-R1052 PolarHBondContact O-N 3.45Å; T1049-R1052 VanDerWaalsContact O-N 3.09Å; S1050-R1052 VanDerWaalsContact C-N 3.35Å; R1052-N1056 VanDerWaalsContact O-CB 3.32Å; R1052-N1056 WeakPolarHBondContact O-CB 3.19Å; R1052-N1056 VanDerWaalsContact O-CG 3.24Å; R1052-N1056 PolarHBondContact O-N 3.03Å; R1052-N1056 PolarHBondContact O-ND2 2.83Å
1053	I	44.3	Very low	36.6	Very low	91 Å²	91	118.5 Å²	118.5	47%	0.467	58%	0.576	S	S	.	*	H	α-helix	trans	-68.5	-53.3	172.2	-72	162.1	0	0	0	109.3	T1049 S1050 F1055 N1056 E1057	T1049-I1053 WeakPolarHBondContact O-CB 3.24Å; T1049-I1053 VanDerWaalsContact O-CG1 3.23Å; T1049-I1053 WeakPolarHBondContact O-CG1 3.28Å; T1049-I1053 PolarHBondContact O-N 3.33Å; S1050-I1053 PolarHBondContact O-N 2.98Å; I1053-F1055 VanDerWaalsContact C-N 3.26Å; I1053-F1055 PolarHBondContact O-N 3Å; I1053-N1056 CarbonylContact O-C 3.49Å; I1053-N1056 WeakPolarHBondContact O-CA 3.46Å; I1053-N1056 PolarHBondContact O-N 2.88Å; I1053-E1057 HydrophobicContact CG2-CG 4.42Å; I1053-E1057 WeakPolarHBondContact O-CG 3.38Å; I1053-E1057 PolarHBondContact O-N 3.36Å
1054	Q	40.9	Very low	36.3	Very low	113 Å²	113	118.6 Å²	118.6	53%	0.528	59%	0.586	S	S	.	*	H	α-helix	trans	-56.9	-37.9	174.5	-72.5	-179	7.1	0	0	112.5	S1050 Q1051 E1057 M1058	S1050-Q1054 WeakPolarHBondContact O-CG 3.5Å; S1050-Q1054 PolarHBondContact O-N 3.42Å; Q1051-Q1054 PolarHBondContact O-N 2.83Å; Q1054-E1057 PolarHBondContact O-N 3.48Å; Q1054-M1058 WeakPolarHBondContact O-CB 3.33Å; Q1054-M1058 WeakPolarHBondContact O-CG 3.3Å; Q1054-M1058 PolarHBondContact O-N 2.99Å
1055	F	33	Very low	36	Very low	124 Å²	124	123.2 Å²	123.2	54%	0.544	60%	0.601	S	S	.	*	H	α-helix	trans	-69.7	-34.2	176.2	-153.6	-101.1	0	0	0	112.2	Q1051 I1053 K1059	Q1051-F1055 VanDerWaalsContact O-CB 3.24Å; Q1051-F1055 WeakPolarHBondContact O-CB 3.32Å; Q1051-F1055 PolarHBondContact O-N 2.77Å; I1053-F1055 VanDerWaalsContact C-N 3.26Å; I1053-F1055 PolarHBondContact O-N 3Å; F1055-K1059 HydrophobicContact CD1-CD 4.41Å; F1055-K1059 WeakPolarHBondContact O-CB 3.4Å; F1055-K1059 WeakPolarHBondContact O-CG 3.09Å; F1055-K1059 PolarHBondContact O-N 3.38Å
1056	N	38.7	Very low	35.4	Very low	81 Å²	81	120.4 Å²	120.4	43%	0.433	60%	0.602	S	S	.	*	H	α-helix	trans	-76.2	-30.5	173.1	-77.2	-24.9	0	0	0	112.8	R1052 I1053 K1059 K1060	R1052-N1056 VanDerWaalsContact O-CB 3.32Å; R1052-N1056 WeakPolarHBondContact O-CB 3.19Å; R1052-N1056 VanDerWaalsContact O-CG 3.24Å; R1052-N1056 PolarHBondContact O-N 3.03Å; R1052-N1056 PolarHBondContact O-ND2 2.83Å; I1053-N1056 CarbonylContact O-C 3.49Å; I1053-N1056 WeakPolarHBondContact O-CA 3.46Å; I1053-N1056 PolarHBondContact O-N 2.88Å; N1056-K1059 PolarHBondContact O-N 3.34Å; N1056-K1060 VanDerWaalsContact O-CG 3.31Å; N1056-K1060 WeakPolarHBondContact O-CG 3.35Å; N1056-K1060 PolarHBondContact O-N 3.46Å
1057	E	39.1	Very low	34.7	Very low	113 Å²	113	123.4 Å²	123.4	53%	0.528	61%	0.612	S	S	.	*	H	α-helix	trans	-70.9	-43.6	172	-71.8	-176.9	151.2	0	0	111.6	I1053 Q1054 K1059 K1060	I1053-E1057 HydrophobicContact CG2-CG 4.42Å; I1053-E1057 WeakPolarHBondContact O-CG 3.38Å; I1053-E1057 PolarHBondContact O-N 3.36Å; Q1054-E1057 PolarHBondContact O-N 3.48Å; E1057-K1059 VanDerWaalsContact C-N 3.29Å; E1057-K1059 PolarHBondContact O-N 3.1Å; E1057-K1060 WeakPolarHBondContact O-CB 3.46Å; E1057-K1060 PolarHBondContact O-N 3.21Å; E1057-K1060 VanDerWaalsContact O-N 3.1Å
1058	M	32.3	Very low	34	Very low	121 Å²	121	129.3 Å²	129.3	60%	0.596	63%	0.629	S	S	*	*	H	α-helix	trans	-59	-40.1	169.1	-78.2	-171.2	-84.4	0	0	111.7	Q1054 K1060 S1061	Q1054-M1058 WeakPolarHBondContact O-CB 3.33Å; Q1054-M1058 WeakPolarHBondContact O-CG 3.3Å; Q1054-M1058 PolarHBondContact O-N 2.99Å; M1058-K1060 VanDerWaalsContact C-N 3.33Å; M1058-K1060 PolarHBondContact O-N 2.87Å; M1058-S1061 WeakPolarHBondContact O-CB 3.46Å; M1058-S1061 PolarHBondContact O-N 3.04Å; M1058-S1061 PolarHBondContact O-OG 3.08Å
1059	K	34.2	Very low	33.6	Very low	149 Å²	149	133.3 Å²	133.3	65%	0.648	65%	0.647	S	S	*	*	H	α-helix	trans	-66	-26.8	174.1	-82.1	-179.1	173	-174.8	0	114.4	F1055 N1056 E1057 S1061	F1055-K1059 HydrophobicContact CD1-CD 4.41Å; F1055-K1059 WeakPolarHBondContact O-CB 3.4Å; F1055-K1059 WeakPolarHBondContact O-CG 3.09Å; F1055-K1059 PolarHBondContact O-N 3.38Å; N1056-K1059 PolarHBondContact O-N 3.34Å; E1057-K1059 VanDerWaalsContact C-N 3.29Å; E1057-K1059 PolarHBondContact O-N 3.1Å; K1059-S1061 PolarHBondContact O-N 3.44Å
1060	K	36.7	Very low	32.8	Very low	170 Å²	170	138.4 Å²	138.4	74%	0.739	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-10.7	174.6	-74.4	165.9	-174.2	172.8	0	113.4	N1056 E1057 M1058	N1056-K1060 VanDerWaalsContact O-CG 3.31Å; N1056-K1060 WeakPolarHBondContact O-CG 3.35Å; N1056-K1060 PolarHBondContact O-N 3.46Å; E1057-K1060 WeakPolarHBondContact O-CB 3.46Å; E1057-K1060 PolarHBondContact O-N 3.21Å; E1057-K1060 VanDerWaalsContact O-N 3.1Å; M1058-K1060 VanDerWaalsContact C-N 3.33Å; M1058-K1060 PolarHBondContact O-N 2.87Å
1061	S	32.3	Very low	31.7	Very low	86 Å²	86	147.4 Å²	147.4	60%	0.601	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	-13.8	-163.4	73.8	0	0	0	0	117.6	M1058 K1059	M1058-S1061 WeakPolarHBondContact O-CB 3.46Å; M1058-S1061 PolarHBondContact O-N 3.04Å; M1058-S1061 PolarHBondContact O-OG 3.08Å; K1059-S1061 PolarHBondContact O-N 3.44Å
1062	R	29	Very low	31.2	Very low	227 Å²	227	147.8 Å²	147.8	86%	0.857	71%	0.712	S	S	*	*			trans	-134.6	109.2	-175.2	-69.1	-169.7	177.4	-165.8	-3.3	114.2
1063	K	25.3	Very low	30.9	Very low	203 Å²	203	144.5 Å²	144.5	88%	0.883	72%	0.715	S	S	*	*			trans	-99	163.8	160.1	-64.9	-180	177.9	-179	0	109.6
1064	S	26.7	Very low	29.9	Very low	115 Å²	115	147.6 Å²	147.6	80%	0.804	73%	0.725	S	S	*	*			trans	75.8	150.8	-178.2	82	0	0	0	0	114.9
1065	Q	27.5	Very low	29.2	Very low	189 Å²	189	148.3 Å²	148.3	88%	0.883	73%	0.726	S	S	*	*			trans	60.5	107.4	-163.8	-60.9	-178.1	-19	0	0	113.6
1066	G	25.2	Very low	28.9	Very low	60 Å²	60	147.6 Å²	147.6	62%	0.619	73%	0.728	S	S	*	*			cis	82.9	114.7	4.9	0	0	0	0	0	112.1
1067	E	25.8	Very low	28.2	Very low	178 Å²	178	148.4 Å²	148.4	83%	0.832	74%	0.74	S	S	*	*			trans	64.7	169.9	-177.5	-61.8	167.4	173.8	0	0	114.5
1068	Y	23.4	Very low	27.5	Very low	213 Å²	213	152.8 Å²	152.8	84%	0.835	76%	0.757	S	S	*	*			trans	60.6	84.1	-176.9	-56.5	-83.2	0	0	0	117.5
1069	L	25.9	Very low	27.1	Very low	168 Å²	168	153.2 Å²	153.2	88%	0.88	77%	0.771	S	S	*	*	S	Bend	trans	-169.2	-7.9	132.6	-107.3	171.6	0	0	0	114.4
1070	N	25.6	Very low	26.6	Very low	162 Å²	162	153.2 Å²	153.2	87%	0.866	77%	0.771	S	S	*	*	S	Bend	trans	-81.5	117.2	161.6	-86.8	-19.1	0	0	0	109.9
1071	R	25.9	Very low	26.2	Very low	243 Å²	243	150.5 Å²	150.5	92%	0.917	77%	0.769	S	S	*	*			trans	67.8	130.1	-171.1	-46.1	-178.4	-174.8	-156	0.6	111
1072	S	24.6	Very low	25.9	Very low	117 Å²	117	155.6 Å²	155.6	82%	0.818	78%	0.776	S	S	*	*				-144.2	171.4	57	51.2	0	0	0	0	115
1073	P	33.1	Very low	25.7	Very low	112 Å²	112	149.2 Å²	149.2	73%	0.727	77%	0.766	S	S	*	*			trans	-129	-174.6	-156.3	44.1	-29.3	0	0	0	116.5
1074	F	23.3	Very low	25.7	Very low	155 Å²	155	145.6 Å²	145.6	68%	0.68	76%	0.757	S	S	*	*	S	Bend	trans	-144.9	136.9	160.3	-89.8	-91.5	0	0	0	107.3
1075	F	25.3	Very low	25.7	Very low	129 Å²	129	143 Å²	143	57%	0.566	75%	0.748	S	S	*	*			cis	-122	137.1	-1.5	-64.9	-106.8	0	0	0	107.2	L1090	F1075-L1090 HydrophobicContact CE1-CD2 3.72Å; F1075-L1090 HydrophobicContact CE1-CG 4.07Å; F1075-L1090 HydrophobicContact CZ-CD2 4.01Å; F1075-L1090 HydrophobicContact CZ-CG 4.29Å
1076	D	27	Very low	25.7	Very low	108 Å²	108	143.5 Å²	143.5	58%	0.578	74%	0.743	S	S	*	*				68.3	131.5	58.7	-148.8	48	0	0	0	112
1077	S	23.5	Very low	25.6	Very low	99 Å²	99	150.5 Å²	150.5	69%	0.692	75%	0.753	S	S	*	*			cis	-152.9	132.7	42.6	55.4	0	0	0	0	117.4
1078	K	24.1	Very low	25.7	Very low	204 Å²	204	146.4 Å²	146.4	89%	0.887	74%	0.742	S	S	*	*	S	Bend	trans	175.2	69.9	144.9	-104.2	-179.3	-179.4	179	0	113.2
1079	C	24.9	Very low	25.8	Very low	130 Å²	130	139.8 Å²	139.8	88%	0.878	73%	0.731	S	S	*	*			trans	-174.2	103.4	150	-112	0	0	0	0	110.8
1080	F	24.3	Very low	25.7	Very low	150 Å²	150	137.4 Å²	137.4	66%	0.658	72%	0.718	S	S	*	*			trans	-136.2	120.6	-176.8	-118.2	-80.9	0	0	0	110.5	Y1082	F1080-Y1082 HydrophobicContact CD1-CE2 4.3Å
1081	V	27.9	Very low	25.6	Very low	113 Å²	113	134.4 Å²	134.4	69%	0.685	71%	0.71	S	S	*	*			trans	-157.1	112.4	135.7	173.6	0	0	0	0	108.7
1082	Y	26.1	Very low	25.5	Very low	193 Å²	193	128 Å²	128	76%	0.757	70%	0.703	S	S	*	*			trans	19.3	141	137.8	-66.3	-84.7	0	0	0	121	F1080	F1080-Y1082 HydrophobicContact CD1-CE2 4.3Å
1083	S	25.2	Very low	25.7	Very low	93 Å²	93	127.6 Å²	127.6	65%	0.65	70%	0.697	S	S	*	*			cis	-153.4	-177.7	-2.8	72.7	0	0	0	0	109.7
1084	D	24.4	Very low	25.3	Very low	127 Å²	127	129 Å²	129	68%	0.679	70%	0.704	S	S	*	*			cis	-152	-168.5	16.9	-142	-71.8	0	0	0	111.6
1085	G	26.5	Very low	25.2	Very low	61 Å²	61	126 Å²	126	63%	0.629	70%	0.695	S	S	*	*	S	Bend	trans	134.7	12.6	158.8	0	0	0	0	0	119.4
1086	Y	26.7	Very low	25.1	Very low	199 Å²	199	127.7 Å²	127.7	78%	0.78	71%	0.709	S	S	*	*			trans	55.4	136.1	164.2	-67.8	-99.6	0	0	0	119.2
1087	Y	24.9	Very low	25	Very low	207 Å²	207	127.9 Å²	127.9	81%	0.812	71%	0.706	S	S	*	*			cis	-168.9	-179	-16.5	-137.9	-133.1	0	0	0	106.9
1088	P	28.1	Very low	25.6	Very low	92 Å²	92	128.1 Å²	128.1	60%	0.597	71%	0.706	S	S	*	*				-133	-168.4	-102.1	43.3	-25.2	0	0	0	115.9
1089	A	24.3	Very low	25.6	Very low	74 Å²	74	123.8 Å²	123.8	61%	0.612	70%	0.696	S	S	*	*			trans	71.1	155.8	143.2	0	0	0	0	0	120.3
1090	L	23.8	Very low	25.6	Very low	118 Å²	118	125.1 Å²	125.1	62%	0.618	69%	0.693	S	S	*	*			cis	-178.2	154.8	-32.6	-130.4	151.9	0	0	0	108.2	F1075	F1075-L1090 HydrophobicContact CE1-CD2 3.72Å; F1075-L1090 HydrophobicContact CE1-CG 4.07Å; F1075-L1090 HydrophobicContact CZ-CD2 4.01Å; F1075-L1090 HydrophobicContact CZ-CG 4.29Å
1091	S	24.2	Very low	25.6	Very low	98 Å²	98	124.6 Å²	124.6	69%	0.685	70%	0.702	S	S	*	*			trans	60.2	158.9	156.2	48.9	0	0	0	0	119.5
1092	S	22.9	Very low	25.4	Very low	110 Å²	110	128.5 Å²	128.5	77%	0.769	71%	0.71	S	S	*	*			cis	-165.1	178.5	-19.6	55	0	0	0	0	108
1093	P	30.3	Very low	25.4	Very low	108 Å²	108	126 Å²	126	70%	0.701	71%	0.714	S	S	*	*			trans	-92.7	163.9	-161.9	37.8	-36.7	0	0	0	115.5
1094	T	23.5	Very low	25.4	Very low	142 Å²	142	128.4 Å²	128.4	87%	0.871	72%	0.72	S	S	*	*			trans	-160.4	161.5	147.5	7.8	0	0	0	0	113.7
1095	N	22.3	Very low	25.6	Very low	90 Å²	90	131.7 Å²	131.7	48%	0.481	73%	0.728	S	S	.	*			trans	-84.7	-178.7	-171.9	-53.2	-6.1	0	0	0	113.9
1096	L	23	Very low	25.7	Very low	166 Å²	166	134.1 Å²	134.1	87%	0.869	73%	0.733	S	S	*	*			trans	95.4	135.8	152.2	-67	158.1	0	0	0	120.6
1097	E	24	Very low	25.8	Very low	111 Å²	111	134 Å²	134	52%	0.519	74%	0.736	S	S	.	*			trans	-72.8	-178.5	169.8	-87.2	-166.4	169	0	0	113.6	H1148	E1097-H1148 IonicContact OE1-CE1 2.75Å; E1097-H1148 IonicContact OE1-CG 3.25Å; E1097-H1148 IonicContact OE1-ND1 3.88Å; E1097-H1148 PolarHBondContact OE1-ND1 3.01Å; E1097-H1148 IonicContact OE2-ND1 3.18Å
1098	P	35.3	Very low	26	Very low	105 Å²	105	132.1 Å²	132.1	68%	0.682	74%	0.741	S	S	*	*			cis	-136.4	-135.4	-36.7	38.5	-20.6	0	0	0	110.6
1099	T	25.2	Very low	25.9	Very low	113 Å²	113	133.2 Å²	133.2	69%	0.693	75%	0.751	S	S	*	*			trans	106	85.4	154.9	-35.2	0	0	0	0	118.3
1100	I	24.3	Very low	26	Very low	157 Å²	157	141.1 Å²	141.1	81%	0.805	77%	0.765	S	S	*	*				27.7	121.8	123.9	-53.2	164.7	0	0	0	118.3
1101	V	25.1	Very low	26.1	Very low	139 Å²	139	142.4 Å²	142.4	84%	0.842	77%	0.772	S	S	*	*				-165.3	146.6	128.4	138.5	0	0	0	0	109.6
1102	K	23.8	Very low	26.1	Very low	195 Å²	195	145.6 Å²	145.6	85%	0.848	78%	0.78	S	S	*	*			trans	-95.3	157.1	173.3	-68.1	179.8	176.3	179.6	0	111.2
1103	V	25.8	Very low	26.2	Very low	142 Å²	142	143.9 Å²	143.9	86%	0.861	78%	0.78	S	S	*	*			trans	173.3	159.7	134.2	148.2	0	0	0	0	110
1104	D	24.6	Very low	26.1	Very low	142 Å²	142	146.4 Å²	146.4	76%	0.759	78%	0.784	S	S	*	*			trans	-96.9	176.4	-155.1	-59.5	-85	0	0	0	117.8
1105	F	29.6	Very low	26.3	Very low	196 Å²	196	143 Å²	143	86%	0.86	77%	0.765	S	S	*	*			trans	-67.5	159.5	-173	-51.6	-97.7	0	0	0	115.2
1106	P	28.8	Very low	26.6	Very low	112 Å²	112	147.6 Å²	147.6	73%	0.727	78%	0.78	S	S	*	*				-155.8	158	90.2	39.6	-20.2	0	0	0	119.5
1107	K	27.3	Very low	27.2	Very low	196 Å²	196	143.7 Å²	143.7	85%	0.852	77%	0.767	S	S	*	*			trans	49.3	108.4	139.8	-62.5	172.6	-177.9	177	0	122.5
1108	N	29.3	Very low	27.7	Very low	168 Å²	168	141.3 Å²	141.3	90%	0.898	76%	0.761	S	S	*	*			trans	38.4	117.9	143.1	-64.4	9.4	0	0	0	122.7
1109	S	26.4	Very low	27.6	Very low	116 Å²	116	141.3 Å²	141.3	81%	0.811	76%	0.755	S	S	*	*			trans	-151.3	162.1	141.5	65.7	0	0	0	0	110.8
1110	W	25.7	Very low	28	Very low	239 Å²	239	145.7 Å²	145.7	91%	0.905	76%	0.759	S	S	*	*			trans	-90.2	-175.5	173.6	-83.1	57.6	0	0	0	111.5
1111	D	25.9	Very low	28.6	Very low	145 Å²	145	147.4 Å²	147.4	78%	0.775	76%	0.755	S	S	*	*			trans	89.7	145.4	160.9	-67.5	-40.2	0	0	0	121.8
1112	I	25	Very low	28.9	Very low	166 Å²	166	149.2 Å²	149.2	85%	0.851	75%	0.747	S	S	*	*			trans	68.4	68.4	168.2	-53.4	150	0	0	0	116.7
1113	G	26.2	Very low	29.3	Very low	74 Å²	74	147 Å²	147	76%	0.763	74%	0.738	S	S	*	*				78.6	85.2	108.6	0	0	0	0	0	120.8
1114	M	27.4	Very low	30	Very low	161 Å²	161	144.1 Å²	144.1	79%	0.793	72%	0.72	S	S	*	*			trans	-138.5	160.2	151.5	-79.8	-150	90.8	0	0	112
1115	P	27.1	Very low	30.7	Very low	71 Å²	71	142.2 Å²	142.2	46%	0.461	71%	0.707	S	S	.	*			trans	-71.6	157	-156	-23.9	36.2	0	0	0	117.6	S1117 C1118 L1119	P1115-S1117 PolarHBondContact O-N 2.83Å; P1115-S1117 VanDerWaalsContact O-N 3.12Å; P1115-C1118 WeakPolarHBondContact O-CB 3.3Å; P1115-C1118 PolarHBondContact O-N 3.07Å; P1115-L1119 PolarHBondContact O-N 2.79Å; P1115-L1119 VanDerWaalsContact O-N 3.17Å
1116	K	28.4	Very low	30.9	Very low	186 Å²	186	141.3 Å²	141.3	81%	0.809	70%	0.698	S	S	*	*	H	α-helix	trans	-60.3	-21.5	-179.6	-66.4	-177.1	179.1	179.8	0	114.4	L1119 R1120	K1116-L1119 PolarHBondContact O-N 2.78Å; K1116-R1120 PolarHBondContact O-N 2.71Å
1117	S	36.5	Very low	31.6	Very low	84 Å²	84	141 Å²	141	59%	0.587	69%	0.686	S	S	*	*	H	α-helix	trans	-67.3	-46.4	171	48.1	0	0	0	0	111.7	P1115 L1119 R1120 R1121	P1115-S1117 PolarHBondContact O-N 2.83Å; P1115-S1117 VanDerWaalsContact O-N 3.12Å; S1117-L1119 VanDerWaalsContact C-N 3.27Å; S1117-L1119 PolarHBondContact O-N 2.81Å; S1117-R1120 PolarHBondContact O-N 2.82Å; S1117-R1121 PolarHBondContact O-N 3.47Å
1118	C	33.9	Very low	32.1	Very low	60 Å²	60	135.7 Å²	135.7	41%	0.405	67%	0.667	S	S	.	*	H	α-helix	trans	-66.1	-28.9	173.3	-64.8	0	0	0	0	112.2	P1115 R1122	P1115-C1118 WeakPolarHBondContact O-CB 3.3Å; P1115-C1118 PolarHBondContact O-N 3.07Å; C1118-R1122 WeakPolarHBondContact O-CB 3.26Å; C1118-R1122 VanDerWaalsContact O-CG 3.3Å; C1118-R1122 WeakPolarHBondContact O-CG 3.24Å; C1118-R1122 PolarHBondContact O-N 3.27Å
1119	L	33.8	Very low	32.6	Very low	105 Å²	105	136.2 Å²	136.2	55%	0.55	66%	0.657	S	S	.	*	H	α-helix	trans	-77.1	-37.8	171	-77.6	172.9	0	0	0	113.3	P1115 K1116 S1117 R1122 F1123	P1115-L1119 PolarHBondContact O-N 2.79Å; P1115-L1119 VanDerWaalsContact O-N 3.17Å; K1116-L1119 PolarHBondContact O-N 2.78Å; S1117-L1119 VanDerWaalsContact C-N 3.27Å; S1117-L1119 PolarHBondContact O-N 2.81Å; L1119-R1122 PolarHBondContact O-N 2.76Å; L1119-F1123 WeakPolarHBondContact O-CA 3.2Å; L1119-F1123 WeakPolarHBondContact O-CB 3.27Å; L1119-F1123 PolarHBondContact O-N 2.77Å
1120	R	34.4	Very low	33.2	Very low	206 Å²	206	136 Å²	136	78%	0.777	65%	0.646	S	S	*	*	H	α-helix	trans	-64.7	-40.7	169.9	-94.6	-172.4	174.5	178.1	-0.9	111.5	K1116 S1117 V1124	K1116-R1120 PolarHBondContact O-N 2.71Å; S1117-R1120 PolarHBondContact O-N 2.82Å; R1120-V1124 VanDerWaalsContact O-CB 3.22Å; R1120-V1124 WeakPolarHBondContact O-CB 3.24Å; R1120-V1124 VanDerWaalsContact O-CG2 3.25Å; R1120-V1124 WeakPolarHBondContact O-CG2 3.22Å; R1120-V1124 PolarHBondContact O-N 3.39Å
1121	R	36.4	Very low	34	Very low	193 Å²	193	127 Å²	127	73%	0.728	62%	0.615	S	S	*	*	H	α-helix	trans	-64.4	-49.8	173.1	-131.2	175	-166	162	2.8	111.2	S1117 F1123 V1124 E1125	S1117-R1121 PolarHBondContact O-N 3.47Å; R1121-F1123 PolarHBondContact O-N 2.66Å; R1121-V1124 PolarHBondContact O-N 2.77Å; R1121-E1125 WeakPolarHBondContact O-CA 3.27Å; R1121-E1125 WeakPolarHBondContact O-CB 3.37Å; R1121-E1125 WeakPolarHBondContact O-CG 3.17Å; R1121-E1125 PolarHBondContact O-N 3.36Å
1122	R	31.8	Very low	34.6	Very low	177 Å²	177	124.6 Å²	124.6	67%	0.668	60%	0.602	S	S	*	*	H	α-helix	trans	-71.6	-22.7	178.8	-73.9	-178.2	174.5	-178.8	0	115.5	C1118 L1119 E1125 R1126	C1118-R1122 WeakPolarHBondContact O-CB 3.26Å; C1118-R1122 VanDerWaalsContact O-CG 3.3Å; C1118-R1122 WeakPolarHBondContact O-CG 3.24Å; C1118-R1122 PolarHBondContact O-N 3.27Å; L1119-R1122 PolarHBondContact O-N 2.76Å; R1122-E1125 WeakPolarHBondContact CA-OE2 3.05Å; R1122-E1125 WeakPolarHBondContact CG-OE2 3.43Å; R1122-R1126 WeakPolarHBondContact O-CA 3.16Å; R1122-R1126 WeakPolarHBondContact O-CB 3.22Å; R1122-R1126 PolarHBondContact O-N 2.97Å
1123	F	32.1	Very low	35.1	Very low	148 Å²	148	120.2 Å²	120.2	65%	0.649	58%	0.578	S	S	*	*	H	α-helix	trans	-90.3	-31.2	176.2	-150.1	-78	0	0	0	110.8	L1119 R1121 H1127	L1119-F1123 WeakPolarHBondContact O-CA 3.2Å; L1119-F1123 WeakPolarHBondContact O-CB 3.27Å; L1119-F1123 PolarHBondContact O-N 2.77Å; R1121-F1123 PolarHBondContact O-N 2.66Å; F1123-H1127 WeakPolarHBondContact O-CA 3.44Å; F1123-H1127 WeakPolarHBondContact O-CB 3.09Å; F1123-H1127 PolarHBondContact O-N 2.67Å
1124	V	40.5	Very low	35.9	Very low	82 Å²	82	119.1 Å²	119.1	50%	0.497	56%	0.559	S	S	.	*	H	α-helix	trans	-69.6	-38	163.1	173.6	0	0	0	0	110.4	R1120 R1121 N1128	R1120-V1124 VanDerWaalsContact O-CB 3.22Å; R1120-V1124 WeakPolarHBondContact O-CB 3.24Å; R1120-V1124 VanDerWaalsContact O-CG2 3.25Å; R1120-V1124 WeakPolarHBondContact O-CG2 3.22Å; R1120-V1124 PolarHBondContact O-N 3.39Å; R1121-V1124 PolarHBondContact O-N 2.77Å; V1124-N1128 WeakPolarHBondContact O-CA 3.46Å; V1124-N1128 WeakPolarHBondContact O-CB 3.49Å; V1124-N1128 PolarHBondContact O-N 2.86Å; V1124-N1128 PolarHBondContact O-ND2 3.46Å; V1124-N1128 PolarHBondContact O-OD1 3.06Å
1125	E	37.5	Very low	36.5	Very low	102 Å²	102	117.8 Å²	117.8	48%	0.477	55%	0.545	S	S	.	.	H	α-helix	trans	-67.8	-38.6	171.7	-74.3	163	162.1	0	0	111.5	R1121 R1122 N1128 R1129	R1121-E1125 WeakPolarHBondContact O-CA 3.27Å; R1121-E1125 WeakPolarHBondContact O-CB 3.37Å; R1121-E1125 WeakPolarHBondContact O-CG 3.17Å; R1121-E1125 PolarHBondContact O-N 3.36Å; R1122-E1125 WeakPolarHBondContact CA-OE2 3.05Å; R1122-E1125 WeakPolarHBondContact CG-OE2 3.43Å; E1125-N1128 CarbonylContact O-C 3.49Å; E1125-R1129 WeakPolarHBondContact O-CA 3.35Å; E1125-R1129 WeakPolarHBondContact O-CB 3.15Å; E1125-R1129 PolarHBondContact O-N 2.86Å
1126	R	35	Very low	37.1	Very low	177 Å²	177	117 Å²	117	67%	0.668	54%	0.536	S	S	*	.	H	α-helix	trans	-81.7	-29.8	-179.5	-168.8	173.9	-168.2	153.9	0.5	112.7	R1122 L1130	R1122-R1126 WeakPolarHBondContact O-CA 3.16Å; R1122-R1126 WeakPolarHBondContact O-CB 3.22Å; R1122-R1126 PolarHBondContact O-N 2.97Å; R1126-L1130 HydrophobicContact CG-CD1 4.27Å; R1126-L1130 VanDerWaalsContact O-CB 3.25Å; R1126-L1130 WeakPolarHBondContact O-CB 3.42Å; R1126-L1130 VanDerWaalsContact O-CG 3.28Å; R1126-L1130 WeakPolarHBondContact O-CG 3.45Å; R1126-L1130 PolarHBondContact O-N 2.8Å
1127	H	42.9	Very low	37.4	Very low	104 Å²	104	112.9 Å²	112.9	48%	0.481	52%	0.523	S	S	.	.	H	α-helix	trans	-68.2	-50.7	164	-175.4	73	0	0	0	109.2	F1123 R1129 L1130 L1131	F1123-H1127 WeakPolarHBondContact O-CA 3.44Å; F1123-H1127 WeakPolarHBondContact O-CB 3.09Å; F1123-H1127 PolarHBondContact O-N 2.67Å; H1127-R1129 PolarHBondContact O-N 3.05Å; H1127-L1130 PolarHBondContact O-N 3.35Å; H1127-L1131 WeakPolarHBondContact O-CB 3.32Å; H1127-L1131 WeakPolarHBondContact O-CD1 3.49Å; H1127-L1131 PolarHBondContact O-N 2.8Å
1128	N	38.1	Very low	37.6	Very low	85 Å²	85	115.6 Å²	115.6	46%	0.455	53%	0.527	S	S	.	.	H	α-helix	trans	-64.6	-19.4	174.7	-68.8	-2.8	0	0	0	113.5	V1124 E1125 L1132	V1124-N1128 WeakPolarHBondContact O-CA 3.46Å; V1124-N1128 WeakPolarHBondContact O-CB 3.49Å; V1124-N1128 PolarHBondContact O-N 2.86Å; V1124-N1128 PolarHBondContact O-ND2 3.46Å; V1124-N1128 PolarHBondContact O-OD1 3.06Å; E1125-N1128 CarbonylContact O-C 3.49Å; N1128-L1132 WeakPolarHBondContact O-CA 3.31Å; N1128-L1132 WeakPolarHBondContact O-CB 3.06Å; N1128-L1132 PolarHBondContact O-N 2.82Å
1129	R	39.4	Very low	37.5	Very low	180 Å²	180	121 Å²	121	68%	0.679	54%	0.539	S	S	*	.	H	α-helix	trans	-98.9	-15.1	176.6	-175.3	174.3	174.3	174.8	-0.6	113.3	E1125 H1127 M1133	E1125-R1129 WeakPolarHBondContact O-CA 3.35Å; E1125-R1129 WeakPolarHBondContact O-CB 3.15Å; E1125-R1129 PolarHBondContact O-N 2.86Å; H1127-R1129 PolarHBondContact O-N 3.05Å; R1129-M1133 WeakPolarHBondContact O-CB 3.08Å; R1129-M1133 WeakPolarHBondContact O-CG 3.48Å; R1129-M1133 PolarHBondContact O-N 3.47Å
1130	L	39.3	Very low	37.5	Very low	112 Å²	112	123.5 Å²	123.5	59%	0.586	54%	0.541	S	S	*	.	H	α-helix	trans	-86.1	-34.9	161.2	-74.8	166.9	0	0	0	110.4	R1126 H1127 M1133 S1134	R1126-L1130 HydrophobicContact CG-CD1 4.27Å; R1126-L1130 VanDerWaalsContact O-CB 3.25Å; R1126-L1130 WeakPolarHBondContact O-CB 3.42Å; R1126-L1130 VanDerWaalsContact O-CG 3.28Å; R1126-L1130 WeakPolarHBondContact O-CG 3.45Å; R1126-L1130 PolarHBondContact O-N 2.8Å; H1127-L1130 PolarHBondContact O-N 3.35Å; L1130-M1133 PolarHBondContact O-N 2.78Å; L1130-S1134 VanDerWaalsContact O-CB 3.3Å; L1130-S1134 WeakPolarHBondContact O-CB 3.5Å; L1130-S1134 PolarHBondContact O-N 2.99Å; L1130-S1134 PolarHBondContact O-OG 3.38Å
1131	L	43.1	Very low	37.3	Very low	48 Å²	48	118.6 Å²	118.6	25%	0.251	54%	0.537	S	S	.	.	H	α-helix	trans	-65.9	-35.1	159.5	-90.7	70.8	0	0	0	111.2	H1127 S1134 R1135	H1127-L1131 WeakPolarHBondContact O-CB 3.32Å; H1127-L1131 WeakPolarHBondContact O-CD1 3.49Å; H1127-L1131 PolarHBondContact O-N 2.8Å; L1131-S1134 PolarHBondContact O-OG 2.77Å; L1131-R1135 WeakPolarHBondContact O-CA 3.23Å; L1131-R1135 WeakPolarHBondContact O-CB 3.38Å; L1131-R1135 WeakPolarHBondContact O-CD 3.39Å; L1131-R1135 WeakPolarHBondContact O-CG 3.31Å; L1131-R1135 PolarHBondContact O-N 2.82Å
1132	L	37.9	Very low	36.9	Very low	95 Å²	95	111 Å²	111	50%	0.497	51%	0.511	S	S	.	.	H	α-helix	trans	-70.8	-40.7	172.8	-133.1	74.4	0	0	0	109.4	N1128 I1136	N1128-L1132 WeakPolarHBondContact O-CA 3.31Å; N1128-L1132 WeakPolarHBondContact O-CB 3.06Å; N1128-L1132 PolarHBondContact O-N 2.82Å; L1132-I1136 HydrophobicContact CB-CD1 4.16Å; L1132-I1136 HydrophobicContact CD2-CD1 3.69Å; L1132-I1136 HydrophobicContact CG-CD1 3.6Å; L1132-I1136 HydrophobicContact CG-CG1 4.23Å; L1132-I1136 WeakPolarHBondContact O-CA 3.49Å; L1132-I1136 WeakPolarHBondContact O-CB 3.36Å; L1132-I1136 WeakPolarHBondContact O-CD1 3.21Å; L1132-I1136 WeakPolarHBondContact O-CG1 3.46Å; L1132-I1136 PolarHBondContact O-N 2.85Å
1133	M	36.4	Very low	36.7	Very low	74 Å²	74	109.2 Å²	109.2	37%	0.365	51%	0.514	S	S	.	.	H	α-helix	trans	-75.1	-27.5	178.7	-70.1	-77.7	94.3	0	0	113.2	R1129 L1130 I1136 N1137	R1129-M1133 WeakPolarHBondContact O-CB 3.08Å; R1129-M1133 WeakPolarHBondContact O-CG 3.48Å; R1129-M1133 PolarHBondContact O-N 3.47Å; L1130-M1133 PolarHBondContact O-N 2.78Å; M1133-I1136 HydrophobicContact CE-CB 4.09Å; M1133-I1136 HydrophobicContact CE-CD1 3.67Å; M1133-I1136 HydrophobicContact CE-CG1 4.47Å; M1133-I1136 HydrophobicContact CE-CG2 4.03Å; M1133-N1137 WeakPolarHBondContact O-CB 3.14Å; M1133-N1137 PolarHBondContact O-N 3.28Å; M1133-N1137 PolarHBondContact O-ND2 2.71Å; M1133-N1137 PolarHBondContact O-OD1 2.77Å
1134	S	41.4	Very low	36.5	Very low	51 Å²	51	106.6 Å²	106.6	36%	0.357	51%	0.51	S	S	.	.	H	α-helix	trans	-71.8	-54.1	168	76.4	0	0	0	0	109.7	L1130 L1131 I1136 N1137 E1138	L1130-S1134 VanDerWaalsContact O-CB 3.3Å; L1130-S1134 WeakPolarHBondContact O-CB 3.5Å; L1130-S1134 PolarHBondContact O-N 2.99Å; L1130-S1134 PolarHBondContact O-OG 3.38Å; L1131-S1134 PolarHBondContact O-OG 2.77Å; S1134-I1136 VanDerWaalsContact C-N 3.27Å; S1134-I1136 PolarHBondContact O-N 2.8Å; S1134-N1137 CarbonylContact O-C 2.88Å; S1134-N1137 WeakPolarHBondContact O-CA 3.33Å; S1134-N1137 PolarHBondContact O-N 2.92Å; S1134-E1138 WeakPolarHBondContact O-CB 3.19Å; S1134-E1138 WeakPolarHBondContact O-CG 3.21Å; S1134-E1138 PolarHBondContact O-N 3.13Å
1135	R	39.7	Very low	35.8	Very low	134 Å²	134	110.8 Å²	110.8	51%	0.506	52%	0.522	S	S	.	.	H	α-helix	trans	-63.3	-26.8	177.4	-66.4	169.7	170.8	175.2	-4.4	113.7	L1131 E1138 R1139	L1131-R1135 WeakPolarHBondContact O-CA 3.23Å; L1131-R1135 WeakPolarHBondContact O-CB 3.38Å; L1131-R1135 WeakPolarHBondContact O-CD 3.39Å; L1131-R1135 WeakPolarHBondContact O-CG 3.31Å; L1131-R1135 PolarHBondContact O-N 2.82Å; R1135-E1138 WeakPolarHBondContact CA-OE2 3.13Å; R1135-E1138 PolarHBondContact N-OE2 2.7Å; R1135-R1139 WeakPolarHBondContact O-CB 3.3Å; R1135-R1139 WeakPolarHBondContact O-CD 3.28Å; R1135-R1139 WeakPolarHBondContact O-CG 3.35Å; R1135-R1139 PolarHBondContact O-N 2.95Å
1136	I	41.3	Very low	35.2	Very low	53 Å²	53	114.6 Å²	114.6	27%	0.272	54%	0.537	S	S	.	.	H	α-helix	trans	-81.1	-29.1	172.2	-73.4	167.2	0	0	0	110.4	L1132 M1133 S1134 R1139 R1140	L1132-I1136 HydrophobicContact CB-CD1 4.16Å; L1132-I1136 HydrophobicContact CD2-CD1 3.69Å; L1132-I1136 HydrophobicContact CG-CD1 3.6Å; L1132-I1136 HydrophobicContact CG-CG1 4.23Å; L1132-I1136 WeakPolarHBondContact O-CA 3.49Å; L1132-I1136 WeakPolarHBondContact O-CB 3.36Å; L1132-I1136 WeakPolarHBondContact O-CD1 3.21Å; L1132-I1136 WeakPolarHBondContact O-CG1 3.46Å; L1132-I1136 PolarHBondContact O-N 2.85Å; M1133-I1136 HydrophobicContact CE-CB 4.09Å; M1133-I1136 HydrophobicContact CE-CD1 3.67Å; M1133-I1136 HydrophobicContact CE-CG1 4.47Å; M1133-I1136 HydrophobicContact CE-CG2 4.03Å; S1134-I1136 VanDerWaalsContact C-N 3.27Å; S1134-I1136 PolarHBondContact O-N 2.8Å; I1136-R1139 CarbonylContact O-C 3.48Å; I1136-R1140 HydrophobicContact CG2-CG 4.03Å; I1136-R1140 WeakPolarHBondContact O-CA 3.39Å; I1136-R1140 WeakPolarHBondContact O-CB 3.04Å; I1136-R1140 WeakPolarHBondContact O-CD 3.31Å; I1136-R1140 WeakPolarHBondContact O-CG 3.48Å; I1136-R1140 PolarHBondContact O-N 3.23Å
1137	N	33.8	Very low	34.7	Very low	100 Å²	100	110.9 Å²	110.9	54%	0.535	54%	0.538	S	S	.	.	H	α-helix	trans	-78	-32.2	172.4	-73.9	-3.5	0	0	0	112	M1133 S1134 R1140	M1133-N1137 WeakPolarHBondContact O-CB 3.14Å; M1133-N1137 PolarHBondContact O-N 3.28Å; M1133-N1137 PolarHBondContact O-ND2 2.71Å; M1133-N1137 PolarHBondContact O-OD1 2.77Å; S1134-N1137 CarbonylContact O-C 2.88Å; S1134-N1137 WeakPolarHBondContact O-CA 3.33Å; S1134-N1137 PolarHBondContact O-N 2.92Å; N1137-R1140 WeakPolarHBondContact OD1-CD 3Å; N1137-R1140 PolarHBondContact OD1-NH1 2.78Å
1138	E	39.9	Very low	33.9	Very low	142 Å²	142	112.8 Å²	112.8	66%	0.664	55%	0.547	S	S	*	.	H	α-helix	trans	-68.3	-33.7	167.8	-67.9	164.8	152.8	0	0	111.4	S1134 R1135	S1134-E1138 WeakPolarHBondContact O-CB 3.19Å; S1134-E1138 WeakPolarHBondContact O-CG 3.21Å; S1134-E1138 PolarHBondContact O-N 3.13Å; R1135-E1138 WeakPolarHBondContact CA-OE2 3.13Å; R1135-E1138 PolarHBondContact N-OE2 2.7Å
1139	R	33.5	Very low	33.3	Very low	173 Å²	173	113.7 Å²	113.7	65%	0.653	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	38	174.8	-56.3	167.6	-179.6	-162.4	-6.9	112.8	R1135 I1136 D1142	R1135-R1139 WeakPolarHBondContact O-CB 3.3Å; R1135-R1139 WeakPolarHBondContact O-CD 3.28Å; R1135-R1139 WeakPolarHBondContact O-CG 3.35Å; R1135-R1139 PolarHBondContact O-N 2.95Å; I1136-R1139 CarbonylContact O-C 3.48Å; R1139-D1142 WeakPolarHBondContact CA-OD1 3.4Å; R1139-D1142 HydrophobicContact CB-CB 4.44Å
1140	R	32.7	Very low	32.6	Very low	157 Å²	157	111.2 Å²	111.2	59%	0.592	56%	0.56	S	S	*	*	S	Bend	trans	-108.5	1	175.9	-112.6	167.6	175.1	162.9	-5.8	114.6	I1136 N1137 D1142	I1136-R1140 HydrophobicContact CG2-CG 4.03Å; I1136-R1140 WeakPolarHBondContact O-CA 3.39Å; I1136-R1140 WeakPolarHBondContact O-CB 3.04Å; I1136-R1140 WeakPolarHBondContact O-CD 3.31Å; I1136-R1140 WeakPolarHBondContact O-CG 3.48Å; I1136-R1140 PolarHBondContact O-N 3.23Å; N1137-R1140 WeakPolarHBondContact OD1-CD 3Å; N1137-R1140 PolarHBondContact OD1-NH1 2.78Å; R1140-D1142 PolarHBondContact O-N 3.28Å
1141	C	30.3	Very low	31.9	Very low	104 Å²	104	111.2 Å²	111.2	70%	0.703	56%	0.561	S	S	*	*	S	Bend	trans	-71.2	-6	153.9	-60.1	0	0	0	0	110.9	I1187	C1141-I1187 WeakPolarHBondContact O-CD1 3.22Å
1142	D	29.1	Very low	31.1	Very low	34 Å²	34	114.3 Å²	114.3	18%	0.182	58%	0.581	C	S	.	*	S	Bend	trans	-111.9	-3.4	-154	-56.1	57.6	0	0	0	117	R1139 R1140 H1186 I1187	R1139-D1142 WeakPolarHBondContact CA-OD1 3.4Å; R1139-D1142 HydrophobicContact CB-CB 4.44Å; R1140-D1142 PolarHBondContact O-N 3.28Å; D1142-H1186 CarbonylContact O-C 3.29Å; D1142-I1187 VanDerWaalsContact CA-CG2 3.46Å; D1142-I1187 HydrophobicContact CB-CB 4.39Å; D1142-I1187 HydrophobicContact CB-CG2 3.69Å; D1142-I1187 CarbonylContact O-C 3.41Å; D1142-I1187 PolarHBondContact O-N 2.94Å; D1142-I1187 WeakPolarHBondContact OD2-CG2 3.46Å
1143	L	27	Very low	30.5	Very low	138 Å²	138	113.4 Å²	113.4	72%	0.723	60%	0.595	S	S	*	*			trans	-165.2	113.6	171.9	-110	143.4	0	0	0	116.1
1144	T	27.6	Very low	30	Very low	93 Å²	93	115.9 Å²	115.9	57%	0.571	62%	0.615	S	S	*	*			trans	-148.9	116.9	164.1	49	0	0	0	0	107.4
1145	F	25.2	Very low	29.1	Very low	170 Å²	170	123.1 Å²	123.1	75%	0.746	64%	0.636	S	S	*	*			cis	-131.4	-169.6	49.8	-119.8	-102.1	0	0	0	114.7
1146	K	24.7	Very low	28.4	Very low	182 Å²	182	127 Å²	127	79%	0.791	65%	0.651	S	S	*	*			trans	-143.5	161	-172.1	-76.2	-173.7	173.4	-174.3	0	114.6
1147	S	25.6	Very low	27.6	Very low	99 Å²	99	130.3 Å²	130.3	69%	0.692	67%	0.669	S	S	*	*			trans	80.7	149.9	142.8	68.7	0	0	0	0	119.4
1148	H	25.9	Very low	27.1	Very low	144 Å²	144	134.2 Å²	134.2	67%	0.667	68%	0.684	S	S	*	*			cis	-89.5	-106.6	-1.3	-73.4	-134.5	0	0	0	113.1	E1097	E1097-H1148 IonicContact OE1-CE1 2.75Å; E1097-H1148 IonicContact OE1-CG 3.25Å; E1097-H1148 IonicContact OE1-ND1 3.88Å; E1097-H1148 PolarHBondContact OE1-ND1 3.01Å; E1097-H1148 IonicContact OE2-ND1 3.18Å
1149	S	25	Very low	26.4	Very low	104 Å²	104	130.7 Å²	130.7	73%	0.727	69%	0.685	S	S	*	*			cis	-157.2	122.4	-3.7	56.1	0	0	0	0	112.1
1150	N	24.5	Very low	26.1	Very low	128 Å²	128	128.3 Å²	128.3	68%	0.684	69%	0.69	S	S	*	*			trans	43.2	131.9	164.5	-64.4	6.7	0	0	0	122.9
1151	D	26	Very low	25.7	Very low	113 Å²	113	129.1 Å²	129.1	60%	0.604	70%	0.7	S	S	*	*			trans	59.1	92.7	157.6	-59.8	-11.9	0	0	0	118.7
1152	V	25	Very low	25.6	Very low	112 Å²	112	131.3 Å²	131.3	68%	0.679	70%	0.703	S	S	*	*				84.8	112.9	62.5	174	0	0	0	0	113.2
1153	G	25.7	Very low	25.6	Very low	77 Å²	77	131.3 Å²	131.3	79%	0.794	71%	0.711	S	S	*	*			trans	174	79.8	176.8	0	0	0	0	0	114.3
1154	T	25.4	Very low	25.8	Very low	126 Å²	126	128.4 Å²	128.4	77%	0.773	70%	0.701	S	S	*	*			trans	-53	147.9	174.8	52.2	0	0	0	0	112.9
1155	Y	23.4	Very low	26	Very low	203 Å²	203	128.1 Å²	128.1	80%	0.796	70%	0.696	S	S	*	*				-162	150.4	66.2	-149.3	-101.4	0	0	0	113.5
1156	W	24.8	Very low	26.3	Very low	215 Å²	215	124 Å²	124	81%	0.814	68%	0.681	S	S	*	*			trans	-110.8	146.6	170.7	-63	55.7	0	0	0	107.2
1157	D	24.3	Very low	26.6	Very low	123 Å²	123	116.9 Å²	116.9	66%	0.658	65%	0.651	S	S	*	*				-171	173.2	66	-83.8	-53.3	0	0	0	106.4
1158	H	24.6	Very low	26.8	Very low	182 Å²	182	116 Å²	116	84%	0.843	64%	0.635	S	S	*	*			cis	-156.8	164.1	34.5	-56.5	-90.6	0	0	0	110.3
1159	G	25.1	Very low	27.1	Very low	68 Å²	68	113 Å²	113	70%	0.701	62%	0.624	S	S	*	*			trans	136.4	57.4	156.9	0	0	0	0	0	119.9
1160	T	25.6	Very low	27.4	Very low	122 Å²	122	110.2 Å²	110.2	75%	0.748	60%	0.6	S	S	*	*			trans	7.7	143.3	139.9	61.1	0	0	0	0	120.5
1161	H	25	Very low	27.6	Very low	174 Å²	174	105.4 Å²	105.4	81%	0.806	58%	0.575	S	S	*	*			cis	-173	82.1	-8.3	-108	-45	0	0	0	110.9
1162	I	27.3	Very low	27.9	Very low	150 Å²	150	102.5 Å²	102.5	77%	0.769	56%	0.555	S	S	*	*			trans	-154.3	135.7	156.7	-73.2	105.6	0	0	0	103
1163	G	29.4	Very low	28.1	Very low	34 Å²	34	100.4 Å²	100.4	35%	0.351	54%	0.54	S	S	.	.			cis	157.3	106.1	6.1	0	0	0	0	0	103.5	D1165	G1163-D1165 PolarHBondContact O-N 3.31Å
1164	P	30.8	Very low	28.3	Very low	77 Å²	77	98.7 Å²	98.7	50%	0.5	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	20.9	-150.6	31.6	-37.5	0	0	0	115	I1167 F1168	P1164-I1167 HydrophobicContact CB-CB 4.47Å; P1164-I1167 HydrophobicContact CB-CG2 4.49Å; P1164-I1167 CarbonylContact O-C 3.36Å; P1164-I1167 WeakPolarHBondContact O-CA 3.27Å; P1164-I1167 PolarHBondContact O-N 2.92Å; P1164-F1168 PolarHBondContact O-N 3.29Å
1165	D	31.8	Very low	28.6	Very low	87 Å²	87	97.4 Å²	97.4	47%	0.465	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.2	-8.2	-159.8	-115.2	-72.7	0	0	0	115.1	G1163 P1189 G1190	G1163-D1165 PolarHBondContact O-N 3.31Å; D1165-P1189 WeakPolarHBondContact OD1-CB 3.35Å; D1165-P1189 WeakPolarHBondContact OD2-CB 2.95Å; D1165-P1189 WeakPolarHBondContact OD2-CG 3.13Å; D1165-G1190 VanDerWaalsContact C-C 3.49Å; D1165-G1190 CarbonylContact C-O 3.57Å; D1165-G1190 WeakPolarHBondContact CA-O 3.31Å; D1165-G1190 CarbonylContact O-C 2.98Å; D1165-G1190 VanDerWaalsContact O-CA 3.3Å; D1165-G1190 WeakPolarHBondContact O-CA 3.38Å; D1165-G1190 WeakPolarHBondContact OD1-CA 3.32Å
1166	L	32	Very low	28.8	Very low	83 Å²	83	88.4 Å²	88.4	44%	0.435	47%	0.465	S	S	.	.	S	Bend	trans	-99.2	11	137.5	-145	81.7	0	0	0	110.9	G1190 L1191 I1192 L1312	L1166-G1190 CarbonylContact C-O 3.55Å; L1166-G1190 WeakPolarHBondContact CA-O 3.41Å; L1166-G1190 PolarHBondContact N-O 3.05Å; L1166-L1191 VanDerWaalsContact C-C 3.47Å; L1166-L1191 HydrophobicContact CB-CB 4.37Å; L1166-L1191 HydrophobicContact CD1-CB 3.56Å; L1166-L1191 HydrophobicContact CD1-CD1 3.73Å; L1166-L1191 HydrophobicContact CD1-CG 4.18Å; L1166-L1191 HydrophobicContact CG-CB 3.81Å; L1166-L1191 CarbonylContact O-C 3.55Å; L1166-I1192 VanDerWaalsContact C-N 3.27Å; L1166-I1192 WeakPolarHBondContact O-CB 3.27Å; L1166-I1192 VanDerWaalsContact O-CD1 3.23Å; L1166-I1192 WeakPolarHBondContact O-CD1 3.38Å; L1166-I1192 WeakPolarHBondContact O-CG1 3.24Å; L1166-I1192 PolarHBondContact O-N 3.03Å; L1166-L1312 HydrophobicContact CD2-CD2 4.28Å
1167	I	31.2	Very low	28.8	Very low	34 Å²	34	83.5 Å²	83.5	17%	0.174	45%	0.449	C	S	.	.	S	Bend	trans	-111.2	16.4	-174.7	-72.2	70.6	0	0	0	117.2	P1164 G1190 I1192 N1193 M1311	P1164-I1167 HydrophobicContact CB-CB 4.47Å; P1164-I1167 HydrophobicContact CB-CG2 4.49Å; P1164-I1167 CarbonylContact O-C 3.36Å; P1164-I1167 WeakPolarHBondContact O-CA 3.27Å; P1164-I1167 PolarHBondContact O-N 2.92Å; I1167-G1190 CarbonylContact C-O 3.6Å; I1167-G1190 PolarHBondContact N-O 2.82Å; I1167-I1192 VanDerWaalsContact C-CA 3.48Å; I1167-I1192 VanDerWaalsContact CA-N 3.29Å; I1167-I1192 HydrophobicContact CB-CB 4.23Å; I1167-I1192 HydrophobicContact CD1-CD1 3.89Å; I1167-I1192 HydrophobicContact CG1-CB 4.23Å; I1167-I1192 HydrophobicContact CG1-CD1 3.67Å; I1167-I1192 HydrophobicContact CG1-CG1 4.44Å; I1167-I1192 CarbonylContact O-C 3.39Å; I1167-N1193 WeakPolarHBondContact CG2-ND2 3.19Å; I1167-N1193 WeakPolarHBondContact O-CA 3.29Å; I1167-N1193 WeakPolarHBondContact O-CB 3.24Å; I1167-N1193 PolarHBondContact O-N 3.46Å; I1167-N1193 PolarHBondContact O-ND2 2.86Å; I1167-M1311 HydrophobicContact CD1-CE 4.01Å
1168	F	30.6	Very low	28.9	Very low	79 Å²	79	82.4 Å²	82.4	35%	0.346	45%	0.449	S	S	.	.	S	Bend	trans	-128.3	38.1	173.7	-141.1	-100.9	0	0	0	122.6	P1164 P1189 G1190 L1191 N1193 G1194	P1164-F1168 PolarHBondContact O-N 3.29Å; F1168-P1189 VanDerWaalsContact CB-C 3.44Å; F1168-P1189 WeakPolarHBondContact CB-O 3.18Å; F1168-G1190 VanDerWaalsContact CA-C 3.43Å; F1168-G1190 WeakPolarHBondContact CA-O 3.29Å; F1168-G1190 VanDerWaalsContact CB-C 3.42Å; F1168-G1190 WeakPolarHBondContact CB-O 3.28Å; F1168-G1190 PolarHBondContact N-O 3.22Å; F1168-L1191 PolarHBondContact O-N 3.39Å; F1168-N1193 VanDerWaalsContact C-N 3.25Å; F1168-N1193 VanDerWaalsContact CA-C 3.43Å; F1168-N1193 HydrophobicContact CD2-CB 4.35Å; F1168-N1193 WeakPolarHBondContact CD2-O 3.21Å; F1168-N1193 VanDerWaalsContact N-N 3.1Å; F1168-G1194 VanDerWaalsContact C-CA 3.45Å; F1168-G1194 WeakPolarHBondContact O-CA 3.37Å; F1168-G1194 PolarHBondContact O-N 3.32Å; F1168-G1194 VanDerWaalsContact O-N 3.15Å
1169	L	32	Very low	29	Very low	82 Å²	82	75.7 Å²	75.7	43%	0.429	42%	0.422	S	S	.	.	S	Bend	trans	-173	15.6	173.4	-139.7	97.3	0	0	0	122.1	L1191 I1192 N1193 T1195	L1169-L1191 CarbonylContact C-O 3.59Å; L1169-L1191 VanDerWaalsContact C-O 3.23Å; L1169-L1191 VanDerWaalsContact CB-CA 3.45Å; L1169-L1191 HydrophobicContact CB-CB 4.46Å; L1169-L1191 HydrophobicContact CB-CD2 4.19Å; L1169-L1191 HydrophobicContact CB-CG 4.27Å; L1169-L1191 VanDerWaalsContact N-N 3.17Å; L1169-L1191 PolarHBondContact N-O 3.14Å; L1169-I1192 CarbonylContact C-O 3.54Å; L1169-I1192 PolarHBondContact N-O 3.4Å; L1169-N1193 VanDerWaalsContact N-N 3.13Å; L1169-T1195 HydrophobicContact CD1-CG2 4.32Å; L1169-T1195 HydrophobicContact CD2-CG2 4.16Å; L1169-T1195 HydrophobicContact CG-CG2 3.81Å; L1169-T1195 PolarHBondContact O-OG1 3.21Å
1170	I	30.7	Very low	29.1	Very low	45 Å²	45	77.8 Å²	77.8	23%	0.231	41%	0.414	C	S	.	.	S	Bend	trans	-126.4	-52.7	179.3	-73	162.4	0	0	0	115.1	R1172 L1173 M1174 L1191 I1192 C1317	I1170-R1172 PolarHBondContact O-N 2.98Å; I1170-L1173 WeakPolarHBondContact O-CA 3.45Å; I1170-L1173 WeakPolarHBondContact O-CB 3.34Å; I1170-L1173 PolarHBondContact O-N 3.33Å; I1170-M1174 VanDerWaalsContact O-CG 3.23Å; I1170-M1174 WeakPolarHBondContact O-CG 2.95Å; I1170-M1174 PolarHBondContact O-N 3.3Å; I1170-L1191 WeakPolarHBondContact CB-O 3.5Å; I1170-L1191 HydrophobicContact CD1-CD2 4.26Å; I1170-L1191 VanDerWaalsContact CD1-O 3.23Å; I1170-L1191 WeakPolarHBondContact CD1-O 3.48Å; I1170-L1191 HydrophobicContact CG1-CD2 4.39Å; I1170-L1191 WeakPolarHBondContact CG1-O 3.48Å; I1170-L1191 PolarHBondContact N-O 2.96Å; I1170-I1192 CarbonylContact C-O 3.04Å; I1170-I1192 VanDerWaalsContact C-O 3.31Å; I1170-I1192 WeakPolarHBondContact CA-O 3.44Å; I1170-I1192 HydrophobicContact CB-CB 4.47Å; I1170-I1192 HydrophobicContact CB-CG1 3.89Å; I1170-I1192 HydrophobicContact CG2-CG1 4.39Å; I1170-I1192 PolarHBondContact N-O 2.9Å; I1170-C1317 HydrophobicContact CG2-CB 3.93Å
1171	N	29.5	Very low	29.2	Very low	28 Å²	28	75.5 Å²	75.5	15%	0.15	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-44.2	-32.5	165.7	-98.5	-2.9	0	0	0	111	M1174 I1192 N1193 S1315 G1316 C1317	N1171-M1174 WeakPolarHBondContact O-CA 3.45Å; N1171-M1174 WeakPolarHBondContact O-CB 3.24Å; N1171-M1174 PolarHBondContact O-N 3.06Å; N1171-I1192 WeakPolarHBondContact CA-O 3.26Å; N1171-I1192 HydrophobicContact CB-CG2 3.27Å; N1171-I1192 WeakPolarHBondContact CB-O 3.4Å; N1171-I1192 PolarHBondContact N-O 2.98Å; N1171-I1192 VanDerWaalsContact ND2-CG2 3.29Å; N1171-I1192 WeakPolarHBondContact ND2-CG2 3.38Å; N1171-I1192 WeakPolarHBondContact OD1-CG2 3.33Å; N1171-N1193 WeakPolarHBondContact CB-OD1 3.3Å; N1171-N1193 PolarHBondContact ND2-OD1 3.49Å; N1171-S1315 PolarHBondContact ND2-O 3.39Å; N1171-S1315 PolarHBondContact OD1-O 3.24Å; N1171-S1315 VanDerWaalsContact OD1-O 3.12Å; N1171-G1316 PolarHBondContact OD1-O 3.05Å; N1171-G1316 VanDerWaalsContact OD1-O 3.11Å; N1171-C1317 WeakPolarHBondContact OD1-CA 3.17Å; N1171-C1317 WeakPolarHBondContact OD1-CB 3.49Å; N1171-C1317 PolarHBondContact OD1-N 3.26Å; N1171-C1317 PolarHBondContact OD1-SG 3.28Å
1172	R	31.2	Very low	29.2	Very low	52 Å²	52	74.2 Å²	74.2	20%	0.196	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-96.7	-11.6	-167.3	-77.3	-155.2	12.2	159.8	-3.2	109.4	I1170 M1174 I1192 N1193 G1194 T1195 V1196 C1197 R1199	I1170-R1172 PolarHBondContact O-N 2.98Å; R1172-M1174 PolarHBondContact O-N 2.77Å; R1172-I1192 WeakPolarHBondContact CB-O 3.13Å; R1172-I1192 PolarHBondContact N-O 3.11Å; R1172-I1192 VanDerWaalsContact N-O 3.1Å; R1172-N1193 VanDerWaalsContact CD-CA 3.4Å; R1172-N1193 WeakPolarHBondContact CD-O 3.33Å; R1172-N1193 VanDerWaalsContact CG-CA 3.5Å; R1172-N1193 HydrophobicContact CG-CB 4.21Å; R1172-N1193 VanDerWaalsContact CZ-O 3.26Å; R1172-N1193 PolarHBondContact NE-O 3.41Å; R1172-G1194 PolarHBondContact NE-O 3.45Å; R1172-G1194 PolarHBondContact NH2-O 2.88Å; R1172-T1195 VanDerWaalsContact C-CB 3.46Å; R1172-T1195 CarbonylContact O-C 3.53Å; R1172-V1196 HydrophobicContact CB-CB 3.47Å; R1172-V1196 VanDerWaalsContact CB-CB 3.47Å; R1172-V1196 HydrophobicContact CB-CG2 3.85Å; R1172-V1196 VanDerWaalsContact CB-N 3.27Å; R1172-V1196 HydrophobicContact CG-CB 3.42Å; R1172-V1196 VanDerWaalsContact CG-CB 3.42Å; R1172-V1196 HydrophobicContact CG-CG1 4.06Å; R1172-V1196 HydrophobicContact CG-CG2 3.67Å; R1172-V1196 WeakPolarHBondContact O-CA 3.35Å; R1172-V1196 WeakPolarHBondContact O-CG2 3.36Å; R1172-V1196 PolarHBondContact O-N 3.01Å; R1172-C1197 PolarHBondContact NH2-SG 2.9Å; R1172-R1199 WeakPolarHBondContact O-CB 3.32Å
1173	L	29.8	Very low	29.1	Very low	67 Å²	67	75.9 Å²	75.9	35%	0.351	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-70.5	-1.8	148.5	-77	172.4	0	0	0	112.6	I1170 T1195 R1199 L1348	I1170-L1173 WeakPolarHBondContact O-CA 3.45Å; I1170-L1173 WeakPolarHBondContact O-CB 3.34Å; I1170-L1173 PolarHBondContact O-N 3.33Å; L1173-T1195 HydrophobicContact CD2-CG2 3.74Å; L1173-T1195 HydrophobicContact CG-CG2 3.95Å; L1173-T1195 PolarHBondContact N-OG1 3.39Å; L1173-R1199 VanDerWaalsContact O-CD 3.23Å; L1173-R1199 WeakPolarHBondContact O-CD 3.3Å; L1173-R1199 PolarHBondContact O-NH1 2.82Å; L1173-L1348 HydrophobicContact CD1-CD2 4.43Å
1174	M	29.9	Very low	29	Very low	41 Å²	41	80 Å²	80	20%	0.202	41%	0.413	C	S	.	.	S	Bend	trans	-117.4	7.5	-164.2	-60.7	-75.2	-178.5	0	0	118.5	I1170 N1171 R1172 R1199 P1344	I1170-M1174 VanDerWaalsContact O-CG 3.23Å; I1170-M1174 WeakPolarHBondContact O-CG 2.95Å; I1170-M1174 PolarHBondContact O-N 3.3Å; N1171-M1174 WeakPolarHBondContact O-CA 3.45Å; N1171-M1174 WeakPolarHBondContact O-CB 3.24Å; N1171-M1174 PolarHBondContact O-N 3.06Å; R1172-M1174 PolarHBondContact O-N 2.77Å; M1174-R1199 VanDerWaalsContact CA-NH1 3.26Å; M1174-R1199 PolarHBondContact O-NH2 2.83Å; M1174-P1344 HydrophobicContact CE-CB 3.76Å; M1174-P1344 HydrophobicContact SD-CB 3.71Å; M1174-P1344 HydrophobicContact SD-CG 4.32Å
1175	L	30.8	Very low	28.9	Very low	99 Å²	99	81 Å²	81	52%	0.518	42%	0.418	S	S	.	.	S	Bend	trans	-101.1	-80.7	-178.2	-62.2	-168.9	0	0	0	119.1	V1196 R1199 Q1200	L1175-V1196 HydrophobicContact CB-CG2 3.7Å; L1175-V1196 HydrophobicContact CD1-CG2 3.68Å; L1175-V1196 HydrophobicContact CG-CG2 3.72Å; L1175-R1199 VanDerWaalsContact C-CZ 3.41Å; L1175-R1199 HydrophobicContact CB-CB 4.45Å; L1175-R1199 VanDerWaalsContact CB-O 3.3Å; L1175-R1199 WeakPolarHBondContact CB-O 3.47Å; L1175-R1199 VanDerWaalsContact N-NE 3.1Å; L1175-R1199 PolarHBondContact O-NH2 2.98Å; L1175-Q1200 HydrophobicContact CD1-CG 4.37Å
1176	E	28	Very low	28.6	Very low	15 Å²	15	82.5 Å²	82.5	7%	0.07	42%	0.422	C	S	.	.			trans	-102.5	-151.1	-156	110.7	-40.4	-134.7	0	0	120.7	R1199 Q1200 S1201 L1202 H1203	E1176-R1199 WeakPolarHBondContact CB-O 3.48Å; E1176-R1199 WeakPolarHBondContact CG-O 3.16Å; E1176-R1199 PolarHBondContact N-O 2.85Å; E1176-R1199 VanDerWaalsContact N-O 3.08Å; E1176-R1199 PolarHBondContact O-NE 3.26Å; E1176-R1199 WeakPolarHBondContact OE1-CA 3.21Å; E1176-R1199 WeakPolarHBondContact OE2-CA 3.32Å; E1176-R1199 WeakPolarHBondContact OE2-CG 3.5Å; E1176-Q1200 WeakPolarHBondContact OE1-CA 3.09Å; E1176-Q1200 PolarHBondContact OE1-N 2.86Å; E1176-S1201 PolarHBondContact OE1-N 2.8Å; E1176-L1202 VanDerWaalsContact OE1-CA 3.25Å; E1176-L1202 WeakPolarHBondContact OE1-CA 2.95Å; E1176-L1202 WeakPolarHBondContact OE1-CB 3.32Å; E1176-L1202 PolarHBondContact OE1-N 3.13Å; E1176-H1203 HydrophobicContact CB-CB 4.2Å; E1176-H1203 HydrophobicContact CG-CB 3.44Å; E1176-H1203 VanDerWaalsContact CG-CB 3.44Å
1177	K	26.3	Very low	28.4	Very low	111 Å²	111	81.1 Å²	81.1	48%	0.483	42%	0.415	S	S	.	.			trans	-152.1	164.7	-169.3	-65.5	168.8	-174.8	169.5	0	110.6	L1202	K1177-L1202 CarbonylContact O-C 3.52Å; K1177-L1202 VanDerWaalsContact O-CB 3.29Å; K1177-L1202 WeakPolarHBondContact O-CB 3.35Å
1178	P	25.6	Very low	28.2	Very low	101 Å²	101	87.4 Å²	87.4	66%	0.656	44%	0.437	S	S	*	.	S	Bend	trans	-59.1	157.8	-177.1	21.3	-35.6	0	0	0	119.1	L1202	P1178-L1202 CarbonylContact C-O 3.38Å
1179	S	26.7	Very low	28.2	Very low	41 Å²	41	86 Å²	86	29%	0.287	44%	0.437	S	S	.	.			trans	122.2	55.1	-164.6	68.5	0	0	0	0	113.9	L1202 H1203 T1204 W1205	S1179-L1202 VanDerWaalsContact C-C 3.44Å; S1179-L1202 CarbonylContact C-O 3.57Å; S1179-L1202 WeakPolarHBondContact CA-O 2.95Å; S1179-L1202 VanDerWaalsContact CB-O 3.31Å; S1179-L1202 WeakPolarHBondContact CB-O 3.39Å; S1179-L1202 PolarHBondContact N-O 3.32Å; S1179-L1202 CarbonylContact O-C 3.59Å; S1179-L1202 PolarHBondContact OG-O 3.33Å; S1179-H1203 VanDerWaalsContact OG-CA 3.32Å; S1179-H1203 WeakPolarHBondContact OG-CA 3.36Å; S1179-T1204 CarbonylContact O-C 3.57Å; S1179-T1204 PolarHBondContact O-N 3.15Å; S1179-T1204 PolarHBondContact OG-N 3.02Å; S1179-W1205 PolarHBondContact O-N 3.45Å
1180	E	26.8	Very low	28	Very low	112 Å²	112	83.1 Å²	83.1	52%	0.523	43%	0.426	S	S	.	.			trans	-38.4	138.9	176.3	-56.5	66.3	86	0	0	117.2	S1201 L1202 W1205	E1180-S1201 CarbonylContact C-O 3.56Å; E1180-S1201 WeakPolarHBondContact CA-O 3.17Å; E1180-L1202 HydrophobicContact CB-CD2 4.19Å; E1180-L1202 HydrophobicContact CG-CD2 3.61Å; E1180-W1205 PolarHBondContact O-NE1 3.11Å
1181	D	27.3	Very low	28.1	Very low	74 Å²	74	84.5 Å²	84.5	40%	0.396	43%	0.434	S	S	.	.			trans	-150.1	163.9	161.2	-149.9	-1.1	0	0	0	114.5	S1201 W1205	D1181-S1201 PolarHBondContact N-O 2.93Å; D1181-W1205 PolarHBondContact OD1-NE1 2.99Å
1182	L	25.6	Very low	28.3	Very low	147 Å²	147	83.2 Å²	83.2	77%	0.77	43%	0.427	S	S	*	.			trans	-138.2	129.7	176.1	-91.9	85.5	0	0	0	113.6
1183	Q	25.6	Very low	28.1	Very low	184 Å²	184	83.1 Å²	83.1	86%	0.86	43%	0.43	S	S	*	.				-169.5	146.4	120.9	-104.7	154.5	47.6	0	0	113.9
1184	D	27.8	Very low	28.2	Very low	120 Å²	120	80.3 Å²	80.3	64%	0.642	42%	0.418	S	S	*	.			trans	64.2	145.3	171.3	-61.6	-6.2	0	0	0	120.3
1185	V	26.9	Very low	28.1	Very low	99 Å²	99	79.4 Å²	79.4	60%	0.6	41%	0.414	S	S	*	.			trans	-145	169.5	-147.4	-172.5	0	0	0	0	111.7
1186	H	27.3	Very low	28.1	Very low	118 Å²	118	74.8 Å²	74.8	55%	0.546	39%	0.39	S	S	.	.			trans	91.7	140.7	164.8	-53.4	-70.3	0	0	0	117.2	D1142	D1142-H1186 CarbonylContact O-C 3.29Å
1187	I	27.8	Very low	28	Very low	54 Å²	54	78.2 Å²	78.2	28%	0.277	42%	0.415	S	S	.	.			cis	-155.3	144.8	-7.2	-107	161	0	0	0	108.7	C1141 D1142	C1141-I1187 WeakPolarHBondContact O-CD1 3.22Å; D1142-I1187 VanDerWaalsContact CA-CG2 3.46Å; D1142-I1187 HydrophobicContact CB-CB 4.39Å; D1142-I1187 HydrophobicContact CB-CG2 3.69Å; D1142-I1187 CarbonylContact O-C 3.41Å; D1142-I1187 PolarHBondContact O-N 2.94Å; D1142-I1187 WeakPolarHBondContact OD2-CG2 3.46Å
1188	Y	25.7	Very low	28.1	Very low	166 Å²	166	76.9 Å²	76.9	65%	0.651	42%	0.418	S	S	*	.			trans	41.5	162.3	148.6	-71.2	-100.3	0	0	0	125.4
1189	P	31	Very low	28.3	Very low	51 Å²	51	73.2 Å²	73.2	33%	0.331	39%	0.392	S	S	.	.			cis	-128.4	148.2	-2.1	15.9	10.2	0	0	0	117.7	D1165 F1168	D1165-P1189 WeakPolarHBondContact OD1-CB 3.35Å; D1165-P1189 WeakPolarHBondContact OD2-CB 2.95Å; D1165-P1189 WeakPolarHBondContact OD2-CG 3.13Å; F1168-P1189 VanDerWaalsContact CB-C 3.44Å; F1168-P1189 WeakPolarHBondContact CB-O 3.18Å
1190	G	27.5	Very low	28.3	Very low	20 Å²	20	76.4 Å²	76.4	21%	0.206	40%	0.402	C	S	.	.			trans	77.3	104.5	148.8	0	0	0	0	0	125.4	D1165 L1166 I1167 F1168	D1165-G1190 VanDerWaalsContact C-C 3.49Å; D1165-G1190 CarbonylContact C-O 3.57Å; D1165-G1190 WeakPolarHBondContact CA-O 3.31Å; D1165-G1190 CarbonylContact O-C 2.98Å; D1165-G1190 VanDerWaalsContact O-CA 3.3Å; D1165-G1190 WeakPolarHBondContact O-CA 3.38Å; D1165-G1190 WeakPolarHBondContact OD1-CA 3.32Å; L1166-G1190 CarbonylContact C-O 3.55Å; L1166-G1190 WeakPolarHBondContact CA-O 3.41Å; L1166-G1190 PolarHBondContact N-O 3.05Å; I1167-G1190 CarbonylContact C-O 3.6Å; I1167-G1190 PolarHBondContact N-O 2.82Å; F1168-G1190 VanDerWaalsContact CA-C 3.43Å; F1168-G1190 WeakPolarHBondContact CA-O 3.29Å; F1168-G1190 VanDerWaalsContact CB-C 3.42Å; F1168-G1190 WeakPolarHBondContact CB-O 3.28Å; F1168-G1190 PolarHBondContact N-O 3.22Å
1191	L	33.6	Very low	28.5	Very low	75 Å²	75	73.1 Å²	73.1	39%	0.393	39%	0.391	S	S	.	.	S	Bend	trans	80.9	-17.3	142.2	-80.1	158.6	0	0	0	131.2	L1166 F1168 L1169 I1170	L1166-L1191 VanDerWaalsContact C-C 3.47Å; L1166-L1191 HydrophobicContact CB-CB 4.37Å; L1166-L1191 HydrophobicContact CD1-CB 3.56Å; L1166-L1191 HydrophobicContact CD1-CD1 3.73Å; L1166-L1191 HydrophobicContact CD1-CG 4.18Å; L1166-L1191 HydrophobicContact CG-CB 3.81Å; L1166-L1191 CarbonylContact O-C 3.55Å; F1168-L1191 PolarHBondContact O-N 3.39Å; L1169-L1191 CarbonylContact C-O 3.59Å; L1169-L1191 VanDerWaalsContact C-O 3.23Å; L1169-L1191 VanDerWaalsContact CB-CA 3.45Å; L1169-L1191 HydrophobicContact CB-CB 4.46Å; L1169-L1191 HydrophobicContact CB-CD2 4.19Å; L1169-L1191 HydrophobicContact CB-CG 4.27Å; L1169-L1191 VanDerWaalsContact N-N 3.17Å; L1169-L1191 PolarHBondContact N-O 3.14Å; I1170-L1191 WeakPolarHBondContact CB-O 3.5Å; I1170-L1191 HydrophobicContact CD1-CD2 4.26Å; I1170-L1191 VanDerWaalsContact CD1-O 3.23Å; I1170-L1191 WeakPolarHBondContact CD1-O 3.48Å; I1170-L1191 HydrophobicContact CG1-CD2 4.39Å; I1170-L1191 WeakPolarHBondContact CG1-O 3.48Å; I1170-L1191 PolarHBondContact N-O 2.96Å
1192	I	33.6	Very low	28.5	Very low	0 Å²	0	72.1 Å²	72.1	0%	0	39%	0.386	C	S	.	.	S	Bend	trans	-107.8	-57	151.1	-70.3	154.7	0	0	0	118.9	L1166 I1167 L1169 I1170 N1171 R1172 G1194 L1312 C1317	L1166-I1192 VanDerWaalsContact C-N 3.27Å; L1166-I1192 WeakPolarHBondContact O-CB 3.27Å; L1166-I1192 VanDerWaalsContact O-CD1 3.23Å; L1166-I1192 WeakPolarHBondContact O-CD1 3.38Å; L1166-I1192 WeakPolarHBondContact O-CG1 3.24Å; L1166-I1192 PolarHBondContact O-N 3.03Å; I1167-I1192 VanDerWaalsContact C-CA 3.48Å; I1167-I1192 VanDerWaalsContact CA-N 3.29Å; I1167-I1192 HydrophobicContact CB-CB 4.23Å; I1167-I1192 HydrophobicContact CD1-CD1 3.89Å; I1167-I1192 HydrophobicContact CG1-CB 4.23Å; I1167-I1192 HydrophobicContact CG1-CD1 3.67Å; I1167-I1192 HydrophobicContact CG1-CG1 4.44Å; I1167-I1192 CarbonylContact O-C 3.39Å; L1169-I1192 CarbonylContact C-O 3.54Å; L1169-I1192 PolarHBondContact N-O 3.4Å; I1170-I1192 CarbonylContact C-O 3.04Å; I1170-I1192 VanDerWaalsContact C-O 3.31Å; I1170-I1192 WeakPolarHBondContact CA-O 3.44Å; I1170-I1192 HydrophobicContact CB-CB 4.47Å; I1170-I1192 HydrophobicContact CB-CG1 3.89Å; I1170-I1192 HydrophobicContact CG2-CG1 4.39Å; I1170-I1192 PolarHBondContact N-O 2.9Å; N1171-I1192 WeakPolarHBondContact CA-O 3.26Å; N1171-I1192 HydrophobicContact CB-CG2 3.27Å; N1171-I1192 WeakPolarHBondContact CB-O 3.4Å; N1171-I1192 PolarHBondContact N-O 2.98Å; N1171-I1192 VanDerWaalsContact ND2-CG2 3.29Å; N1171-I1192 WeakPolarHBondContact ND2-CG2 3.38Å; N1171-I1192 WeakPolarHBondContact OD1-CG2 3.33Å; R1172-I1192 WeakPolarHBondContact CB-O 3.13Å; R1172-I1192 PolarHBondContact N-O 3.11Å; R1172-I1192 VanDerWaalsContact N-O 3.1Å; I1192-G1194 PolarHBondContact O-N 2.75Å; I1192-L1312 HydrophobicContact CD1-CD2 3.39Å; I1192-L1312 HydrophobicContact CG1-CD2 4.5Å; I1192-C1317 HydrophobicContact CB-CB 4.16Å; I1192-C1317 HydrophobicContact CD1-CB 3.6Å; I1192-C1317 WeakPolarHBondContact CD1-SG 3.12Å; I1192-C1317 HydrophobicContact CG1-CB 3.49Å; I1192-C1317 VanDerWaalsContact CG1-CB 3.49Å; I1192-C1317 VanDerWaalsContact CG1-SG 3.59Å; I1192-C1317 HydrophobicContact CG2-CB 3.6Å; I1192-C1317 WeakPolarHBondContact CG2-SG 3.46Å
1193	N	26.6	Very low	28.6	Very low	50 Å²	50	70 Å²	70	27%	0.267	37%	0.371	S	S	.	.	S	Bend	trans	-92.8	52.8	-175.6	-65.3	-68	0	0	0	117.5	I1167 F1168 L1169 N1171 R1172	I1167-N1193 WeakPolarHBondContact CG2-ND2 3.19Å; I1167-N1193 WeakPolarHBondContact O-CA 3.29Å; I1167-N1193 WeakPolarHBondContact O-CB 3.24Å; I1167-N1193 PolarHBondContact O-N 3.46Å; I1167-N1193 PolarHBondContact O-ND2 2.86Å; F1168-N1193 VanDerWaalsContact C-N 3.25Å; F1168-N1193 VanDerWaalsContact CA-C 3.43Å; F1168-N1193 HydrophobicContact CD2-CB 4.35Å; F1168-N1193 WeakPolarHBondContact CD2-O 3.21Å; F1168-N1193 VanDerWaalsContact N-N 3.1Å; L1169-N1193 VanDerWaalsContact N-N 3.13Å; N1171-N1193 WeakPolarHBondContact CB-OD1 3.3Å; N1171-N1193 PolarHBondContact ND2-OD1 3.49Å; R1172-N1193 VanDerWaalsContact CD-CA 3.4Å; R1172-N1193 WeakPolarHBondContact CD-O 3.33Å; R1172-N1193 VanDerWaalsContact CG-CA 3.5Å; R1172-N1193 HydrophobicContact CG-CB 4.21Å; R1172-N1193 VanDerWaalsContact CZ-O 3.26Å; R1172-N1193 PolarHBondContact NE-O 3.41Å
1194	G	31.4	Very low	28.7	Very low	9 Å²	9	65.9 Å²	65.9	9%	0.093	36%	0.359	C	S	.	.			trans	-116.5	-79.6	-177.8	0	0	0	0	0	115.5	F1168 R1172 I1192 V1196 C1197	F1168-G1194 VanDerWaalsContact C-CA 3.45Å; F1168-G1194 WeakPolarHBondContact O-CA 3.37Å; F1168-G1194 PolarHBondContact O-N 3.32Å; F1168-G1194 VanDerWaalsContact O-N 3.15Å; R1172-G1194 PolarHBondContact NE-O 3.45Å; R1172-G1194 PolarHBondContact NH2-O 2.88Å; I1192-G1194 PolarHBondContact O-N 2.75Å; G1194-V1196 PolarHBondContact O-N 3.06Å; G1194-C1197 PolarHBondContact O-N 2.85Å
1195	T	28.6	Very low	28.5	Very low	22 Å²	22	69 Å²	69	14%	0.135	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-41.3	6.5	178.4	23.3	0	0	0	0	119.4	L1169 R1172 L1173 C1198 R1199	L1169-T1195 HydrophobicContact CD1-CG2 4.32Å; L1169-T1195 HydrophobicContact CD2-CG2 4.16Å; L1169-T1195 HydrophobicContact CG-CG2 3.81Å; L1169-T1195 PolarHBondContact O-OG1 3.21Å; R1172-T1195 VanDerWaalsContact C-CB 3.46Å; R1172-T1195 CarbonylContact O-C 3.53Å; L1173-T1195 HydrophobicContact CD2-CG2 3.74Å; L1173-T1195 HydrophobicContact CG-CG2 3.95Å; L1173-T1195 PolarHBondContact N-OG1 3.39Å; T1195-C1198 VanDerWaalsContact C-N 3.32Å; T1195-C1198 CarbonylContact O-C 2.92Å; T1195-C1198 WeakPolarHBondContact O-CA 3.41Å; T1195-C1198 WeakPolarHBondContact O-CB 3.34Å; T1195-C1198 PolarHBondContact O-N 3.41Å; T1195-R1199 PolarHBondContact O-N 2.95Å; T1195-R1199 VanDerWaalsContact O-N 3.13Å
1196	V	30.8	Very low	28.6	Very low	1 Å²	1	69.5 Å²	69.5	1%	0.006	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-16	169.3	124.6	0	0	0	0	110.2	R1172 L1175 G1194 C1198 R1199 Q1200 S1201	R1172-V1196 HydrophobicContact CB-CB 3.47Å; R1172-V1196 VanDerWaalsContact CB-CB 3.47Å; R1172-V1196 HydrophobicContact CB-CG2 3.85Å; R1172-V1196 VanDerWaalsContact CB-N 3.27Å; R1172-V1196 HydrophobicContact CG-CB 3.42Å; R1172-V1196 VanDerWaalsContact CG-CB 3.42Å; R1172-V1196 HydrophobicContact CG-CG1 4.06Å; R1172-V1196 HydrophobicContact CG-CG2 3.67Å; R1172-V1196 WeakPolarHBondContact O-CA 3.35Å; R1172-V1196 WeakPolarHBondContact O-CG2 3.36Å; R1172-V1196 PolarHBondContact O-N 3.01Å; L1175-V1196 HydrophobicContact CB-CG2 3.7Å; L1175-V1196 HydrophobicContact CD1-CG2 3.68Å; L1175-V1196 HydrophobicContact CG-CG2 3.72Å; G1194-V1196 PolarHBondContact O-N 3.06Å; V1196-C1198 PolarHBondContact O-N 3.05Å; V1196-R1199 HydrophobicContact CB-CB 4.44Å; V1196-R1199 HydrophobicContact CG2-CB 3.74Å; V1196-R1199 WeakPolarHBondContact CG2-O 3.29Å; V1196-R1199 CarbonylContact O-C 3.19Å; V1196-R1199 PolarHBondContact O-N 3.42Å; V1196-Q1200 HydrophobicContact CB-CG 4.42Å; V1196-Q1200 HydrophobicContact CG1-CB 3.78Å; V1196-Q1200 HydrophobicContact CG1-CG 3.54Å; V1196-Q1200 HydrophobicContact CG2-CG 4.17Å; V1196-Q1200 WeakPolarHBondContact O-CA 3.26Å; V1196-Q1200 PolarHBondContact O-N 3.43Å; V1196-S1201 PolarHBondContact O-N 3.43Å
1197	C	26.1	Very low	28.5	Very low	88 Å²	88	69.9 Å²	69.9	60%	0.595	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-3.6	149.9	-66.3	0	0	0	0	111.7	R1172 G1194 S1201	R1172-C1197 PolarHBondContact NH2-SG 2.9Å; G1194-C1197 PolarHBondContact O-N 2.85Å; C1197-S1201 VanDerWaalsContact CA-OG 3.32Å; C1197-S1201 WeakPolarHBondContact CA-OG 3.44Å; C1197-S1201 WeakPolarHBondContact O-CB 3.47Å; C1197-S1201 PolarHBondContact O-OG 3.06Å
1198	C	27.5	Very low	28.4	Very low	82 Å²	82	74.3 Å²	74.3	55%	0.554	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.3	11.8	162.8	-32.6	0	0	0	0	113.2	T1195 V1196	T1195-C1198 VanDerWaalsContact C-N 3.32Å; T1195-C1198 CarbonylContact O-C 2.92Å; T1195-C1198 WeakPolarHBondContact O-CA 3.41Å; T1195-C1198 WeakPolarHBondContact O-CB 3.34Å; T1195-C1198 PolarHBondContact O-N 3.41Å; V1196-C1198 PolarHBondContact O-N 3.05Å
1199	R	29.9	Very low	28.3	Very low	25 Å²	25	71.5 Å²	71.5	9%	0.094	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-151	22.7	-179.6	-96.5	-170.5	99.6	177.7	-6.3	115.7	R1172 L1173 M1174 L1175 E1176 T1195 V1196	R1172-R1199 WeakPolarHBondContact O-CB 3.32Å; L1173-R1199 VanDerWaalsContact O-CD 3.23Å; L1173-R1199 WeakPolarHBondContact O-CD 3.3Å; L1173-R1199 PolarHBondContact O-NH1 2.82Å; M1174-R1199 VanDerWaalsContact CA-NH1 3.26Å; M1174-R1199 PolarHBondContact O-NH2 2.83Å; L1175-R1199 VanDerWaalsContact C-CZ 3.41Å; L1175-R1199 HydrophobicContact CB-CB 4.45Å; L1175-R1199 VanDerWaalsContact CB-O 3.3Å; L1175-R1199 WeakPolarHBondContact CB-O 3.47Å; L1175-R1199 VanDerWaalsContact N-NE 3.1Å; L1175-R1199 PolarHBondContact O-NH2 2.98Å; E1176-R1199 WeakPolarHBondContact CB-O 3.48Å; E1176-R1199 WeakPolarHBondContact CG-O 3.16Å; E1176-R1199 PolarHBondContact N-O 2.85Å; E1176-R1199 VanDerWaalsContact N-O 3.08Å; E1176-R1199 PolarHBondContact O-NE 3.26Å; E1176-R1199 WeakPolarHBondContact OE1-CA 3.21Å; E1176-R1199 WeakPolarHBondContact OE2-CA 3.32Å; E1176-R1199 WeakPolarHBondContact OE2-CG 3.5Å; T1195-R1199 PolarHBondContact O-N 2.95Å; T1195-R1199 VanDerWaalsContact O-N 3.13Å; V1196-R1199 HydrophobicContact CB-CB 4.44Å; V1196-R1199 HydrophobicContact CG2-CB 3.74Å; V1196-R1199 WeakPolarHBondContact CG2-O 3.29Å; V1196-R1199 CarbonylContact O-C 3.19Å; V1196-R1199 PolarHBondContact O-N 3.42Å
1200	Q	27.5	Very low	28	Very low	107 Å²	107	74.5 Å²	74.5	50%	0.5	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135	-35.5	157.4	-82.2	170.5	-14	0	0	109.6	L1175 E1176 V1196 L1202 H1203	L1175-Q1200 HydrophobicContact CD1-CG 4.37Å; E1176-Q1200 WeakPolarHBondContact OE1-CA 3.09Å; E1176-Q1200 PolarHBondContact OE1-N 2.86Å; V1196-Q1200 HydrophobicContact CB-CG 4.42Å; V1196-Q1200 HydrophobicContact CG1-CB 3.78Å; V1196-Q1200 HydrophobicContact CG1-CG 3.54Å; V1196-Q1200 HydrophobicContact CG2-CG 4.17Å; V1196-Q1200 WeakPolarHBondContact O-CA 3.26Å; V1196-Q1200 PolarHBondContact O-N 3.43Å; Q1200-L1202 PolarHBondContact O-N 3.06Å; Q1200-H1203 PolarHBondContact O-N 3.11Å
1201	S	29.8	Very low	27.7	Very low	43 Å²	43	78.1 Å²	78.1	30%	0.301	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-4.8	177.3	-39.9	0	0	0	0	115.3	E1176 E1180 D1181 V1196 C1197	E1176-S1201 PolarHBondContact OE1-N 2.8Å; E1180-S1201 CarbonylContact C-O 3.56Å; E1180-S1201 WeakPolarHBondContact CA-O 3.17Å; D1181-S1201 PolarHBondContact N-O 2.93Å; V1196-S1201 PolarHBondContact O-N 3.43Å; C1197-S1201 VanDerWaalsContact CA-OG 3.32Å; C1197-S1201 WeakPolarHBondContact CA-OG 3.44Å; C1197-S1201 WeakPolarHBondContact O-CB 3.47Å; C1197-S1201 PolarHBondContact O-OG 3.06Å
1202	L	27.4	Very low	27.3	Very low	53 Å²	53	82 Å²	82	28%	0.277	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	1.6	171.6	-46.9	164.8	0	0	0	113.1	E1176 K1177 P1178 S1179 E1180 Q1200	E1176-L1202 VanDerWaalsContact OE1-CA 3.25Å; E1176-L1202 WeakPolarHBondContact OE1-CA 2.95Å; E1176-L1202 WeakPolarHBondContact OE1-CB 3.32Å; E1176-L1202 PolarHBondContact OE1-N 3.13Å; K1177-L1202 CarbonylContact O-C 3.52Å; K1177-L1202 VanDerWaalsContact O-CB 3.29Å; K1177-L1202 WeakPolarHBondContact O-CB 3.35Å; P1178-L1202 CarbonylContact C-O 3.38Å; S1179-L1202 VanDerWaalsContact C-C 3.44Å; S1179-L1202 CarbonylContact C-O 3.57Å; S1179-L1202 WeakPolarHBondContact CA-O 2.95Å; S1179-L1202 VanDerWaalsContact CB-O 3.31Å; S1179-L1202 WeakPolarHBondContact CB-O 3.39Å; S1179-L1202 PolarHBondContact N-O 3.32Å; S1179-L1202 CarbonylContact O-C 3.59Å; S1179-L1202 PolarHBondContact OG-O 3.33Å; E1180-L1202 HydrophobicContact CB-CD2 4.19Å; E1180-L1202 HydrophobicContact CG-CD2 3.61Å; Q1200-L1202 PolarHBondContact O-N 3.06Å
1203	H	27.8	Very low	26.7	Very low	102 Å²	102	86.4 Å²	86.4	47%	0.472	50%	0.495	S	S	.	.	S	Bend	trans	-97.1	6.1	178.1	-116.5	-20.3	0	0	0	117.4	E1176 S1179 Q1200	E1176-H1203 HydrophobicContact CB-CB 4.2Å; E1176-H1203 HydrophobicContact CG-CB 3.44Å; E1176-H1203 VanDerWaalsContact CG-CB 3.44Å; S1179-H1203 VanDerWaalsContact OG-CA 3.32Å; S1179-H1203 WeakPolarHBondContact OG-CA 3.36Å; Q1200-H1203 PolarHBondContact O-N 3.11Å
1204	T	28	Very low	26.6	Very low	98 Å²	98	89.5 Å²	89.5	60%	0.601	52%	0.521	S	S	*	.			trans	-148.3	80.3	-169.7	50.7	0	0	0	0	114.2	S1179	S1179-T1204 CarbonylContact O-C 3.57Å; S1179-T1204 PolarHBondContact O-N 3.15Å; S1179-T1204 PolarHBondContact OG-N 3.02Å
1205	W	24.6	Very low	26.4	Very low	185 Å²	185	95.4 Å²	95.4	70%	0.701	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-102.1	135.5	156.6	-126	36.1	0	0	0	113	S1179 E1180 D1181	S1179-W1205 PolarHBondContact O-N 3.45Å; E1180-W1205 PolarHBondContact O-NE1 3.11Å; D1181-W1205 PolarHBondContact OD1-NE1 2.99Å
1206	P	27.4	Very low	26.2	Very low	110 Å²	110	101.9 Å²	101.9	71%	0.714	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-88.8	131.9	-161.9	32.9	-35.8	0	0	0	114.4
1207	V	26.8	Very low	25.9	Very low	127 Å²	127	107.3 Å²	107.3	77%	0.77	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-87.2	120.9	160.5	-179.6	0	0	0	0	109.2
1208	K	24.7	Very low	25.9	Very low	146 Å²	146	107.8 Å²	107.8	64%	0.635	63%	0.63	S	S	*	*			trans	9.2	132.7	152.8	-54.6	175.4	-171.4	170.6	0	116.2
1209	S	24.9	Very low	25.9	Very low	108 Å²	108	109.7 Å²	109.7	76%	0.755	64%	0.638	S	S	*	*			cis	-173	172.8	31.4	45.6	0	0	0	0	113.1
1210	S	23.8	Very low	25.8	Very low	113 Å²	113	114 Å²	114	79%	0.79	67%	0.667	S	S	*	*			trans	77.5	143.4	168.9	78.6	0	0	0	0	116.5
1211	S	22.1	Very low	25.7	Very low	96 Å²	96	115.5 Å²	115.5	67%	0.671	68%	0.679	S	S	*	*			cis	-170.8	148.5	-24	48.5	0	0	0	0	110.1
1212	L	23.5	Very low	25.9	Very low	157 Å²	157	121.4 Å²	121.4	82%	0.822	70%	0.702	S	S	*	*			trans	62.7	100	162.1	-64.6	159.5	0	0	0	115.4
1213	S	22.2	Very low	25.9	Very low	93 Å²	93	125.2 Å²	125.2	65%	0.65	72%	0.721	S	S	*	*				90	142.9	69.1	69.3	0	0	0	0	114.2
1214	S	23.6	Very low	25.7	Very low	115 Å²	115	125 Å²	125	80%	0.804	73%	0.731	S	S	*	*			trans	72.5	142.2	-169.7	83.1	0	0	0	0	113.5
1215	V	26.8	Very low	25.9	Very low	132 Å²	132	126 Å²	126	80%	0.8	74%	0.74	S	S	*	*			cis	-122.5	142.4	5.4	172.8	0	0	0	0	110.8
1216	I	24.3	Very low	25.9	Very low	158 Å²	158	125 Å²	125	81%	0.81	74%	0.742	S	S	*	*			trans	-100.5	162.8	176.1	-67.2	167.1	0	0	0	109.4
1217	S	24.7	Very low	25.8	Very low	116 Å²	116	128.1 Å²	128.1	81%	0.811	75%	0.746	S	S	*	*			trans	84.5	137.3	176.2	-145	0	0	0	0	112.8
1218	S	25.8	Very low	25.7	Very low	98 Å²	98	124.9 Å²	124.9	69%	0.685	74%	0.739	S	S	*	*			cis	-156.2	163.3	15	61.4	0	0	0	0	108.9
1219	T	28.4	Very low	25.7	Very low	121 Å²	121	122.2 Å²	122.2	74%	0.742	73%	0.732	S	S	*	*			cis	-150.9	137.3	4.7	31.3	0	0	0	0	104.9
1220	V	27	Very low	25.9	Very low	116 Å²	116	123 Å²	123	70%	0.703	73%	0.726	S	S	*	*			cis	61.2	81.3	49.7	-171.1	0	0	0	0	112.8
1221	D	26.8	Very low	26.1	Very low	139 Å²	139	126 Å²	126	74%	0.743	73%	0.727	S	S	*	*			trans	163.9	125.8	160.2	-93.7	-14.3	0	0	0	107.2
1222	Q	33.2	Very low	26.3	Very low	167 Å²	167	125.8 Å²	125.8	78%	0.78	72%	0.716	S	S	*	*			cis	-131.3	146.7	-4.1	-61.4	114.3	24.1	0	0	106.8
1223	I	26.6	Very low	26.4	Very low	133 Å²	133	125.9 Å²	125.9	68%	0.682	71%	0.713	S	S	*	*			cis	66.8	81.1	27.3	-47.3	-177.5	0	0	0	114.4
1224	S	25.4	Very low	26.7	Very low	96 Å²	96	126.1 Å²	126.1	67%	0.671	72%	0.715	S	S	*	*			trans	176.9	157.1	143.8	35.9	0	0	0	0	110.1
1225	C	30.8	Very low	26.6	Very low	119 Å²	119	125.3 Å²	125.3	80%	0.804	71%	0.709	S	S	*	*			trans	62.5	85.5	-174.8	-51	0	0	0	0	112.9
1226	F	25.4	Very low	26.3	Very low	166 Å²	166	126.8 Å²	126.8	73%	0.728	71%	0.712	S	S	*	*			cis	56.3	134.8	32.9	-77.8	-58.7	0	0	0	112.3
1227	E	25.1	Very low	26.1	Very low	174 Å²	174	121.3 Å²	121.3	81%	0.813	69%	0.688	S	S	*	*			cis	-163.5	160.3	-3.1	-164.5	155.3	-143.1	0	0	110
1228	G	24.6	Very low	26	Very low	59 Å²	59	120.4 Å²	120.4	61%	0.608	67%	0.673	S	S	*	*			trans	129.6	131.6	167.2	0	0	0	0	0	115.6
1229	N	25.7	Very low	25.9	Very low	91 Å²	91	120.7 Å²	120.7	49%	0.487	66%	0.664	S	S	.	*	S	Bend	trans	51.2	109.4	165.2	-52	-3.5	0	0	0	116.3	L2089 F2091	N1229-L2089 WeakPolarHBondContact ND2-CD2 3.07Å; N1229-F2091 WeakPolarHBondContact OD1-CD2 3.18Å; N1229-F2091 VanDerWaalsContact OD1-CE2 3.22Å; N1229-F2091 WeakPolarHBondContact OD1-CE2 3.32Å
1230	I	27.6	Very low	25.7	Very low	123 Å²	123	117.3 Å²	117.3	63%	0.631	65%	0.645	S	S	*	*			cis	-142.7	88.3	19.8	-54.8	172.6	0	0	0	109.2	M1233	I1230-M1233 HydrophobicContact CG2-CG 4.31Å; I1230-M1233 WeakPolarHBondContact O-CG 3.3Å
1231	H	27.7	Very low	25.7	Very low	178 Å²	178	116.9 Å²	116.9	82%	0.824	64%	0.638	S	S	*	*			trans	-110.5	66	174.7	-96.5	-52.8	0	0	0	112.7
1232	Q	26.4	Very low	25.6	Very low	91 Å²	91	111.5 Å²	111.5	43%	0.425	62%	0.615	S	S	.	*			trans	-149.2	42.8	160.6	-105.7	162.8	46.1	0	0	110.7	S1234 Q2093	Q1232-S1234 VanDerWaalsContact C-N 3.26Å; Q1232-S1234 PolarHBondContact O-N 3.36Å; Q1232-Q2093 VanDerWaalsContact OE1-CG 3.31Å
1233	M	26.3	Very low	25.3	Very low	158 Å²	158	105 Å²	105	78%	0.778	59%	0.588	S	S	*	*			trans	-75.1	69.2	-178.3	-58.6	171.2	74.4	0	0	111.3	I1230	I1230-M1233 HydrophobicContact CG2-CG 4.31Å; I1230-M1233 WeakPolarHBondContact O-CG 3.3Å
1234	S	27.5	Very low	25.3	Very low	98 Å²	98	108.7 Å²	108.7	69%	0.685	59%	0.593	S	S	*	*			trans	-145.4	24.1	-174	60.4	0	0	0	0	115.8	Q1232	Q1232-S1234 VanDerWaalsContact C-N 3.26Å; Q1232-S1234 PolarHBondContact O-N 3.36Å
1235	S	22.1	Very low	25.7	Very low	98 Å²	98	112.7 Å²	112.7	69%	0.685	59%	0.594	S	S	*	*	S	Bend	trans	-174.1	135.5	172	51.5	0	0	0	0	108
1236	L	20.3	Very low	25.2	Very low	164 Å²	164	112.6 Å²	112.6	86%	0.859	59%	0.59	S	S	*	*	S	Bend	cis	-135	121.3	6.3	-59.7	156.6	0	0	0	108
1237	S	21.2	Very low	25	Very low	42 Å²	42	106.1 Å²	106.1	29%	0.294	57%	0.565	S	S	.	*			trans	171.7	27.6	171.6	37.2	0	0	0	0	116.8	S1251	S1237-S1251 WeakPolarHBondContact CA-O 3.26Å; S1237-S1251 PolarHBondContact O-OG 2.81Å
1238	L	23.1	Very low	25	Very low	98 Å²	98	101.9 Å²	101.9	51%	0.513	54%	0.542	S	S	.	.			trans	-134	78	-161.7	-71	151.6	0	0	0	116.9	Y1248 S1251	L1238-Y1248 HydrophobicContact CB-CD1 4.42Å; L1238-Y1248 WeakPolarHBondContact O-CD1 3.46Å; L1238-S1251 PolarHBondContact N-OG 2.72Å
1239	E	22.5	Very low	25.1	Very low	104 Å²	104	101.2 Å²	101.2	49%	0.486	53%	0.525	S	S	.	.			trans	-144.5	152.3	167.5	-57.4	94.6	115.6	0	0	111.4	Y1248 L1249 Q1250 S1251	E1239-Y1248 CarbonylContact O-C 3.57Å; E1239-Y1248 WeakPolarHBondContact O-CA 3.37Å; E1239-Y1248 PolarHBondContact O-N 3.33Å; E1239-L1249 VanDerWaalsContact C-N 3.32Å; E1239-L1249 CarbonylContact O-C 3.57Å; E1239-L1249 WeakPolarHBondContact O-CA 3.2Å; E1239-L1249 PolarHBondContact O-N 2.72Å; E1239-Q1250 PolarHBondContact O-N 3.25Å; E1239-S1251 PolarHBondContact N-OG 3.35Å; E1239-S1251 WeakPolarHBondContact OE2-CB 3.43Å; E1239-S1251 PolarHBondContact OE2-OG 2.74Å
1240	S	24.5	Very low	25.2	Very low	49 Å²	49	102.6 Å²	102.6	34%	0.343	53%	0.528	S	S	.	.	S	Bend	trans	65.7	34.8	-177.7	-45.2	0	0	0	0	130.3	T1246 S1247 Y1248 Q1250	S1240-T1246 CarbonylContact C-O 3.58Å; S1240-S1247 VanDerWaalsContact N-CA 3.31Å; S1240-S1247 PolarHBondContact N-OG 3.5Å; S1240-Y1248 VanDerWaalsContact CA-N 3.32Å; S1240-Q1250 WeakPolarHBondContact OG-CB 3.15Å; S1240-Q1250 PolarHBondContact OG-OE1 2.88Å
1241	I	26.9	Very low	25.1	Very low	107 Å²	107	99.1 Å²	99.1	55%	0.549	52%	0.515	S	S	.	.	S	Bend	trans	-134.1	-37.9	155.4	66.6	106.6	0	0	0	118.2	T1246 L1249	I1241-T1246 CarbonylContact C-O 3.58Å; I1241-T1246 WeakPolarHBondContact CA-O 3.01Å; I1241-T1246 PolarHBondContact N-O 3.37Å; I1241-T1246 VanDerWaalsContact N-O 3.14Å; I1241-T1246 CarbonylContact O-C 3.33Å; I1241-T1246 VanDerWaalsContact O-C 3.25Å; I1241-T1246 VanDerWaalsContact O-CA 3.25Å; I1241-T1246 WeakPolarHBondContact O-CA 3.24Å; I1241-T1246 PolarHBondContact O-N 2.64Å; I1241-L1249 HydrophobicContact CB-CB 4.43Å; I1241-L1249 HydrophobicContact CG1-CB 4.07Å; I1241-L1249 HydrophobicContact CG2-CB 3.6Å; I1241-L1249 HydrophobicContact CG2-CD2 4.07Å; I1241-L1249 HydrophobicContact CG2-CG 3.66Å
1242	G	25.1	Very low	25.2	Very low	27 Å²	27	91.8 Å²	91.8	28%	0.278	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.4	36.2	-162.5	0	0	0	0	0	118.3	R1244 R1245 T1246 S1247	G1242-R1244 VanDerWaalsContact C-N 3.31Å; G1242-R1244 PolarHBondContact O-N 3.09Å; G1242-R1245 PolarHBondContact O-N 2.77Å; G1242-T1246 VanDerWaalsContact CA-N 3.32Å; G1242-T1246 VanDerWaalsContact N-C 3.27Å; G1242-S1247 CarbonylContact C-O 3.59Å; G1242-S1247 VanDerWaalsContact CA-O 3.24Å; G1242-S1247 WeakPolarHBondContact CA-O 3.37Å; G1242-S1247 PolarHBondContact N-O 2.92Å
1243	S	26.3	Very low	25.5	Very low	29 Å²	29	91.1 Å²	91.1	20%	0.203	48%	0.48	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	83.5	-157	57	0	0	0	0	109	R1245 T1246 S1247	S1243-R1245 PolarHBondContact O-N 3.08Å; S1243-T1246 VanDerWaalsContact N-N 3.1Å; S1243-T1246 PolarHBondContact OG-OG1 3.09Å; S1243-S1247 WeakPolarHBondContact CA-O 3.49Å; S1243-S1247 WeakPolarHBondContact CB-O 3.4Å; S1243-S1247 PolarHBondContact N-O 3.49Å; S1243-S1247 WeakPolarHBondContact OG-CA 3.38Å; S1243-S1247 WeakPolarHBondContact OG-CB 3.41Å; S1243-S1247 PolarHBondContact OG-N 2.9Å
1244	R	27	Very low	25.7	Very low	211 Å²	211	87.1 Å²	87.1	80%	0.796	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	36.2	-159.3	-36.2	102.9	-158.4	-134.3	1.6	109	G1242 Y1248	G1242-R1244 VanDerWaalsContact C-N 3.31Å; G1242-R1244 PolarHBondContact O-N 3.09Å; R1244-Y1248 PolarHBondContact NE-OH 3.28Å; R1244-Y1248 PolarHBondContact NH2-OH 2.72Å
1245	R	32.9	Very low	25.8	Very low	181 Å²	181	86.5 Å²	86.5	68%	0.683	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	119	-159.7	-55.4	118.3	-178.2	149.2	2	113.9	G1242 S1243	G1242-R1245 PolarHBondContact O-N 2.77Å; S1243-R1245 PolarHBondContact O-N 3.08Å
1246	T	20.7	Very low	26.5	Very low	116 Å²	116	90.6 Å²	90.6	71%	0.712	46%	0.457	S	S	*	.	S	Bend	trans	111.9	-47	-179	75.6	0	0	0	0	122.9	S1240 I1241 G1242 S1243	S1240-T1246 CarbonylContact C-O 3.58Å; I1241-T1246 CarbonylContact C-O 3.58Å; I1241-T1246 WeakPolarHBondContact CA-O 3.01Å; I1241-T1246 PolarHBondContact N-O 3.37Å; I1241-T1246 VanDerWaalsContact N-O 3.14Å; I1241-T1246 CarbonylContact O-C 3.33Å; I1241-T1246 VanDerWaalsContact O-C 3.25Å; I1241-T1246 VanDerWaalsContact O-CA 3.25Å; I1241-T1246 WeakPolarHBondContact O-CA 3.24Å; I1241-T1246 PolarHBondContact O-N 2.64Å; G1242-T1246 VanDerWaalsContact CA-N 3.32Å; G1242-T1246 VanDerWaalsContact N-C 3.27Å; S1243-T1246 VanDerWaalsContact N-N 3.1Å; S1243-T1246 PolarHBondContact OG-OG1 3.09Å
1247	S	21.9	Very low	27.5	Very low	31 Å²	31	87.6 Å²	87.6	22%	0.217	44%	0.438	C	S	.	.			trans	-109.1	145.3	170.2	150.8	0	0	0	0	119	S1240 G1242 S1243	S1240-S1247 VanDerWaalsContact N-CA 3.31Å; S1240-S1247 PolarHBondContact N-OG 3.5Å; G1242-S1247 CarbonylContact C-O 3.59Å; G1242-S1247 VanDerWaalsContact CA-O 3.24Å; G1242-S1247 WeakPolarHBondContact CA-O 3.37Å; G1242-S1247 PolarHBondContact N-O 2.92Å; S1243-S1247 WeakPolarHBondContact CA-O 3.49Å; S1243-S1247 WeakPolarHBondContact CB-O 3.4Å; S1243-S1247 PolarHBondContact N-O 3.49Å; S1243-S1247 WeakPolarHBondContact OG-CA 3.38Å; S1243-S1247 WeakPolarHBondContact OG-CB 3.41Å; S1243-S1247 PolarHBondContact OG-N 2.9Å
1248	Y	23.9	Very low	28.2	Very low	85 Å²	85	92.1 Å²	92.1	33%	0.333	46%	0.456	S	S	.	.	S	Bend	trans	135	17.4	-174	-51.3	-24.2	0	0	0	119.4	L1238 E1239 S1240 R1244	L1238-Y1248 HydrophobicContact CB-CD1 4.42Å; L1238-Y1248 WeakPolarHBondContact O-CD1 3.46Å; E1239-Y1248 CarbonylContact O-C 3.57Å; E1239-Y1248 WeakPolarHBondContact O-CA 3.37Å; E1239-Y1248 PolarHBondContact O-N 3.33Å; S1240-Y1248 VanDerWaalsContact CA-N 3.32Å; R1244-Y1248 PolarHBondContact NE-OH 3.28Å; R1244-Y1248 PolarHBondContact NH2-OH 2.72Å
1249	L	28	Very low	28.8	Very low	45 Å²	45	93.6 Å²	93.6	24%	0.236	46%	0.464	C	S	.	.			trans	-154.1	91.3	148.9	131.3	69.2	0	0	0	116.2	M1 E1239 I1241 S1252	M1-L1249 HydrophobicContact CE-CD1 3.72Å; E1239-L1249 VanDerWaalsContact C-N 3.32Å; E1239-L1249 CarbonylContact O-C 3.57Å; E1239-L1249 WeakPolarHBondContact O-CA 3.2Å; E1239-L1249 PolarHBondContact O-N 2.72Å; I1241-L1249 HydrophobicContact CB-CB 4.43Å; I1241-L1249 HydrophobicContact CG1-CB 4.07Å; I1241-L1249 HydrophobicContact CG2-CB 3.6Å; I1241-L1249 HydrophobicContact CG2-CD2 4.07Å; I1241-L1249 HydrophobicContact CG2-CG 3.66Å; L1249-S1252 WeakPolarHBondContact CB-OG 3.2Å; L1249-S1252 WeakPolarHBondContact CD1-OG 3.33Å
1250	Q	27.8	Very low	29.9	Very low	119 Å²	119	92.6 Å²	92.6	56%	0.556	46%	0.459	S	S	*	.	S	Bend	trans	-133.7	-10.7	167	165.3	165.9	6.2	0	0	109	M1 E1239 S1240	M1-Q1250 VanDerWaalsContact CE-O 3.3Å; M1-Q1250 WeakPolarHBondContact CE-O 3.26Å; E1239-Q1250 PolarHBondContact O-N 3.25Å; S1240-Q1250 WeakPolarHBondContact OG-CB 3.15Å; S1240-Q1250 PolarHBondContact OG-OE1 2.88Å
1251	S	24.5	Very low	30.9	Very low	51 Å²	51	92.6 Å²	92.6	36%	0.357	46%	0.46	S	S	.	.	S	Bend	trans	-115.3	25.8	177.4	48.6	0	0	0	0	112.8	S1237 L1238 E1239	S1237-S1251 WeakPolarHBondContact CA-O 3.26Å; S1237-S1251 PolarHBondContact O-OG 2.81Å; L1238-S1251 PolarHBondContact N-OG 2.72Å; E1239-S1251 PolarHBondContact N-OG 3.35Å; E1239-S1251 WeakPolarHBondContact OE2-CB 3.43Å; E1239-S1251 PolarHBondContact OE2-OG 2.74Å
1252	S	29.9	Very low	31.8	Very low	24 Å²	24	92.7 Å²	92.7	17%	0.168	47%	0.467	C	S	.	.			trans	-148.6	31.2	177.7	58.5	0	0	0	0	116.2	L1249 R1256	L1249-S1252 WeakPolarHBondContact CB-OG 3.2Å; L1249-S1252 WeakPolarHBondContact CD1-OG 3.33Å; S1252-R1256 PolarHBondContact O-N 2.78Å
1253	H	32.3	Very low	33.1	Very low	76 Å²	76	92.4 Å²	92.4	35%	0.352	46%	0.464	S	S	.	.	H	α-helix	trans	-64.5	-46.5	168.2	-122.5	-121.5	0	0	0	110.7	M1 L1255 R1256 E1257	M1-H1253 HydrophobicContact CE-CB 3.47Å; M1-H1253 VanDerWaalsContact CE-CB 3.47Å; M1-H1253 VanDerWaalsContact CE-CD2 3.49Å; M1-H1253 WeakPolarHBondContact CE-CD2 3.48Å; M1-H1253 VanDerWaalsContact CE-N 3.29Å; M1-H1253 VanDerWaalsContact CG-CD2 3.45Å; M1-H1253 WeakPolarHBondContact CG-CD2 3.44Å; M1-H1253 HydrophobicContact SD-CB 3.71Å; H1253-L1255 VanDerWaalsContact C-N 3.29Å; H1253-L1255 PolarHBondContact O-N 3.3Å; H1253-L1255 VanDerWaalsContact O-N 3.16Å; H1253-R1256 CarbonylContact O-C 3.6Å; H1253-R1256 WeakPolarHBondContact O-CA 3.46Å; H1253-R1256 PolarHBondContact O-N 3.45Å; H1253-E1257 VanDerWaalsContact C-OE2 3.26Å; H1253-E1257 CovalentContact CE1-OE1 1.76Å; H1253-E1257 IonicContact CE1-OE1 2.73Å; H1253-E1257 PolarHBondContact CE1-OE1 2.81Å; H1253-E1257 IonicContact CE1-OE2 3.09Å; H1253-E1257 PolarHBondContact CE1-OE2 3.44Å; H1253-E1257 VanDerWaalsContact CE1-OE2 3.25Å; H1253-E1257 IonicContact CG-OE1 2.9Å; H1253-E1257 IonicContact ND1-OE1 3.97Å; H1253-E1257 PolarHBondContact ND1-OE1 3.5Å; H1253-E1257 IonicContact NE2-OE1 2.61Å; H1253-E1257 WeakPolarHBondContact O-CB 3.12Å; H1253-E1257 WeakPolarHBondContact O-CG 3.42Å; H1253-E1257 PolarHBondContact O-N 2.68Å
1254	S	30.4	Very low	34.4	Very low	74 Å²	74	94.2 Å²	94.2	52%	0.517	47%	0.471	S	S	.	.	H	α-helix	trans	-47.9	-45.5	175.8	160.3	0	0	0	0	113.3	R1256 E1257 M1258	S1254-R1256 PolarHBondContact O-N 3.39Å; S1254-E1257 PolarHBondContact N-OE2 3.05Å; S1254-E1257 PolarHBondContact O-N 2.71Å; S1254-M1258 WeakPolarHBondContact O-CB 3.46Å; S1254-M1258 VanDerWaalsContact O-CG 3.24Å; S1254-M1258 WeakPolarHBondContact O-CG 3.43Å; S1254-M1258 PolarHBondContact O-N 2.84Å
1255	L	29.7	Very low	35.6	Very low	85 Å²	85	90.4 Å²	90.4	45%	0.445	46%	0.458	S	S	.	.	H	α-helix	trans	-75.8	-19.9	177.3	-88.4	172.8	0	0	0	114.1	H1253 M1258 L1259	H1253-L1255 VanDerWaalsContact C-N 3.29Å; H1253-L1255 PolarHBondContact O-N 3.3Å; H1253-L1255 VanDerWaalsContact O-N 3.16Å; L1255-M1258 HydrophobicContact CD2-SD 4.43Å; L1255-L1259 WeakPolarHBondContact O-CB 3.47Å; L1255-L1259 VanDerWaalsContact O-CG 3.28Å; L1255-L1259 WeakPolarHBondContact O-CG 3.25Å; L1255-L1259 PolarHBondContact O-N 3.45Å
1256	R	36.9	Very low	36.5	Very low	185 Å²	185	84.1 Å²	84.1	70%	0.698	44%	0.437	S	S	*	.	H	α-helix	trans	-89.1	-17.9	174	-149.2	175.2	-161.1	-133.1	2.5	113.1	S1252 H1253 S1254	S1252-R1256 PolarHBondContact O-N 2.78Å; H1253-R1256 CarbonylContact O-C 3.6Å; H1253-R1256 WeakPolarHBondContact O-CA 3.46Å; H1253-R1256 PolarHBondContact O-N 3.45Å; S1254-R1256 PolarHBondContact O-N 3.39Å
1257	E	42.3	Very low	38.2	Very low	100 Å²	100	82.1 Å²	82.1	47%	0.467	42%	0.422	S	S	.	.	H	α-helix	trans	-83.8	-38.9	167.6	-71.4	156.7	166.3	0	0	109.9	H1253 S1254 H1260	H1253-E1257 VanDerWaalsContact C-OE2 3.26Å; H1253-E1257 CovalentContact CE1-OE1 1.76Å; H1253-E1257 IonicContact CE1-OE1 2.73Å; H1253-E1257 PolarHBondContact CE1-OE1 2.81Å; H1253-E1257 IonicContact CE1-OE2 3.09Å; H1253-E1257 PolarHBondContact CE1-OE2 3.44Å; H1253-E1257 VanDerWaalsContact CE1-OE2 3.25Å; H1253-E1257 IonicContact CG-OE1 2.9Å; H1253-E1257 IonicContact ND1-OE1 3.97Å; H1253-E1257 PolarHBondContact ND1-OE1 3.5Å; H1253-E1257 IonicContact NE2-OE1 2.61Å; H1253-E1257 WeakPolarHBondContact O-CB 3.12Å; H1253-E1257 WeakPolarHBondContact O-CG 3.42Å; H1253-E1257 PolarHBondContact O-N 2.68Å; S1254-E1257 PolarHBondContact N-OE2 3.05Å; S1254-E1257 PolarHBondContact O-N 2.71Å; E1257-H1260 PolarHBondContact O-CD2 3.41Å; E1257-H1260 PolarHBondContact O-NE2 2.66Å
1258	M	36.2	Very low	39.9	Very low	137 Å²	137	85.1 Å²	85.1	68%	0.675	44%	0.436	S	S	*	.	H	α-helix	trans	-70	-39.1	171	-72.2	174.6	67.5	0	0	112.9	S1254 L1255 H1260	S1254-M1258 WeakPolarHBondContact O-CB 3.46Å; S1254-M1258 VanDerWaalsContact O-CG 3.24Å; S1254-M1258 WeakPolarHBondContact O-CG 3.43Å; S1254-M1258 PolarHBondContact O-N 2.84Å; L1255-M1258 HydrophobicContact CD2-SD 4.43Å; M1258-H1260 VanDerWaalsContact C-N 3.35Å; M1258-H1260 PolarHBondContact O-N 2.89Å
1259	L	35.5	Very low	41.7	Very low	129 Å²	129	83.3 Å²	83.3	68%	0.675	43%	0.432	S	S	*	.	S	Bend	trans	-93.6	64.1	175.4	-61	171.4	0	0	0	110.7	L1255 S1261	L1255-L1259 WeakPolarHBondContact O-CB 3.47Å; L1255-L1259 VanDerWaalsContact O-CG 3.28Å; L1255-L1259 WeakPolarHBondContact O-CG 3.25Å; L1255-L1259 PolarHBondContact O-N 3.45Å; L1259-S1261 PolarHBondContact O-N 3.19Å
1260	H	45.2	Very low	43.1	Very low	83 Å²	83	87.1 Å²	87.1	38%	0.384	44%	0.443	S	S	.	.			trans	-48.9	129.9	163.1	-64.8	-109.6	0	0	0	108.6	E1257 M1258 Y1265 D1268	E1257-H1260 PolarHBondContact O-CD2 3.41Å; E1257-H1260 PolarHBondContact O-NE2 2.66Å; M1258-H1260 VanDerWaalsContact C-N 3.35Å; M1258-H1260 PolarHBondContact O-N 2.89Å; H1260-Y1265 HydrophobicContact CB-CD2 3.78Å; H1260-Y1265 HydrophobicContact CB-CG 4.29Å; H1260-Y1265 AromaticContact CD2-CD2 3.9Å; H1260-Y1265 AromaticContact CG-CD2 3.72Å; H1260-D1268 IonicContact CE1-OD2 3.18Å; H1260-D1268 PolarHBondContact CE1-OD2 2.8Å; H1260-D1268 IonicContact ND1-OD2 2.72Å; H1260-D1268 PolarHBondContact ND1-OD2 2.83Å
1261	S	45.6	Very low	44.6	Very low	50 Å²	50	85.3 Å²	85.3	35%	0.35	44%	0.435	S	S	.	.			trans	-62	153.1	169	87.7	0	0	0	0	108.7	L1259 G1263 D1264 Y1265	L1259-S1261 PolarHBondContact O-N 3.19Å; S1261-G1263 PolarHBondContact O-N 2.78Å; S1261-G1263 PolarHBondContact OG-N 3.01Å; S1261-D1264 WeakPolarHBondContact CB-OD2 3.2Å; S1261-D1264 PolarHBondContact O-N 2.7Å; S1261-D1264 PolarHBondContact OG-N 2.66Å; S1261-D1264 VanDerWaalsContact OG-N 3.13Å; S1261-D1264 PolarHBondContact OG-OD2 3.25Å; S1261-Y1265 PolarHBondContact O-N 3.47Å
1262	P	45	Very low	46.4	Very low	108 Å²	108	86.9 Å²	86.9	70%	0.701	44%	0.439	S	S	*	.	H	α-helix	trans	-54.5	-31	175.6	-27.7	35.6	0	0	0	112.6	L1266	P1262-L1266 VanDerWaalsContact O-CB 3.3Å; P1262-L1266 WeakPolarHBondContact O-CB 3.23Å; P1262-L1266 VanDerWaalsContact O-CD1 3.32Å; P1262-L1266 WeakPolarHBondContact O-CD1 3.21Å; P1262-L1266 WeakPolarHBondContact O-CG 3.35Å; P1262-L1266 PolarHBondContact O-N 3.27Å; P1262-L1266 VanDerWaalsContact O-N 3.08Å
1263	G	53	Low	47.8	Very low	21 Å²	21	87.7 Å²	87.7	22%	0.216	44%	0.44	C	S	.	.	H	α-helix	trans	-70.5	-31.5	173.5	0	0	0	0	0	113.8	S1261 N1267 K1352	S1261-G1263 PolarHBondContact O-N 2.78Å; S1261-G1263 PolarHBondContact OG-N 3.01Å; G1263-N1267 PolarHBondContact O-N 3.23Å; G1263-K1352 WeakPolarHBondContact O-CD 3.32Å; G1263-K1352 WeakPolarHBondContact O-CE 3.47Å; G1263-K1352 PolarHBondContact O-NZ 2.97Å
1264	D	54.3	Low	49.1	Very low	67 Å²	67	88.6 Å²	88.6	36%	0.358	44%	0.443	S	S	.	.	H	α-helix	trans	-89.7	-35.4	-177.3	-54.9	-43.8	0	0	0	110.9	S1261 L1266 N1267 D1268 K1352	S1261-D1264 WeakPolarHBondContact CB-OD2 3.2Å; S1261-D1264 PolarHBondContact O-N 2.7Å; S1261-D1264 PolarHBondContact OG-N 2.66Å; S1261-D1264 VanDerWaalsContact OG-N 3.13Å; S1261-D1264 PolarHBondContact OG-OD2 3.25Å; D1264-L1266 PolarHBondContact O-N 2.85Å; D1264-N1267 CarbonylContact O-C 3.53Å; D1264-N1267 WeakPolarHBondContact O-CA 3.22Å; D1264-N1267 VanDerWaalsContact O-CB 3.27Å; D1264-N1267 WeakPolarHBondContact O-CB 3.22Å; D1264-N1267 PolarHBondContact O-N 2.94Å; D1264-D1268 PolarHBondContact O-N 2.84Å; D1264-K1352 IonicContact OD1-NZ 3.68Å; D1264-K1352 PolarHBondContact OD1-NZ 3.4Å
1265	Y	51.4	Low	50.4	Low	132 Å²	132	91.2 Å²	91.2	52%	0.518	44%	0.442	S	S	.	.	H	α-helix	trans	-56.8	-37.2	162.8	-149.8	-117.2	0	0	0	110.9	H1260 S1261 N1267 D1268 L1269	H1260-Y1265 HydrophobicContact CB-CD2 3.78Å; H1260-Y1265 HydrophobicContact CB-CG 4.29Å; H1260-Y1265 AromaticContact CD2-CD2 3.9Å; H1260-Y1265 AromaticContact CG-CD2 3.72Å; S1261-Y1265 PolarHBondContact O-N 3.47Å; Y1265-N1267 VanDerWaalsContact C-N 3.31Å; Y1265-N1267 PolarHBondContact O-N 3.12Å; Y1265-D1268 PolarHBondContact O-N 3.48Å; Y1265-L1269 HydrophobicContact CD1-CD1 3.53Å; Y1265-L1269 HydrophobicContact CD1-CG 4.05Å; Y1265-L1269 HydrophobicContact CE1-CD1 3.71Å; Y1265-L1269 HydrophobicContact CE1-CD2 4.49Å; Y1265-L1269 HydrophobicContact CE1-CG 4.18Å; Y1265-L1269 HydrophobicContact CG-CD1 4.38Å; Y1265-L1269 WeakPolarHBondContact O-CA 3.14Å; Y1265-L1269 WeakPolarHBondContact O-CB 3.23Å; Y1265-L1269 WeakPolarHBondContact O-CG 3.5Å; Y1265-L1269 PolarHBondContact O-N 3.38Å
1266	L	52.3	Low	51.7	Low	48 Å²	48	94.2 Å²	94.2	25%	0.251	45%	0.452	S	S	.	.	H	α-helix	trans	-69.3	-18.4	169.8	-77.2	168.6	0	0	0	115	P1262 D1264 R1270 L1273 L1353 L1356	P1262-L1266 VanDerWaalsContact O-CB 3.3Å; P1262-L1266 WeakPolarHBondContact O-CB 3.23Å; P1262-L1266 VanDerWaalsContact O-CD1 3.32Å; P1262-L1266 WeakPolarHBondContact O-CD1 3.21Å; P1262-L1266 WeakPolarHBondContact O-CG 3.35Å; P1262-L1266 PolarHBondContact O-N 3.27Å; P1262-L1266 VanDerWaalsContact O-N 3.08Å; D1264-L1266 PolarHBondContact O-N 2.85Å; L1266-R1270 WeakPolarHBondContact O-CB 3.46Å; L1266-R1270 PolarHBondContact O-N 3Å; L1266-L1273 HydrophobicContact CD2-CD1 3.66Å; L1266-L1353 HydrophobicContact CD1-CD2 3.64Å; L1266-L1353 HydrophobicContact CD2-CD2 4.23Å; L1266-L1356 HydrophobicContact CD2-CD1 4.45Å
1267	N	56.4	Low	52.6	Low	74 Å²	74	87.3 Å²	87.3	40%	0.396	43%	0.43	S	S	.	.	H	α-helix	trans	-80.9	-43.1	170.4	-81.4	-13.4	0	0	0	111.2	G1263 D1264 Y1265 R1270 K1352	G1263-N1267 PolarHBondContact O-N 3.23Å; D1264-N1267 CarbonylContact O-C 3.53Å; D1264-N1267 WeakPolarHBondContact O-CA 3.22Å; D1264-N1267 VanDerWaalsContact O-CB 3.27Å; D1264-N1267 WeakPolarHBondContact O-CB 3.22Å; D1264-N1267 PolarHBondContact O-N 2.94Å; Y1265-N1267 VanDerWaalsContact C-N 3.31Å; Y1265-N1267 PolarHBondContact O-N 3.12Å; N1267-R1270 WeakPolarHBondContact O-CB 3.19Å; N1267-R1270 PolarHBondContact O-N 2.9Å; N1267-K1352 PolarHBondContact ND2-NZ 3.19Å; N1267-K1352 WeakPolarHBondContact OD1-CD 3.4Å; N1267-K1352 PolarHBondContact OD1-NZ 3.39Å
1268	D	57.7	Low	53.2	Low	95 Å²	95	87.6 Å²	87.6	51%	0.508	43%	0.43	S	S	.	.	H	α-helix	trans	-71.8	-43.5	180	-56.1	-45.8	0	0	0	110.1	H1260 D1264 Y1265 R1270	H1260-D1268 IonicContact CE1-OD2 3.18Å; H1260-D1268 PolarHBondContact CE1-OD2 2.8Å; H1260-D1268 IonicContact ND1-OD2 2.72Å; H1260-D1268 PolarHBondContact ND1-OD2 2.83Å; D1264-D1268 PolarHBondContact O-N 2.84Å; Y1265-D1268 PolarHBondContact O-N 3.48Å; D1268-R1270 PolarHBondContact O-N 3.04Å; D1268-R1270 VanDerWaalsContact O-N 3.17Å
1269	L	60.5	Low	54.5	Low	47 Å²	47	86.6 Å²	86.6	25%	0.246	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-3.7	165	-63.8	179	0	0	0	113.2	Y1265 E1271 I1272 L1273	Y1265-L1269 HydrophobicContact CD1-CD1 3.53Å; Y1265-L1269 HydrophobicContact CD1-CG 4.05Å; Y1265-L1269 HydrophobicContact CE1-CD1 3.71Å; Y1265-L1269 HydrophobicContact CE1-CD2 4.49Å; Y1265-L1269 HydrophobicContact CE1-CG 4.18Å; Y1265-L1269 HydrophobicContact CG-CD1 4.38Å; Y1265-L1269 WeakPolarHBondContact O-CA 3.14Å; Y1265-L1269 WeakPolarHBondContact O-CB 3.23Å; Y1265-L1269 WeakPolarHBondContact O-CG 3.5Å; Y1265-L1269 PolarHBondContact O-N 3.38Å; L1269-E1271 VanDerWaalsContact C-N 3.31Å; L1269-E1271 PolarHBondContact O-N 3.41Å; L1269-I1272 HydrophobicContact CD2-CB 4.26Å; L1269-I1272 HydrophobicContact CD2-CD1 3.75Å; L1269-I1272 HydrophobicContact CD2-CG2 4.18Å; L1269-I1272 CarbonylContact O-C 3.1Å; L1269-I1272 PolarHBondContact O-N 2.87Å; L1269-L1273 HydrophobicContact CB-CD1 3.78Å; L1269-L1273 HydrophobicContact CB-CG 4.08Å; L1269-L1273 WeakPolarHBondContact O-CB 3.49Å; L1269-L1273 VanDerWaalsContact O-CG 3.27Å; L1269-L1273 WeakPolarHBondContact O-CG 3.27Å; L1269-L1273 PolarHBondContact O-N 3.5Å
1270	R	58.6	Low	55.7	Low	124 Å²	124	81.4 Å²	81.4	47%	0.468	41%	0.405	S	S	.	.	H	α-helix	trans	-62	-39.7	-176.6	-170	-178.1	178.5	-161.5	2	111.9	L1266 N1267 D1268 K1274	L1266-R1270 WeakPolarHBondContact O-CB 3.46Å; L1266-R1270 PolarHBondContact O-N 3Å; N1267-R1270 WeakPolarHBondContact O-CB 3.19Å; N1267-R1270 PolarHBondContact O-N 2.9Å; D1268-R1270 PolarHBondContact O-N 3.04Å; D1268-R1270 VanDerWaalsContact O-N 3.17Å; R1270-K1274 WeakPolarHBondContact O-CB 2.89Å; R1270-K1274 WeakPolarHBondContact O-CG 3.33Å; R1270-K1274 PolarHBondContact O-N 3.18Å; R1270-K1274 VanDerWaalsContact O-N 3.08Å
1271	E	58.4	Low	56.9	Low	82 Å²	82	80.3 Å²	80.3	38%	0.383	41%	0.405	S	S	.	.	H	α-helix	trans	-71.4	-30.9	174.5	-81.7	-61.5	120.5	0	0	112.7	L1269 K1274 R1275	L1269-E1271 VanDerWaalsContact C-N 3.31Å; L1269-E1271 PolarHBondContact O-N 3.41Å; E1271-K1274 WeakPolarHBondContact OE1-CD 3.31Å; E1271-K1274 IonicContact OE1-NZ 3.24Å; E1271-K1274 PolarHBondContact OE1-NZ 3.43Å; E1271-R1275 WeakPolarHBondContact O-CB 3.49Å; E1271-R1275 VanDerWaalsContact O-CD 3.24Å; E1271-R1275 WeakPolarHBondContact O-CD 3.11Å; E1271-R1275 WeakPolarHBondContact O-CG 3.44Å; E1271-R1275 PolarHBondContact O-N 3.41Å; E1271-R1275 PolarHBondContact O-NE 3.42Å; E1271-R1275 IonicContact OE2-CZ 2.75Å; E1271-R1275 IonicContact OE2-NE 2.75Å; E1271-R1275 IonicContact OE2-NH2 3.83Å; E1271-R1275 PolarHBondContact OE2-NH2 3.07Å
1272	I	63.2	Low	58	Low	84 Å²	84	81.9 Å²	81.9	43%	0.431	42%	0.421	S	S	.	.	H	α-helix	trans	-71.7	-49.4	176.2	-69.8	165.2	0	0	0	109.7	L1269 K1274 R1275 F1276	L1269-I1272 HydrophobicContact CD2-CB 4.26Å; L1269-I1272 HydrophobicContact CD2-CD1 3.75Å; L1269-I1272 HydrophobicContact CD2-CG2 4.18Å; L1269-I1272 CarbonylContact O-C 3.1Å; L1269-I1272 PolarHBondContact O-N 2.87Å; I1272-K1274 PolarHBondContact O-N 3.34Å; I1272-R1275 CarbonylContact O-C 3.6Å; I1272-R1275 WeakPolarHBondContact O-CA 3.45Å; I1272-R1275 WeakPolarHBondContact O-CB 3.25Å; I1272-R1275 PolarHBondContact O-N 2.67Å; I1272-F1276 HydrophobicContact CG2-CD2 3.68Å; I1272-F1276 HydrophobicContact CG2-CE2 4.07Å; I1272-F1276 WeakPolarHBondContact O-CD2 3.13Å; I1272-F1276 PolarHBondContact O-N 3.28Å
1273	L	58.5	Low	59.1	Low	40 Å²	40	80.7 Å²	80.7	21%	0.209	41%	0.412	C	S	.	.	H	α-helix	trans	-65	-39.4	-179.5	-66.9	162.9	0	0	0	112.1	L1266 L1269 R1275 F1276 V1277 L1356	L1266-L1273 HydrophobicContact CD2-CD1 3.66Å; L1269-L1273 HydrophobicContact CB-CD1 3.78Å; L1269-L1273 HydrophobicContact CB-CG 4.08Å; L1269-L1273 WeakPolarHBondContact O-CB 3.49Å; L1269-L1273 VanDerWaalsContact O-CG 3.27Å; L1269-L1273 WeakPolarHBondContact O-CG 3.27Å; L1269-L1273 PolarHBondContact O-N 3.5Å; L1273-R1275 PolarHBondContact O-N 2.83Å; L1273-F1276 PolarHBondContact O-N 3Å; L1273-V1277 HydrophobicContact CB-CG2 4.04Å; L1273-V1277 HydrophobicContact CD2-CG2 3.68Å; L1273-V1277 WeakPolarHBondContact O-CB 3.5Å; L1273-V1277 WeakPolarHBondContact O-CG2 3.43Å; L1273-V1277 PolarHBondContact O-N 3.48Å; L1273-L1356 HydrophobicContact CB-CD2 3.79Å; L1273-L1356 HydrophobicContact CD1-CD1 4.18Å; L1273-L1356 HydrophobicContact CD1-CD2 4.45Å
1274	K	60.6	Low	59.8	Low	95 Å²	95	83.5 Å²	83.5	41%	0.413	42%	0.421	S	S	.	.	H	α-helix	trans	-57.1	-26.6	168.2	-78.9	174	-173.9	175.9	0	113.7	R1270 E1271 I1272	R1270-K1274 WeakPolarHBondContact O-CB 2.89Å; R1270-K1274 WeakPolarHBondContact O-CG 3.33Å; R1270-K1274 PolarHBondContact O-N 3.18Å; R1270-K1274 VanDerWaalsContact O-N 3.08Å; E1271-K1274 WeakPolarHBondContact OE1-CD 3.31Å; E1271-K1274 IonicContact OE1-NZ 3.24Å; E1271-K1274 PolarHBondContact OE1-NZ 3.43Å; I1272-K1274 PolarHBondContact O-N 3.34Å
1275	R	58	Low	60.1	Low	130 Å²	130	83.3 Å²	83.3	49%	0.491	43%	0.425	S	S	.	.	H	α-helix	trans	-97.6	-8.7	-177.7	-70	171.3	-159.6	-160.3	6.2	114.2	E1271 I1272 L1273 F1278	E1271-R1275 WeakPolarHBondContact O-CB 3.49Å; E1271-R1275 VanDerWaalsContact O-CD 3.24Å; E1271-R1275 WeakPolarHBondContact O-CD 3.11Å; E1271-R1275 WeakPolarHBondContact O-CG 3.44Å; E1271-R1275 PolarHBondContact O-N 3.41Å; E1271-R1275 PolarHBondContact O-NE 3.42Å; E1271-R1275 IonicContact OE2-CZ 2.75Å; E1271-R1275 IonicContact OE2-NE 2.75Å; E1271-R1275 IonicContact OE2-NH2 3.83Å; E1271-R1275 PolarHBondContact OE2-NH2 3.07Å; I1272-R1275 CarbonylContact O-C 3.6Å; I1272-R1275 WeakPolarHBondContact O-CA 3.45Å; I1272-R1275 WeakPolarHBondContact O-CB 3.25Å; I1272-R1275 PolarHBondContact O-N 2.67Å; L1273-R1275 PolarHBondContact O-N 2.83Å; R1275-F1278 WeakPolarHBondContact O-CE2 3.34Å; R1275-F1278 WeakPolarHBondContact O-CZ 3.23Å
1276	F	57	Low	60.3	Low	148 Å²	148	80.3 Å²	80.3	65%	0.649	42%	0.423	S	S	*	.	H	α-helix	trans	-135.4	-15.6	-173.2	-66.6	-64.4	0	0	0	115.5	I1272 L1273 F1278	I1272-F1276 HydrophobicContact CG2-CD2 3.68Å; I1272-F1276 HydrophobicContact CG2-CE2 4.07Å; I1272-F1276 WeakPolarHBondContact O-CD2 3.13Å; I1272-F1276 PolarHBondContact O-N 3.28Å; L1273-F1276 PolarHBondContact O-N 3Å; F1276-F1278 PolarHBondContact O-N 2.85Å
1277	V	54.9	Low	60.2	Low	40 Å²	40	79.8 Å²	79.8	24%	0.242	43%	0.429	C	S	.	.			trans	-82.3	83.9	178.2	-179.6	0	0	0	0	110.1	L1273 L1356 C1360	L1273-V1277 HydrophobicContact CB-CG2 4.04Å; L1273-V1277 HydrophobicContact CD2-CG2 3.68Å; L1273-V1277 WeakPolarHBondContact O-CB 3.5Å; L1273-V1277 WeakPolarHBondContact O-CG2 3.43Å; L1273-V1277 PolarHBondContact O-N 3.48Å; V1277-L1356 HydrophobicContact CG2-CD2 4.25Å; V1277-C1360 VanDerWaalsContact CG1-SG 3.56Å
1278	F	55.5	Low	59.7	Low	105 Å²	105	83.6 Å²	83.6	46%	0.461	44%	0.442	S	S	.	.			trans	-111.9	0.9	-176	-62.5	-56.1	0	0	0	115.1	R1275 F1276 Q1363	R1275-F1278 WeakPolarHBondContact O-CE2 3.34Å; R1275-F1278 WeakPolarHBondContact O-CZ 3.23Å; F1276-F1278 PolarHBondContact O-N 2.85Å; F1278-Q1363 PolarHBondContact O-NE2 3.45Å
1279	V	62.1	Low	59.4	Low	117 Å²	117	81.9 Å²	81.9	71%	0.709	44%	0.436	S	S	*	.			trans	-94.5	108.5	-171.9	-174.9	0	0	0	0	111.1
1280	V	61.2	Low	58.9	Low	20 Å²	20	83.9 Å²	83.9	12%	0.121	45%	0.446	C	S	.	.			trans	-88.2	134.4	165	179.5	0	0	0	0	108.2	I942 P944 A1282 Q1363	I942-V1280 HydrophobicContact CG2-CB 4.36Å; P944-V1280 HydrophobicContact CB-CG1 4.4Å; P944-V1280 HydrophobicContact CG-CG1 4.47Å; V1280-A1282 PolarHBondContact O-N 2.97Å; V1280-Q1363 HydrophobicContact CG2-CB 3.61Å
1281	P	71.3	Confident	58.7	Low	60 Å²	60	83.5 Å²	83.5	39%	0.39	45%	0.45	S	S	.	.			trans	-64.8	134.5	174.5	28	-33.8	0	0	0	110.1	P944 V1283 I1284 C1360	P944-P1281 WeakPolarHBondContact CA-O 3.33Å; P944-P1281 VanDerWaalsContact CB-O 3.31Å; P944-P1281 WeakPolarHBondContact CB-O 3.38Å; P1281-V1283 VanDerWaalsContact C-N 3.27Å; P1281-V1283 PolarHBondContact O-N 2.85Å; P1281-I1284 HydrophobicContact CG-CD1 4.2Å; P1281-I1284 HydrophobicContact CG-CG1 4.31Å; P1281-C1360 WeakPolarHBondContact CD-O 3.4Å
1282	A	68.1	Low	58.6	Low	82 Å²	82	80.1 Å²	80.1	68%	0.678	44%	0.435	S	S	*	.	S	Bend	trans	-62.9	-32.1	-174.3	0	0	0	0	0	113.5	F945 V1280	F945-A1282 WeakPolarHBondContact CB-O 3.4Å; F945-A1282 PolarHBondContact N-O 3.07Å; V1280-A1282 PolarHBondContact O-N 2.97Å
1283	V	68.3	Low	58	Low	84 Å²	84	80.1 Å²	80.1	51%	0.509	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	143.3	-174	-176.7	0	0	0	0	111.2	F945 V947 P1281	F945-V1283 HydrophobicContact CB-CG2 4.46Å; F945-V1283 HydrophobicContact CD1-CG1 4.48Å; F945-V1283 CarbonylContact O-C 3.18Å; F945-V1283 WeakPolarHBondContact O-CA 3.21Å; V947-V1283 HydrophobicContact CG2-CG1 3.59Å; P1281-V1283 VanDerWaalsContact C-N 3.27Å; P1281-V1283 PolarHBondContact O-N 2.85Å
1284	I	67.5	Low	57.7	Low	79 Å²	79	81.3 Å²	81.3	41%	0.405	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	142.8	170.4	-64.3	179.8	0	0	0	109.3	P944 F945 R946 V947 P1281	P944-I1284 HydrophobicContact CB-CB 4.4Å; P944-I1284 HydrophobicContact CB-CD1 3.63Å; P944-I1284 HydrophobicContact CB-CG1 3.74Å; P944-I1284 HydrophobicContact CG-CD1 3.6Å; P944-I1284 HydrophobicContact CG-CG1 4.27Å; F945-I1284 PolarHBondContact O-N 2.78Å; R946-I1284 WeakPolarHBondContact CA-O 3.32Å; V947-I1284 PolarHBondContact N-O 3.4Å; P1281-I1284 HydrophobicContact CG-CD1 4.2Å; P1281-I1284 HydrophobicContact CG-CG1 4.31Å
1285	S	61.3	Low	57.3	Low	63 Å²	63	83.3 Å²	83.3	44%	0.441	46%	0.459	S	S	.	.			trans	-120.1	164.9	168.9	60.3	0	0	0	0	111
1286	S	54.7	Low	56.7	Low	70 Å²	70	79.9 Å²	79.9	49%	0.49	46%	0.458	S	S	.	.			trans	-94.4	-22.3	-179	-15.5	0	0	0	0	112.9	R946 D949	R946-S1286 PolarHBondContact NE-OG 3.19Å; R946-S1286 PolarHBondContact NH2-OG 3.19Å; D949-S1286 WeakPolarHBondContact OD1-CA 3.44Å; D949-S1286 WeakPolarHBondContact OD1-CB 3.48Å; D949-S1286 PolarHBondContact OD1-N 2.82Å; D949-S1286 VanDerWaalsContact OD1-N 3.11Å; D949-S1286 PolarHBondContact OD1-OG 2.79Å; D949-S1286 WeakPolarHBondContact OD2-CB 3.33Å; D949-S1286 PolarHBondContact OD2-OG 3.02Å
1287	G	51.1	Low	55.9	Low	36 Å²	36	75.2 Å²	75.2	37%	0.371	44%	0.44	S	S	.	.			trans	165.2	-160.4	179.9	0	0	0	0	0	111	L952	L952-G1287 VanDerWaalsContact CD1-O 3.27Å; L952-G1287 WeakPolarHBondContact CD1-O 3.39Å
1288	F	45.9	Very low	55.7	Low	154 Å²	154	77.2 Å²	77.2	68%	0.675	45%	0.447	S	S	*	.			trans	-121.7	151.2	164.7	59.7	-94	0	0	0	109	L952 L1290	L952-F1288 HydrophobicContact CB-CB 4.29Å; L952-F1288 WeakPolarHBondContact O-CA 3.43Å; F1288-L1290 HydrophobicContact CD2-CD2 4.44Å; F1288-L1290 HydrophobicContact CD2-CG 4.43Å; F1288-L1290 HydrophobicContact CE2-CD2 4.37Å; F1288-L1290 HydrophobicContact CE2-CG 4.31Å
1289	T	50.4	Low	55.5	Low	60 Å²	60	77.3 Å²	77.3	37%	0.368	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	139.7	-178.1	54.9	0	0	0	0	110.7	D949 L952 T953 Y954	D949-T1289 HydrophobicContact CB-CG2 4.16Å; D949-T1289 PolarHBondContact O-OG1 3.3Å; D949-T1289 VanDerWaalsContact O-OG1 3.11Å; L952-T1289 PolarHBondContact O-N 3.42Å; T953-T1289 WeakPolarHBondContact CA-O 3.18Å; T953-T1289 WeakPolarHBondContact CG2-OG1 3.3Å; Y954-T1289 PolarHBondContact N-O 3.38Å
1290	L	50.7	Low	54.6	Low	89 Å²	89	76.2 Å²	76.2	47%	0.466	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	105.2	-177	-70.6	173.3	0	0	0	109.8	L956 F1288	L956-L1290 HydrophobicContact CD1-CD2 4.06Å; F1288-L1290 HydrophobicContact CD2-CD2 4.44Å; F1288-L1290 HydrophobicContact CD2-CG 4.43Å; F1288-L1290 HydrophobicContact CE2-CD2 4.37Å; F1288-L1290 HydrophobicContact CE2-CG 4.31Å
1291	Q	53.6	Low	54	Low	116 Å²	116	78 Å²	78	54%	0.542	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	116.4	179.4	-160.2	-179.4	18.4	0	0	109.3	Y954 L956	Y954-Q1291 PolarHBondContact O-N 2.8Å; Y954-Q1291 VanDerWaalsContact O-N 3.16Å; L956-Q1291 PolarHBondContact N-O 3.46Å; L956-Q1291 VanDerWaalsContact N-O 3.08Å
1292	V	56.8	Low	53.3	Low	11 Å²	11	78.9 Å²	78.9	7%	0.067	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	122.6	-174.6	-179.5	0	0	0	0	110.2	N1294 L1297 L1301	V1292-N1294 PolarHBondContact O-N 3.4Å; V1292-L1297 HydrophobicContact CG1-CB 3.8Å; V1292-L1297 HydrophobicContact CG1-CD1 4.16Å; V1292-L1301 HydrophobicContact CG2-CD1 3.79Å
1293	S	51.7	Low	52.3	Low	83 Å²	83	78 Å²	78	58%	0.58	43%	0.429	S	S	*	.	S	Bend	trans	-66.1	26.9	-176.3	49.1	0	0	0	0	116.1
1294	N	51.2	Low	51.2	Low	65 Å²	65	77.5 Å²	77.5	35%	0.348	42%	0.42	S	S	.	.			trans	-151.6	108.4	176.5	177.3	9.2	0	0	0	109.9	V1292 A1296 L1297 E1298	V1292-N1294 PolarHBondContact O-N 3.4Å; N1294-A1296 PolarHBondContact O-N 3.11Å; N1294-A1296 WeakPolarHBondContact OD1-CB 3.17Å; N1294-A1296 PolarHBondContact OD1-N 3.09Å; N1294-A1296 VanDerWaalsContact OD1-N 3.08Å; N1294-L1297 HydrophobicContact CB-CB 4.2Å; N1294-L1297 HydrophobicContact CB-CD1 4.2Å; N1294-L1297 HydrophobicContact CB-CG 4.39Å; N1294-L1297 WeakPolarHBondContact O-CA 3.25Å; N1294-L1297 WeakPolarHBondContact O-CB 3.36Å; N1294-L1297 PolarHBondContact O-N 3.26Å; N1294-E1298 PolarHBondContact O-N 3.04Å
1295	H	52.1	Low	50.3	Low	138 Å²	138	77.9 Å²	77.9	64%	0.639	42%	0.421	S	S	*	.	H	α-helix	trans	-53.9	-25.2	178.9	-156.7	-40.2	0	0	0	113.4	H1299	H1295-H1299 VanDerWaalsContact O-CB 3.23Å; H1295-H1299 WeakPolarHBondContact O-CB 3.12Å; H1295-H1299 PolarHBondContact O-N 2.76Å
1296	A	44.8	Very low	49.8	Very low	57 Å²	57	77.8 Å²	77.8	47%	0.471	42%	0.415	S	S	.	.	H	α-helix	trans	-81.4	-22.6	174.8	0	0	0	0	0	114	N1294 Q1300	N1294-A1296 PolarHBondContact O-N 3.11Å; N1294-A1296 WeakPolarHBondContact OD1-CB 3.17Å; N1294-A1296 PolarHBondContact OD1-N 3.09Å; N1294-A1296 VanDerWaalsContact OD1-N 3.08Å; A1296-Q1300 WeakPolarHBondContact O-CB 3.49Å; A1296-Q1300 WeakPolarHBondContact O-CG 3.47Å; A1296-Q1300 PolarHBondContact O-N 2.89Å
1297	L	41	Very low	49.1	Very low	50 Å²	50	82.1 Å²	82.1	26%	0.262	42%	0.42	S	S	.	.	H	α-helix	trans	-83.5	-39.3	168.9	-81	171.9	0	0	0	111.1	V961 V1292 N1294 Q1300 L1301	V961-L1297 HydrophobicContact CG1-CD1 4.14Å; V1292-L1297 HydrophobicContact CG1-CB 3.8Å; V1292-L1297 HydrophobicContact CG1-CD1 4.16Å; N1294-L1297 HydrophobicContact CB-CB 4.2Å; N1294-L1297 HydrophobicContact CB-CD1 4.2Å; N1294-L1297 HydrophobicContact CB-CG 4.39Å; N1294-L1297 WeakPolarHBondContact O-CA 3.25Å; N1294-L1297 WeakPolarHBondContact O-CB 3.36Å; N1294-L1297 PolarHBondContact O-N 3.26Å; L1297-Q1300 CarbonylContact O-C 3.55Å; L1297-Q1300 WeakPolarHBondContact O-CA 3.24Å; L1297-Q1300 WeakPolarHBondContact O-CB 3.14Å; L1297-Q1300 PolarHBondContact O-N 3.28Å; L1297-Q1300 VanDerWaalsContact O-N 3.08Å; L1297-L1301 WeakPolarHBondContact O-CB 3.31Å; L1297-L1301 WeakPolarHBondContact O-CG 3.34Å; L1297-L1301 PolarHBondContact O-N 3.09Å
1298	E	50.6	Low	48.7	Very low	83 Å²	83	84.6 Å²	84.6	39%	0.388	42%	0.424	S	S	.	.	H	α-helix	trans	-56.5	-52.6	171.1	179.6	171.8	-142.7	0	0	110.9	N1294 Q1300 L1301 I1302	N1294-E1298 PolarHBondContact O-N 3.04Å; E1298-Q1300 PolarHBondContact O-N 3Å; E1298-L1301 PolarHBondContact O-N 3.42Å; E1298-L1301 VanDerWaalsContact O-N 3.08Å; E1298-I1302 HydrophobicContact CG-CD1 4.04Å; E1298-I1302 WeakPolarHBondContact O-CG1 3.12Å; E1298-I1302 PolarHBondContact O-N 3.48Å
1299	H	51	Low	48.7	Very low	107 Å²	107	79.1 Å²	79.1	50%	0.495	40%	0.399	S	S	.	.	H	α-helix	trans	-66.1	-21.1	175.3	-155.3	-20.3	0	0	0	112.8	H1295 N1303	H1295-H1299 VanDerWaalsContact O-CB 3.23Å; H1295-H1299 WeakPolarHBondContact O-CB 3.12Å; H1295-H1299 PolarHBondContact O-N 2.76Å; H1299-N1303 PolarHBondContact ND1-ND2 3.07Å; H1299-N1303 VanDerWaalsContact ND1-ND2 3.13Å; H1299-N1303 WeakPolarHBondContact O-CB 3.3Å; H1299-N1303 PolarHBondContact O-N 3.5Å; H1299-N1303 VanDerWaalsContact O-N 3.11Å; H1299-N1303 PolarHBondContact O-ND2 2.94Å
1300	Q	43.4	Very low	48.4	Very low	93 Å²	93	80 Å²	80	44%	0.435	40%	0.401	S	S	.	.	H	α-helix	trans	-80.6	-33.1	169.7	-84.1	-178.6	15.6	0	0	113.5	A1296 L1297 E1298 N1303 Q1304	A1296-Q1300 WeakPolarHBondContact O-CB 3.49Å; A1296-Q1300 WeakPolarHBondContact O-CG 3.47Å; A1296-Q1300 PolarHBondContact O-N 2.89Å; L1297-Q1300 CarbonylContact O-C 3.55Å; L1297-Q1300 WeakPolarHBondContact O-CA 3.24Å; L1297-Q1300 WeakPolarHBondContact O-CB 3.14Å; L1297-Q1300 PolarHBondContact O-N 3.28Å; L1297-Q1300 VanDerWaalsContact O-N 3.08Å; E1298-Q1300 PolarHBondContact O-N 3Å; Q1300-N1303 CarbonylContact O-C 3.57Å; Q1300-N1303 PolarHBondContact O-N 3.47Å; Q1300-Q1304 WeakPolarHBondContact O-CB 3.28Å; Q1300-Q1304 WeakPolarHBondContact O-CG 3.46Å; Q1300-Q1304 PolarHBondContact O-N 2.94Å
1301	L	48.6	Very low	47.6	Very low	57 Å²	57	78.7 Å²	78.7	30%	0.298	39%	0.394	S	S	.	.	H	α-helix	trans	-72.5	-43.5	175.4	-75.9	166.8	0	0	0	110.2	V1292 L1297 E1298 N1303 Q1304 E1305	V1292-L1301 HydrophobicContact CG2-CD1 3.79Å; L1297-L1301 WeakPolarHBondContact O-CB 3.31Å; L1297-L1301 WeakPolarHBondContact O-CG 3.34Å; L1297-L1301 PolarHBondContact O-N 3.09Å; E1298-L1301 PolarHBondContact O-N 3.42Å; E1298-L1301 VanDerWaalsContact O-N 3.08Å; L1301-N1303 VanDerWaalsContact C-N 3.33Å; L1301-N1303 PolarHBondContact O-N 3.41Å; L1301-Q1304 CarbonylContact O-C 3.59Å; L1301-Q1304 PolarHBondContact O-N 2.99Å; L1301-E1305 WeakPolarHBondContact O-CB 3.29Å; L1301-E1305 PolarHBondContact O-N 3.14Å
1302	I	56.6	Low	46.8	Very low	79 Å²	79	74.4 Å²	74.4	41%	0.405	37%	0.374	S	S	.	.	H	α-helix	trans	-59	-45	169.3	-65.7	166.2	0	0	0	110	E1298 Q1304 E1305 I1306	E1298-I1302 HydrophobicContact CG-CD1 4.04Å; E1298-I1302 WeakPolarHBondContact O-CG1 3.12Å; E1298-I1302 PolarHBondContact O-N 3.48Å; I1302-Q1304 VanDerWaalsContact C-N 3.32Å; I1302-Q1304 PolarHBondContact O-N 2.93Å; I1302-E1305 PolarHBondContact O-N 3.41Å; I1302-I1306 HydrophobicContact CG2-CD1 3.78Å; I1302-I1306 HydrophobicContact CG2-CG1 4.46Å; I1302-I1306 WeakPolarHBondContact O-CB 3.45Å; I1302-I1306 VanDerWaalsContact O-CG1 3.24Å; I1302-I1306 WeakPolarHBondContact O-CG1 3.3Å; I1302-I1306 PolarHBondContact O-N 2.72Å
1303	N	47.6	Very low	45.9	Very low	65 Å²	65	75.2 Å²	75.2	35%	0.348	38%	0.378	S	S	.	.	H	α-helix	trans	-66.8	-27.1	173.8	-89.5	-61	0	0	0	113.8	H1299 Q1300 L1301 R1307	H1299-N1303 PolarHBondContact ND1-ND2 3.07Å; H1299-N1303 VanDerWaalsContact ND1-ND2 3.13Å; H1299-N1303 WeakPolarHBondContact O-CB 3.3Å; H1299-N1303 PolarHBondContact O-N 3.5Å; H1299-N1303 VanDerWaalsContact O-N 3.11Å; H1299-N1303 PolarHBondContact O-ND2 2.94Å; Q1300-N1303 CarbonylContact O-C 3.57Å; Q1300-N1303 PolarHBondContact O-N 3.47Å; L1301-N1303 VanDerWaalsContact C-N 3.33Å; L1301-N1303 PolarHBondContact O-N 3.41Å; N1303-R1307 WeakPolarHBondContact O-CB 3.47Å; N1303-R1307 PolarHBondContact O-N 3.22Å
1304	Q	45.3	Very low	45.1	Very low	72 Å²	72	76 Å²	76	34%	0.336	38%	0.384	S	S	.	.	H	α-helix	trans	-77.2	-39.1	173	-81.8	-174.7	29.9	0	0	111	Q1300 L1301 I1302 R1307 I1308	Q1300-Q1304 WeakPolarHBondContact O-CB 3.28Å; Q1300-Q1304 WeakPolarHBondContact O-CG 3.46Å; Q1300-Q1304 PolarHBondContact O-N 2.94Å; L1301-Q1304 CarbonylContact O-C 3.59Å; L1301-Q1304 PolarHBondContact O-N 2.99Å; I1302-Q1304 VanDerWaalsContact C-N 3.32Å; I1302-Q1304 PolarHBondContact O-N 2.93Å; Q1304-R1307 CarbonylContact O-C 3.53Å; Q1304-R1307 PolarHBondContact O-N 3.24Å; Q1304-I1308 VanDerWaalsContact O-CB 3.25Å; Q1304-I1308 WeakPolarHBondContact O-CB 3.35Å; Q1304-I1308 WeakPolarHBondContact O-CD1 3.48Å; Q1304-I1308 WeakPolarHBondContact O-CG1 2.93Å; Q1304-I1308 PolarHBondContact O-N 3.14Å
1305	E	48.4	Very low	44.3	Very low	87 Å²	87	74.8 Å²	74.8	41%	0.407	38%	0.38	S	S	.	.	H	α-helix	trans	-63.7	-49.1	174.9	-164.6	-167.8	163.1	0	0	110.4	L1301 I1302 R1307 I1308 R1309 F2024	L1301-E1305 WeakPolarHBondContact O-CB 3.29Å; L1301-E1305 PolarHBondContact O-N 3.14Å; I1302-E1305 PolarHBondContact O-N 3.41Å; E1305-R1307 PolarHBondContact O-N 3.26Å; E1305-I1308 PolarHBondContact O-N 3.42Å; E1305-R1309 VanDerWaalsContact O-CG 3.27Å; E1305-R1309 WeakPolarHBondContact O-CG 3.48Å; E1305-R1309 PolarHBondContact O-N 2.9Å; E1305-R1309 IonicContact OE1-CZ 3.65Å; E1305-R1309 IonicContact OE1-NE 2.77Å; E1305-R1309 IonicContact OE1-NH2 3.51Å; E1305-R1309 PolarHBondContact OE1-NH2 3.02Å; E1305-F2024 HydrophobicContact CB-CE2 4.3Å; E1305-F2024 HydrophobicContact CG-CD2 4.49Å; E1305-F2024 HydrophobicContact CG-CE2 3.86Å; E1305-F2024 WeakPolarHBondContact OE1-CD2 3.3Å
1306	I	51.3	Low	43.5	Very low	62 Å²	62	70.3 Å²	70.3	32%	0.318	37%	0.371	S	S	.	.	H	α-helix	trans	-56.5	-49.6	172	-67.5	168	0	0	0	110.1	I1302 I1308 R1309 D1310 F2024	I1302-I1306 HydrophobicContact CG2-CD1 3.78Å; I1302-I1306 HydrophobicContact CG2-CG1 4.46Å; I1302-I1306 WeakPolarHBondContact O-CB 3.45Å; I1302-I1306 VanDerWaalsContact O-CG1 3.24Å; I1302-I1306 WeakPolarHBondContact O-CG1 3.3Å; I1302-I1306 PolarHBondContact O-N 2.72Å; I1306-I1308 VanDerWaalsContact C-N 3.29Å; I1306-I1308 PolarHBondContact O-N 3.37Å; I1306-R1309 CarbonylContact O-C 3.49Å; I1306-R1309 PolarHBondContact O-N 3.43Å; I1306-R1309 VanDerWaalsContact O-N 3.16Å; I1306-D1310 WeakPolarHBondContact O-CB 3.19Å; I1306-D1310 VanDerWaalsContact O-CG 3.28Å; I1306-D1310 PolarHBondContact O-N 3.04Å; I1306-F2024 HydrophobicContact CG1-CE2 3.81Å; I1306-F2024 HydrophobicContact CG1-CZ 4.16Å
1307	R	38.9	Very low	43	Very low	161 Å²	161	67.7 Å²	67.7	61%	0.608	35%	0.349	S	S	*	.	H	α-helix	trans	-66	-28	179.4	-170.1	-178.9	-56.6	169.9	4.6	113.5	N1303 Q1304 E1305 M1311	N1303-R1307 WeakPolarHBondContact O-CB 3.47Å; N1303-R1307 PolarHBondContact O-N 3.22Å; Q1304-R1307 CarbonylContact O-C 3.53Å; Q1304-R1307 PolarHBondContact O-N 3.24Å; E1305-R1307 PolarHBondContact O-N 3.26Å; R1307-M1311 WeakPolarHBondContact O-CB 3.35Å; R1307-M1311 WeakPolarHBondContact O-CG 3.44Å; R1307-M1311 PolarHBondContact O-N 3.31Å
1308	I	43.9	Very low	42.5	Very low	88 Å²	88	67.1 Å²	67.1	45%	0.451	35%	0.346	S	S	.	.	H	α-helix	trans	-72.9	-47.5	171.8	-74.5	163.5	0	0	0	109.2	Q1304 E1305 I1306 D1310 M1311 L1312	Q1304-I1308 VanDerWaalsContact O-CB 3.25Å; Q1304-I1308 WeakPolarHBondContact O-CB 3.35Å; Q1304-I1308 WeakPolarHBondContact O-CD1 3.48Å; Q1304-I1308 WeakPolarHBondContact O-CG1 2.93Å; Q1304-I1308 PolarHBondContact O-N 3.14Å; E1305-I1308 PolarHBondContact O-N 3.42Å; I1306-I1308 VanDerWaalsContact C-N 3.29Å; I1306-I1308 PolarHBondContact O-N 3.37Å; I1308-D1310 VanDerWaalsContact C-N 3.3Å; I1308-D1310 PolarHBondContact O-N 2.69Å; I1308-M1311 WeakPolarHBondContact O-CB 3.38Å; I1308-M1311 PolarHBondContact O-N 2.71Å; I1308-M1311 VanDerWaalsContact O-N 3.15Å; I1308-L1312 HydrophobicContact CG2-CD1 3.88Å; I1308-L1312 HydrophobicContact CG2-CG 4.35Å; I1308-L1312 WeakPolarHBondContact O-CB 3.36Å; I1308-L1312 WeakPolarHBondContact O-CG 3.37Å; I1308-L1312 PolarHBondContact O-N 2.76Å
1309	R	45.7	Very low	41.8	Very low	39 Å²	39	66.5 Å²	66.5	15%	0.147	34%	0.344	C	S	.	.	H	α-helix	trans	-58.1	-43.1	173.5	-60.3	-138.2	-147.7	100.1	-4.4	111.2	E1305 I1306 L1312 L1313 H2023 F2024	E1305-R1309 VanDerWaalsContact O-CG 3.27Å; E1305-R1309 WeakPolarHBondContact O-CG 3.48Å; E1305-R1309 PolarHBondContact O-N 2.9Å; E1305-R1309 IonicContact OE1-CZ 3.65Å; E1305-R1309 IonicContact OE1-NE 2.77Å; E1305-R1309 IonicContact OE1-NH2 3.51Å; E1305-R1309 PolarHBondContact OE1-NH2 3.02Å; I1306-R1309 CarbonylContact O-C 3.49Å; I1306-R1309 PolarHBondContact O-N 3.43Å; I1306-R1309 VanDerWaalsContact O-N 3.16Å; R1309-L1312 CarbonylContact O-C 3.25Å; R1309-L1312 PolarHBondContact O-N 3.26Å; R1309-L1312 VanDerWaalsContact O-N 3.17Å; R1309-L1313 WeakPolarHBondContact O-CB 3.27Å; R1309-L1313 VanDerWaalsContact O-CG 3.23Å; R1309-L1313 WeakPolarHBondContact O-CG 3.36Å; R1309-L1313 PolarHBondContact O-N 3.37Å; R1309-H2023 PolarHBondContact NH1-O 3.19Å; R1309-F2024 HydrophobicContact CB-CE1 4.47Å; R1309-F2024 HydrophobicContact CB-CZ 3.71Å; R1309-F2024 HydrophobicContact CG-CE1 4Å; R1309-F2024 HydrophobicContact CG-CE2 4.12Å; R1309-F2024 HydrophobicContact CG-CZ 3.21Å
1310	D	43.7	Very low	40.9	Very low	77 Å²	77	63.8 Å²	63.8	41%	0.412	34%	0.335	S	S	.	.	H	α-helix	trans	-65.3	-37.9	175.6	-71.1	-19.5	0	0	0	112.3	I1306 I1308 S1314	I1306-D1310 WeakPolarHBondContact O-CB 3.19Å; I1306-D1310 VanDerWaalsContact O-CG 3.28Å; I1306-D1310 PolarHBondContact O-N 3.04Å; I1308-D1310 VanDerWaalsContact C-N 3.3Å; I1308-D1310 PolarHBondContact O-N 2.69Å; D1310-S1314 WeakPolarHBondContact O-CB 3.19Å; D1310-S1314 PolarHBondContact O-N 3.25Å; D1310-S1314 PolarHBondContact O-OG 2.73Å
1311	M	33.6	Very low	40.4	Very low	63 Å²	63	61.1 Å²	61.1	31%	0.31	33%	0.327	S	S	.	.	H	α-helix	trans	-62.2	-43.5	169.4	-90	-178.3	57.7	0	0	111.6	I1167 R1307 I1308 S1314 S1315	I1167-M1311 HydrophobicContact CD1-CE 4.01Å; R1307-M1311 WeakPolarHBondContact O-CB 3.35Å; R1307-M1311 WeakPolarHBondContact O-CG 3.44Å; R1307-M1311 PolarHBondContact O-N 3.31Å; I1308-M1311 WeakPolarHBondContact O-CB 3.38Å; I1308-M1311 PolarHBondContact O-N 2.71Å; I1308-M1311 VanDerWaalsContact O-N 3.15Å; M1311-S1314 WeakPolarHBondContact CA-OG 2.96Å; M1311-S1314 PolarHBondContact O-N 2.93Å; M1311-S1314 PolarHBondContact O-OG 3.3Å; M1311-S1315 WeakPolarHBondContact O-CB 3.16Å; M1311-S1315 PolarHBondContact O-N 3.43Å; M1311-S1315 PolarHBondContact O-OG 2.78Å
1312	L	37.8	Very low	39.5	Very low	25 Å²	25	61 Å²	61	13%	0.131	32%	0.324	C	S	.	.	H	α-helix	trans	-69.4	-33.3	-179.9	-65.2	171.4	0	0	0	112.6	L1166 I1192 I1308 R1309 C1317 L1318	L1166-L1312 HydrophobicContact CD2-CD2 4.28Å; I1192-L1312 HydrophobicContact CD1-CD2 3.39Å; I1192-L1312 HydrophobicContact CG1-CD2 4.5Å; I1308-L1312 HydrophobicContact CG2-CD1 3.88Å; I1308-L1312 HydrophobicContact CG2-CG 4.35Å; I1308-L1312 WeakPolarHBondContact O-CB 3.36Å; I1308-L1312 WeakPolarHBondContact O-CG 3.37Å; I1308-L1312 PolarHBondContact O-N 2.76Å; R1309-L1312 CarbonylContact O-C 3.25Å; R1309-L1312 PolarHBondContact O-N 3.26Å; R1309-L1312 VanDerWaalsContact O-N 3.17Å; L1312-C1317 PolarHBondContact O-N 2.77Å; L1312-L1318 HydrophobicContact CB-CB 4.25Å; L1312-L1318 HydrophobicContact CB-CD1 3.84Å; L1312-L1318 HydrophobicContact CB-CG 3.97Å; L1312-L1318 HydrophobicContact CD1-CD1 3.79Å; L1312-L1318 HydrophobicContact CD1-CG 4.42Å; L1312-L1318 HydrophobicContact CG-CD1 4.41Å; L1312-L1318 PolarHBondContact O-N 3.27Å
1313	L	35.9	Very low	38.3	Very low	28 Å²	28	59.6 Å²	59.6	15%	0.147	32%	0.315	C	S	.	.	H	α-helix	trans	-71.9	-41.7	172.5	-75.9	164.6	0	0	0	111.9	R1309 P1320 F1323	R1309-L1313 WeakPolarHBondContact O-CB 3.27Å; R1309-L1313 VanDerWaalsContact O-CG 3.23Å; R1309-L1313 WeakPolarHBondContact O-CG 3.36Å; R1309-L1313 PolarHBondContact O-N 3.37Å; L1313-P1320 HydrophobicContact CD2-CB 4.46Å; L1313-F1323 HydrophobicContact CD2-CD2 3.9Å; L1313-F1323 HydrophobicContact CD2-CE2 4Å; L1313-F1323 HydrophobicContact CG-CE2 4.33Å
1314	S	35.1	Very low	37.4	Very low	101 Å²	101	59.5 Å²	59.5	71%	0.706	32%	0.318	S	S	*	.	H	α-helix	trans	-82.2	-21.1	-177	58.7	0	0	0	0	114.5	D1310 M1311	D1310-S1314 WeakPolarHBondContact O-CB 3.19Å; D1310-S1314 PolarHBondContact O-N 3.25Å; D1310-S1314 PolarHBondContact O-OG 2.73Å; M1311-S1314 WeakPolarHBondContact CA-OG 2.96Å; M1311-S1314 PolarHBondContact O-N 2.93Å; M1311-S1314 PolarHBondContact O-OG 3.3Å
1315	S	34.6	Very low	36.6	Very low	39 Å²	39	58.6 Å²	58.6	27%	0.273	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-0	175.3	54.7	0	0	0	0	114.9	N1171 M1311 C1317	N1171-S1315 PolarHBondContact ND2-O 3.39Å; N1171-S1315 PolarHBondContact OD1-O 3.24Å; N1171-S1315 VanDerWaalsContact OD1-O 3.12Å; M1311-S1315 WeakPolarHBondContact O-CB 3.16Å; M1311-S1315 PolarHBondContact O-N 3.43Å; M1311-S1315 PolarHBondContact O-OG 2.78Å; S1315-C1317 PolarHBondContact O-SG 2.71Å; S1315-C1317 PolarHBondContact OG-SG 3.43Å
1316	G	35.5	Very low	35.6	Very low	44 Å²	44	59.9 Å²	59.9	45%	0.454	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.3	13.9	164.8	0	0	0	0	0	117.5	N1171	N1171-G1316 PolarHBondContact OD1-O 3.05Å; N1171-G1316 VanDerWaalsContact OD1-O 3.11Å
1317	C	33.7	Very low	34.9	Very low	1 Å²	1	60 Å²	60	1%	0.007	33%	0.33	C	S	.	.	S	Bend	trans	-117.4	-45.7	-150.2	-10	0	0	0	0	113	I1170 N1171 I1192 L1312 S1315 H1319	I1170-C1317 HydrophobicContact CG2-CB 3.93Å; N1171-C1317 WeakPolarHBondContact OD1-CA 3.17Å; N1171-C1317 WeakPolarHBondContact OD1-CB 3.49Å; N1171-C1317 PolarHBondContact OD1-N 3.26Å; N1171-C1317 PolarHBondContact OD1-SG 3.28Å; I1192-C1317 HydrophobicContact CB-CB 4.16Å; I1192-C1317 HydrophobicContact CD1-CB 3.6Å; I1192-C1317 WeakPolarHBondContact CD1-SG 3.12Å; I1192-C1317 HydrophobicContact CG1-CB 3.49Å; I1192-C1317 VanDerWaalsContact CG1-CB 3.49Å; I1192-C1317 VanDerWaalsContact CG1-SG 3.59Å; I1192-C1317 HydrophobicContact CG2-CB 3.6Å; I1192-C1317 WeakPolarHBondContact CG2-SG 3.46Å; L1312-C1317 PolarHBondContact O-N 2.77Å; S1315-C1317 PolarHBondContact O-SG 2.71Å; S1315-C1317 PolarHBondContact OG-SG 3.43Å; C1317-H1319 PolarHBondContact O-N 2.77Å
1318	L	32.2	Very low	34.6	Very low	38 Å²	38	56.5 Å²	56.5	20%	0.199	33%	0.331	C	S	.	.	S	Bend	trans	-79.6	102.9	144.3	-63.5	-175.6	0	0	0	105	L1312 F1322 F1323	L1312-L1318 HydrophobicContact CB-CB 4.25Å; L1312-L1318 HydrophobicContact CB-CD1 3.84Å; L1312-L1318 HydrophobicContact CB-CG 3.97Å; L1312-L1318 HydrophobicContact CD1-CD1 3.79Å; L1312-L1318 HydrophobicContact CD1-CG 4.42Å; L1312-L1318 HydrophobicContact CG-CD1 4.41Å; L1312-L1318 PolarHBondContact O-N 3.27Å; L1318-F1322 HydrophobicContact CB-CD2 4.3Å; L1318-F1322 HydrophobicContact CD2-CD1 4.14Å; L1318-F1322 HydrophobicContact CD2-CD2 4.17Å; L1318-F1322 HydrophobicContact CD2-CE1 4.01Å; L1318-F1322 HydrophobicContact CD2-CE2 4.03Å; L1318-F1322 HydrophobicContact CD2-CG 4.23Å; L1318-F1322 HydrophobicContact CD2-CZ 3.96Å; L1318-F1323 HydrophobicContact CB-CE2 4.41Å; L1318-F1323 HydrophobicContact CD1-CE2 4.12Å; L1318-F1323 HydrophobicContact CD1-CZ 4.19Å
1319	H	34.6	Very low	34	Very low	71 Å²	71	57.3 Å²	57.3	33%	0.329	33%	0.332	S	S	.	.			trans	-51.4	145.9	171.3	179.9	-96	0	0	0	109.2	C1317 S1321 P1344	C1317-H1319 PolarHBondContact O-N 2.77Å; H1319-S1321 WeakPolarHBondContact ND1-CB 2.96Å; H1319-S1321 PolarHBondContact ND1-OG 3.37Å; H1319-S1321 PolarHBondContact O-N 3.01Å; H1319-P1344 HydrophobicContact CB-CG 3.63Å
1320	P	32	Very low	33.3	Very low	50 Å²	50	60 Å²	60	33%	0.325	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	65.7	177.9	-15.6	31.1	0	0	0	112	L1313 H2028 Y2029	L1313-P1320 HydrophobicContact CD2-CB 4.46Å; P1320-H2028 CarbonylContact C-O 2.89Å; P1320-Y2029 HydrophobicContact CB-CD2 3.3Å; P1320-Y2029 HydrophobicContact CB-CE2 3.5Å; P1320-Y2029 VanDerWaalsContact CB-CE2 3.5Å; P1320-Y2029 HydrophobicContact CB-CG 4.28Å; P1320-Y2029 WeakPolarHBondContact O-CB 3.21Å; P1320-Y2029 WeakPolarHBondContact O-CD2 3.05Å
1321	S	34.2	Very low	32.7	Very low	36 Å²	36	58.3 Å²	58.3	25%	0.252	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-168.5	11.9	178.8	76.7	0	0	0	0	114.4	H1319 F1323 H2028	H1319-S1321 WeakPolarHBondContact ND1-CB 2.96Å; H1319-S1321 PolarHBondContact ND1-OG 3.37Å; H1319-S1321 PolarHBondContact O-N 3.01Å; S1321-F1323 PolarHBondContact O-N 2.89Å; S1321-F1323 VanDerWaalsContact O-N 3.07Å; S1321-H2028 PolarHBondContact N-O 3.38Å
1322	F	28.9	Very low	32.5	Very low	56 Å²	56	62.7 Å²	62.7	25%	0.246	35%	0.353	C	S	.	.	S	Bend	trans	-70.8	15.7	172.4	-94.5	-101.4	0	0	0	113.8	L1318 P1344 Q1345	L1318-F1322 HydrophobicContact CB-CD2 4.3Å; L1318-F1322 HydrophobicContact CD2-CD1 4.14Å; L1318-F1322 HydrophobicContact CD2-CD2 4.17Å; L1318-F1322 HydrophobicContact CD2-CE1 4.01Å; L1318-F1322 HydrophobicContact CD2-CE2 4.03Å; L1318-F1322 HydrophobicContact CD2-CG 4.23Å; L1318-F1322 HydrophobicContact CD2-CZ 3.96Å; F1322-P1344 HydrophobicContact CE2-CB 4.04Å; F1322-P1344 HydrophobicContact CE2-CG 4.41Å; F1322-P1344 HydrophobicContact CZ-CB 4.47Å; F1322-Q1345 HydrophobicContact CD1-CG 3.95Å; F1322-Q1345 HydrophobicContact CE1-CG 3.56Å; F1322-Q1345 HydrophobicContact CZ-CG 4Å
1323	F	31.2	Very low	32.3	Very low	48 Å²	48	70.5 Å²	70.5	21%	0.211	38%	0.38	C	S	.	.	S	Bend		177.1	148.8	-115.9	-82.5	-25.5	0	0	0	110.8	L1313 L1318 S1321 F2024 S2027 H2028 Y2029	L1313-F1323 HydrophobicContact CD2-CD2 3.9Å; L1313-F1323 HydrophobicContact CD2-CE2 4Å; L1313-F1323 HydrophobicContact CG-CE2 4.33Å; L1318-F1323 HydrophobicContact CB-CE2 4.41Å; L1318-F1323 HydrophobicContact CD1-CE2 4.12Å; L1318-F1323 HydrophobicContact CD1-CZ 4.19Å; S1321-F1323 PolarHBondContact O-N 2.89Å; S1321-F1323 VanDerWaalsContact O-N 3.07Å; F1323-F2024 HydrophobicContact CE1-CE1 4.49Å; F1323-S2027 CarbonylContact C-O 3.54Å; F1323-S2027 WeakPolarHBondContact CA-O 3.47Å; F1323-S2027 WeakPolarHBondContact CB-O 3.36Å; F1323-S2027 WeakPolarHBondContact CD1-O 3.33Å; F1323-S2027 WeakPolarHBondContact CG-O 3.3Å; F1323-H2028 CarbonylContact C-O 3.54Å; F1323-H2028 HydrophobicContact CB-CB 4.19Å; F1323-H2028 WeakPolarHBondContact CB-O 3.5Å; F1323-H2028 CarbonylContact O-C 3.53Å; F1323-Y2029 PolarHBondContact O-N 3.44Å
1324	P	29.4	Very low	31.9	Very low	63 Å²	63	74.7 Å²	74.7	41%	0.409	40%	0.397	S	S	.	.			trans	-124.4	112.9	170.8	21.1	1.8	0	0	0	118.2	Q2026 S2027 H2028	P1324-Q2026 HydrophobicContact CG-CB 4.35Å; P1324-Q2026 HydrophobicContact CG-CG 4.25Å; P1324-S2027 WeakPolarHBondContact CD-O 3.28Å; P1324-S2027 CarbonylContact O-C 3.24Å; P1324-H2028 VanDerWaalsContact N-N 3.19Å; P1324-H2028 PolarHBondContact O-N 3.34Å
1325	M	27.4	Very low	31.6	Very low	53 Å²	53	72.9 Å²	72.9	26%	0.261	38%	0.382	S	S	.	.			trans	-95.7	178.2	178.7	-138.5	-24.2	171.7	0	0	111	H2028 Y2029 Q2030	M1325-H2028 HydrophobicContact CB-CB 4.28Å; M1325-H2028 WeakPolarHBondContact CE-CE1 3.46Å; M1325-H2028 HydrophobicContact CG-CB 4.24Å; M1325-H2028 WeakPolarHBondContact CG-ND1 3.34Å; M1325-H2028 PolarHBondContact SD-CE1 2.71Å; M1325-H2028 PolarHBondContact SD-ND1 3.49Å; M1325-Y2029 VanDerWaalsContact CB-CA 3.44Å; M1325-Y2029 HydrophobicContact CB-CD1 3.3Å; M1325-Y2029 HydrophobicContact CB-CD2 4.1Å; M1325-Y2029 HydrophobicContact CB-CE1 3.61Å; M1325-Y2029 HydrophobicContact CB-CE2 4.3Å; M1325-Y2029 HydrophobicContact CB-CG 3.58Å; M1325-Y2029 HydrophobicContact CG-CD1 3.64Å; M1325-Y2029 HydrophobicContact CG-CD2 4.33Å; M1325-Y2029 HydrophobicContact CG-CE1 3.33Å; M1325-Y2029 HydrophobicContact CG-CE2 4.02Å; M1325-Y2029 HydrophobicContact CG-CG 4.14Å; M1325-Q2030 WeakPolarHBondContact O-CA 3.33Å; M1325-Q2030 WeakPolarHBondContact O-CB 2.96Å; M1325-Q2030 VanDerWaalsContact O-CD 3.31Å; M1325-Q2030 WeakPolarHBondContact O-CG 3.36Å; M1325-Q2030 PolarHBondContact O-N 2.79Å; M1325-Q2030 PolarHBondContact O-OE1 3.05Å
1326	N	27	Very low	31.1	Very low	115 Å²	115	79.2 Å²	79.2	62%	0.615	41%	0.405	S	S	*	.			trans	-69.5	134.1	172.7	-63.6	-41.3	0	0	0	114.8	S1328	N1326-S1328 PolarHBondContact O-N 2.74Å
1327	S	37.6	Very low	30.6	Very low	63 Å²	63	83.2 Å²	83.2	44%	0.441	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	30.6	-172.6	45.7	0	0	0	0	116.6	Q2030 N2032	S1327-Q2030 PolarHBondContact OG-OE1 2.69Å; S1327-N2032 PolarHBondContact O-ND2 2.98Å; S1327-N2032 PolarHBondContact O-OD1 3.16Å; S1327-N2032 VanDerWaalsContact O-OD1 3.1Å
1328	S	33.1	Very low	30.1	Very low	89 Å²	89	94.4 Å²	94.4	62%	0.622	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-17.4	-174.4	49.9	0	0	0	0	115.7	N1326 N2032	N1326-S1328 PolarHBondContact O-N 2.74Å; S1328-N2032 PolarHBondContact O-ND2 3.43Å
1329	E	30.1	Very low	29.8	Very low	104 Å²	104	99.5 Å²	99.5	49%	0.486	49%	0.485	S	S	.	.	S	Bend	trans	-123.8	-14.5	-159.1	179.9	-174.7	-118.3	0	0	118.4	H1331 E1332 Y2031 N2032	E1329-H1331 PolarHBondContact O-N 2.85Å; E1329-H1331 VanDerWaalsContact O-N 3.09Å; E1329-E1332 PolarHBondContact O-N 3.09Å; E1329-Y2031 HydrophobicContact CB-CE2 3.61Å; E1329-Y2031 HydrophobicContact CG-CE2 4.13Å; E1329-Y2031 WeakPolarHBondContact CG-OH 3.33Å; E1329-Y2031 PolarHBondContact OE2-OH 3.47Å; E1329-N2032 PolarHBondContact N-ND2 2.91Å; E1329-N2032 PolarHBondContact N-OD1 3.43Å
1330	Y	31	Very low	29.4	Very low	95 Å²	95	101 Å²	101	37%	0.373	50%	0.499	S	S	.	.	G	3₁₀ helix	trans	-59.3	-22	164.9	-157.7	-134.6	0	0	0	112.6	E1332 R1333 K1334 Y2031 N2032	Y1330-E1332 PolarHBondContact O-N 2.87Å; Y1330-R1333 PolarHBondContact O-N 3.21Å; Y1330-R1333 VanDerWaalsContact O-N 3.13Å; Y1330-K1334 HydrophobicContact CD1-CD 4.22Å; Y1330-Y2031 VanDerWaalsContact CD1-C 3.42Å; Y1330-Y2031 VanDerWaalsContact CD2-CB 3.44Å; Y1330-Y2031 AromaticContact CD2-CD1 3.24Å; Y1330-Y2031 HydrophobicContact CD2-CD1 3.24Å; Y1330-Y2031 HydrophobicContact CD2-CE1 4.15Å; Y1330-Y2031 AromaticContact CD2-CG 3.61Å; Y1330-Y2031 HydrophobicContact CD2-CG 3.61Å; Y1330-Y2031 WeakPolarHBondContact CE1-O 2.85Å; Y1330-Y2031 AromaticContact CE2-CD1 3.96Å; Y1330-Y2031 HydrophobicContact CE2-CD1 3.96Å; Y1330-Y2031 HydrophobicContact CE2-CG 4.29Å; Y1330-Y2031 AromaticContact CG-CD1 3.9Å; Y1330-Y2031 HydrophobicContact CG-CD1 3.9Å; Y1330-Y2031 AromaticContact CG-CG 3.87Å; Y1330-Y2031 HydrophobicContact CG-CG 3.87Å; Y1330-Y2031 VanDerWaalsContact N-CD2 3.3Å; Y1330-Y2031 VanDerWaalsContact N-CE2 3.27Å; Y1330-N2032 VanDerWaalsContact CB-OD1 3.29Å; Y1330-N2032 WeakPolarHBondContact CB-OD1 3.21Å; Y1330-N2032 VanDerWaalsContact CD1-C 3.5Å; Y1330-N2032 HydrophobicContact CD1-CB 4.46Å; Y1330-N2032 WeakPolarHBondContact CD1-O 3.35Å; Y1330-N2032 WeakPolarHBondContact CE1-O 3.4Å; Y1330-N2032 VanDerWaalsContact N-CG 3.33Å; Y1330-N2032 PolarHBondContact N-ND2 2.93Å; Y1330-N2032 PolarHBondContact N-OD1 2.72Å
1331	H	31.5	Very low	29.3	Very low	42 Å²	42	104.6 Å²	104.6	19%	0.194	52%	0.52	C	S	.	.	G	3₁₀ helix	trans	-46.5	-25.6	177.8	-108	-51.7	0	0	0	111.6	E1329 N2032 R2033 S2034 T2035	E1329-H1331 PolarHBondContact O-N 2.85Å; E1329-H1331 VanDerWaalsContact O-N 3.09Å; H1331-N2032 WeakPolarHBondContact CB-ND2 3.45Å; H1331-N2032 PolarHBondContact CD2-ND2 2.88Å; H1331-N2032 PolarHBondContact N-ND2 3.48Å; H1331-R2033 VanDerWaalsContact CE1-CB 3.49Å; H1331-R2033 WeakPolarHBondContact CE1-CB 3.34Å; H1331-R2033 WeakPolarHBondContact CE1-CG 3.41Å; H1331-R2033 VanDerWaalsContact NE2-CD 3.29Å; H1331-R2033 WeakPolarHBondContact NE2-CD 3.39Å; H1331-R2033 PolarHBondContact NE2-NH1 2.86Å; H1331-S2034 CarbonylContact C-O 3.03Å; H1331-S2034 VanDerWaalsContact CA-O 3.25Å; H1331-S2034 WeakPolarHBondContact CA-O 3.25Å; H1331-S2034 PolarHBondContact CE1-OG 3.2Å; H1331-S2034 PolarHBondContact ND1-N 3.47Å; H1331-S2034 PolarHBondContact ND1-OG 2.79Å; H1331-S2034 CarbonylContact O-C 3.18Å; H1331-S2034 VanDerWaalsContact O-O 3.11Å; H1331-T2035 WeakPolarHBondContact O-CB 3.17Å; H1331-T2035 PolarHBondContact O-N 3.42Å; H1331-T2035 VanDerWaalsContact O-N 3.15Å; H1331-T2035 PolarHBondContact O-OG1 3.38Å
1332	E	28.9	Very low	29.1	Very low	156 Å²	156	107.4 Å²	107.4	73%	0.729	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-110.6	-15.8	-173.1	-53.8	-161.7	143.5	0	0	113.8	E1329 Y1330	E1329-E1332 PolarHBondContact O-N 3.09Å; Y1330-E1332 PolarHBondContact O-N 2.87Å
1333	R	33.5	Very low	29.1	Very low	189 Å²	189	107.2 Å²	107.2	71%	0.713	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-12.4	-179.5	-69.1	-168	-179.7	-171	2	115.2	Y1330 T1335	Y1330-R1333 PolarHBondContact O-N 3.21Å; Y1330-R1333 VanDerWaalsContact O-N 3.13Å; R1333-T1335 PolarHBondContact O-N 2.89Å; R1333-T1335 VanDerWaalsContact O-N 3.1Å
1334	K	28.6	Very low	29.1	Very low	116 Å²	116	105.4 Å²	105.4	50%	0.504	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	2.6	-172.1	-139.9	163.1	-169.2	158.5	0	115.5	Y1330 N2032 R2033 S2034 T2035	Y1330-K1334 HydrophobicContact CD1-CD 4.22Å; K1334-N2032 PolarHBondContact NZ-O 2.88Å; K1334-R2033 WeakPolarHBondContact CD-O 3.34Å; K1334-R2033 PolarHBondContact NZ-O 2.98Å; K1334-S2034 WeakPolarHBondContact CB-O 3.24Å; K1334-S2034 WeakPolarHBondContact CD-O 3.24Å; K1334-T2035 CarbonylContact C-O 3.52Å
1335	T	28.1	Very low	29.3	Very low	63 Å²	63	108.3 Å²	108.3	39%	0.387	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-21.8	-174.4	46.1	0	0	0	0	115	R1333 T2035	R1333-T1335 PolarHBondContact O-N 2.89Å; R1333-T1335 VanDerWaalsContact O-N 3.1Å; T1335-T2035 HydrophobicContact CG2-CG2 3.38Å; T1335-T2035 WeakPolarHBondContact CG2-O 3.31Å; T1335-T2035 PolarHBondContact N-O 3.37Å
1336	F	23.9	Very low	29.6	Very low	172 Å²	172	109.8 Å²	109.8	75%	0.754	54%	0.54	S	S	*	.	S	Bend	trans	-123	103.9	-164.7	-116.1	-106.4	0	0	0	113.6
1337	N	25.6	Very low	30	Very low	127 Å²	127	110 Å²	110	68%	0.679	53%	0.532	S	S	*	.			trans	59.9	105.7	156.4	-65	-39.8	0	0	0	120.9
1338	R	23.5	Very low	29.9	Very low	236 Å²	236	112.6 Å²	112.6	89%	0.891	54%	0.54	S	S	*	.			trans	49.5	136.8	133.1	-61.6	-176.1	178.4	-168.6	-1.3	120.8
1339	L	26.9	Very low	30	Very low	146 Å²	146	112.8 Å²	112.8	76%	0.764	53%	0.532	S	S	*	.			trans	85.2	135.7	174.5	-60.2	168.2	0	0	0	115.1
1340	T	25.3	Very low	30.6	Very low	103 Å²	103	111.4 Å²	111.4	63%	0.632	53%	0.532	S	S	*	.			trans	-87.3	114.4	-179.7	37.9	0	0	0	0	110.1
1341	T	30	Very low	31.4	Very low	124 Å²	124	111 Å²	111	76%	0.761	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-95.6	125.5	174.8	38.2	0	0	0	0	110.9
1342	W	29.3	Very low	32.3	Very low	95 Å²	95	112.7 Å²	112.7	36%	0.36	55%	0.55	S	S	.	*	P	Polyproline II helix	trans	-96.1	157.2	-173.8	-60.3	25.9	0	0	0	109.7	L48 V51 P1344 M1346	L48-W1342 HydrophobicContact CD2-CZ2 4.05Å; V51-W1342 HydrophobicContact CB-CH2 4.14Å; V51-W1342 HydrophobicContact CG1-CH2 3.67Å; V51-W1342 HydrophobicContact CG1-CZ3 3.81Å; V51-W1342 HydrophobicContact CG2-CH2 4.37Å; W1342-P1344 WeakPolarHBondContact O-CD 3.44Å; W1342-M1346 HydrophobicContact CE3-CE 4.05Å
1343	S	30	Very low	33.3	Very low	53 Å²	53	107.5 Å²	107.5	37%	0.371	53%	0.527	S	S	.	.	P	Polyproline II helix	trans	-59.9	122.3	178.1	43.3	0	0	0	0	111.2	Q1345 M1346	S1343-Q1345 VanDerWaalsContact C-N 3.29Å; S1343-Q1345 PolarHBondContact O-N 3.05Å; S1343-Q1345 VanDerWaalsContact O-N 3.11Å; S1343-M1346 WeakPolarHBondContact O-CA 3.41Å; S1343-M1346 WeakPolarHBondContact O-CB 3.23Å; S1343-M1346 PolarHBondContact O-N 2.84Å
1344	P	30.8	Very low	34.6	Very low	9 Å²	9	102.1 Å²	102.1	6%	0.058	51%	0.51	C	S	.	.	G	3₁₀ helix	trans	-71.4	-11.7	-165.2	-26.7	38	0	0	0	117.5	M1174 H1319 F1322 W1342 M1346 W1347	M1174-P1344 HydrophobicContact CE-CB 3.76Å; M1174-P1344 HydrophobicContact SD-CB 3.71Å; M1174-P1344 HydrophobicContact SD-CG 4.32Å; H1319-P1344 HydrophobicContact CB-CG 3.63Å; F1322-P1344 HydrophobicContact CE2-CB 4.04Å; F1322-P1344 HydrophobicContact CE2-CG 4.41Å; F1322-P1344 HydrophobicContact CZ-CB 4.47Å; W1342-P1344 WeakPolarHBondContact O-CD 3.44Å; P1344-M1346 PolarHBondContact O-N 3.23Å; P1344-W1347 WeakPolarHBondContact O-CB 3.28Å; P1344-W1347 PolarHBondContact O-N 2.93Å
1345	Q	34.5	Very low	35.9	Very low	125 Å²	125	100.7 Å²	100.7	58%	0.584	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-58.7	-25.1	165	-68.2	173.9	-13.9	0	0	111.7	F1322 S1343	F1322-Q1345 HydrophobicContact CD1-CG 3.95Å; F1322-Q1345 HydrophobicContact CE1-CG 3.56Å; F1322-Q1345 HydrophobicContact CZ-CG 4Å; S1343-Q1345 VanDerWaalsContact C-N 3.29Å; S1343-Q1345 PolarHBondContact O-N 3.05Å; S1343-Q1345 VanDerWaalsContact O-N 3.11Å
1346	M	33.4	Very low	37.3	Very low	84 Å²	84	99.4 Å²	99.4	41%	0.414	50%	0.496	S	S	.	.	G	3₁₀ helix	trans	-90.6	6	175.9	-155.3	150.1	61.6	0	0	113.2	W1342 S1343 P1344	W1342-M1346 HydrophobicContact CE3-CE 4.05Å; S1343-M1346 WeakPolarHBondContact O-CA 3.41Å; S1343-M1346 WeakPolarHBondContact O-CB 3.23Å; S1343-M1346 PolarHBondContact O-N 2.84Å; P1344-M1346 PolarHBondContact O-N 3.23Å
1347	W	34.5	Very low	39	Very low	120 Å²	120	93.2 Å²	93.2	46%	0.455	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-21	178.6	-117.2	93	0	0	0	113.8	P1344	P1344-W1347 WeakPolarHBondContact O-CB 3.28Å; P1344-W1347 PolarHBondContact O-N 2.93Å
1348	L	34.8	Very low	40.8	Very low	116 Å²	116	90.7 Å²	90.7	61%	0.607	46%	0.457	S	S	*	.	S	Bend	trans	-96.6	-10.3	175.7	-78	165.4	0	0	0	113.3	L1173	L1173-L1348 HydrophobicContact CD1-CD2 4.43Å
1349	M	35.9	Very low	42.5	Very low	93 Å²	93	81.5 Å²	81.5	46%	0.458	43%	0.429	S	S	.	.	S	Bend	trans	-103.4	119.1	169.9	-77.7	-73.6	155.6	0	0	108.9	S1351 L1353 V1357	M1349-S1351 PolarHBondContact O-N 2.98Å; M1349-L1353 HydrophobicContact SD-CB 4.32Å; M1349-L1353 HydrophobicContact SD-CD1 4.21Å; M1349-V1357 HydrophobicContact SD-CG2 3.99Å
1350	P	42.3	Very low	44.2	Very low	76 Å²	76	76.7 Å²	76.7	49%	0.494	41%	0.407	S	S	.	.			trans	-53.2	136.9	164.2	-22.3	32.1	0	0	0	109.4	K1352 L1353	P1350-K1352 PolarHBondContact O-N 3.05Å; P1350-L1353 HydrophobicContact CB-CG 4.32Å; P1350-L1353 HydrophobicContact CG-CD1 4.23Å; P1350-L1353 HydrophobicContact CG-CG 4.26Å; P1350-L1353 PolarHBondContact O-N 2.72Å
1351	S	49	Very low	46.2	Very low	87 Å²	87	78.6 Å²	78.6	61%	0.608	40%	0.403	S	S	*	.	H	α-helix	trans	-55.9	-28.6	177.1	51.1	0	0	0	0	112.5	M1349 L1353 H1354	M1349-S1351 PolarHBondContact O-N 2.98Å; S1351-L1353 PolarHBondContact O-N 2.67Å; S1351-H1354 PolarHBondContact O-N 2.63Å
1352	K	50.3	Low	48.1	Very low	76 Å²	76	76.5 Å²	76.5	33%	0.33	39%	0.386	S	S	.	.	H	α-helix	trans	-60.4	-24.8	171.9	-56.3	-167.4	-177	-166.6	0	114.1	G1263 D1264 N1267 P1350	G1263-K1352 WeakPolarHBondContact O-CD 3.32Å; G1263-K1352 WeakPolarHBondContact O-CE 3.47Å; G1263-K1352 PolarHBondContact O-NZ 2.97Å; D1264-K1352 IonicContact OD1-NZ 3.68Å; D1264-K1352 PolarHBondContact OD1-NZ 3.4Å; N1267-K1352 PolarHBondContact ND2-NZ 3.19Å; N1267-K1352 WeakPolarHBondContact OD1-CD 3.4Å; N1267-K1352 PolarHBondContact OD1-NZ 3.39Å; P1350-K1352 PolarHBondContact O-N 3.05Å
1353	L	50.2	Low	50	Low	47 Å²	47	74.6 Å²	74.6	25%	0.246	38%	0.381	C	S	.	.	H	α-helix	trans	-90.3	-15	177.3	-62.2	-170.1	0	0	0	114.3	L1266 M1349 P1350 S1351 Q1355 L1356 V1357	L1266-L1353 HydrophobicContact CD1-CD2 3.64Å; L1266-L1353 HydrophobicContact CD2-CD2 4.23Å; M1349-L1353 HydrophobicContact SD-CB 4.32Å; M1349-L1353 HydrophobicContact SD-CD1 4.21Å; P1350-L1353 HydrophobicContact CB-CG 4.32Å; P1350-L1353 HydrophobicContact CG-CD1 4.23Å; P1350-L1353 HydrophobicContact CG-CG 4.26Å; P1350-L1353 PolarHBondContact O-N 2.72Å; S1351-L1353 PolarHBondContact O-N 2.67Å; L1353-Q1355 VanDerWaalsContact C-N 3.3Å; L1353-Q1355 PolarHBondContact O-N 3.19Å; L1353-L1356 HydrophobicContact CD2-CD1 3.82Å; L1353-L1356 WeakPolarHBondContact O-CB 3.39Å; L1353-L1356 PolarHBondContact O-N 2.78Å; L1353-V1357 PolarHBondContact O-N 2.72Å
1354	H	59.7	Low	51.7	Low	77 Å²	77	76.3 Å²	76.3	36%	0.356	38%	0.382	S	S	.	.	H	α-helix	trans	-56	-45.1	-174.4	177.2	88	0	0	0	112.3	S1351 L1356 V1357 M1358	S1351-H1354 PolarHBondContact O-N 2.63Å; H1354-L1356 PolarHBondContact O-N 3.24Å; H1354-V1357 PolarHBondContact O-N 3.31Å; H1354-M1358 PolarHBondContact O-N 2.87Å
1355	Q	56.7	Low	53.7	Low	86 Å²	86	78.7 Å²	78.7	40%	0.402	40%	0.397	S	S	.	.	H	α-helix	trans	-58.5	-33.8	178.1	-175.3	160.3	22.7	0	0	112.6	L1353 S1359	L1353-Q1355 VanDerWaalsContact C-N 3.3Å; L1353-Q1355 PolarHBondContact O-N 3.19Å; Q1355-S1359 PolarHBondContact O-N 3.31Å; Q1355-S1359 PolarHBondContact O-OG 2.63Å
1356	L	56.8	Low	55.5	Low	35 Å²	35	75.2 Å²	75.2	18%	0.183	38%	0.383	C	S	.	.	H	α-helix	trans	-76.1	-40.3	178.2	-54.7	174.8	0	0	0	111.8	L1266 L1273 V1277 L1353 H1354 M1358 S1359 C1360	L1266-L1356 HydrophobicContact CD2-CD1 4.45Å; L1273-L1356 HydrophobicContact CB-CD2 3.79Å; L1273-L1356 HydrophobicContact CD1-CD1 4.18Å; L1273-L1356 HydrophobicContact CD1-CD2 4.45Å; V1277-L1356 HydrophobicContact CG2-CD2 4.25Å; L1353-L1356 HydrophobicContact CD2-CD1 3.82Å; L1353-L1356 WeakPolarHBondContact O-CB 3.39Å; L1353-L1356 PolarHBondContact O-N 2.78Å; H1354-L1356 PolarHBondContact O-N 3.24Å; L1356-M1358 VanDerWaalsContact C-N 3.25Å; L1356-M1358 PolarHBondContact O-N 2.82Å; L1356-S1359 WeakPolarHBondContact CA-OG 3.29Å; L1356-S1359 PolarHBondContact O-N 3.05Å; L1356-S1359 PolarHBondContact O-OG 2.79Å; L1356-C1360 PolarHBondContact O-N 3.22Å; L1356-C1360 PolarHBondContact O-SG 3.03Å
1357	V	60.2	Low	57.6	Low	43 Å²	43	74.7 Å²	74.7	26%	0.261	39%	0.386	S	S	.	.	H	α-helix	trans	-66.8	-28.9	177	180	0	0	0	0	111.3	M1349 L1353 H1354 R1361	M1349-V1357 HydrophobicContact SD-CG2 3.99Å; L1353-V1357 PolarHBondContact O-N 2.72Å; H1354-V1357 PolarHBondContact O-N 3.31Å; V1357-R1361 WeakPolarHBondContact O-CD 3.4Å; V1357-R1361 VanDerWaalsContact O-CG 3.23Å; V1357-R1361 WeakPolarHBondContact O-CG 3.43Å
1358	M	61.7	Low	59.8	Low	74 Å²	74	74.1 Å²	74.1	37%	0.365	38%	0.383	S	S	.	.	H	α-helix	trans	-72.8	-46.1	171.5	-64.6	-50.4	107.3	0	0	112.2	H1354 L1356 C1360 R1361 I1362	H1354-M1358 PolarHBondContact O-N 2.87Å; L1356-M1358 VanDerWaalsContact C-N 3.25Å; L1356-M1358 PolarHBondContact O-N 2.82Å; M1358-C1360 VanDerWaalsContact C-N 3.27Å; M1358-C1360 PolarHBondContact O-N 3.23Å; M1358-R1361 PolarHBondContact O-N 3.22Å; M1358-I1362 PolarHBondContact O-N 3.42Å
1359	S	60.8	Low	62.2	Low	42 Å²	42	71.2 Å²	71.2	29%	0.294	37%	0.368	S	S	.	.	H	α-helix	trans	-62.4	-31.8	177.9	53	0	0	0	0	113.4	Q1355 L1356 R1361	Q1355-S1359 PolarHBondContact O-N 3.31Å; Q1355-S1359 PolarHBondContact O-OG 2.63Å; L1356-S1359 WeakPolarHBondContact CA-OG 3.29Å; L1356-S1359 PolarHBondContact O-N 3.05Å; L1356-S1359 PolarHBondContact O-OG 2.79Å; S1359-R1361 VanDerWaalsContact C-N 3.27Å; S1359-R1361 PolarHBondContact O-N 3.06Å
1360	C	62.5	Low	64.5	Low	46 Å²	46	68.2 Å²	68.2	31%	0.311	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	0.3	174.6	-61.6	0	0	0	0	114.3	V1277 P1281 L1356 M1358	V1277-C1360 VanDerWaalsContact CG1-SG 3.56Å; P1281-C1360 WeakPolarHBondContact CD-O 3.4Å; L1356-C1360 PolarHBondContact O-N 3.22Å; L1356-C1360 PolarHBondContact O-SG 3.03Å; M1358-C1360 VanDerWaalsContact C-N 3.27Å; M1358-C1360 PolarHBondContact O-N 3.23Å
1361	R	67.3	Low	66.7	Low	142 Å²	142	65.8 Å²	65.8	54%	0.536	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-40.1	179.6	-80.7	173.2	177.1	-170.1	-1.4	113.8	P944 V1357 M1358 S1359	P944-R1361 WeakPolarHBondContact CD-O 3.47Å; V1357-R1361 WeakPolarHBondContact O-CD 3.4Å; V1357-R1361 VanDerWaalsContact O-CG 3.23Å; V1357-R1361 WeakPolarHBondContact O-CG 3.43Å; M1358-R1361 PolarHBondContact O-N 3.22Å; S1359-R1361 VanDerWaalsContact C-N 3.27Å; S1359-R1361 PolarHBondContact O-N 3.06Å
1362	I	68.9	Low	68.5	Low	80 Å²	80	67.3 Å²	67.3	41%	0.41	33%	0.329	S	S	.	.			trans	-144.7	125.8	177	-53.8	177.7	0	0	0	107.9	I941 M1358 F1364	I941-I1362 HydrophobicContact CG2-CG2 3.71Å; M1358-I1362 PolarHBondContact O-N 3.42Å; I1362-F1364 HydrophobicContact CB-CE2 4.04Å; I1362-F1364 HydrophobicContact CB-CZ 4.43Å; I1362-F1364 HydrophobicContact CG2-CD2 4.23Å; I1362-F1364 HydrophobicContact CG2-CE1 4.31Å; I1362-F1364 HydrophobicContact CG2-CE2 3.63Å; I1362-F1364 HydrophobicContact CG2-CZ 3.66Å
1363	Q	68.9	Low	70.3	Confident	56 Å²	56	64.1 Å²	64.1	26%	0.262	32%	0.316	S	S	.	.	B	Isolated β-bridge	trans	-100.7	107.8	177.5	-179.5	178.7	31.4	0	0	110.4	I942 F1278 V1280	I942-Q1363 HydrophobicContact CB-CB 4.27Å; I942-Q1363 PolarHBondContact N-O 3.03Å; I942-Q1363 PolarHBondContact O-N 2.88Å; F1278-Q1363 PolarHBondContact O-NE2 3.45Å; V1280-Q1363 HydrophobicContact CG2-CB 3.61Å
1364	F	66.3	Low	72.3	Confident	88 Å²	88	61.9 Å²	61.9	39%	0.386	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-83.1	144.8	166.9	-62.5	-82	0	0	0	110	L71 I941 I1362 D1366	L71-F1364 HydrophobicContact CB-CE1 4.01Å; L71-F1364 HydrophobicContact CB-CZ 4.18Å; L71-F1364 HydrophobicContact CD2-CD2 4.4Å; L71-F1364 HydrophobicContact CD2-CE1 3.81Å; L71-F1364 HydrophobicContact CD2-CE2 3.62Å; L71-F1364 HydrophobicContact CD2-CZ 3.29Å; L71-F1364 HydrophobicContact CG-CZ 4.35Å; I941-F1364 HydrophobicContact CD1-CD1 4.15Å; I941-F1364 HydrophobicContact CD1-CE1 4.02Å; I941-F1364 HydrophobicContact CG1-CD1 4.37Å; I941-F1364 HydrophobicContact CG2-CD1 4.19Å; I941-F1364 HydrophobicContact CG2-CE1 4.16Å; I1362-F1364 HydrophobicContact CB-CE2 4.04Å; I1362-F1364 HydrophobicContact CB-CZ 4.43Å; I1362-F1364 HydrophobicContact CG2-CD2 4.23Å; I1362-F1364 HydrophobicContact CG2-CE1 4.31Å; I1362-F1364 HydrophobicContact CG2-CE2 3.63Å; I1362-F1364 HydrophobicContact CG2-CZ 3.66Å; F1364-D1366 PolarHBondContact O-N 2.82Å
1365	P	72.2	Confident	73.7	Confident	59 Å²	59	58.3 Å²	58.3	38%	0.383	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-66.9	127.1	175.3	27.2	-33.5	0	0	0	110.9	L1369	P1365-L1369 HydrophobicContact CB-CD1 4.05Å
1366	D	73	Confident	75.5	Confident	53 Å²	53	54.2 Å²	54.2	28%	0.283	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-60.5	129.8	173.1	-177.5	-25.5	0	0	0	109	F1364 R1368 L1369	F1364-D1366 PolarHBondContact O-N 2.82Å; D1366-R1368 PolarHBondContact O-N 2.62Å; D1366-R1368 VanDerWaalsContact OD1-CB 3.32Å; D1366-R1368 WeakPolarHBondContact OD1-CB 3.23Å; D1366-R1368 VanDerWaalsContact OD1-CG 3.29Å; D1366-R1368 WeakPolarHBondContact OD1-CG 3.27Å; D1366-R1368 PolarHBondContact OD1-N 3.11Å; D1366-R1368 WeakPolarHBondContact OD2-CD 3.47Å; D1366-R1368 IonicContact OD2-CZ 3.88Å; D1366-R1368 IonicContact OD2-NH1 3.63Å; D1366-R1368 PolarHBondContact OD2-NH1 2.75Å; D1366-L1369 HydrophobicContact CB-CG 4.47Å; D1366-L1369 VanDerWaalsContact O-CB 3.28Å; D1366-L1369 WeakPolarHBondContact O-CB 3.48Å; D1366-L1369 WeakPolarHBondContact O-CG 3.35Å; D1366-L1369 PolarHBondContact O-N 2.8Å
1367	P	77.9	Confident	77.2	Confident	73 Å²	73	52.6 Å²	52.6	47%	0.474	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-22.6	176	21.8	-34.6	0	0	0	114.3	L1369 I1370 Y1413	P1367-L1369 PolarHBondContact O-N 2.85Å; P1367-I1370 WeakPolarHBondContact O-CB 3.47Å; P1367-I1370 WeakPolarHBondContact O-CG1 3.12Å; P1367-I1370 PolarHBondContact O-N 2.97Å; P1367-I1370 VanDerWaalsContact O-N 3.17Å; P1367-Y1413 HydrophobicContact CB-CD2 4.19Å; P1367-Y1413 HydrophobicContact CB-CE2 4.24Å; P1367-Y1413 HydrophobicContact CG-CE2 4.2Å
1368	R	81.1	Confident	78.7	Confident	107 Å²	107	53 Å²	53	40%	0.404	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-34.7	169.3	-73.5	177.9	-177.5	122.1	-8.8	113.1	D1366 I1370 Q1371 Y1372 Y1413	D1366-R1368 PolarHBondContact O-N 2.62Å; D1366-R1368 VanDerWaalsContact OD1-CB 3.32Å; D1366-R1368 WeakPolarHBondContact OD1-CB 3.23Å; D1366-R1368 VanDerWaalsContact OD1-CG 3.29Å; D1366-R1368 WeakPolarHBondContact OD1-CG 3.27Å; D1366-R1368 PolarHBondContact OD1-N 3.11Å; D1366-R1368 WeakPolarHBondContact OD2-CD 3.47Å; D1366-R1368 IonicContact OD2-CZ 3.88Å; D1366-R1368 IonicContact OD2-NH1 3.63Å; D1366-R1368 PolarHBondContact OD2-NH1 2.75Å; R1368-I1370 PolarHBondContact O-N 3.25Å; R1368-I1370 VanDerWaalsContact O-N 3.07Å; R1368-Q1371 PolarHBondContact O-N 3.16Å; R1368-Y1372 HydrophobicContact CB-CD2 4.35Å; R1368-Y1372 HydrophobicContact CB-CE2 4.21Å; R1368-Y1372 VanDerWaalsContact O-CD2 3.26Å; R1368-Y1372 WeakPolarHBondContact O-CD2 3.2Å; R1368-Y1413 WeakPolarHBondContact CG-OH 3.46Å
1369	L	84.1	Confident	80.2	Confident	55 Å²	55	54.8 Å²	54.8	29%	0.288	26%	0.263	S	S	.	.	H	α-helix	trans	-60.8	-19.5	-178.3	-64.3	172.3	0	0	0	112.7	P1365 D1366 P1367 Q1371 Y1372 D1373	P1365-L1369 HydrophobicContact CB-CD1 4.05Å; D1366-L1369 HydrophobicContact CB-CG 4.47Å; D1366-L1369 VanDerWaalsContact O-CB 3.28Å; D1366-L1369 WeakPolarHBondContact O-CB 3.48Å; D1366-L1369 WeakPolarHBondContact O-CG 3.35Å; D1366-L1369 PolarHBondContact O-N 2.8Å; P1367-L1369 PolarHBondContact O-N 2.85Å; L1369-Q1371 PolarHBondContact O-N 2.85Å; L1369-Y1372 PolarHBondContact O-N 2.68Å; L1369-D1373 WeakPolarHBondContact O-CB 3.16Å; L1369-D1373 PolarHBondContact O-N 2.8Å
1370	I	85.1	Confident	81.8	Confident	31 Å²	31	52.8 Å²	52.8	16%	0.159	25%	0.249	C	C	.	.	H	α-helix	trans	-60	-35.7	172.5	-60.1	171.8	0	0	0	110.9	H932 P1367 R1368 L1377 I1406	H932-I1370 PolarHBondContact NE2-O 3.47Å; P1367-I1370 WeakPolarHBondContact O-CB 3.47Å; P1367-I1370 WeakPolarHBondContact O-CG1 3.12Å; P1367-I1370 PolarHBondContact O-N 2.97Å; P1367-I1370 VanDerWaalsContact O-N 3.17Å; R1368-I1370 PolarHBondContact O-N 3.25Å; R1368-I1370 VanDerWaalsContact O-N 3.07Å; I1370-L1377 HydrophobicContact CG2-CD1 4.21Å; I1370-L1377 VanDerWaalsContact O-CD1 3.29Å; I1370-L1377 WeakPolarHBondContact O-CD1 3.43Å; I1370-I1406 HydrophobicContact CG2-CG2 4.24Å
1371	Q	86.8	Confident	83.3	Confident	25 Å²	25	52.8 Å²	52.8	12%	0.117	24%	0.244	C	C	.	.	H	α-helix	trans	-77.4	-46.1	175.5	-175.5	177.6	-11.7	0	0	111.6	R1368 L1369 C1374 Q1378 F1410 H1414	R1368-Q1371 PolarHBondContact O-N 3.16Å; L1369-Q1371 PolarHBondContact O-N 2.85Å; Q1371-C1374 PolarHBondContact O-N 2.83Å; Q1371-C1374 VanDerWaalsContact O-O 3.06Å; Q1371-Q1378 HydrophobicContact CG-CG 4.46Å; Q1371-Q1378 WeakPolarHBondContact O-CG 3.35Å; Q1371-F1410 HydrophobicContact CB-CE2 4.36Å; Q1371-F1410 HydrophobicContact CG-CE2 4.28Å; Q1371-H1414 PolarHBondContact OE1-CE1 2.8Å; Q1371-H1414 VanDerWaalsContact OE1-CE1 3.26Å; Q1371-H1414 PolarHBondContact OE1-NE2 3.02Å
1372	Y	87.7	Confident	84.4	Confident	118 Å²	118	48.3 Å²	48.3	46%	0.463	23%	0.234	S	C	.	.	H	α-helix	trans	-80	-24.3	-172.4	-60.5	-79.3	0	0	0	114.6	S891 R1368 L1369 C1374	S891-Y1372 PolarHBondContact OG-O 3.1Å; R1368-Y1372 HydrophobicContact CB-CD2 4.35Å; R1368-Y1372 HydrophobicContact CB-CE2 4.21Å; R1368-Y1372 VanDerWaalsContact O-CD2 3.26Å; R1368-Y1372 WeakPolarHBondContact O-CD2 3.2Å; L1369-Y1372 PolarHBondContact O-N 2.68Å; Y1372-C1374 PolarHBondContact O-N 2.64Å
1373	D	87.9	Confident	85.6	Confident	9 Å²	9	45 Å²	45	5%	0.048	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-7.6	172.1	-84.8	11.2	0	0	0	112.4	R893 Q894 P933 R939 L1369	R893-D1373 WeakPolarHBondContact CD-OD2 3.32Å; R893-D1373 IonicContact CZ-OD2 3.55Å; R893-D1373 IonicContact NE-OD2 3.26Å; R893-D1373 IonicContact NH1-OD2 3.11Å; R893-D1373 PolarHBondContact NH1-OD2 3.36Å; Q894-D1373 WeakPolarHBondContact CG-O 3.34Å; P933-D1373 WeakPolarHBondContact CD-O 3.28Å; P933-D1373 HydrophobicContact CG-CB 3.87Å; P933-D1373 VanDerWaalsContact CG-O 3.28Å; P933-D1373 WeakPolarHBondContact CG-O 3.12Å; R939-D1373 IonicContact CZ-OD1 2.88Å; R939-D1373 IonicContact CZ-OD2 2.73Å; R939-D1373 IonicContact NE-OD1 2.68Å; R939-D1373 IonicContact NE-OD2 3.65Å; R939-D1373 PolarHBondContact NE-OD2 2.93Å; R939-D1373 IonicContact NH2-OD1 2.73Å; R939-D1373 PolarHBondContact NH2-OD1 3.3Å; R939-D1373 IonicContact NH2-OD2 2.76Å; R939-D1373 PolarHBondContact NH2-OD2 2.91Å; L1369-D1373 WeakPolarHBondContact O-CB 3.16Å; L1369-D1373 PolarHBondContact O-N 2.8Å
1374	C	91.9	Very high	86.8	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.205	C	C	.	.			trans	-141.6	115.6	-179.2	-175.8	0	0	0	0	114.8	N931 Q1371 Y1372 K1376 L1377 Q1378	N931-C1374 PolarHBondContact O-SG 3.05Å; Q1371-C1374 PolarHBondContact O-N 2.83Å; Q1371-C1374 VanDerWaalsContact O-O 3.06Å; Y1372-C1374 PolarHBondContact O-N 2.64Å; C1374-K1376 VanDerWaalsContact C-N 3.29Å; C1374-K1376 PolarHBondContact O-N 3.15Å; C1374-L1377 HydrophobicContact CB-CB 4.25Å; C1374-L1377 HydrophobicContact CB-CD1 4.28Å; C1374-L1377 HydrophobicContact CB-CG 4.2Å; C1374-L1377 PolarHBondContact O-N 2.75Å; C1374-Q1378 PolarHBondContact O-N 2.98Å; C1374-Q1378 VanDerWaalsContact O-N 3.16Å
1375	G	90	Very high	88.1	Confident	3 Å²	3	44.9 Å²	44.9	3%	0.031	21%	0.212	C	C	.	.	H	α-helix	trans	-62.9	-29.9	-179.3	0	0	0	0	0	114.7	Q894 L1377 Q1378 R1379	Q894-G1375 VanDerWaalsContact OE1-N 3.08Å; G1375-L1377 VanDerWaalsContact C-N 3.34Å; G1375-L1377 PolarHBondContact O-N 2.79Å; G1375-Q1378 PolarHBondContact O-N 2.86Å; G1375-R1379 PolarHBondContact O-N 3.31Å
1376	K	93.6	Very high	89.1	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-64	-36.8	170.9	-70.2	-170.6	-179	-171.6	0	112.3	C888 N931 C1374 L1380 Y1468 S1500 E1505	C888-K1376 HydrophobicContact CB-CG 4.18Å; N931-K1376 PolarHBondContact OD1-NZ 2.8Å; C1374-K1376 VanDerWaalsContact C-N 3.29Å; C1374-K1376 PolarHBondContact O-N 3.15Å; K1376-L1380 WeakPolarHBondContact O-CB 3.41Å; K1376-L1380 PolarHBondContact O-N 3.04Å; K1376-Y1468 HydrophobicContact CB-CE2 3.89Å; K1376-Y1468 WeakPolarHBondContact CB-OH 3.27Å; K1376-Y1468 HydrophobicContact CD-CD1 4.4Å; K1376-Y1468 HydrophobicContact CD-CE1 3.89Å; K1376-Y1468 HydrophobicContact CD-CE2 4.34Å; K1376-Y1468 PolarHBondContact NZ-O 3.09Å; K1376-S1500 WeakPolarHBondContact CE-OG 3.24Å; K1376-E1505 WeakPolarHBondContact CE-OE2 3.35Å; K1376-E1505 IonicContact NZ-OE1 3.7Å; K1376-E1505 PolarHBondContact NZ-OE1 3.15Å; K1376-E1505 IonicContact NZ-OE2 2.72Å; K1376-E1505 PolarHBondContact NZ-OE2 2.99Å
1377	L	93.5	Very high	90	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-75.8	-31.2	178.5	-70.4	-176.9	0	0	0	112.4	I1370 C1374 G1375 L1380 H1381 M1403 I1406 L1407 F1410 Y1468	I1370-L1377 HydrophobicContact CG2-CD1 4.21Å; I1370-L1377 VanDerWaalsContact O-CD1 3.29Å; I1370-L1377 WeakPolarHBondContact O-CD1 3.43Å; C1374-L1377 HydrophobicContact CB-CB 4.25Å; C1374-L1377 HydrophobicContact CB-CD1 4.28Å; C1374-L1377 HydrophobicContact CB-CG 4.2Å; C1374-L1377 PolarHBondContact O-N 2.75Å; G1375-L1377 VanDerWaalsContact C-N 3.34Å; G1375-L1377 PolarHBondContact O-N 2.79Å; L1377-L1380 HydrophobicContact CD2-CD2 3.85Å; L1377-H1381 WeakPolarHBondContact O-CB 3.48Å; L1377-H1381 PolarHBondContact O-N 3.26Å; L1377-M1403 HydrophobicContact CD2-CE 4.23Å; L1377-I1406 HydrophobicContact CD1-CG2 4.49Å; L1377-L1407 HydrophobicContact CD2-CD2 3.91Å; L1377-F1410 HydrophobicContact CB-CE2 4.19Å; L1377-F1410 HydrophobicContact CD1-CD2 4.36Å; L1377-F1410 HydrophobicContact CD2-CD1 4.36Å; L1377-F1410 HydrophobicContact CD2-CD2 4.44Å; L1377-F1410 HydrophobicContact CD2-CE1 4.38Å; L1377-F1410 HydrophobicContact CD2-CE2 4.45Å; L1377-F1410 HydrophobicContact CD2-CG 4.39Å; L1377-F1410 HydrophobicContact CD2-CZ 4.42Å; L1377-Y1468 HydrophobicContact CD2-CE2 3.88Å
1378	Q	92.2	Very high	90.6	Very high	53 Å²	53	47.4 Å²	47.4	25%	0.248	21%	0.209	C	C	.	.	H	α-helix	trans	-58.2	-56.4	168.9	-63.3	171.9	-26.8	0	0	110.8	Q1371 C1374 G1375 L1380 H1381 S1382	Q1371-Q1378 HydrophobicContact CG-CG 4.46Å; Q1371-Q1378 WeakPolarHBondContact O-CG 3.35Å; C1374-Q1378 PolarHBondContact O-N 2.98Å; C1374-Q1378 VanDerWaalsContact O-N 3.16Å; G1375-Q1378 PolarHBondContact O-N 2.86Å; Q1378-L1380 VanDerWaalsContact C-N 3.34Å; Q1378-L1380 PolarHBondContact O-N 2.7Å; Q1378-H1381 WeakPolarHBondContact O-CB 3.22Å; Q1378-H1381 PolarHBondContact O-N 2.8Å; Q1378-H1381 VanDerWaalsContact O-N 3.12Å; Q1378-S1382 PolarHBondContact O-N 2.71Å
1379	R	92.9	Very high	91.1	Very high	111 Å²	111	46.7 Å²	46.7	42%	0.419	22%	0.221	S	C	.	.	H	α-helix	trans	-65.1	-35.1	179.5	-66.7	-73.2	169.2	178.2	-8.5	112.5	G1375 H1381 L1383 D1635	G1375-R1379 PolarHBondContact O-N 3.31Å; R1379-H1381 VanDerWaalsContact C-N 3.34Å; R1379-H1381 PolarHBondContact O-N 3.47Å; R1379-L1383 WeakPolarHBondContact O-CB 3.3Å; R1379-L1383 PolarHBondContact O-N 2.86Å; R1379-L1383 VanDerWaalsContact O-N 3.15Å; R1379-D1635 IonicContact NH2-OD2 2.66Å
1380	L	94.4	Very high	91.3	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.6	-35.8	172.6	-177.7	65	0	0	0	112.5	K1376 L1377 Q1378 L1384 L1407 F1410 I1466 Y1468 L1498	K1376-L1380 WeakPolarHBondContact O-CB 3.41Å; K1376-L1380 PolarHBondContact O-N 3.04Å; L1377-L1380 HydrophobicContact CD2-CD2 3.85Å; Q1378-L1380 VanDerWaalsContact C-N 3.34Å; Q1378-L1380 PolarHBondContact O-N 2.7Å; L1380-L1384 HydrophobicContact CD1-CD1 4.04Å; L1380-L1384 HydrophobicContact CD1-CG 4.04Å; L1380-L1384 HydrophobicContact CD2-CD1 4.41Å; L1380-L1384 HydrophobicContact CG-CD1 3.85Å; L1380-L1384 HydrophobicContact CG-CG 4.25Å; L1380-L1384 WeakPolarHBondContact O-CB 3.5Å; L1380-L1384 VanDerWaalsContact O-CG 3.26Å; L1380-L1384 WeakPolarHBondContact O-CG 3.02Å; L1380-L1384 PolarHBondContact O-N 2.99Å; L1380-L1407 HydrophobicContact CD2-CD2 3.92Å; L1380-F1410 HydrophobicContact CD2-CE1 3.96Å; L1380-F1410 HydrophobicContact CG-CE1 4.27Å; L1380-I1466 HydrophobicContact CD1-CD1 3.75Å; L1380-I1466 HydrophobicContact CD1-CG2 4.22Å; L1380-Y1468 HydrophobicContact CD2-CD2 4.28Å; L1380-Y1468 HydrophobicContact CD2-CE2 4.19Å; L1380-L1498 HydrophobicContact CB-CD1 4.26Å; L1380-L1498 HydrophobicContact CD1-CD1 4.46Å
1381	H	92.9	Very high	91.5	Very high	45 Å²	45	50.4 Å²	50.4	21%	0.208	25%	0.25	C	C	.	.	H	α-helix	trans	-62	-53.1	177.2	179	82.9	0	0	0	111.5	L1377 Q1378 R1379 L1383 L1384 R1385 F1410 H1414	L1377-H1381 WeakPolarHBondContact O-CB 3.48Å; L1377-H1381 PolarHBondContact O-N 3.26Å; Q1378-H1381 WeakPolarHBondContact O-CB 3.22Å; Q1378-H1381 PolarHBondContact O-N 2.8Å; Q1378-H1381 VanDerWaalsContact O-N 3.12Å; R1379-H1381 VanDerWaalsContact C-N 3.34Å; R1379-H1381 PolarHBondContact O-N 3.47Å; H1381-L1383 VanDerWaalsContact C-N 3.32Å; H1381-L1383 PolarHBondContact O-N 3.12Å; H1381-L1384 PolarHBondContact O-N 2.91Å; H1381-L1384 VanDerWaalsContact O-N 3.15Å; H1381-R1385 PolarHBondContact O-N 2.96Å; H1381-F1410 HydrophobicContact CB-CE2 4.5Å; H1381-F1410 HydrophobicContact CB-CZ 4.05Å; H1381-H1414 AromaticContact CE1-CE1 3.32Å; H1381-H1414 PolarHBondContact CE1-CE1 3.09Å; H1381-H1414 AromaticContact CE1-ND1 3.45Å; H1381-H1414 PolarHBondContact CE1-ND1 2.74Å; H1381-H1414 AromaticContact CE1-NE2 3.78Å; H1381-H1414 AromaticContact ND1-CD2 3.56Å; H1381-H1414 AromaticContact ND1-CE1 3.06Å; H1381-H1414 PolarHBondContact ND1-CE1 3.12Å; H1381-H1414 AromaticContact ND1-CG 3.81Å; H1381-H1414 AromaticContact ND1-ND1 3.52Å; H1381-H1414 AromaticContact ND1-NE2 3.05Å; H1381-H1414 PolarHBondContact ND1-NE2 2.89Å
1382	S	92	Very high	91.8	Very high	48 Å²	48	52.1 Å²	52.1	34%	0.336	26%	0.258	S	S	.	.	H	α-helix	trans	-60.9	-42.6	-179.3	-53.7	0	0	0	0	111.2	Q1378 L1384 R1385 E1386	Q1378-S1382 PolarHBondContact O-N 2.71Å; S1382-L1384 PolarHBondContact O-N 3.13Å; S1382-R1385 WeakPolarHBondContact O-CB 3.26Å; S1382-R1385 PolarHBondContact O-N 2.68Å; S1382-E1386 PolarHBondContact O-N 3.47Å
1383	L	93.7	Very high	92	Very high	11 Å²	11	49 Å²	49	6%	0.058	25%	0.245	C	C	.	.	H	α-helix	trans	-62.1	-39.9	174.6	-175.1	65.8	0	0	0	112.7	I886 R1379 H1381 E1386 L1387 I1466 Y1496	I886-L1383 HydrophobicContact CD1-CD2 4.02Å; R1379-L1383 WeakPolarHBondContact O-CB 3.3Å; R1379-L1383 PolarHBondContact O-N 2.86Å; R1379-L1383 VanDerWaalsContact O-N 3.15Å; H1381-L1383 VanDerWaalsContact C-N 3.32Å; H1381-L1383 PolarHBondContact O-N 3.12Å; L1383-E1386 PolarHBondContact O-N 3.46Å; L1383-L1387 HydrophobicContact CD1-CD1 4.15Å; L1383-L1387 HydrophobicContact CD1-CG 4.35Å; L1383-L1387 HydrophobicContact CG-CD1 3.84Å; L1383-L1387 HydrophobicContact CG-CG 4.44Å; L1383-L1387 WeakPolarHBondContact O-CB 3.25Å; L1383-L1387 WeakPolarHBondContact O-CD1 3.04Å; L1383-L1387 WeakPolarHBondContact O-CG 3.47Å; L1383-L1387 PolarHBondContact O-N 3.11Å; L1383-I1466 HydrophobicContact CD2-CD1 3.88Å; L1383-I1466 HydrophobicContact CD2-CG1 4.45Å; L1383-Y1496 HydrophobicContact CD1-CD1 4.28Å; L1383-Y1496 HydrophobicContact CD1-CD2 4.34Å; L1383-Y1496 HydrophobicContact CD1-CE1 4.1Å; L1383-Y1496 HydrophobicContact CD1-CE2 4.14Å; L1383-Y1496 HydrophobicContact CD1-CG 4.41Å; L1383-Y1496 HydrophobicContact CD2-CD1 4.32Å; L1383-Y1496 HydrophobicContact CD2-CD2 4.09Å; L1383-Y1496 HydrophobicContact CD2-CG 3.89Å
1384	L	94.3	Very high	92.4	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-73.8	-25.1	176	-71.7	175.1	0	0	0	113.2	L1380 H1381 S1382 K1388 V1394 F1410 L1411 F1444 V1445 I1466	L1380-L1384 HydrophobicContact CD1-CD1 4.04Å; L1380-L1384 HydrophobicContact CD1-CG 4.04Å; L1380-L1384 HydrophobicContact CD2-CD1 4.41Å; L1380-L1384 HydrophobicContact CG-CD1 3.85Å; L1380-L1384 HydrophobicContact CG-CG 4.25Å; L1380-L1384 WeakPolarHBondContact O-CB 3.5Å; L1380-L1384 VanDerWaalsContact O-CG 3.26Å; L1380-L1384 WeakPolarHBondContact O-CG 3.02Å; L1380-L1384 PolarHBondContact O-N 2.99Å; H1381-L1384 PolarHBondContact O-N 2.91Å; H1381-L1384 VanDerWaalsContact O-N 3.15Å; S1382-L1384 PolarHBondContact O-N 3.13Å; L1384-K1388 WeakPolarHBondContact O-CB 3.47Å; L1384-K1388 PolarHBondContact O-N 3.05Å; L1384-V1394 HydrophobicContact CD2-CB 4.5Å; L1384-V1394 HydrophobicContact CD2-CG1 4.16Å; L1384-V1394 HydrophobicContact CD2-CG2 4.28Å; L1384-F1410 HydrophobicContact CD1-CE1 4.12Å; L1384-L1411 HydrophobicContact CD1-CD2 3.91Å; L1384-F1444 HydrophobicContact CB-CE1 4.42Å; L1384-F1444 HydrophobicContact CD2-CE1 3.94Å; L1384-F1444 HydrophobicContact CD2-CZ 4.22Å; L1384-V1445 HydrophobicContact CD2-CG2 4.5Å; L1384-I1466 HydrophobicContact CD2-CD1 4.27Å
1385	R	92	Very high	92.5	Very high	140 Å²	140	48.6 Å²	48.6	53%	0.528	24%	0.243	S	C	.	.	H	α-helix	trans	-67.9	-45.7	170.5	-178.4	179.1	170.7	-157.5	-7.2	110.2	H1381 S1382 S1389 E1627	H1381-R1385 PolarHBondContact O-N 2.96Å; S1382-R1385 WeakPolarHBondContact O-CB 3.26Å; S1382-R1385 PolarHBondContact O-N 2.68Å; R1385-S1389 PolarHBondContact O-N 2.92Å; R1385-E1627 IonicContact CZ-OE1 2.68Å; R1385-E1627 VanDerWaalsContact CZ-OE1 3.26Å; R1385-E1627 IonicContact NH1-OE1 3.88Å; R1385-E1627 PolarHBondContact NH1-OE1 2.91Å; R1385-E1627 IonicContact NH2-OE1 2.69Å; R1385-E1627 PolarHBondContact NH2-OE1 3.12Å; R1385-E1627 IonicContact NH2-OE2 3.12Å
1386	E	93.2	Very high	92.7	Very high	121 Å²	121	48.4 Å²	48.4	57%	0.565	24%	0.241	S	C	*	.	H	α-helix	trans	-64.7	-52.2	175.6	-174.9	-174.8	-176.7	0	0	112.6	S1382 L1383 K1388 S1389 G1390	S1382-E1386 PolarHBondContact O-N 3.47Å; L1383-E1386 PolarHBondContact O-N 3.46Å; E1386-K1388 PolarHBondContact O-N 3.03Å; E1386-K1388 VanDerWaalsContact O-N 3.12Å; E1386-S1389 PolarHBondContact O-N 3.34Å; E1386-S1389 PolarHBondContact O-OG 2.7Å; E1386-G1390 PolarHBondContact O-N 2.78Å
1387	L	93.4	Very high	92.7	Very high	7 Å²	7	48.4 Å²	48.4	4%	0.037	24%	0.241	C	C	.	.	H	α-helix	trans	-62.1	-25.9	180	-69.3	168.5	0	0	0	112.8	L1383 N1391 H1392 V1394 F1444 T1464 I1466 Y1496	L1383-L1387 HydrophobicContact CD1-CD1 4.15Å; L1383-L1387 HydrophobicContact CD1-CG 4.35Å; L1383-L1387 HydrophobicContact CG-CD1 3.84Å; L1383-L1387 HydrophobicContact CG-CG 4.44Å; L1383-L1387 WeakPolarHBondContact O-CB 3.25Å; L1383-L1387 WeakPolarHBondContact O-CD1 3.04Å; L1383-L1387 WeakPolarHBondContact O-CG 3.47Å; L1383-L1387 PolarHBondContact O-N 3.11Å; L1387-N1391 PolarHBondContact O-N 3.49Å; L1387-H1392 HydrophobicContact CB-CB 4.38Å; L1387-H1392 HydrophobicContact CD2-CB 4.1Å; L1387-H1392 PolarHBondContact O-N 2.92Å; L1387-H1392 VanDerWaalsContact O-N 3.08Å; L1387-V1394 HydrophobicContact CB-CG2 4.14Å; L1387-V1394 HydrophobicContact CD1-CG1 4.5Å; L1387-V1394 HydrophobicContact CD1-CG2 3.92Å; L1387-F1444 HydrophobicContact CB-CE2 4.36Å; L1387-F1444 HydrophobicContact CB-CZ 4.05Å; L1387-T1464 HydrophobicContact CD1-CG2 3.71Å; L1387-T1464 HydrophobicContact CD2-CG2 3.92Å; L1387-T1464 HydrophobicContact CG-CG2 4.49Å; L1387-I1466 HydrophobicContact CD1-CD1 4.25Å; L1387-Y1496 HydrophobicContact CD1-CE2 4.44Å; L1387-Y1496 HydrophobicContact CD2-CE2 4.27Å
1388	K	90.6	Very high	92.7	Very high	110 Å²	110	48.4 Å²	48.4	48%	0.478	24%	0.241	S	C	.	.	H	α-helix	trans	-75.5	-36.1	174.3	-174.1	177.1	176.6	-174.5	0	112.5	L1384 E1386 N1391 F1444	L1384-K1388 WeakPolarHBondContact O-CB 3.47Å; L1384-K1388 PolarHBondContact O-N 3.05Å; E1386-K1388 PolarHBondContact O-N 3.03Å; E1386-K1388 VanDerWaalsContact O-N 3.12Å; K1388-N1391 PolarHBondContact O-N 3.06Å; K1388-F1444 HydrophobicContact CB-CE1 4.15Å; K1388-F1444 HydrophobicContact CB-CE2 3.99Å; K1388-F1444 HydrophobicContact CB-CZ 3.69Å
1389	S	90.7	Very high	92.6	Very high	93 Å²	93	47.8 Å²	47.8	65%	0.65	24%	0.239	S	C	*	.	H	α-helix	trans	-71.1	-35.3	172.7	63.7	0	0	0	0	111.6	R1385 E1386 N1391	R1385-S1389 PolarHBondContact O-N 2.92Å; E1386-S1389 PolarHBondContact O-N 3.34Å; E1386-S1389 PolarHBondContact O-OG 2.7Å; S1389-N1391 PolarHBondContact O-N 3.47Å; S1389-N1391 PolarHBondContact O-ND2 2.63Å
1390	G	87.8	Confident	92.4	Very high	37 Å²	37	43.9 Å²	43.9	38%	0.381	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-5.3	172.8	0	0	0	0	0	115.8	E1386 H1392	E1386-G1390 PolarHBondContact O-N 2.78Å; G1390-H1392 VanDerWaalsContact C-N 3.26Å; G1390-H1392 PolarHBondContact O-N 2.76Å
1391	N	89.6	Confident	92.1	Very high	126 Å²	126	46.9 Å²	46.9	67%	0.674	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.7	43.9	-173.9	-72.8	-75	0	0	0	113.2	L1387 K1388 S1389 R1491	L1387-N1391 PolarHBondContact O-N 3.49Å; K1388-N1391 PolarHBondContact O-N 3.06Å; S1389-N1391 PolarHBondContact O-N 3.47Å; S1389-N1391 PolarHBondContact O-ND2 2.63Å; N1391-R1491 PolarHBondContact O-NH1 3.33Å
1392	H	92.9	Very high	91.9	Very high	61 Å²	61	51.9 Å²	51.9	28%	0.282	27%	0.267	S	S	.	.			trans	-86.4	163.6	171.3	-67.6	-63.4	0	0	0	111.3	L1387 G1390 F1444 D1463	L1387-H1392 HydrophobicContact CB-CB 4.38Å; L1387-H1392 HydrophobicContact CD2-CB 4.1Å; L1387-H1392 PolarHBondContact O-N 2.92Å; L1387-H1392 VanDerWaalsContact O-N 3.08Å; G1390-H1392 VanDerWaalsContact C-N 3.26Å; G1390-H1392 PolarHBondContact O-N 2.76Å; H1392-F1444 VanDerWaalsContact O-CD2 3.25Å; H1392-F1444 WeakPolarHBondContact O-CD2 3.2Å; H1392-F1444 VanDerWaalsContact O-CE2 3.3Å; H1392-F1444 WeakPolarHBondContact O-CE2 3.42Å; H1392-D1463 WeakPolarHBondContact CA-OD1 3.27Å; H1392-D1463 VanDerWaalsContact CB-OD1 3.32Å; H1392-D1463 WeakPolarHBondContact CB-OD1 3.17Å; H1392-D1463 IonicContact CE1-OD2 2.66Å; H1392-D1463 IonicContact CG-OD1 3.28Å; H1392-D1463 IonicContact CG-OD2 2.77Å; H1392-D1463 IonicContact ND1-OD1 3.77Å; H1392-D1463 IonicContact ND1-OD2 3.65Å; H1392-D1463 PolarHBondContact ND1-OD2 3.08Å
1393	R	93.6	Very high	91.9	Very high	53 Å²	53	49.6 Å²	49.6	20%	0.2	25%	0.251	C	S	.	.			trans	-122.9	127.1	172.9	-78.3	-165.4	-64.7	-170.6	-7.2	109.9	F1437 I1443 G1461 A1462 D1463 T1464	R1393-F1437 HydrophobicContact CB-CZ 4.24Å; R1393-F1437 PolarHBondContact NH1-O 2.75Å; R1393-I1443 WeakPolarHBondContact CD-O 3.45Å; R1393-G1461 PolarHBondContact NE-O 3.39Å; R1393-G1461 PolarHBondContact NH2-O 3.5Å; R1393-A1462 WeakPolarHBondContact O-CA 3.37Å; R1393-A1462 WeakPolarHBondContact O-CB 3.32Å; R1393-D1463 PolarHBondContact N-OD1 3.35Å; R1393-D1463 PolarHBondContact O-N 3.35Å; R1393-D1463 VanDerWaalsContact O-N 3.1Å; R1393-D1463 VanDerWaalsContact O-OD1 3.12Å; R1393-T1464 PolarHBondContact O-N 3.19Å; R1393-T1464 VanDerWaalsContact O-N 3.09Å
1394	V	94.6	Very high	91.9	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	126	-159.8	-170.7	0	0	0	0	111.4	L1384 L1387 I1396 F1444 V1445 F1446 T1464 I1466	L1384-V1394 HydrophobicContact CD2-CB 4.5Å; L1384-V1394 HydrophobicContact CD2-CG1 4.16Å; L1384-V1394 HydrophobicContact CD2-CG2 4.28Å; L1387-V1394 HydrophobicContact CB-CG2 4.14Å; L1387-V1394 HydrophobicContact CD1-CG1 4.5Å; L1387-V1394 HydrophobicContact CD1-CG2 3.92Å; V1394-I1396 HydrophobicContact CG1-CG1 4.17Å; V1394-F1444 HydrophobicContact CG2-CD2 4.49Å; V1394-F1444 HydrophobicContact CG2-CE2 3.85Å; V1394-F1444 HydrophobicContact CG2-CZ 3.85Å; V1394-F1444 PolarHBondContact N-O 2.84Å; V1394-V1445 CarbonylContact O-C 3.45Å; V1394-V1445 WeakPolarHBondContact O-CA 3.33Å; V1394-F1446 PolarHBondContact O-N 2.76Å; V1394-T1464 WeakPolarHBondContact CA-O 3.15Å; V1394-T1464 HydrophobicContact CG1-CG2 4.42Å; V1394-I1466 HydrophobicContact CG1-CD1 3.5Å; V1394-I1466 VanDerWaalsContact CG1-CD1 3.5Å; V1394-I1466 HydrophobicContact CG1-CG1 3.77Å
1395	L	94.7	Very high	91.8	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	131.9	163.4	-52.6	-174.6	0	0	0	109.2	F1397 F1437 F1446 L1448 L1459 A1462 T1464 V1465 I1466 C1484	L1395-F1397 HydrophobicContact CB-CE2 4.12Å; L1395-F1397 HydrophobicContact CB-CZ 4.48Å; L1395-F1397 HydrophobicContact CD1-CE2 4.16Å; L1395-F1397 HydrophobicContact CD1-CZ 4.1Å; L1395-F1437 HydrophobicContact CD2-CE1 3.84Å; L1395-F1437 HydrophobicContact CD2-CZ 3.92Å; L1395-F1446 WeakPolarHBondContact CA-O 3.38Å; L1395-F1446 HydrophobicContact CD2-CB 3.83Å; L1395-F1446 HydrophobicContact CD2-CD1 4.2Å; L1395-F1446 HydrophobicContact CD2-CG 4.48Å; L1395-L1448 HydrophobicContact CB-CD1 4.14Å; L1395-L1448 HydrophobicContact CD1-CD1 4.39Å; L1395-L1448 HydrophobicContact CD2-CD1 3.94Å; L1395-L1448 HydrophobicContact CG-CD1 4.38Å; L1395-L1459 HydrophobicContact CD1-CB 4.07Å; L1395-L1459 HydrophobicContact CD1-CD1 3.62Å; L1395-L1459 HydrophobicContact CD1-CG 4.49Å; L1395-L1459 HydrophobicContact CD2-CD1 3.97Å; L1395-L1459 HydrophobicContact CG-CD1 4.46Å; L1395-A1462 HydrophobicContact CD1-CB 4.04Å; L1395-A1462 HydrophobicContact CD2-CB 3.59Å; L1395-A1462 HydrophobicContact CG-CB 3.5Å; L1395-A1462 VanDerWaalsContact CG-CB 3.5Å; L1395-T1464 PolarHBondContact N-O 3.42Å; L1395-V1465 HydrophobicContact CD1-CG2 4.35Å; L1395-V1465 CarbonylContact O-C 3.57Å; L1395-I1466 PolarHBondContact O-N 2.9Å; L1395-C1484 HydrophobicContact CD1-CB 4.18Å
1396	I	94.9	Very high	91.8	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	116.7	170.2	-57.1	179.4	0	0	0	108.5	V1394 T1398 L1407 V1445 F1446 I1447 L1448 I1466	V1394-I1396 HydrophobicContact CG1-CG1 4.17Å; I1396-T1398 HydrophobicContact CG2-CG2 4.47Å; I1396-L1407 HydrophobicContact CG2-CD1 3.97Å; I1396-V1445 HydrophobicContact CD1-CG1 3.64Å; I1396-V1445 HydrophobicContact CG1-CG1 3.86Å; I1396-F1446 PolarHBondContact N-O 3.35Å; I1396-I1447 HydrophobicContact CB-CG2 4.36Å; I1396-L1448 PolarHBondContact O-N 3.1Å; I1396-I1466 WeakPolarHBondContact CA-O 3.21Å; I1396-I1466 HydrophobicContact CG1-CB 4.38Å; I1396-I1466 HydrophobicContact CG1-CD1 4.47Å
1397	F	93.6	Very high	91.8	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	134.6	175.6	-70.7	-68	0	0	0	111.3	L1395 L1448 V1465 I1466 F1467 Y1468 A1480	L1395-F1397 HydrophobicContact CB-CE2 4.12Å; L1395-F1397 HydrophobicContact CB-CZ 4.48Å; L1395-F1397 HydrophobicContact CD1-CE2 4.16Å; L1395-F1397 HydrophobicContact CD1-CZ 4.1Å; F1397-L1448 WeakPolarHBondContact CA-O 3.15Å; F1397-L1448 HydrophobicContact CD1-CB 3.57Å; F1397-L1448 HydrophobicContact CD1-CD1 4.49Å; F1397-L1448 HydrophobicContact CE1-CB 3.54Å; F1397-L1448 HydrophobicContact CE1-CD1 3.85Å; F1397-L1448 HydrophobicContact CE1-CD2 4.45Å; F1397-L1448 HydrophobicContact CE1-CG 4.15Å; F1397-L1448 HydrophobicContact CZ-CD1 4.09Å; F1397-V1465 HydrophobicContact CD2-CG1 3.65Å; F1397-V1465 HydrophobicContact CE2-CG1 3.67Å; F1397-I1466 PolarHBondContact N-O 2.79Å; F1397-F1467 HydrophobicContact CB-CD1 3.83Å; F1397-F1467 HydrophobicContact CB-CE1 4.03Å; F1397-F1467 HydrophobicContact CD2-CD1 4.3Å; F1397-F1467 AromaticContact CD2-CE1 3.85Å; F1397-F1467 HydrophobicContact CD2-CE1 3.85Å; F1397-F1467 HydrophobicContact CD2-CZ 4.22Å; F1397-F1467 HydrophobicContact CG-CD1 4.43Å; F1397-F1467 HydrophobicContact CG-CE1 4.15Å; F1397-Y1468 PolarHBondContact O-N 3.02Å; F1397-Y1468 VanDerWaalsContact O-N 3.14Å; F1397-A1480 HydrophobicContact CD1-CB 4.47Å; F1397-A1480 HydrophobicContact CD2-CB 4.34Å; F1397-A1480 HydrophobicContact CE1-CB 4.17Å; F1397-A1480 HydrophobicContact CE2-CB 4.03Å; F1397-A1480 HydrophobicContact CZ-CB 3.94Å
1398	T	92.9	Very high	91.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	152.5	171.8	66.4	0	0	0	0	112.1	I1396 M1403 L1404 L1407 L1448 S1449 T1450 D1469	I1396-T1398 HydrophobicContact CG2-CG2 4.47Å; T1398-M1403 HydrophobicContact CG2-CG 4.26Å; T1398-L1404 HydrophobicContact CG2-CD2 4.46Å; T1398-L1404 VanDerWaalsContact OG1-CD2 3.22Å; T1398-L1404 WeakPolarHBondContact OG1-CD2 3.23Å; T1398-L1407 HydrophobicContact CG2-CD1 3.58Å; T1398-L1448 PolarHBondContact N-O 3.16Å; T1398-S1449 CarbonylContact O-C 3.31Å; T1398-S1449 VanDerWaalsContact O-CA 3.28Å; T1398-S1449 WeakPolarHBondContact O-CA 3.5Å; T1398-T1450 PolarHBondContact O-N 2.65Å; T1398-T1450 PolarHBondContact O-OG1 3.12Å; T1398-D1469 VanDerWaalsContact CA-OD1 3.25Å; T1398-D1469 WeakPolarHBondContact CA-OD1 3.26Å
1399	Q	90.3	Very high	91.8	Very high	40 Å²	40	43 Å²	43	19%	0.187	23%	0.23	C	C	.	.	S	Bend	trans	-86.5	-40.7	171.3	-56.5	-62.7	-12.4	0	0	111.9	T1450 D1469 D1471	Q1399-T1450 VanDerWaalsContact NE2-CB 3.35Å; Q1399-T1450 PolarHBondContact NE2-OG1 2.72Å; Q1399-T1450 VanDerWaalsContact NE2-OG1 3.14Å; Q1399-D1469 PolarHBondContact N-OD1 2.88Å; Q1399-D1471 PolarHBondContact NE2-OD2 3.15Å
1400	M	88.2	Confident	92	Very high	29 Å²	29	38.6 Å²	38.6	14%	0.143	20%	0.199	C	C	.	.			trans	-87	113.1	-173.9	-59	-168.1	-170.5	0	0	112.7	M924 R927 K928 L935 R1402 M1403	M924-M1400 HydrophobicContact SD-CE 3.99Å; R927-M1400 HydrophobicContact CB-CE 3.79Å; K928-M1400 HydrophobicContact CG-CE 3.89Å; K928-M1400 HydrophobicContact CG-SD 3.77Å; L935-M1400 HydrophobicContact CD1-SD 4.22Å; M1400-R1402 VanDerWaalsContact C-N 3.26Å; M1400-R1402 PolarHBondContact O-N 3.37Å; M1400-R1402 VanDerWaalsContact O-N 3.14Å; M1400-M1403 HydrophobicContact CB-CB 4.21Å; M1400-M1403 VanDerWaalsContact O-CB 3.26Å; M1400-M1403 WeakPolarHBondContact O-CB 3.05Å; M1400-M1403 PolarHBondContact O-N 3.25Å
1401	A	87.7	Confident	92.2	Very high	62 Å²	62	36.9 Å²	36.9	51%	0.512	18%	0.181	S	C	.	.	H	α-helix	trans	-56.2	-33.6	179.9	0	0	0	0	0	114.5	M1403 L1404	A1401-M1403 VanDerWaalsContact C-N 3.26Å; A1401-M1403 PolarHBondContact O-N 2.61Å; A1401-L1404 VanDerWaalsContact O-CB 3.29Å; A1401-L1404 WeakPolarHBondContact O-CB 3.19Å; A1401-L1404 PolarHBondContact O-N 2.73Å
1402	R	89.2	Confident	92.3	Very high	150 Å²	150	32.7 Å²	32.7	57%	0.566	16%	0.164	S	C	*	.	H	α-helix	trans	-66.9	-23.2	174.1	-70	-171.9	-176.6	-176.1	1.1	113.6	L935 M1400 L1404 D1405	L935-R1402 HydrophobicContact CD2-CB 3.61Å; M1400-R1402 VanDerWaalsContact C-N 3.26Å; M1400-R1402 PolarHBondContact O-N 3.37Å; M1400-R1402 VanDerWaalsContact O-N 3.14Å; R1402-L1404 VanDerWaalsContact C-N 3.3Å; R1402-D1405 PolarHBondContact O-N 3.29Å
1403	M	93.4	Very high	92.1	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-70.7	-29.4	175.2	-169	65.2	-152.7	0	0	111.1	N931 H932 L935 L1377 T1398 M1400 A1401 D1405 I1406 L1407 Y1468	N931-M1403 HydrophobicContact CB-SD 4.48Å; H932-M1403 HydrophobicContact CB-CE 4.32Å; H932-M1403 HydrophobicContact CB-SD 3.97Å; L935-M1403 HydrophobicContact CD1-CB 4.44Å; L935-M1403 HydrophobicContact CD1-SD 3.88Å; L1377-M1403 HydrophobicContact CD2-CE 4.23Å; T1398-M1403 HydrophobicContact CG2-CG 4.26Å; M1400-M1403 HydrophobicContact CB-CB 4.21Å; M1400-M1403 VanDerWaalsContact O-CB 3.26Å; M1400-M1403 WeakPolarHBondContact O-CB 3.05Å; M1400-M1403 PolarHBondContact O-N 3.25Å; A1401-M1403 VanDerWaalsContact C-N 3.26Å; A1401-M1403 PolarHBondContact O-N 2.61Å; M1403-D1405 VanDerWaalsContact C-N 3.26Å; M1403-D1405 PolarHBondContact O-N 3.38Å; M1403-I1406 HydrophobicContact CE-CB 4.31Å; M1403-I1406 HydrophobicContact CE-CG2 4.13Å; M1403-I1406 PolarHBondContact O-N 3.06Å; M1403-I1406 HydrophobicContact SD-CB 4.38Å; M1403-I1406 HydrophobicContact SD-CD1 4.36Å; M1403-L1407 HydrophobicContact CE-CD2 4Å; M1403-L1407 HydrophobicContact CE-CG 3.94Å; M1403-L1407 HydrophobicContact CG-CD1 4.28Å; M1403-L1407 HydrophobicContact CG-CG 4.34Å; M1403-L1407 WeakPolarHBondContact O-CG 3.22Å; M1403-L1407 PolarHBondContact O-N 3.31Å; M1403-Y1468 HydrophobicContact CE-CD1 4.39Å; M1403-Y1468 HydrophobicContact CE-CE1 3.59Å; M1403-Y1468 HydrophobicContact CE-CE2 4.21Å; M1403-Y1468 VanDerWaalsContact CE-CZ 3.49Å; M1403-Y1468 WeakPolarHBondContact CE-OH 3.4Å; M1403-Y1468 HydrophobicContact CG-CD1 4.22Å; M1403-Y1468 HydrophobicContact CG-CE1 4.15Å; M1403-Y1468 HydrophobicContact SD-CE1 3.96Å
1404	L	92.6	Very high	91.9	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-59.2	-39.6	173.4	-58	173.3	0	0	0	111.4	T1398 A1401 R1402 I1406 L1407 E1408 D1422 I1447	T1398-L1404 HydrophobicContact CG2-CD2 4.46Å; T1398-L1404 VanDerWaalsContact OG1-CD2 3.22Å; T1398-L1404 WeakPolarHBondContact OG1-CD2 3.23Å; A1401-L1404 VanDerWaalsContact O-CB 3.29Å; A1401-L1404 WeakPolarHBondContact O-CB 3.19Å; A1401-L1404 PolarHBondContact O-N 2.73Å; R1402-L1404 VanDerWaalsContact C-N 3.3Å; L1404-I1406 VanDerWaalsContact C-N 3.33Å; L1404-I1406 PolarHBondContact O-N 2.87Å; L1404-L1407 PolarHBondContact O-N 2.72Å; L1404-E1408 WeakPolarHBondContact O-CB 2.94Å; L1404-E1408 PolarHBondContact O-N 2.73Å; L1404-D1422 HydrophobicContact CD1-CB 3.77Å; L1404-I1447 HydrophobicContact CD2-CB 4.33Å; L1404-I1447 HydrophobicContact CD2-CG2 3.43Å; L1404-I1447 VanDerWaalsContact CD2-CG2 3.43Å
1405	D	92.2	Very high	91.5	Very high	65 Å²	65	37 Å²	37	35%	0.348	20%	0.198	S	C	.	.	H	α-helix	trans	-67.2	-33.6	179	-53.8	-32.9	0	0	0	111.8	R1402 M1403 Q1409 R1420	R1402-D1405 PolarHBondContact O-N 3.29Å; M1403-D1405 VanDerWaalsContact C-N 3.26Å; M1403-D1405 PolarHBondContact O-N 3.38Å; D1405-Q1409 WeakPolarHBondContact O-CG 3.18Å; D1405-Q1409 PolarHBondContact O-N 3.32Å; D1405-R1420 IonicContact OD1-CZ 2.8Å; D1405-R1420 VanDerWaalsContact OD1-CZ 3.24Å; D1405-R1420 IonicContact OD1-NH1 2.71Å; D1405-R1420 PolarHBondContact OD1-NH1 2.67Å; D1405-R1420 IonicContact OD1-NH2 3.7Å; D1405-R1420 PolarHBondContact OD1-NH2 3.04Å
1406	I	92.4	Very high	91.4	Very high	19 Å²	19	37.9 Å²	37.9	10%	0.097	20%	0.203	C	C	.	.	H	α-helix	trans	-75.4	-43.3	175.6	-60.2	176.5	0	0	0	110.8	H932 L935 I1370 L1377 M1403 L1404 E1408 Q1409 F1410	H932-I1406 HydrophobicContact CB-CD1 4.14Å; L935-I1406 HydrophobicContact CD2-CD1 3.65Å; L935-I1406 HydrophobicContact CG-CD1 3.79Å; I1370-I1406 HydrophobicContact CG2-CG2 4.24Å; L1377-I1406 HydrophobicContact CD1-CG2 4.49Å; M1403-I1406 HydrophobicContact CE-CB 4.31Å; M1403-I1406 HydrophobicContact CE-CG2 4.13Å; M1403-I1406 PolarHBondContact O-N 3.06Å; M1403-I1406 HydrophobicContact SD-CB 4.38Å; M1403-I1406 HydrophobicContact SD-CD1 4.36Å; L1404-I1406 VanDerWaalsContact C-N 3.33Å; L1404-I1406 PolarHBondContact O-N 2.87Å; I1406-E1408 VanDerWaalsContact C-N 3.28Å; I1406-E1408 PolarHBondContact O-N 2.75Å; I1406-Q1409 PolarHBondContact O-N 3.16Å; I1406-F1410 WeakPolarHBondContact O-CB 3.23Å; I1406-F1410 PolarHBondContact O-N 3.12Å
1407	L	93.9	Very high	91.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62.9	-35.3	174.6	-71.5	172.9	0	0	0	111.9	L1377 L1380 I1396 T1398 M1403 L1404 F1410 L1411 I1447	L1377-L1407 HydrophobicContact CD2-CD2 3.91Å; L1380-L1407 HydrophobicContact CD2-CD2 3.92Å; I1396-L1407 HydrophobicContact CG2-CD1 3.97Å; T1398-L1407 HydrophobicContact CG2-CD1 3.58Å; M1403-L1407 HydrophobicContact CE-CD2 4Å; M1403-L1407 HydrophobicContact CE-CG 3.94Å; M1403-L1407 HydrophobicContact CG-CD1 4.28Å; M1403-L1407 HydrophobicContact CG-CG 4.34Å; M1403-L1407 WeakPolarHBondContact O-CG 3.22Å; M1403-L1407 PolarHBondContact O-N 3.31Å; L1404-L1407 PolarHBondContact O-N 2.72Å; L1407-F1410 PolarHBondContact O-N 3.5Å; L1407-L1411 VanDerWaalsContact O-CB 3.31Å; L1407-L1411 WeakPolarHBondContact O-CB 3.46Å; L1407-L1411 VanDerWaalsContact O-CG 3.26Å; L1407-L1411 WeakPolarHBondContact O-CG 3.4Å; L1407-L1411 PolarHBondContact O-N 3.23Å; L1407-I1447 HydrophobicContact CB-CD1 4.4Å; L1407-I1447 HydrophobicContact CD1-CG2 4.04Å
1408	E	93.5	Very high	91.3	Very high	55 Å²	55	46.7 Å²	46.7	26%	0.257	24%	0.236	S	C	.	.	H	α-helix	trans	-62.1	-44.2	172.5	169.4	141.6	-139.9	0	0	111.5	L1404 I1406 A1412 Y1418 R1420	L1404-E1408 WeakPolarHBondContact O-CB 2.94Å; L1404-E1408 PolarHBondContact O-N 2.73Å; I1406-E1408 VanDerWaalsContact C-N 3.28Å; I1406-E1408 PolarHBondContact O-N 2.75Å; E1408-A1412 WeakPolarHBondContact O-CB 3.48Å; E1408-A1412 PolarHBondContact O-N 2.77Å; E1408-Y1418 HydrophobicContact CB-CE2 4.43Å; E1408-Y1418 HydrophobicContact CG-CE2 4.02Å; E1408-Y1418 WeakPolarHBondContact CG-OH 3.4Å; E1408-Y1418 VanDerWaalsContact OE1-CE2 3.25Å; E1408-Y1418 WeakPolarHBondContact OE1-CE2 3.05Å; E1408-Y1418 PolarHBondContact OE1-OH 2.89Å; E1408-R1420 IonicContact OE2-CZ 3.32Å; E1408-R1420 IonicContact OE2-NH1 3.03Å; E1408-R1420 PolarHBondContact OE2-NH1 3.43Å
1409	Q	90.4	Very high	91.3	Very high	112 Å²	112	47.8 Å²	47.8	52%	0.523	24%	0.242	S	C	.	.	H	α-helix	trans	-64.3	-44.1	173.1	-69.3	173.1	17.8	0	0	112.5	D1405 I1406 A1412 Y1413	D1405-Q1409 WeakPolarHBondContact O-CG 3.18Å; D1405-Q1409 PolarHBondContact O-N 3.32Å; I1406-Q1409 PolarHBondContact O-N 3.16Å; Q1409-A1412 PolarHBondContact O-N 3.21Å; Q1409-Y1413 WeakPolarHBondContact O-CB 2.99Å; Q1409-Y1413 PolarHBondContact O-N 2.78Å
1410	F	93	Very high	91.4	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.009	24%	0.244	C	C	.	.	H	α-helix	trans	-64.1	-46.1	179	171.6	-100.4	0	0	0	112.9	Q1371 L1377 L1380 H1381 L1384 I1406 L1407 Y1413 H1414	Q1371-F1410 HydrophobicContact CB-CE2 4.36Å; Q1371-F1410 HydrophobicContact CG-CE2 4.28Å; L1377-F1410 HydrophobicContact CB-CE2 4.19Å; L1377-F1410 HydrophobicContact CD1-CD2 4.36Å; L1377-F1410 HydrophobicContact CD2-CD1 4.36Å; L1377-F1410 HydrophobicContact CD2-CD2 4.44Å; L1377-F1410 HydrophobicContact CD2-CE1 4.38Å; L1377-F1410 HydrophobicContact CD2-CE2 4.45Å; L1377-F1410 HydrophobicContact CD2-CG 4.39Å; L1377-F1410 HydrophobicContact CD2-CZ 4.42Å; L1380-F1410 HydrophobicContact CD2-CE1 3.96Å; L1380-F1410 HydrophobicContact CG-CE1 4.27Å; H1381-F1410 HydrophobicContact CB-CE2 4.5Å; H1381-F1410 HydrophobicContact CB-CZ 4.05Å; L1384-F1410 HydrophobicContact CD1-CE1 4.12Å; I1406-F1410 WeakPolarHBondContact O-CB 3.23Å; I1406-F1410 PolarHBondContact O-N 3.12Å; L1407-F1410 PolarHBondContact O-N 3.5Å; F1410-Y1413 WeakPolarHBondContact O-CB 3.21Å; F1410-Y1413 PolarHBondContact O-N 3.44Å; F1410-H1414 AromaticContact CD2-CD2 3.82Å; F1410-H1414 AromaticContact CD2-NE2 3.65Å; F1410-H1414 AromaticContact CE2-CD2 3.56Å; F1410-H1414 AromaticContact CE2-NE2 3.17Å; F1410-H1414 WeakPolarHBondContact CE2-NE2 3.48Å; F1410-H1414 AromaticContact CZ-CD2 3.7Å; F1410-H1414 AromaticContact CZ-NE2 3.65Å; F1410-H1414 PolarHBondContact O-CD2 3.03Å; F1410-H1414 PolarHBondContact O-N 3.45Å; F1410-H1414 VanDerWaalsContact O-N 3.1Å
1411	L	93.4	Very high	91.4	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-69.6	-33.4	177.3	-69.1	167.7	0	0	0	112	L1384 L1407 G1415 H1416 Y1418 V1445 I1447	L1384-L1411 HydrophobicContact CD1-CD2 3.91Å; L1407-L1411 VanDerWaalsContact O-CB 3.31Å; L1407-L1411 WeakPolarHBondContact O-CB 3.46Å; L1407-L1411 VanDerWaalsContact O-CG 3.26Å; L1407-L1411 WeakPolarHBondContact O-CG 3.4Å; L1407-L1411 PolarHBondContact O-N 3.23Å; L1411-G1415 PolarHBondContact O-N 3.48Å; L1411-H1416 HydrophobicContact CD2-CB 4.08Å; L1411-H1416 PolarHBondContact O-N 2.88Å; L1411-Y1418 HydrophobicContact CB-CD1 3.94Å; L1411-Y1418 HydrophobicContact CB-CG 4.5Å; L1411-Y1418 HydrophobicContact CD1-CG 4.42Å; L1411-V1445 HydrophobicContact CD1-CB 4.35Å; L1411-V1445 HydrophobicContact CD1-CG1 3.96Å; L1411-V1445 HydrophobicContact CD2-CG2 4.06Å; L1411-I1447 HydrophobicContact CD1-CD1 3.65Å; L1411-I1447 HydrophobicContact CD1-CG1 3.93Å
1412	A	91.3	Very high	91.4	Very high	39 Å²	39	45.1 Å²	45.1	32%	0.322	22%	0.216	S	C	.	.	H	α-helix	trans	-70.2	-29.9	171.8	0	0	0	0	0	113.1	E1408 Q1409	E1408-A1412 WeakPolarHBondContact O-CB 3.48Å; E1408-A1412 PolarHBondContact O-N 2.77Å; Q1409-A1412 PolarHBondContact O-N 3.21Å
1413	Y	88.3	Confident	91	Very high	104 Å²	104	40.1 Å²	40.1	41%	0.408	21%	0.212	S	C	.	.	H	α-helix	trans	-68.3	-46.9	173.6	178.1	-102.1	0	0	0	111.6	P1367 R1368 Q1409 F1410 G1415	P1367-Y1413 HydrophobicContact CB-CD2 4.19Å; P1367-Y1413 HydrophobicContact CB-CE2 4.24Å; P1367-Y1413 HydrophobicContact CG-CE2 4.2Å; R1368-Y1413 WeakPolarHBondContact CG-OH 3.46Å; Q1409-Y1413 WeakPolarHBondContact O-CB 2.99Å; Q1409-Y1413 PolarHBondContact O-N 2.78Å; F1410-Y1413 WeakPolarHBondContact O-CB 3.21Å; F1410-Y1413 PolarHBondContact O-N 3.44Å; Y1413-G1415 VanDerWaalsContact C-N 3.27Å; Y1413-G1415 PolarHBondContact O-N 3.23Å
1414	H	89.2	Confident	90.6	Very high	41 Å²	41	46.1 Å²	46.1	19%	0.19	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-0.9	177	-64.4	-54.5	0	0	0	114.5	Q1371 H1381 F1410 H1416	Q1371-H1414 PolarHBondContact OE1-CE1 2.8Å; Q1371-H1414 VanDerWaalsContact OE1-CE1 3.26Å; Q1371-H1414 PolarHBondContact OE1-NE2 3.02Å; H1381-H1414 AromaticContact CE1-CE1 3.32Å; H1381-H1414 PolarHBondContact CE1-CE1 3.09Å; H1381-H1414 AromaticContact CE1-ND1 3.45Å; H1381-H1414 PolarHBondContact CE1-ND1 2.74Å; H1381-H1414 AromaticContact CE1-NE2 3.78Å; H1381-H1414 AromaticContact ND1-CD2 3.56Å; H1381-H1414 AromaticContact ND1-CE1 3.06Å; H1381-H1414 PolarHBondContact ND1-CE1 3.12Å; H1381-H1414 AromaticContact ND1-CG 3.81Å; H1381-H1414 AromaticContact ND1-ND1 3.52Å; H1381-H1414 AromaticContact ND1-NE2 3.05Å; H1381-H1414 PolarHBondContact ND1-NE2 2.89Å; F1410-H1414 AromaticContact CD2-CD2 3.82Å; F1410-H1414 AromaticContact CD2-NE2 3.65Å; F1410-H1414 AromaticContact CE2-CD2 3.56Å; F1410-H1414 AromaticContact CE2-NE2 3.17Å; F1410-H1414 WeakPolarHBondContact CE2-NE2 3.48Å; F1410-H1414 AromaticContact CZ-CD2 3.7Å; F1410-H1414 AromaticContact CZ-NE2 3.65Å; F1410-H1414 PolarHBondContact O-CD2 3.03Å; F1410-H1414 PolarHBondContact O-N 3.45Å; F1410-H1414 VanDerWaalsContact O-N 3.1Å; H1414-H1416 VanDerWaalsContact CB-CD2 3.48Å; H1414-H1416 WeakPolarHBondContact CB-CD2 3.34Å; H1414-H1416 PolarHBondContact O-N 2.73Å
1415	G	87.6	Confident	90.2	Very high	58 Å²	58	47.1 Å²	47.1	60%	0.598	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	70	24.4	175.3	0	0	0	0	0	115.4	L1411 Y1413	L1411-G1415 PolarHBondContact O-N 3.48Å; Y1413-G1415 VanDerWaalsContact C-N 3.27Å; Y1413-G1415 PolarHBondContact O-N 3.23Å
1416	H	91.8	Very high	89.6	Confident	20 Å²	20	50.8 Å²	50.8	9%	0.093	27%	0.267	C	S	.	.			trans	-78.4	138.2	173.8	-62.8	-95.9	0	0	0	110.7	L1411 H1414 Y1418 F1444	L1411-H1416 HydrophobicContact CD2-CB 4.08Å; L1411-H1416 PolarHBondContact O-N 2.88Å; H1414-H1416 VanDerWaalsContact CB-CD2 3.48Å; H1414-H1416 WeakPolarHBondContact CB-CD2 3.34Å; H1414-H1416 PolarHBondContact O-N 2.73Å; H1416-Y1418 WeakPolarHBondContact O-CD1 2.99Å; H1416-Y1418 PolarHBondContact O-N 3.27Å; H1416-F1444 HydrophobicContact CB-CD1 4.25Å; H1416-F1444 AromaticContact CE1-CE1 3.7Å; H1416-F1444 AromaticContact ND1-CD1 3.19Å; H1416-F1444 WeakPolarHBondContact ND1-CD1 3.38Å; H1416-F1444 AromaticContact ND1-CE1 3.33Å; H1416-F1444 VanDerWaalsContact ND1-CE1 3.33Å; H1416-F1444 WeakPolarHBondContact ND1-CE1 3.19Å
1417	R	92.5	Very high	88.8	Confident	122 Å²	122	54 Å²	54	46%	0.46	29%	0.288	S	S	.	.			trans	-77.3	117	170.9	-71.8	-178	60	178.7	-7.5	109.9	Q1442 F1444 V1445	R1417-Q1442 WeakPolarHBondContact CD-O 3.34Å; R1417-Q1442 PolarHBondContact NE-O 3.26Å; R1417-F1444 PolarHBondContact O-N 3.34Å; R1417-F1444 VanDerWaalsContact O-N 3.11Å; R1417-V1445 PolarHBondContact O-N 3.49Å
1418	Y	93.9	Very high	88	Confident	63 Å²	63	61.6 Å²	61.6	25%	0.247	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	164.1	179.7	66.6	-85.4	0	0	0	112.9	E1408 L1411 H1416 V1445 I1447	E1408-Y1418 HydrophobicContact CB-CE2 4.43Å; E1408-Y1418 HydrophobicContact CG-CE2 4.02Å; E1408-Y1418 WeakPolarHBondContact CG-OH 3.4Å; E1408-Y1418 VanDerWaalsContact OE1-CE2 3.25Å; E1408-Y1418 WeakPolarHBondContact OE1-CE2 3.05Å; E1408-Y1418 PolarHBondContact OE1-OH 2.89Å; L1411-Y1418 HydrophobicContact CB-CD1 3.94Å; L1411-Y1418 HydrophobicContact CB-CG 4.5Å; L1411-Y1418 HydrophobicContact CD1-CG 4.42Å; H1416-Y1418 WeakPolarHBondContact O-CD1 2.99Å; H1416-Y1418 PolarHBondContact O-N 3.27Å; Y1418-V1445 CarbonylContact C-O 3.59Å; Y1418-V1445 WeakPolarHBondContact CA-O 3.25Å; Y1418-I1447 HydrophobicContact CD2-CD1 3.8Å; Y1418-I1447 HydrophobicContact CD2-CG1 4.41Å; Y1418-I1447 HydrophobicContact CE2-CD1 4.46Å; Y1418-I1447 HydrophobicContact CG-CD1 4.27Å
1419	L	92.9	Very high	87.6	Confident	23 Å²	23	64 Å²	64	12%	0.12	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	163.5	159.7	-70.9	177.2	0	0	0	109.7	L1433 F1437 I1443 V1445 F1446 I1447	L1419-L1433 HydrophobicContact CD1-CD2 4.47Å; L1419-L1433 HydrophobicContact CD2-CD2 4.14Å; L1419-F1437 HydrophobicContact CD1-CB 4.23Å; L1419-I1443 HydrophobicContact CD1-CD1 3.66Å; L1419-I1443 HydrophobicContact CD1-CG2 4.32Å; L1419-I1443 HydrophobicContact CD2-CD1 4.4Å; L1419-I1443 HydrophobicContact CG-CD1 3.91Å; L1419-I1443 HydrophobicContact CG-CG2 4.01Å; L1419-V1445 PolarHBondContact N-O 2.86Å; L1419-V1445 VanDerWaalsContact N-O 3.11Å; L1419-F1446 HydrophobicContact CB-CD2 3.58Å; L1419-F1446 HydrophobicContact CB-CE2 3.74Å; L1419-F1446 HydrophobicContact CB-CG 4.47Å; L1419-I1447 PolarHBondContact O-N 2.68Å
1420	R	92	Very high	87.2	Confident	63 Å²	63	60.4 Å²	60.4	24%	0.238	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	131.2	-178.6	177.1	179	174.9	144.1	4.1	110.4	D1405 E1408 D1422 I1447	D1405-R1420 IonicContact OD1-CZ 2.8Å; D1405-R1420 VanDerWaalsContact OD1-CZ 3.24Å; D1405-R1420 IonicContact OD1-NH1 2.71Å; D1405-R1420 PolarHBondContact OD1-NH1 2.67Å; D1405-R1420 IonicContact OD1-NH2 3.7Å; D1405-R1420 PolarHBondContact OD1-NH2 3.04Å; E1408-R1420 IonicContact OE2-CZ 3.32Å; E1408-R1420 IonicContact OE2-NH1 3.03Å; E1408-R1420 PolarHBondContact OE2-NH1 3.43Å; R1420-D1422 IonicContact CZ-OD2 3.52Å; R1420-D1422 IonicContact NE-OD2 3.12Å; R1420-D1422 PolarHBondContact NE-OD2 3.3Å; R1420-D1422 IonicContact NH2-OD2 3.04Å; R1420-D1422 PolarHBondContact NH2-OD2 3.23Å; R1420-D1422 VanDerWaalsContact NH2-OD2 3.17Å; R1420-I1447 WeakPolarHBondContact CA-O 3.32Å
1421	L	89	Confident	86.6	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	107.3	172.2	-168.8	165.4	0	0	0	110.6	R1430 M1434 F1446 I1447 L1448 S1449 I1457	L1421-R1430 HydrophobicContact CD1-CB 4.19Å; L1421-R1430 HydrophobicContact CD1-CG 4.19Å; L1421-R1430 HydrophobicContact CD2-CG 4.39Å; L1421-R1430 HydrophobicContact CG-CG 4.18Å; L1421-M1434 HydrophobicContact CD1-CG 4.3Å; L1421-F1446 HydrophobicContact CB-CE2 3.64Å; L1421-F1446 HydrophobicContact CB-CZ 3.73Å; L1421-F1446 HydrophobicContact CD1-CZ 3.81Å; L1421-F1446 HydrophobicContact CG-CZ 4.43Å; L1421-I1447 PolarHBondContact N-O 2.73Å; L1421-L1448 HydrophobicContact CB-CD2 3.99Å; L1421-L1448 HydrophobicContact CD1-CD2 4.32Å; L1421-L1448 HydrophobicContact CD2-CD2 4.3Å; L1421-L1448 HydrophobicContact CG-CD2 4.42Å; L1421-S1449 PolarHBondContact O-N 3.11Å; L1421-I1457 HydrophobicContact CD1-CD1 4.14Å; L1421-I1457 HydrophobicContact CD2-CD1 4.5Å
1422	D	87	Confident	86.3	Confident	11 Å²	11	69.2 Å²	69.2	6%	0.059	36%	0.363	C	S	.	.			trans	-127.6	-179.5	175.9	65.9	41	0	0	0	111.7	L1404 R1420 T1424 T1425	L1404-D1422 HydrophobicContact CD1-CB 3.77Å; R1420-D1422 IonicContact CZ-OD2 3.52Å; R1420-D1422 IonicContact NE-OD2 3.12Å; R1420-D1422 PolarHBondContact NE-OD2 3.3Å; R1420-D1422 IonicContact NH2-OD2 3.04Å; R1420-D1422 PolarHBondContact NH2-OD2 3.23Å; R1420-D1422 VanDerWaalsContact NH2-OD2 3.17Å; D1422-T1424 PolarHBondContact O-N 3.16Å; D1422-T1424 VanDerWaalsContact O-N 3.17Å; D1422-T1424 WeakPolarHBondContact OD1-CA 3.31Å; D1422-T1424 WeakPolarHBondContact OD1-CB 3.44Å; D1422-T1424 PolarHBondContact OD1-N 3.31Å; D1422-T1424 PolarHBondContact OD1-OG1 3.47Å; D1422-T1425 PolarHBondContact O-N 3.03Å; D1422-T1425 PolarHBondContact O-OG1 2.66Å
1423	G	81	Confident	86.1	Confident	46 Å²	46	69.2 Å²	69.2	47%	0.474	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-24	-178.3	0	0	0	0	0	114.7	T1425 R1430 S1452	G1423-T1425 VanDerWaalsContact C-N 3.34Å; G1423-R1430 PolarHBondContact O-NH2 2.84Å; G1423-S1452 PolarHBondContact N-OG 3.45Å
1424	T	84.4	Confident	86	Confident	126 Å²	126	64.8 Å²	64.8	77%	0.773	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-19	-178.2	75	0	0	0	0	113.1	D1422	D1422-T1424 PolarHBondContact O-N 3.16Å; D1422-T1424 VanDerWaalsContact O-N 3.17Å; D1422-T1424 WeakPolarHBondContact OD1-CA 3.31Å; D1422-T1424 WeakPolarHBondContact OD1-CB 3.44Å; D1422-T1424 PolarHBondContact OD1-N 3.31Å; D1422-T1424 PolarHBondContact OD1-OG1 3.47Å
1425	T	84	Confident	85.9	Confident	21 Å²	21	67 Å²	67	13%	0.129	35%	0.351	C	S	.	.	S	Bend	trans	-67.1	132.1	177	62.1	0	0	0	0	110.9	D1422 G1423 R1430 L1433	D1422-T1425 PolarHBondContact O-N 3.03Å; D1422-T1425 PolarHBondContact O-OG1 2.66Å; G1423-T1425 VanDerWaalsContact C-N 3.34Å; T1425-R1430 VanDerWaalsContact O-CZ 3.26Å; T1425-R1430 PolarHBondContact O-NE 3.13Å; T1425-R1430 PolarHBondContact O-NH2 2.98Å; T1425-R1430 WeakPolarHBondContact OG1-CG 3.05Å; T1425-R1430 PolarHBondContact OG1-NE 2.86Å; T1425-L1433 HydrophobicContact CG2-CD1 4.47Å
1426	K	80.1	Confident	86	Confident	141 Å²	141	69.8 Å²	69.8	61%	0.613	34%	0.344	S	S	*	.			trans	-67.5	146.7	178.5	-64.9	-175.6	176.6	-175.4	0	111.1	E1428 Q1429 R1430	K1426-E1428 VanDerWaalsContact C-N 3.26Å; K1426-E1428 PolarHBondContact O-N 2.94Å; K1426-Q1429 HydrophobicContact CB-CB 4.46Å; K1426-Q1429 HydrophobicContact CB-CG 4.24Å; K1426-Q1429 WeakPolarHBondContact O-CA 3.23Å; K1426-Q1429 WeakPolarHBondContact O-CB 3.27Å; K1426-Q1429 PolarHBondContact O-N 2.9Å; K1426-R1430 PolarHBondContact O-N 2.9Å
1427	V	75.8	Confident	85.9	Confident	87 Å²	87	68.8 Å²	68.8	53%	0.527	34%	0.339	S	S	.	.	H	α-helix	trans	-53.8	-41.6	-177.3	-177.6	0	0	0	0	112.4	Q1429 R1430	V1427-Q1429 PolarHBondContact O-N 2.73Å; V1427-R1430 PolarHBondContact O-N 2.88Å
1428	E	77.8	Confident	85.7	Confident	160 Å²	160	65.4 Å²	65.4	75%	0.748	33%	0.33	S	S	*	.	H	α-helix	trans	-61	-40.9	175.3	-63.2	166.7	174.5	0	0	112.5	K1426	K1426-E1428 VanDerWaalsContact C-N 3.26Å; K1426-E1428 PolarHBondContact O-N 2.94Å
1429	Q	83.9	Confident	85.5	Confident	105 Å²	105	69.3 Å²	69.3	49%	0.491	35%	0.351	S	S	.	.	H	α-helix	trans	-73.9	-31.6	-179.5	-66.1	175.1	-45	0	0	112.3	K1426 V1427 Q1431 V1432 L1433	K1426-Q1429 HydrophobicContact CB-CB 4.46Å; K1426-Q1429 HydrophobicContact CB-CG 4.24Å; K1426-Q1429 WeakPolarHBondContact O-CA 3.23Å; K1426-Q1429 WeakPolarHBondContact O-CB 3.27Å; K1426-Q1429 PolarHBondContact O-N 2.9Å; V1427-Q1429 PolarHBondContact O-N 2.73Å; Q1429-Q1431 VanDerWaalsContact C-N 3.33Å; Q1429-Q1431 PolarHBondContact O-N 3.35Å; Q1429-V1432 PolarHBondContact O-N 2.83Å; Q1429-L1433 WeakPolarHBondContact O-CG 3.37Å; Q1429-L1433 PolarHBondContact O-N 3.26Å
1430	R	82.7	Confident	85.2	Confident	37 Å²	37	70.7 Å²	70.7	14%	0.14	36%	0.358	C	S	.	.	H	α-helix	trans	-56.5	-47.6	176.9	-68.7	178.9	-162.6	-171.6	7.3	111.2	L1421 G1423 T1425 K1426 V1427 V1432 L1433 M1434	L1421-R1430 HydrophobicContact CD1-CB 4.19Å; L1421-R1430 HydrophobicContact CD1-CG 4.19Å; L1421-R1430 HydrophobicContact CD2-CG 4.39Å; L1421-R1430 HydrophobicContact CG-CG 4.18Å; G1423-R1430 PolarHBondContact O-NH2 2.84Å; T1425-R1430 VanDerWaalsContact O-CZ 3.26Å; T1425-R1430 PolarHBondContact O-NE 3.13Å; T1425-R1430 PolarHBondContact O-NH2 2.98Å; T1425-R1430 WeakPolarHBondContact OG1-CG 3.05Å; T1425-R1430 PolarHBondContact OG1-NE 2.86Å; K1426-R1430 PolarHBondContact O-N 2.9Å; V1427-R1430 PolarHBondContact O-N 2.88Å; R1430-V1432 PolarHBondContact O-N 2.83Å; R1430-L1433 PolarHBondContact O-N 2.93Å; R1430-M1434 HydrophobicContact CB-SD 4.48Å; R1430-M1434 WeakPolarHBondContact O-CG 3.38Å; R1430-M1434 PolarHBondContact O-N 3.28Å
1431	Q	80.1	Confident	84.9	Confident	92 Å²	92	71.9 Å²	71.9	43%	0.43	38%	0.376	S	S	.	.	H	α-helix	trans	-60	-44.9	178.4	-174.7	64.2	21.3	0	0	111.8	Q1429 L1433 M1434 E1435	Q1429-Q1431 VanDerWaalsContact C-N 3.33Å; Q1429-Q1431 PolarHBondContact O-N 3.35Å; Q1431-L1433 PolarHBondContact O-N 2.83Å; Q1431-M1434 PolarHBondContact O-N 3.43Å; Q1431-E1435 WeakPolarHBondContact CG-OE1 3.29Å; Q1431-E1435 PolarHBondContact NE2-OE1 2.69Å; Q1431-E1435 WeakPolarHBondContact O-CB 3Å; Q1431-E1435 WeakPolarHBondContact O-CG 3.49Å; Q1431-E1435 PolarHBondContact O-N 2.89Å
1432	V	86.8	Confident	84.8	Confident	94 Å²	94	78 Å²	78	57%	0.57	41%	0.405	S	S	*	.	H	α-helix	trans	-63.8	-39.6	178	179.6	0	0	0	0	111.7	Q1429 R1430 R1436	Q1429-V1432 PolarHBondContact O-N 2.83Å; R1430-V1432 PolarHBondContact O-N 2.83Å; V1432-R1436 WeakPolarHBondContact O-CB 3.32Å; V1432-R1436 PolarHBondContact O-N 3.35Å
1433	L	88.4	Confident	85	Confident	40 Å²	40	77.7 Å²	77.7	21%	0.209	40%	0.403	C	S	.	.	H	α-helix	trans	-65.9	-38.9	175.6	-70.1	168.7	0	0	0	112.2	L1419 T1425 Q1429 R1430 Q1431 F1437	L1419-L1433 HydrophobicContact CD1-CD2 4.47Å; L1419-L1433 HydrophobicContact CD2-CD2 4.14Å; T1425-L1433 HydrophobicContact CG2-CD1 4.47Å; Q1429-L1433 WeakPolarHBondContact O-CG 3.37Å; Q1429-L1433 PolarHBondContact O-N 3.26Å; R1430-L1433 PolarHBondContact O-N 2.93Å; Q1431-L1433 PolarHBondContact O-N 2.83Å; L1433-F1437 PolarHBondContact O-N 2.73Å
1434	M	84.8	Confident	85.6	Confident	10 Å²	10	76.7 Å²	76.7	5%	0.049	39%	0.386	C	S	.	.	H	α-helix	trans	-67.9	-47.1	176	-67.5	153.7	42.6	0	0	112.3	L1421 R1430 Q1431 R1436 F1437 N1438 I1457 L1459	L1421-M1434 HydrophobicContact CD1-CG 4.3Å; R1430-M1434 HydrophobicContact CB-SD 4.48Å; R1430-M1434 WeakPolarHBondContact O-CG 3.38Å; R1430-M1434 PolarHBondContact O-N 3.28Å; Q1431-M1434 PolarHBondContact O-N 3.43Å; M1434-R1436 VanDerWaalsContact C-N 3.29Å; M1434-R1436 PolarHBondContact O-N 2.85Å; M1434-F1437 PolarHBondContact O-N 2.71Å; M1434-N1438 PolarHBondContact O-N 3.23Å; M1434-N1438 PolarHBondContact O-ND2 3.17Å; M1434-I1457 HydrophobicContact CE-CB 4.17Å; M1434-I1457 HydrophobicContact CE-CG1 4.11Å; M1434-I1457 HydrophobicContact CE-CG2 3.82Å; M1434-I1457 HydrophobicContact CG-CG2 3.91Å; M1434-I1457 HydrophobicContact SD-CB 4.16Å; M1434-I1457 HydrophobicContact SD-CD1 4Å; M1434-I1457 HydrophobicContact SD-CG1 3.65Å; M1434-I1457 HydrophobicContact SD-CG2 3.7Å; M1434-L1459 HydrophobicContact CB-CD2 4.49Å; M1434-L1459 HydrophobicContact CG-CD2 4.13Å
1435	E	86.9	Confident	86.1	Confident	87 Å²	87	70.7 Å²	70.7	41%	0.407	35%	0.349	S	S	.	.	H	α-helix	trans	-60.3	-43.5	175.9	-76.1	175.5	-168	0	0	110.4	Q1431 N1438 Q1439	Q1431-E1435 WeakPolarHBondContact CG-OE1 3.29Å; Q1431-E1435 PolarHBondContact NE2-OE1 2.69Å; Q1431-E1435 WeakPolarHBondContact O-CB 3Å; Q1431-E1435 WeakPolarHBondContact O-CG 3.49Å; Q1431-E1435 PolarHBondContact O-N 2.89Å; E1435-N1438 PolarHBondContact O-N 3.23Å; E1435-Q1439 WeakPolarHBondContact O-CB 3.25Å; E1435-Q1439 WeakPolarHBondContact O-CG 3.48Å; E1435-Q1439 PolarHBondContact O-N 3.47Å
1436	R	89.9	Confident	86.6	Confident	117 Å²	117	69.7 Å²	69.7	44%	0.442	34%	0.343	S	S	.	.	H	α-helix	trans	-59.6	-46	173	-171.9	179.3	-173	172.4	8.9	112.7	V1432 M1434 N1438 Q1439 D1440 I1443	V1432-R1436 WeakPolarHBondContact O-CB 3.32Å; V1432-R1436 PolarHBondContact O-N 3.35Å; M1434-R1436 VanDerWaalsContact C-N 3.29Å; M1434-R1436 PolarHBondContact O-N 2.85Å; R1436-N1438 VanDerWaalsContact C-N 3.33Å; R1436-N1438 PolarHBondContact O-N 3.24Å; R1436-Q1439 PolarHBondContact O-N 2.83Å; R1436-D1440 HydrophobicContact CG-CB 4.45Å; R1436-D1440 VanDerWaalsContact CG-OD2 3.25Å; R1436-D1440 WeakPolarHBondContact CG-OD2 3.28Å; R1436-D1440 IonicContact CZ-OD2 2.94Å; R1436-D1440 IonicContact NE-OD2 3.28Å; R1436-D1440 PolarHBondContact NE-OD2 2.93Å; R1436-D1440 IonicContact NH2-OD2 2.76Å; R1436-D1440 VanDerWaalsContact O-CB 3.3Å; R1436-D1440 WeakPolarHBondContact O-CB 3.18Å; R1436-D1440 PolarHBondContact O-N 2.76Å; R1436-I1443 HydrophobicContact CG-CD1 4.17Å
1437	F	91	Very high	87.2	Confident	0 Å²	0	63 Å²	63	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-63.4	-38	177.6	178.4	-106.7	0	0	0	112.8	R1393 L1395 L1419 L1433 M1434 I1443 F1446 L1459 A1462	R1393-F1437 HydrophobicContact CB-CZ 4.24Å; R1393-F1437 PolarHBondContact NH1-O 2.75Å; L1395-F1437 HydrophobicContact CD2-CE1 3.84Å; L1395-F1437 HydrophobicContact CD2-CZ 3.92Å; L1419-F1437 HydrophobicContact CD1-CB 4.23Å; L1433-F1437 PolarHBondContact O-N 2.73Å; M1434-F1437 PolarHBondContact O-N 2.71Å; F1437-I1443 HydrophobicContact CD2-CB 4.31Å; F1437-I1443 HydrophobicContact CD2-CG2 3.94Å; F1437-I1443 HydrophobicContact CE2-CG2 4.34Å; F1437-F1446 HydrophobicContact CB-CD1 4.16Å; F1437-F1446 HydrophobicContact CB-CE1 4.27Å; F1437-F1446 AromaticContact CD1-CD1 3.87Å; F1437-F1446 HydrophobicContact CD1-CD1 3.87Å; F1437-F1446 HydrophobicContact CD2-CB 3.93Å; F1437-F1446 HydrophobicContact CD2-CD1 4.23Å; F1437-F1446 HydrophobicContact CD2-CG 4.29Å; F1437-F1446 HydrophobicContact CE1-CD1 4.34Å; F1437-F1446 HydrophobicContact CE2-CB 3.81Å; F1437-F1446 HydrophobicContact CG-CB 4.35Å; F1437-F1446 AromaticContact CG-CD1 3.8Å; F1437-F1446 HydrophobicContact CG-CD1 3.8Å; F1437-F1446 HydrophobicContact CG-CE1 4.39Å; F1437-F1446 HydrophobicContact CG-CG 4.3Å; F1437-F1446 HydrophobicContact CZ-CB 4.12Å; F1437-L1459 HydrophobicContact CD1-CD2 4.45Å; F1437-A1462 HydrophobicContact CE1-CB 3.89Å; F1437-A1462 HydrophobicContact CZ-CB 3.97Å
1438	N	87.8	Confident	88	Confident	50 Å²	50	58.9 Å²	58.9	27%	0.267	29%	0.288	S	S	.	.	H	α-helix	trans	-70.7	-34.2	177	-70.1	-43.6	0	0	0	112	M1434 E1435 R1436 N1458 G1461	M1434-N1438 PolarHBondContact O-N 3.23Å; M1434-N1438 PolarHBondContact O-ND2 3.17Å; E1435-N1438 PolarHBondContact O-N 3.23Å; R1436-N1438 VanDerWaalsContact C-N 3.33Å; R1436-N1438 PolarHBondContact O-N 3.24Å; N1438-N1458 PolarHBondContact ND2-O 3.43Å; N1438-N1458 VanDerWaalsContact ND2-O 3.08Å; N1438-G1461 PolarHBondContact OD1-N 3.42Å
1439	Q	88.6	Confident	88.6	Confident	146 Å²	146	52 Å²	52	68%	0.682	26%	0.258	S	S	*	.	H	α-helix	trans	-82.8	-50.8	179.4	-68.8	167.4	21.2	0	0	114	E1435 R1436 S1441	E1435-Q1439 WeakPolarHBondContact O-CB 3.25Å; E1435-Q1439 WeakPolarHBondContact O-CG 3.48Å; E1435-Q1439 PolarHBondContact O-N 3.47Å; R1436-Q1439 PolarHBondContact O-N 2.83Å; Q1439-S1441 PolarHBondContact O-N 3.3Å; Q1439-S1441 VanDerWaalsContact O-N 3.13Å
1440	D	88.4	Confident	88.6	Confident	52 Å²	52	47 Å²	47	28%	0.278	24%	0.235	S	C	.	.			trans	-75.4	96.9	-179	-78	-19.3	0	0	0	110.1	R1436 Q1442 I1443	R1436-D1440 HydrophobicContact CG-CB 4.45Å; R1436-D1440 VanDerWaalsContact CG-OD2 3.25Å; R1436-D1440 WeakPolarHBondContact CG-OD2 3.28Å; R1436-D1440 IonicContact CZ-OD2 2.94Å; R1436-D1440 IonicContact NE-OD2 3.28Å; R1436-D1440 PolarHBondContact NE-OD2 2.93Å; R1436-D1440 IonicContact NH2-OD2 2.76Å; R1436-D1440 VanDerWaalsContact O-CB 3.3Å; R1436-D1440 WeakPolarHBondContact O-CB 3.18Å; R1436-D1440 PolarHBondContact O-N 2.76Å; D1440-Q1442 PolarHBondContact O-N 3.02Å; D1440-Q1442 VanDerWaalsContact O-N 3.1Å; D1440-I1443 HydrophobicContact CB-CD1 3.68Å; D1440-I1443 HydrophobicContact CB-CG1 3.82Å; D1440-I1443 PolarHBondContact O-N 3.33Å
1441	S	84.8	Confident	88.5	Confident	87 Å²	87	53.4 Å²	53.4	61%	0.608	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-16	169.6	60.1	0	0	0	0	113.8	Q1439 I1443	Q1439-S1441 PolarHBondContact O-N 3.3Å; Q1439-S1441 VanDerWaalsContact O-N 3.13Å; S1441-I1443 VanDerWaalsContact C-N 3.27Å; S1441-I1443 PolarHBondContact O-N 2.8Å
1442	Q	86.6	Confident	88.3	Confident	130 Å²	130	49.6 Å²	49.6	61%	0.607	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.6	2.7	-178.5	-64.8	-76.1	-64.8	0	0	114.3	R1417 D1440	R1417-Q1442 WeakPolarHBondContact CD-O 3.34Å; R1417-Q1442 PolarHBondContact NE-O 3.26Å; D1440-Q1442 PolarHBondContact O-N 3.02Å; D1440-Q1442 VanDerWaalsContact O-N 3.1Å
1443	I	91.9	Very high	87.4	Confident	4 Å²	4	45.1 Å²	45.1	2%	0.021	22%	0.216	C	C	.	.			trans	-107.1	109.7	178.2	-58.3	179.2	0	0	0	107.7	R1393 L1419 R1436 F1437 D1440 S1441	R1393-I1443 WeakPolarHBondContact CD-O 3.45Å; L1419-I1443 HydrophobicContact CD1-CD1 3.66Å; L1419-I1443 HydrophobicContact CD1-CG2 4.32Å; L1419-I1443 HydrophobicContact CD2-CD1 4.4Å; L1419-I1443 HydrophobicContact CG-CD1 3.91Å; L1419-I1443 HydrophobicContact CG-CG2 4.01Å; R1436-I1443 HydrophobicContact CG-CD1 4.17Å; F1437-I1443 HydrophobicContact CD2-CB 4.31Å; F1437-I1443 HydrophobicContact CD2-CG2 3.94Å; F1437-I1443 HydrophobicContact CE2-CG2 4.34Å; D1440-I1443 HydrophobicContact CB-CD1 3.68Å; D1440-I1443 HydrophobicContact CB-CG1 3.82Å; D1440-I1443 PolarHBondContact O-N 3.33Å; S1441-I1443 VanDerWaalsContact C-N 3.27Å; S1441-I1443 PolarHBondContact O-N 2.8Å
1444	F	93.1	Very high	86.1	Confident	25 Å²	25	43.6 Å²	43.6	11%	0.11	21%	0.21	C	C	.	.			trans	-82.3	-39.9	-171.7	174.8	-120.5	0	0	0	112.3	L1384 L1387 K1388 H1392 V1394 H1416 R1417	L1384-F1444 HydrophobicContact CB-CE1 4.42Å; L1384-F1444 HydrophobicContact CD2-CE1 3.94Å; L1384-F1444 HydrophobicContact CD2-CZ 4.22Å; L1387-F1444 HydrophobicContact CB-CE2 4.36Å; L1387-F1444 HydrophobicContact CB-CZ 4.05Å; K1388-F1444 HydrophobicContact CB-CE1 4.15Å; K1388-F1444 HydrophobicContact CB-CE2 3.99Å; K1388-F1444 HydrophobicContact CB-CZ 3.69Å; H1392-F1444 VanDerWaalsContact O-CD2 3.25Å; H1392-F1444 WeakPolarHBondContact O-CD2 3.2Å; H1392-F1444 VanDerWaalsContact O-CE2 3.3Å; H1392-F1444 WeakPolarHBondContact O-CE2 3.42Å; V1394-F1444 HydrophobicContact CG2-CD2 4.49Å; V1394-F1444 HydrophobicContact CG2-CE2 3.85Å; V1394-F1444 HydrophobicContact CG2-CZ 3.85Å; V1394-F1444 PolarHBondContact N-O 2.84Å; H1416-F1444 HydrophobicContact CB-CD1 4.25Å; H1416-F1444 AromaticContact CE1-CE1 3.7Å; H1416-F1444 AromaticContact ND1-CD1 3.19Å; H1416-F1444 WeakPolarHBondContact ND1-CD1 3.38Å; H1416-F1444 AromaticContact ND1-CE1 3.33Å; H1416-F1444 VanDerWaalsContact ND1-CE1 3.33Å; H1416-F1444 WeakPolarHBondContact ND1-CE1 3.19Å; R1417-F1444 PolarHBondContact O-N 3.34Å; R1417-F1444 VanDerWaalsContact O-N 3.11Å
1445	V	94.8	Very high	85.2	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	141.1	-177.1	-170.7	0	0	0	0	111.4	L1384 V1394 I1396 L1411 R1417 Y1418 L1419 I1447	L1384-V1445 HydrophobicContact CD2-CG2 4.5Å; V1394-V1445 CarbonylContact O-C 3.45Å; V1394-V1445 WeakPolarHBondContact O-CA 3.33Å; I1396-V1445 HydrophobicContact CD1-CG1 3.64Å; I1396-V1445 HydrophobicContact CG1-CG1 3.86Å; L1411-V1445 HydrophobicContact CD1-CB 4.35Å; L1411-V1445 HydrophobicContact CD1-CG1 3.96Å; L1411-V1445 HydrophobicContact CD2-CG2 4.06Å; R1417-V1445 PolarHBondContact O-N 3.49Å; Y1418-V1445 CarbonylContact C-O 3.59Å; Y1418-V1445 WeakPolarHBondContact CA-O 3.25Å; L1419-V1445 PolarHBondContact N-O 2.86Å; L1419-V1445 VanDerWaalsContact N-O 3.11Å; V1445-I1447 HydrophobicContact CG1-CG1 4.27Å
1446	F	94	Very high	84	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	114.2	164	-166	-170.1	0	0	0	109.5	V1394 L1395 I1396 L1419 L1421 F1437 L1448 L1459	V1394-F1446 PolarHBondContact O-N 2.76Å; L1395-F1446 WeakPolarHBondContact CA-O 3.38Å; L1395-F1446 HydrophobicContact CD2-CB 3.83Å; L1395-F1446 HydrophobicContact CD2-CD1 4.2Å; L1395-F1446 HydrophobicContact CD2-CG 4.48Å; I1396-F1446 PolarHBondContact N-O 3.35Å; L1419-F1446 HydrophobicContact CB-CD2 3.58Å; L1419-F1446 HydrophobicContact CB-CE2 3.74Å; L1419-F1446 HydrophobicContact CB-CG 4.47Å; L1421-F1446 HydrophobicContact CB-CE2 3.64Å; L1421-F1446 HydrophobicContact CB-CZ 3.73Å; L1421-F1446 HydrophobicContact CD1-CZ 3.81Å; L1421-F1446 HydrophobicContact CG-CZ 4.43Å; F1437-F1446 HydrophobicContact CB-CD1 4.16Å; F1437-F1446 HydrophobicContact CB-CE1 4.27Å; F1437-F1446 AromaticContact CD1-CD1 3.87Å; F1437-F1446 HydrophobicContact CD1-CD1 3.87Å; F1437-F1446 HydrophobicContact CD2-CB 3.93Å; F1437-F1446 HydrophobicContact CD2-CD1 4.23Å; F1437-F1446 HydrophobicContact CD2-CG 4.29Å; F1437-F1446 HydrophobicContact CE1-CD1 4.34Å; F1437-F1446 HydrophobicContact CE2-CB 3.81Å; F1437-F1446 HydrophobicContact CG-CB 4.35Å; F1437-F1446 AromaticContact CG-CD1 3.8Å; F1437-F1446 HydrophobicContact CG-CD1 3.8Å; F1437-F1446 HydrophobicContact CG-CE1 4.39Å; F1437-F1446 HydrophobicContact CG-CG 4.3Å; F1437-F1446 HydrophobicContact CZ-CB 4.12Å; F1446-L1448 HydrophobicContact CB-CD1 4.37Å; F1446-L1448 HydrophobicContact CD1-CD1 4.01Å; F1446-L1448 HydrophobicContact CD1-CG 4.46Å; F1446-L1448 HydrophobicContact CD2-CG 4.49Å; F1446-L1448 HydrophobicContact CE1-CD2 4.34Å; F1446-L1448 HydrophobicContact CG-CD1 4.08Å; F1446-L1448 HydrophobicContact CG-CG 4.39Å; F1446-L1448 HydrophobicContact CZ-CD2 4.44Å; F1446-L1459 HydrophobicContact CD1-CD1 4.27Å; F1446-L1459 HydrophobicContact CD1-CD2 4.05Å; F1446-L1459 HydrophobicContact CE1-CD1 4.39Å; F1446-L1459 HydrophobicContact CE1-CD2 3.7Å
1447	I	93.5	Very high	83.1	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	125	-179.2	-29.3	170.8	0	0	0	109	I1396 L1404 L1407 L1411 Y1418 L1419 R1420 L1421 V1445	I1396-I1447 HydrophobicContact CB-CG2 4.36Å; L1404-I1447 HydrophobicContact CD2-CB 4.33Å; L1404-I1447 HydrophobicContact CD2-CG2 3.43Å; L1404-I1447 VanDerWaalsContact CD2-CG2 3.43Å; L1407-I1447 HydrophobicContact CB-CD1 4.4Å; L1407-I1447 HydrophobicContact CD1-CG2 4.04Å; L1411-I1447 HydrophobicContact CD1-CD1 3.65Å; L1411-I1447 HydrophobicContact CD1-CG1 3.93Å; Y1418-I1447 HydrophobicContact CD2-CD1 3.8Å; Y1418-I1447 HydrophobicContact CD2-CG1 4.41Å; Y1418-I1447 HydrophobicContact CE2-CD1 4.46Å; Y1418-I1447 HydrophobicContact CG-CD1 4.27Å; L1419-I1447 PolarHBondContact O-N 2.68Å; R1420-I1447 WeakPolarHBondContact CA-O 3.32Å; L1421-I1447 PolarHBondContact N-O 2.73Å; V1445-I1447 HydrophobicContact CG1-CG1 4.27Å
1448	L	92.2	Very high	82.6	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	142.7	-172.4	-71.7	133.8	0	0	0	110.6	L1395 I1396 F1397 T1398 L1421 F1446 L1459	L1395-L1448 HydrophobicContact CB-CD1 4.14Å; L1395-L1448 HydrophobicContact CD1-CD1 4.39Å; L1395-L1448 HydrophobicContact CD2-CD1 3.94Å; L1395-L1448 HydrophobicContact CG-CD1 4.38Å; I1396-L1448 PolarHBondContact O-N 3.1Å; F1397-L1448 WeakPolarHBondContact CA-O 3.15Å; F1397-L1448 HydrophobicContact CD1-CB 3.57Å; F1397-L1448 HydrophobicContact CD1-CD1 4.49Å; F1397-L1448 HydrophobicContact CE1-CB 3.54Å; F1397-L1448 HydrophobicContact CE1-CD1 3.85Å; F1397-L1448 HydrophobicContact CE1-CD2 4.45Å; F1397-L1448 HydrophobicContact CE1-CG 4.15Å; F1397-L1448 HydrophobicContact CZ-CD1 4.09Å; T1398-L1448 PolarHBondContact N-O 3.16Å; L1421-L1448 HydrophobicContact CB-CD2 3.99Å; L1421-L1448 HydrophobicContact CD1-CD2 4.32Å; L1421-L1448 HydrophobicContact CD2-CD2 4.3Å; L1421-L1448 HydrophobicContact CG-CD2 4.42Å; F1446-L1448 HydrophobicContact CB-CD1 4.37Å; F1446-L1448 HydrophobicContact CD1-CD1 4.01Å; F1446-L1448 HydrophobicContact CD1-CG 4.46Å; F1446-L1448 HydrophobicContact CD2-CG 4.49Å; F1446-L1448 HydrophobicContact CE1-CD2 4.34Å; F1446-L1448 HydrophobicContact CG-CD1 4.08Å; F1446-L1448 HydrophobicContact CG-CG 4.39Å; F1446-L1448 HydrophobicContact CZ-CD2 4.44Å; L1448-L1459 HydrophobicContact CD1-CD1 3.75Å; L1448-L1459 HydrophobicContact CD2-CD1 4.21Å
1449	S	89.9	Confident	82.4	Confident	16 Å²	16	39.5 Å²	39.5	11%	0.112	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	133.8	159.9	169.9	0	0	0	0	109.7	T1398 L1421 R1451 S1452 G1453	T1398-S1449 CarbonylContact O-C 3.31Å; T1398-S1449 VanDerWaalsContact O-CA 3.28Å; T1398-S1449 WeakPolarHBondContact O-CA 3.5Å; L1421-S1449 PolarHBondContact O-N 3.11Å; S1449-R1451 VanDerWaalsContact C-N 3.3Å; S1449-R1451 PolarHBondContact O-N 2.9Å; S1449-S1452 CarbonylContact O-C 3.58Å; S1449-S1452 WeakPolarHBondContact O-CA 3.13Å; S1449-S1452 WeakPolarHBondContact O-CB 3.39Å; S1449-S1452 PolarHBondContact O-N 3.4Å; S1449-G1453 PolarHBondContact O-N 2.85Å
1450	T	84.9	Confident	82.3	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.006	19%	0.189	C	C	.	.	H	α-helix	trans	-54.4	-44.6	-176.1	-44	0	0	0	0	112.2	T1398 Q1399 S1452 G1453 G1454 A1480	T1398-T1450 PolarHBondContact O-N 2.65Å; T1398-T1450 PolarHBondContact O-OG1 3.12Å; Q1399-T1450 VanDerWaalsContact NE2-CB 3.35Å; Q1399-T1450 PolarHBondContact NE2-OG1 2.72Å; Q1399-T1450 VanDerWaalsContact NE2-OG1 3.14Å; T1450-S1452 VanDerWaalsContact C-N 3.32Å; T1450-S1452 PolarHBondContact O-N 3.21Å; T1450-G1453 PolarHBondContact O-N 2.8Å; T1450-G1454 PolarHBondContact O-N 3.37Å; T1450-A1480 HydrophobicContact CG2-CB 4.24Å
1451	R	81	Confident	82.2	Confident	171 Å²	171	33 Å²	33	65%	0.645	18%	0.182	S	C	*	.	H	α-helix	trans	-63.5	-34.5	175.2	-64.5	-173.6	179.8	-159.9	-1.4	113.1	S1449	S1449-R1451 VanDerWaalsContact C-N 3.3Å; S1449-R1451 PolarHBondContact O-N 2.9Å
1452	S	74.6	Confident	82.5	Confident	11 Å²	11	28.8 Å²	28.8	8%	0.077	15%	0.153	C	C	.	.	H	α-helix	trans	-77.3	-38.1	179.7	-62.3	0	0	0	0	112.4	G1423 S1449 T1450 L1455	G1423-S1452 PolarHBondContact N-OG 3.45Å; S1449-S1452 CarbonylContact O-C 3.58Å; S1449-S1452 WeakPolarHBondContact O-CA 3.13Å; S1449-S1452 WeakPolarHBondContact O-CB 3.39Å; S1449-S1452 PolarHBondContact O-N 3.4Å; T1450-S1452 VanDerWaalsContact C-N 3.32Å; T1450-S1452 PolarHBondContact O-N 3.21Å; S1452-L1455 WeakPolarHBondContact O-CB 3.41Å; S1452-L1455 PolarHBondContact O-N 2.73Å
1453	G	67.3	Low	82.8	Confident	1 Å²	1	22.8 Å²	22.8	1%	0.01	13%	0.125	C	C	.	.	H	α-helix	trans	-73.8	-25	174.2	0	0	0	0	0	114.3	S1449 T1450 L1455 R1483	S1449-G1453 PolarHBondContact O-N 2.85Å; T1450-G1453 PolarHBondContact O-N 2.8Å; G1453-L1455 PolarHBondContact O-N 3.24Å; G1453-L1455 VanDerWaalsContact O-O 3.11Å; G1453-R1483 PolarHBondContact O-NH1 3.16Å
1454	G	62.4	Low	82.9	Confident	8 Å²	8	22.7 Å²	22.7	8%	0.082	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-20.1	172.2	0	0	0	0	0	114.3	T1450 R1483	T1450-G1454 PolarHBondContact O-N 3.37Å; G1454-R1483 VanDerWaalsContact C-NH1 3.32Å; G1454-R1483 PolarHBondContact O-NH1 2.89Å; G1454-R1483 PolarHBondContact O-NH2 2.68Å
1455	L	65.5	Low	82.9	Confident	62 Å²	62	21.5 Å²	21.5	33%	0.325	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	151.6	169.4	-58.2	174.2	0	0	0	110.5	S1452 G1453 I1457 R1483	S1452-L1455 WeakPolarHBondContact O-CB 3.41Å; S1452-L1455 PolarHBondContact O-N 2.73Å; G1453-L1455 PolarHBondContact O-N 3.24Å; G1453-L1455 VanDerWaalsContact O-O 3.11Å; L1455-I1457 VanDerWaalsContact C-N 3.28Å; L1455-I1457 WeakPolarHBondContact O-CB 3.42Å; L1455-I1457 VanDerWaalsContact O-CG1 3.31Å; L1455-I1457 WeakPolarHBondContact O-CG1 2.99Å; L1455-I1457 PolarHBondContact O-N 3.03Å; L1455-R1483 VanDerWaalsContact C-NH1 3.3Å; L1455-R1483 PolarHBondContact O-NH1 2.87Å
1456	G	61	Low	83	Confident	35 Å²	35	21.5 Å²	21.5	36%	0.361	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	64.6	-160.1	0	0	0	0	0	118.6
1457	I	72.7	Confident	83	Confident	11 Å²	11	21.5 Å²	21.5	6%	0.056	12%	0.119	C	C	.	.			trans	-103.2	153	-170.2	-70.7	175	0	0	0	110.7	L1421 M1434 L1455 L1459 R1483 R1486	L1421-I1457 HydrophobicContact CD1-CD1 4.14Å; L1421-I1457 HydrophobicContact CD2-CD1 4.5Å; M1434-I1457 HydrophobicContact CE-CB 4.17Å; M1434-I1457 HydrophobicContact CE-CG1 4.11Å; M1434-I1457 HydrophobicContact CE-CG2 3.82Å; M1434-I1457 HydrophobicContact CG-CG2 3.91Å; M1434-I1457 HydrophobicContact SD-CB 4.16Å; M1434-I1457 HydrophobicContact SD-CD1 4Å; M1434-I1457 HydrophobicContact SD-CG1 3.65Å; M1434-I1457 HydrophobicContact SD-CG2 3.7Å; L1455-I1457 VanDerWaalsContact C-N 3.28Å; L1455-I1457 WeakPolarHBondContact O-CB 3.42Å; L1455-I1457 VanDerWaalsContact O-CG1 3.31Å; L1455-I1457 WeakPolarHBondContact O-CG1 2.99Å; L1455-I1457 PolarHBondContact O-N 3.03Å; I1457-L1459 HydrophobicContact CG2-CD1 4.22Å; I1457-L1459 HydrophobicContact CG2-CD2 3.63Å; I1457-L1459 HydrophobicContact CG2-CG 3.67Å; I1457-R1483 WeakPolarHBondContact O-CD 3.2Å; I1457-R1486 PolarHBondContact O-NH1 3.24Å
1458	N	79.9	Confident	83	Confident	68 Å²	68	21.5 Å²	21.5	36%	0.364	12%	0.119	S	C	.	.			trans	-118.7	112	175.6	-58.4	-14.3	0	0	0	110	N1438 R1486	N1438-N1458 PolarHBondContact ND2-O 3.43Å; N1438-N1458 VanDerWaalsContact ND2-O 3.08Å; N1458-R1486 PolarHBondContact OD1-NH1 2.75Å; N1458-R1486 PolarHBondContact OD1-NH2 3.34Å
1459	L	83.9	Confident	83	Confident	1 Å²	1	21.5 Å²	21.5	1%	0.005	12%	0.119	C	C	.	.			trans	-118.2	47.2	-179.1	-56.9	-179.7	0	0	0	111.7	L1395 M1434 F1437 F1446 L1448 I1457 G1461 A1462 R1483	L1395-L1459 HydrophobicContact CD1-CB 4.07Å; L1395-L1459 HydrophobicContact CD1-CD1 3.62Å; L1395-L1459 HydrophobicContact CD1-CG 4.49Å; L1395-L1459 HydrophobicContact CD2-CD1 3.97Å; L1395-L1459 HydrophobicContact CG-CD1 4.46Å; M1434-L1459 HydrophobicContact CB-CD2 4.49Å; M1434-L1459 HydrophobicContact CG-CD2 4.13Å; F1437-L1459 HydrophobicContact CD1-CD2 4.45Å; F1446-L1459 HydrophobicContact CD1-CD1 4.27Å; F1446-L1459 HydrophobicContact CD1-CD2 4.05Å; F1446-L1459 HydrophobicContact CE1-CD1 4.39Å; F1446-L1459 HydrophobicContact CE1-CD2 3.7Å; L1448-L1459 HydrophobicContact CD1-CD1 3.75Å; L1448-L1459 HydrophobicContact CD2-CD1 4.21Å; I1457-L1459 HydrophobicContact CG2-CD1 4.22Å; I1457-L1459 HydrophobicContact CG2-CD2 3.63Å; I1457-L1459 HydrophobicContact CG2-CG 3.67Å; L1459-G1461 PolarHBondContact O-N 2.85Å; L1459-G1461 VanDerWaalsContact O-N 3.07Å; L1459-A1462 PolarHBondContact O-N 3.38Å; L1459-R1483 CarbonylContact C-O 3.59Å; L1459-R1483 WeakPolarHBondContact CA-O 3Å; L1459-R1483 PolarHBondContact N-O 3.43Å
1460	T	85.2	Confident	82.9	Confident	49 Å²	49	21.3 Å²	21.3	30%	0.301	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-6.2	-179.5	52.6	0	0	0	0	114
1461	G	86.1	Confident	83	Confident	12 Å²	12	22.4 Å²	22.4	12%	0.124	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-30.5	173.2	0	0	0	0	0	114.5	R1393 N1438 L1459	R1393-G1461 PolarHBondContact NE-O 3.39Å; R1393-G1461 PolarHBondContact NH2-O 3.5Å; N1438-G1461 PolarHBondContact OD1-N 3.42Å; L1459-G1461 PolarHBondContact O-N 2.85Å; L1459-G1461 VanDerWaalsContact O-N 3.07Å
1462	A	91.5	Very high	83	Confident	0 Å²	0	18 Å²	18	0%	0	11%	0.107	C	C	.	.			trans	-78.7	153.4	175.9	0	0	0	0	0	111.1	R1393 L1395 F1437 L1459 C1484 Q1489	R1393-A1462 WeakPolarHBondContact O-CA 3.37Å; R1393-A1462 WeakPolarHBondContact O-CB 3.32Å; L1395-A1462 HydrophobicContact CD1-CB 4.04Å; L1395-A1462 HydrophobicContact CD2-CB 3.59Å; L1395-A1462 HydrophobicContact CG-CB 3.5Å; L1395-A1462 VanDerWaalsContact CG-CB 3.5Å; F1437-A1462 HydrophobicContact CE1-CB 3.89Å; F1437-A1462 HydrophobicContact CZ-CB 3.97Å; L1459-A1462 PolarHBondContact O-N 3.38Å; A1462-C1484 PolarHBondContact O-SG 2.72Å; A1462-Q1489 PolarHBondContact O-NE2 2.95Å
1463	D	92.4	Very high	83.3	Confident	4 Å²	4	18.3 Å²	18.3	2%	0.021	11%	0.108	C	C	.	.			trans	-121.8	-19.8	169	54.3	7.4	0	0	0	112	H1392 R1393 R1491 V1493 H1494	H1392-D1463 WeakPolarHBondContact CA-OD1 3.27Å; H1392-D1463 VanDerWaalsContact CB-OD1 3.32Å; H1392-D1463 WeakPolarHBondContact CB-OD1 3.17Å; H1392-D1463 IonicContact CE1-OD2 2.66Å; H1392-D1463 IonicContact CG-OD1 3.28Å; H1392-D1463 IonicContact CG-OD2 2.77Å; H1392-D1463 IonicContact ND1-OD1 3.77Å; H1392-D1463 IonicContact ND1-OD2 3.65Å; H1392-D1463 PolarHBondContact ND1-OD2 3.08Å; R1393-D1463 PolarHBondContact N-OD1 3.35Å; R1393-D1463 PolarHBondContact O-N 3.35Å; R1393-D1463 VanDerWaalsContact O-N 3.1Å; R1393-D1463 VanDerWaalsContact O-OD1 3.12Å; D1463-R1491 HydrophobicContact CB-CB 3.98Å; D1463-R1491 WeakPolarHBondContact OD2-CD 3.07Å; D1463-R1491 IonicContact OD2-CZ 3.11Å; D1463-R1491 IonicContact OD2-NE 3.77Å; D1463-R1491 IonicContact OD2-NH1 2.77Å; D1463-R1491 PolarHBondContact OD2-NH1 3.27Å; D1463-V1493 WeakPolarHBondContact O-CA 3.27Å; D1463-H1494 PolarHBondContact O-N 2.96Å
1464	T	94.4	Very high	84.1	Confident	1 Å²	1	19.1 Å²	19.1	1%	0.006	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	139.6	178.7	-52.7	0	0	0	0	111.8	L1387 R1393 V1394 L1395 I1466 H1494 Y1496	L1387-T1464 HydrophobicContact CD1-CG2 3.71Å; L1387-T1464 HydrophobicContact CD2-CG2 3.92Å; L1387-T1464 HydrophobicContact CG-CG2 4.49Å; R1393-T1464 PolarHBondContact O-N 3.19Å; R1393-T1464 VanDerWaalsContact O-N 3.09Å; V1394-T1464 WeakPolarHBondContact CA-O 3.15Å; V1394-T1464 HydrophobicContact CG1-CG2 4.42Å; L1395-T1464 PolarHBondContact N-O 3.42Å; T1464-I1466 HydrophobicContact CG2-CG1 4.48Å; T1464-H1494 CarbonylContact C-O 3.56Å; T1464-H1494 WeakPolarHBondContact CA-O 3.46Å; T1464-Y1496 HydrophobicContact CG2-CD2 3.66Å; T1464-Y1496 HydrophobicContact CG2-CE2 3.61Å
1465	V	94.6	Very high	85	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	132.2	177.1	179.5	0	0	0	0	108.9	L1395 F1397 F1467 C1484 V1493 H1494 I1495 Y1496	L1395-V1465 HydrophobicContact CD1-CG2 4.35Å; L1395-V1465 CarbonylContact O-C 3.57Å; F1397-V1465 HydrophobicContact CD2-CG1 3.65Å; F1397-V1465 HydrophobicContact CE2-CG1 3.67Å; V1465-F1467 HydrophobicContact CG1-CD2 4.33Å; V1465-F1467 HydrophobicContact CG1-CE2 3.9Å; V1465-F1467 HydrophobicContact CG1-CZ 4.17Å; V1465-C1484 HydrophobicContact CG2-CB 3.83Å; V1465-V1493 HydrophobicContact CG2-CG1 4.42Å; V1465-H1494 PolarHBondContact N-O 2.72Å; V1465-I1495 HydrophobicContact CB-CG1 4.28Å; V1465-I1495 CarbonylContact O-C 3.42Å; V1465-I1495 WeakPolarHBondContact O-CA 3.3Å; V1465-Y1496 PolarHBondContact O-N 2.95Å
1466	I	95.5	Very high	85.9	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	121.2	175.3	-53.6	-179.7	0	0	0	108.9	L1380 L1383 L1384 L1387 V1394 L1395 I1396 F1397 T1464 Y1496 L1498	L1380-I1466 HydrophobicContact CD1-CD1 3.75Å; L1380-I1466 HydrophobicContact CD1-CG2 4.22Å; L1383-I1466 HydrophobicContact CD2-CD1 3.88Å; L1383-I1466 HydrophobicContact CD2-CG1 4.45Å; L1384-I1466 HydrophobicContact CD2-CD1 4.27Å; L1387-I1466 HydrophobicContact CD1-CD1 4.25Å; V1394-I1466 HydrophobicContact CG1-CD1 3.5Å; V1394-I1466 VanDerWaalsContact CG1-CD1 3.5Å; V1394-I1466 HydrophobicContact CG1-CG1 3.77Å; L1395-I1466 PolarHBondContact O-N 2.9Å; I1396-I1466 WeakPolarHBondContact CA-O 3.21Å; I1396-I1466 HydrophobicContact CG1-CB 4.38Å; I1396-I1466 HydrophobicContact CG1-CD1 4.47Å; F1397-I1466 PolarHBondContact N-O 2.79Å; T1464-I1466 HydrophobicContact CG2-CG1 4.48Å; I1466-Y1496 CarbonylContact C-O 3.56Å; I1466-Y1496 WeakPolarHBondContact CA-O 3.23Å; I1466-Y1496 HydrophobicContact CG1-CD2 4.41Å; I1466-L1498 HydrophobicContact CG2-CD1 4.44Å; I1466-L1498 HydrophobicContact CG2-CG 4.33Å
1467	F	94.7	Very high	87.1	Confident	0 Å²	0	17 Å²	17	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	114.1	166.2	-67.8	-76.7	0	0	0	109	F1397 V1465 D1477 A1480 I1495 Y1496 L1498	F1397-F1467 HydrophobicContact CB-CD1 3.83Å; F1397-F1467 HydrophobicContact CB-CE1 4.03Å; F1397-F1467 HydrophobicContact CD2-CD1 4.3Å; F1397-F1467 AromaticContact CD2-CE1 3.85Å; F1397-F1467 HydrophobicContact CD2-CE1 3.85Å; F1397-F1467 HydrophobicContact CD2-CZ 4.22Å; F1397-F1467 HydrophobicContact CG-CD1 4.43Å; F1397-F1467 HydrophobicContact CG-CE1 4.15Å; V1465-F1467 HydrophobicContact CG1-CD2 4.33Å; V1465-F1467 HydrophobicContact CG1-CE2 3.9Å; V1465-F1467 HydrophobicContact CG1-CZ 4.17Å; F1467-D1477 HydrophobicContact CD1-CB 4.43Å; F1467-D1477 HydrophobicContact CE1-CB 3.83Å; F1467-D1477 HydrophobicContact CE2-CB 4.38Å; F1467-D1477 HydrophobicContact CZ-CB 3.8Å; F1467-D1477 WeakPolarHBondContact CZ-O 3.32Å; F1467-A1480 HydrophobicContact CE1-CB 4.15Å; F1467-A1480 HydrophobicContact CZ-CB 4.22Å; F1467-I1495 HydrophobicContact CD2-CG2 3.84Å; F1467-I1495 HydrophobicContact CE2-CG2 3.67Å; F1467-Y1496 PolarHBondContact N-O 2.81Å; F1467-L1498 PolarHBondContact O-N 3Å
1468	Y	94.3	Very high	87.7	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.103	C	C	.	.	S	Bend	trans	-81.8	-36.6	179	-167.2	-90.8	0	0	0	112.4	N931 K1376 L1377 L1380 F1397 M1403 L1498	N931-Y1468 HydrophobicContact CB-CE1 4Å; N931-Y1468 WeakPolarHBondContact O-CE1 3.15Å; N931-Y1468 PolarHBondContact O-OH 2.77Å; K1376-Y1468 HydrophobicContact CB-CE2 3.89Å; K1376-Y1468 WeakPolarHBondContact CB-OH 3.27Å; K1376-Y1468 HydrophobicContact CD-CD1 4.4Å; K1376-Y1468 HydrophobicContact CD-CE1 3.89Å; K1376-Y1468 HydrophobicContact CD-CE2 4.34Å; K1376-Y1468 PolarHBondContact NZ-O 3.09Å; L1377-Y1468 HydrophobicContact CD2-CE2 3.88Å; L1380-Y1468 HydrophobicContact CD2-CD2 4.28Å; L1380-Y1468 HydrophobicContact CD2-CE2 4.19Å; F1397-Y1468 PolarHBondContact O-N 3.02Å; F1397-Y1468 VanDerWaalsContact O-N 3.14Å; M1403-Y1468 HydrophobicContact CE-CD1 4.39Å; M1403-Y1468 HydrophobicContact CE-CE1 3.59Å; M1403-Y1468 HydrophobicContact CE-CE2 4.21Å; M1403-Y1468 VanDerWaalsContact CE-CZ 3.49Å; M1403-Y1468 WeakPolarHBondContact CE-OH 3.4Å; M1403-Y1468 HydrophobicContact CG-CD1 4.22Å; M1403-Y1468 HydrophobicContact CG-CE1 4.15Å; M1403-Y1468 HydrophobicContact SD-CE1 3.96Å; Y1468-L1498 HydrophobicContact CD2-CD1 3.89Å; Y1468-L1498 HydrophobicContact CE2-CD1 4.2Å
1469	D	91.7	Very high	87.9	Confident	1 Å²	1	16.3 Å²	16.3	1%	0.005	9%	0.092	C	C	.	.	S	Bend	trans	-133.9	137	169.9	51.5	-2	0	0	0	111.2	N931 T1398 Q1399	N931-D1469 PolarHBondContact ND2-OD2 2.84Å; T1398-D1469 VanDerWaalsContact CA-OD1 3.25Å; T1398-D1469 WeakPolarHBondContact CA-OD1 3.26Å; Q1399-D1469 PolarHBondContact N-OD1 2.88Å
1470	S	88.1	Confident	87.9	Confident	12 Å²	12	16.2 Å²	16.2	8%	0.084	9%	0.092	C	C	.	.			trans	-89.1	140.8	-176.5	-61.8	0	0	0	0	112	R927 R1497	R927-S1470 PolarHBondContact NH1-O 3.35Å; R927-S1470 PolarHBondContact NH2-O 3.33Å; S1470-R1497 PolarHBondContact OG-NH1 3.35Å
1471	D	86	Confident	88.1	Confident	23 Å²	23	14.7 Å²	14.7	12%	0.123	8%	0.081	C	C	.	.			trans	-77.7	157.1	180	-139.2	-30.3	0	0	0	112.3	Q1399 N1473 M1476	Q1399-D1471 PolarHBondContact NE2-OD2 3.15Å; D1471-N1473 PolarHBondContact O-N 2.72Å; D1471-M1476 HydrophobicContact CB-CB 4.35Å; D1471-M1476 WeakPolarHBondContact OD2-CB 3.14Å
1472	W	82.1	Confident	88	Confident	79 Å²	79	14.5 Å²	14.5	30%	0.299	8%	0.077	S	C	.	.	S	Bend	trans	-72.5	-3.4	174.7	-74.9	112.3	0	0	0	113.5	L923 I1508 K1515	L923-W1472 HydrophobicContact CD1-CH2 4.32Å; L923-W1472 HydrophobicContact CD1-CZ2 4.24Å; W1472-I1508 HydrophobicContact CD2-CG1 4.37Å; W1472-I1508 HydrophobicContact CE3-CG1 3.98Å; W1472-I1508 HydrophobicContact CE3-CG2 4.34Å; W1472-I1508 HydrophobicContact CH2-CD1 4.31Å; W1472-I1508 HydrophobicContact CH2-CG1 3.61Å; W1472-I1508 HydrophobicContact CZ2-CD1 4.29Å; W1472-I1508 HydrophobicContact CZ2-CG1 4.01Å; W1472-I1508 HydrophobicContact CZ3-CB 4.45Å; W1472-I1508 HydrophobicContact CZ3-CG1 3.59Å; W1472-K1515 PolarHBondContact O-NZ 2.88Å
1473	N	81	Confident	87.7	Confident	18 Å²	18	14.7 Å²	14.7	10%	0.096	8%	0.078	C	C	.	.	S	Bend	trans	-132.3	110.8	-179.3	175.9	15.7	0	0	0	109.6	D1471 T1475 M1476	D1471-N1473 PolarHBondContact O-N 2.72Å; N1473-T1475 PolarHBondContact ND2-OG1 3.04Å; N1473-T1475 PolarHBondContact O-N 3.07Å; N1473-T1475 PolarHBondContact OD1-N 3.48Å; N1473-T1475 VanDerWaalsContact OD1-N 3.14Å; N1473-T1475 PolarHBondContact OD1-OG1 2.93Å; N1473-M1476 HydrophobicContact CB-CG 4.26Å; N1473-M1476 PolarHBondContact O-N 2.92Å; N1473-M1476 VanDerWaalsContact O-N 3.08Å
1474	P	84	Confident	87.5	Confident	17 Å²	17	14.5 Å²	14.5	11%	0.11	8%	0.077	C	C	.	.	H	α-helix	trans	-61.3	-21.9	-177.4	28.9	-38.5	0	0	0	112.8	M1476 A1478 A1512 K1515 R1516	P1474-M1476 PolarHBondContact O-N 2.66Å; P1474-A1478 VanDerWaalsContact O-CB 3.24Å; P1474-A1478 WeakPolarHBondContact O-CB 3.29Å; P1474-A1478 PolarHBondContact O-N 2.72Å; P1474-A1512 WeakPolarHBondContact CG-O 3.05Å; P1474-K1515 HydrophobicContact CG-CB 4.09Å; P1474-R1516 HydrophobicContact CB-CB 4.05Å; P1474-R1516 HydrophobicContact CG-CB 3.93Å
1475	T	81.6	Confident	87.1	Confident	12 Å²	12	15 Å²	15	7%	0.074	8%	0.079	C	C	.	.	H	α-helix	trans	-71	-17.3	179.2	78.3	0	0	0	0	113.5	T805 Q808 N1473 Q1479	T805-T1475 HydrophobicContact CG2-CG2 4.08Å; Q808-T1475 HydrophobicContact CB-CG2 4.21Å; Q808-T1475 HydrophobicContact CG-CG2 4.02Å; Q808-T1475 PolarHBondContact NE2-OG1 2.81Å; N1473-T1475 PolarHBondContact ND2-OG1 3.04Å; N1473-T1475 PolarHBondContact O-N 3.07Å; N1473-T1475 PolarHBondContact OD1-N 3.48Å; N1473-T1475 VanDerWaalsContact OD1-N 3.14Å; N1473-T1475 PolarHBondContact OD1-OG1 2.93Å; T1475-Q1479 WeakPolarHBondContact O-CB 3.33Å; T1475-Q1479 PolarHBondContact O-N 3.47Å
1476	M	83	Confident	86.6	Confident	44 Å²	44	18 Å²	18	22%	0.217	9%	0.09	C	C	.	.	H	α-helix	trans	-77.3	-49.5	175.6	-65.1	-52.5	-55.4	0	0	111	D1471 N1473 P1474 A1478 Q1479 A1480	D1471-M1476 HydrophobicContact CB-CB 4.35Å; D1471-M1476 WeakPolarHBondContact OD2-CB 3.14Å; N1473-M1476 HydrophobicContact CB-CG 4.26Å; N1473-M1476 PolarHBondContact O-N 2.92Å; N1473-M1476 VanDerWaalsContact O-N 3.08Å; P1474-M1476 PolarHBondContact O-N 2.66Å; M1476-A1478 VanDerWaalsContact C-N 3.31Å; M1476-A1478 PolarHBondContact O-N 2.83Å; M1476-Q1479 WeakPolarHBondContact O-CB 3.45Å; M1476-Q1479 PolarHBondContact O-N 2.87Å; M1476-Q1479 VanDerWaalsContact O-N 3.1Å; M1476-A1480 PolarHBondContact O-N 3.43Å
1477	D	87.3	Confident	85.7	Confident	4 Å²	4	21.3 Å²	21.3	2%	0.021	11%	0.107	C	C	.	.	H	α-helix	trans	-60.5	-43.2	173.1	-66.2	-1.5	0	0	0	110.5	F1467 Q1479 A1480 Q1481 R1497	F1467-D1477 HydrophobicContact CD1-CB 4.43Å; F1467-D1477 HydrophobicContact CE1-CB 3.83Å; F1467-D1477 HydrophobicContact CE2-CB 4.38Å; F1467-D1477 HydrophobicContact CZ-CB 3.8Å; F1467-D1477 WeakPolarHBondContact CZ-O 3.32Å; D1477-Q1479 VanDerWaalsContact C-N 3.27Å; D1477-Q1479 PolarHBondContact O-N 3.04Å; D1477-A1480 PolarHBondContact O-N 3.43Å; D1477-Q1481 PolarHBondContact O-N 2.75Å; D1477-R1497 IonicContact OD2-CZ 3.75Å; D1477-R1497 IonicContact OD2-NH1 3.94Å; D1477-R1497 PolarHBondContact OD2-NH1 3.15Å; D1477-R1497 IonicContact OD2-NH2 3.81Å
1478	A	84.3	Confident	84.9	Confident	38 Å²	38	24 Å²	24	31%	0.314	14%	0.135	S	C	.	.	H	α-helix	trans	-63	-31.4	175	0	0	0	0	0	113.2	P1474 M1476 Q1481 D1482	P1474-A1478 VanDerWaalsContact O-CB 3.24Å; P1474-A1478 WeakPolarHBondContact O-CB 3.29Å; P1474-A1478 PolarHBondContact O-N 2.72Å; M1476-A1478 VanDerWaalsContact C-N 3.31Å; M1476-A1478 PolarHBondContact O-N 2.83Å; A1478-Q1481 VanDerWaalsContact O-CG 3.27Å; A1478-Q1481 WeakPolarHBondContact O-CG 3.47Å; A1478-D1482 WeakPolarHBondContact O-CB 3.21Å
1479	Q	83.6	Confident	84.5	Confident	27 Å²	27	24.9 Å²	24.9	13%	0.126	14%	0.139	C	C	.	.	H	α-helix	trans	-75.7	-27	173.8	177	161.3	80.2	0	0	112.5	M674 T1475 M1476 D1477 R1483	M674-Q1479 HydrophobicContact SD-CB 4.46Å; M674-Q1479 HydrophobicContact SD-CG 3.78Å; M674-Q1479 PolarHBondContact SD-NE2 3.05Å; T1475-Q1479 WeakPolarHBondContact O-CB 3.33Å; T1475-Q1479 PolarHBondContact O-N 3.47Å; M1476-Q1479 WeakPolarHBondContact O-CB 3.45Å; M1476-Q1479 PolarHBondContact O-N 2.87Å; M1476-Q1479 VanDerWaalsContact O-N 3.1Å; D1477-Q1479 VanDerWaalsContact C-N 3.27Å; D1477-Q1479 PolarHBondContact O-N 3.04Å; Q1479-R1483 WeakPolarHBondContact O-CG 3.3Å; Q1479-R1483 PolarHBondContact O-NE 2.81Å
1480	A	85.5	Confident	84.3	Confident	0 Å²	0	31 Å²	31	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-78.4	-47.1	177.7	0	0	0	0	0	112.6	F1397 T1450 F1467 M1476 D1477 D1482 R1483	F1397-A1480 HydrophobicContact CD1-CB 4.47Å; F1397-A1480 HydrophobicContact CD2-CB 4.34Å; F1397-A1480 HydrophobicContact CE1-CB 4.17Å; F1397-A1480 HydrophobicContact CE2-CB 4.03Å; F1397-A1480 HydrophobicContact CZ-CB 3.94Å; T1450-A1480 HydrophobicContact CG2-CB 4.24Å; F1467-A1480 HydrophobicContact CE1-CB 4.15Å; F1467-A1480 HydrophobicContact CZ-CB 4.22Å; M1476-A1480 PolarHBondContact O-N 3.43Å; D1477-A1480 PolarHBondContact O-N 3.43Å; A1480-D1482 PolarHBondContact O-N 3.1Å; A1480-R1483 WeakPolarHBondContact O-CB 3.36Å; A1480-R1483 PolarHBondContact O-N 3.06Å; A1480-R1483 VanDerWaalsContact O-N 3.11Å
1481	Q	88.3	Confident	84.3	Confident	16 Å²	16	35.9 Å²	35.9	8%	0.075	19%	0.193	C	C	.	.	H	α-helix	trans	-57.3	-35.8	175.4	69.7	-175.2	6.7	0	0	111.8	D1477 A1478 R1483 C1484 H1485 I1495	D1477-Q1481 PolarHBondContact O-N 2.75Å; A1478-Q1481 VanDerWaalsContact O-CG 3.27Å; A1478-Q1481 WeakPolarHBondContact O-CG 3.47Å; Q1481-R1483 PolarHBondContact O-N 2.7Å; Q1481-C1484 PolarHBondContact O-N 2.95Å; Q1481-H1485 PolarHBondContact O-N 2.85Å; Q1481-I1495 HydrophobicContact CB-CD1 4.17Å; Q1481-I1495 HydrophobicContact CB-CG1 4.48Å
1482	D	85.1	Confident	84.6	Confident	9 Å²	9	37.6 Å²	37.6	5%	0.048	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-1.8	179.8	-93	21	0	0	0	114.3	M674 K871 K881 A1478 A1480	M674-D1482 HydrophobicContact CB-CB 4.33Å; M674-D1482 WeakPolarHBondContact CB-OD2 3.36Å; K871-D1482 IonicContact NZ-OD1 2.66Å; K871-D1482 PolarHBondContact NZ-OD1 2.88Å; K871-D1482 IonicContact NZ-OD2 2.87Å; K871-D1482 PolarHBondContact NZ-OD2 2.76Å; K881-D1482 IonicContact NZ-OD1 2.67Å; A1478-D1482 WeakPolarHBondContact O-CB 3.21Å; A1480-D1482 PolarHBondContact O-N 3.1Å
1483	R	83.8	Confident	85.1	Confident	4 Å²	4	33.9 Å²	33.9	2%	0.015	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-18.4	173.5	-47.6	-48.7	168.8	79.4	-7.3	113	G1453 G1454 L1455 I1457 L1459 Q1479 A1480 Q1481	G1453-R1483 PolarHBondContact O-NH1 3.16Å; G1454-R1483 VanDerWaalsContact C-NH1 3.32Å; G1454-R1483 PolarHBondContact O-NH1 2.89Å; G1454-R1483 PolarHBondContact O-NH2 2.68Å; L1455-R1483 VanDerWaalsContact C-NH1 3.3Å; L1455-R1483 PolarHBondContact O-NH1 2.87Å; I1457-R1483 WeakPolarHBondContact O-CD 3.2Å; L1459-R1483 CarbonylContact C-O 3.59Å; L1459-R1483 WeakPolarHBondContact CA-O 3Å; L1459-R1483 PolarHBondContact N-O 3.43Å; Q1479-R1483 WeakPolarHBondContact O-CG 3.3Å; Q1479-R1483 PolarHBondContact O-NE 2.81Å; A1480-R1483 WeakPolarHBondContact O-CB 3.36Å; A1480-R1483 PolarHBondContact O-N 3.06Å; A1480-R1483 VanDerWaalsContact O-N 3.11Å; Q1481-R1483 PolarHBondContact O-N 2.7Å
1484	C	87.9	Confident	85.7	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-52.3	163.6	175.4	0	0	0	0	110.3	L1395 A1462 V1465 Q1481 R1486	L1395-C1484 HydrophobicContact CD1-CB 4.18Å; A1462-C1484 PolarHBondContact O-SG 2.72Å; V1465-C1484 HydrophobicContact CG2-CB 3.83Å; Q1481-C1484 PolarHBondContact O-N 2.95Å; C1484-R1486 PolarHBondContact O-N 3.37Å
1485	H	87.7	Confident	86.2	Confident	10 Å²	10	34.8 Å²	34.8	5%	0.046	19%	0.19	C	C	.	.	S	Bend	trans	-77.5	80.2	178.2	-168.3	-98.8	0	0	0	111.9	P879 Q1481 V1493	P879-H1485 PolarHBondContact O-NE2 3.02Å; Q1481-H1485 PolarHBondContact O-N 2.85Å; H1485-V1493 HydrophobicContact CB-CG2 4.29Å
1486	R	82.5	Confident	86.9	Confident	64 Å²	64	35.6 Å²	35.6	24%	0.242	19%	0.192	C	C	.	.	S	Bend	trans	-146.8	157.8	-173.9	-164.8	161.1	175.2	-177.6	-9.8	111.8	I1457 N1458 C1484 G1488 Q1489	I1457-R1486 PolarHBondContact O-NH1 3.24Å; N1458-R1486 PolarHBondContact OD1-NH1 2.75Å; N1458-R1486 PolarHBondContact OD1-NH2 3.34Å; C1484-R1486 PolarHBondContact O-N 3.37Å; R1486-G1488 PolarHBondContact O-N 3.49Å; R1486-G1488 VanDerWaalsContact O-N 3.09Å; R1486-Q1489 VanDerWaalsContact O-CB 3.3Å; R1486-Q1489 WeakPolarHBondContact O-CB 3.3Å; R1486-Q1489 PolarHBondContact O-N 2.8Å
1487	I	76.6	Confident	87.4	Confident	70 Å²	70	34.2 Å²	34.2	36%	0.359	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	117.1	175.5	-53.9	175.5	0	0	0	109.2	L878	L878-I1487 HydrophobicContact CD2-CG1 4.32Å
1488	G	78.8	Confident	87.8	Confident	56 Å²	56	34 Å²	34	58%	0.577	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	120	-20.1	-170.3	0	0	0	0	0	113.7	R1486	R1486-G1488 PolarHBondContact O-N 3.49Å; R1486-G1488 VanDerWaalsContact O-N 3.09Å
1489	Q	86.2	Confident	88.3	Confident	18 Å²	18	32.3 Å²	32.3	8%	0.084	17%	0.169	C	C	.	.			trans	-69.6	140.7	165.1	178.9	60	-84.6	0	0	110.7	P879 A1462 R1486 R1491 V1493	P879-Q1489 HydrophobicContact CG-CB 4.33Å; P879-Q1489 HydrophobicContact CG-CG 3.76Å; A1462-Q1489 PolarHBondContact O-NE2 2.95Å; R1486-Q1489 VanDerWaalsContact O-CB 3.3Å; R1486-Q1489 WeakPolarHBondContact O-CB 3.3Å; R1486-Q1489 PolarHBondContact O-N 2.8Å; Q1489-R1491 WeakPolarHBondContact CG-O 3.44Å; Q1489-V1493 HydrophobicContact CG-CG2 3.81Å
1490	T	86.5	Confident	88.6	Confident	129 Å²	129	31 Å²	31	79%	0.791	16%	0.163	S	C	*	.			trans	-123.2	-13.8	178.6	57.5	0	0	0	0	114.1
1491	R	89.4	Confident	88.7	Confident	115 Å²	115	34.2 Å²	34.2	43%	0.434	18%	0.178	S	C	.	.	S	Bend	trans	-100.7	152.3	174	-66.8	-179.5	171.8	-175.5	-5.8	110.9	P879 N1391 D1463 Q1489	P879-R1491 WeakPolarHBondContact CB-O 3.21Å; P879-R1491 WeakPolarHBondContact CG-O 3.04Å; N1391-R1491 PolarHBondContact O-NH1 3.33Å; D1463-R1491 HydrophobicContact CB-CB 3.98Å; D1463-R1491 WeakPolarHBondContact OD2-CD 3.07Å; D1463-R1491 IonicContact OD2-CZ 3.11Å; D1463-R1491 IonicContact OD2-NE 3.77Å; D1463-R1491 IonicContact OD2-NH1 2.77Å; D1463-R1491 PolarHBondContact OD2-NH1 3.27Å; Q1489-R1491 WeakPolarHBondContact CG-O 3.44Å
1492	D	91.4	Very high	88.5	Confident	60 Å²	60	41.2 Å²	41.2	32%	0.321	20%	0.204	S	C	.	.			trans	-59.9	140.4	166.7	-84.3	3.8	0	0	0	109.9	P879 R880 Y882	P879-D1492 VanDerWaalsContact CB-OD1 3.27Å; P879-D1492 WeakPolarHBondContact CB-OD1 3.43Å; R880-D1492 PolarHBondContact N-OD1 2.79Å; R880-D1492 WeakPolarHBondContact O-CA 3.39Å; Y882-D1492 HydrophobicContact CE2-CB 4.01Å; Y882-D1492 VanDerWaalsContact CE2-OD2 3.29Å; Y882-D1492 WeakPolarHBondContact CE2-OD2 3.14Å; Y882-D1492 PolarHBondContact OH-OD2 2.88Å
1493	V	92.6	Very high	88.7	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	114.5	-172.2	177.7	0	0	0	0	110.5	R880 K881 Y882 D1463 V1465 H1485 Q1489 I1495	R880-V1493 PolarHBondContact O-N 2.83Å; K881-V1493 VanDerWaalsContact CA-O 3.31Å; K881-V1493 WeakPolarHBondContact CA-O 3.45Å; K881-V1493 HydrophobicContact CB-CB 4.37Å; Y882-V1493 PolarHBondContact N-O 3.3Å; D1463-V1493 WeakPolarHBondContact O-CA 3.27Å; V1465-V1493 HydrophobicContact CG2-CG1 4.42Å; H1485-V1493 HydrophobicContact CB-CG2 4.29Å; Q1489-V1493 HydrophobicContact CG-CG2 3.81Å; V1493-I1495 HydrophobicContact CG1-CG1 4.2Å
1494	H	94.5	Very high	88.8	Confident	52 Å²	52	41.8 Å²	41.8	24%	0.241	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	122.1	179.4	-70.7	-114.9	0	0	0	109.8	H884 D1463 T1464 V1465 Y1496	H884-H1494 AromaticContact NE2-CE1 3.31Å; H884-H1494 PolarHBondContact NE2-CE1 3.42Å; H884-H1494 VanDerWaalsContact NE2-CE1 3.31Å; H884-H1494 AromaticContact NE2-CG 3.56Å; H884-H1494 AromaticContact NE2-ND1 2.72Å; H884-H1494 PolarHBondContact NE2-ND1 2.89Å; D1463-H1494 PolarHBondContact O-N 2.96Å; T1464-H1494 CarbonylContact C-O 3.56Å; T1464-H1494 WeakPolarHBondContact CA-O 3.46Å; V1465-H1494 PolarHBondContact N-O 2.72Å; H1494-Y1496 HydrophobicContact CB-CE2 3.81Å
1495	I	94.7	Very high	88.9	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.01	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	108.2	-178.3	-60.1	150.8	0	0	0	107.7	K881 Y882 E883 H884 V1465 F1467 Q1481 V1493	K881-I1495 HydrophobicContact CB-CD1 4.16Å; Y882-I1495 WeakPolarHBondContact O-CB 3.41Å; Y882-I1495 PolarHBondContact O-N 3.43Å; E883-I1495 CarbonylContact C-O 3.6Å; E883-I1495 WeakPolarHBondContact CA-O 3.16Å; E883-I1495 HydrophobicContact CG-CG2 4.45Å; H884-I1495 PolarHBondContact N-O 2.84Å; V1465-I1495 HydrophobicContact CB-CG1 4.28Å; V1465-I1495 CarbonylContact O-C 3.42Å; V1465-I1495 WeakPolarHBondContact O-CA 3.3Å; F1467-I1495 HydrophobicContact CD2-CG2 3.84Å; F1467-I1495 HydrophobicContact CE2-CG2 3.67Å; Q1481-I1495 HydrophobicContact CB-CD1 4.17Å; Q1481-I1495 HydrophobicContact CB-CG1 4.48Å; V1493-I1495 HydrophobicContact CG1-CG1 4.2Å
1496	Y	95.3	Very high	88.9	Confident	29 Å²	29	43.9 Å²	43.9	11%	0.114	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	135.4	175.8	-61	-77.6	0	0	0	110.4	H884 I886 L1383 L1387 T1464 V1465 I1466 F1467 H1494	H884-Y1496 HydrophobicContact CB-CD1 3.53Å; H884-Y1496 HydrophobicContact CB-CE1 3.78Å; H884-Y1496 HydrophobicContact CB-CG 4.49Å; H884-Y1496 AromaticContact CD2-CE1 3.72Å; H884-Y1496 AromaticContact CG-CE1 3.77Å; H884-Y1496 CarbonylContact O-C 3.52Å; H884-Y1496 WeakPolarHBondContact O-CA 3.21Å; I886-Y1496 HydrophobicContact CD1-CD1 3.75Å; I886-Y1496 HydrophobicContact CD1-CG 4.37Å; I886-Y1496 HydrophobicContact CG1-CD1 4.38Å; L1383-Y1496 HydrophobicContact CD1-CD1 4.28Å; L1383-Y1496 HydrophobicContact CD1-CD2 4.34Å; L1383-Y1496 HydrophobicContact CD1-CE1 4.1Å; L1383-Y1496 HydrophobicContact CD1-CE2 4.14Å; L1383-Y1496 HydrophobicContact CD1-CG 4.41Å; L1383-Y1496 HydrophobicContact CD2-CD1 4.32Å; L1383-Y1496 HydrophobicContact CD2-CD2 4.09Å; L1383-Y1496 HydrophobicContact CD2-CG 3.89Å; L1387-Y1496 HydrophobicContact CD1-CE2 4.44Å; L1387-Y1496 HydrophobicContact CD2-CE2 4.27Å; T1464-Y1496 HydrophobicContact CG2-CD2 3.66Å; T1464-Y1496 HydrophobicContact CG2-CE2 3.61Å; V1465-Y1496 PolarHBondContact O-N 2.95Å; I1466-Y1496 CarbonylContact C-O 3.56Å; I1466-Y1496 WeakPolarHBondContact CA-O 3.23Å; I1466-Y1496 HydrophobicContact CG1-CD2 4.41Å; F1467-Y1496 PolarHBondContact N-O 2.81Å; H1494-Y1496 HydrophobicContact CB-CE2 3.81Å
1497	R	94.7	Very high	89	Confident	15 Å²	15	43.9 Å²	43.9	6%	0.057	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	110.8	179.1	-175.5	-177.3	-64.4	-77.1	0.4	109.1	E883 H884 I886 S1470 D1477 I1499	E883-R1497 IonicContact OE1-CZ 3.37Å; E883-R1497 IonicContact OE1-NE 2.63Å; E883-R1497 PolarHBondContact OE1-NE 3.26Å; E883-R1497 IonicContact OE1-NH2 3.32Å; E883-R1497 PolarHBondContact OE1-NH2 2.71Å; H884-R1497 PolarHBondContact O-N 3.31Å; I886-R1497 PolarHBondContact N-O 3.1Å; S1470-R1497 PolarHBondContact OG-NH1 3.35Å; D1477-R1497 IonicContact OD2-CZ 3.75Å; D1477-R1497 IonicContact OD2-NH1 3.94Å; D1477-R1497 PolarHBondContact OD2-NH1 3.15Å; D1477-R1497 IonicContact OD2-NH2 3.81Å; R1497-I1499 HydrophobicContact CG-CD1 4.13Å; R1497-I1499 HydrophobicContact CG-CG1 4.08Å
1498	L	94.7	Very high	89.5	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	128.3	179	-52.9	-173.7	0	0	0	110.1	I886 L1380 I1466 F1467 Y1468	I886-L1498 HydrophobicContact CB-CD2 3.89Å; I886-L1498 HydrophobicContact CD1-CD2 4.05Å; I886-L1498 HydrophobicContact CG1-CD2 4.47Å; I886-L1498 HydrophobicContact CG2-CD2 4.14Å; L1380-L1498 HydrophobicContact CB-CD1 4.26Å; L1380-L1498 HydrophobicContact CD1-CD1 4.46Å; I1466-L1498 HydrophobicContact CG2-CD1 4.44Å; I1466-L1498 HydrophobicContact CG2-CG 4.33Å; F1467-L1498 PolarHBondContact O-N 3Å; Y1468-L1498 HydrophobicContact CD2-CD1 3.89Å; Y1468-L1498 HydrophobicContact CE2-CD1 4.2Å
1499	I	93.8	Very high	89.9	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	129.1	-177.7	-57.5	-173.8	0	0	0	110.1	V885 I886 M887 C888 R1497 E1501 E1505 L1509	V885-I1499 HydrophobicContact CG1-CD1 3.71Å; V885-I1499 HydrophobicContact CG1-CG1 4.29Å; I886-I1499 PolarHBondContact O-N 2.87Å; M887-I1499 HydrophobicContact CE-CG2 4.35Å; M887-I1499 HydrophobicContact SD-CB 4.2Å; M887-I1499 HydrophobicContact SD-CG2 4.37Å; C888-I1499 PolarHBondContact N-O 2.91Å; R1497-I1499 HydrophobicContact CG-CD1 4.13Å; R1497-I1499 HydrophobicContact CG-CG1 4.08Å; I1499-E1501 PolarHBondContact O-N 2.76Å; I1499-E1505 HydrophobicContact CG2-CB 3.94Å; I1499-L1509 HydrophobicContact CD1-CB 3.9Å; I1499-L1509 HydrophobicContact CD1-CD1 4.24Å; I1499-L1509 HydrophobicContact CD1-CD2 3.51Å; I1499-L1509 HydrophobicContact CD1-CG 4.05Å
1500	S	91.4	Very high	89.8	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.007	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	122.7	176.1	-69	0	0	0	0	112.9	C888 K1376 T1503 E1505	C888-S1500 CarbonylContact O-C 3.26Å; C888-S1500 VanDerWaalsContact O-CA 3.31Å; C888-S1500 WeakPolarHBondContact O-CA 3.34Å; K1376-S1500 WeakPolarHBondContact CE-OG 3.24Å; S1500-T1503 WeakPolarHBondContact CB-OG1 3.29Å; S1500-T1503 PolarHBondContact O-N 2.95Å; S1500-T1503 PolarHBondContact O-OG1 3.48Å; S1500-E1505 PolarHBondContact N-OE2 3.33Å
1501	E	87.4	Confident	89.6	Confident	67 Å²	67	41.4 Å²	41.4	31%	0.313	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	140	179.1	-71.1	167.9	-154.9	0	0	113.1	M887 C888 R889 I1499 T1503	M887-E1501 HydrophobicContact CB-CG 3.81Å; M887-E1501 HydrophobicContact CE-CG 3.92Å; C888-E1501 PolarHBondContact O-N 3.32Å; R889-E1501 WeakPolarHBondContact CG-OE2 3.47Å; I1499-E1501 PolarHBondContact O-N 2.76Å; E1501-T1503 WeakPolarHBondContact O-CG2 3.38Å; E1501-T1503 PolarHBondContact O-N 2.67Å; E1501-T1503 VanDerWaalsContact O-N 3.1Å
1502	R	84.3	Confident	89.3	Confident	163 Å²	163	36.4 Å²	36.4	62%	0.615	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.3	19.5	177.9	-52.7	-178.8	-178.3	-176.5	-0.9	114.2
1503	T	88.5	Confident	88.9	Confident	5 Å²	5	36.7 Å²	36.7	3%	0.031	17%	0.166	C	C	.	.	S	Bend	trans	-109.1	171.5	179.3	76.1	0	0	0	0	113.2	L890 Y898 S1500 E1501 E1505 E1506	L890-T1503 HydrophobicContact CD1-CG2 3.75Å; L890-T1503 HydrophobicContact CD2-CG2 4.18Å; L890-T1503 HydrophobicContact CG-CG2 4.02Å; Y898-T1503 HydrophobicContact CE2-CG2 4.3Å; S1500-T1503 WeakPolarHBondContact CB-OG1 3.29Å; S1500-T1503 PolarHBondContact O-N 2.95Å; S1500-T1503 PolarHBondContact O-OG1 3.48Å; E1501-T1503 WeakPolarHBondContact O-CG2 3.38Å; E1501-T1503 PolarHBondContact O-N 2.67Å; E1501-T1503 VanDerWaalsContact O-N 3.1Å; T1503-E1505 PolarHBondContact O-N 2.87Å; T1503-E1505 WeakPolarHBondContact OG1-CB 3.23Å; T1503-E1505 PolarHBondContact OG1-N 2.88Å; T1503-E1505 VanDerWaalsContact OG1-N 3.11Å; T1503-E1506 PolarHBondContact O-N 2.82Å; T1503-E1506 VanDerWaalsContact O-N 3.16Å
1504	V	86.7	Confident	88	Confident	19 Å²	19	40.3 Å²	40.3	12%	0.115	18%	0.183	C	C	.	.	H	α-helix	trans	-48.7	-27.3	167.1	161.9	0	0	0	0	113.8	Y898 L923 L926 E1506 N1507 I1508	Y898-V1504 PolarHBondContact OH-N 2.89Å; L923-V1504 HydrophobicContact CD2-CB 4.4Å; L923-V1504 HydrophobicContact CD2-CG1 3.66Å; L923-V1504 HydrophobicContact CD2-CG2 3.74Å; L926-V1504 HydrophobicContact CD1-CG2 3.83Å; V1504-E1506 PolarHBondContact O-N 3.32Å; V1504-N1507 PolarHBondContact O-N 3.12Å; V1504-I1508 HydrophobicContact CG1-CD1 3.66Å; V1504-I1508 HydrophobicContact CG1-CG1 4.36Å; V1504-I1508 WeakPolarHBondContact O-CD1 3.34Å; V1504-I1508 WeakPolarHBondContact O-CG1 3.19Å; V1504-I1508 PolarHBondContact O-N 2.78Å
1505	E	88.8	Confident	87.2	Confident	11 Å²	11	40.9 Å²	40.9	5%	0.051	19%	0.185	C	C	.	.	H	α-helix	trans	-66.3	-34.3	179.4	-61.2	-161.5	141.9	0	0	114.1	C930 K1376 I1499 S1500 T1503 I1508 L1509	C930-E1505 HydrophobicContact CB-CG 4.3Å; K1376-E1505 WeakPolarHBondContact CE-OE2 3.35Å; K1376-E1505 IonicContact NZ-OE1 3.7Å; K1376-E1505 PolarHBondContact NZ-OE1 3.15Å; K1376-E1505 IonicContact NZ-OE2 2.72Å; K1376-E1505 PolarHBondContact NZ-OE2 2.99Å; I1499-E1505 HydrophobicContact CG2-CB 3.94Å; S1500-E1505 PolarHBondContact N-OE2 3.33Å; T1503-E1505 PolarHBondContact O-N 2.87Å; T1503-E1505 WeakPolarHBondContact OG1-CB 3.23Å; T1503-E1505 PolarHBondContact OG1-N 2.88Å; T1503-E1505 VanDerWaalsContact OG1-N 3.11Å; E1505-I1508 WeakPolarHBondContact O-CB 3.31Å; E1505-I1508 PolarHBondContact O-N 2.9Å; E1505-L1509 PolarHBondContact O-N 3.31Å
1506	E	87.8	Confident	86.3	Confident	43 Å²	43	45.6 Å²	45.6	20%	0.201	20%	0.203	C	C	.	.	H	α-helix	trans	-65.8	-43.3	176.4	-162.9	-168.8	130.7	0	0	110.5	M887 T1503 V1504 I1508 L1509 R1510	M887-E1506 HydrophobicContact CE-CG 4.45Å; T1503-E1506 PolarHBondContact O-N 2.82Å; T1503-E1506 VanDerWaalsContact O-N 3.16Å; V1504-E1506 PolarHBondContact O-N 3.32Å; E1506-I1508 VanDerWaalsContact C-N 3.26Å; E1506-I1508 PolarHBondContact O-N 2.8Å; E1506-L1509 PolarHBondContact O-N 3.37Å; E1506-L1509 VanDerWaalsContact O-N 3.12Å; E1506-R1510 WeakPolarHBondContact O-CG 3.36Å; E1506-R1510 PolarHBondContact O-N 2.94Å; E1506-R1510 IonicContact OE1-CZ 3.76Å; E1506-R1510 IonicContact OE1-NE 3.52Å; E1506-R1510 PolarHBondContact OE1-NE 3Å; E1506-R1510 IonicContact OE1-NH2 3.61Å; E1506-R1510 PolarHBondContact OE1-NH2 3.49Å
1507	N	84.6	Confident	85.3	Confident	64 Å²	64	49.2 Å²	49.2	34%	0.342	22%	0.219	S	C	.	.	H	α-helix	trans	-64.2	-29.9	174.3	-70.1	-34.4	0	0	0	112.8	V1504 K1511	V1504-N1507 PolarHBondContact O-N 3.12Å; N1507-K1511 WeakPolarHBondContact O-CG 3.49Å; N1507-K1511 PolarHBondContact O-N 2.95Å
1508	I	87.2	Confident	84.1	Confident	3 Å²	3	50.4 Å²	50.4	2%	0.015	23%	0.227	C	C	.	.	H	α-helix	trans	-68.2	-45	171.2	-70.6	152.6	0	0	0	110.5	R927 W1472 V1504 E1505 E1506 K1511 A1512	R927-I1508 HydrophobicContact CG-CD1 4.31Å; R927-I1508 VanDerWaalsContact NE-CD1 3.33Å; W1472-I1508 HydrophobicContact CD2-CG1 4.37Å; W1472-I1508 HydrophobicContact CE3-CG1 3.98Å; W1472-I1508 HydrophobicContact CE3-CG2 4.34Å; W1472-I1508 HydrophobicContact CH2-CD1 4.31Å; W1472-I1508 HydrophobicContact CH2-CG1 3.61Å; W1472-I1508 HydrophobicContact CZ2-CD1 4.29Å; W1472-I1508 HydrophobicContact CZ2-CG1 4.01Å; W1472-I1508 HydrophobicContact CZ3-CB 4.45Å; W1472-I1508 HydrophobicContact CZ3-CG1 3.59Å; V1504-I1508 HydrophobicContact CG1-CD1 3.66Å; V1504-I1508 HydrophobicContact CG1-CG1 4.36Å; V1504-I1508 WeakPolarHBondContact O-CD1 3.34Å; V1504-I1508 WeakPolarHBondContact O-CG1 3.19Å; V1504-I1508 PolarHBondContact O-N 2.78Å; E1505-I1508 WeakPolarHBondContact O-CB 3.31Å; E1505-I1508 PolarHBondContact O-N 2.9Å; E1506-I1508 VanDerWaalsContact C-N 3.26Å; E1506-I1508 PolarHBondContact O-N 2.8Å; I1508-K1511 PolarHBondContact O-N 3.21Å; I1508-A1512 VanDerWaalsContact O-CB 3.3Å; I1508-A1512 WeakPolarHBondContact O-CB 3.49Å; I1508-A1512 PolarHBondContact O-N 3.36Å
1509	L	87.3	Confident	82.9	Confident	27 Å²	27	50.8 Å²	50.8	14%	0.141	23%	0.229	C	C	.	.	H	α-helix	trans	-60.5	-48.9	175.7	178.6	70.1	0	0	0	111.2	V885 I1499 E1505 E1506 K1511 A1512 N1513	V885-L1509 HydrophobicContact CG1-CD2 4.41Å; I1499-L1509 HydrophobicContact CD1-CB 3.9Å; I1499-L1509 HydrophobicContact CD1-CD1 4.24Å; I1499-L1509 HydrophobicContact CD1-CD2 3.51Å; I1499-L1509 HydrophobicContact CD1-CG 4.05Å; E1505-L1509 PolarHBondContact O-N 3.31Å; E1506-L1509 PolarHBondContact O-N 3.37Å; E1506-L1509 VanDerWaalsContact O-N 3.12Å; L1509-K1511 VanDerWaalsContact C-N 3.31Å; L1509-K1511 PolarHBondContact O-N 3.33Å; L1509-A1512 PolarHBondContact O-N 3.03Å; L1509-A1512 VanDerWaalsContact O-N 3.1Å; L1509-N1513 WeakPolarHBondContact O-CB 3.36Å; L1509-N1513 PolarHBondContact O-N 3.27Å
1510	R	84.3	Confident	81.8	Confident	66 Å²	66	53.3 Å²	53.3	25%	0.249	24%	0.243	C	C	.	.	H	α-helix	trans	-53.5	-48.5	178.5	-67.4	178.4	-173.1	-150.4	11.6	111	E1506 N1513 Q1514 A1543	E1506-R1510 WeakPolarHBondContact O-CG 3.36Å; E1506-R1510 PolarHBondContact O-N 2.94Å; E1506-R1510 IonicContact OE1-CZ 3.76Å; E1506-R1510 IonicContact OE1-NE 3.52Å; E1506-R1510 PolarHBondContact OE1-NE 3Å; E1506-R1510 IonicContact OE1-NH2 3.61Å; E1506-R1510 PolarHBondContact OE1-NH2 3.49Å; R1510-N1513 PolarHBondContact O-N 3Å; R1510-Q1514 PolarHBondContact O-N 3.1Å; R1510-A1543 PolarHBondContact NH1-O 2.89Å
1511	K	81.3	Confident	80.7	Confident	125 Å²	125	55 Å²	55	54%	0.543	25%	0.253	S	S	.	.	H	α-helix	trans	-70.2	-30.6	177.4	-70.1	-178.1	178.4	-175.7	0	113.9	N1507 I1508 L1509 K1515	N1507-K1511 WeakPolarHBondContact O-CG 3.49Å; N1507-K1511 PolarHBondContact O-N 2.95Å; I1508-K1511 PolarHBondContact O-N 3.21Å; L1509-K1511 VanDerWaalsContact C-N 3.31Å; L1509-K1511 PolarHBondContact O-N 3.33Å; K1511-K1515 WeakPolarHBondContact O-CG 3.24Å; K1511-K1515 PolarHBondContact O-N 2.77Å
1512	A	84	Confident	79.7	Confident	10 Å²	10	52.4 Å²	52.4	8%	0.083	24%	0.243	C	C	.	.	H	α-helix	trans	-70.3	-41.6	173.5	0	0	0	0	0	111.6	P1474 I1508 L1509 K1515 R1516	P1474-A1512 WeakPolarHBondContact CG-O 3.05Å; I1508-A1512 VanDerWaalsContact O-CB 3.3Å; I1508-A1512 WeakPolarHBondContact O-CB 3.49Å; I1508-A1512 PolarHBondContact O-N 3.36Å; L1509-A1512 PolarHBondContact O-N 3.03Å; L1509-A1512 VanDerWaalsContact O-N 3.1Å; A1512-K1515 PolarHBondContact O-N 3.29Å; A1512-R1516 WeakPolarHBondContact O-CB 3.03Å; A1512-R1516 PolarHBondContact O-N 3.11Å
1513	N	83.4	Confident	79	Confident	66 Å²	66	45.6 Å²	45.6	35%	0.353	22%	0.219	S	C	.	.	H	α-helix	trans	-64.9	-40.3	175.7	-73.7	-11.3	0	0	0	111.6	L1509 R1510 K1515 R1516 F1517	L1509-N1513 WeakPolarHBondContact O-CB 3.36Å; L1509-N1513 PolarHBondContact O-N 3.27Å; R1510-N1513 PolarHBondContact O-N 3Å; N1513-K1515 PolarHBondContact O-N 2.88Å; N1513-R1516 WeakPolarHBondContact O-CB 3.37Å; N1513-R1516 PolarHBondContact O-N 3.05Å; N1513-F1517 WeakPolarHBondContact O-CB 3.47Å; N1513-F1517 PolarHBondContact O-N 3.34Å
1514	Q	74.2	Confident	77.9	Confident	77 Å²	77	50.1 Å²	50.1	36%	0.36	24%	0.239	S	C	.	.	H	α-helix	trans	-56.3	-45.1	172.1	-170.7	-176.4	36.6	0	0	112.3	I844 R1510 L1518	I844-Q1514 VanDerWaalsContact CG2-NE2 3.3Å; R1510-Q1514 PolarHBondContact O-N 3.1Å; Q1514-L1518 WeakPolarHBondContact O-CB 3.23Å; Q1514-L1518 PolarHBondContact O-N 2.77Å
1515	K	76.4	Confident	76.3	Confident	64 Å²	64	51.7 Å²	51.7	28%	0.278	26%	0.26	S	S	.	.	H	α-helix	trans	-67.2	-39.5	175.2	-71.2	-179.8	-178.6	-173.2	0	113.5	N809 W1472 P1474 K1511 A1512 N1513 L1518 S1519	N809-K1515 PolarHBondContact OD1-NZ 3.07Å; W1472-K1515 PolarHBondContact O-NZ 2.88Å; P1474-K1515 HydrophobicContact CG-CB 4.09Å; K1511-K1515 WeakPolarHBondContact O-CG 3.24Å; K1511-K1515 PolarHBondContact O-N 2.77Å; A1512-K1515 PolarHBondContact O-N 3.29Å; N1513-K1515 PolarHBondContact O-N 2.88Å; K1515-L1518 PolarHBondContact O-N 2.9Å; K1515-S1519 PolarHBondContact O-N 2.79Å
1516	R	77.2	Confident	74.4	Confident	101 Å²	101	54.6 Å²	54.6	38%	0.381	29%	0.292	S	S	.	.	H	α-helix	trans	-59.8	-53.9	176.6	179.2	175.6	175.5	172.9	-2.9	109.5	E883 P1474 A1512 N1513 L1518 S1519 D1520	E883-R1516 IonicContact OE1-NH1 3.99Å; E883-R1516 IonicContact OE2-CZ 3.52Å; E883-R1516 IonicContact OE2-NH1 2.66Å; E883-R1516 PolarHBondContact OE2-NH1 2.82Å; E883-R1516 IonicContact OE2-NH2 3.59Å; P1474-R1516 HydrophobicContact CB-CB 4.05Å; P1474-R1516 HydrophobicContact CG-CB 3.93Å; A1512-R1516 WeakPolarHBondContact O-CB 3.03Å; A1512-R1516 PolarHBondContact O-N 3.11Å; N1513-R1516 WeakPolarHBondContact O-CB 3.37Å; N1513-R1516 PolarHBondContact O-N 3.05Å; R1516-L1518 VanDerWaalsContact C-N 3.32Å; R1516-L1518 PolarHBondContact O-N 3.14Å; R1516-S1519 PolarHBondContact O-N 3.17Å; R1516-D1520 PolarHBondContact O-N 3.27Å
1517	F	73.1	Confident	72.5	Confident	105 Å²	105	61.9 Å²	61.9	46%	0.461	32%	0.323	S	S	.	.	H	α-helix	trans	-55.4	-42.6	175.5	-176	-109	0	0	0	112.5	N1513 S1519 D1520 V1521 F1533	N1513-F1517 WeakPolarHBondContact O-CB 3.47Å; N1513-F1517 PolarHBondContact O-N 3.34Å; F1517-S1519 PolarHBondContact O-N 3.24Å; F1517-D1520 PolarHBondContact O-N 3.26Å; F1517-V1521 HydrophobicContact CD1-CG2 4.1Å; F1517-V1521 HydrophobicContact CD2-CG2 4.02Å; F1517-V1521 HydrophobicContact CE1-CG2 3.83Å; F1517-V1521 HydrophobicContact CE2-CG2 3.74Å; F1517-V1521 HydrophobicContact CG-CG2 4.2Å; F1517-V1521 HydrophobicContact CZ-CG2 3.64Å; F1517-V1521 VanDerWaalsContact O-CB 3.25Å; F1517-V1521 WeakPolarHBondContact O-CB 3.16Å; F1517-V1521 VanDerWaalsContact O-CG2 3.23Å; F1517-V1521 WeakPolarHBondContact O-CG2 3.08Å; F1517-V1521 PolarHBondContact O-N 3.01Å; F1517-F1533 AromaticContact CE1-CE1 3.82Å; F1517-F1533 HydrophobicContact CE1-CE1 3.82Å; F1517-F1533 AromaticContact CE1-CZ 3.66Å; F1517-F1533 HydrophobicContact CE1-CZ 3.66Å; F1517-F1533 HydrophobicContact CZ-CE1 4.16Å; F1517-F1533 AromaticContact CZ-CZ 3.87Å; F1517-F1533 HydrophobicContact CZ-CZ 3.87Å
1518	L	69.1	Low	70.6	Confident	40 Å²	40	60.6 Å²	60.6	21%	0.209	32%	0.315	C	S	.	.	H	α-helix	trans	-61.6	-40.3	174.4	-176.9	147	0	0	0	113	I844 Q1514 K1515 R1516 A1522	I844-L1518 HydrophobicContact CD1-CD1 3.75Å; Q1514-L1518 WeakPolarHBondContact O-CB 3.23Å; Q1514-L1518 PolarHBondContact O-N 2.77Å; K1515-L1518 PolarHBondContact O-N 2.9Å; R1516-L1518 VanDerWaalsContact C-N 3.32Å; R1516-L1518 PolarHBondContact O-N 3.14Å; L1518-A1522 WeakPolarHBondContact O-CB 3.46Å; L1518-A1522 PolarHBondContact O-N 3.34Å
1519	S	70.2	Confident	68.2	Low	9 Å²	9	64.5 Å²	64.5	6%	0.063	34%	0.339	C	S	.	.	H	α-helix	trans	-70.3	-34.9	177.4	-160.9	0	0	0	0	112.3	L807 K1515 R1516 F1517 I1523	L807-S1519 PolarHBondContact O-OG 3.38Å; K1515-S1519 PolarHBondContact O-N 2.79Å; R1516-S1519 PolarHBondContact O-N 3.17Å; F1517-S1519 PolarHBondContact O-N 3.24Å; S1519-I1523 VanDerWaalsContact O-CD1 3.27Å; S1519-I1523 WeakPolarHBondContact O-CD1 3.2Å; S1519-I1523 WeakPolarHBondContact O-CG1 3.48Å
1520	D	71.6	Confident	66.2	Low	53 Å²	53	68 Å²	68	28%	0.283	36%	0.361	S	S	.	.	H	α-helix	trans	-73.8	-49.1	177.7	-61.6	-30.1	0	0	0	110.6	R868 R1516 F1517 A1522 I1523 E1524	R868-D1520 IonicContact NH2-OD1 2.71Å; R1516-D1520 PolarHBondContact O-N 3.27Å; F1517-D1520 PolarHBondContact O-N 3.26Å; D1520-A1522 PolarHBondContact O-N 2.82Å; D1520-I1523 PolarHBondContact O-N 3.4Å; D1520-E1524 WeakPolarHBondContact O-CB 3.15Å; D1520-E1524 WeakPolarHBondContact O-CG 2.76Å; D1520-E1524 PolarHBondContact O-N 2.74Å
1521	V	67.2	Low	64.6	Low	36 Å²	36	67.6 Å²	67.6	22%	0.218	37%	0.372	C	S	.	.	H	α-helix	trans	-57.4	-43	175.3	167.8	0	0	0	0	112.4	F1517 I1523 F1528	F1517-V1521 HydrophobicContact CD1-CG2 4.1Å; F1517-V1521 HydrophobicContact CD2-CG2 4.02Å; F1517-V1521 HydrophobicContact CE1-CG2 3.83Å; F1517-V1521 HydrophobicContact CE2-CG2 3.74Å; F1517-V1521 HydrophobicContact CG-CG2 4.2Å; F1517-V1521 HydrophobicContact CZ-CG2 3.64Å; F1517-V1521 VanDerWaalsContact O-CB 3.25Å; F1517-V1521 WeakPolarHBondContact O-CB 3.16Å; F1517-V1521 VanDerWaalsContact O-CG2 3.23Å; F1517-V1521 WeakPolarHBondContact O-CG2 3.08Å; F1517-V1521 PolarHBondContact O-N 3.01Å; V1521-I1523 PolarHBondContact O-N 3.15Å; V1521-F1528 HydrophobicContact CG1-CD2 3.98Å; V1521-F1528 HydrophobicContact CG1-CE2 3.74Å
1522	A	66.6	Low	62.8	Low	13 Å²	13	70 Å²	70	11%	0.107	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-7.3	-177.6	0	0	0	0	0	114.3	L807 H859 L1518 D1520	L807-A1522 HydrophobicContact CD1-CB 3.7Å; H859-A1522 PolarHBondContact CE1-O 3.27Å; H859-A1522 VanDerWaalsContact CE1-O 3.29Å; L1518-A1522 WeakPolarHBondContact O-CB 3.46Å; L1518-A1522 PolarHBondContact O-N 3.34Å; D1520-A1522 PolarHBondContact O-N 2.82Å
1523	I	69.6	Low	61	Low	20 Å²	20	72.6 Å²	72.6	10%	0.103	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.7	-33.5	-171.3	-44.1	168.7	0	0	0	114.1	P806 L807 L866 R868 S1519 D1520 V1521 G1525	P806-I1523 HydrophobicContact CG-CD1 3.71Å; L807-I1523 HydrophobicContact CB-CD1 4.12Å; L807-I1523 HydrophobicContact CD1-CD1 4.07Å; L807-I1523 HydrophobicContact CD1-CG1 4.01Å; L807-I1523 HydrophobicContact CG-CD1 4.35Å; L866-I1523 HydrophobicContact CD2-CG2 4.41Å; R868-I1523 VanDerWaalsContact CD-CG2 3.48Å; S1519-I1523 VanDerWaalsContact O-CD1 3.27Å; S1519-I1523 WeakPolarHBondContact O-CD1 3.2Å; S1519-I1523 WeakPolarHBondContact O-CG1 3.48Å; D1520-I1523 PolarHBondContact O-N 3.4Å; V1521-I1523 PolarHBondContact O-N 3.15Å; I1523-G1525 VanDerWaalsContact C-N 3.26Å; I1523-G1525 PolarHBondContact O-N 2.64Å
1524	E	64.5	Low	59	Low	100 Å²	100	76.5 Å²	76.5	47%	0.467	41%	0.407	S	S	.	.	S	Bend	trans	-79.8	2	-169.5	-60.3	-157.1	147.3	0	0	115.8	R868 L870 D1520	R868-E1524 IonicContact CZ-OE1 3.46Å; R868-E1524 IonicContact NE-OE1 3.8Å; R868-E1524 IonicContact NH2-OE1 2.81Å; R868-E1524 PolarHBondContact NH2-OE1 3.43Å; L870-E1524 VanDerWaalsContact CD1-OE1 3.29Å; L870-E1524 WeakPolarHBondContact CD1-OE1 3Å; L870-E1524 WeakPolarHBondContact CD2-OE1 2.88Å; D1520-E1524 WeakPolarHBondContact O-CB 3.15Å; D1520-E1524 WeakPolarHBondContact O-CG 2.76Å; D1520-E1524 PolarHBondContact O-N 2.74Å
1525	G	54.5	Low	57.7	Low	53 Å²	53	80.4 Å²	80.4	55%	0.546	43%	0.425	S	S	.	.			trans	76	70.7	143.5	0	0	0	0	0	117.4	I1523	I1523-G1525 VanDerWaalsContact C-N 3.26Å; I1523-G1525 PolarHBondContact O-N 2.64Å
1526	G	48.6	Very low	56.2	Low	71 Å²	71	82.8 Å²	82.8	73%	0.732	44%	0.44	S	S	*	.	S	Bend	trans	116.6	7.4	153.3	0	0	0	0	0	117.7
1527	K	46.8	Very low	54.8	Low	197 Å²	197	81.5 Å²	81.5	86%	0.857	44%	0.444	S	S	*	.			trans	-101.1	41.3	168.8	-67.5	-173.6	177.9	-179.9	0	112.5	T1529	K1527-T1529 PolarHBondContact O-N 2.81Å
1528	F	45	Very low	53.7	Low	36 Å²	36	79 Å²	79	16%	0.158	44%	0.435	C	S	.	.			trans	-79.1	57.4	178.8	-159.3	-88.1	0	0	0	111	M843 E852 V1521 T1530 F1533	M843-F1528 HydrophobicContact SD-CE2 4.34Å; M843-F1528 HydrophobicContact SD-CZ 3.8Å; E852-F1528 HydrophobicContact CB-CD1 3.8Å; E852-F1528 HydrophobicContact CB-CE1 4.1Å; E852-F1528 HydrophobicContact CG-CB 4.18Å; E852-F1528 HydrophobicContact CG-CD1 3.63Å; E852-F1528 HydrophobicContact CG-CE1 4.42Å; E852-F1528 HydrophobicContact CG-CG 4.16Å; V1521-F1528 HydrophobicContact CG1-CD2 3.98Å; V1521-F1528 HydrophobicContact CG1-CE2 3.74Å; F1528-T1530 PolarHBondContact O-N 3.33Å; F1528-F1533 HydrophobicContact CE2-CE2 4.39Å; F1528-F1533 HydrophobicContact CZ-CE2 4.17Å
1529	T	36.7	Very low	52.7	Low	85 Å²	85	81.5 Å²	81.5	52%	0.521	45%	0.452	S	S	.	.			trans	-84	116.1	179.2	-48.5	0	0	0	0	109.3	K1527 A1531 F1532	K1527-T1529 PolarHBondContact O-N 2.81Å; T1529-A1531 HydrophobicContact CG2-CB 3.97Å; T1529-A1531 PolarHBondContact O-N 3.24Å; T1529-F1532 PolarHBondContact O-N 3.05Å
1530	T	47	Very low	51.6	Low	100 Å²	100	87.2 Å²	87.2	61%	0.613	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-53	-23.1	-179.7	50.8	0	0	0	0	114.2	F1528 F1532 F1533	F1528-T1530 PolarHBondContact O-N 3.33Å; T1530-F1532 PolarHBondContact O-N 2.88Å; T1530-F1532 VanDerWaalsContact O-N 3.12Å; T1530-F1533 PolarHBondContact O-N 2.81Å
1531	A	48.8	Very low	50.3	Low	58 Å²	58	89.3 Å²	89.3	48%	0.479	49%	0.488	S	S	.	.	G	3₁₀ helix	trans	-57.5	-19.4	172.7	0	0	0	0	0	115.2	T1529	T1529-A1531 HydrophobicContact CG2-CB 3.97Å; T1529-A1531 PolarHBondContact O-N 3.24Å
1532	F	44	Very low	49.1	Very low	175 Å²	175	93.5 Å²	93.5	77%	0.768	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-77.5	-17.4	171.7	-94.3	-84.2	0	0	0	113.9	T1529 T1530	T1529-F1532 PolarHBondContact O-N 3.05Å; T1530-F1532 PolarHBondContact O-N 2.88Å; T1530-F1532 VanDerWaalsContact O-N 3.12Å
1533	F	46.9	Very low	47.8	Very low	65 Å²	65	95 Å²	95	29%	0.285	52%	0.516	S	S	.	.	G	3₁₀ helix	trans	-97.9	29.4	176.2	-73.7	-74	0	0	0	112.2	F1517 F1528 T1530 Q1535 I1538	F1517-F1533 AromaticContact CE1-CE1 3.82Å; F1517-F1533 HydrophobicContact CE1-CE1 3.82Å; F1517-F1533 AromaticContact CE1-CZ 3.66Å; F1517-F1533 HydrophobicContact CE1-CZ 3.66Å; F1517-F1533 HydrophobicContact CZ-CE1 4.16Å; F1517-F1533 AromaticContact CZ-CZ 3.87Å; F1517-F1533 HydrophobicContact CZ-CZ 3.87Å; F1528-F1533 HydrophobicContact CE2-CE2 4.39Å; F1528-F1533 HydrophobicContact CZ-CE2 4.17Å; T1530-F1533 PolarHBondContact O-N 2.81Å; F1533-Q1535 PolarHBondContact O-N 3.36Å; F1533-I1538 HydrophobicContact CB-CD1 4.18Å; F1533-I1538 HydrophobicContact CD1-CD1 4.09Å; F1533-I1538 HydrophobicContact CD1-CG1 4.43Å
1534	K	41.4	Very low	46.3	Very low	149 Å²	149	101.3 Å²	101.3	65%	0.648	55%	0.545	S	S	*	.			trans	-59	135.5	169.4	-81.3	-176.4	176.6	-173.1	0	109.5	N1536 T1537	K1534-N1536 PolarHBondContact O-N 3.28Å; K1534-T1537 PolarHBondContact O-N 2.89Å
1535	Q	46.3	Very low	44.9	Very low	158 Å²	158	100.2 Å²	100.2	74%	0.738	55%	0.546	S	S	*	.	H	α-helix	trans	-50	-40.9	-163.1	-73.5	160.7	-37.5	0	0	113.6	F1533 T1537 I1538 T1539	F1533-Q1535 PolarHBondContact O-N 3.36Å; Q1535-T1537 VanDerWaalsContact C-N 3.34Å; Q1535-T1537 PolarHBondContact O-N 2.87Å; Q1535-T1537 VanDerWaalsContact O-N 3.15Å; Q1535-I1538 CarbonylContact O-C 3.59Å; Q1535-I1538 WeakPolarHBondContact O-CA 3.26Å; Q1535-I1538 WeakPolarHBondContact O-CB 3.43Å; Q1535-I1538 PolarHBondContact O-N 2.7Å; Q1535-T1539 PolarHBondContact O-N 3.12Å; Q1535-T1539 PolarHBondContact O-OG1 3.11Å; Q1535-T1539 VanDerWaalsContact O-OG1 3.06Å
1536	N	45	Very low	43.9	Very low	114 Å²	114	99.9 Å²	99.9	61%	0.61	54%	0.536	S	S	*	.	H	α-helix	trans	-42.8	-52	-179.7	-58.9	48.5	0	0	0	114.2	K1534 I1538 T1539 E1540	K1534-N1536 PolarHBondContact O-N 3.28Å; N1536-I1538 VanDerWaalsContact C-N 3.32Å; N1536-I1538 PolarHBondContact O-N 3.12Å; N1536-T1539 CarbonylContact O-C 3.48Å; N1536-T1539 PolarHBondContact O-N 3.11Å; N1536-E1540 WeakPolarHBondContact O-CB 3.43Å; N1536-E1540 VanDerWaalsContact O-CG 3.29Å; N1536-E1540 WeakPolarHBondContact O-CG 3.48Å; N1536-E1540 PolarHBondContact O-N 3.19Å
1537	T	49	Very low	43.3	Very low	74 Å²	74	97.4 Å²	97.4	45%	0.454	51%	0.511	S	S	.	.	H	α-helix	trans	-72.7	-27	-177.7	-50.1	0	0	0	0	112.3	K1534 Q1535 L1541	K1534-T1537 PolarHBondContact O-N 2.89Å; Q1535-T1537 VanDerWaalsContact C-N 3.34Å; Q1535-T1537 PolarHBondContact O-N 2.87Å; Q1535-T1537 VanDerWaalsContact O-N 3.15Å; T1537-L1541 HydrophobicContact CG2-CD1 4.36Å; T1537-L1541 WeakPolarHBondContact O-CB 3.48Å; T1537-L1541 WeakPolarHBondContact O-CD1 3.46Å; T1537-L1541 WeakPolarHBondContact O-CG 3.15Å; T1537-L1541 PolarHBondContact O-N 3.31Å
1538	I	49	Very low	42.7	Very low	54 Å²	54	95.1 Å²	95.1	28%	0.277	51%	0.507	S	S	.	.	H	α-helix	trans	-70.2	-45.4	170.6	-57.8	177.4	0	0	0	109.1	F1533 Q1535 N1536 E1540 L1541 F1542	F1533-I1538 HydrophobicContact CB-CD1 4.18Å; F1533-I1538 HydrophobicContact CD1-CD1 4.09Å; F1533-I1538 HydrophobicContact CD1-CG1 4.43Å; Q1535-I1538 CarbonylContact O-C 3.59Å; Q1535-I1538 WeakPolarHBondContact O-CA 3.26Å; Q1535-I1538 WeakPolarHBondContact O-CB 3.43Å; Q1535-I1538 PolarHBondContact O-N 2.7Å; N1536-I1538 VanDerWaalsContact C-N 3.32Å; N1536-I1538 PolarHBondContact O-N 3.12Å; I1538-E1540 VanDerWaalsContact C-N 3.33Å; I1538-E1540 PolarHBondContact O-N 3.18Å; I1538-L1541 PolarHBondContact O-N 2.83Å; I1538-F1542 HydrophobicContact CG2-CD2 3.62Å; I1538-F1542 HydrophobicContact CG2-CE2 3.96Å; I1538-F1542 WeakPolarHBondContact O-CB 3.38Å; I1538-F1542 WeakPolarHBondContact O-CD2 3.29Å; I1538-F1542 PolarHBondContact O-N 2.91Å
1539	T	47.2	Very low	42.2	Very low	91 Å²	91	98.5 Å²	98.5	56%	0.558	52%	0.523	S	S	*	.	H	α-helix	trans	-63	-36.3	176	-47.9	0	0	0	0	111.8	Q1535 N1536 A1543	Q1535-T1539 PolarHBondContact O-N 3.12Å; Q1535-T1539 PolarHBondContact O-OG1 3.11Å; Q1535-T1539 VanDerWaalsContact O-OG1 3.06Å; N1536-T1539 CarbonylContact O-C 3.48Å; N1536-T1539 PolarHBondContact O-N 3.11Å; T1539-A1543 WeakPolarHBondContact O-CA 3.24Å; T1539-A1543 WeakPolarHBondContact O-CB 3.12Å; T1539-A1543 PolarHBondContact O-N 3.3Å
1540	E	48.7	Very low	42.3	Very low	129 Å²	129	98 Å²	98	60%	0.603	52%	0.517	S	S	*	.	H	α-helix	trans	-68.6	-36.2	172.7	-73.2	162.1	-178.8	0	0	112.5	N1536 I1538	N1536-E1540 WeakPolarHBondContact O-CB 3.43Å; N1536-E1540 VanDerWaalsContact O-CG 3.29Å; N1536-E1540 WeakPolarHBondContact O-CG 3.48Å; N1536-E1540 PolarHBondContact O-N 3.19Å; I1538-E1540 VanDerWaalsContact C-N 3.33Å; I1538-E1540 PolarHBondContact O-N 3.18Å
1541	L	44.2	Very low	41.7	Very low	97 Å²	97	97.4 Å²	97.4	51%	0.508	51%	0.51	S	S	.	.	H	α-helix	trans	-74.6	-34.3	177.4	-76.3	167.9	0	0	0	113.2	T1537 I1538	T1537-L1541 HydrophobicContact CG2-CD1 4.36Å; T1537-L1541 WeakPolarHBondContact O-CB 3.48Å; T1537-L1541 WeakPolarHBondContact O-CD1 3.46Å; T1537-L1541 WeakPolarHBondContact O-CG 3.15Å; T1537-L1541 PolarHBondContact O-N 3.31Å; I1538-L1541 PolarHBondContact O-N 2.83Å
1542	F	41.5	Very low	41	Very low	125 Å²	125	97.7 Å²	97.7	55%	0.548	51%	0.512	S	S	.	.	H	α-helix	trans	-102.2	-1.8	-179.1	-72.3	-76.8	0	0	0	114.4	I1538 E1544	I1538-F1542 HydrophobicContact CG2-CD2 3.62Å; I1538-F1542 HydrophobicContact CG2-CE2 3.96Å; I1538-F1542 WeakPolarHBondContact O-CB 3.38Å; I1538-F1542 WeakPolarHBondContact O-CD2 3.29Å; I1538-F1542 PolarHBondContact O-N 2.91Å; F1542-E1544 PolarHBondContact O-N 2.99Å; F1542-E1544 VanDerWaalsContact O-N 3.12Å
1543	A	40.1	Very low	40.7	Very low	44 Å²	44	95.8 Å²	95.8	36%	0.364	50%	0.503	S	S	.	.			trans	-57.2	118.5	166.9	0	0	0	0	0	109	R1510 T1539	R1510-A1543 PolarHBondContact NH1-O 2.89Å; T1539-A1543 WeakPolarHBondContact O-CA 3.24Å; T1539-A1543 WeakPolarHBondContact O-CB 3.12Å; T1539-A1543 PolarHBondContact O-N 3.3Å
1544	E	37	Very low	40	Very low	153 Å²	153	100 Å²	100	72%	0.715	53%	0.526	S	S	*	.			trans	-51.1	152.8	166.1	-61.7	-167.6	132.4	0	0	109.9	F1542 S1546	F1542-E1544 PolarHBondContact O-N 2.99Å; F1542-E1544 VanDerWaalsContact O-N 3.12Å; E1544-S1546 PolarHBondContact O-N 3.1Å; E1544-S1546 PolarHBondContact O-OG 2.92Å
1545	P	35.5	Very low	39.6	Very low	76 Å²	76	100.1 Å²	100.1	49%	0.494	53%	0.526	S	S	.	.			trans	-68.9	83.3	177.2	28.9	-34.8	0	0	0	110.7	G1547	P1545-G1547 PolarHBondContact O-N 3.27Å
1546	S	32.7	Very low	38.7	Very low	47 Å²	47	95.9 Å²	95.9	33%	0.329	53%	0.526	S	S	.	.	G	3₁₀ helix	trans	-61.1	-1.4	-178.9	-55.7	0	0	0	0	114.6	E1544 L1548 Q1549 D1550	E1544-S1546 PolarHBondContact O-N 3.1Å; E1544-S1546 PolarHBondContact O-OG 2.92Å; S1546-L1548 PolarHBondContact O-N 3.06Å; S1546-Q1549 CarbonylContact O-C 3.55Å; S1546-Q1549 WeakPolarHBondContact O-CA 3.1Å; S1546-Q1549 WeakPolarHBondContact O-CB 3.49Å; S1546-Q1549 PolarHBondContact O-N 2.94Å; S1546-D1550 PolarHBondContact O-N 3.02Å
1547	G	36.3	Very low	37.8	Very low	19 Å²	19	95.2 Å²	95.2	20%	0.196	53%	0.53	C	S	.	.	G	3₁₀ helix	trans	-58.3	-8.2	173.7	0	0	0	0	0	115.8	P1545	P1545-G1547 PolarHBondContact O-N 3.27Å
1548	L	34.4	Very low	36.8	Very low	148 Å²	148	95.6 Å²	95.6	78%	0.775	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-85.2	-36.7	164.6	-147.8	82.1	0	0	0	112.7	S1546	S1546-L1548 PolarHBondContact O-N 3.06Å
1549	Q	35.1	Very low	35.5	Very low	107 Å²	107	99.6 Å²	99.6	50%	0.5	57%	0.567	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.5	-33.1	175.4	-65.5	-175.6	4.9	0	0	112.4	S1546 L1551 A1552 K1553	S1546-Q1549 CarbonylContact O-C 3.55Å; S1546-Q1549 WeakPolarHBondContact O-CA 3.1Å; S1546-Q1549 WeakPolarHBondContact O-CB 3.49Å; S1546-Q1549 PolarHBondContact O-N 2.94Å; Q1549-L1551 VanDerWaalsContact C-N 3.26Å; Q1549-L1551 PolarHBondContact O-N 2.95Å; Q1549-A1552 CarbonylContact O-C 3.41Å; Q1549-A1552 WeakPolarHBondContact O-CA 3.42Å; Q1549-A1552 WeakPolarHBondContact O-CB 3.18Å; Q1549-A1552 PolarHBondContact O-N 3.37Å; Q1549-K1553 WeakPolarHBondContact O-CG 3.29Å; Q1549-K1553 PolarHBondContact O-N 3.24Å
1550	D	37.4	Very low	34.5	Very low	74 Å²	74	103.2 Å²	103.2	40%	0.396	58%	0.582	S	S	.	*	H	α-helix	trans	-69.1	-28.5	178.2	-59	-34.6	0	0	0	111.4	S1546 A1552 K1553 M1554	S1546-D1550 PolarHBondContact O-N 3.02Å; D1550-A1552 VanDerWaalsContact C-N 3.33Å; D1550-K1553 PolarHBondContact O-N 3.09Å; D1550-M1554 WeakPolarHBondContact O-CB 3.36Å; D1550-M1554 WeakPolarHBondContact O-CG 3.3Å; D1550-M1554 PolarHBondContact O-N 3.37Å
1551	L	35.2	Very low	33.5	Very low	88 Å²	88	103 Å²	103	46%	0.461	59%	0.59	S	S	.	*	H	α-helix	trans	-71.6	-22.8	167.8	-84.3	174.5	0	0	0	113.7	Q1549 K1555	Q1549-L1551 VanDerWaalsContact C-N 3.26Å; Q1549-L1551 PolarHBondContact O-N 2.95Å; L1551-K1555 WeakPolarHBondContact O-CG 3.16Å
1552	A	35	Very low	32.6	Very low	64 Å²	64	103.1 Å²	103.1	53%	0.529	59%	0.588	S	S	.	*	H	α-helix	trans	-79	-44.1	170	0	0	0	0	0	110.7	Q1549 D1550 K1555 G1556	Q1549-A1552 CarbonylContact O-C 3.41Å; Q1549-A1552 WeakPolarHBondContact O-CA 3.42Å; Q1549-A1552 WeakPolarHBondContact O-CB 3.18Å; Q1549-A1552 PolarHBondContact O-N 3.37Å; D1550-A1552 VanDerWaalsContact C-N 3.33Å; A1552-K1555 WeakPolarHBondContact O-CB 3.34Å; A1552-K1555 PolarHBondContact O-N 3.23Å; A1552-K1555 VanDerWaalsContact O-N 3.11Å; A1552-G1556 PolarHBondContact O-N 2.92Å
1553	K	36.4	Very low	31.8	Very low	135 Å²	135	99.7 Å²	99.7	59%	0.587	58%	0.577	S	S	*	*	H	α-helix	trans	-63.7	-45	177.7	-68.6	171.5	-176.1	170	0	112.3	Q1549 D1550 K1555 G1556	Q1549-K1553 WeakPolarHBondContact O-CG 3.29Å; Q1549-K1553 PolarHBondContact O-N 3.24Å; D1550-K1553 PolarHBondContact O-N 3.09Å; K1553-K1555 PolarHBondContact O-N 3.13Å; K1553-K1555 VanDerWaalsContact O-N 3.16Å; K1553-G1556 PolarHBondContact O-N 2.56Å
1554	M	33.6	Very low	31.1	Very low	153 Å²	153	102.1 Å²	102.1	75%	0.754	59%	0.591	S	S	*	*	H	α-helix	trans	-66.9	-10.6	173.7	-78	-169.6	156.1	0	0	114.5	D1550	D1550-M1554 WeakPolarHBondContact O-CB 3.36Å; D1550-M1554 WeakPolarHBondContact O-CG 3.3Å; D1550-M1554 PolarHBondContact O-N 3.37Å
1555	K	33	Very low	30.5	Very low	152 Å²	152	99.4 Å²	99.4	66%	0.661	59%	0.589	S	S	*	*	H	α-helix	trans	-91.5	-13.3	170.4	-85.1	-177	171.3	-177.4	0	113.8	L1551 A1552 K1553	L1551-K1555 WeakPolarHBondContact O-CG 3.16Å; A1552-K1555 WeakPolarHBondContact O-CB 3.34Å; A1552-K1555 PolarHBondContact O-N 3.23Å; A1552-K1555 VanDerWaalsContact O-N 3.11Å; K1553-K1555 PolarHBondContact O-N 3.13Å; K1553-K1555 VanDerWaalsContact O-N 3.16Å
1556	G	27.6	Very low	30	Very low	70 Å²	70	103.8 Å²	103.8	72%	0.722	61%	0.608	S	S	*	*	H	α-helix	trans	-92.3	-15.9	-176.4	0	0	0	0	0	115.5	A1552 K1553	A1552-G1556 PolarHBondContact O-N 2.92Å; K1553-G1556 PolarHBondContact O-N 2.56Å
1557	S	26	Very low	29.8	Very low	100 Å²	100	105.8 Å²	105.8	70%	0.699	62%	0.62	S	S	*	*	S	Bend	trans	-114.8	31.4	-162	67.5	0	0	0	0	114.9
1558	A	26.3	Very low	29.2	Very low	81 Å²	81	113.4 Å²	113.4	67%	0.669	65%	0.65	S	S	*	*	S	Bend	trans	-148.7	24.8	-166.3	0	0	0	0	0	117.5
1559	T	23.5	Very low	28.7	Very low	138 Å²	138	110.8 Å²	110.8	85%	0.847	64%	0.644	S	S	*	*			trans	-153	87.4	169.8	-38.1	0	0	0	0	113.8
1560	L	25.4	Very low	28.3	Very low	167 Å²	167	111.4 Å²	111.4	87%	0.874	65%	0.65	S	S	*	*			trans	-171.1	143.2	151.7	-111.7	164.4	0	0	0	114.4
1561	V	28.1	Very low	28.1	Very low	126 Å²	126	115.9 Å²	115.9	76%	0.764	67%	0.666	S	S	*	*			trans	69.8	133	166.7	-166.7	0	0	0	0	118.7
1562	E	24.1	Very low	27.9	Very low	98 Å²	98	122 Å²	122	46%	0.458	69%	0.689	S	S	.	*			trans	-121.1	159.8	-178.7	-66.5	150.6	113.9	0	0	111.4	E1691 P1692	E1562-E1691 VanDerWaalsContact OE1-CA 3.32Å; E1562-E1691 WeakPolarHBondContact OE1-CA 3.02Å; E1562-E1691 PolarHBondContact OE1-N 3.38Å; E1562-P1692 HydrophobicContact CB-CG 4.01Å; E1562-P1692 HydrophobicContact CG-CG 4.42Å; E1562-P1692 WeakPolarHBondContact OE2-CB 3.44Å; E1562-P1692 WeakPolarHBondContact OE2-CG 3.45Å
1563	T	25.4	Very low	27.5	Very low	54 Å²	54	122 Å²	122	33%	0.331	70%	0.695	S	S	.	*			trans	62.5	115.6	146.4	49.6	0	0	0	0	123.7	E1691 F1693	T1563-E1691 HydrophobicContact CG2-CG 4.27Å; T1563-E1691 WeakPolarHBondContact CG2-OE1 3.28Å; T1563-F1693 HydrophobicContact CG2-CZ 4.24Å; T1563-F1693 WeakPolarHBondContact OG1-CE1 3.31Å; T1563-F1693 WeakPolarHBondContact OG1-CZ 3.46Å
1564	S	24.7	Very low	27	Very low	94 Å²	94	121.5 Å²	121.5	66%	0.657	70%	0.704	S	S	*	*				72.9	155.4	129.7	74.8	0	0	0	0	121.8
1565	S	25.1	Very low	26.5	Very low	96 Å²	96	120.7 Å²	120.7	67%	0.671	70%	0.702	S	S	*	*			cis	-173.1	133.3	-28.9	57.8	0	0	0	0	113.5
1566	L	23.8	Very low	26	Very low	169 Å²	169	118.5 Å²	118.5	89%	0.885	71%	0.706	S	S	*	*			trans	61	-176.6	152.4	-67.9	168.9	0	0	0	116.4
1567	P	28.7	Very low	25.8	Very low	89 Å²	89	121.8 Å²	121.8	58%	0.578	71%	0.708	S	S	*	*			cis	-136.1	179.9	-1.6	44.3	-28	0	0	0	117.4
1568	H	24.7	Very low	25.8	Very low	179 Å²	179	127.1 Å²	127.1	83%	0.829	72%	0.718	S	S	*	*			trans	67.7	156.7	155.4	-59.8	-35.9	0	0	0	119.4
1569	S	23	Very low	25.7	Very low	93 Å²	93	126.9 Å²	126.9	65%	0.65	72%	0.724	S	S	*	*			cis	-174	134.1	-27	56.2	0	0	0	0	111.3
1570	D	28.3	Very low	25.8	Very low	119 Å²	119	125.3 Å²	125.3	64%	0.636	72%	0.719	S	S	*	*			trans	-179.6	123.5	134.6	-105	17.6	0	0	0	119.4
1571	K	33.3	Very low	26.2	Very low	168 Å²	168	124.5 Å²	124.5	73%	0.73	72%	0.72	S	S	*	*				43.2	75.5	126.9	-52.4	-177.4	-167	79.8	0	121.6
1572	K	29.7	Very low	26.6	Very low	217 Å²	217	123.5 Å²	123.5	94%	0.943	72%	0.717	S	S	*	*			trans	176.8	124.3	142	-102.9	166.3	-177.1	177.5	0	110.8
1573	G	27.8	Very low	26.4	Very low	63 Å²	63	128 Å²	128	65%	0.649	74%	0.737	S	S	*	*			cis	168	105.2	-14.4	0	0	0	0	0	114
1574	T	24.8	Very low	26.4	Very low	126 Å²	126	131 Å²	131	77%	0.773	76%	0.761	S	S	*	*			trans	58.1	137.2	148.2	59.2	0	0	0	0	120.2
1575	D	23.3	Very low	26.4	Very low	135 Å²	135	135.5 Å²	135.5	72%	0.722	77%	0.771	S	S	*	*			cis	-166.1	160.6	-5.2	-93.4	-29.6	0	0	0	109
1576	S	23.5	Very low	26.4	Very low	106 Å²	106	135.8 Å²	135.8	74%	0.741	77%	0.766	S	S	*	*			trans	64.7	155.5	165.1	81.4	0	0	0	0	116
1577	N	22.7	Very low	26.4	Very low	140 Å²	140	137.5 Å²	137.5	75%	0.749	76%	0.76	S	S	*	*			cis	179.6	-177.8	-15.7	-100.3	-25.6	0	0	0	104.7
1578	F	26.3	Very low	26.1	Very low	211 Å²	211	139 Å²	139	93%	0.925	77%	0.768	S	S	*	*			trans	70.7	92.9	178.4	-53.4	-84.7	0	0	0	115.6
1579	G	23.2	Very low	26.1	Very low	77 Å²	77	134.5 Å²	134.5	79%	0.794	76%	0.761	S	S	*	*			cis	120.3	93	-10.1	0	0	0	0	0	115.5
1580	S	26	Very low	26.2	Very low	104 Å²	104	134.9 Å²	134.9	73%	0.727	76%	0.759	S	S	*	*			trans	-176.5	144.8	159.8	57.5	0	0	0	0	112.7	P1582	S1580-P1582 WeakPolarHBondContact O-CD 3.33Å
1581	V	33.4	Very low	25.9	Very low	150 Å²	150	132.8 Å²	132.8	91%	0.909	75%	0.751	S	S	*	*				-122.2	99.5	-88.8	-176.1	0	0	0	0	109.2
1582	P	36	Very low	25.6	Very low	106 Å²	106	125.9 Å²	125.9	69%	0.688	73%	0.727	S	S	*	*			trans	-141.6	141.4	179.8	35.4	-15.2	0	0	0	116.4	S1580	S1580-P1582 WeakPolarHBondContact O-CD 3.33Å
1583	Q	21.1	Very low	25.4	Very low	191 Å²	191	121.9 Å²	121.9	89%	0.893	72%	0.715	S	S	*	*			trans	77.5	156.2	173.2	-54.4	-176.1	-38.6	0	0	118.3
1584	S	25.1	Very low	25.3	Very low	118 Å²	118	124.2 Å²	124.2	83%	0.825	72%	0.716	S	S	*	*			trans	60.5	106.3	162.6	64.1	0	0	0	0	121.3
1585	E	24.2	Very low	25.3	Very low	188 Å²	188	126.9 Å²	126.9	88%	0.879	71%	0.712	S	S	*	*			trans	-156.8	150	149.4	-94.4	-176.6	-164.7	0	0	106.5
1586	D	25.1	Very low	25.3	Very low	103 Å²	103	128.5 Å²	128.5	55%	0.551	72%	0.715	S	S	*	*			cis	-161.9	179.8	-23.8	-149.7	0.9	0	0	0	111.5
1587	R	23.5	Very low	25.4	Very low	204 Å²	204	126.4 Å²	126.4	77%	0.77	70%	0.695	S	S	*	*			trans	-30.3	149.8	171.2	-49.5	130.1	-174.7	155.3	-1.7	116.7
1588	V	24.1	Very low	25.5	Very low	122 Å²	122	125.2 Å²	125.2	74%	0.739	68%	0.68	S	S	*	*				173.1	132.3	80.1	167	0	0	0	0	104.8	V1590	V1588-V1590 HydrophobicContact CG1-CG2 4.29Å
1589	A	23.2	Very low	25.6	Very low	83 Å²	83	120 Å²	120	69%	0.686	67%	0.667	S	S	*	*				79.3	162.7	55.3	0	0	0	0	0	116.5
1590	V	24.7	Very low	25.5	Very low	101 Å²	101	121.4 Å²	121.4	61%	0.612	67%	0.671	S	S	*	*			trans	100.6	80.9	167.5	-168.3	0	0	0	0	119.7	V1588	V1588-V1590 HydrophobicContact CG1-CG2 4.29Å
1591	T	23.8	Very low	25.4	Very low	76 Å²	76	119.9 Å²	119.9	47%	0.466	67%	0.672	S	S	.	*				35.3	127.6	110.8	66.4	0	0	0	0	123.3	V1687	T1591-V1687 WeakPolarHBondContact CA-O 3.36Å; T1591-V1687 PolarHBondContact N-O 2.75Å
1592	G	27.1	Very low	24.8	Very low	22 Å²	22	118.7 Å²	118.7	23%	0.227	67%	0.669	C	S	.	*			trans	91.7	146.5	172.7	0	0	0	0	0	113.1	V1687	G1592-V1687 VanDerWaalsContact N-CG1 3.27Å; G1592-V1687 WeakPolarHBondContact O-CG1 3.3Å
1593	I	24.5	Very low	24.2	Very low	134 Å²	134	121.6 Å²	121.6	69%	0.687	68%	0.675	S	S	*	*			cis	-163.6	122.7	12.2	-85.5	130.7	0	0	0	105.8
1594	V	25.1	Very low	24.3	Very low	111 Å²	111	119.7 Å²	119.7	67%	0.673	67%	0.671	S	S	*	*				48	80.2	83.1	-172.3	0	0	0	0	116
1595	R	24.9	Very low	24.3	Very low	183 Å²	183	118.7 Å²	118.7	69%	0.691	66%	0.663	S	S	*	*			trans	166.1	130.4	147.8	-88.6	146.9	-166.7	161.3	5.4	108.5	I1597	R1595-I1597 HydrophobicContact CB-CD1 4.38Å; R1595-I1597 HydrophobicContact CG-CD1 3.84Å; R1595-I1597 HydrophobicContact CG-CG1 4.24Å
1596	E	24.9	Very low	24.3	Very low	169 Å²	169	114.5 Å²	114.5	79%	0.79	66%	0.655	S	S	*	*			cis	70.8	166.7	34.6	-146.5	-151.4	-145.2	0	0	113.8
1597	I	25.3	Very low	24.2	Very low	61 Å²	61	115.6 Å²	115.6	31%	0.313	67%	0.665	S	S	.	*			trans	83.9	71.4	172	-32.3	161.2	0	0	0	117.3	R1595 N2392 T2393 V2394	R1595-I1597 HydrophobicContact CB-CD1 4.38Å; R1595-I1597 HydrophobicContact CG-CD1 3.84Å; R1595-I1597 HydrophobicContact CG-CG1 4.24Å; I1597-N2392 WeakPolarHBondContact CG2-O 3.45Å; I1597-T2393 WeakPolarHBondContact CB-OG1 3.3Å; I1597-T2393 WeakPolarHBondContact CG2-OG1 3.5Å; I1597-T2393 CarbonylContact O-C 3.4Å; I1597-T2393 WeakPolarHBondContact O-CA 3.31Å; I1597-T2393 WeakPolarHBondContact O-CB 3.28Å; I1597-T2393 PolarHBondContact O-OG1 3.23Å; I1597-V2394 PolarHBondContact O-N 2.66Å
1598	R	24.4	Very low	24.3	Very low	116 Å²	116	111 Å²	111	44%	0.438	67%	0.665	S	S	.	*			trans	92.1	173.3	143	-87.2	-165.3	-158.7	68.3	1.7	124.8	I2390 G2391 N2392 T2393 V2394 R2395	R1598-I2390 PolarHBondContact NH2-O 3.31Å; R1598-I2390 VanDerWaalsContact NH2-O 3.12Å; R1598-G2391 PolarHBondContact NE-O 3.39Å; R1598-N2392 WeakPolarHBondContact CB-O 3.46Å; R1598-N2392 WeakPolarHBondContact CD-O 3.32Å; R1598-N2392 PolarHBondContact NH1-O 3.11Å; R1598-T2393 CarbonylContact C-O 3.54Å; R1598-T2393 CarbonylContact O-C 3.37Å; R1598-T2393 VanDerWaalsContact O-O 3.13Å; R1598-V2394 CarbonylContact O-C 3.6Å; R1598-V2394 WeakPolarHBondContact O-CA 3.42Å; R1598-V2394 PolarHBondContact O-N 3.26Å; R1598-V2394 VanDerWaalsContact O-N 3.13Å; R1598-R2395 PolarHBondContact O-N 2.87Å
1599	P	27.1	Very low	24.3	Very low	101 Å²	101	109.5 Å²	109.5	66%	0.656	67%	0.665	S	S	*	*			trans	-115.2	178.5	170.4	39.8	-28.4	0	0	0	115.5
1600	A	22.6	Very low	24.5	Very low	106 Å²	106	111.1 Å²	111.1	88%	0.876	67%	0.671	S	S	*	*			trans	81.1	137.6	159.5	0	0	0	0	0	120.6
1601	G	23.7	Very low	25	Very low	72 Å²	72	111.7 Å²	111.7	74%	0.742	68%	0.677	S	S	*	*			trans	128.7	124.4	153.8	0	0	0	0	0	118.1
1602	C	20.7	Very low	25.2	Very low	125 Å²	125	118.8 Å²	118.8	85%	0.845	70%	0.695	S	S	*	*			trans	40.5	114.6	146.8	-75.1	0	0	0	0	122.9
1603	M	22.8	Very low	25.2	Very low	168 Å²	168	123.9 Å²	123.9	83%	0.828	72%	0.718	S	S	*	*				59.4	131.6	113.2	-71.6	-72.2	173	0	0	122.5
1604	L	24.3	Very low	25.4	Very low	151 Å²	151	123.2 Å²	123.2	79%	0.791	72%	0.719	S	S	*	*			trans	92.8	100.5	146	-70	162	0	0	0	122
1605	S	24.5	Very low	25.6	Very low	96 Å²	96	123.3 Å²	123.3	67%	0.671	73%	0.725	S	S	*	*				78.2	130.3	122.8	62.8	0	0	0	0	124.4
1606	S	23.3	Very low	25.9	Very low	100 Å²	100	117.9 Å²	117.9	70%	0.699	72%	0.72	S	S	*	*			trans	70.5	144.3	140.6	53.7	0	0	0	0	121.5
1607	T	23.9	Very low	26.2	Very low	126 Å²	126	114.6 Å²	114.6	77%	0.773	71%	0.707	S	S	*	*			cis	-167.6	154	-20	24.3	0	0	0	0	111.7
1608	S	24.7	Very low	26.3	Very low	108 Å²	108	117.1 Å²	117.1	76%	0.755	72%	0.718	S	S	*	*			trans	66	136	142.2	63.4	0	0	0	0	124.8
1609	A	25.9	Very low	26.4	Very low	91 Å²	91	116.1 Å²	116.1	75%	0.752	73%	0.728	S	S	*	*			trans	71.3	127.1	150.2	0	0	0	0	0	119.3
1610	S	26.5	Very low	26.4	Very low	116 Å²	116	118 Å²	118	81%	0.811	74%	0.738	S	S	*	*			cis	104.6	152.1	14.7	90.9	0	0	0	0	115.2
1611	P	35.9	Very low	26.7	Very low	114 Å²	114	115.7 Å²	115.7	74%	0.74	73%	0.725	S	S	*	*			trans	-127	-167.2	-130.1	45.1	-33.3	0	0	0	114.9
1612	R	27.7	Very low	27	Very low	224 Å²	224	118.2 Å²	118.2	85%	0.845	73%	0.728	S	S	*	*			trans	174.6	156.4	138.7	-105.9	176.2	-170.2	170.5	2.8	121.3
1613	D	27.6	Very low	27.4	Very low	130 Å²	130	119.3 Å²	119.3	70%	0.695	72%	0.724	S	S	*	*			trans	100.4	107.1	134.1	-71.4	-9.7	0	0	0	126.8
1614	V	28.9	Very low	27.6	Very low	119 Å²	119	116.6 Å²	116.6	72%	0.721	72%	0.721	S	S	*	*				103.8	125.2	110.9	167.9	0	0	0	0	124.9
1615	S	28.3	Very low	27.8	Very low	113 Å²	113	114.9 Å²	114.9	79%	0.79	71%	0.713	S	S	*	*			trans	78.2	156.5	149.4	69	0	0	0	0	123.4
1616	A	30.4	Very low	28.5	Very low	70 Å²	70	114.6 Å²	114.6	58%	0.579	71%	0.711	S	S	*	*			cis	-176	165.8	-31.9	0	0	0	0	0	113.6
1617	N	31.2	Very low	29.1	Very low	99 Å²	99	115.3 Å²	115.3	53%	0.529	70%	0.703	S	S	.	*			trans	95	114.3	152.4	-72.2	19.1	0	0	0	125.6	Y2070	N1617-Y2070 PolarHBondContact OD1-OH 3.47Å
1618	E	27.1	Very low	29.8	Very low	115 Å²	115	112.2 Å²	112.2	54%	0.537	69%	0.69	S	S	.	*				84	96.5	125	-63.1	-171.2	133.5	0	0	125.8	H2069	E1618-H2069 IonicContact OE1-CE1 2.76Å; E1618-H2069 PolarHBondContact OE1-CE1 2.94Å; E1618-H2069 VanDerWaalsContact OE1-CE1 3.28Å; E1618-H2069 IonicContact OE1-ND1 3.27Å
1619	S	28.1	Very low	30.4	Very low	94 Å²	94	113 Å²	113	66%	0.657	68%	0.682	S	S	*	*				106.7	114.5	120.5	77.8	0	0	0	0	122.3
1620	T	26.9	Very low	31.2	Very low	141 Å²	141	113.8 Å²	113.8	87%	0.865	67%	0.673	S	S	*	*				169.2	132.6	117.2	33.5	0	0	0	0	114.8
1621	G	28.7	Very low	32.1	Very low	57 Å²	57	113.2 Å²	113.2	59%	0.588	66%	0.658	S	S	*	*			trans	61.8	107.7	146.8	0	0	0	0	0	120.9
1622	P	30.6	Very low	32.6	Very low	125 Å²	125	110.4 Å²	110.4	81%	0.812	64%	0.644	S	S	*	*			trans	-77.6	143.3	-177.9	31.9	-35.7	0	0	0	114.5
1623	I	28.7	Very low	33.2	Very low	148 Å²	148	104.8 Å²	104.8	76%	0.759	63%	0.631	S	S	*	*			trans	-124.9	125.4	167.9	-62.9	178	0	0	0	108.8
1624	S	27.2	Very low	34.2	Very low	111 Å²	111	103.7 Å²	103.7	78%	0.776	62%	0.624	S	S	*	*			trans	-75.4	119.2	178.2	52.3	0	0	0	0	112.1
1625	N	28.8	Very low	35.1	Very low	116 Å²	116	100.8 Å²	100.8	62%	0.62	61%	0.605	S	S	*	*			trans	-161.5	7.7	170.7	-102.2	-20.2	0	0	0	116.5
1626	S	38.2	Very low	36.1	Very low	89 Å²	89	97.7 Å²	97.7	62%	0.622	59%	0.586	S	S	*	*	H	α-helix	trans	-82.8	-32	-165	47.8	0	0	0	0	117.1	A1628 Q1629 L1630	S1626-A1628 VanDerWaalsContact C-N 3.34Å; S1626-A1628 PolarHBondContact O-N 3.19Å; S1626-Q1629 PolarHBondContact O-N 3.14Å; S1626-L1630 PolarHBondContact O-N 3.49Å
1627	E	36	Very low	36.9	Very low	115 Å²	115	98.3 Å²	98.3	54%	0.537	59%	0.585	S	S	.	*	H	α-helix	trans	-65.2	-38.5	179.7	-163.8	172.7	175.9	0	0	111	R1385 Q1629 L1630 E1631	R1385-E1627 IonicContact CZ-OE1 2.68Å; R1385-E1627 VanDerWaalsContact CZ-OE1 3.26Å; R1385-E1627 IonicContact NH1-OE1 3.88Å; R1385-E1627 PolarHBondContact NH1-OE1 2.91Å; R1385-E1627 IonicContact NH2-OE1 2.69Å; R1385-E1627 PolarHBondContact NH2-OE1 3.12Å; R1385-E1627 IonicContact NH2-OE2 3.12Å; E1627-Q1629 PolarHBondContact O-N 3.43Å; E1627-L1630 PolarHBondContact O-N 3.3Å; E1627-E1631 PolarHBondContact O-N 2.8Å
1628	A	38.1	Very low	37.4	Very low	61 Å²	61	98.4 Å²	98.4	50%	0.504	58%	0.582	S	S	.	*	H	α-helix	trans	-69.7	-28.5	175.2	0	0	0	0	0	113.5	S1626 A1632	S1626-A1628 VanDerWaalsContact C-N 3.34Å; S1626-A1628 PolarHBondContact O-N 3.19Å; A1628-A1632 VanDerWaalsContact O-CB 3.3Å; A1628-A1632 WeakPolarHBondContact O-CB 3.44Å; A1628-A1632 PolarHBondContact O-N 2.99Å
1629	Q	38.2	Very low	38.6	Very low	125 Å²	125	96.4 Å²	96.4	58%	0.584	57%	0.573	S	S	*	*	H	α-helix	trans	-74.9	-29.6	172.2	-74.2	-178.4	-31.5	0	0	112.1	S1626 E1627 L1633	S1626-Q1629 PolarHBondContact O-N 3.14Å; E1627-Q1629 PolarHBondContact O-N 3.43Å; Q1629-L1633 VanDerWaalsContact O-CB 3.29Å; Q1629-L1633 WeakPolarHBondContact O-CB 3.36Å; Q1629-L1633 VanDerWaalsContact O-CG 3.28Å; Q1629-L1633 WeakPolarHBondContact O-CG 3.35Å; Q1629-L1633 PolarHBondContact O-N 3.14Å
1630	L	42.7	Very low	39.7	Very low	108 Å²	108	95.8 Å²	95.8	57%	0.565	56%	0.56	S	S	*	*	H	α-helix	trans	-73.4	-37.8	170.2	-80.5	166.5	0	0	0	112.4	S1626 E1627 L1633 L1634	S1626-L1630 PolarHBondContact O-N 3.49Å; E1627-L1630 PolarHBondContact O-N 3.3Å; L1630-L1633 PolarHBondContact O-N 3.28Å; L1630-L1634 WeakPolarHBondContact O-CB 3.37Å; L1630-L1634 WeakPolarHBondContact O-CG 3.41Å; L1630-L1634 PolarHBondContact O-N 3.3Å
1631	E	45.7	Very low	40.9	Very low	103 Å²	103	91.6 Å²	91.6	48%	0.481	54%	0.536	S	S	.	.	H	α-helix	trans	-61.3	-44.7	167	-83.4	-168.3	147.9	0	0	111	E1627 L1633 L1634 D1635	E1627-E1631 PolarHBondContact O-N 2.8Å; E1631-L1633 PolarHBondContact O-N 3.27Å; E1631-L1634 PolarHBondContact O-N 2.76Å; E1631-D1635 WeakPolarHBondContact O-CB 3.4Å; E1631-D1635 PolarHBondContact O-N 3.49Å
1632	A	45.9	Very low	41.7	Very low	56 Å²	56	90.3 Å²	90.3	46%	0.463	52%	0.516	S	S	.	.	H	α-helix	trans	-66.3	-34.1	177.7	0	0	0	0	0	113.5	A1628 A1636	A1628-A1632 VanDerWaalsContact O-CB 3.3Å; A1628-A1632 WeakPolarHBondContact O-CB 3.44Å; A1628-A1632 PolarHBondContact O-N 2.99Å; A1632-A1636 VanDerWaalsContact O-CB 3.23Å; A1632-A1636 WeakPolarHBondContact O-CB 3.3Å; A1632-A1636 PolarHBondContact O-N 2.87Å
1633	L	39.6	Very low	43	Very low	106 Å²	106	90.9 Å²	90.9	56%	0.555	50%	0.502	S	S	*	.	H	α-helix	trans	-73.7	-31.8	173.5	-78.5	167.6	0	0	0	112.1	Q1629 L1630 E1631 A1636 C1637	Q1629-L1633 VanDerWaalsContact O-CB 3.29Å; Q1629-L1633 WeakPolarHBondContact O-CB 3.36Å; Q1629-L1633 VanDerWaalsContact O-CG 3.28Å; Q1629-L1633 WeakPolarHBondContact O-CG 3.35Å; Q1629-L1633 PolarHBondContact O-N 3.14Å; L1630-L1633 PolarHBondContact O-N 3.28Å; E1631-L1633 PolarHBondContact O-N 3.27Å; L1633-A1636 PolarHBondContact O-N 3.5Å; L1633-C1637 WeakPolarHBondContact O-CB 3.42Å; L1633-C1637 PolarHBondContact O-N 3.11Å; L1633-C1637 PolarHBondContact O-SG 2.96Å
1634	L	48.5	Very low	44.3	Very low	107 Å²	107	87.7 Å²	87.7	56%	0.56	49%	0.485	S	S	*	.	H	α-helix	trans	-70.2	-45.7	170.2	-77.6	165.5	0	0	0	111.3	L1630 E1631 A1636 C1637 E1638	L1630-L1634 WeakPolarHBondContact O-CB 3.37Å; L1630-L1634 WeakPolarHBondContact O-CG 3.41Å; L1630-L1634 PolarHBondContact O-N 3.3Å; E1631-L1634 PolarHBondContact O-N 2.76Å; L1634-A1636 PolarHBondContact O-N 3.41Å; L1634-C1637 PolarHBondContact O-N 2.82Å; L1634-E1638 WeakPolarHBondContact O-CB 3.17Å; L1634-E1638 WeakPolarHBondContact O-CG 3.17Å; L1634-E1638 PolarHBondContact O-N 3.28Å
1635	D	48	Very low	45.5	Very low	58 Å²	58	82.9 Å²	82.9	31%	0.31	45%	0.452	S	S	.	.	H	α-helix	trans	-56.3	-39.5	170.6	-95.8	-18.3	0	0	0	110.4	R1379 E1631 E1639	R1379-D1635 IonicContact NH2-OD2 2.66Å; E1631-D1635 WeakPolarHBondContact O-CB 3.4Å; E1631-D1635 PolarHBondContact O-N 3.49Å; D1635-E1639 VanDerWaalsContact O-CB 3.27Å; D1635-E1639 WeakPolarHBondContact O-CB 3.37Å; D1635-E1639 WeakPolarHBondContact O-CG 2.96Å; D1635-E1639 PolarHBondContact O-N 3.19Å
1636	A	49.4	Very low	46.6	Very low	48 Å²	48	80.8 Å²	80.8	40%	0.397	44%	0.443	S	S	.	.	H	α-helix	trans	-72.2	-37.4	176.3	0	0	0	0	0	113.7	A1632 L1633 L1634 E1640	A1632-A1636 VanDerWaalsContact O-CB 3.23Å; A1632-A1636 WeakPolarHBondContact O-CB 3.3Å; A1632-A1636 PolarHBondContact O-N 2.87Å; L1633-A1636 PolarHBondContact O-N 3.5Å; L1634-A1636 PolarHBondContact O-N 3.41Å; A1636-E1640 WeakPolarHBondContact O-CB 3.13Å; A1636-E1640 PolarHBondContact O-N 3.32Å
1637	C	46.6	Very low	47.6	Very low	83 Å²	83	85 Å²	85	56%	0.561	45%	0.446	S	S	*	.	H	α-helix	trans	-70.2	-36.3	173.8	-70.4	0	0	0	0	111.6	L1633 L1634 S1641	L1633-C1637 WeakPolarHBondContact O-CB 3.42Å; L1633-C1637 PolarHBondContact O-N 3.11Å; L1633-C1637 PolarHBondContact O-SG 2.96Å; L1634-C1637 PolarHBondContact O-N 2.82Å; C1637-S1641 VanDerWaalsContact O-CB 3.32Å; C1637-S1641 WeakPolarHBondContact O-CB 3.18Å; C1637-S1641 PolarHBondContact O-N 3.46Å
1638	E	42.9	Very low	48.7	Very low	100 Å²	100	87.6 Å²	87.6	47%	0.467	45%	0.451	S	S	.	.	H	α-helix	trans	-69	-43.7	172.3	-74.2	-165.3	-167.5	0	0	110.6	L1634 E1640 S1641 D1642	L1634-E1638 WeakPolarHBondContact O-CB 3.17Å; L1634-E1638 WeakPolarHBondContact O-CG 3.17Å; L1634-E1638 PolarHBondContact O-N 3.28Å; E1638-E1640 PolarHBondContact O-N 3.46Å; E1638-S1641 CarbonylContact O-C 3.59Å; E1638-S1641 PolarHBondContact O-N 2.79Å; E1638-S1641 VanDerWaalsContact O-N 3.16Å; E1638-S1641 PolarHBondContact O-OG 2.73Å; E1638-D1642 WeakPolarHBondContact O-CB 3.25Å; E1638-D1642 PolarHBondContact O-N 2.81Å
1639	E	52.6	Low	49.7	Very low	73 Å²	73	88.8 Å²	88.8	34%	0.341	45%	0.452	S	S	.	.	H	α-helix	trans	-59.1	-41.4	172	-84.5	-173.4	-152.3	0	0	112.4	R889 D1635 D1642 R1643	R889-E1639 IonicContact CZ-OE1 2.71Å; R889-E1639 IonicContact NH1-OE1 3.45Å; R889-E1639 PolarHBondContact NH1-OE1 2.78Å; R889-E1639 IonicContact NH2-OE1 2.77Å; R889-E1639 PolarHBondContact NH2-OE1 2.79Å; D1635-E1639 VanDerWaalsContact O-CB 3.27Å; D1635-E1639 WeakPolarHBondContact O-CB 3.37Å; D1635-E1639 WeakPolarHBondContact O-CG 2.96Å; D1635-E1639 PolarHBondContact O-N 3.19Å; E1639-D1642 CarbonylContact O-C 3.53Å; E1639-D1642 PolarHBondContact O-N 3.46Å; E1639-R1643 WeakPolarHBondContact O-CB 3.42Å; E1639-R1643 VanDerWaalsContact O-CG 3.27Å; E1639-R1643 WeakPolarHBondContact O-CG 3.4Å; E1639-R1643 PolarHBondContact O-N 2.71Å
1640	E	51.3	Low	50.9	Low	82 Å²	82	86.2 Å²	86.2	38%	0.383	44%	0.442	S	S	.	.	H	α-helix	trans	-72.2	-32.4	175.2	-163.3	56.6	-129.5	0	0	111.8	A1636 E1638 D1642 R1643 I1644	A1636-E1640 WeakPolarHBondContact O-CB 3.13Å; A1636-E1640 PolarHBondContact O-N 3.32Å; E1638-E1640 PolarHBondContact O-N 3.46Å; E1640-D1642 VanDerWaalsContact C-N 3.31Å; E1640-D1642 PolarHBondContact O-N 3.45Å; E1640-R1643 PolarHBondContact O-N 2.95Å; E1640-R1643 WeakPolarHBondContact OE2-CD 3.44Å; E1640-R1643 IonicContact OE2-CZ 2.81Å; E1640-R1643 IonicContact OE2-NE 3.83Å; E1640-R1643 IonicContact OE2-NH1 2.85Å; E1640-R1643 PolarHBondContact OE2-NH1 3.39Å; E1640-I1644 HydrophobicContact CG-CD1 4.39Å; E1640-I1644 WeakPolarHBondContact O-CB 3.27Å; E1640-I1644 VanDerWaalsContact O-CG1 3.25Å; E1640-I1644 WeakPolarHBondContact O-CG1 3.38Å; E1640-I1644 PolarHBondContact O-N 3.09Å
1641	S	51.3	Low	51.7	Low	52 Å²	52	84.9 Å²	84.9	36%	0.364	44%	0.435	S	S	.	.	H	α-helix	trans	-66.7	-33.2	170	89.3	0	0	0	0	112.6	C1637 E1638 A1645	C1637-S1641 VanDerWaalsContact O-CB 3.32Å; C1637-S1641 WeakPolarHBondContact O-CB 3.18Å; C1637-S1641 PolarHBondContact O-N 3.46Å; E1638-S1641 CarbonylContact O-C 3.59Å; E1638-S1641 PolarHBondContact O-N 2.79Å; E1638-S1641 VanDerWaalsContact O-N 3.16Å; E1638-S1641 PolarHBondContact O-OG 2.73Å; S1641-A1645 WeakPolarHBondContact O-CB 3.28Å; S1641-A1645 PolarHBondContact O-N 2.66Å
1642	D	46.4	Very low	52.5	Low	31 Å²	31	84.4 Å²	84.4	17%	0.166	43%	0.433	C	S	.	.	H	α-helix	trans	-77.1	-31.9	174.7	-105.6	7.5	0	0	0	111	R892 R895 E1638 E1639 E1640 A1645 T1646	R892-D1642 WeakPolarHBondContact CD-OD1 3.47Å; R895-D1642 IonicContact CZ-OD2 3.65Å; R895-D1642 IonicContact NH1-OD2 2.7Å; R895-D1642 PolarHBondContact NH1-OD2 3.4Å; R895-D1642 IonicContact NH2-OD2 3.58Å; R895-D1642 PolarHBondContact NH2-OD2 2.74Å; R895-D1642 VanDerWaalsContact NH2-OD2 3.1Å; E1638-D1642 WeakPolarHBondContact O-CB 3.25Å; E1638-D1642 PolarHBondContact O-N 2.81Å; E1639-D1642 CarbonylContact O-C 3.53Å; E1639-D1642 PolarHBondContact O-N 3.46Å; E1640-D1642 VanDerWaalsContact C-N 3.31Å; E1640-D1642 PolarHBondContact O-N 3.45Å; D1642-A1645 PolarHBondContact O-N 2.8Å; D1642-T1646 VanDerWaalsContact O-CB 3.3Å; D1642-T1646 WeakPolarHBondContact O-CB 3.35Å; D1642-T1646 VanDerWaalsContact O-CG2 3.3Å; D1642-T1646 WeakPolarHBondContact O-CG2 3.02Å; D1642-T1646 PolarHBondContact O-N 2.78Å; D1642-T1646 PolarHBondContact O-OG1 2.85Å
1643	R	57.2	Low	53.1	Low	137 Å²	137	83.7 Å²	83.7	52%	0.517	43%	0.427	S	S	.	.	H	α-helix	trans	-65.8	-47	167.6	-74.1	164.9	-176.8	-179	4	110.6	E1639 E1640 A1645 T1646 R1647	E1639-R1643 WeakPolarHBondContact O-CB 3.42Å; E1639-R1643 VanDerWaalsContact O-CG 3.27Å; E1639-R1643 WeakPolarHBondContact O-CG 3.4Å; E1639-R1643 PolarHBondContact O-N 2.71Å; E1640-R1643 PolarHBondContact O-N 2.95Å; E1640-R1643 WeakPolarHBondContact OE2-CD 3.44Å; E1640-R1643 IonicContact OE2-CZ 2.81Å; E1640-R1643 IonicContact OE2-NE 3.83Å; E1640-R1643 IonicContact OE2-NH1 2.85Å; E1640-R1643 PolarHBondContact OE2-NH1 3.39Å; R1643-A1645 VanDerWaalsContact C-N 3.29Å; R1643-A1645 PolarHBondContact O-N 3.1Å; R1643-T1646 WeakPolarHBondContact CA-OG1 3.34Å; R1643-T1646 PolarHBondContact O-N 3.3Å; R1643-T1646 PolarHBondContact O-OG1 3.48Å; R1643-R1647 WeakPolarHBondContact O-CA 3.26Å; R1643-R1647 WeakPolarHBondContact O-CB 3.19Å; R1643-R1647 PolarHBondContact O-N 2.72Å
1644	I	55.9	Low	54.1	Low	81 Å²	81	84.8 Å²	84.8	42%	0.415	43%	0.427	S	S	.	.	H	α-helix	trans	-62.6	-37.7	174.7	-68.2	163.7	0	0	0	110.9	E1640 R1648	E1640-I1644 HydrophobicContact CG-CD1 4.39Å; E1640-I1644 WeakPolarHBondContact O-CB 3.27Å; E1640-I1644 VanDerWaalsContact O-CG1 3.25Å; E1640-I1644 WeakPolarHBondContact O-CG1 3.38Å; E1640-I1644 PolarHBondContact O-N 3.09Å; I1644-R1648 WeakPolarHBondContact O-CB 3.41Å; I1644-R1648 WeakPolarHBondContact O-CG 3.18Å; I1644-R1648 PolarHBondContact O-N 2.83Å
1645	A	53	Low	54.8	Low	10 Å²	10	81.8 Å²	81.8	8%	0.083	42%	0.418	C	S	.	.	H	α-helix	trans	-71.8	-46.2	177.1	0	0	0	0	0	113.1	R892 S1641 D1642 R1643 R1647 R1648 V1649	R892-A1645 VanDerWaalsContact CZ-CB 3.41Å; S1641-A1645 WeakPolarHBondContact O-CB 3.28Å; S1641-A1645 PolarHBondContact O-N 2.66Å; D1642-A1645 PolarHBondContact O-N 2.8Å; R1643-A1645 VanDerWaalsContact C-N 3.29Å; R1643-A1645 PolarHBondContact O-N 3.1Å; A1645-R1647 VanDerWaalsContact C-N 3.3Å; A1645-R1648 PolarHBondContact O-N 3.42Å; A1645-V1649 WeakPolarHBondContact O-CG2 3.33Å; A1645-V1649 PolarHBondContact O-N 3.12Å
1646	T	50.4	Low	55.1	Low	71 Å²	71	83 Å²	83	44%	0.436	42%	0.424	S	S	.	.	H	α-helix	trans	-69.6	-28.9	175.9	52.4	0	0	0	0	111.9	D1642 R1643 L1650	D1642-T1646 VanDerWaalsContact O-CB 3.3Å; D1642-T1646 WeakPolarHBondContact O-CB 3.35Å; D1642-T1646 VanDerWaalsContact O-CG2 3.3Å; D1642-T1646 WeakPolarHBondContact O-CG2 3.02Å; D1642-T1646 PolarHBondContact O-N 2.78Å; D1642-T1646 PolarHBondContact O-OG1 2.85Å; R1643-T1646 WeakPolarHBondContact CA-OG1 3.34Å; R1643-T1646 PolarHBondContact O-N 3.3Å; R1643-T1646 PolarHBondContact O-OG1 3.48Å; T1646-L1650 VanDerWaalsContact O-CB 3.23Å; T1646-L1650 WeakPolarHBondContact O-CB 3.41Å; T1646-L1650 WeakPolarHBondContact O-CG 3.5Å; T1646-L1650 PolarHBondContact O-N 2.7Å
1647	R	59	Low	55.6	Low	177 Å²	177	85.9 Å²	85.9	67%	0.668	43%	0.433	S	S	*	.	H	α-helix	trans	-67.6	-47.6	168.9	-166.9	168.9	-165.3	152.3	3.8	110.6	R1643 A1645 V1649 L1650 D1651	R1643-R1647 WeakPolarHBondContact O-CA 3.26Å; R1643-R1647 WeakPolarHBondContact O-CB 3.19Å; R1643-R1647 PolarHBondContact O-N 2.72Å; A1645-R1647 VanDerWaalsContact C-N 3.3Å; R1647-V1649 VanDerWaalsContact C-N 3.35Å; R1647-V1649 PolarHBondContact O-N 2.94Å; R1647-L1650 CarbonylContact O-C 3.58Å; R1647-L1650 PolarHBondContact O-N 2.94Å; R1647-L1650 VanDerWaalsContact O-N 3.13Å; R1647-D1651 WeakPolarHBondContact CG-OD2 3.36Å; R1647-D1651 VanDerWaalsContact O-CB 3.29Å; R1647-D1651 WeakPolarHBondContact O-CB 3.17Å; R1647-D1651 PolarHBondContact O-N 3.41Å
1648	R	59.3	Low	55.8	Low	170 Å²	170	84.6 Å²	84.6	64%	0.642	43%	0.428	S	S	*	.	H	α-helix	trans	-58.8	-40.6	171.1	-76.9	-179	-170.5	177.9	4.5	113.4	I1644 A1645 D1651 E1652	I1644-R1648 WeakPolarHBondContact O-CB 3.41Å; I1644-R1648 WeakPolarHBondContact O-CG 3.18Å; I1644-R1648 PolarHBondContact O-N 2.83Å; A1645-R1648 PolarHBondContact O-N 3.42Å; R1648-D1651 PolarHBondContact O-N 3.01Å; R1648-E1652 VanDerWaalsContact O-CB 3.32Å; R1648-E1652 WeakPolarHBondContact O-CB 3.31Å; R1648-E1652 WeakPolarHBondContact O-CG 3.2Å; R1648-E1652 PolarHBondContact O-N 3.42Å
1649	V	59.7	Low	56.3	Low	87 Å²	87	87.3 Å²	87.3	53%	0.527	44%	0.441	S	S	.	.	H	α-helix	trans	-70.9	-31.8	176	171.8	0	0	0	0	111.6	A1645 R1647 A1653	A1645-V1649 WeakPolarHBondContact O-CG2 3.33Å; A1645-V1649 PolarHBondContact O-N 3.12Å; R1647-V1649 VanDerWaalsContact C-N 3.35Å; R1647-V1649 PolarHBondContact O-N 2.94Å; V1649-A1653 WeakPolarHBondContact O-CB 3.49Å; V1649-A1653 PolarHBondContact O-N 3.47Å
1650	L	63.1	Low	55.9	Low	71 Å²	71	92.2 Å²	92.2	37%	0.372	46%	0.461	S	S	.	.	H	α-helix	trans	-73.4	-31.6	170.6	-86.2	161.4	0	0	0	112.7	T1646 R1647 K1654	T1646-L1650 VanDerWaalsContact O-CB 3.23Å; T1646-L1650 WeakPolarHBondContact O-CB 3.41Å; T1646-L1650 WeakPolarHBondContact O-CG 3.5Å; T1646-L1650 PolarHBondContact O-N 2.7Å; R1647-L1650 CarbonylContact O-C 3.58Å; R1647-L1650 PolarHBondContact O-N 2.94Å; R1647-L1650 VanDerWaalsContact O-N 3.13Å; L1650-K1654 WeakPolarHBondContact O-CB 3.38Å; L1650-K1654 WeakPolarHBondContact O-CD 3.3Å; L1650-K1654 WeakPolarHBondContact O-CG 3.47Å; L1650-K1654 PolarHBondContact O-N 2.73Å
1651	D	59.6	Low	55.2	Low	80 Å²	80	94.2 Å²	94.2	43%	0.428	47%	0.47	S	S	.	.	H	α-helix	trans	-80.8	-31.7	178.6	-63.7	-23.9	0	0	0	110.3	R1647 R1648 A1655	R1647-D1651 WeakPolarHBondContact CG-OD2 3.36Å; R1647-D1651 VanDerWaalsContact O-CB 3.29Å; R1647-D1651 WeakPolarHBondContact O-CB 3.17Å; R1647-D1651 PolarHBondContact O-N 3.41Å; R1648-D1651 PolarHBondContact O-N 3.01Å; D1651-A1655 WeakPolarHBondContact O-CB 3.27Å; D1651-A1655 PolarHBondContact O-N 3.41Å
1652	E	63.9	Low	54.4	Low	92 Å²	92	97.8 Å²	97.8	43%	0.43	48%	0.481	S	S	.	.	H	α-helix	trans	-65.9	-50.9	163.4	-77.2	173.5	-156.3	0	0	110.6	R1648 K1654 A1655 D1656 R2001	R1648-E1652 VanDerWaalsContact O-CB 3.32Å; R1648-E1652 WeakPolarHBondContact O-CB 3.31Å; R1648-E1652 WeakPolarHBondContact O-CG 3.2Å; R1648-E1652 PolarHBondContact O-N 3.42Å; E1652-K1654 PolarHBondContact O-N 3.28Å; E1652-A1655 CarbonylContact O-C 3.36Å; E1652-A1655 WeakPolarHBondContact O-CA 3.25Å; E1652-A1655 WeakPolarHBondContact O-CB 3.42Å; E1652-A1655 PolarHBondContact O-N 3.18Å; E1652-D1656 PolarHBondContact O-N 2.96Å; E1652-R2001 IonicContact OE2-NH1 2.74Å; E1652-R2001 PolarHBondContact OE2-NH1 3.31Å
1653	A	58	Low	53.8	Low	41 Å²	41	101 Å²	101	34%	0.339	49%	0.494	S	S	.	.	H	α-helix	trans	-64.7	-28.4	177.7	0	0	0	0	0	112.9	V1649 L1657	V1649-A1653 WeakPolarHBondContact O-CB 3.49Å; V1649-A1653 PolarHBondContact O-N 3.47Å; A1653-L1657 WeakPolarHBondContact O-CB 3.34Å; A1653-L1657 WeakPolarHBondContact O-CD1 3.02Å; A1653-L1657 VanDerWaalsContact O-CG 3.24Å; A1653-L1657 WeakPolarHBondContact O-CG 3.48Å; A1653-L1657 PolarHBondContact O-N 3.33Å
1654	K	59.9	Low	52.4	Low	129 Å²	129	98.6 Å²	98.6	56%	0.561	50%	0.498	S	S	*	.	H	α-helix	trans	-76.2	-27.8	168.7	-79.1	171.1	175.4	-172.9	0	112.8	L1650 E1652 A1658	L1650-K1654 WeakPolarHBondContact O-CB 3.38Å; L1650-K1654 WeakPolarHBondContact O-CD 3.3Å; L1650-K1654 WeakPolarHBondContact O-CG 3.47Å; L1650-K1654 PolarHBondContact O-N 2.73Å; E1652-K1654 PolarHBondContact O-N 3.28Å; K1654-A1658 WeakPolarHBondContact O-CB 3.18Å; K1654-A1658 PolarHBondContact O-N 2.9Å
1655	A	64.2	Low	51.2	Low	45 Å²	45	98.2 Å²	98.2	37%	0.372	50%	0.501	S	S	.	.	H	α-helix	trans	-68.4	-50.5	169.4	0	0	0	0	0	109.7	D1651 E1652 L1657 A1658 E1659	D1651-A1655 WeakPolarHBondContact O-CB 3.27Å; D1651-A1655 PolarHBondContact O-N 3.41Å; E1652-A1655 CarbonylContact O-C 3.36Å; E1652-A1655 WeakPolarHBondContact O-CA 3.25Å; E1652-A1655 WeakPolarHBondContact O-CB 3.42Å; E1652-A1655 PolarHBondContact O-N 3.18Å; A1655-L1657 PolarHBondContact O-N 2.82Å; A1655-A1658 CarbonylContact O-C 3.56Å; A1655-A1658 PolarHBondContact O-N 3.16Å; A1655-A1658 VanDerWaalsContact O-N 3.17Å; A1655-E1659 WeakPolarHBondContact O-CB 3.46Å; A1655-E1659 WeakPolarHBondContact O-CG 3.23Å; A1655-E1659 PolarHBondContact O-N 3.02Å
1656	D	54.1	Low	50	Low	82 Å²	82	107.1 Å²	107.1	44%	0.439	53%	0.533	S	S	.	.	H	α-helix	trans	-53.6	-37.6	172.8	-71.9	48.6	0	0	0	112.3	E1652 F1660 R2001	E1652-D1656 PolarHBondContact O-N 2.96Å; D1656-F1660 WeakPolarHBondContact O-CD2 3.38Å; D1656-R2001 IonicContact OD1-NH2 3.1Å; D1656-R2001 PolarHBondContact OD1-NH2 2.75Å; D1656-R2001 IonicContact OD2-CZ 2.87Å; D1656-R2001 IonicContact OD2-NH2 3.76Å; D1656-R2001 PolarHBondContact OD2-NH2 2.78Å
1657	L	59.7	Low	48.9	Very low	110 Å²	110	109.6 Å²	109.6	58%	0.576	54%	0.544	S	S	*	.	H	α-helix	trans	-80.5	-36	176.7	-73.7	167.3	0	0	0	113.9	A1653 A1655 E1659 F1660 E1661	A1653-L1657 WeakPolarHBondContact O-CB 3.34Å; A1653-L1657 WeakPolarHBondContact O-CD1 3.02Å; A1653-L1657 VanDerWaalsContact O-CG 3.24Å; A1653-L1657 WeakPolarHBondContact O-CG 3.48Å; A1653-L1657 PolarHBondContact O-N 3.33Å; A1655-L1657 PolarHBondContact O-N 2.82Å; L1657-E1659 VanDerWaalsContact C-N 3.3Å; L1657-F1660 CarbonylContact O-C 3.55Å; L1657-F1660 WeakPolarHBondContact O-CA 3.33Å; L1657-F1660 WeakPolarHBondContact O-CB 3.15Å; L1657-F1660 PolarHBondContact O-N 3.49Å; L1657-E1661 PolarHBondContact O-N 3.27Å
1658	A	51.2	Low	47.5	Very low	56 Å²	56	109.1 Å²	109.1	46%	0.463	55%	0.55	S	S	.	.	H	α-helix	trans	-79.9	-10.8	176	0	0	0	0	0	113.3	K1654 A1655	K1654-A1658 WeakPolarHBondContact O-CB 3.18Å; K1654-A1658 PolarHBondContact O-N 2.9Å; A1655-A1658 CarbonylContact O-C 3.56Å; A1655-A1658 PolarHBondContact O-N 3.16Å; A1655-A1658 VanDerWaalsContact O-N 3.17Å
1659	E	52.4	Low	46.2	Very low	157 Å²	157	106.5 Å²	106.5	73%	0.734	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-1.5	160.6	-72.5	-173.3	174.9	0	0	112.1	A1655 L1657	A1655-E1659 WeakPolarHBondContact O-CB 3.46Å; A1655-E1659 WeakPolarHBondContact O-CG 3.23Å; A1655-E1659 PolarHBondContact O-N 3.02Å; L1657-E1659 VanDerWaalsContact C-N 3.3Å
1660	F	44.6	Very low	44.8	Very low	176 Å²	176	108.1 Å²	108.1	77%	0.772	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121	-19	179.9	-100	-89.8	0	0	0	115.8	D1656 L1657	D1656-F1660 WeakPolarHBondContact O-CD2 3.38Å; L1657-F1660 CarbonylContact O-C 3.55Å; L1657-F1660 WeakPolarHBondContact O-CA 3.33Å; L1657-F1660 WeakPolarHBondContact O-CB 3.15Å; L1657-F1660 PolarHBondContact O-N 3.49Å
1661	E	36.9	Very low	43.3	Very low	123 Å²	123	111 Å²	111	58%	0.575	57%	0.57	S	S	*	*	S	Bend	trans	-126.6	157.2	179.7	-65.1	-168	146.1	0	0	113.1	L1657	L1657-E1661 PolarHBondContact O-N 3.27Å
1662	E	34.2	Very low	41.9	Very low	128 Å²	128	114.3 Å²	114.3	60%	0.598	59%	0.587	S	S	*	*			trans	62.7	150.6	-163.8	-54.5	-165.3	75.7	0	0	114.6	N2403 S2404	E1662-N2403 HydrophobicContact CB-CB 3.5Å; E1662-N2403 VanDerWaalsContact CB-CB 3.5Å; E1662-N2403 WeakPolarHBondContact CB-ND2 3.24Å; E1662-N2403 CarbonylContact O-C 3.45Å; E1662-N2403 PolarHBondContact OE1-ND2 3.15Å; E1662-N2403 PolarHBondContact OE2-ND2 3.4Å; E1662-N2403 PolarHBondContact OE2-OD1 2.65Å; E1662-S2404 WeakPolarHBondContact O-CA 3.4Å; E1662-S2404 VanDerWaalsContact O-CB 3.24Å; E1662-S2404 WeakPolarHBondContact O-CB 3.2Å; E1662-S2404 PolarHBondContact O-N 2.82Å
1663	K	33.9	Very low	40	Very low	99 Å²	99	114.9 Å²	114.9	43%	0.43	60%	0.602	S	S	.	*			cis	-84.2	139.8	-5	-54.8	-177.9	171.1	84.4	0	109.8	S2402 N2403 S2404	K1663-S2402 PolarHBondContact NZ-O 3.2Å; K1663-N2403 HydrophobicContact CB-CB 4.42Å; K1663-N2403 HydrophobicContact CD-CB 4.35Å; K1663-N2403 HydrophobicContact CG-CB 3.35Å; K1663-N2403 PolarHBondContact NZ-O 2.8Å; K1663-S2404 WeakPolarHBondContact CB-OG 3.46Å; K1663-S2404 WeakPolarHBondContact CG-OG 3.37Å; K1663-S2404 PolarHBondContact N-OG 3.47Å
1664	S	27.1	Very low	38.5	Very low	85 Å²	85	119.2 Å²	119.2	59%	0.594	62%	0.618	S	S	*	*				77.6	169.6	80.4	108.5	0	0	0	0	112.8
1665	P	31.7	Very low	36.9	Very low	73 Å²	73	119.6 Å²	119.6	47%	0.474	62%	0.624	S	S	.	*			cis	-127.3	167.9	15.5	12.8	14.4	0	0	0	117.8	E1727	P1665-E1727 WeakPolarHBondContact CG-OE1 3.2Å
1666	Y	26.3	Very low	35.2	Very low	197 Å²	197	121.2 Å²	121.2	77%	0.773	64%	0.638	S	S	*	*				18.6	159.4	126.3	-57.6	-52.4	0	0	0	121.5
1667	N	28.6	Very low	34	Very low	124 Å²	124	124.4 Å²	124.4	66%	0.663	66%	0.655	S	S	*	*			cis	-166.3	-163.1	-4.9	-112.9	-15.2	0	0	0	108.8
1668	E	29.8	Very low	32.6	Very low	167 Å²	167	125.4 Å²	125.4	78%	0.78	66%	0.661	S	S	*	*			trans	84	136.1	151.8	-45.9	-163.8	166.6	0	0	115.2
1669	D	32.1	Very low	31.5	Very low	114 Å²	114	128.6 Å²	128.6	61%	0.61	67%	0.67	S	S	*	*			cis	-160.8	137.6	0.5	-129.3	23.2	0	0	0	116.5
1670	N	30.5	Very low	30.4	Very low	122 Å²	122	127.8 Å²	127.8	65%	0.652	67%	0.671	S	S	*	*				60	150.8	129.1	-75.3	-27.5	0	0	0	126.8
1671	N	29.9	Very low	29.7	Very low	132 Å²	132	124.1 Å²	124.1	71%	0.706	67%	0.667	S	S	*	*			trans	94.8	126.1	149.7	-58.5	-39	0	0	0	122
1672	D	31	Very low	29.4	Very low	149 Å²	149	122.4 Å²	122.4	80%	0.797	67%	0.669	S	S	*	*			trans	54.4	123.8	140.4	-57.4	-25.1	0	0	0	120
1673	S	25	Very low	29.2	Very low	104 Å²	104	122.9 Å²	122.9	73%	0.727	68%	0.675	S	S	*	*			cis	-164.9	171.9	16.6	62.9	0	0	0	0	110.2
1674	I	25.2	Very low	28.9	Very low	132 Å²	132	125.4 Å²	125.4	68%	0.677	69%	0.692	S	S	*	*			cis	-156	146.7	18.4	-145.5	149.9	0	0	0	111.7
1675	I	26.4	Very low	29	Very low	137 Å²	137	125.8 Å²	125.8	70%	0.703	69%	0.692	S	S	*	*			trans	31.8	97.6	148.9	-57.4	171	0	0	0	116.2
1676	A	28.4	Very low	28.6	Very low	79 Å²	79	124 Å²	124	65%	0.653	68%	0.682	S	S	*	*				65.4	130.3	74.6	0	0	0	0	0	115.6
1677	D	29.5	Very low	28.6	Very low	149 Å²	149	115.9 Å²	115.9	80%	0.797	65%	0.653	S	S	*	*				-173.7	140.4	125.6	-98	-10	0	0	0	113.5
1678	D	29.6	Very low	28.5	Very low	131 Å²	131	112.4 Å²	112.4	70%	0.701	64%	0.636	S	S	*	*			trans	60.4	131.9	142.4	-94.4	19.2	0	0	0	127.1
1679	N	28.9	Very low	28.5	Very low	122 Å²	122	108.6 Å²	108.6	65%	0.652	63%	0.633	S	S	*	*			trans	80.9	149	137.9	-66.2	-37.3	0	0	0	123.1
1680	N	29.4	Very low	28.2	Very low	140 Å²	140	109.3 Å²	109.3	75%	0.749	64%	0.635	S	S	*	*			trans	62.7	106.3	169.6	-62.7	-17.5	0	0	0	115.4
1681	S	29.4	Very low	28.1	Very low	99 Å²	99	106.8 Å²	106.8	69%	0.692	62%	0.62	S	S	*	*				67.4	136.3	73.4	78.6	0	0	0	0	113.2
1682	S	30.2	Very low	28.2	Very low	88 Å²	88	102.2 Å²	102.2	62%	0.615	60%	0.597	S	S	*	*			cis	176	143.2	-8.3	46.8	0	0	0	0	108
1683	N	30.1	Very low	27.9	Very low	137 Å²	137	99.9 Å²	99.9	73%	0.733	58%	0.58	S	S	*	*			trans	56.7	112.3	148.3	-51.4	-16.6	0	0	0	118.1
1684	I	27.8	Very low	28	Very low	152 Å²	152	99.6 Å²	99.6	78%	0.779	58%	0.578	S	S	*	*				63.6	132.3	75.4	-60.4	160.3	0	0	0	112.7
1685	P	28.2	Very low	28	Very low	93 Å²	93	98.7 Å²	98.7	60%	0.604	58%	0.583	S	S	*	*			cis	-119.5	161	0.8	39.8	-27.3	0	0	0	114.6
1686	S	25	Very low	27.8	Very low	36 Å²	36	98.8 Å²	98.8	25%	0.252	58%	0.584	S	S	.	*			trans	-153	131.8	177.4	42.7	0	0	0	0	109.4	P1692 F1693	S1686-P1692 PolarHBondContact OG-O 2.78Å; S1686-F1693 WeakPolarHBondContact OG-CD2 3.14Å
1687	V	26	Very low	27.6	Very low	27 Å²	27	106 Å²	106	16%	0.164	59%	0.594	C	S	.	*			trans	-169.6	-178.2	-168.6	137.3	0	0	0	0	106.9	T1591 G1592 I1690 E1691	T1591-V1687 WeakPolarHBondContact CA-O 3.36Å; T1591-V1687 PolarHBondContact N-O 2.75Å; G1592-V1687 VanDerWaalsContact N-CG1 3.27Å; G1592-V1687 WeakPolarHBondContact O-CG1 3.3Å; V1687-I1690 CarbonylContact C-O 2.9Å; V1687-I1690 WeakPolarHBondContact CA-O 3.43Å; V1687-E1691 VanDerWaalsContact CA-C 3.49Å; V1687-E1691 WeakPolarHBondContact CA-O 3.46Å; V1687-E1691 WeakPolarHBondContact CG2-O 3.18Å
1688	T	25.5	Very low	27.3	Very low	51 Å²	51	103.9 Å²	103.9	31%	0.313	58%	0.583	S	S	.	*	S	Bend	trans	-140.9	-46.4	141	30.8	0	0	0	0	107.6	I1690 E1691	T1688-I1690 PolarHBondContact N-O 2.78Å; T1688-E1691 WeakPolarHBondContact CB-OE2 3.4Å; T1688-E1691 WeakPolarHBondContact CG2-OE2 3.27Å; T1688-E1691 VanDerWaalsContact N-CB 3.34Å; T1688-E1691 PolarHBondContact OG1-OE2 2.89Å
1689	A	31.2	Very low	26.9	Very low	87 Å²	87	102.5 Å²	102.5	72%	0.719	58%	0.582	S	S	*	*	S	Bend	trans	-155.5	-28.8	166.2	0	0	0	0	0	118.9
1690	I	24.7	Very low	26.6	Very low	128 Å²	128	102.5 Å²	102.5	66%	0.656	58%	0.581	S	S	*	*	S	Bend	cis	69.7	147.8	14	-44.7	166.3	0	0	0	112.6	V1687 T1688	V1687-I1690 CarbonylContact C-O 2.9Å; V1687-I1690 WeakPolarHBondContact CA-O 3.43Å; T1688-I1690 PolarHBondContact N-O 2.78Å
1691	E	28.3	Very low	26.3	Very low	69 Å²	69	102.7 Å²	102.7	32%	0.322	58%	0.578	S	S	.	*			trans	68	160.9	165.7	-92.6	179.7	160	0	0	117.8	E1562 T1563 V1687 T1688	E1562-E1691 VanDerWaalsContact OE1-CA 3.32Å; E1562-E1691 WeakPolarHBondContact OE1-CA 3.02Å; E1562-E1691 PolarHBondContact OE1-N 3.38Å; T1563-E1691 HydrophobicContact CG2-CG 4.27Å; T1563-E1691 WeakPolarHBondContact CG2-OE1 3.28Å; V1687-E1691 VanDerWaalsContact CA-C 3.49Å; V1687-E1691 WeakPolarHBondContact CA-O 3.46Å; V1687-E1691 WeakPolarHBondContact CG2-O 3.18Å; T1688-E1691 WeakPolarHBondContact CB-OE2 3.4Å; T1688-E1691 WeakPolarHBondContact CG2-OE2 3.27Å; T1688-E1691 VanDerWaalsContact N-CB 3.34Å; T1688-E1691 PolarHBondContact OG1-OE2 2.89Å
1692	P	32	Very low	26	Very low	37 Å²	37	106.1 Å²	106.1	24%	0.24	58%	0.583	C	S	.	*				-152.1	-117.5	-121.1	44.1	-19.4	0	0	0	115.1	E1562 S1686	E1562-P1692 HydrophobicContact CB-CG 4.01Å; E1562-P1692 HydrophobicContact CG-CG 4.42Å; E1562-P1692 WeakPolarHBondContact OE2-CB 3.44Å; E1562-P1692 WeakPolarHBondContact OE2-CG 3.45Å; S1686-P1692 PolarHBondContact OG-O 2.78Å
1693	F	24.2	Very low	25.7	Very low	99 Å²	99	105.9 Å²	105.9	43%	0.434	58%	0.581	S	S	.	*			trans	77.5	80.4	-177.7	-59.4	-80.1	0	0	0	117.3	T1563 S1686	T1563-F1693 HydrophobicContact CG2-CZ 4.24Å; T1563-F1693 WeakPolarHBondContact OG1-CE1 3.31Å; T1563-F1693 WeakPolarHBondContact OG1-CZ 3.46Å; S1686-F1693 WeakPolarHBondContact OG-CD2 3.14Å
1694	S	27.8	Very low	25.5	Very low	98 Å²	98	106.1 Å²	106.1	69%	0.685	58%	0.582	S	S	*	*				51	131.1	104.7	73.6	0	0	0	0	121
1695	C	25	Very low	25.3	Very low	114 Å²	114	105.3 Å²	105.3	77%	0.77	58%	0.575	S	S	*	*			trans	84	160.9	137.2	-137.8	0	0	0	0	120.2
1696	L	22.8	Very low	25.3	Very low	139 Å²	139	104.3 Å²	104.3	73%	0.728	57%	0.567	S	S	*	*			trans	62.7	89.3	166.2	-55.2	-177.2	0	0	0	119.4
1697	R	23.8	Very low	25.2	Very low	231 Å²	231	105.5 Å²	105.5	87%	0.872	57%	0.571	S	S	*	*				-138.9	100.9	105	-169.6	164.9	-84.8	-161.2	-9.9	107.6
1698	N	22.6	Very low	25.2	Very low	104 Å²	104	110.3 Å²	110.3	56%	0.556	60%	0.6	S	S	*	*				60.2	133.6	92.8	-54.9	11.7	0	0	0	111.8
1699	C	22.2	Very low	25.2	Very low	101 Å²	101	112 Å²	112	68%	0.682	62%	0.619	S	S	*	*			cis	-170.5	169	1.2	-119.2	0	0	0	0	109.9
1700	L	22	Very low	24.9	Very low	123 Å²	123	112.6 Å²	112.6	64%	0.644	62%	0.618	S	S	*	*			trans	66.1	124.7	169.9	-82.8	74.7	0	0	0	114.2
1701	Q	23.6	Very low	25	Very low	143 Å²	143	114 Å²	114	67%	0.668	62%	0.622	S	S	*	*				94.4	130.9	52.4	-86.8	-175.5	-13.9	0	0	111.7
1702	Q	23.4	Very low	24.9	Very low	172 Å²	172	117.1 Å²	117.1	80%	0.804	64%	0.641	S	S	*	*			trans	65	154.3	162.3	-65.1	158.5	11.4	0	0	112.1
1703	S	23.5	Very low	24.6	Very low	82 Å²	82	120.6 Å²	120.6	57%	0.573	66%	0.662	S	S	*	*			cis	-178.9	126.6	-1.6	39.2	0	0	0	0	101.9
1704	D	25.7	Very low	24.8	Very low	142 Å²	142	122.1 Å²	122.1	76%	0.759	67%	0.674	S	S	*	*				71	130.3	107.7	-55	-42.8	0	0	0	115.2
1705	E	24.6	Very low	24.7	Very low	136 Å²	136	126 Å²	126	64%	0.636	68%	0.681	S	S	*	*			trans	67.9	156.8	147	-68.5	-164.4	178.6	0	0	117.3	N514	N514-E1705 WeakPolarHBondContact ND2-CA 3.47Å; N514-E1705 PolarHBondContact ND2-N 2.85Å
1706	V	26.6	Very low	25.1	Very low	71 Å²	71	126.6 Å²	126.6	43%	0.43	68%	0.682	S	S	.	*			cis	-158.9	142.5	-4.3	107.8	0	0	0	0	112.5	N514	N514-V1706 HydrophobicContact CB-CG2 4.27Å
1707	N	24.8	Very low	25.3	Very low	61 Å²	61	128.1 Å²	128.1	33%	0.326	69%	0.69	S	S	.	*			trans	58.8	124.4	145.4	-63.5	-7.3	0	0	0	124.4	N514 S515	N514-N1707 WeakPolarHBondContact O-CA 3.42Å; N514-N1707 PolarHBondContact O-N 3.17Å; N514-N1707 PolarHBondContact O-OD1 3.15Å; N514-N1707 VanDerWaalsContact O-OD1 3.11Å; S515-N1707 PolarHBondContact N-OD1 2.89Å; S515-N1707 PolarHBondContact OG-OD1 3.16Å
1708	T	24.9	Very low	26.1	Very low	128 Å²	128	121.2 Å²	121.2	79%	0.785	67%	0.668	S	S	*	*				84.2	160.5	120.4	63.4	0	0	0	0	123.6
1709	A	26.5	Very low	27.3	Very low	86 Å²	86	119.5 Å²	119.5	71%	0.711	66%	0.661	S	S	*	*			trans	80	88.2	155	0	0	0	0	0	116.8
1710	S	24.4	Very low	28.5	Very low	100 Å²	100	121.4 Å²	121.4	70%	0.699	66%	0.663	S	S	*	*			cis	95.1	150.5	47.5	74.8	0	0	0	0	114.6
1711	Q	26.1	Very low	29.7	Very low	158 Å²	158	122.1 Å²	122.1	74%	0.738	66%	0.663	S	S	*	*			trans	84	126.4	167.3	-55	-178.9	22.4	0	0	117.5
1712	N	26.9	Very low	31.6	Very low	134 Å²	134	119.2 Å²	119.2	72%	0.717	65%	0.65	S	S	*	*			trans	70.4	142.9	151.7	-50.9	-23.3	0	0	0	117.3
1713	T	25.5	Very low	33.3	Very low	110 Å²	110	115.4 Å²	115.4	68%	0.675	63%	0.634	S	S	*	*			cis	-165.1	152.8	-15.4	17.7	0	0	0	0	108.2
1714	N	27.7	Very low	34.8	Very low	131 Å²	131	115 Å²	115	70%	0.701	63%	0.627	S	S	*	*			trans	68.5	115.4	157	-53.8	-5.8	0	0	0	119.3
1715	E	25.2	Very low	36.9	Very low	179 Å²	179	114.1 Å²	114.1	84%	0.836	62%	0.619	S	S	*	*				41	95.1	118.7	-55.3	176.6	152.6	0	0	119.7
1716	T	33.6	Very low	39.1	Very low	127 Å²	127	114.6 Å²	114.6	78%	0.779	62%	0.615	S	S	*	*				-153.2	132	122.1	29.8	0	0	0	0	110.4	E1718	T1716-E1718 PolarHBondContact O-N 2.77Å
1717	L	28.6	Very low	40.7	Very low	172 Å²	172	115.3 Å²	115.3	90%	0.901	61%	0.613	S	S	*	*			trans	-90.4	89.1	162.2	-76.8	164	0	0	0	107.5	T1719	L1717-T1719 PolarHBondContact O-N 3.38Å
1718	E	39.8	Very low	42.8	Very low	86 Å²	86	117.5 Å²	117.5	40%	0.402	63%	0.625	S	S	.	*			trans	-64.9	122.6	164.7	-67.3	-163.3	146.9	0	0	107.9	T1716 Q1722 R1726	T1716-E1718 PolarHBondContact O-N 2.77Å; E1718-Q1722 VanDerWaalsContact CA-OE1 3.29Å; E1718-R1726 IonicContact OE1-CZ 3.49Å; E1718-R1726 IonicContact OE1-NH1 2.7Å; E1718-R1726 IonicContact OE1-NH2 3.41Å; E1718-R1726 PolarHBondContact OE1-NH2 3.11Å; E1718-R1726 IonicContact OE2-CZ 3.93Å; E1718-R1726 IonicContact OE2-NH1 2.66Å; E1718-R1726 PolarHBondContact OE2-NH1 2.8Å; E1718-R1726 IonicContact OE2-NH2 3.33Å; E1718-R1726 PolarHBondContact OE2-NH2 2.86Å
1719	T	47.3	Very low	44.8	Very low	68 Å²	68	117 Å²	117	42%	0.417	62%	0.617	S	S	.	*			trans	-74.5	158.3	177.5	50.1	0	0	0	0	110.7	L1717 E1721 Q1722	L1717-T1719 PolarHBondContact O-N 3.38Å; T1719-E1721 PolarHBondContact O-N 2.93Å; T1719-E1721 PolarHBondContact OG1-OE2 3.42Å; T1719-E1721 VanDerWaalsContact OG1-OE2 3.04Å; T1719-Q1722 PolarHBondContact O-N 3.41Å
1720	I	48	Very low	46.8	Very low	140 Å²	140	114.3 Å²	114.3	72%	0.718	60%	0.597	S	S	*	*	H	α-helix	trans	-51.4	-32.7	178.8	-62.5	171.7	0	0	0	111.5	Q1722 I1723 V1724	I1720-Q1722 PolarHBondContact O-N 2.63Å; I1720-I1723 PolarHBondContact O-N 3.29Å; I1720-V1724 WeakPolarHBondContact O-CG2 3.28Å; I1720-V1724 PolarHBondContact O-N 3.46Å; I1720-V1724 VanDerWaalsContact O-N 3.14Å
1721	E	47.5	Very low	48.5	Very low	138 Å²	138	115.8 Å²	115.8	65%	0.645	59%	0.591	S	S	*	*	H	α-helix	trans	-54.8	-45.3	174.3	-62.5	158.5	141.2	0	0	112.6	T1719 I1723 V1724 E1725	T1719-E1721 PolarHBondContact O-N 2.93Å; T1719-E1721 PolarHBondContact OG1-OE2 3.42Å; T1719-E1721 VanDerWaalsContact OG1-OE2 3.04Å; E1721-I1723 VanDerWaalsContact C-N 3.31Å; E1721-I1723 PolarHBondContact O-N 2.65Å; E1721-V1724 PolarHBondContact O-N 3.23Å; E1721-E1725 WeakPolarHBondContact O-CG 3.25Å; E1721-E1725 PolarHBondContact O-N 2.91Å
1722	Q	62.6	Low	50.1	Low	83 Å²	83	110.8 Å²	110.8	39%	0.388	57%	0.567	S	S	.	*	H	α-helix	trans	-70.9	-27.1	-178	-65.1	-176.5	-38.1	0	0	112.8	E1718 T1719 I1720 R1726	E1718-Q1722 VanDerWaalsContact CA-OE1 3.29Å; T1719-Q1722 PolarHBondContact O-N 3.41Å; I1720-Q1722 PolarHBondContact O-N 2.63Å; Q1722-R1726 WeakPolarHBondContact O-CB 3.33Å; Q1722-R1726 PolarHBondContact O-N 2.86Å; Q1722-R1726 VanDerWaalsContact O-N 3.09Å
1723	I	59.3	Low	52	Low	92 Å²	92	107.9 Å²	107.9	47%	0.472	56%	0.558	S	S	.	*	H	α-helix	trans	-71	-43.7	173.3	-59.4	176.1	0	0	0	109.5	I1720 E1721 R1726 E1727	I1720-I1723 PolarHBondContact O-N 3.29Å; E1721-I1723 VanDerWaalsContact C-N 3.31Å; E1721-I1723 PolarHBondContact O-N 2.65Å; I1723-R1726 PolarHBondContact O-N 2.84Å; I1723-E1727 PolarHBondContact O-N 3.18Å
1724	V	55.7	Low	53.8	Low	72 Å²	72	109.8 Å²	109.8	44%	0.436	56%	0.559	S	S	.	*	H	α-helix	trans	-64.1	-40.9	175.9	175.2	0	0	0	0	111.7	I1720 E1721 R1726 E1727 L1728	I1720-V1724 WeakPolarHBondContact O-CG2 3.28Å; I1720-V1724 PolarHBondContact O-N 3.46Å; I1720-V1724 VanDerWaalsContact O-N 3.14Å; E1721-V1724 PolarHBondContact O-N 3.23Å; V1724-R1726 VanDerWaalsContact C-N 3.34Å; V1724-R1726 PolarHBondContact O-N 3Å; V1724-E1727 PolarHBondContact O-N 3.21Å; V1724-L1728 HydrophobicContact CG1-CD1 3.99Å; V1724-L1728 HydrophobicContact CG1-CG 4.48Å; V1724-L1728 WeakPolarHBondContact O-CB 3.47Å; V1724-L1728 WeakPolarHBondContact O-CG 3.23Å; V1724-L1728 PolarHBondContact O-N 3.27Å
1725	E	68.4	Low	55.1	Low	124 Å²	124	106.4 Å²	106.4	58%	0.579	54%	0.54	S	S	*	.	H	α-helix	trans	-60.7	-41.5	172.6	-73.4	-176	155.7	0	0	112.2	E1721 L1728 L1729	E1721-E1725 WeakPolarHBondContact O-CG 3.25Å; E1721-E1725 PolarHBondContact O-N 2.91Å; E1725-L1728 PolarHBondContact O-N 2.86Å; E1725-L1729 WeakPolarHBondContact O-CG 3.31Å; E1725-L1729 PolarHBondContact O-N 2.86Å
1726	R	70.9	Confident	56.8	Low	146 Å²	146	103.7 Å²	103.7	55%	0.551	53%	0.526	S	S	*	.	H	α-helix	trans	-66.7	-38.2	179.1	-168.7	176.6	-73.6	142.3	-0.1	112.1	E1718 Q1722 I1723 V1724 G1730	E1718-R1726 IonicContact OE1-CZ 3.49Å; E1718-R1726 IonicContact OE1-NH1 2.7Å; E1718-R1726 IonicContact OE1-NH2 3.41Å; E1718-R1726 PolarHBondContact OE1-NH2 3.11Å; E1718-R1726 IonicContact OE2-CZ 3.93Å; E1718-R1726 IonicContact OE2-NH1 2.66Å; E1718-R1726 PolarHBondContact OE2-NH1 2.8Å; E1718-R1726 IonicContact OE2-NH2 3.33Å; E1718-R1726 PolarHBondContact OE2-NH2 2.86Å; Q1722-R1726 WeakPolarHBondContact O-CB 3.33Å; Q1722-R1726 PolarHBondContact O-N 2.86Å; Q1722-R1726 VanDerWaalsContact O-N 3.09Å; I1723-R1726 PolarHBondContact O-N 2.84Å; V1724-R1726 VanDerWaalsContact C-N 3.34Å; V1724-R1726 PolarHBondContact O-N 3Å; R1726-G1730 PolarHBondContact O-N 2.76Å; R1726-G1730 VanDerWaalsContact O-N 3.14Å
1727	E	61.9	Low	58.2	Low	87 Å²	87	102.9 Å²	102.9	41%	0.407	52%	0.523	S	S	.	.	H	α-helix	trans	-70.7	-40	173.2	-71.1	-129.9	134.1	0	0	113	P1665 I1723 V1724 L1729 G1730 F1731	P1665-E1727 WeakPolarHBondContact CG-OE1 3.2Å; I1723-E1727 PolarHBondContact O-N 3.18Å; V1724-E1727 PolarHBondContact O-N 3.21Å; E1727-L1729 PolarHBondContact O-N 2.84Å; E1727-G1730 CarbonylContact O-C 3.59Å; E1727-G1730 VanDerWaalsContact O-CA 3.27Å; E1727-G1730 WeakPolarHBondContact O-CA 3.14Å; E1727-G1730 PolarHBondContact O-N 3.14Å; E1727-F1731 PolarHBondContact O-N 2.81Å
1728	L	68.3	Low	59.5	Low	107 Å²	107	100.5 Å²	100.5	56%	0.56	52%	0.515	S	S	*	.	H	α-helix	trans	-61.8	-42.2	176.4	-78.8	168.6	0	0	0	111.9	V1724 E1725 G1730 F1731 E1732	V1724-L1728 HydrophobicContact CG1-CD1 3.99Å; V1724-L1728 HydrophobicContact CG1-CG 4.48Å; V1724-L1728 WeakPolarHBondContact O-CB 3.47Å; V1724-L1728 WeakPolarHBondContact O-CG 3.23Å; V1724-L1728 PolarHBondContact O-N 3.27Å; E1725-L1728 PolarHBondContact O-N 2.86Å; L1728-G1730 VanDerWaalsContact C-N 3.26Å; L1728-G1730 PolarHBondContact O-N 2.76Å; L1728-F1731 PolarHBondContact O-N 2.82Å; L1728-E1732 PolarHBondContact O-N 3.14Å
1729	L	66.5	Low	60.4	Low	118 Å²	118	99.9 Å²	99.9	62%	0.618	51%	0.512	S	S	*	.	H	α-helix	trans	-62.5	-34	170.8	-73	167.9	0	0	0	112.1	E1725 E1727 S1733	E1725-L1729 WeakPolarHBondContact O-CG 3.31Å; E1725-L1729 PolarHBondContact O-N 2.86Å; E1727-L1729 PolarHBondContact O-N 2.84Å; L1729-S1733 WeakPolarHBondContact O-CB 3.22Å; L1729-S1733 PolarHBondContact O-N 3.36Å
1730	G	69.7	Low	61.3	Low	28 Å²	28	100.4 Å²	100.4	29%	0.289	51%	0.507	S	S	.	.	H	α-helix	trans	-59.7	-48.2	170.2	0	0	0	0	0	112.8	R1726 E1727 L1728 S1733	R1726-G1730 PolarHBondContact O-N 2.76Å; R1726-G1730 VanDerWaalsContact O-N 3.14Å; E1727-G1730 CarbonylContact O-C 3.59Å; E1727-G1730 VanDerWaalsContact O-CA 3.27Å; E1727-G1730 WeakPolarHBondContact O-CA 3.14Å; E1727-G1730 PolarHBondContact O-N 3.14Å; L1728-G1730 VanDerWaalsContact C-N 3.26Å; L1728-G1730 PolarHBondContact O-N 2.76Å; G1730-S1733 WeakPolarHBondContact O-CB 3.47Å; G1730-S1733 PolarHBondContact O-N 2.72Å; G1730-S1733 PolarHBondContact O-OG 3.48Å
1731	F	58.8	Low	62.2	Low	132 Å²	132	99.9 Å²	99.9	58%	0.579	50%	0.499	S	S	*	.	H	α-helix	trans	-68.8	-41	176.7	-88.7	-80.8	0	0	0	113.1	E1727 L1728 S1733 Q1734 L1735	E1727-F1731 PolarHBondContact O-N 2.81Å; L1728-F1731 PolarHBondContact O-N 2.82Å; F1731-S1733 PolarHBondContact O-N 2.66Å; F1731-Q1734 PolarHBondContact O-N 3.24Å; F1731-L1735 PolarHBondContact O-N 3.08Å
1732	E	60.1	Low	63	Low	53 Å²	53	94.9 Å²	94.9	25%	0.248	48%	0.484	C	S	.	.	H	α-helix	trans	-54.9	-36.5	170.8	-112.9	-125.4	125.4	0	0	110.9	L1728 Q1734 R1740 R1744	L1728-E1732 PolarHBondContact O-N 3.14Å; E1732-Q1734 VanDerWaalsContact C-N 3.27Å; E1732-Q1734 PolarHBondContact O-N 3.49Å; E1732-R1740 WeakPolarHBondContact O-CD 3.34Å; E1732-R1740 PolarHBondContact O-NE 3.36Å; E1732-R1740 PolarHBondContact O-NH1 2.86Å; E1732-R1740 PolarHBondContact O-NH2 2.8Å; E1732-R1744 IonicContact OE1-CZ 3.94Å; E1732-R1744 IonicContact OE1-NE 2.78Å; E1732-R1744 PolarHBondContact OE1-NE 3.49Å; E1732-R1744 IonicContact OE1-NH2 3.88Å; E1732-R1744 PolarHBondContact OE1-NH2 2.79Å; E1732-R1744 IonicContact OE2-CZ 3.54Å; E1732-R1744 IonicContact OE2-NH2 2.76Å; E1732-R1744 PolarHBondContact OE2-NH2 3.36Å
1733	S	67.6	Low	63.1	Low	73 Å²	73	93.4 Å²	93.4	51%	0.51	48%	0.481	S	S	.	.	H	α-helix	trans	-65.4	-24.7	179.4	87.6	0	0	0	0	114.4	L1729 G1730 F1731 R1740	L1729-S1733 WeakPolarHBondContact O-CB 3.22Å; L1729-S1733 PolarHBondContact O-N 3.36Å; G1730-S1733 WeakPolarHBondContact O-CB 3.47Å; G1730-S1733 PolarHBondContact O-N 2.72Å; G1730-S1733 PolarHBondContact O-OG 3.48Å; F1731-S1733 PolarHBondContact O-N 2.66Å; S1733-R1740 VanDerWaalsContact C-NH2 3.32Å; S1733-R1740 PolarHBondContact O-NH2 2.75Å
1734	Q	63.5	Low	63.4	Low	150 Å²	150	95 Å²	95	70%	0.701	48%	0.481	S	S	*	.	H	α-helix	trans	-93.5	-22.9	-175.1	-62.9	-175.3	24.9	0	0	114	F1731 E1732	F1731-Q1734 PolarHBondContact O-N 3.24Å; E1732-Q1734 VanDerWaalsContact C-N 3.27Å; E1732-Q1734 PolarHBondContact O-N 3.49Å
1735	L	53.3	Low	63.8	Low	59 Å²	59	95.7 Å²	95.7	31%	0.309	48%	0.479	S	S	.	.	S	Bend	trans	-64.2	137.1	175.4	-68.4	170.7	0	0	0	111.3	F1731 E1739 R1740 V1743	F1731-L1735 PolarHBondContact O-N 3.08Å; L1735-E1739 HydrophobicContact CB-CB 4.18Å; L1735-E1739 HydrophobicContact CD2-CB 4.11Å; L1735-R1740 HydrophobicContact CB-CG 3.55Å; L1735-R1740 HydrophobicContact CD1-CG 4.46Å; L1735-R1740 PolarHBondContact O-NE 3.19Å; L1735-R1740 PolarHBondContact O-NH2 3.31Å; L1735-V1743 HydrophobicContact CD1-CG2 4.21Å
1736	K	61.3	Low	63.8	Low	122 Å²	122	93.8 Å²	93.8	53%	0.53	48%	0.476	S	S	.	.			trans	-62.5	157.5	173.5	-63.2	171.9	-152.7	70.3	0	110.2	V1738 E1739 R1740	K1736-V1738 PolarHBondContact O-N 2.78Å; K1736-V1738 VanDerWaalsContact O-N 3.13Å; K1736-E1739 HydrophobicContact CB-CB 4.34Å; K1736-E1739 HydrophobicContact CB-CG 4.23Å; K1736-E1739 VanDerWaalsContact CB-OE2 3.23Å; K1736-E1739 WeakPolarHBondContact CB-OE2 3.33Å; K1736-E1739 WeakPolarHBondContact CD-OE2 3.1Å; K1736-E1739 WeakPolarHBondContact CG-OE2 3.41Å; K1736-E1739 PolarHBondContact N-OE2 3.42Å; K1736-E1739 IonicContact NZ-OE1 3.28Å; K1736-E1739 PolarHBondContact NZ-OE1 2.7Å; K1736-E1739 IonicContact NZ-OE2 2.64Å; K1736-E1739 PolarHBondContact NZ-OE2 3.21Å; K1736-E1739 CarbonylContact O-C 3.54Å; K1736-E1739 WeakPolarHBondContact O-CA 3.21Å; K1736-E1739 WeakPolarHBondContact O-CB 3.39Å; K1736-E1739 PolarHBondContact O-N 2.81Å; K1736-R1740 PolarHBondContact O-N 3.29Å
1737	P	62.8	Low	63.6	Low	110 Å²	110	91.4 Å²	91.4	71%	0.714	47%	0.471	S	S	*	.	H	α-helix	trans	-54.3	-35.8	178.2	-28.8	36.3	0	0	0	114.7	F1741	P1737-F1741 VanDerWaalsContact O-CB 3.26Å; P1737-F1741 WeakPolarHBondContact O-CB 3.29Å; P1737-F1741 PolarHBondContact O-N 2.65Å
1738	V	55.5	Low	64	Low	122 Å²	122	94 Å²	94	74%	0.739	48%	0.484	S	S	*	.	H	α-helix	trans	-70	-33.9	174.8	-178.9	0	0	0	0	111.9	K1736 G1742	K1736-V1738 PolarHBondContact O-N 2.78Å; K1736-V1738 VanDerWaalsContact O-N 3.13Å; V1738-G1742 PolarHBondContact O-N 2.99Å
1739	E	59.4	Low	63.5	Low	74 Å²	74	95.1 Å²	95.1	35%	0.346	49%	0.486	S	S	.	.	H	α-helix	trans	-76.2	-41	179.1	-68.7	157.6	179	0	0	110.5	L1735 K1736 G1742 V1743	L1735-E1739 HydrophobicContact CB-CB 4.18Å; L1735-E1739 HydrophobicContact CD2-CB 4.11Å; K1736-E1739 HydrophobicContact CB-CB 4.34Å; K1736-E1739 HydrophobicContact CB-CG 4.23Å; K1736-E1739 VanDerWaalsContact CB-OE2 3.23Å; K1736-E1739 WeakPolarHBondContact CB-OE2 3.33Å; K1736-E1739 WeakPolarHBondContact CD-OE2 3.1Å; K1736-E1739 WeakPolarHBondContact CG-OE2 3.41Å; K1736-E1739 PolarHBondContact N-OE2 3.42Å; K1736-E1739 IonicContact NZ-OE1 3.28Å; K1736-E1739 PolarHBondContact NZ-OE1 2.7Å; K1736-E1739 IonicContact NZ-OE2 2.64Å; K1736-E1739 PolarHBondContact NZ-OE2 3.21Å; K1736-E1739 CarbonylContact O-C 3.54Å; K1736-E1739 WeakPolarHBondContact O-CA 3.21Å; K1736-E1739 WeakPolarHBondContact O-CB 3.39Å; K1736-E1739 PolarHBondContact O-N 2.81Å; E1739-G1742 PolarHBondContact O-N 3.33Å; E1739-V1743 WeakPolarHBondContact O-CB 3.31Å; E1739-V1743 VanDerWaalsContact O-CG2 3.28Å; E1739-V1743 WeakPolarHBondContact O-CG2 3.04Å; E1739-V1743 PolarHBondContact O-N 2.65Å
1740	R	66.8	Low	63.2	Low	79 Å²	79	94 Å²	94	30%	0.298	47%	0.473	S	S	.	.	H	α-helix	trans	-61.9	-42	169.4	-63.5	-172	-148.7	-157.9	0.9	112.4	E1732 S1733 L1735 K1736 V1743 R1744	E1732-R1740 WeakPolarHBondContact O-CD 3.34Å; E1732-R1740 PolarHBondContact O-NE 3.36Å; E1732-R1740 PolarHBondContact O-NH1 2.86Å; E1732-R1740 PolarHBondContact O-NH2 2.8Å; S1733-R1740 VanDerWaalsContact C-NH2 3.32Å; S1733-R1740 PolarHBondContact O-NH2 2.75Å; L1735-R1740 HydrophobicContact CB-CG 3.55Å; L1735-R1740 HydrophobicContact CD1-CG 4.46Å; L1735-R1740 PolarHBondContact O-NE 3.19Å; L1735-R1740 PolarHBondContact O-NH2 3.31Å; K1736-R1740 PolarHBondContact O-N 3.29Å; R1740-V1743 PolarHBondContact O-N 3.01Å; R1740-R1744 WeakPolarHBondContact O-CB 3.47Å; R1740-R1744 VanDerWaalsContact O-CG 3.29Å; R1740-R1744 WeakPolarHBondContact O-CG 3.39Å; R1740-R1744 PolarHBondContact O-N 3.05Å
1741	F	66.6	Low	62.8	Low	129 Å²	129	97.4 Å²	97.4	57%	0.566	48%	0.482	S	S	*	.	H	α-helix	trans	-65.6	-42	176.6	-174.9	-97.8	0	0	0	111.2	P1737 Q1745	P1737-F1741 VanDerWaalsContact O-CB 3.26Å; P1737-F1741 WeakPolarHBondContact O-CB 3.29Å; P1737-F1741 PolarHBondContact O-N 2.65Å; F1741-Q1745 VanDerWaalsContact CE1-OE1 3.24Å; F1741-Q1745 WeakPolarHBondContact O-CB 3.37Å; F1741-Q1745 PolarHBondContact O-N 2.91Å
1742	G	65	Low	63.1	Low	32 Å²	32	97.9 Å²	97.9	33%	0.33	49%	0.485	S	S	.	.	H	α-helix	trans	-62.6	-44.5	174	0	0	0	0	0	113.1	V1738 E1739 V1746	V1738-G1742 PolarHBondContact O-N 2.99Å; E1739-G1742 PolarHBondContact O-N 3.33Å; G1742-V1746 VanDerWaalsContact O-CB 3.3Å; G1742-V1746 WeakPolarHBondContact O-CB 3.42Å; G1742-V1746 WeakPolarHBondContact O-CG2 3.13Å; G1742-V1746 PolarHBondContact O-N 2.74Å
1743	V	63.8	Low	63.2	Low	53 Å²	53	99.6 Å²	99.6	32%	0.321	50%	0.495	S	S	.	.	H	α-helix	trans	-61.9	-56.3	175.6	167.1	0	0	0	0	110.4	L1735 E1739 R1740 Q1745 V1746 E1747	L1735-V1743 HydrophobicContact CD1-CG2 4.21Å; E1739-V1743 WeakPolarHBondContact O-CB 3.31Å; E1739-V1743 VanDerWaalsContact O-CG2 3.28Å; E1739-V1743 WeakPolarHBondContact O-CG2 3.04Å; E1739-V1743 PolarHBondContact O-N 2.65Å; R1740-V1743 PolarHBondContact O-N 3.01Å; V1743-Q1745 PolarHBondContact O-N 2.75Å; V1743-V1746 CarbonylContact O-C 3.54Å; V1743-V1746 PolarHBondContact O-N 3.31Å; V1743-V1746 VanDerWaalsContact O-N 3.15Å; V1743-E1747 VanDerWaalsContact CG1-CD 3.49Å; V1743-E1747 HydrophobicContact CG1-CG 4.4Å; V1743-E1747 WeakPolarHBondContact CG1-OE1 3.42Å; V1743-E1747 WeakPolarHBondContact CG1-OE2 3.2Å; V1743-E1747 WeakPolarHBondContact O-CB 3.02Å; V1743-E1747 WeakPolarHBondContact O-CG 3.18Å; V1743-E1747 PolarHBondContact O-N 2.71Å
1744	R	65.3	Low	63	Low	126 Å²	126	96.1 Å²	96.1	48%	0.475	47%	0.47	S	S	.	.	H	α-helix	trans	-61.3	-38.6	-179.4	-68.9	176.3	-174.9	-157.4	-3	113.3	E1732 R1740 E1747 E1748	E1732-R1744 IonicContact OE1-CZ 3.94Å; E1732-R1744 IonicContact OE1-NE 2.78Å; E1732-R1744 PolarHBondContact OE1-NE 3.49Å; E1732-R1744 IonicContact OE1-NH2 3.88Å; E1732-R1744 PolarHBondContact OE1-NH2 2.79Å; E1732-R1744 IonicContact OE2-CZ 3.54Å; E1732-R1744 IonicContact OE2-NH2 2.76Å; E1732-R1744 PolarHBondContact OE2-NH2 3.36Å; R1740-R1744 WeakPolarHBondContact O-CB 3.47Å; R1740-R1744 VanDerWaalsContact O-CG 3.29Å; R1740-R1744 WeakPolarHBondContact O-CG 3.39Å; R1740-R1744 PolarHBondContact O-N 3.05Å; R1744-E1747 PolarHBondContact O-N 3.22Å; R1744-E1748 WeakPolarHBondContact O-CB 3.43Å; R1744-E1748 WeakPolarHBondContact O-CG 3.07Å; R1744-E1748 PolarHBondContact O-N 3.45Å
1745	Q	65.1	Low	63.2	Low	85 Å²	85	92.9 Å²	92.9	40%	0.397	46%	0.458	S	S	.	.	H	α-helix	trans	-72.9	-32.3	178.2	-171.5	167.9	46.9	0	0	112.2	F1741 V1743 Q1749	F1741-Q1745 VanDerWaalsContact CE1-OE1 3.24Å; F1741-Q1745 WeakPolarHBondContact O-CB 3.37Å; F1741-Q1745 PolarHBondContact O-N 2.91Å; V1743-Q1745 PolarHBondContact O-N 2.75Å; Q1745-Q1749 WeakPolarHBondContact O-CB 3.21Å; Q1745-Q1749 VanDerWaalsContact O-CG 3.28Å; Q1745-Q1749 WeakPolarHBondContact O-CG 3.3Å; Q1745-Q1749 PolarHBondContact O-N 2.7Å; Q1745-Q1749 VanDerWaalsContact O-N 3.11Å
1746	V	67.8	Low	64.1	Low	84 Å²	84	96 Å²	96	51%	0.509	47%	0.471	S	S	.	.	H	α-helix	trans	-69.2	-38.8	169.2	167.5	0	0	0	0	110.6	G1742 V1743 R1750	G1742-V1746 VanDerWaalsContact O-CB 3.3Å; G1742-V1746 WeakPolarHBondContact O-CB 3.42Å; G1742-V1746 WeakPolarHBondContact O-CG2 3.13Å; G1742-V1746 PolarHBondContact O-N 2.74Å; V1743-V1746 CarbonylContact O-C 3.54Å; V1743-V1746 PolarHBondContact O-N 3.31Å; V1743-V1746 VanDerWaalsContact O-N 3.15Å; V1746-R1750 WeakPolarHBondContact O-CB 3.19Å; V1746-R1750 PolarHBondContact O-N 2.85Å
1747	E	66.8	Low	64.4	Low	97 Å²	97	94 Å²	94	45%	0.453	46%	0.463	S	S	.	.	H	α-helix	trans	-65.3	-53.3	176.4	-73	166	161.4	0	0	111.4	V1743 R1744 Q1749 R1750 E1751	V1743-E1747 VanDerWaalsContact CG1-CD 3.49Å; V1743-E1747 HydrophobicContact CG1-CG 4.4Å; V1743-E1747 WeakPolarHBondContact CG1-OE1 3.42Å; V1743-E1747 WeakPolarHBondContact CG1-OE2 3.2Å; V1743-E1747 WeakPolarHBondContact O-CB 3.02Å; V1743-E1747 WeakPolarHBondContact O-CG 3.18Å; V1743-E1747 PolarHBondContact O-N 2.71Å; R1744-E1747 PolarHBondContact O-N 3.22Å; E1747-Q1749 PolarHBondContact O-N 2.75Å; E1747-R1750 PolarHBondContact O-N 3.07Å; E1747-R1750 VanDerWaalsContact O-N 3.12Å; E1747-E1751 WeakPolarHBondContact O-CB 3.37Å; E1747-E1751 WeakPolarHBondContact O-CG 3.12Å; E1747-E1751 PolarHBondContact O-N 3.46Å
1748	E	69.4	Low	64.5	Low	142 Å²	142	89.8 Å²	89.8	66%	0.664	44%	0.435	S	S	*	.	H	α-helix	trans	-55	-47.9	175.4	-76.4	-177.1	148.8	0	0	112.1	R1744 R1750 H1752	R1744-E1748 WeakPolarHBondContact O-CB 3.43Å; R1744-E1748 WeakPolarHBondContact O-CG 3.07Å; R1744-E1748 PolarHBondContact O-N 3.45Å; E1748-R1750 VanDerWaalsContact C-N 3.34Å; E1748-R1750 PolarHBondContact O-N 3.25Å; E1748-H1752 VanDerWaalsContact O-CB 3.3Å; E1748-H1752 WeakPolarHBondContact O-CB 3.27Å; E1748-H1752 PolarHBondContact O-N 2.9Å
1749	Q	58.7	Low	65.3	Low	129 Å²	129	89.6 Å²	89.6	60%	0.603	43%	0.429	S	S	*	.	H	α-helix	trans	-65.1	-38.8	178	-75.5	-175.9	-5.2	0	0	112.3	Q1745 E1747 M1753	Q1745-Q1749 WeakPolarHBondContact O-CB 3.21Å; Q1745-Q1749 VanDerWaalsContact O-CG 3.28Å; Q1745-Q1749 WeakPolarHBondContact O-CG 3.3Å; Q1745-Q1749 PolarHBondContact O-N 2.7Å; Q1745-Q1749 VanDerWaalsContact O-N 3.11Å; E1747-Q1749 PolarHBondContact O-N 2.75Å; Q1749-M1753 VanDerWaalsContact O-CB 3.3Å; Q1749-M1753 WeakPolarHBondContact O-CB 3.44Å; Q1749-M1753 PolarHBondContact O-N 2.74Å; Q1749-M1753 VanDerWaalsContact O-N 3.12Å
1750	R	59.6	Low	65.8	Low	94 Å²	94	90.6 Å²	90.6	36%	0.355	44%	0.436	S	S	.	.	H	α-helix	trans	-75.4	-35.5	-176.9	-160	162.6	-174.9	-144.6	-6.6	111.1	V1746 E1747 E1748 L1754 I2409 R2410 Q2412	V1746-R1750 WeakPolarHBondContact O-CB 3.19Å; V1746-R1750 PolarHBondContact O-N 2.85Å; E1747-R1750 PolarHBondContact O-N 3.07Å; E1747-R1750 VanDerWaalsContact O-N 3.12Å; E1748-R1750 VanDerWaalsContact C-N 3.34Å; E1748-R1750 PolarHBondContact O-N 3.25Å; R1750-L1754 WeakPolarHBondContact O-CB 3.42Å; R1750-L1754 WeakPolarHBondContact O-CD1 3.04Å; R1750-L1754 VanDerWaalsContact O-CG 3.3Å; R1750-L1754 WeakPolarHBondContact O-CG 3.38Å; R1750-L1754 PolarHBondContact O-N 3.33Å; R1750-I2409 HydrophobicContact CG-CG2 3.67Å; R1750-I2409 PolarHBondContact NH2-O 3.33Å; R1750-R2410 PolarHBondContact NH2-O 3.4Å; R1750-Q2412 PolarHBondContact O-NE2 2.85Å
1751	E	62.4	Low	65.8	Low	101 Å²	101	88.7 Å²	88.7	47%	0.472	44%	0.436	S	S	.	.	H	α-helix	trans	-71.1	-37.5	172.3	-70.6	-140.1	124.3	0	0	113.5	E1747 L1754 N1755 R2410	E1747-E1751 WeakPolarHBondContact O-CB 3.37Å; E1747-E1751 WeakPolarHBondContact O-CG 3.12Å; E1747-E1751 PolarHBondContact O-N 3.46Å; E1751-L1754 WeakPolarHBondContact O-CA 3.46Å; E1751-L1754 WeakPolarHBondContact O-CB 3.14Å; E1751-L1754 PolarHBondContact O-N 3.32Å; E1751-L1754 VanDerWaalsContact O-N 3.14Å; E1751-N1755 PolarHBondContact O-N 2.99Å; E1751-N1755 VanDerWaalsContact O-N 3.14Å; E1751-R2410 IonicContact OE1-NH1 3.24Å
1752	H	65	Low	66.1	Low	141 Å²	141	85.8 Å²	85.8	65%	0.653	43%	0.427	S	S	*	.	H	α-helix	trans	-73.1	-40.3	178.9	-153.8	-49.4	0	0	0	112.2	E1748 L1754 E1756	E1748-H1752 VanDerWaalsContact O-CB 3.3Å; E1748-H1752 WeakPolarHBondContact O-CB 3.27Å; E1748-H1752 PolarHBondContact O-N 2.9Å; H1752-L1754 PolarHBondContact O-N 3.13Å; H1752-E1756 WeakPolarHBondContact O-CB 3.37Å; H1752-E1756 PolarHBondContact O-N 2.77Å
1753	M	61.1	Low	66.6	Low	89 Å²	89	86.7 Å²	86.7	44%	0.438	43%	0.431	S	S	.	.	H	α-helix	trans	-63.2	-16.3	168.9	-173	170.3	74.2	0	0	112.4	Q1749 Q1757 L2411	Q1749-M1753 VanDerWaalsContact O-CB 3.3Å; Q1749-M1753 WeakPolarHBondContact O-CB 3.44Å; Q1749-M1753 PolarHBondContact O-N 2.74Å; Q1749-M1753 VanDerWaalsContact O-N 3.12Å; M1753-Q1757 WeakPolarHBondContact O-CB 3.41Å; M1753-Q1757 WeakPolarHBondContact O-CG 3.28Å; M1753-Q1757 PolarHBondContact O-N 2.77Å; M1753-L2411 HydrophobicContact CE-CD2 4.36Å
1754	L	64.2	Low	67	Low	0 Å²	0	88.4 Å²	88.4	0%	0	44%	0.436	C	S	.	.	H	α-helix	trans	-85.8	-52.6	-173.6	-116.9	159.3	0	0	0	113.6	R1750 E1751 H1752 E1756 Q1757 L1758 I2409 R2410 Q2412 R2413 V2414	R1750-L1754 WeakPolarHBondContact O-CB 3.42Å; R1750-L1754 WeakPolarHBondContact O-CD1 3.04Å; R1750-L1754 VanDerWaalsContact O-CG 3.3Å; R1750-L1754 WeakPolarHBondContact O-CG 3.38Å; R1750-L1754 PolarHBondContact O-N 3.33Å; E1751-L1754 WeakPolarHBondContact O-CA 3.46Å; E1751-L1754 WeakPolarHBondContact O-CB 3.14Å; E1751-L1754 PolarHBondContact O-N 3.32Å; E1751-L1754 VanDerWaalsContact O-N 3.14Å; H1752-L1754 PolarHBondContact O-N 3.13Å; L1754-E1756 PolarHBondContact O-N 3.31Å; L1754-Q1757 PolarHBondContact O-N 3.49Å; L1754-L1758 PolarHBondContact O-N 3.36Å; L1754-I2409 HydrophobicContact CD1-CG2 4.39Å; L1754-R2410 HydrophobicContact CD1-CB 4.24Å; L1754-R2410 HydrophobicContact CD1-CG 4.26Å; L1754-R2410 VanDerWaalsContact CD1-NH1 3.34Å; L1754-R2410 HydrophobicContact CD2-CB 4.36Å; L1754-R2410 HydrophobicContact CD2-CG 4.07Å; L1754-Q2412 HydrophobicContact CD1-CG 4.28Å; L1754-Q2412 HydrophobicContact CD2-CB 3.78Å; L1754-Q2412 HydrophobicContact CD2-CG 3.51Å; L1754-Q2412 WeakPolarHBondContact CD2-O 3.24Å; L1754-Q2412 HydrophobicContact CG-CB 4.31Å; L1754-Q2412 HydrophobicContact CG-CG 3.52Å; L1754-R2413 WeakPolarHBondContact CD2-O 3.35Å; L1754-V2414 HydrophobicContact CD2-CG2 4.17Å
1755	N	68.3	Low	66.8	Low	83 Å²	83	87.5 Å²	87.5	44%	0.444	44%	0.44	S	S	.	.	H	α-helix	trans	-67.9	-35.5	179.8	-59.6	-20.4	0	0	0	108.7	E1751 L1758 D1759	E1751-N1755 PolarHBondContact O-N 2.99Å; E1751-N1755 VanDerWaalsContact O-N 3.14Å; N1755-L1758 PolarHBondContact O-N 2.94Å; N1755-D1759 WeakPolarHBondContact O-CB 3.13Å; N1755-D1759 PolarHBondContact O-N 2.76Å
1756	E	70.3	Confident	67.1	Low	124 Å²	124	87.7 Å²	87.7	58%	0.579	44%	0.443	S	S	*	.	H	α-helix	trans	-62.8	-42.8	171.8	-167.3	166.6	-143.2	0	0	112.7	H1752 L1754 L1758 M1760	H1752-E1756 WeakPolarHBondContact O-CB 3.37Å; H1752-E1756 PolarHBondContact O-N 2.77Å; L1754-E1756 PolarHBondContact O-N 3.31Å; E1756-L1758 PolarHBondContact O-N 3.34Å; E1756-M1760 WeakPolarHBondContact O-CG 3.28Å; E1756-M1760 PolarHBondContact O-N 2.98Å; E1756-M1760 VanDerWaalsContact O-N 3.11Å
1757	Q	67.6	Low	67.2	Low	79 Å²	79	89.9 Å²	89.9	37%	0.369	45%	0.447	S	S	.	.	H	α-helix	trans	-67.5	-31.9	174.5	-83.3	-172.2	19.5	0	0	113.7	M1753 L1754 A1761 Q2412	M1753-Q1757 WeakPolarHBondContact O-CB 3.41Å; M1753-Q1757 WeakPolarHBondContact O-CG 3.28Å; M1753-Q1757 PolarHBondContact O-N 2.77Å; L1754-Q1757 PolarHBondContact O-N 3.49Å; Q1757-A1761 WeakPolarHBondContact O-CB 3.41Å; Q1757-A1761 PolarHBondContact O-N 3.37Å; Q1757-Q2412 HydrophobicContact CB-CB 4.45Å; Q1757-Q2412 VanDerWaalsContact OE1-OE1 3.06Å
1758	L	66.1	Low	67.2	Low	22 Å²	22	88.2 Å²	88.2	12%	0.115	45%	0.447	C	S	.	.	H	α-helix	trans	-84.3	-33.1	176.7	-149.1	92.8	0	0	0	113.6	L1754 N1755 E1756 M1760 A1761 D1762 V2414 V2415	L1754-L1758 PolarHBondContact O-N 3.36Å; N1755-L1758 PolarHBondContact O-N 2.94Å; E1756-L1758 PolarHBondContact O-N 3.34Å; L1758-M1760 PolarHBondContact O-N 3.45Å; L1758-A1761 HydrophobicContact CD1-CB 4.4Å; L1758-A1761 PolarHBondContact O-N 2.99Å; L1758-A1761 VanDerWaalsContact O-N 3.11Å; L1758-D1762 WeakPolarHBondContact O-CB 3.29Å; L1758-D1762 PolarHBondContact O-N 3.06Å; L1758-V2414 HydrophobicContact CB-CG2 3.74Å; L1758-V2414 HydrophobicContact CD1-CG2 4.1Å; L1758-V2414 WeakPolarHBondContact CD1-O 3.43Å; L1758-V2414 HydrophobicContact CD2-CB 3.84Å; L1758-V2414 HydrophobicContact CD2-CG2 3.76Å; L1758-V2414 HydrophobicContact CG-CG2 4.04Å; L1758-V2415 HydrophobicContact CD2-CG2 3.88Å
1759	D	71	Confident	67.2	Low	118 Å²	118	87.3 Å²	87.3	63%	0.631	44%	0.442	S	S	*	.	H	α-helix	trans	-60.4	-32.5	169.5	-72.3	-21.5	0	0	0	110.1	N1755 A1763	N1755-D1759 WeakPolarHBondContact O-CB 3.13Å; N1755-D1759 PolarHBondContact O-N 2.76Å; D1759-A1763 WeakPolarHBondContact O-CB 3.49Å; D1759-A1763 PolarHBondContact O-N 2.98Å
1760	M	71.6	Confident	68	Low	96 Å²	96	87 Å²	87	47%	0.473	44%	0.439	S	S	.	.	H	α-helix	trans	-68.8	-50	167	-75.2	-179.9	59.1	0	0	113	E1756 L1758 A1763 E1764	E1756-M1760 WeakPolarHBondContact O-CG 3.28Å; E1756-M1760 PolarHBondContact O-N 2.98Å; E1756-M1760 VanDerWaalsContact O-N 3.11Å; L1758-M1760 PolarHBondContact O-N 3.45Å; M1760-A1763 WeakPolarHBondContact O-CB 3.33Å; M1760-A1763 PolarHBondContact O-N 2.86Å; M1760-E1764 PolarHBondContact O-N 2.87Å
1761	A	65.7	Low	68.6	Low	38 Å²	38	86.3 Å²	86.3	31%	0.314	45%	0.445	S	S	.	.	H	α-helix	trans	-65.4	-39.5	-177.5	0	0	0	0	0	113.3	Q1757 L1758 A1763 E1764 L1765	Q1757-A1761 WeakPolarHBondContact O-CB 3.41Å; Q1757-A1761 PolarHBondContact O-N 3.37Å; L1758-A1761 HydrophobicContact CD1-CB 4.4Å; L1758-A1761 PolarHBondContact O-N 2.99Å; L1758-A1761 VanDerWaalsContact O-N 3.11Å; A1761-A1763 VanDerWaalsContact C-N 3.34Å; A1761-E1764 PolarHBondContact O-N 3.31Å; A1761-L1765 WeakPolarHBondContact O-CB 3.45Å; A1761-L1765 WeakPolarHBondContact O-CG 3.37Å; A1761-L1765 PolarHBondContact O-N 3.11Å
1762	D	72.6	Confident	69	Low	69 Å²	69	87.7 Å²	87.7	37%	0.369	45%	0.446	S	S	.	.	H	α-helix	trans	-68.6	-33.4	173.2	-80.7	-6.7	0	0	0	110.9	L1758 L1765 I1766	L1758-D1762 WeakPolarHBondContact O-CB 3.29Å; L1758-D1762 PolarHBondContact O-N 3.06Å; D1762-L1765 PolarHBondContact O-N 3.19Å; D1762-I1766 VanDerWaalsContact O-CB 3.3Å; D1762-I1766 WeakPolarHBondContact O-CB 3.08Å; D1762-I1766 WeakPolarHBondContact O-CD1 3.47Å; D1762-I1766 WeakPolarHBondContact O-CG1 3.1Å; D1762-I1766 PolarHBondContact O-N 2.69Å
1763	A	76.8	Confident	69	Low	51 Å²	51	85 Å²	85	42%	0.421	43%	0.433	S	S	.	.	H	α-helix	trans	-67.1	-44	171.5	0	0	0	0	0	112.4	D1759 M1760 A1761 I1766 E1767	D1759-A1763 WeakPolarHBondContact O-CB 3.49Å; D1759-A1763 PolarHBondContact O-N 2.98Å; M1760-A1763 WeakPolarHBondContact O-CB 3.33Å; M1760-A1763 PolarHBondContact O-N 2.86Å; A1761-A1763 VanDerWaalsContact C-N 3.34Å; A1763-I1766 PolarHBondContact O-N 3.13Å; A1763-E1767 WeakPolarHBondContact O-CG 3.47Å; A1763-E1767 PolarHBondContact O-N 3.4Å
1764	E	70.6	Confident	69.6	Low	88 Å²	88	85.4 Å²	85.4	41%	0.411	44%	0.437	S	S	.	.	H	α-helix	trans	-67.3	-33.3	173.7	-71.2	-147.5	152.3	0	0	112.2	M1760 A1761 S1768	M1760-E1764 PolarHBondContact O-N 2.87Å; A1761-E1764 PolarHBondContact O-N 3.31Å; E1764-S1768 WeakPolarHBondContact O-CB 3.32Å; E1764-S1768 PolarHBondContact O-N 3.33Å; E1764-S1768 PolarHBondContact O-OG 2.95Å
1765	L	63	Low	69.7	Low	108 Å²	108	91.3 Å²	91.3	57%	0.565	46%	0.464	S	S	*	.	H	α-helix	trans	-64.5	-42.8	169.8	-83.3	169	0	0	0	111.9	A1761 D1762 S1768 E1769	A1761-L1765 WeakPolarHBondContact O-CB 3.45Å; A1761-L1765 WeakPolarHBondContact O-CG 3.37Å; A1761-L1765 PolarHBondContact O-N 3.11Å; D1762-L1765 PolarHBondContact O-N 3.19Å; L1765-S1768 WeakPolarHBondContact CA-OG 3.08Å; L1765-S1768 PolarHBondContact O-OG 2.69Å; L1765-E1769 VanDerWaalsContact O-CB 3.25Å; L1765-E1769 WeakPolarHBondContact O-CB 3.44Å; L1765-E1769 PolarHBondContact O-N 2.96Å
1766	I	71	Confident	69.6	Low	89 Å²	89	90.5 Å²	90.5	46%	0.456	46%	0.457	S	S	.	.	H	α-helix	trans	-69.7	-36.6	177.8	-73.6	167	0	0	0	111.5	D1762 A1763 K1770	D1762-I1766 VanDerWaalsContact O-CB 3.3Å; D1762-I1766 WeakPolarHBondContact O-CB 3.08Å; D1762-I1766 WeakPolarHBondContact O-CD1 3.47Å; D1762-I1766 WeakPolarHBondContact O-CG1 3.1Å; D1762-I1766 PolarHBondContact O-N 2.69Å; A1763-I1766 PolarHBondContact O-N 3.13Å; I1766-K1770 HydrophobicContact CG2-CD 4.29Å; I1766-K1770 VanDerWaalsContact CG2-CE 3.44Å; I1766-K1770 VanDerWaalsContact CG2-NZ 3.28Å; I1766-K1770 WeakPolarHBondContact O-CB 3.39Å; I1766-K1770 VanDerWaalsContact O-CD 3.27Å; I1766-K1770 WeakPolarHBondContact O-CD 3.43Å; I1766-K1770 WeakPolarHBondContact O-CG 3.44Å; I1766-K1770 PolarHBondContact O-N 3.17Å; I1766-K1770 VanDerWaalsContact O-N 3.14Å
1767	E	69.9	Low	69.5	Low	129 Å²	129	89.5 Å²	89.5	60%	0.603	46%	0.455	S	S	*	.	H	α-helix	trans	-70.7	-44.2	173.1	-70	-121.5	127.4	0	0	111.8	A1763 K1770 V1771	A1763-E1767 WeakPolarHBondContact O-CG 3.47Å; A1763-E1767 PolarHBondContact O-N 3.4Å; E1767-K1770 WeakPolarHBondContact O-CB 3.33Å; E1767-K1770 PolarHBondContact O-N 3.4Å; E1767-V1771 WeakPolarHBondContact O-CB 3.03Å; E1767-V1771 VanDerWaalsContact O-CG2 3.31Å; E1767-V1771 WeakPolarHBondContact O-CG2 2.99Å; E1767-V1771 PolarHBondContact O-N 2.75Å
1768	S	66	Low	69.7	Low	63 Å²	63	92.1 Å²	92.1	44%	0.441	47%	0.465	S	S	.	.	H	α-helix	trans	-68.9	-33.5	177.9	62.7	0	0	0	0	112.7	E1764 L1765 V1771 W1772	E1764-S1768 WeakPolarHBondContact O-CB 3.32Å; E1764-S1768 PolarHBondContact O-N 3.33Å; E1764-S1768 PolarHBondContact O-OG 2.95Å; L1765-S1768 WeakPolarHBondContact CA-OG 3.08Å; L1765-S1768 PolarHBondContact O-OG 2.69Å; S1768-V1771 PolarHBondContact O-N 2.75Å; S1768-W1772 WeakPolarHBondContact O-CB 3.34Å; S1768-W1772 PolarHBondContact O-N 2.74Å
1769	E	70.4	Confident	69.7	Low	123 Å²	123	93.7 Å²	93.7	58%	0.575	48%	0.481	S	S	*	.	H	α-helix	trans	-66.9	-41.3	170.7	-172.3	174.9	-134.6	0	0	111.2	L1765 W1772 H1773	L1765-E1769 VanDerWaalsContact O-CB 3.25Å; L1765-E1769 WeakPolarHBondContact O-CB 3.44Å; L1765-E1769 PolarHBondContact O-N 2.96Å; E1769-W1772 PolarHBondContact O-N 2.98Å; E1769-H1773 WeakPolarHBondContact O-CB 3.23Å; E1769-H1773 PolarHBondContact O-N 3Å
1770	K	74	Confident	69.3	Low	122 Å²	122	92 Å²	92	53%	0.53	47%	0.472	S	S	.	.	H	α-helix	trans	-62	-45.7	172.6	-73.6	163.7	-169.7	164.6	0	111.9	I1766 E1767 H1773 L1774	I1766-K1770 HydrophobicContact CG2-CD 4.29Å; I1766-K1770 VanDerWaalsContact CG2-CE 3.44Å; I1766-K1770 VanDerWaalsContact CG2-NZ 3.28Å; I1766-K1770 WeakPolarHBondContact O-CB 3.39Å; I1766-K1770 VanDerWaalsContact O-CD 3.27Å; I1766-K1770 WeakPolarHBondContact O-CD 3.43Å; I1766-K1770 WeakPolarHBondContact O-CG 3.44Å; I1766-K1770 PolarHBondContact O-N 3.17Å; I1766-K1770 VanDerWaalsContact O-N 3.14Å; E1767-K1770 WeakPolarHBondContact O-CB 3.33Å; E1767-K1770 PolarHBondContact O-N 3.4Å; K1770-H1773 PolarHBondContact O-N 3.13Å; K1770-L1774 WeakPolarHBondContact O-CB 3.15Å; K1770-L1774 PolarHBondContact O-N 2.74Å
1771	V	74	Confident	69.3	Low	80 Å²	80	93.2 Å²	93.2	49%	0.485	48%	0.476	S	S	.	.	H	α-helix	trans	-63.5	-45.4	177.2	168.9	0	0	0	0	110.2	E1767 S1768 H1773 L1774 E1775	E1767-V1771 WeakPolarHBondContact O-CB 3.03Å; E1767-V1771 VanDerWaalsContact O-CG2 3.31Å; E1767-V1771 WeakPolarHBondContact O-CG2 2.99Å; E1767-V1771 PolarHBondContact O-N 2.75Å; S1768-V1771 PolarHBondContact O-N 2.75Å; V1771-H1773 PolarHBondContact O-N 3.08Å; V1771-L1774 CarbonylContact O-C 3.49Å; V1771-L1774 WeakPolarHBondContact O-CB 3.34Å; V1771-L1774 PolarHBondContact O-N 3.47Å; V1771-L1774 VanDerWaalsContact O-N 3.14Å; V1771-E1775 HydrophobicContact CG1-CG 4.42Å; V1771-E1775 PolarHBondContact O-N 3.08Å
1772	W	70.8	Confident	69.6	Low	130 Å²	130	95.9 Å²	95.9	49%	0.492	48%	0.482	S	S	.	.	H	α-helix	trans	-62.2	-40.3	174.9	179.5	81.7	0	0	0	111.8	S1768 E1769 E1775 K1776	S1768-W1772 WeakPolarHBondContact O-CB 3.34Å; S1768-W1772 PolarHBondContact O-N 2.74Å; E1769-W1772 PolarHBondContact O-N 2.98Å; W1772-E1775 PolarHBondContact O-N 2.81Å; W1772-K1776 HydrophobicContact CD2-CD 4.24Å; W1772-K1776 HydrophobicContact CE3-CD 4.01Å; W1772-K1776 HydrophobicContact CH2-CD 3.77Å; W1772-K1776 HydrophobicContact CZ2-CD 3.95Å; W1772-K1776 HydrophobicContact CZ3-CD 3.79Å; W1772-K1776 WeakPolarHBondContact O-CB 3.29Å; W1772-K1776 PolarHBondContact O-N 3.02Å
1773	H	65	Low	69	Low	83 Å²	83	94.4 Å²	94.4	38%	0.384	48%	0.479	S	S	.	.	H	α-helix	trans	-64.8	-38.2	173.1	-111.3	-100.1	0	0	0	112.2	E1769 K1770 V1771 K1776 L1777	E1769-H1773 WeakPolarHBondContact O-CB 3.23Å; E1769-H1773 PolarHBondContact O-N 3Å; K1770-H1773 PolarHBondContact O-N 3.13Å; V1771-H1773 PolarHBondContact O-N 3.08Å; H1773-K1776 PolarHBondContact NE2-NZ 3.11Å; H1773-L1777 VanDerWaalsContact O-CB 3.28Å; H1773-L1777 WeakPolarHBondContact O-CB 3.47Å; H1773-L1777 VanDerWaalsContact O-CG 3.25Å; H1773-L1777 WeakPolarHBondContact O-CG 3.5Å; H1773-L1777 PolarHBondContact O-N 2.78Å
1774	L	71.8	Confident	68.5	Low	98 Å²	98	95.6 Å²	95.6	51%	0.513	48%	0.479	S	S	.	.	H	α-helix	trans	-68.3	-41.6	174.4	-99	162.6	0	0	0	112.8	K1770 V1771 L1777 K1778	K1770-L1774 WeakPolarHBondContact O-CB 3.15Å; K1770-L1774 PolarHBondContact O-N 2.74Å; V1771-L1774 CarbonylContact O-C 3.49Å; V1771-L1774 WeakPolarHBondContact O-CB 3.34Å; V1771-L1774 PolarHBondContact O-N 3.47Å; V1771-L1774 VanDerWaalsContact O-N 3.14Å; L1774-L1777 PolarHBondContact O-N 3.13Å; L1774-K1778 WeakPolarHBondContact O-CB 3.44Å; L1774-K1778 VanDerWaalsContact O-CG 3.23Å; L1774-K1778 WeakPolarHBondContact O-CG 3.49Å; L1774-K1778 PolarHBondContact O-N 2.92Å
1775	E	66.9	Low	68	Low	124 Å²	124	96.1 Å²	96.1	58%	0.579	48%	0.481	S	S	*	.	H	α-helix	trans	-71.2	-35.7	175.3	-71.8	-157.7	139.8	0	0	112	V1771 W1772 K1778 A1779	V1771-E1775 HydrophobicContact CG1-CG 4.42Å; V1771-E1775 PolarHBondContact O-N 3.08Å; W1772-E1775 PolarHBondContact O-N 2.81Å; E1775-K1778 CarbonylContact O-C 3.57Å; E1775-K1778 PolarHBondContact O-N 3.21Å; E1775-A1779 WeakPolarHBondContact O-CB 3.32Å; E1775-A1779 PolarHBondContact O-N 3.3Å
1776	K	66.2	Low	67.7	Low	66 Å²	66	97.1 Å²	97.1	29%	0.287	48%	0.477	S	S	.	.	H	α-helix	trans	-66.8	-38.1	172.3	175.2	-178.2	168.1	-166.6	0	112.1	W1772 H1773 L1780	W1772-K1776 HydrophobicContact CD2-CD 4.24Å; W1772-K1776 HydrophobicContact CE3-CD 4.01Å; W1772-K1776 HydrophobicContact CH2-CD 3.77Å; W1772-K1776 HydrophobicContact CZ2-CD 3.95Å; W1772-K1776 HydrophobicContact CZ3-CD 3.79Å; W1772-K1776 WeakPolarHBondContact O-CB 3.29Å; W1772-K1776 PolarHBondContact O-N 3.02Å; H1773-K1776 PolarHBondContact NE2-NZ 3.11Å; K1776-L1780 WeakPolarHBondContact O-CB 3.46Å; K1776-L1780 VanDerWaalsContact O-CG 3.28Å; K1776-L1780 WeakPolarHBondContact O-CG 3.44Å; K1776-L1780 PolarHBondContact O-N 2.78Å
1777	L	68.5	Low	67.1	Low	104 Å²	104	99.6 Å²	99.6	55%	0.545	48%	0.481	S	S	.	.	H	α-helix	trans	-70.6	-42.2	171.6	-77.6	168.8	0	0	0	111.4	H1773 L1774 L1780 H1781	H1773-L1777 VanDerWaalsContact O-CB 3.28Å; H1773-L1777 WeakPolarHBondContact O-CB 3.47Å; H1773-L1777 VanDerWaalsContact O-CG 3.25Å; H1773-L1777 WeakPolarHBondContact O-CG 3.5Å; H1773-L1777 PolarHBondContact O-N 2.78Å; L1774-L1777 PolarHBondContact O-N 3.13Å; L1777-L1780 PolarHBondContact O-N 2.72Å; L1777-H1781 VanDerWaalsContact O-CB 3.31Å; L1777-H1781 WeakPolarHBondContact O-CB 3.23Å; L1777-H1781 PolarHBondContact O-N 2.73Å
1778	K	70.9	Confident	66.4	Low	134 Å²	134	95.5 Å²	95.5	58%	0.583	47%	0.47	S	S	*	.	H	α-helix	trans	-62.6	-40.4	172.2	-76.5	169.8	-178	173.3	0	112.3	L1774 E1775 H1781 E1782	L1774-K1778 WeakPolarHBondContact O-CB 3.44Å; L1774-K1778 VanDerWaalsContact O-CG 3.23Å; L1774-K1778 WeakPolarHBondContact O-CG 3.49Å; L1774-K1778 PolarHBondContact O-N 2.92Å; E1775-K1778 CarbonylContact O-C 3.57Å; E1775-K1778 PolarHBondContact O-N 3.21Å; K1778-H1781 PolarHBondContact O-N 3.37Å; K1778-E1782 WeakPolarHBondContact O-CB 3.33Å; K1778-E1782 PolarHBondContact O-N 3.33Å
1779	A	66.5	Low	65.8	Low	54 Å²	54	97.6 Å²	97.6	45%	0.446	48%	0.476	S	S	.	.	H	α-helix	trans	-76.5	-23.9	179.3	0	0	0	0	0	112.5	E1775 A1783	E1775-A1779 WeakPolarHBondContact O-CB 3.32Å; E1775-A1779 PolarHBondContact O-N 3.3Å; A1779-A1783 WeakPolarHBondContact O-CB 3.46Å; A1779-A1783 PolarHBondContact O-N 2.83Å; A1779-A1783 VanDerWaalsContact O-N 3.1Å
1780	L	63.4	Low	64.8	Low	83 Å²	83	97.3 Å²	97.3	44%	0.435	48%	0.477	S	S	.	.	H	α-helix	trans	-73.2	-47	164.8	-79.3	167.9	0	0	0	110.7	K1776 L1777 E1782 A1783 D1784	K1776-L1780 WeakPolarHBondContact O-CB 3.46Å; K1776-L1780 VanDerWaalsContact O-CG 3.28Å; K1776-L1780 WeakPolarHBondContact O-CG 3.44Å; K1776-L1780 PolarHBondContact O-N 2.78Å; L1777-L1780 PolarHBondContact O-N 2.72Å; L1780-E1782 PolarHBondContact O-N 2.8Å; L1780-A1783 CarbonylContact O-C 3.58Å; L1780-A1783 PolarHBondContact O-N 3.11Å; L1780-A1783 VanDerWaalsContact O-N 3.09Å; L1780-D1784 WeakPolarHBondContact O-CB 3.5Å; L1780-D1784 PolarHBondContact O-N 3.5Å
1781	H	71.9	Confident	63.5	Low	122 Å²	122	97.3 Å²	97.3	57%	0.565	48%	0.479	S	S	*	.	H	α-helix	trans	-61.4	-44.6	177.1	-163	77.4	0	0	0	111.4	L1777 K1778 A1783 D1784 E1785	L1777-H1781 VanDerWaalsContact O-CB 3.31Å; L1777-H1781 WeakPolarHBondContact O-CB 3.23Å; L1777-H1781 PolarHBondContact O-N 2.73Å; K1778-H1781 PolarHBondContact O-N 3.37Å; H1781-A1783 VanDerWaalsContact C-N 3.28Å; H1781-A1783 PolarHBondContact O-N 2.82Å; H1781-D1784 CarbonylContact O-C 3.59Å; H1781-D1784 PolarHBondContact O-N 2.82Å; H1781-E1785 IonicContact CD2-OE2 3.39Å; H1781-E1785 WeakPolarHBondContact O-CA 3.21Å; H1781-E1785 VanDerWaalsContact O-CB 3.22Å; H1781-E1785 WeakPolarHBondContact O-CB 3.26Å; H1781-E1785 WeakPolarHBondContact O-CG 3.42Å; H1781-E1785 PolarHBondContact O-N 3.34Å
1782	E	70.9	Confident	62	Low	93 Å²	93	95.8 Å²	95.8	44%	0.435	47%	0.468	S	S	.	.	H	α-helix	trans	-76.1	-12.1	176	-158	-153.7	-161.5	0	0	112.5	K1778 L1780 R1786	K1778-E1782 WeakPolarHBondContact O-CB 3.33Å; K1778-E1782 PolarHBondContact O-N 3.33Å; L1780-E1782 PolarHBondContact O-N 2.8Å; E1782-R1786 VanDerWaalsContact O-CB 3.27Å; E1782-R1786 WeakPolarHBondContact O-CB 3.27Å; E1782-R1786 WeakPolarHBondContact O-CD 3.38Å; E1782-R1786 WeakPolarHBondContact O-CG 3.39Å; E1782-R1786 PolarHBondContact O-N 2.68Å; E1782-R1786 PolarHBondContact O-NH1 3.14Å; E1782-R1786 IonicContact OE1-CZ 3.64Å; E1782-R1786 IonicContact OE1-NH1 3.76Å; E1782-R1786 IonicContact OE1-NH2 1.76Å; E1782-R1786 PolarHBondContact OE1-NH2 2.85Å; E1782-R1786 IonicContact OE2-CZ 2.84Å; E1782-R1786 IonicContact OE2-NH1 3.83Å; E1782-R1786 PolarHBondContact OE2-NH1 3.46Å; E1782-R1786 IonicContact OE2-NH2 3.68Å; E1782-R1786 PolarHBondContact OE2-NH2 3.44Å
1783	A	61.5	Low	60.5	Low	38 Å²	38	95.4 Å²	95.4	31%	0.314	48%	0.476	S	S	.	.	H	α-helix	trans	-89.3	-31.9	168.8	0	0	0	0	0	111.9	A1779 L1780 H1781 R1786 R1787	A1779-A1783 WeakPolarHBondContact O-CB 3.46Å; A1779-A1783 PolarHBondContact O-N 2.83Å; A1779-A1783 VanDerWaalsContact O-N 3.1Å; L1780-A1783 CarbonylContact O-C 3.58Å; L1780-A1783 PolarHBondContact O-N 3.11Å; L1780-A1783 VanDerWaalsContact O-N 3.09Å; H1781-A1783 VanDerWaalsContact C-N 3.28Å; H1781-A1783 PolarHBondContact O-N 2.82Å; A1783-R1786 CarbonylContact O-C 2.9Å; A1783-R1787 WeakPolarHBondContact O-CG 3.38Å; A1783-R1787 PolarHBondContact O-N 3.29Å
1784	D	64.5	Low	59.2	Low	76 Å²	76	99 Å²	99	41%	0.406	50%	0.498	S	S	.	.	H	α-helix	trans	-87.6	-22.9	175.9	-71.5	-26.4	0	0	0	112.2	L1780 H1781 R1787 A1788	L1780-D1784 WeakPolarHBondContact O-CB 3.5Å; L1780-D1784 PolarHBondContact O-N 3.5Å; H1781-D1784 CarbonylContact O-C 3.59Å; H1781-D1784 PolarHBondContact O-N 2.82Å; D1784-R1787 PolarHBondContact O-N 3.23Å; D1784-R1787 IonicContact OD1-CZ 2.72Å; D1784-R1787 IonicContact OD1-NH1 3.44Å; D1784-R1787 PolarHBondContact OD1-NH1 2.85Å; D1784-A1788 WeakPolarHBondContact O-CB 3.14Å; D1784-A1788 PolarHBondContact O-N 2.94Å
1785	E	61.9	Low	57.3	Low	100 Å²	100	100.8 Å²	100.8	47%	0.467	51%	0.505	S	S	.	.	H	α-helix	trans	-69.9	-42.3	159.6	-79.4	-175.4	124.4	0	0	109.5	H1781 R1787 A1788 D1789	H1781-E1785 IonicContact CD2-OE2 3.39Å; H1781-E1785 WeakPolarHBondContact O-CA 3.21Å; H1781-E1785 VanDerWaalsContact O-CB 3.22Å; H1781-E1785 WeakPolarHBondContact O-CB 3.26Å; H1781-E1785 WeakPolarHBondContact O-CG 3.42Å; H1781-E1785 PolarHBondContact O-N 3.34Å; E1785-R1787 VanDerWaalsContact C-N 3.29Å; E1785-R1787 PolarHBondContact O-N 2.99Å; E1785-A1788 CarbonylContact O-C 3.6Å; E1785-A1788 PolarHBondContact O-N 3.09Å; E1785-D1789 VanDerWaalsContact O-CB 3.31Å; E1785-D1789 WeakPolarHBondContact O-CB 3.43Å; E1785-D1789 PolarHBondContact O-N 3.22Å
1786	R	55.5	Low	55.4	Low	128 Å²	128	102.1 Å²	102.1	48%	0.483	51%	0.51	S	S	.	.	H	α-helix	trans	-68.9	-23.7	171.3	-77.2	-179.4	-162.2	108.4	-10.1	113.5	E1782 A1783 L1790	E1782-R1786 VanDerWaalsContact O-CB 3.27Å; E1782-R1786 WeakPolarHBondContact O-CB 3.27Å; E1782-R1786 WeakPolarHBondContact O-CD 3.38Å; E1782-R1786 WeakPolarHBondContact O-CG 3.39Å; E1782-R1786 PolarHBondContact O-N 2.68Å; E1782-R1786 PolarHBondContact O-NH1 3.14Å; E1782-R1786 IonicContact OE1-CZ 3.64Å; E1782-R1786 IonicContact OE1-NH1 3.76Å; E1782-R1786 IonicContact OE1-NH2 1.76Å; E1782-R1786 PolarHBondContact OE1-NH2 2.85Å; E1782-R1786 IonicContact OE2-CZ 2.84Å; E1782-R1786 IonicContact OE2-NH1 3.83Å; E1782-R1786 PolarHBondContact OE2-NH1 3.46Å; E1782-R1786 IonicContact OE2-NH2 3.68Å; E1782-R1786 PolarHBondContact OE2-NH2 3.44Å; A1783-R1786 CarbonylContact O-C 2.9Å; R1786-L1790 WeakPolarHBondContact O-CB 3.5Å; R1786-L1790 WeakPolarHBondContact O-CD1 3.45Å; R1786-L1790 WeakPolarHBondContact O-CG 3.4Å; R1786-L1790 PolarHBondContact O-N 3.14Å
1787	R	58	Low	53.6	Low	141 Å²	141	109.5 Å²	109.5	53%	0.532	54%	0.537	S	S	.	.	H	α-helix	trans	-73.7	-47.1	165.6	-80.5	-168.1	178.2	101.4	-2.8	110.4	A1783 D1784 E1785 D1789 L1790 E1791	A1783-R1787 WeakPolarHBondContact O-CG 3.38Å; A1783-R1787 PolarHBondContact O-N 3.29Å; D1784-R1787 PolarHBondContact O-N 3.23Å; D1784-R1787 IonicContact OD1-CZ 2.72Å; D1784-R1787 IonicContact OD1-NH1 3.44Å; D1784-R1787 PolarHBondContact OD1-NH1 2.85Å; E1785-R1787 VanDerWaalsContact C-N 3.29Å; E1785-R1787 PolarHBondContact O-N 2.99Å; R1787-D1789 VanDerWaalsContact C-N 3.31Å; R1787-D1789 PolarHBondContact O-N 2.68Å; R1787-L1790 CarbonylContact O-C 3.56Å; R1787-L1790 PolarHBondContact O-N 2.74Å; R1787-E1791 WeakPolarHBondContact O-CB 2.93Å; R1787-E1791 WeakPolarHBondContact O-CG 3.35Å; R1787-E1791 PolarHBondContact O-N 3.43Å
1788	A	57	Low	51.6	Low	44 Å²	44	110.1 Å²	110.1	36%	0.364	55%	0.549	S	S	.	.	H	α-helix	trans	-56.9	-46.5	177	0	0	0	0	0	110.1	D1784 E1785 L1790 E1791 D1792	D1784-A1788 WeakPolarHBondContact O-CB 3.14Å; D1784-A1788 PolarHBondContact O-N 2.94Å; E1785-A1788 CarbonylContact O-C 3.6Å; E1785-A1788 PolarHBondContact O-N 3.09Å; A1788-L1790 VanDerWaalsContact C-N 3.3Å; A1788-L1790 PolarHBondContact O-N 3.49Å; A1788-E1791 PolarHBondContact O-N 3.16Å; A1788-D1792 WeakPolarHBondContact O-CA 3.11Å; A1788-D1792 WeakPolarHBondContact O-CB 3.26Å; A1788-D1792 PolarHBondContact O-N 3.03Å
1789	D	52.4	Low	49.4	Very low	106 Å²	106	110.3 Å²	110.3	57%	0.567	57%	0.566	S	S	*	*	H	α-helix	trans	-62.2	-29.1	173.9	-80.4	-22	0	0	0	113.4	E1785 R1787 D1793	E1785-D1789 VanDerWaalsContact O-CB 3.31Å; E1785-D1789 WeakPolarHBondContact O-CB 3.43Å; E1785-D1789 PolarHBondContact O-N 3.22Å; R1787-D1789 VanDerWaalsContact C-N 3.31Å; R1787-D1789 PolarHBondContact O-N 2.68Å; D1789-D1793 WeakPolarHBondContact O-CB 3.31Å; D1789-D1793 PolarHBondContact O-N 2.61Å
1790	L	49.8	Very low	47.5	Very low	117 Å²	117	110.8 Å²	110.8	61%	0.613	58%	0.576	S	S	*	*	H	α-helix	trans	-86.6	-36.6	177.7	-77.8	171.3	0	0	0	112.6	R1786 R1787 A1788 D1792 D1794	R1786-L1790 WeakPolarHBondContact O-CB 3.5Å; R1786-L1790 WeakPolarHBondContact O-CD1 3.45Å; R1786-L1790 WeakPolarHBondContact O-CG 3.4Å; R1786-L1790 PolarHBondContact O-N 3.14Å; R1787-L1790 CarbonylContact O-C 3.56Å; R1787-L1790 PolarHBondContact O-N 2.74Å; A1788-L1790 VanDerWaalsContact C-N 3.3Å; A1788-L1790 PolarHBondContact O-N 3.49Å; L1790-D1792 VanDerWaalsContact C-N 3.34Å; L1790-D1794 WeakPolarHBondContact O-CB 3.11Å; L1790-D1794 PolarHBondContact O-N 2.75Å
1791	E	46.5	Very low	45.7	Very low	122 Å²	122	116.8 Å²	116.8	57%	0.57	60%	0.599	S	S	*	*	H	α-helix	trans	-73.5	-30.8	172.5	-68.1	173.8	-158.1	0	0	110.1	R1787 A1788 M1795	R1787-E1791 WeakPolarHBondContact O-CB 2.93Å; R1787-E1791 WeakPolarHBondContact O-CG 3.35Å; R1787-E1791 PolarHBondContact O-N 3.43Å; A1788-E1791 PolarHBondContact O-N 3.16Å; E1791-M1795 WeakPolarHBondContact O-CB 3.32Å; E1791-M1795 VanDerWaalsContact O-CG 3.29Å; E1791-M1795 WeakPolarHBondContact O-CG 3.34Å; E1791-M1795 PolarHBondContact O-N 2.79Å
1792	D	42.6	Very low	43.6	Very low	48 Å²	48	121.7 Å²	121.7	26%	0.257	61%	0.614	S	S	.	*	H	α-helix	trans	-76.3	-40.9	167.5	-84.7	-31.6	0	0	0	111.4	A1788 L1790 D1794 M1795 F1796	A1788-D1792 WeakPolarHBondContact O-CA 3.11Å; A1788-D1792 WeakPolarHBondContact O-CB 3.26Å; A1788-D1792 PolarHBondContact O-N 3.03Å; L1790-D1792 VanDerWaalsContact C-N 3.34Å; D1792-D1794 PolarHBondContact O-N 2.81Å; D1792-M1795 CarbonylContact O-C 2.86Å; D1792-M1795 WeakPolarHBondContact O-CA 3.05Å; D1792-M1795 PolarHBondContact O-N 3.47Å; D1792-M1795 WeakPolarHBondContact OD1-CE 3.29Å; D1792-F1796 HydrophobicContact CB-CD2 3.73Å; D1792-F1796 HydrophobicContact CB-CE2 4.07Å; D1792-F1796 WeakPolarHBondContact O-CA 3.48Å; D1792-F1796 WeakPolarHBondContact O-CB 3.47Å; D1792-F1796 WeakPolarHBondContact O-CD2 3.43Å; D1792-F1796 PolarHBondContact O-N 3.21Å
1793	D	39.7	Very low	41.6	Very low	122 Å²	122	123.6 Å²	123.6	65%	0.652	63%	0.627	S	S	*	*	H	α-helix	trans	-61.9	-33.4	172.5	-102.7	-14.5	0	0	0	111.6	D1789	D1789-D1793 WeakPolarHBondContact O-CB 3.31Å; D1789-D1793 PolarHBondContact O-N 2.61Å
1794	D	37.8	Very low	40.1	Very low	160 Å²	160	126.7 Å²	126.7	86%	0.856	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-11.6	170.1	-88.1	-25.4	0	0	0	113.8	L1790 D1792	L1790-D1794 WeakPolarHBondContact O-CB 3.11Å; L1790-D1794 PolarHBondContact O-N 2.75Å; D1792-D1794 PolarHBondContact O-N 2.81Å
1795	M	31.5	Very low	39.1	Very low	134 Å²	134	127.5 Å²	127.5	66%	0.66	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.5	-23	170.3	-77.7	-158.8	-63.9	0	0	115.3	E1791 D1792 Y1797	E1791-M1795 WeakPolarHBondContact O-CB 3.32Å; E1791-M1795 VanDerWaalsContact O-CG 3.29Å; E1791-M1795 WeakPolarHBondContact O-CG 3.34Å; E1791-M1795 PolarHBondContact O-N 2.79Å; D1792-M1795 CarbonylContact O-C 2.86Å; D1792-M1795 WeakPolarHBondContact O-CA 3.05Å; D1792-M1795 PolarHBondContact O-N 3.47Å; D1792-M1795 WeakPolarHBondContact OD1-CE 3.29Å; M1795-Y1797 PolarHBondContact O-N 3.48Å
1796	F	27.4	Very low	38.1	Very low	153 Å²	153	126 Å²	126	67%	0.671	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	25.9	-166.4	-102	-96	0	0	0	115.1	D1792	D1792-F1796 HydrophobicContact CB-CD2 3.73Å; D1792-F1796 HydrophobicContact CB-CE2 4.07Å; D1792-F1796 WeakPolarHBondContact O-CA 3.48Å; D1792-F1796 WeakPolarHBondContact O-CB 3.47Å; D1792-F1796 WeakPolarHBondContact O-CD2 3.43Å; D1792-F1796 PolarHBondContact O-N 3.21Å
1797	Y	27.1	Very low	37.2	Very low	220 Å²	220	126.1 Å²	126.1	86%	0.863	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.6	27.8	173.1	-99	-67.1	0	0	0	116.8	M1795	M1795-Y1797 PolarHBondContact O-N 3.48Å
1798	C	27	Very low	36.6	Very low	118 Å²	118	124 Å²	124	80%	0.797	66%	0.655	S	S	*	*	S	Bend	trans	-167.9	96.5	142.2	-114.2	0	0	0	0	118
1799	C	24.1	Very low	36.2	Very low	137 Å²	137	124.3 Å²	124.3	93%	0.926	66%	0.657	S	S	*	*			trans	36	116.6	145.5	-66.9	0	0	0	0	121.8
1800	G	26.3	Very low	35.8	Very low	65 Å²	65	123.7 Å²	123.7	67%	0.67	65%	0.651	S	S	*	*				153.7	87.6	129.4	0	0	0	0	0	120.7
1801	K	27	Very low	35.6	Very low	208 Å²	208	122.7 Å²	122.7	90%	0.904	65%	0.645	S	S	*	*			trans	48.2	76	155.1	-59.9	-178.3	179.2	178.7	0	117.5
1802	Y	26.6	Very low	35.5	Very low	225 Å²	225	122.2 Å²	122.2	88%	0.882	64%	0.643	S	S	*	*			trans	-130.4	130.9	148.9	-85.1	-88.7	0	0	0	108.5	L1804	Y1802-L1804 PolarHBondContact O-N 2.72Å; Y1802-L1804 VanDerWaalsContact O-N 3.16Å
1803	D	30	Very low	35.9	Very low	134 Å²	134	127.4 Å²	127.4	72%	0.717	66%	0.659	S	S	*	*			trans	-83	91.1	-174.4	-82.9	-45.5	0	0	0	110.2	S1805 S1806	D1803-S1805 PolarHBondContact O-N 3.23Å; D1803-S1806 WeakPolarHBondContact O-CB 3.31Å; D1803-S1806 PolarHBondContact O-N 2.93Å
1804	L	29.9	Very low	36.3	Very low	103 Å²	103	126.3 Å²	126.3	54%	0.539	65%	0.653	S	S	.	*	H	α-helix	trans	-55.8	-29	170.5	-133.2	73.6	0	0	0	111.6	Y1802 S1806 Q1807 L1808	Y1802-L1804 PolarHBondContact O-N 2.72Å; Y1802-L1804 VanDerWaalsContact O-N 3.16Å; L1804-S1806 PolarHBondContact O-N 3.18Å; L1804-Q1807 PolarHBondContact O-N 3.02Å; L1804-Q1807 VanDerWaalsContact O-N 3.11Å; L1804-L1808 WeakPolarHBondContact O-CB 3.28Å; L1804-L1808 PolarHBondContact O-N 3.15Å
1805	S	42.5	Very low	36.5	Very low	92 Å²	92	124.9 Å²	124.9	64%	0.643	64%	0.641	S	S	*	*	H	α-helix	trans	-62.2	-16.5	171.1	-55.8	0	0	0	0	114.7	D1803 A1809	D1803-S1805 PolarHBondContact O-N 3.23Å; S1805-A1809 WeakPolarHBondContact O-CB 3.32Å; S1805-A1809 PolarHBondContact O-N 3.36Å
1806	S	42.3	Very low	37.2	Very low	68 Å²	68	125.2 Å²	125.2	48%	0.476	64%	0.635	S	S	.	*	H	α-helix	trans	-79.3	-43.7	169.9	-159.8	0	0	0	0	110.7	D1803 L1804 A1809 E1810	D1803-S1806 WeakPolarHBondContact O-CB 3.31Å; D1803-S1806 PolarHBondContact O-N 2.93Å; L1804-S1806 PolarHBondContact O-N 3.18Å; S1806-A1809 CarbonylContact O-C 3.55Å; S1806-A1809 PolarHBondContact O-N 3.12Å; S1806-E1810 WeakPolarHBondContact O-CB 3.32Å; S1806-E1810 PolarHBondContact O-N 3.02Å
1807	Q	36.3	Very low	37.9	Very low	131 Å²	131	121.3 Å²	121.3	61%	0.612	62%	0.62	S	S	*	*	H	α-helix	trans	-74.7	-32.8	179.4	-74.3	-179.4	-41.5	0	0	112.7	L1804 A1809 E1810 L1811	L1804-Q1807 PolarHBondContact O-N 3.02Å; L1804-Q1807 VanDerWaalsContact O-N 3.11Å; Q1807-A1809 VanDerWaalsContact C-N 3.34Å; Q1807-E1810 PolarHBondContact O-N 2.94Å; Q1807-L1811 WeakPolarHBondContact O-CB 3.03Å; Q1807-L1811 VanDerWaalsContact O-CG 3.29Å; Q1807-L1811 WeakPolarHBondContact O-CG 2.95Å; Q1807-L1811 PolarHBondContact O-N 3.38Å
1808	L	44.7	Very low	38.3	Very low	98 Å²	98	120 Å²	120	51%	0.513	61%	0.614	S	S	.	*	H	α-helix	trans	-69.7	-30.8	168.6	-70.5	169	0	0	0	111.9	L1804 E1812	L1804-L1808 WeakPolarHBondContact O-CB 3.28Å; L1804-L1808 PolarHBondContact O-N 3.15Å; L1808-E1812 VanDerWaalsContact O-CB 3.31Å; L1808-E1812 WeakPolarHBondContact O-CB 3.4Å; L1808-E1812 WeakPolarHBondContact O-CG 3.13Å; L1808-E1812 PolarHBondContact O-N 3.43Å
1809	A	49.5	Very low	39	Very low	50 Å²	50	121.4 Å²	121.4	41%	0.413	61%	0.61	S	S	.	*	H	α-helix	trans	-74.8	-29.3	169.9	0	0	0	0	0	112.9	S1805 S1806 Q1807 R1813	S1805-A1809 WeakPolarHBondContact O-CB 3.32Å; S1805-A1809 PolarHBondContact O-N 3.36Å; S1806-A1809 CarbonylContact O-C 3.55Å; S1806-A1809 PolarHBondContact O-N 3.12Å; Q1807-A1809 VanDerWaalsContact C-N 3.34Å; A1809-R1813 WeakPolarHBondContact O-CB 3.35Å; A1809-R1813 PolarHBondContact O-N 2.83Å
1810	E	42.8	Very low	39.6	Very low	93 Å²	93	121.2 Å²	121.2	44%	0.435	60%	0.596	S	S	.	*	H	α-helix	trans	-71.7	-39	170.7	-134.3	76	-117.4	0	0	110.8	S1806 Q1807 R1813 L1814	S1806-E1810 WeakPolarHBondContact O-CB 3.32Å; S1806-E1810 PolarHBondContact O-N 3.02Å; Q1807-E1810 PolarHBondContact O-N 2.94Å; E1810-R1813 CarbonylContact O-C 3.53Å; E1810-R1813 WeakPolarHBondContact O-CB 3.19Å; E1810-R1813 PolarHBondContact O-N 3.37Å; E1810-L1814 WeakPolarHBondContact O-CB 3.26Å; E1810-L1814 VanDerWaalsContact O-CG 3.25Å; E1810-L1814 WeakPolarHBondContact O-CG 3.3Å; E1810-L1814 PolarHBondContact O-N 2.92Å
1811	L	47.1	Very low	40	Very low	95 Å²	95	125.4 Å²	125.4	50%	0.497	60%	0.598	S	S	.	*	H	α-helix	trans	-72.5	-46.7	176.7	-74.3	167.6	0	0	0	112	Q1807 R1813 L1814 E1815	Q1807-L1811 WeakPolarHBondContact O-CB 3.03Å; Q1807-L1811 VanDerWaalsContact O-CG 3.29Å; Q1807-L1811 WeakPolarHBondContact O-CG 2.95Å; Q1807-L1811 PolarHBondContact O-N 3.38Å; L1811-R1813 PolarHBondContact O-N 3.13Å; L1811-R1813 VanDerWaalsContact O-N 3.07Å; L1811-L1814 PolarHBondContact O-N 2.91Å; L1811-L1814 VanDerWaalsContact O-N 3.15Å; L1811-E1815 WeakPolarHBondContact O-CB 3.11Å; L1811-E1815 WeakPolarHBondContact O-CG 3.42Å; L1811-E1815 PolarHBondContact O-N 3.19Å
1812	E	44.3	Very low	40.2	Very low	112 Å²	112	120.8 Å²	120.8	52%	0.523	59%	0.588	S	S	.	*	H	α-helix	trans	-58	-23.9	170	-83.6	-167.2	171.5	0	0	112.5	L1808 R1816	L1808-E1812 VanDerWaalsContact O-CB 3.31Å; L1808-E1812 WeakPolarHBondContact O-CB 3.4Å; L1808-E1812 WeakPolarHBondContact O-CG 3.13Å; L1808-E1812 PolarHBondContact O-N 3.43Å; E1812-R1816 VanDerWaalsContact O-CB 3.31Å; E1812-R1816 WeakPolarHBondContact O-CB 3.25Å; E1812-R1816 VanDerWaalsContact O-CG 3.24Å; E1812-R1816 WeakPolarHBondContact O-CG 3.33Å; E1812-R1816 PolarHBondContact O-N 3.44Å; E1812-R1816 PolarHBondContact O-NE 3.15Å; E1812-R1816 IonicContact OE2-CZ 2.75Å; E1812-R1816 IonicContact OE2-NH2 3.26Å; E1812-R1816 PolarHBondContact OE2-NH2 2.8Å
1813	R	50.3	Low	40.2	Very low	158 Å²	158	116 Å²	116	60%	0.596	58%	0.577	S	S	*	*	H	α-helix	trans	-85.9	-38.5	177.9	-174.5	-179.2	-152	159.7	6.1	111.9	A1809 E1810 L1811 R1816 I1817	A1809-R1813 WeakPolarHBondContact O-CB 3.35Å; A1809-R1813 PolarHBondContact O-N 2.83Å; E1810-R1813 CarbonylContact O-C 3.53Å; E1810-R1813 WeakPolarHBondContact O-CB 3.19Å; E1810-R1813 PolarHBondContact O-N 3.37Å; L1811-R1813 PolarHBondContact O-N 3.13Å; L1811-R1813 VanDerWaalsContact O-N 3.07Å; R1813-R1816 PolarHBondContact O-N 2.74Å; R1813-I1817 HydrophobicContact CG-CD1 4.29Å; R1813-I1817 WeakPolarHBondContact O-CB 3.21Å; R1813-I1817 WeakPolarHBondContact O-CD1 3.4Å; R1813-I1817 VanDerWaalsContact O-CG1 3.24Å; R1813-I1817 WeakPolarHBondContact O-CG1 3.42Å; R1813-I1817 PolarHBondContact O-N 3.07Å
1814	L	47.4	Very low	40.2	Very low	98 Å²	98	117.6 Å²	117.6	51%	0.513	59%	0.586	S	S	.	*	H	α-helix	trans	-73	-33.8	173.6	-73.2	166.9	0	0	0	111.9	E1810 L1811 R1818	E1810-L1814 WeakPolarHBondContact O-CB 3.26Å; E1810-L1814 VanDerWaalsContact O-CG 3.25Å; E1810-L1814 WeakPolarHBondContact O-CG 3.3Å; E1810-L1814 PolarHBondContact O-N 2.92Å; L1811-L1814 PolarHBondContact O-N 2.91Å; L1811-L1814 VanDerWaalsContact O-N 3.15Å; L1814-R1818 WeakPolarHBondContact O-CB 3.22Å; L1814-R1818 PolarHBondContact O-N 3.31Å
1815	E	42.2	Very low	40.1	Very low	130 Å²	130	118.1 Å²	118.1	61%	0.607	60%	0.595	S	S	*	*	H	α-helix	trans	-70.4	-36.1	169.6	-71.7	-173.6	133.6	0	0	111.4	L1811 R1818 M1819	L1811-E1815 WeakPolarHBondContact O-CB 3.11Å; L1811-E1815 WeakPolarHBondContact O-CG 3.42Å; L1811-E1815 PolarHBondContact O-N 3.19Å; E1815-R1818 PolarHBondContact O-N 2.82Å; E1815-M1819 VanDerWaalsContact O-CB 3.3Å; E1815-M1819 WeakPolarHBondContact O-CB 3.25Å; E1815-M1819 WeakPolarHBondContact O-CG 3.46Å; E1815-M1819 PolarHBondContact O-N 2.82Å
1816	R	46.3	Very low	39.4	Very low	142 Å²	142	121.7 Å²	121.7	54%	0.536	61%	0.607	S	S	.	*	H	α-helix	trans	-61.5	-49.7	168.7	-86.3	177.3	-97.2	-161.8	-9.3	112	E1812 R1813 R1818 M1819 E1820	E1812-R1816 VanDerWaalsContact O-CB 3.31Å; E1812-R1816 WeakPolarHBondContact O-CB 3.25Å; E1812-R1816 VanDerWaalsContact O-CG 3.24Å; E1812-R1816 WeakPolarHBondContact O-CG 3.33Å; E1812-R1816 PolarHBondContact O-N 3.44Å; E1812-R1816 PolarHBondContact O-NE 3.15Å; E1812-R1816 IonicContact OE2-CZ 2.75Å; E1812-R1816 IonicContact OE2-NH2 3.26Å; E1812-R1816 PolarHBondContact OE2-NH2 2.8Å; R1813-R1816 PolarHBondContact O-N 2.74Å; R1816-R1818 VanDerWaalsContact C-N 3.32Å; R1816-R1818 PolarHBondContact O-N 2.79Å; R1816-M1819 CarbonylContact O-C 3.57Å; R1816-M1819 PolarHBondContact O-N 3.31Å; R1816-M1819 VanDerWaalsContact O-N 3.13Å; R1816-E1820 VanDerWaalsContact O-CG 3.25Å; R1816-E1820 WeakPolarHBondContact O-CG 3.36Å; R1816-E1820 PolarHBondContact O-N 2.82Å
1817	I	41.3	Very low	38.9	Very low	70 Å²	70	122.6 Å²	122.6	36%	0.359	62%	0.619	S	S	.	*	H	α-helix	trans	-59.6	-42.1	176.2	-69.6	162.1	0	0	0	111.1	R1813 M1819 E1820 E1821	R1813-I1817 HydrophobicContact CG-CD1 4.29Å; R1813-I1817 WeakPolarHBondContact O-CB 3.21Å; R1813-I1817 WeakPolarHBondContact O-CD1 3.4Å; R1813-I1817 VanDerWaalsContact O-CG1 3.24Å; R1813-I1817 WeakPolarHBondContact O-CG1 3.42Å; R1813-I1817 PolarHBondContact O-N 3.07Å; I1817-M1819 VanDerWaalsContact C-N 3.29Å; I1817-M1819 PolarHBondContact O-N 3.21Å; I1817-E1820 WeakPolarHBondContact O-CA 3.18Å; I1817-E1820 WeakPolarHBondContact O-CB 3.31Å; I1817-E1820 PolarHBondContact O-N 3.11Å; I1817-E1821 PolarHBondContact O-N 3.17Å; I1817-E1821 VanDerWaalsContact O-N 3.12Å
1818	R	36.7	Very low	38.4	Very low	193 Å²	193	121.6 Å²	121.6	73%	0.728	63%	0.626	S	S	*	*	H	α-helix	trans	-69.8	-23.8	178.5	-163.2	176.7	-159.7	172.1	6.5	113.8	L1814 E1815 R1816	L1814-R1818 WeakPolarHBondContact O-CB 3.22Å; L1814-R1818 PolarHBondContact O-N 3.31Å; E1815-R1818 PolarHBondContact O-N 2.82Å; R1816-R1818 VanDerWaalsContact C-N 3.32Å; R1816-R1818 PolarHBondContact O-N 2.79Å
1819	M	40.4	Very low	37.6	Very low	147 Å²	147	123.8 Å²	123.8	72%	0.724	64%	0.637	S	S	*	*	H	α-helix	trans	-88.5	-8.2	170.7	-64.1	-79.7	-80.4	0	0	112.3	E1815 R1816 I1817	E1815-M1819 VanDerWaalsContact O-CB 3.3Å; E1815-M1819 WeakPolarHBondContact O-CB 3.25Å; E1815-M1819 WeakPolarHBondContact O-CG 3.46Å; E1815-M1819 PolarHBondContact O-N 2.82Å; R1816-M1819 CarbonylContact O-C 3.57Å; R1816-M1819 PolarHBondContact O-N 3.31Å; R1816-M1819 VanDerWaalsContact O-N 3.13Å; I1817-M1819 VanDerWaalsContact C-N 3.29Å; I1817-M1819 PolarHBondContact O-N 3.21Å
1820	E	37.1	Very low	36.6	Very low	134 Å²	134	128 Å²	128	63%	0.626	65%	0.652	S	S	*	*	H	α-helix	trans	-90.9	-22.7	172.1	-74	164.4	169.1	0	0	111.8	R1816 I1817	R1816-E1820 VanDerWaalsContact O-CG 3.25Å; R1816-E1820 WeakPolarHBondContact O-CG 3.36Å; R1816-E1820 PolarHBondContact O-N 2.82Å; I1817-E1820 WeakPolarHBondContact O-CA 3.18Å; I1817-E1820 WeakPolarHBondContact O-CB 3.31Å; I1817-E1820 PolarHBondContact O-N 3.11Å
1821	E	34.8	Very low	35.8	Very low	152 Å²	152	130 Å²	130	71%	0.71	67%	0.666	S	S	*	*	S	Bend	trans	-84.5	-4.4	-176.8	-75.7	-177.7	153.9	0	0	116.3	I1817	I1817-E1821 PolarHBondContact O-N 3.17Å; I1817-E1821 VanDerWaalsContact O-N 3.12Å
1822	T	32.5	Very low	34.8	Very low	112 Å²	112	132.3 Å²	132.3	69%	0.687	68%	0.678	S	S	*	*			trans	-120.5	63	177	63.4	0	0	0	0	112.7
1823	N	26.7	Very low	34	Very low	123 Å²	123	134.4 Å²	134.4	66%	0.658	69%	0.693	S	S	*	*			trans	-133.9	88.8	169.1	-70.2	-80.5	0	0	0	110	P1825	N1823-P1825 WeakPolarHBondContact O-CD 3.4Å
1824	D	29.6	Very low	32.8	Very low	169 Å²	169	131.8 Å²	131.8	90%	0.904	70%	0.698	S	S	*	*			trans	-67.7	123.8	164.8	-82.7	-53.4	0	0	0	109.2
1825	P	27.7	Very low	31.8	Very low	114 Å²	114	130.7 Å²	130.7	74%	0.74	71%	0.71	S	S	*	*			trans	-103	125.9	-168.1	35.6	-31.1	0	0	0	113.7	N1823	N1823-P1825 WeakPolarHBondContact O-CD 3.4Å
1826	D	28.3	Very low	31.1	Very low	166 Å²	166	133 Å²	133	89%	0.888	72%	0.721	S	S	*	*			trans	-159	150.6	145.5	-117.1	-33.4	0	0	0	112.2
1827	A	31.1	Very low	30.1	Very low	88 Å²	88	132.6 Å²	132.6	73%	0.727	73%	0.729	S	S	*	*			trans	49.8	83.5	-179.5	0	0	0	0	0	116.3
1828	S	26.7	Very low	29.2	Very low	109 Å²	109	138 Å²	138	76%	0.762	75%	0.75	S	S	*	*			cis	78.7	153.7	35.2	105.4	0	0	0	0	116
1829	I	27.5	Very low	28.7	Very low	145 Å²	145	133.3 Å²	133.3	74%	0.744	75%	0.746	S	S	*	*			trans	83.3	95	-171.5	-52.9	178.9	0	0	0	113.7
1830	N	28	Very low	27.9	Very low	137 Å²	137	132.2 Å²	132.2	73%	0.733	75%	0.753	S	S	*	*				80.2	141.7	71.6	-66.3	-26.4	0	0	0	113.8
1831	L	25.7	Very low	27.4	Very low	137 Å²	137	129.3 Å²	129.3	72%	0.717	76%	0.76	S	S	*	*			cis	-156	155.3	6.9	-150.9	70.6	0	0	0	114.4
1832	L	26.6	Very low	27	Very low	143 Å²	143	134.2 Å²	134.2	75%	0.749	77%	0.771	S	S	*	*			trans	-10.4	137.8	158.9	-57.4	164	0	0	0	122
1833	D	26.6	Very low	26.8	Very low	156 Å²	156	133 Å²	133	83%	0.834	77%	0.767	S	S	*	*				170.1	152.8	107.9	-107	-16.5	0	0	0	111.8
1834	S	25.8	Very low	26.9	Very low	102 Å²	102	136.6 Å²	136.6	71%	0.713	78%	0.777	S	S	*	*			cis	-163.7	133.6	-6	59.2	0	0	0	0	112.4
1835	G	27.1	Very low	26.9	Very low	75 Å²	75	139.5 Å²	139.5	77%	0.773	78%	0.777	S	S	*	*			trans	73.2	165.6	160.3	0	0	0	0	0	119.5
1836	Q	27.5	Very low	27.3	Very low	179 Å²	179	139.3 Å²	139.3	84%	0.836	78%	0.776	S	S	*	*			cis	-167.7	153.1	-11.7	-130.1	-176.9	31.5	0	0	112.8
1837	I	23.9	Very low	27.1	Very low	134 Å²	134	139 Å²	139	69%	0.687	76%	0.762	S	S	*	*			trans	90.2	122.2	153.9	-63	163	0	0	0	122.4
1838	F	23.6	Very low	27.1	Very low	183 Å²	183	141 Å²	141	80%	0.803	75%	0.754	S	S	*	*			trans	-1.4	146.4	149.6	-58.1	-101.6	0	0	0	121
1839	S	25.3	Very low	27.7	Very low	94 Å²	94	140.6 Å²	140.6	66%	0.657	74%	0.736	S	S	*	*			cis	102.4	136.1	14.3	84.8	0	0	0	0	118.7
1840	S	23.9	Very low	27.8	Very low	125 Å²	125	138 Å²	138	87%	0.874	73%	0.728	S	S	*	*			trans	88.8	150.8	157.3	84.4	0	0	0	0	122.3
1841	G	26.5	Very low	27.9	Very low	73 Å²	73	138.3 Å²	138.3	75%	0.753	72%	0.721	S	S	*	*			trans	96.3	89.7	163.6	0	0	0	0	0	117.2
1842	R	26.9	Very low	27.9	Very low	254 Å²	254	135.2 Å²	135.2	96%	0.958	71%	0.705	S	S	*	*				83.1	125.1	50.1	-158.3	-176.7	-160.9	-167.1	7.9	114.9
1843	S	28.7	Very low	27.8	Very low	86 Å²	86	131.4 Å²	131.4	60%	0.601	69%	0.69	S	S	*	*			trans	109.2	106.1	156.6	-179.3	0	0	0	0	121.2
1844	K	28.1	Very low	27.7	Very low	199 Å²	199	127.9 Å²	127.9	87%	0.865	68%	0.677	S	S	*	*			trans	75.5	144.1	149.4	-60.3	161.5	-165.6	163.6	0	119.6
1845	Y	29.8	Very low	27.6	Very low	231 Å²	231	127.2 Å²	127.2	91%	0.906	67%	0.672	S	S	*	*			trans	-53.9	160.1	165.5	-60.3	-80.8	0	0	0	112.8
1846	P	36.2	Very low	27.4	Very low	109 Å²	109	128.9 Å²	128.9	71%	0.708	67%	0.667	S	S	*	*			cis	-139.4	-162.2	-19.7	37.5	-15.9	0	0	0	114.3
1847	R	23.6	Very low	27.5	Very low	159 Å²	159	124 Å²	124	60%	0.6	66%	0.658	S	S	*	*			trans	78.6	-138.2	159	-70.3	-172.6	177.8	-176.7	1.3	120.7	R2326 S2328	R1847-R2326 CarbonylContact C-O 3.52Å; R1847-S2328 PolarHBondContact NE-OG 3.03Å; R1847-S2328 PolarHBondContact NH2-OG 2.87Å
1848	K	31.3	Very low	27.7	Very low	130 Å²	130	125.6 Å²	125.6	57%	0.565	66%	0.662	S	S	*	*				-165.3	154.6	-125.3	-141.2	173.9	-160.2	170.9	0	113.4	P2325 R2326	K1848-P2325 HydrophobicContact CB-CB 4.48Å; K1848-P2325 HydrophobicContact CD-CG 4.36Å; K1848-P2325 WeakPolarHBondContact CE-O 3.33Å; K1848-P2325 HydrophobicContact CG-CB 3.63Å; K1848-P2325 HydrophobicContact CG-CG 3.52Å; K1848-R2326 WeakPolarHBondContact CB-O 3.37Å; K1848-R2326 WeakPolarHBondContact CD-O 3.39Å; K1848-R2326 WeakPolarHBondContact CG-O 3.46Å
1849	R	39.9	Very low	27.8	Very low	102 Å²	102	125.7 Å²	125.7	39%	0.385	66%	0.662	S	S	.	*			cis	-86.8	-115.5	-12.8	-79.9	-160	117.2	-106.7	26.7	111.9	Y1851 Q2323 P2325	R1849-Y1851 VanDerWaalsContact CZ-CD2 3.43Å; R1849-Y1851 VanDerWaalsContact NE-CD2 3.31Å; R1849-Y1851 VanDerWaalsContact NE-CE2 3.31Å; R1849-Y1851 VanDerWaalsContact NH1-CA 3.33Å; R1849-Q2323 PolarHBondContact NH1-O 3.42Å; R1849-P2325 VanDerWaalsContact CA-CG 3.44Å; R1849-P2325 HydrophobicContact CB-CB 4.29Å; R1849-P2325 HydrophobicContact CB-CG 3.59Å; R1849-P2325 HydrophobicContact CG-CG 3.5Å; R1849-P2325 WeakPolarHBondContact O-CB 3.43Å
1850	P	28.7	Very low	28	Very low	89 Å²	89	126.1 Å²	126.1	58%	0.578	66%	0.661	S	S	*	*			cis	-93.7	166.8	7.3	40.3	-36	0	0	0	114
1851	Y	31.1	Very low	28.2	Very low	145 Å²	145	128.7 Å²	128.7	57%	0.569	66%	0.659	S	S	*	*			trans	-76.7	164.4	159.4	-98.2	-85.9	0	0	0	108.2	R1849 A2322	R1849-Y1851 VanDerWaalsContact CZ-CD2 3.43Å; R1849-Y1851 VanDerWaalsContact NE-CD2 3.31Å; R1849-Y1851 VanDerWaalsContact NE-CE2 3.31Å; R1849-Y1851 VanDerWaalsContact NH1-CA 3.33Å; Y1851-A2322 CarbonylContact C-O 3.52Å
1852	D	24.5	Very low	28.4	Very low	71 Å²	71	129.3 Å²	129.3	38%	0.38	66%	0.657	S	S	.	*				-161.7	163.2	107.1	-80.3	-13.9	0	0	0	110	C1854 F2321 A2322 Q2323	D1852-C1854 VanDerWaalsContact CA-N 3.35Å; D1852-C1854 HydrophobicContact CB-CB 4.24Å; D1852-C1854 VanDerWaalsContact CG-N 3.25Å; D1852-C1854 VanDerWaalsContact OD1-CB 3.23Å; D1852-C1854 WeakPolarHBondContact OD1-CB 3.41Å; D1852-C1854 PolarHBondContact OD1-N 3.16Å; D1852-C1854 PolarHBondContact OD1-SG 2.96Å; D1852-C1854 WeakPolarHBondContact OD2-CB 3.47Å; D1852-F2321 CarbonylContact C-O 2.98Å; D1852-F2321 WeakPolarHBondContact CB-O 3.22Å; D1852-F2321 CarbonylContact O-C 3.57Å; D1852-F2321 VanDerWaalsContact O-C 3.28Å; D1852-A2322 VanDerWaalsContact N-C 3.31Å; D1852-A2322 PolarHBondContact N-O 3.49Å; D1852-A2322 CarbonylContact O-C 3.28Å; D1852-A2322 WeakPolarHBondContact O-CA 3.33Å; D1852-A2322 PolarHBondContact O-N 2.87Å; D1852-Q2323 PolarHBondContact O-N 2.85Å
1853	S	24.9	Very low	28.5	Very low	64 Å²	64	127.3 Å²	127.3	45%	0.448	65%	0.649	S	S	.	*			cis	-44.3	117.6	-4.8	56	0	0	0	0	111.3	H2320 F2321	S1853-H2320 WeakPolarHBondContact CA-O 3.44Å; S1853-H2320 WeakPolarHBondContact CB-O 3.46Å; S1853-F2321 VanDerWaalsContact N-C 3.31Å; S1853-F2321 PolarHBondContact N-O 3.43Å
1854	C	25.3	Very low	28.4	Very low	82 Å²	82	130.6 Å²	130.6	55%	0.554	66%	0.655	S	S	*	*				-21	88.8	70.4	-75.6	0	0	0	0	115.4	D1852	D1852-C1854 VanDerWaalsContact CA-N 3.35Å; D1852-C1854 HydrophobicContact CB-CB 4.24Å; D1852-C1854 VanDerWaalsContact CG-N 3.25Å; D1852-C1854 VanDerWaalsContact OD1-CB 3.23Å; D1852-C1854 WeakPolarHBondContact OD1-CB 3.41Å; D1852-C1854 PolarHBondContact OD1-N 3.16Å; D1852-C1854 PolarHBondContact OD1-SG 2.96Å; D1852-C1854 WeakPolarHBondContact OD2-CB 3.47Å
1855	S	22.7	Very low	28.3	Very low	88 Å²	88	126.6 Å²	126.6	62%	0.615	65%	0.647	S	S	*	*				-92.4	106.9	103.1	172.1	0	0	0	0	108.1
1856	T	23.8	Very low	28.3	Very low	110 Å²	110	121.4 Å²	121.4	68%	0.675	64%	0.639	S	S	*	*			trans	73.7	159.5	143.1	-39.1	0	0	0	0	119.3
1857	A	28.6	Very low	27.9	Very low	77 Å²	77	121.6 Å²	121.6	64%	0.636	64%	0.642	S	S	*	*			trans	62.7	97.4	163.2	0	0	0	0	0	117.6
1858	H	28.5	Very low	27.8	Very low	167 Å²	167	119.9 Å²	119.9	77%	0.773	65%	0.651	S	S	*	*				68.8	114.6	80.5	-73.9	-43	0	0	0	116.1
1859	K	26.4	Very low	27.5	Very low	185 Å²	185	117.3 Å²	117.3	80%	0.804	66%	0.662	S	S	*	*				75.8	172.5	125.2	-151	176.5	-166.1	174.2	0	115.1
1860	T	29.4	Very low	26.7	Very low	102 Å²	102	120.4 Å²	120.4	63%	0.626	69%	0.685	S	S	*	*			trans	45.6	99.4	160.9	32.4	0	0	0	0	118.6
1861	Q	28.1	Very low	26.3	Very low	180 Å²	180	120.4 Å²	120.4	84%	0.841	69%	0.687	S	S	*	*				93.1	127.1	74.8	-89.5	-179.5	9	0	0	114.7
1862	A	30.8	Very low	26	Very low	85 Å²	85	123.8 Å²	123.8	70%	0.702	70%	0.699	S	S	*	*			trans	66.2	167.8	151.3	0	0	0	0	0	116.9
1863	R	27.8	Very low	25.9	Very low	213 Å²	213	125.8 Å²	125.8	80%	0.804	71%	0.714	S	S	*	*			cis	-127.5	150	-1.9	-121.3	120.7	-173.8	-168.9	-1.1	107.8
1864	Q	26.7	Very low	25.8	Very low	154 Å²	154	129.2 Å²	129.2	72%	0.72	73%	0.727	S	S	*	*				58.7	140.6	63.9	-122.5	-178.7	-0	0	0	110.7
1865	V	26.6	Very low	25.7	Very low	116 Å²	116	135.1 Å²	135.1	70%	0.703	74%	0.743	S	S	*	*			cis	-147.3	-175.1	25.2	-131.3	0	0	0	0	107.3
1866	V	30	Very low	25.7	Very low	121 Å²	121	135.1 Å²	135.1	73%	0.733	74%	0.743	S	S	*	*			cis	-136.8	125.2	15.2	-175.7	0	0	0	0	110.2
1867	C	27.1	Very low	25.6	Very low	113 Å²	113	135.7 Å²	135.7	76%	0.764	75%	0.747	S	S	*	*	S	Bend	trans	-100.2	151.9	140.6	-78.5	0	0	0	0	107.4	G1869	C1867-G1869 PolarHBondContact O-N 3.29Å
1868	P	21.5	Very low	25.2	Very low	124 Å²	124	142.9 Å²	142.9	81%	0.805	76%	0.757	S	S	*	*			trans	-55.3	132.6	-173.9	-27.4	35.3	0	0	0	113.4	L1870	P1868-L1870 PolarHBondContact O-N 2.83Å
1869	G	24.7	Very low	24.9	Very low	76 Å²	76	139 Å²	139	78%	0.784	75%	0.749	S	S	*	*			trans	-82.5	94.5	175.4	0	0	0	0	0	111.8	C1867	C1867-G1869 PolarHBondContact O-N 3.29Å
1870	L	22.9	Very low	24.7	Very low	166 Å²	166	136.3 Å²	136.3	87%	0.869	75%	0.749	S	S	*	*			trans	-171	133.4	161.8	-100.6	150.1	0	0	0	109.1	P1868	P1868-L1870 PolarHBondContact O-N 2.83Å
1871	S	22.3	Very low	24.4	Very low	89 Å²	89	136 Å²	136	62%	0.622	75%	0.751	S	S	*	*			cis	-159.3	167.5	-35.2	63.3	0	0	0	0	108.2
1872	R	23.2	Very low	24.2	Very low	217 Å²	217	134 Å²	134	82%	0.819	75%	0.75	S	S	*	*			trans	52.1	101.1	153.3	-71.8	-179.5	171.7	168.4	-1.6	119.7
1873	T	22.8	Very low	24	Very low	113 Å²	113	132.9 Å²	132.9	69%	0.693	75%	0.747	S	S	*	*				74.9	136.3	116.3	63.8	0	0	0	0	121.9
1874	N	23.6	Very low	24	Very low	135 Å²	135	132 Å²	132	72%	0.722	75%	0.749	S	S	*	*			trans	39.8	141.1	130.2	-61.6	-26.8	0	0	0	121.2
1875	K	22.9	Very low	24.1	Very low	206 Å²	206	130.7 Å²	130.7	90%	0.896	75%	0.751	S	S	*	*			trans	68	152	165	-64.6	166.6	-177.8	179.4	0	111.7
1876	S	21.9	Very low	24.1	Very low	88 Å²	88	131.1 Å²	131.1	62%	0.615	75%	0.745	S	S	*	*			cis	157.3	143.3	-7.3	170.4	0	0	0	0	102.7
1877	T	21.7	Very low	23.9	Very low	122 Å²	122	133.1 Å²	133.1	75%	0.748	74%	0.744	S	S	*	*			trans	59.8	150.5	155.1	44.5	0	0	0	0	120
1878	R	20	Very low	23.8	Very low	228 Å²	228	138.1 Å²	138.1	86%	0.86	75%	0.747	S	S	*	*			trans	64.6	105.6	156.2	-77.6	-179.2	164.7	160.5	-4.8	116.3
1879	S	22.4	Very low	23.9	Very low	85 Å²	85	138.5 Å²	138.5	59%	0.594	74%	0.741	S	S	*	*				85.1	157.4	66.2	72.8	0	0	0	0	113
1880	T	21.9	Very low	23.9	Very low	130 Å²	130	144.3 Å²	144.3	80%	0.798	74%	0.74	S	S	*	*			trans	62.8	141.6	169.3	43.5	0	0	0	0	115.6
1881	S	23.3	Very low	24	Very low	96 Å²	96	142.7 Å²	142.7	67%	0.671	73%	0.731	S	S	*	*			cis	-174.3	151	-11.1	44.1	0	0	0	0	109.5
1882	V	24.4	Very low	24.1	Very low	138 Å²	138	141.4 Å²	141.4	84%	0.836	72%	0.717	S	S	*	*			trans	54.6	122.9	152.9	177	0	0	0	0	117.5
1883	G	27.6	Very low	24.1	Very low	61 Å²	61	139.6 Å²	139.6	63%	0.629	72%	0.715	S	S	*	*			cis	138.4	175.8	3.2	0	0	0	0	0	111.7
1884	K	27.7	Very low	24.2	Very low	195 Å²	195	137 Å²	137	85%	0.848	70%	0.701	S	S	*	*			trans	68.9	149.3	-176.6	-52.9	171.5	-178.5	175.8	0	112
1885	V	27.5	Very low	24.2	Very low	125 Å²	125	136.4 Å²	136.4	76%	0.758	69%	0.691	S	S	*	*			cis	-153.8	142.3	-2.8	115	0	0	0	0	106.7
1886	H	27.8	Very low	24.2	Very low	126 Å²	126	133.4 Å²	133.4	58%	0.583	68%	0.678	S	S	*	*			cis	-153.2	153.5	-16.5	-133.9	63.7	0	0	0	112.3
1887	K	25.5	Very low	24.4	Very low	163 Å²	163	134.5 Å²	134.5	71%	0.709	68%	0.683	S	S	*	*			trans	0.1	139.9	145.1	-47.3	176	-166.1	153.2	0	116.8
1888	R	24	Very low	24.5	Very low	218 Å²	218	133.9 Å²	133.9	82%	0.823	67%	0.674	S	S	*	*			cis	-139.2	123.6	44.3	-74.7	178.1	167	173.8	-4.8	116.6
1889	L	24.3	Very low	24.7	Very low	132 Å²	132	127.7 Å²	127.7	69%	0.691	66%	0.658	S	S	*	*				58.2	115.6	127.8	-61.2	164.8	0	0	0	121.8	R2255	L1889-R2255 PolarHBondContact O-NH1 2.84Å; L1889-R2255 PolarHBondContact O-NH2 3.09Å
1890	R	25.4	Very low	24.9	Very low	198 Å²	198	126.5 Å²	126.5	75%	0.747	65%	0.645	S	S	*	*			trans	-92.8	-179	135.4	-63.4	170.3	159.8	127.6	-9.3	108.3
1891	L	24.4	Very low	25.2	Very low	131 Å²	131	123.1 Å²	123.1	69%	0.686	62%	0.624	S	S	*	*			trans	74.1	151.6	160.4	-51.2	146.7	0	0	0	114.6
1892	D	23.4	Very low	25.3	Very low	63 Å²	63	125.8 Å²	125.8	34%	0.337	62%	0.624	S	S	.	*			cis	-168.5	154.8	-8.3	-104.5	-26.5	0	0	0	111.4	V1953	D1892-V1953 HydrophobicContact CB-CG2 3.73Å; D1892-V1953 VanDerWaalsContact CG-CG2 3.48Å; D1892-V1953 VanDerWaalsContact OD2-CG2 3.31Å; D1892-V1953 WeakPolarHBondContact OD2-CG2 3.5Å
1893	K	23.3	Very low	25.5	Very low	179 Å²	179	123.8 Å²	123.8	78%	0.778	61%	0.612	S	S	*	*			trans	-167.5	132.8	156.8	-115.2	-174.1	-179.3	-173.6	0	114.9	P1951	K1893-P1951 WeakPolarHBondContact O-CB 3.33Å; K1893-P1951 VanDerWaalsContact O-CG 3.28Å; K1893-P1951 WeakPolarHBondContact O-CG 3.47Å
1894	P	24.8	Very low	25.6	Very low	59 Å²	59	124.7 Å²	124.7	38%	0.383	61%	0.608	S	S	.	*			trans	-142.4	170.3	-130.6	42	-22.6	0	0	0	121.8	P1951 V1953	P1894-P1951 HydrophobicContact CB-CB 4Å; P1894-P1951 HydrophobicContact CB-CG 4.49Å; P1894-V1953 HydrophobicContact CB-CB 3.7Å; P1894-V1953 HydrophobicContact CB-CG2 3.77Å; P1894-V1953 HydrophobicContact CG-CB 4.12Å; P1894-V1953 HydrophobicContact CG-CG2 4.16Å
1895	K	24.1	Very low	25.5	Very low	122 Å²	122	122 Å²	122	53%	0.53	60%	0.603	S	S	.	*			trans	76.8	164.7	162.2	-59.3	146.6	-172.7	178.5	0	116	V1953	K1895-V1953 WeakPolarHBondContact CE-O 3.5Å
1896	K	21.8	Very low	25.5	Very low	142 Å²	142	120.2 Å²	120.2	62%	0.617	60%	0.596	S	S	*	*			cis	-143.6	165.6	15.8	-59.1	175.3	-179.5	173.8	0	113.1	K1960 S1961	K1896-K1960 PolarHBondContact NZ-O 3.3Å; K1896-S1961 PolarHBondContact NZ-O 3.17Å
1897	P	26.4	Very low	25.6	Very low	111 Å²	111	121 Å²	121	72%	0.721	60%	0.6	S	S	*	*			trans	-114.5	179.2	143.2	38.8	-29.9	0	0	0	113.3
1898	I	25.3	Very low	25.7	Very low	110 Å²	110	120.1 Å²	120.1	56%	0.564	60%	0.597	S	S	*	*			trans	90.2	138.5	163.3	-54.1	165.6	0	0	0	119.6
1899	D	23.9	Very low	25.9	Very low	97 Å²	97	115.5 Å²	115.5	52%	0.519	59%	0.588	S	S	.	*			trans	-35.3	160.3	179.9	-20.1	-41.6	0	0	0	122.4	S1961	D1899-S1961 WeakPolarHBondContact O-CB 3.43Å
1900	I	26.7	Very low	26.2	Very low	60 Å²	60	113.2 Å²	113.2	31%	0.308	57%	0.574	S	S	.	*			trans	86.1	118.9	139.7	-83.4	168.8	0	0	0	119.3	E1910 I1911 S1961	I1900-E1910 HydrophobicContact CG2-CB 4.14Å; I1900-E1910 HydrophobicContact CG2-CG 4Å; I1900-I1911 HydrophobicContact CB-CG2 4.5Å; I1900-I1911 HydrophobicContact CD1-CG2 3.88Å; I1900-I1911 HydrophobicContact CG1-CG2 3.76Å; I1900-I1911 HydrophobicContact CG2-CB 4.22Å; I1900-I1911 HydrophobicContact CG2-CG1 4.43Å; I1900-I1911 HydrophobicContact CG2-CG2 4.2Å; I1900-S1961 WeakPolarHBondContact O-CB 3.06Å; I1900-S1961 PolarHBondContact O-OG 3.16Å
1901	T	27	Very low	26.4	Very low	60 Å²	60	107 Å²	107	37%	0.368	56%	0.555	S	S	.	*			trans	-101.7	-121.3	-159	22.7	0	0	0	0	120	E1910 I1911 N1912 G1962	T1901-E1910 CarbonylContact O-C 3.48Å; T1901-E1910 WeakPolarHBondContact O-CA 3.3Å; T1901-E1910 PolarHBondContact O-N 2.65Å; T1901-I1911 CarbonylContact C-O 3.59Å; T1901-I1911 VanDerWaalsContact CA-O 3.29Å; T1901-I1911 WeakPolarHBondContact CA-O 3.25Å; T1901-I1911 WeakPolarHBondContact CB-O 3.36Å; T1901-I1911 VanDerWaalsContact N-CA 3.33Å; T1901-I1911 PolarHBondContact N-O 2.95Å; T1901-I1911 VanDerWaalsContact N-O 3.16Å; T1901-I1911 PolarHBondContact O-N 3.3Å; T1901-I1911 PolarHBondContact OG1-O 3.38Å; T1901-N1912 PolarHBondContact OG1-O 3.08Å; T1901-G1962 WeakPolarHBondContact CG2-O 3.46Å
1902	F	25.6	Very low	26.6	Very low	152 Å²	152	105.1 Å²	105.1	67%	0.667	55%	0.545	S	S	*	.			trans	34.5	175.1	-164.2	-68.7	-59.1	0	0	0	118.6	E1910 I1911	F1902-E1910 WeakPolarHBondContact CB-O 3.43Å; F1902-E1910 VanDerWaalsContact CD2-O 3.26Å; F1902-E1910 WeakPolarHBondContact CD2-O 3.37Å; F1902-I1911 PolarHBondContact N-O 3.24Å
1903	V	29.8	Very low	26.9	Very low	96 Å²	96	108.1 Å²	108.1	58%	0.582	56%	0.56	S	S	*	*			cis	-127.1	-166.7	-15.2	87.5	0	0	0	0	110.1
1904	S	28.1	Very low	27.1	Very low	80 Å²	80	105.2 Å²	105.2	56%	0.559	55%	0.553	S	S	*	*			trans	-47.4	-177.9	157.4	-48.1	0	0	0	0	113.9
1905	D	25.5	Very low	27.1	Very low	137 Å²	137	109.8 Å²	109.8	73%	0.733	57%	0.569	S	S	*	*	S	Bend	trans	70.6	164.1	166.9	-50.1	-28.6	0	0	0	111.2
1906	S	29.3	Very low	27	Very low	88 Å²	88	109.4 Å²	109.4	62%	0.615	57%	0.573	S	S	*	*	S	Bend		49.5	94.1	58.4	151.1	0	0	0	0	111.6
1907	E	30	Very low	27	Very low	143 Å²	143	108.5 Å²	108.5	67%	0.668	57%	0.574	S	S	*	*	S	Bend	trans	76.7	178.9	165.6	-44.5	161.8	168.9	0	0	114.8
1908	K	25.9	Very low	26.9	Very low	145 Å²	145	107.8 Å²	107.8	63%	0.63	57%	0.571	S	S	*	*			trans	39	114.9	154.4	-54.5	140.4	-175.5	166.8	0	123.9
1909	D	29.8	Very low	26.9	Very low	120 Å²	120	110.5 Å²	110.5	64%	0.642	58%	0.579	S	S	*	*				53.5	122.4	123.2	-49.9	-46.6	0	0	0	127.9
1910	E	29.2	Very low	26.9	Very low	85 Å²	85	117.1 Å²	117.1	40%	0.397	60%	0.597	S	S	.	*				81.9	138.8	128.8	-73.3	-158.3	165.8	0	0	128.9	I1900 T1901 F1902 K1960	I1900-E1910 HydrophobicContact CG2-CB 4.14Å; I1900-E1910 HydrophobicContact CG2-CG 4Å; T1901-E1910 CarbonylContact O-C 3.48Å; T1901-E1910 WeakPolarHBondContact O-CA 3.3Å; T1901-E1910 PolarHBondContact O-N 2.65Å; F1902-E1910 WeakPolarHBondContact CB-O 3.43Å; F1902-E1910 VanDerWaalsContact CD2-O 3.26Å; F1902-E1910 WeakPolarHBondContact CD2-O 3.37Å; E1910-K1960 IonicContact OE1-NZ 3.72Å; E1910-K1960 PolarHBondContact OE1-NZ 3.3Å
1911	I	29.4	Very low	26.8	Very low	68 Å²	68	117.7 Å²	117.7	35%	0.349	62%	0.617	S	S	.	*			trans	86.1	151	158.5	-3.1	176.9	0	0	0	123.8	I1900 T1901 F1902	I1900-I1911 HydrophobicContact CB-CG2 4.5Å; I1900-I1911 HydrophobicContact CD1-CG2 3.88Å; I1900-I1911 HydrophobicContact CG1-CG2 3.76Å; I1900-I1911 HydrophobicContact CG2-CB 4.22Å; I1900-I1911 HydrophobicContact CG2-CG1 4.43Å; I1900-I1911 HydrophobicContact CG2-CG2 4.2Å; T1901-I1911 CarbonylContact C-O 3.59Å; T1901-I1911 VanDerWaalsContact CA-O 3.29Å; T1901-I1911 WeakPolarHBondContact CA-O 3.25Å; T1901-I1911 WeakPolarHBondContact CB-O 3.36Å; T1901-I1911 VanDerWaalsContact N-CA 3.33Å; T1901-I1911 PolarHBondContact N-O 2.95Å; T1901-I1911 VanDerWaalsContact N-O 3.16Å; T1901-I1911 PolarHBondContact O-N 3.3Å; T1901-I1911 PolarHBondContact OG1-O 3.38Å; F1902-I1911 PolarHBondContact N-O 3.24Å
1912	N	29.8	Very low	26.7	Very low	91 Å²	91	124.5 Å²	124.5	49%	0.487	64%	0.642	S	S	.	*			trans	52.9	171	145.1	-78.6	-0.6	0	0	0	123.3	T1901	T1901-N1912 PolarHBondContact OG1-O 3.08Å
1913	I	29.6	Very low	26.6	Very low	126 Å²	126	121.8 Å²	121.8	65%	0.646	64%	0.641	S	S	*	*			cis	-171.4	150.7	-40.1	-152.2	164.8	0	0	0	110.4
1914	N	26.3	Very low	26.3	Very low	118 Å²	118	122.6 Å²	122.6	63%	0.631	65%	0.647	S	S	*	*			trans	51.6	153.8	153.7	-74.5	10.1	0	0	0	125.8
1915	Q	24.8	Very low	26.1	Very low	155 Å²	155	125 Å²	125	72%	0.724	65%	0.654	S	S	*	*			trans	68.4	159.4	141.1	-73.6	171	-69.1	0	0	119.7
1916	D	22.1	Very low	26	Very low	113 Å²	113	126.6 Å²	126.6	60%	0.604	66%	0.657	S	S	*	*			cis	-162.9	166.1	-13.3	-117.7	-22.3	0	0	0	113.9
1917	I	22.7	Very low	25.6	Very low	124 Å²	124	127 Å²	127	64%	0.636	66%	0.66	S	S	*	*			trans	52.8	108.5	140.3	-62.8	164.1	0	0	0	121.4
1918	S	23.4	Very low	25.3	Very low	96 Å²	96	126 Å²	126	67%	0.671	66%	0.663	S	S	*	*				49	133.9	123.5	-159.3	0	0	0	0	122.8
1919	K	26.6	Very low	25.2	Very low	166 Å²	166	126.8 Å²	126.8	72%	0.722	67%	0.669	S	S	*	*				178.4	145.8	109.7	-92.1	146.5	-163.7	159.7	0	115
1920	R	23.1	Very low	24.9	Very low	237 Å²	237	127 Å²	127	89%	0.894	67%	0.669	S	S	*	*			trans	15.1	133.8	138.3	-47.5	170.3	-176.1	-177.3	-1.2	117.3
1921	G	24.8	Very low	24.7	Very low	71 Å²	71	129.4 Å²	129.4	73%	0.732	68%	0.684	S	S	*	*			cis	119.2	167.3	8.9	0	0	0	0	0	112.9
1922	K	24.7	Very low	24.4	Very low	204 Å²	204	132.9 Å²	132.9	89%	0.887	70%	0.702	S	S	*	*			trans	81.9	127.9	175	-62.3	-168.8	171.8	-170.1	0	120
1923	S	23.7	Very low	24.2	Very low	94 Å²	94	134.5 Å²	134.5	66%	0.657	71%	0.71	S	S	*	*				82.7	128.7	124.3	65.8	0	0	0	0	123.7
1924	T	23.2	Very low	24	Very low	114 Å²	114	136.6 Å²	136.6	70%	0.699	72%	0.717	S	S	*	*			trans	76.6	123.9	135.7	47.9	0	0	0	0	121.9
1925	N	23.6	Very low	24	Very low	131 Å²	131	135.5 Å²	135.5	70%	0.701	72%	0.718	S	S	*	*			trans	84.8	121.6	132.9	-69.8	-0.4	0	0	0	121.1
1926	Q	23.8	Very low	24	Very low	170 Å²	170	133.1 Å²	133.1	79%	0.794	72%	0.718	S	S	*	*			trans	82.4	143.9	134.8	-70.4	174.2	-3.5	0	0	120.7
1927	S	22	Very low	24.3	Very low	97 Å²	97	136.3 Å²	136.3	68%	0.678	73%	0.727	S	S	*	*			trans	66.6	103	145	56.7	0	0	0	0	120.8
1928	T	22.9	Very low	24.5	Very low	120 Å²	120	136.7 Å²	136.7	74%	0.736	74%	0.735	S	S	*	*				68.9	127.7	122.1	59.7	0	0	0	0	122.3
1929	Q	23.1	Very low	24.6	Very low	163 Å²	163	135.6 Å²	135.6	76%	0.762	74%	0.739	S	S	*	*			trans	81.2	144.4	132.2	-84.5	-172.5	-62.2	0	0	121.6
1930	I	25	Very low	24.7	Very low	124 Å²	124	135 Å²	135	64%	0.636	74%	0.742	S	S	*	*			trans	71.7	106.8	152	-68.2	159.9	0	0	0	113.1
1931	D	23.4	Very low	24.8	Very low	136 Å²	136	132.4 Å²	132.4	73%	0.727	74%	0.74	S	S	*	*				63.9	149	77.4	-56.3	-49	0	0	0	111.7
1932	I	25	Very low	24.8	Very low	140 Å²	140	133.5 Å²	133.5	72%	0.718	74%	0.743	S	S	*	*			cis	-169.4	154.5	30.2	-147.7	158	0	0	0	111.9
1933	I	24.7	Very low	24.6	Very low	126 Å²	126	133 Å²	133	65%	0.646	74%	0.74	S	S	*	*			trans	70	121.1	151.7	-76.8	159.2	0	0	0	123.5
1934	E	25.9	Very low	24.7	Very low	170 Å²	170	133.1 Å²	133.1	79%	0.794	74%	0.737	S	S	*	*				35	154.3	129.8	-35.7	178	133.8	0	0	122.5
1935	S	25.1	Very low	24.7	Very low	95 Å²	95	134 Å²	134	66%	0.664	73%	0.733	S	S	*	*			cis	-180	145.1	46.7	47.6	0	0	0	0	115.3
1936	S	25.3	Very low	24.8	Very low	104 Å²	104	135 Å²	135	73%	0.727	73%	0.731	S	S	*	*			trans	68.6	164.1	146.7	87.9	0	0	0	0	119.7
1937	K	28.6	Very low	24.8	Very low	181 Å²	181	133 Å²	133	79%	0.787	72%	0.723	S	S	*	*			cis	-157.9	135.7	-3.5	-133	158.8	-167.1	165.5	0	112
1938	T	26.7	Very low	25.2	Very low	132 Å²	132	134.2 Å²	134.2	81%	0.81	72%	0.718	S	S	*	*			trans	26.2	130.4	145.1	60.1	0	0	0	0	123.2
1939	G	26.4	Very low	26	Very low	72 Å²	72	137.2 Å²	137.2	74%	0.742	72%	0.721	S	S	*	*				124.4	149.8	105.8	0	0	0	0	0	121.6
1940	I	27.3	Very low	26.3	Very low	155 Å²	155	132.6 Å²	132.6	80%	0.795	71%	0.706	S	S	*	*			trans	84.8	108.1	151.6	-55.4	175.3	0	0	0	119.1
1941	E	25.3	Very low	26.3	Very low	181 Å²	181	129.8 Å²	129.8	85%	0.846	70%	0.696	S	S	*	*			trans	37.8	122.1	135.2	-58	171.5	-176.2	0	0	119.9
1942	A	24.3	Very low	26.3	Very low	95 Å²	95	129 Å²	129	79%	0.785	70%	0.696	S	S	*	*			cis	106.2	157	44	0	0	0	0	0	113.4
1943	F	22.2	Very low	26.2	Very low	192 Å²	192	124.7 Å²	124.7	84%	0.842	68%	0.676	S	S	*	*			trans	76.4	99.7	162	-123.5	-115.6	0	0	0	120.9
1944	V	24.6	Very low	26.2	Very low	97 Å²	97	128 Å²	128	59%	0.588	69%	0.688	S	S	*	*				82.9	107.1	120.9	163.3	0	0	0	0	120.7
1945	E	24	Very low	26	Very low	132 Å²	132	123.4 Å²	123.4	62%	0.617	68%	0.675	S	S	*	*			trans	71.6	128	132.6	-70.9	-164.9	149	0	0	123.6
1946	K	25.5	Very low	26	Very low	153 Å²	153	127.2 Å²	127.2	67%	0.665	68%	0.68	S	S	*	*			trans	71.3	141.6	138.6	-66.8	165.8	-169.8	153.5	0	116.3
1947	M	23.8	Very low	26.2	Very low	127 Å²	127	132.7 Å²	132.7	63%	0.626	68%	0.684	S	S	*	*			cis	-159.5	166.1	9.6	-138.6	-178.1	-169.1	0	0	110.7
1948	H	30.3	Very low	26.5	Very low	123 Å²	123	130.6 Å²	130.6	57%	0.569	68%	0.675	S	S	*	*			trans	72.1	166.3	153.1	-84.2	15.4	0	0	0	114.1
1949	F	39.6	Very low	26.8	Very low	183 Å²	183	130.6 Å²	130.6	80%	0.803	67%	0.666	S	S	*	*				52	161.1	50.2	-72.2	-124.1	0	0	0	111.8
1950	P	30	Very low	26.9	Very low	66 Å²	66	130.8 Å²	130.8	43%	0.429	65%	0.646	S	S	.	*			cis	-84	-163.7	-21.8	38.5	-31.2	0	0	0	109.5
1951	P	24.8	Very low	26.9	Very low	66 Å²	66	125 Å²	125	43%	0.429	62%	0.62	S	S	.	*				-155.3	152	85.2	37.4	-18	0	0	0	119.3	K1893 P1894	K1893-P1951 WeakPolarHBondContact O-CB 3.33Å; K1893-P1951 VanDerWaalsContact O-CG 3.28Å; K1893-P1951 WeakPolarHBondContact O-CG 3.47Å; P1894-P1951 HydrophobicContact CB-CB 4Å; P1894-P1951 HydrophobicContact CB-CG 4.49Å
1952	T	22.3	Very low	26.9	Very low	120 Å²	120	117.9 Å²	117.9	74%	0.736	59%	0.594	S	S	*	*			trans	-134.7	98.1	156.7	41	0	0	0	0	110.9
1953	V	23.6	Very low	27	Very low	49 Å²	49	119.2 Å²	119.2	30%	0.297	59%	0.587	S	S	.	*			trans	-121.2	99.1	169.1	-178.2	0	0	0	0	109.7	D1892 P1894 K1895	D1892-V1953 HydrophobicContact CB-CG2 3.73Å; D1892-V1953 VanDerWaalsContact CG-CG2 3.48Å; D1892-V1953 VanDerWaalsContact OD2-CG2 3.31Å; D1892-V1953 WeakPolarHBondContact OD2-CG2 3.5Å; P1894-V1953 HydrophobicContact CB-CB 3.7Å; P1894-V1953 HydrophobicContact CB-CG2 3.77Å; P1894-V1953 HydrophobicContact CG-CB 4.12Å; P1894-V1953 HydrophobicContact CG-CG2 4.16Å; K1895-V1953 WeakPolarHBondContact CE-O 3.5Å
1954	H	23.7	Very low	27.3	Very low	194 Å²	194	118.4 Å²	118.4	90%	0.898	58%	0.579	S	S	*	*			trans	-52.5	139.6	159.5	-96.2	-32.5	0	0	0	110.1
1955	S	22.4	Very low	27.5	Very low	74 Å²	74	120.1 Å²	120.1	52%	0.517	58%	0.584	S	S	.	*			trans	-160.7	122.8	149.8	-141.9	0	0	0	0	111
1956	K	24.8	Very low	28.1	Very low	176 Å²	176	120.6 Å²	120.6	77%	0.765	59%	0.591	S	S	*	*	S	Bend	trans	-56.7	147.5	136.6	-81.2	-169.3	174.3	-177.3	0	106.8	F1958	K1956-F1958 HydrophobicContact CB-CE1 4.32Å; K1956-F1958 HydrophobicContact CB-CE2 4.2Å; K1956-F1958 HydrophobicContact CB-CZ 3.82Å; K1956-F1958 HydrophobicContact CD-CZ 4.37Å; K1956-F1958 HydrophobicContact CG-CE1 4.39Å; K1956-F1958 HydrophobicContact CG-CZ 3.8Å
1957	R	29.6	Very low	28.2	Very low	218 Å²	218	118 Å²	118	82%	0.823	59%	0.585	S	S	*	*	S	Bend	trans	76.9	102.1	-171.4	-55.7	175.9	173.7	158.7	-1.7	112.2
1958	F	34.6	Very low	28.2	Very low	137 Å²	137	118.4 Å²	118.4	60%	0.601	59%	0.588	S	S	*	*			cis	151.1	153.7	-26	-77.6	-36	0	0	0	105.7	K1956	K1956-F1958 HydrophobicContact CB-CE1 4.32Å; K1956-F1958 HydrophobicContact CB-CE2 4.2Å; K1956-F1958 HydrophobicContact CB-CZ 3.82Å; K1956-F1958 HydrophobicContact CD-CZ 4.37Å; K1956-F1958 HydrophobicContact CG-CE1 4.39Å; K1956-F1958 HydrophobicContact CG-CZ 3.8Å
1959	H	33.9	Very low	27.9	Very low	132 Å²	132	122.5 Å²	122.5	61%	0.611	60%	0.601	S	S	*	*			cis	-151.6	165.8	-11.6	-107	-48.9	0	0	0	104.6
1960	K	28.8	Very low	27.1	Very low	77 Å²	77	118.5 Å²	118.5	34%	0.335	60%	0.595	S	S	.	*			cis	-142.7	-169.5	-7.4	-145.6	158.2	-179.5	171.9	0	107.2	K1896 E1910	K1896-K1960 PolarHBondContact NZ-O 3.3Å; E1910-K1960 IonicContact OE1-NZ 3.72Å; E1910-K1960 PolarHBondContact OE1-NZ 3.3Å
1961	S	26.2	Very low	26.7	Very low	34 Å²	34	126.3 Å²	126.3	24%	0.238	62%	0.616	C	S	.	*			trans	27.8	163.5	151.2	50.5	0	0	0	0	124.4	K1896 D1899 I1900	K1896-S1961 PolarHBondContact NZ-O 3.17Å; D1899-S1961 WeakPolarHBondContact O-CB 3.43Å; I1900-S1961 WeakPolarHBondContact O-CB 3.06Å; I1900-S1961 PolarHBondContact O-OG 3.16Å
1962	G	27	Very low	26.6	Very low	30 Å²	30	127.8 Å²	127.8	31%	0.309	63%	0.628	S	S	.	*			cis	139.6	144.3	-16.4	0	0	0	0	0	111.9	T1901	T1901-G1962 WeakPolarHBondContact CG2-O 3.46Å
1963	I	25	Very low	26.7	Very low	124 Å²	124	129.3 Å²	129.3	64%	0.636	63%	0.632	S	S	*	*			cis	-150.4	118.1	-17.4	-60.8	92.9	0	0	0	103.4
1964	R	29.8	Very low	26.8	Very low	175 Å²	175	134.6 Å²	134.6	66%	0.66	66%	0.659	S	S	*	*			cis	78.3	129.2	10	-88.4	-178.4	170.5	-85.4	-2.8	117	N1967	R1964-N1967 VanDerWaalsContact CZ-ND2 3.27Å; R1964-N1967 PolarHBondContact NH1-ND2 2.7Å; R1964-N1967 PolarHBondContact NH2-ND2 2.72Å; R1964-N1967 VanDerWaalsContact NH2-ND2 3.18Å
1965	N	29.1	Very low	27.4	Very low	132 Å²	132	130.4 Å²	130.4	71%	0.706	65%	0.648	S	S	*	*			cis	-131.6	108.8	19.8	-71.7	-64.5	0	0	0	115.7
1966	N	36.1	Very low	27.7	Very low	143 Å²	143	134.9 Å²	134.9	77%	0.765	66%	0.661	S	S	*	*				-57.3	164.8	126.8	-82.5	-24.5	0	0	0	109.9
1967	N	26.5	Very low	27.7	Very low	99 Å²	99	130.3 Å²	130.3	53%	0.529	65%	0.651	S	S	.	*			trans	132.3	142.1	150.9	-67.8	-40.5	0	0	0	112.8	R1964	R1964-N1967 VanDerWaalsContact CZ-ND2 3.27Å; R1964-N1967 PolarHBondContact NH1-ND2 2.7Å; R1964-N1967 PolarHBondContact NH2-ND2 2.72Å; R1964-N1967 VanDerWaalsContact NH2-ND2 3.18Å
1968	L	24.9	Very low	27.7	Very low	134 Å²	134	126.1 Å²	126.1	70%	0.702	64%	0.639	S	S	*	*			cis	-157.2	150.7	-6	-112.8	159	0	0	0	109.5
1969	Y	23.5	Very low	27.4	Very low	210 Å²	210	126.1 Å²	126.1	82%	0.824	65%	0.65	S	S	*	*			trans	-12.2	139	137.7	-70.5	-110.3	0	0	0	114.4
1970	S	22.5	Very low	27.3	Very low	99 Å²	99	122.9 Å²	122.9	69%	0.692	65%	0.653	S	S	*	*				-175.6	171.4	50.6	46.3	0	0	0	0	113
1971	R	21.9	Very low	27.3	Very low	229 Å²	229	122.3 Å²	122.3	86%	0.864	66%	0.663	S	S	*	*			trans	80	88.2	162.1	-63.6	-178.9	170.8	-176.5	-5.2	119.7
1972	S	22.4	Very low	27.1	Very low	98 Å²	98	123.4 Å²	123.4	69%	0.685	67%	0.67	S	S	*	*				41.4	128.1	119.3	61.9	0	0	0	0	122.6
1973	N	24.6	Very low	26.9	Very low	152 Å²	152	126.2 Å²	126.2	81%	0.813	68%	0.677	S	S	*	*			trans	88	104.8	147	-57.4	-2.4	0	0	0	121.3
1974	N	26.4	Very low	26.9	Very low	160 Å²	160	126.5 Å²	126.5	86%	0.856	68%	0.676	S	S	*	*				43.6	159.9	128.7	-95.1	-18.3	0	0	0	123.6
1975	P	34.9	Very low	26.5	Very low	105 Å²	105	122.4 Å²	122.4	68%	0.682	66%	0.664	S	S	*	*			cis	-139.3	168.1	-9.5	38	-18.1	0	0	0	118.2
1976	Q	29.5	Very low	26.2	Very low	168 Å²	168	121.8 Å²	121.8	79%	0.785	66%	0.661	S	S	*	*			trans	51.2	129.8	148.7	-68.2	-170.9	11.2	0	0	126.4
1977	S	24.2	Very low	25.6	Very low	81 Å²	81	121.1 Å²	121.1	57%	0.566	66%	0.662	S	S	*	*			trans	96.1	135.4	138.4	81.9	0	0	0	0	123.2
1978	K	30.5	Very low	25.6	Very low	129 Å²	129	124.5 Å²	124.5	56%	0.561	68%	0.678	S	S	*	*			trans	51.9	140	148.8	-75.3	-177.1	179.1	-179.6	0	120	A376 L377 T378	A376-K1978 PolarHBondContact O-NZ 3.2Å; L377-K1978 VanDerWaalsContact C-NZ 3.26Å; L377-K1978 PolarHBondContact O-NZ 2.81Å; T378-K1978 PolarHBondContact OG1-NZ 3.18Å
1979	T	27.8	Very low	25.7	Very low	137 Å²	137	121.2 Å²	121.2	84%	0.84	67%	0.666	S	S	*	*			cis	-145.4	140.3	11.6	46.6	0	0	0	0	112.4
1980	G	31.1	Very low	25.6	Very low	65 Å²	65	113.7 Å²	113.7	67%	0.67	65%	0.645	S	S	*	*			trans	178	176.3	171.4	0	0	0	0	0	111.7
1981	A	28.6	Very low	25.6	Very low	65 Å²	65	115.5 Å²	115.5	54%	0.537	64%	0.636	S	S	.	*			cis	-153.9	161	-10.4	0	0	0	0	0	109.7	R2228	A1981-R2228 WeakPolarHBondContact O-CD 3.45Å; A1981-R2228 PolarHBondContact O-NH1 2.75Å
1982	C	23.9	Very low	25.7	Very low	57 Å²	57	109.3 Å²	109.3	39%	0.385	62%	0.615	S	S	.	*			trans	-137.8	93.9	-151.6	-53.9	0	0	0	0	118.1	Q2227 R2228 T2230	C1982-Q2227 CarbonylContact C-O 3.51Å; C1982-Q2227 VanDerWaalsContact C-O 3.31Å; C1982-Q2227 VanDerWaalsContact CA-O 3.24Å; C1982-Q2227 WeakPolarHBondContact CA-O 3.25Å; C1982-R2228 HydrophobicContact CB-CB 3.94Å; C1982-T2230 HydrophobicContact CB-CG2 4.4Å
1983	L	22.8	Very low	25.7	Very low	89 Å²	89	108.2 Å²	108.2	47%	0.466	60%	0.601	S	S	.	*			trans	-165.2	149.3	145.9	-125.7	179.4	0	0	0	111.4	Q2227 R2228 F2229	L1983-Q2227 CarbonylContact C-O 3.49Å; L1983-Q2227 VanDerWaalsContact C-O 3.26Å; L1983-Q2227 VanDerWaalsContact CA-O 3.29Å; L1983-Q2227 WeakPolarHBondContact CA-O 3.45Å; L1983-Q2227 PolarHBondContact N-O 3.24Å; L1983-Q2227 WeakPolarHBondContact O-CB 3.28Å; L1983-Q2227 WeakPolarHBondContact O-CG 3.01Å; L1983-Q2227 PolarHBondContact O-OE1 3.19Å; L1983-Q2227 VanDerWaalsContact O-OE1 3.05Å; L1983-R2228 WeakPolarHBondContact CA-O 2.95Å; L1983-F2229 HydrophobicContact CD2-CD1 4.24Å; L1983-F2229 HydrophobicContact CG-CD1 4.22Å; L1983-F2229 HydrophobicContact CG-CE1 4.48Å
1984	Q	23.5	Very low	25.6	Very low	129 Å²	129	106.7 Å²	106.7	60%	0.603	59%	0.589	S	S	*	*			trans	-72.4	159.9	173.2	-53.4	164.2	-94.9	0	0	111.6
1985	Q	22.3	Very low	25.5	Very low	89 Å²	89	102.7 Å²	102.7	42%	0.416	56%	0.564	S	S	.	*				177.9	154.2	53.6	-141	-175.4	-45.8	0	0	110.2
1986	D	21.6	Very low	24.8	Very low	120 Å²	120	101.1 Å²	101.1	64%	0.642	55%	0.551	S	S	*	*			trans	55.3	141.6	159.2	-42.3	-43.7	0	0	0	119.7
1987	V	24.6	Very low	24.5	Very low	128 Å²	128	98.8 Å²	98.8	78%	0.776	54%	0.535	S	S	*	.			cis	-145.1	135	33.2	166.9	0	0	0	0	111.6
1988	I	25.4	Very low	24.5	Very low	170 Å²	170	102.8 Å²	102.8	87%	0.872	55%	0.55	S	S	*	.			trans	-107.6	135.1	167	-62.2	167.6	0	0	0	108.5
1989	S	27.8	Very low	24.2	Very low	66 Å²	66	99.3 Å²	99.3	46%	0.462	54%	0.541	S	S	.	.			trans	-164.1	96.6	175.2	-79.5	0	0	0	0	115.4	K472	K472-S1989 WeakPolarHBondContact CG-O 3.29Å
1990	S	21.8	Very low	24	Very low	52 Å²	52	96.5 Å²	96.5	36%	0.364	53%	0.528	S	S	.	.			trans	-174.7	106.2	134.6	-90.2	0	0	0	0	115
1991	R	22.6	Very low	23.6	Very low	136 Å²	136	100 Å²	100	51%	0.513	52%	0.521	S	S	.	.			trans	66.6	158.6	161.1	-50.3	137.2	162	-164.3	13.1	114.9	E473 C474	E473-R1991 VanDerWaalsContact CB-NH1 3.27Å; E473-R1991 VanDerWaalsContact CG-NH1 3.29Å; E473-R1991 IonicContact OE1-CZ 3.32Å; E473-R1991 IonicContact OE1-NH1 3.46Å; E473-R1991 PolarHBondContact OE1-NH1 2.68Å; E473-R1991 IonicContact OE1-NH2 2.67Å; E473-R1991 PolarHBondContact OE1-NH2 3.39Å; C474-R1991 HydrophobicContact CB-CB 4.29Å; C474-R1991 HydrophobicContact CB-CG 4.37Å; C474-R1991 WeakPolarHBondContact SG-CB 3.35Å; C474-R1991 VanDerWaalsContact SG-CD 3.53Å
1992	K	23.6	Very low	23.5	Very low	99 Å²	99	100.8 Å²	100.8	43%	0.43	52%	0.522	S	S	.	.			cis	-119	150.3	-12.8	-105	161	171.9	-178.3	0	107.4	C474 Y476	C474-K1992 VanDerWaalsContact SG-CD 3.51Å; C474-K1992 WeakPolarHBondContact SG-CE 3.26Å; C474-K1992 VanDerWaalsContact SG-CG 3.54Å; Y476-K1992 VanDerWaalsContact CB-NZ 3.3Å; Y476-K1992 HydrophobicContact CD2-CD 4.2Å; Y476-K1992 HydrophobicContact CE2-CD 4.29Å; Y476-K1992 VanDerWaalsContact CG-NZ 3.26Å
1993	L	22.2	Very low	23.5	Very low	75 Å²	75	108.4 Å²	108.4	39%	0.393	54%	0.544	S	S	.	.			cis	94.3	61.8	14.1	-111	178.3	0	0	0	119.2	F269 K272	F269-L1993 HydrophobicContact CD2-CD1 4.48Å; F269-L1993 HydrophobicContact CD2-CD2 3.34Å; F269-L1993 HydrophobicContact CE2-CD2 3.33Å; F269-L1993 HydrophobicContact CG-CD2 4.38Å; F269-L1993 HydrophobicContact CZ-CD2 4.36Å; K272-L1993 HydrophobicContact CD-CD1 4.36Å; K272-L1993 HydrophobicContact CD-CD2 4.5Å; K272-L1993 PolarHBondContact NZ-O 2.69Å
1994	E	22.8	Very low	23.5	Very low	120 Å²	120	109.6 Å²	109.6	56%	0.561	56%	0.557	S	S	*	*			trans	-151.6	115.9	147.1	-115.9	71.2	-112.9	0	0	104.8	K272	K272-E1994 IonicContact NZ-OE1 3.11Å; K272-E1994 PolarHBondContact NZ-OE1 3.11Å; K272-E1994 IonicContact NZ-OE2 2.77Å; K272-E1994 PolarHBondContact NZ-OE2 3.26Å
1995	K	23.3	Very low	23.6	Very low	76 Å²	76	109.8 Å²	109.8	33%	0.33	57%	0.567	S	S	.	*				66.6	130.4	76.3	-78.6	177.6	-75.2	156.1	0	113	F269 N2423	F269-K1995 HydrophobicContact CE2-CD 3.91Å; F269-K1995 HydrophobicContact CE2-CG 4.03Å; F269-K1995 HydrophobicContact CZ-CD 3.8Å; F269-K1995 HydrophobicContact CZ-CG 3.7Å; K1995-N2423 HydrophobicContact CD-CB 3.62Å; K1995-N2423 WeakPolarHBondContact CD-OD1 3.37Å; K1995-N2423 VanDerWaalsContact CE-OD1 3.24Å; K1995-N2423 WeakPolarHBondContact CE-OD1 3.17Å; K1995-N2423 PolarHBondContact NZ-OD1 2.67Å
1996	N	21.4	Very low	23.7	Very low	73 Å²	73	111.2 Å²	111.2	39%	0.39	58%	0.584	S	S	.	*				-163.6	-177.7	53.7	-117.7	-8.6	0	0	0	112.4	S906 E909	S906-N1996 VanDerWaalsContact CB-C 3.47Å; S906-N1996 WeakPolarHBondContact CB-O 3.04Å; S906-N1996 PolarHBondContact OG-O 2.89Å; E909-N1996 VanDerWaalsContact CD-ND2 3.28Å; E909-N1996 PolarHBondContact OE1-ND2 3.42Å; E909-N1996 VanDerWaalsContact OE2-CB 3.29Å; E909-N1996 WeakPolarHBondContact OE2-CB 3.19Å; E909-N1996 PolarHBondContact OE2-ND2 2.79Å
1997	Y	23	Very low	23.7	Very low	118 Å²	118	114.4 Å²	114.4	46%	0.463	60%	0.595	S	S	.	*			trans	22.4	131.9	171.4	-53	-87	0	0	0	120.3	S906	S906-Y1997 VanDerWaalsContact N-CD2 3.3Å; S906-Y1997 PolarHBondContact OG-O 3.03Å
1998	L	23.6	Very low	23.7	Very low	166 Å²	166	114.1 Å²	114.1	87%	0.869	59%	0.588	S	S	*	*			cis	56.2	90.8	5.4	-90.9	176.1	0	0	0	118
1999	S	23.9	Very low	23.6	Very low	55 Å²	55	109.8 Å²	109.8	39%	0.385	57%	0.573	S	S	.	*			trans	-177.3	147.7	150.4	-175.9	0	0	0	0	109.6	L904	L904-S1999 VanDerWaalsContact CD2-N 3.33Å; L904-S1999 VanDerWaalsContact CD2-O 3.23Å; L904-S1999 WeakPolarHBondContact CD2-O 3.3Å
2000	S	24.8	Very low	23.4	Very low	79 Å²	79	114.4 Å²	114.4	55%	0.552	59%	0.587	S	S	*	*			cis	174.7	140.3	-49.8	47.5	0	0	0	0	113.1
2001	R	22.8	Very low	23.6	Very low	139 Å²	139	118 Å²	118	53%	0.525	60%	0.599	S	S	.	*			trans	-175.4	115.7	145.3	-101.3	164.7	177.3	-140.7	1.2	107.1	E1652 D1656	E1652-R2001 IonicContact OE2-NH1 2.74Å; E1652-R2001 PolarHBondContact OE2-NH1 3.31Å; D1656-R2001 IonicContact OD1-NH2 3.1Å; D1656-R2001 PolarHBondContact OD1-NH2 2.75Å; D1656-R2001 IonicContact OD2-CZ 2.87Å; D1656-R2001 IonicContact OD2-NH2 3.76Å; D1656-R2001 PolarHBondContact OD2-NH2 2.78Å
2002	S	25.2	Very low	23.7	Very low	80 Å²	80	117 Å²	117	56%	0.559	60%	0.603	S	S	*	*			cis	69.7	146.6	27.3	100.2	0	0	0	0	112.8
2003	Y	23.9	Very low	23.8	Very low	217 Å²	217	118 Å²	118	85%	0.851	62%	0.618	S	S	*	*			cis	-148.5	-155.4	4.5	-107.4	-48.7	0	0	0	107.9
2004	P	23.9	Very low	23.7	Very low	114 Å²	114	118.4 Å²	118.4	74%	0.74	63%	0.627	S	S	*	*			cis	-128.8	-178.3	-9.5	43	-27.6	0	0	0	114.6
2005	V	24.8	Very low	23.7	Very low	134 Å²	134	122.2 Å²	122.2	81%	0.812	64%	0.637	S	S	*	*			trans	-176.4	144.6	138.7	136.9	0	0	0	0	109.1
2006	P	23.8	Very low	23.6	Very low	119 Å²	119	127 Å²	127	77%	0.773	66%	0.658	S	S	*	*			trans	-97.9	172.2	-161.7	38.3	-38.4	0	0	0	116.8
2007	E	22.2	Very low	23.7	Very low	186 Å²	186	125.3 Å²	125.3	87%	0.869	66%	0.658	S	S	*	*			trans	-79.2	159.4	172.6	-57.1	166.2	137	0	0	113
2008	L	25.5	Very low	23.6	Very low	122 Å²	122	123.7 Å²	123.7	64%	0.639	66%	0.657	S	S	*	*			trans	-175.4	138.2	137.9	-104.4	168.4	0	0	0	112.3	L2411	L2008-L2411 HydrophobicContact CD1-CD1 4.47Å; L2008-L2411 HydrophobicContact CD2-CB 3.99Å; L2008-L2411 HydrophobicContact CD2-CD1 4.02Å
2009	S	23.1	Very low	23.6	Very low	80 Å²	80	116.2 Å²	116.2	56%	0.559	62%	0.618	S	S	*	*			trans	4.4	123.4	160.5	57.5	0	0	0	0	118.9
2010	E	24.1	Very low	23.6	Very low	162 Å²	162	116.5 Å²	116.5	76%	0.757	61%	0.613	S	S	*	*				69.7	112.1	61.7	-63.8	167.2	149.6	0	0	114
2011	E	24.5	Very low	23.7	Very low	128 Å²	128	115.1 Å²	115.1	60%	0.598	60%	0.599	S	S	*	*				179.4	133.7	109.1	-105.9	-159.1	-127.7	0	0	113.9
2012	N	25.2	Very low	23.8	Very low	114 Å²	114	115 Å²	115	61%	0.61	60%	0.598	S	S	*	*			trans	65.6	156.6	142.3	-83.1	-59.2	0	0	0	125.5
2013	V	25	Very low	23.8	Very low	122 Å²	122	115.4 Å²	115.4	74%	0.739	59%	0.591	S	S	*	*			trans	84.1	68.9	162	-154.8	0	0	0	0	121.4
2014	S	21.9	Very low	23.9	Very low	83 Å²	83	109.1 Å²	109.1	58%	0.58	57%	0.568	S	S	*	*				63.2	143.5	119.1	87.4	0	0	0	0	124.8
2015	Y	21.4	Very low	23.9	Very low	199 Å²	199	108 Å²	108	78%	0.78	56%	0.556	S	S	*	*			trans	71.2	149.5	151.7	-63.9	-179.4	0	0	0	116.5
2016	K	21.8	Very low	24	Very low	177 Å²	177	107.5 Å²	107.5	77%	0.77	55%	0.545	S	S	*	.			cis	-153.8	-160.6	0.2	-123.2	166.5	-170.4	175	0	110.4
2017	G	22.7	Very low	23.8	Very low	38 Å²	38	102.5 Å²	102.5	39%	0.392	51%	0.513	S	S	.	.			trans	-80.1	-157.1	169.5	0	0	0	0	0	114.2
2018	L	22.4	Very low	23.7	Very low	83 Å²	83	95.7 Å²	95.7	44%	0.435	48%	0.481	S	S	.	.			trans	80.4	147.6	-166.3	-58.8	160.9	0	0	0	112.2	R144 D147	R144-L2018 VanDerWaalsContact CB-O 3.27Å; R144-L2018 WeakPolarHBondContact CB-O 2.98Å; R144-L2018 WeakPolarHBondContact CD-O 3.25Å; D147-L2018 PolarHBondContact OD1-N 3.28Å; D147-L2018 WeakPolarHBondContact OD2-CA 3.43Å; D147-L2018 PolarHBondContact OD2-N 2.96Å; D147-L2018 VanDerWaalsContact OD2-N 3.13Å
2019	E	23.8	Very low	23.6	Very low	10 Å²	10	92.9 Å²	92.9	5%	0.047	46%	0.462	C	S	.	.				64.6	137.6	54.3	-88	148.4	-168.3	0	0	115.2	E141 R144 D147 N149 S150	E141-E2019 WeakPolarHBondContact O-CB 3.2Å; E141-E2019 VanDerWaalsContact O-CG 3.26Å; E141-E2019 WeakPolarHBondContact O-CG 3.33Å; R144-E2019 WeakPolarHBondContact CD-O 2.99Å; R144-E2019 PolarHBondContact NE-O 3.3Å; R144-E2019 PolarHBondContact NH1-O 3.05Å; D147-E2019 HydrophobicContact CB-CB 4.24Å; D147-E2019 HydrophobicContact CB-CG 3.63Å; D147-E2019 WeakPolarHBondContact CB-OE1 3.21Å; D147-E2019 VanDerWaalsContact O-OE1 3.06Å; N149-E2019 WeakPolarHBondContact CA-OE1 3.44Å; N149-E2019 VanDerWaalsContact CB-OE1 3.27Å; N149-E2019 WeakPolarHBondContact CB-OE1 3.41Å; N149-E2019 PolarHBondContact N-OE1 3.42Å; N149-E2019 PolarHBondContact ND2-OE1 2.69Å; N149-E2019 PolarHBondContact ND2-OE2 3.29Å; S150-E2019 WeakPolarHBondContact CB-OE1 3.21Å; S150-E2019 PolarHBondContact N-OE1 2.87Å
2020	E	22.9	Very low	23.6	Very low	60 Å²	60	93.9 Å²	93.9	28%	0.28	46%	0.458	S	S	.	.			trans	72.9	125.7	-167.2	174.8	-175.6	-121.8	0	0	115.8	E143 R144 R2022	E143-E2020 VanDerWaalsContact N-N 3.1Å; R144-E2020 WeakPolarHBondContact CB-O 3.33Å; R144-E2020 VanDerWaalsContact CD-O 3.3Å; R144-E2020 WeakPolarHBondContact CD-O 3.13Å; R144-E2020 WeakPolarHBondContact CG-O 3.23Å; R144-E2020 VanDerWaalsContact CZ-O 3.22Å; R144-E2020 IonicContact CZ-OE2 2.72Å; R144-E2020 PolarHBondContact NE-O 3.19Å; R144-E2020 IonicContact NH1-OE2 3.14Å; R144-E2020 PolarHBondContact NH2-O 2.96Å; R144-E2020 IonicContact NH2-OE2 3.66Å; R144-E2020 PolarHBondContact NH2-OE2 2.86Å; E2020-R2022 IonicContact OE1-CZ 2.69Å; E2020-R2022 IonicContact OE1-NH1 3.94Å; E2020-R2022 PolarHBondContact OE1-NH1 3.25Å
2021	I	27.4	Very low	23.6	Very low	50 Å²	50	88.6 Å²	88.6	26%	0.256	43%	0.432	S	S	.	.			cis	77.2	165.1	28.8	-125.4	175.9	0	0	0	117.3	D142 E143	D142-I2021 HydrophobicContact CB-CB 4.02Å; D142-I2021 HydrophobicContact CB-CD1 4.25Å; D142-I2021 HydrophobicContact CB-CG2 3.71Å; D142-I2021 WeakPolarHBondContact OD1-CG2 3.18Å; D142-I2021 WeakPolarHBondContact OD2-CG2 3.18Å; E143-I2021 HydrophobicContact CB-CB 3.51Å; E143-I2021 HydrophobicContact CB-CD1 3.91Å; E143-I2021 HydrophobicContact CB-CG1 3.55Å; E143-I2021 HydrophobicContact CG-CG1 4.23Å; E143-I2021 WeakPolarHBondContact OE1-CG1 3.37Å
2022	R	23.5	Very low	23.5	Very low	137 Å²	137	83.4 Å²	83.4	52%	0.517	41%	0.408	S	S	.	.			trans	72.3	137.3	176.4	-39.2	-172.3	-175.5	94.8	13.1	117.8	D142 E2020	D142-R2022 IonicContact OD1-CZ 3.6Å; D142-R2022 IonicContact OD1-NH2 2.68Å; D142-R2022 PolarHBondContact OD1-NH2 3.05Å; D142-R2022 IonicContact OD2-CZ 2.74Å; D142-R2022 IonicContact OD2-NH1 3.87Å; D142-R2022 IonicContact OD2-NH2 2.72Å; D142-R2022 PolarHBondContact OD2-NH2 3.41Å; E2020-R2022 IonicContact OE1-CZ 2.69Å; E2020-R2022 IonicContact OE1-NH1 3.94Å; E2020-R2022 PolarHBondContact OE1-NH1 3.25Å
2023	H	26.6	Very low	23.5	Very low	88 Å²	88	87.1 Å²	87.1	41%	0.407	41%	0.414	S	S	.	.			cis	-167.4	109.7	-40.7	-96.9	-44.5	0	0	0	105.5	R1309 D2025	R1309-H2023 PolarHBondContact NH1-O 3.19Å; H2023-D2025 IonicContact CE1-OD2 3.41Å; H2023-D2025 PolarHBondContact CE1-OD2 2.76Å; H2023-D2025 IonicContact CG-OD2 2.77Å; H2023-D2025 IonicContact ND1-OD2 3.78Å; H2023-D2025 PolarHBondContact ND1-OD2 2.55Å
2024	F	24.8	Very low	23.4	Very low	85 Å²	85	83.7 Å²	83.7	37%	0.373	40%	0.395	S	S	.	.	S	Bend	trans	-172.9	62	150.6	-90.7	-48.8	0	0	0	110.3	E1305 I1306 R1309 F1323	E1305-F2024 HydrophobicContact CB-CE2 4.3Å; E1305-F2024 HydrophobicContact CG-CD2 4.49Å; E1305-F2024 HydrophobicContact CG-CE2 3.86Å; E1305-F2024 WeakPolarHBondContact OE1-CD2 3.3Å; I1306-F2024 HydrophobicContact CG1-CE2 3.81Å; I1306-F2024 HydrophobicContact CG1-CZ 4.16Å; R1309-F2024 HydrophobicContact CB-CE1 4.47Å; R1309-F2024 HydrophobicContact CB-CZ 3.71Å; R1309-F2024 HydrophobicContact CG-CE1 4Å; R1309-F2024 HydrophobicContact CG-CE2 4.12Å; R1309-F2024 HydrophobicContact CG-CZ 3.21Å; F1323-F2024 HydrophobicContact CE1-CE1 4.49Å
2025	D	23.7	Very low	23.4	Very low	90 Å²	90	81.5 Å²	81.5	48%	0.481	38%	0.378	S	S	.	.	S	Bend	cis	55.5	162.3	13.3	-156.2	31.6	0	0	0	118.4	H2023 S2027	H2023-D2025 IonicContact CE1-OD2 3.41Å; H2023-D2025 PolarHBondContact CE1-OD2 2.76Å; H2023-D2025 IonicContact CG-OD2 2.77Å; H2023-D2025 IonicContact ND1-OD2 3.78Å; H2023-D2025 PolarHBondContact ND1-OD2 2.55Å; D2025-S2027 PolarHBondContact O-N 2.85Å
2026	Q	27.2	Very low	23.5	Very low	124 Å²	124	77.3 Å²	77.3	58%	0.579	37%	0.368	S	S	*	.			trans	-39.4	112.5	170.1	-61.8	154.3	91.2	0	0	114.1	P1324	P1324-Q2026 HydrophobicContact CG-CB 4.35Å; P1324-Q2026 HydrophobicContact CG-CG 4.25Å
2027	S	19.4	Very low	23.6	Very low	14 Å²	14	76.3 Å²	76.3	10%	0.098	37%	0.366	C	S	.	.			trans	-145.6	140.3	134.6	100	0	0	0	0	108.1	F1323 P1324 D2025	F1323-S2027 CarbonylContact C-O 3.54Å; F1323-S2027 WeakPolarHBondContact CA-O 3.47Å; F1323-S2027 WeakPolarHBondContact CB-O 3.36Å; F1323-S2027 WeakPolarHBondContact CD1-O 3.33Å; F1323-S2027 WeakPolarHBondContact CG-O 3.3Å; P1324-S2027 WeakPolarHBondContact CD-O 3.28Å; P1324-S2027 CarbonylContact O-C 3.24Å; D2025-S2027 PolarHBondContact O-N 2.85Å
2028	H	21.5	Very low	23.6	Very low	44 Å²	44	79.9 Å²	79.9	20%	0.204	38%	0.38	C	S	.	.	S	Bend	trans	79.1	68	143.7	-48.4	-18.2	0	0	0	127	P1320 S1321 F1323 P1324 M1325	P1320-H2028 CarbonylContact C-O 2.89Å; S1321-H2028 PolarHBondContact N-O 3.38Å; F1323-H2028 CarbonylContact C-O 3.54Å; F1323-H2028 HydrophobicContact CB-CB 4.19Å; F1323-H2028 WeakPolarHBondContact CB-O 3.5Å; F1323-H2028 CarbonylContact O-C 3.53Å; P1324-H2028 VanDerWaalsContact N-N 3.19Å; P1324-H2028 PolarHBondContact O-N 3.34Å; M1325-H2028 HydrophobicContact CB-CB 4.28Å; M1325-H2028 WeakPolarHBondContact CE-CE1 3.46Å; M1325-H2028 HydrophobicContact CG-CB 4.24Å; M1325-H2028 WeakPolarHBondContact CG-ND1 3.34Å; M1325-H2028 PolarHBondContact SD-CE1 2.71Å; M1325-H2028 PolarHBondContact SD-ND1 3.49Å
2029	Y	22.4	Very low	23.6	Very low	62 Å²	62	83.8 Å²	83.8	24%	0.243	40%	0.396	C	S	.	.				-170.8	107	73.8	-82.3	-88.5	0	0	0	114.1	P1320 F1323 M1325 Y2031	P1320-Y2029 HydrophobicContact CB-CD2 3.3Å; P1320-Y2029 HydrophobicContact CB-CE2 3.5Å; P1320-Y2029 VanDerWaalsContact CB-CE2 3.5Å; P1320-Y2029 HydrophobicContact CB-CG 4.28Å; P1320-Y2029 WeakPolarHBondContact O-CB 3.21Å; P1320-Y2029 WeakPolarHBondContact O-CD2 3.05Å; F1323-Y2029 PolarHBondContact O-N 3.44Å; M1325-Y2029 VanDerWaalsContact CB-CA 3.44Å; M1325-Y2029 HydrophobicContact CB-CD1 3.3Å; M1325-Y2029 HydrophobicContact CB-CD2 4.1Å; M1325-Y2029 HydrophobicContact CB-CE1 3.61Å; M1325-Y2029 HydrophobicContact CB-CE2 4.3Å; M1325-Y2029 HydrophobicContact CB-CG 3.58Å; M1325-Y2029 HydrophobicContact CG-CD1 3.64Å; M1325-Y2029 HydrophobicContact CG-CD2 4.33Å; M1325-Y2029 HydrophobicContact CG-CE1 3.33Å; M1325-Y2029 HydrophobicContact CG-CE2 4.02Å; M1325-Y2029 HydrophobicContact CG-CG 4.14Å; Y2029-Y2031 HydrophobicContact CD1-CD1 4.07Å; Y2029-Y2031 AromaticContact CD1-CD2 3.45Å; Y2029-Y2031 HydrophobicContact CD1-CD2 3.45Å; Y2029-Y2031 VanDerWaalsContact CD1-CD2 3.45Å; Y2029-Y2031 HydrophobicContact CD1-CE1 4.09Å; Y2029-Y2031 AromaticContact CD1-CE2 3.37Å; Y2029-Y2031 HydrophobicContact CD1-CE2 3.37Å; Y2029-Y2031 AromaticContact CD1-CG 3.82Å; Y2029-Y2031 HydrophobicContact CD1-CG 3.82Å; Y2029-Y2031 AromaticContact CD1-CZ 3.76Å; Y2029-Y2031 HydrophobicContact CE1-CD2 4.04Å; Y2029-Y2031 HydrophobicContact CE1-CE1 4.3Å; Y2029-Y2031 AromaticContact CE1-CE2 3.45Å; Y2029-Y2031 HydrophobicContact CE1-CE2 3.45Å; Y2029-Y2031 VanDerWaalsContact CE1-CE2 3.45Å; Y2029-Y2031 AromaticContact CE1-CZ 3.64Å; Y2029-Y2031 HydrophobicContact CG-CD2 4.48Å; Y2029-Y2031 HydrophobicContact CG-CG 4.49Å
2030	Q	23.9	Very low	23.5	Very low	101 Å²	101	92.9 Å²	92.9	47%	0.472	44%	0.436	S	S	.	.			trans	-60.3	139	135.9	-53.2	166.7	-28.5	0	0	105.2	M1325 S1327	M1325-Q2030 WeakPolarHBondContact O-CA 3.33Å; M1325-Q2030 WeakPolarHBondContact O-CB 2.96Å; M1325-Q2030 VanDerWaalsContact O-CD 3.31Å; M1325-Q2030 WeakPolarHBondContact O-CG 3.36Å; M1325-Q2030 PolarHBondContact O-N 2.79Å; M1325-Q2030 PolarHBondContact O-OE1 3.05Å; S1327-Q2030 PolarHBondContact OG-OE1 2.69Å
2031	Y	23.5	Very low	23.5	Very low	52 Å²	52	101.4 Å²	101.4	20%	0.204	47%	0.465	C	S	.	.			trans	-151.7	138	170.5	-120.1	-160.2	0	0	0	107.2	E1329 Y1330 Y2029	E1329-Y2031 HydrophobicContact CB-CE2 3.61Å; E1329-Y2031 HydrophobicContact CG-CE2 4.13Å; E1329-Y2031 WeakPolarHBondContact CG-OH 3.33Å; E1329-Y2031 PolarHBondContact OE2-OH 3.47Å; Y1330-Y2031 VanDerWaalsContact CD1-C 3.42Å; Y1330-Y2031 VanDerWaalsContact CD2-CB 3.44Å; Y1330-Y2031 AromaticContact CD2-CD1 3.24Å; Y1330-Y2031 HydrophobicContact CD2-CD1 3.24Å; Y1330-Y2031 HydrophobicContact CD2-CE1 4.15Å; Y1330-Y2031 AromaticContact CD2-CG 3.61Å; Y1330-Y2031 HydrophobicContact CD2-CG 3.61Å; Y1330-Y2031 WeakPolarHBondContact CE1-O 2.85Å; Y1330-Y2031 AromaticContact CE2-CD1 3.96Å; Y1330-Y2031 HydrophobicContact CE2-CD1 3.96Å; Y1330-Y2031 HydrophobicContact CE2-CG 4.29Å; Y1330-Y2031 AromaticContact CG-CD1 3.9Å; Y1330-Y2031 HydrophobicContact CG-CD1 3.9Å; Y1330-Y2031 AromaticContact CG-CG 3.87Å; Y1330-Y2031 HydrophobicContact CG-CG 3.87Å; Y1330-Y2031 VanDerWaalsContact N-CD2 3.3Å; Y1330-Y2031 VanDerWaalsContact N-CE2 3.27Å; Y2029-Y2031 HydrophobicContact CD1-CD1 4.07Å; Y2029-Y2031 AromaticContact CD1-CD2 3.45Å; Y2029-Y2031 HydrophobicContact CD1-CD2 3.45Å; Y2029-Y2031 VanDerWaalsContact CD1-CD2 3.45Å; Y2029-Y2031 HydrophobicContact CD1-CE1 4.09Å; Y2029-Y2031 AromaticContact CD1-CE2 3.37Å; Y2029-Y2031 HydrophobicContact CD1-CE2 3.37Å; Y2029-Y2031 AromaticContact CD1-CG 3.82Å; Y2029-Y2031 HydrophobicContact CD1-CG 3.82Å; Y2029-Y2031 AromaticContact CD1-CZ 3.76Å; Y2029-Y2031 HydrophobicContact CE1-CD2 4.04Å; Y2029-Y2031 HydrophobicContact CE1-CE1 4.3Å; Y2029-Y2031 AromaticContact CE1-CE2 3.45Å; Y2029-Y2031 HydrophobicContact CE1-CE2 3.45Å; Y2029-Y2031 VanDerWaalsContact CE1-CE2 3.45Å; Y2029-Y2031 AromaticContact CE1-CZ 3.64Å; Y2029-Y2031 HydrophobicContact CG-CD2 4.48Å; Y2029-Y2031 HydrophobicContact CG-CG 4.49Å
2032	N	23.5	Very low	23.3	Very low	19 Å²	19	104 Å²	104	10%	0.102	48%	0.483	C	S	.	.			trans	-69.2	-168.4	-144.3	-19.7	-5.3	0	0	0	118.1	S1327 S1328 E1329 Y1330 H1331 K1334	S1327-N2032 PolarHBondContact O-ND2 2.98Å; S1327-N2032 PolarHBondContact O-OD1 3.16Å; S1327-N2032 VanDerWaalsContact O-OD1 3.1Å; S1328-N2032 PolarHBondContact O-ND2 3.43Å; E1329-N2032 PolarHBondContact N-ND2 2.91Å; E1329-N2032 PolarHBondContact N-OD1 3.43Å; Y1330-N2032 VanDerWaalsContact CB-OD1 3.29Å; Y1330-N2032 WeakPolarHBondContact CB-OD1 3.21Å; Y1330-N2032 VanDerWaalsContact CD1-C 3.5Å; Y1330-N2032 HydrophobicContact CD1-CB 4.46Å; Y1330-N2032 WeakPolarHBondContact CD1-O 3.35Å; Y1330-N2032 WeakPolarHBondContact CE1-O 3.4Å; Y1330-N2032 VanDerWaalsContact N-CG 3.33Å; Y1330-N2032 PolarHBondContact N-ND2 2.93Å; Y1330-N2032 PolarHBondContact N-OD1 2.72Å; H1331-N2032 WeakPolarHBondContact CB-ND2 3.45Å; H1331-N2032 PolarHBondContact CD2-ND2 2.88Å; H1331-N2032 PolarHBondContact N-ND2 3.48Å; K1334-N2032 PolarHBondContact NZ-O 2.88Å
2033	R	23.6	Very low	23.2	Very low	192 Å²	192	102.5 Å²	102.5	73%	0.725	49%	0.485	S	S	*	.				60.3	172.3	55	-120.1	165.6	166	-141.7	9.2	113.3	H1331 K1334	H1331-R2033 VanDerWaalsContact CE1-CB 3.49Å; H1331-R2033 WeakPolarHBondContact CE1-CB 3.34Å; H1331-R2033 WeakPolarHBondContact CE1-CG 3.41Å; H1331-R2033 VanDerWaalsContact NE2-CD 3.29Å; H1331-R2033 WeakPolarHBondContact NE2-CD 3.39Å; H1331-R2033 PolarHBondContact NE2-NH1 2.86Å; K1334-R2033 WeakPolarHBondContact CD-O 3.34Å; K1334-R2033 PolarHBondContact NZ-O 2.98Å
2034	S	22.8	Very low	23.1	Very low	49 Å²	49	106.5 Å²	106.5	34%	0.343	50%	0.497	S	S	.	.			trans	-52	-170.1	-157.2	77.7	0	0	0	0	118.2	H1331 K1334	H1331-S2034 CarbonylContact C-O 3.03Å; H1331-S2034 VanDerWaalsContact CA-O 3.25Å; H1331-S2034 WeakPolarHBondContact CA-O 3.25Å; H1331-S2034 PolarHBondContact CE1-OG 3.2Å; H1331-S2034 PolarHBondContact ND1-N 3.47Å; H1331-S2034 PolarHBondContact ND1-OG 2.79Å; H1331-S2034 CarbonylContact O-C 3.18Å; H1331-S2034 VanDerWaalsContact O-O 3.11Å; K1334-S2034 WeakPolarHBondContact CB-O 3.24Å; K1334-S2034 WeakPolarHBondContact CD-O 3.24Å
2035	T	22.5	Very low	23	Very low	37 Å²	37	111.5 Å²	111.5	23%	0.227	51%	0.513	C	S	.	.			cis	-135.4	120	25.5	-78.2	0	0	0	0	107.4	H1331 K1334 T1335	H1331-T2035 WeakPolarHBondContact O-CB 3.17Å; H1331-T2035 PolarHBondContact O-N 3.42Å; H1331-T2035 VanDerWaalsContact O-N 3.15Å; H1331-T2035 PolarHBondContact O-OG1 3.38Å; K1334-T2035 CarbonylContact C-O 3.52Å; T1335-T2035 HydrophobicContact CG2-CG2 3.38Å; T1335-T2035 WeakPolarHBondContact CG2-O 3.31Å; T1335-T2035 PolarHBondContact N-O 3.37Å
2036	I	24.5	Very low	23.1	Very low	112 Å²	112	113.6 Å²	113.6	57%	0.574	53%	0.525	S	S	*	.				89.4	131.4	87.2	-103	160.4	0	0	0	112.2
2037	Q	23.6	Very low	22.9	Very low	156 Å²	156	111.8 Å²	111.8	73%	0.729	52%	0.522	S	S	*	.			trans	48.5	132.3	151.7	-58.1	168.5	8.6	0	0	118.5
2038	T	22.4	Very low	23.1	Very low	112 Å²	112	118.8 Å²	118.8	69%	0.687	55%	0.553	S	S	*	*			cis	-169.1	170.8	28.2	-13.7	0	0	0	0	112.8
2039	Q	22.1	Very low	23.1	Very low	165 Å²	165	121.2 Å²	121.2	77%	0.771	57%	0.574	S	S	*	*			trans	67.7	109.2	157.1	-65	162.8	26.8	0	0	116.9
2040	K	22.3	Very low	23.2	Very low	202 Å²	202	126 Å²	126	88%	0.878	60%	0.598	S	S	*	*				63.6	96.4	71	-71.7	-170.6	173.6	-178.1	0	114.8
2041	R	21.5	Very low	23.2	Very low	238 Å²	238	127.8 Å²	127.8	90%	0.898	61%	0.61	S	S	*	*			trans	160.2	151.2	135.7	-92.3	-163.2	169.3	103.3	-5.4	109.6
2042	V	23	Very low	23.2	Very low	104 Å²	104	130 Å²	130	63%	0.63	63%	0.631	S	S	*	*			cis	-168.1	152.3	-26	80.6	0	0	0	0	107
2043	D	22.5	Very low	23.3	Very low	106 Å²	106	135.9 Å²	135.9	57%	0.567	66%	0.663	S	S	*	*			trans	58	147.5	159.7	-72	1.4	0	0	0	118.7
2044	R	24.2	Very low	23.2	Very low	173 Å²	173	134.8 Å²	134.8	65%	0.653	66%	0.663	S	S	*	*			cis	-173.3	172.8	-3.7	-118	167.5	178.7	149.8	-11	107.6
2045	R	23.9	Very low	23.3	Very low	189 Å²	189	138.4 Å²	138.4	71%	0.713	68%	0.683	S	S	*	*			trans	73.7	114.1	148.2	-79.3	162.3	-169.9	173.9	2	115
2046	N	24.5	Very low	23.3	Very low	135 Å²	135	145.1 Å²	145.1	72%	0.722	71%	0.709	S	S	*	*				85.4	136.8	74.6	-79	34.8	0	0	0	109.6
2047	T	23.7	Very low	23.1	Very low	86 Å²	86	149 Å²	149	53%	0.528	72%	0.717	S	S	.	*			cis	-156.7	178.2	2.2	6.3	0	0	0	0	110.3
2048	E	22.3	Very low	23.1	Very low	161 Å²	161	148.7 Å²	148.7	75%	0.752	71%	0.713	S	S	*	*			trans	43.3	131.6	139.1	-65.8	140.2	-164.3	0	0	119.2
2049	C	22.5	Very low	23.1	Very low	94 Å²	94	149.8 Å²	149.8	64%	0.635	72%	0.715	S	S	*	*			cis	-174.3	174	6.9	-125	0	0	0	0	111.6
2050	H	24.1	Very low	23.3	Very low	162 Å²	162	149.4 Å²	149.4	75%	0.75	71%	0.713	S	S	*	*			trans	55.8	91.9	153.3	-64.5	-52.8	0	0	0	120.4
2051	L	24.4	Very low	23.6	Very low	139 Å²	139	145.4 Å²	145.4	73%	0.728	71%	0.708	S	S	*	*				19.7	138.3	99.3	-85.8	157.2	0	0	0	116.7
2052	P	24	Very low	23.7	Very low	100 Å²	100	140.4 Å²	140.4	65%	0.649	70%	0.699	S	S	*	*				-148.6	162.5	67	42.5	-26.5	0	0	0	118
2053	D	25.2	Very low	23.7	Very low	141 Å²	141	140.5 Å²	140.5	75%	0.754	70%	0.704	S	S	*	*			trans	-52.8	141	150	-58.6	-82.9	0	0	0	111.3
2054	K	21.3	Very low	23.7	Very low	169 Å²	169	141.4 Å²	141.4	74%	0.735	71%	0.713	S	S	*	*			trans	-159	134.1	151.4	-110.6	139.9	-170	175.1	0	115.3	F2056	K2054-F2056 HydrophobicContact CB-CE2 4.1Å
2055	V	24.1	Very low	23.6	Very low	125 Å²	125	140.1 Å²	140.1	76%	0.758	72%	0.718	S	S	*	*			trans	-65.6	125.2	176.1	175.9	0	0	0	0	112.2	R2057	V2055-R2057 HydrophobicContact CG1-CB 4.48Å
2056	F	23.4	Very low	23.6	Very low	179 Å²	179	139.9 Å²	139.9	79%	0.785	72%	0.722	S	S	*	*			trans	-152.2	134.6	160.6	-63.2	-79.4	0	0	0	107.8	K2054	K2054-F2056 HydrophobicContact CB-CE2 4.1Å
2057	R	20.6	Very low	23.4	Very low	193 Å²	193	137.2 Å²	137.2	73%	0.728	71%	0.714	S	S	*	*			cis	72.2	121.3	-5.5	-131.9	-178.5	-173.2	-165.1	3	118.7	V2055	V2055-R2057 HydrophobicContact CG1-CB 4.48Å
2058	F	22.3	Very low	23.4	Very low	149 Å²	149	138.4 Å²	138.4	65%	0.654	72%	0.718	S	S	*	*			trans	82.3	106.1	168	-62	-67.5	0	0	0	118.9
2059	D	22.2	Very low	23.5	Very low	136 Å²	136	136.2 Å²	136.2	73%	0.727	71%	0.707	S	S	*	*				37.9	118.4	107.6	-42.4	-6.7	0	0	0	119
2060	E	26.6	Very low	23.6	Very low	156 Å²	156	138.6 Å²	138.6	73%	0.729	70%	0.704	S	S	*	*			trans	52.1	162.2	136.9	-100.3	-157.2	-122.3	0	0	121.3	N2062	E2060-N2062 PolarHBondContact OE2-ND2 3.34Å
2061	P	28.4	Very low	23.8	Very low	118 Å²	118	137.6 Å²	137.6	77%	0.766	70%	0.704	S	S	*	*			cis	-145.4	175.4	40.4	43.4	-22.7	0	0	0	119.5
2062	N	24.8	Very low	23.9	Very low	133 Å²	133	134.1 Å²	134.1	71%	0.711	69%	0.69	S	S	*	*			trans	-55.8	141.1	167.6	-73.8	-90.1	0	0	0	116	E2060	E2060-N2062 PolarHBondContact OE2-ND2 3.34Å
2063	S	22.3	Very low	23.9	Very low	106 Å²	106	137 Å²	137	74%	0.741	69%	0.694	S	S	*	*			trans	-159.2	120.1	138.1	41	0	0	0	0	108.3
2064	V	23.4	Very low	23.8	Very low	126 Å²	126	136.8 Å²	136.8	76%	0.764	69%	0.693	S	S	*	*				52.6	105.7	87.1	-179.4	0	0	0	0	109.6
2065	I	22.6	Very low	24	Very low	145 Å²	145	134.4 Å²	134.4	74%	0.744	69%	0.693	S	S	*	*				-138	125.6	50.5	-61.2	171.1	0	0	0	108.4
2066	F	22	Very low	24.1	Very low	184 Å²	184	132.2 Å²	132.2	81%	0.807	69%	0.688	S	S	*	*				61.6	141.8	87	-107.1	-79.4	0	0	0	117.4
2067	S	21.8	Very low	24.1	Very low	80 Å²	80	130.6 Å²	130.6	56%	0.559	68%	0.682	S	S	*	*			trans	61	111.3	159.7	55.3	0	0	0	0	121.3
2068	N	22.7	Very low	24.3	Very low	111 Å²	111	128.2 Å²	128.2	59%	0.594	68%	0.68	S	S	*	*			trans	67.8	150.5	137.2	-42.7	-10.5	0	0	0	118.1
2069	H	24.6	Very low	24.3	Very low	115 Å²	115	128.8 Å²	128.8	53%	0.532	68%	0.684	S	S	.	*			cis	-101.4	-117	0.8	-65.3	-142.5	0	0	0	108.6	E1618	E1618-H2069 IonicContact OE1-CE1 2.76Å; E1618-H2069 PolarHBondContact OE1-CE1 2.94Å; E1618-H2069 VanDerWaalsContact OE1-CE1 3.28Å; E1618-H2069 IonicContact OE1-ND1 3.27Å
2070	Y	26	Very low	24.3	Very low	143 Å²	143	128.4 Å²	128.4	56%	0.561	68%	0.681	S	S	*	*			cis	-156.2	49.4	-10.9	-139.2	-39.2	0	0	0	113.4	N1617	N1617-Y2070 PolarHBondContact OD1-OH 3.47Å
2071	D	26.8	Very low	24.3	Very low	142 Å²	142	126.7 Å²	126.7	76%	0.759	68%	0.681	S	S	*	*			trans	-60.7	146.5	153.2	-60.4	-68.8	0	0	0	109
2072	P	28	Very low	24	Very low	66 Å²	66	127.3 Å²	127.3	43%	0.429	67%	0.674	S	S	.	*				-133.4	144.6	89.4	31.8	-15.1	0	0	0	111.9
2073	E	23.7	Very low	24	Very low	159 Å²	159	125.1 Å²	125.1	74%	0.743	67%	0.673	S	S	*	*				54.2	113.8	70.5	-57	179.8	136.9	0	0	112.9
2074	N	23.3	Very low	24.2	Very low	137 Å²	137	126.6 Å²	126.6	73%	0.733	67%	0.673	S	S	*	*				171.7	143	112.8	-89.9	-40.3	0	0	0	113.3
2075	V	24.5	Very low	24.2	Very low	119 Å²	119	126.7 Å²	126.7	72%	0.721	67%	0.669	S	S	*	*				35.8	121.8	128.7	-169.5	0	0	0	0	116
2076	A	25.3	Very low	24.3	Very low	79 Å²	79	127 Å²	127	65%	0.653	67%	0.672	S	S	*	*				-158.1	163.5	57.6	0	0	0	0	0	115
2077	H	24.5	Very low	24.5	Very low	146 Å²	146	123.4 Å²	123.4	68%	0.676	67%	0.665	S	S	*	*				19	144.5	118.9	-55.7	-103.8	0	0	0	117.5
2078	E	23.8	Very low	24.6	Very low	143 Å²	143	128.2 Å²	128.2	67%	0.668	68%	0.679	S	S	*	*			cis	-166.5	148.5	8.5	-108.9	150.3	-163.4	0	0	104.9
2079	E	22.7	Very low	24.6	Very low	161 Å²	161	129 Å²	129	75%	0.752	68%	0.682	S	S	*	*				68.9	170.4	89.1	-137.9	-175.3	-131.3	0	0	116.1
2080	I	23.7	Very low	24.7	Very low	127 Å²	127	128.9 Å²	128.9	65%	0.651	69%	0.691	S	S	*	*			trans	72.1	113.9	154.2	-73.4	167.7	0	0	0	120.6
2081	V	25.4	Very low	24.4	Very low	121 Å²	121	126.6 Å²	126.6	73%	0.733	69%	0.685	S	S	*	*			trans	61.8	115.6	134.9	173.4	0	0	0	0	119.3
2082	E	22.5	Very low	24.2	Very low	131 Å²	131	125.6 Å²	125.6	61%	0.612	68%	0.679	S	S	*	*				62	106.1	73.5	-85.1	-175.9	-164	0	0	117.3	R2395	E2082-R2395 IonicContact OE1-CZ 3.63Å; E2082-R2395 IonicContact OE1-NH2 3.21Å; E2082-R2395 PolarHBondContact OE1-NH2 2.87Å
2083	A	25.3	Very low	23.9	Very low	86 Å²	86	127.3 Å²	127.3	71%	0.711	68%	0.681	S	S	*	*			trans	52.4	123.6	158.6	0	0	0	0	0	119.5
2084	N	25.3	Very low	23.9	Very low	138 Å²	138	127.5 Å²	127.5	74%	0.738	68%	0.682	S	S	*	*				176.2	135.4	103.2	-96	-70.4	0	0	0	113.9
2085	N	24.3	Very low	23.8	Very low	127 Å²	127	124.7 Å²	124.7	68%	0.679	67%	0.673	S	S	*	*			trans	36.3	124.7	132.3	-71.5	-48.2	0	0	0	122.6
2086	L	24.9	Very low	23.8	Very low	151 Å²	151	124.9 Å²	124.9	79%	0.791	67%	0.671	S	S	*	*			trans	82.7	122	131.8	-65	169.1	0	0	0	121.6
2087	V	24.9	Very low	23.7	Very low	110 Å²	110	127.3 Å²	127.3	67%	0.667	67%	0.672	S	S	*	*				98.3	119.5	122.1	163.5	0	0	0	0	121.6
2088	E	24.5	Very low	23.6	Very low	181 Å²	181	126.1 Å²	126.1	85%	0.846	68%	0.675	S	S	*	*			trans	88.3	152.5	146	-85.3	162.8	-143.8	0	0	125.1
2089	L	23.1	Very low	23.6	Very low	126 Å²	126	126.8 Å²	126.8	66%	0.66	68%	0.682	S	S	*	*			trans	-85.9	178.6	178	-63.8	169.2	0	0	0	109	N1229	N1229-L2089 WeakPolarHBondContact ND2-CD2 3.07Å
2090	P	25.9	Very low	23.7	Very low	113 Å²	113	123.4 Å²	123.4	73%	0.734	68%	0.677	S	S	*	*			cis	-125.8	170.9	17.5	22.3	4.7	0	0	0	113.7
2091	F	20.7	Very low	23.7	Very low	96 Å²	96	124.1 Å²	124.1	42%	0.421	68%	0.682	S	S	.	*			cis	69.7	144	50	-131.3	-81.8	0	0	0	114.3	N1229	N1229-F2091 WeakPolarHBondContact OD1-CD2 3.18Å; N1229-F2091 VanDerWaalsContact OD1-CE2 3.22Å; N1229-F2091 WeakPolarHBondContact OD1-CE2 3.32Å
2092	N	22.3	Very low	23.6	Very low	121 Å²	121	121.7 Å²	121.7	65%	0.647	68%	0.675	S	S	*	*			trans	66.2	152.9	-177.3	-74.9	-20.2	0	0	0	116.1
2093	Q	22.1	Very low	23.6	Very low	101 Å²	101	123.7 Å²	123.7	47%	0.472	68%	0.681	S	S	.	*			cis	179.2	171.9	-31.6	-130.7	-162.4	3.1	0	0	106.4	Q1232	Q1232-Q2093 VanDerWaalsContact OE1-CG 3.31Å
2094	Q	23.3	Very low	23.6	Very low	163 Å²	163	126.9 Å²	126.9	76%	0.762	68%	0.682	S	S	*	*			trans	67.6	147.3	159.3	-68	160.6	46.5	0	0	116.3
2095	S	21.4	Very low	23.5	Very low	78 Å²	78	125.6 Å²	125.6	55%	0.545	68%	0.679	S	S	.	*			cis	-170.3	-178.4	-18.1	52.8	0	0	0	0	109.5
2096	N	23.5	Very low	23.4	Very low	124 Å²	124	124.6 Å²	124.6	66%	0.663	68%	0.681	S	S	*	*			trans	73.7	100.8	146.4	-66.4	-15.1	0	0	0	119.2
2097	N	23.6	Very low	23.4	Very low	129 Å²	129	124.2 Å²	124.2	69%	0.69	69%	0.685	S	S	*	*				89.1	118.6	124.2	-56.5	-19.9	0	0	0	117.1
2098	V	23.1	Very low	23.4	Very low	122 Å²	122	121.9 Å²	121.9	74%	0.739	68%	0.684	S	S	*	*				76.7	144.9	50.5	178.1	0	0	0	0	111.1
2099	L	24.1	Very low	23.5	Very low	156 Å²	156	119 Å²	119	82%	0.817	68%	0.683	S	S	*	*			trans	83.9	135.4	-172	-51.2	-178.7	0	0	0	113.3
2100	S	23.7	Very low	23.6	Very low	90 Å²	90	117.5 Å²	117.5	63%	0.629	68%	0.683	S	S	*	*			cis	-164.7	164.1	-11.3	47.7	0	0	0	0	111.3
2101	D	23	Very low	23.5	Very low	142 Å²	142	118.4 Å²	118.4	76%	0.759	68%	0.681	S	S	*	*				14.2	144.5	129.2	-42.3	-31.8	0	0	0	118.5
2102	A	24.1	Very low	23.7	Very low	71 Å²	71	121.4 Å²	121.4	59%	0.587	69%	0.693	S	S	*	*			cis	177.7	-155.6	-9.9	0	0	0	0	0	104.8
2103	F	23.3	Very low	23.8	Very low	172 Å²	172	121.7 Å²	121.7	75%	0.754	69%	0.694	S	S	*	*			trans	67.7	158.1	165.3	-54	-81.6	0	0	0	114.6
2104	E	23.8	Very low	23.9	Very low	153 Å²	153	124 Å²	124	72%	0.715	71%	0.705	S	S	*	*			cis	-143.4	130.1	-6	-137	144.7	-160.3	0	0	112
2105	V	23.9	Very low	24	Very low	112 Å²	112	120.9 Å²	120.9	68%	0.679	70%	0.701	S	S	*	*				51.1	102.5	126.5	177.9	0	0	0	0	119.2
2106	S	23	Very low	24.2	Very low	105 Å²	105	123.5 Å²	123.5	73%	0.734	71%	0.705	S	S	*	*				72.9	178	123.2	-53.2	0	0	0	0	121
2107	V	23.9	Very low	24.3	Very low	144 Å²	144	126.5 Å²	126.5	87%	0.873	71%	0.707	S	S	*	*			trans	67.7	86.5	170.6	-159.6	0	0	0	0	114.1
2108	G	25.2	Very low	24.6	Very low	61 Å²	61	127.3 Å²	127.3	63%	0.629	71%	0.71	S	S	*	*			cis	113.4	-162.7	6.9	0	0	0	0	0	112.4
2109	S	26.3	Very low	25	Very low	120 Å²	120	126.8 Å²	126.8	84%	0.839	71%	0.709	S	S	*	*			trans	72.1	142.4	-175.9	95.4	0	0	0	0	114.4
2110	S	24.5	Very low	25.2	Very low	94 Å²	94	122.3 Å²	122.3	66%	0.657	70%	0.701	S	S	*	*			cis	-176.5	165.8	-16.9	-120.2	0	0	0	0	110.9
2111	I	24.9	Very low	25.3	Very low	133 Å²	133	126.6 Å²	126.6	68%	0.682	71%	0.708	S	S	*	*			trans	64.2	121.4	138.7	-70.2	170.2	0	0	0	116.2
2112	K	25.1	Very low	25.5	Very low	158 Å²	158	126.6 Å²	126.6	69%	0.687	70%	0.703	S	S	*	*			cis	-172	141.7	14.9	-109.6	176.7	-170.4	171.6	0	110.6
2113	L	24.4	Very low	25.6	Very low	128 Å²	128	128.7 Å²	128.7	67%	0.67	71%	0.705	S	S	*	*			trans	65.7	158.5	136.5	-53.8	173.3	0	0	0	117.9
2114	Q	24.2	Very low	25.7	Very low	148 Å²	148	126.2 Å²	126.2	69%	0.692	70%	0.7	S	S	*	*			cis	-167.5	159	-11.3	-121.6	168.6	-29.2	0	0	110.9
2115	S	25.3	Very low	25.8	Very low	98 Å²	98	127.8 Å²	127.8	69%	0.685	70%	0.704	S	S	*	*			trans	63.2	161.1	138.5	75.5	0	0	0	0	120
2116	E	25	Very low	26.3	Very low	134 Å²	134	127.4 Å²	127.4	63%	0.626	70%	0.704	S	S	*	*			cis	-174.5	161.9	-21.2	-104.3	-171.2	106.9	0	0	105.7
2117	R	25.1	Very low	26.3	Very low	186 Å²	186	126.9 Å²	126.9	70%	0.702	71%	0.706	S	S	*	*			cis	-140.2	176.4	6.9	-97.3	138.4	-164.2	167.4	19.6	106.5
2118	I	30.8	Very low	26.4	Very low	146 Å²	146	124.6 Å²	124.6	75%	0.749	70%	0.697	S	S	*	*			cis	67.1	147.8	38.5	-60.6	170.6	0	0	0	111.7
2119	P	31.7	Very low	26.4	Very low	112 Å²	112	131.1 Å²	131.1	73%	0.727	71%	0.711	S	S	*	*			cis	-113.9	-178.4	-5.6	25.2	-2.9	0	0	0	113.4
2120	G	27.2	Very low	26.3	Very low	62 Å²	62	128.8 Å²	128.8	64%	0.639	71%	0.706	S	S	*	*			cis	141.2	158.9	-8.8	0	0	0	0	0	114.6
2121	F	26.4	Very low	26.3	Very low	179 Å²	179	132.1 Å²	132.1	79%	0.785	72%	0.715	S	S	*	*			trans	68.1	151.9	166.9	-60	-73.4	0	0	0	118
2122	H	27.2	Very low	26.3	Very low	142 Å²	142	131 Å²	131	66%	0.657	72%	0.719	S	S	*	*			cis	-153.2	147.7	0.4	-122.2	-47.2	0	0	0	109.9
2123	N	26.4	Very low	26.7	Very low	115 Å²	115	128.4 Å²	128.4	62%	0.615	72%	0.718	S	S	*	*				37.7	149.4	128.9	-69.3	48.5	0	0	0	122
2124	D	25.4	Very low	26.6	Very low	121 Å²	121	129.3 Å²	129.3	65%	0.647	73%	0.729	S	S	*	*			cis	-159.6	171.6	7.5	-108.4	-25.1	0	0	0	114.4
2125	F	25.6	Very low	26.6	Very low	185 Å²	185	125.3 Å²	125.3	81%	0.811	73%	0.728	S	S	*	*			trans	-28.4	176.7	159.2	-73.6	-106.7	0	0	0	119.5
2126	P	34.1	Very low	26.5	Very low	105 Å²	105	128.8 Å²	128.8	68%	0.682	74%	0.738	S	S	*	*			cis	-144.8	-167.4	-44.5	42.8	-24.7	0	0	0	114.3
2127	A	24.3	Very low	26.3	Very low	93 Å²	93	127.9 Å²	127.9	77%	0.769	75%	0.746	S	S	*	*			trans	66	163.5	152	0	0	0	0	0	118.2
2128	S	26	Very low	26.6	Very low	97 Å²	97	124.8 Å²	124.8	68%	0.678	75%	0.752	S	S	*	*			cis	-164.3	163.6	-21.5	46.1	0	0	0	0	110.3
2129	E	23.9	Very low	26.4	Very low	198 Å²	198	123.7 Å²	123.7	93%	0.925	75%	0.754	S	S	*	*			trans	65.5	168.8	165.8	-61.4	178.5	-179.7	0	0	118.4
2130	G	25.2	Very low	26.2	Very low	71 Å²	71	127.4 Å²	127.4	73%	0.732	76%	0.759	S	S	*	*			trans	122.5	53.7	156.2	0	0	0	0	0	121.6
2131	L	25.1	Very low	26.1	Very low	164 Å²	164	134.9 Å²	134.9	86%	0.859	77%	0.769	S	S	*	*			trans	36	108.8	141.3	-71	160.4	0	0	0	121.9
2132	S	23.5	Very low	25.9	Very low	109 Å²	109	132.5 Å²	132.5	76%	0.762	77%	0.77	S	S	*	*				76.2	-177.8	129.2	85.3	0	0	0	0	118.2
2133	P	34	Very low	25.9	Very low	104 Å²	104	129.1 Å²	129.1	68%	0.675	77%	0.773	S	S	*	*				-135	-175.1	-114	35.3	-11.5	0	0	0	117.6
2134	T	23.1	Very low	26.7	Very low	146 Å²	146	129.5 Å²	129.5	90%	0.896	78%	0.781	S	S	*	*			trans	78.4	164.1	169	79.9	0	0	0	0	116.9
2135	G	23.6	Very low	26.9	Very low	65 Å²	65	128.7 Å²	128.7	67%	0.67	78%	0.783	S	S	*	*			trans	112.5	61.1	158.4	0	0	0	0	0	120.1
2136	L	22.7	Very low	27	Very low	171 Å²	171	125.7 Å²	125.7	90%	0.895	78%	0.78	S	S	*	*			trans	57.3	163.3	137.1	-77.6	160.1	0	0	0	123
2137	S	21.9	Very low	26.7	Very low	114 Å²	114	126.2 Å²	126.2	80%	0.797	78%	0.781	S	S	*	*			trans	72.1	138.1	160.3	68.8	0	0	0	0	119.8
2138	C	30.7	Very low	26.8	Very low	121 Å²	121	127.9 Å²	127.9	82%	0.818	78%	0.782	S	S	*	*			trans	-81.3	166.7	166.5	-53.9	0	0	0	0	109.5
2139	P	25.7	Very low	27	Very low	123 Å²	123	128.6 Å²	128.6	80%	0.799	78%	0.783	S	S	*	*				-140.2	165.2	107.4	38.4	-28.3	0	0	0	115.1
2140	K	27.9	Very low	27.2	Very low	191 Å²	191	125.1 Å²	125.1	83%	0.83	78%	0.777	S	S	*	*			trans	-75.8	137.5	157.8	-52.9	170.5	-179.5	178.5	0	108.5
2141	Y	24.6	Very low	27.2	Very low	218 Å²	218	124.4 Å²	124.4	86%	0.855	77%	0.77	S	S	*	*			trans	-168.4	116.1	145.1	-107.1	-83.9	0	0	0	104.7
2142	V	24	Very low	27	Very low	130 Å²	130	123.7 Å²	123.7	79%	0.788	77%	0.766	S	S	*	*				63.9	110.5	62.9	178.2	0	0	0	0	111.4
2143	G	26.1	Very low	26.9	Very low	70 Å²	70	126.2 Å²	126.2	72%	0.722	77%	0.765	S	S	*	*			trans	153.3	94.7	172.8	0	0	0	0	0	115.7
2144	P	42.6	Very low	26.3	Very low	123 Å²	123	127.5 Å²	127.5	80%	0.799	77%	0.765	S	S	*	*			trans	-81.4	-175.4	156.7	40.1	-36.9	0	0	0	109.6
2145	P	29.4	Very low	26.3	Very low	105 Å²	105	128 Å²	128	68%	0.682	76%	0.758	S	S	*	*			cis	-144	-157.5	14.9	42.8	-20.8	0	0	0	115.9
2146	T	27.8	Very low	26.4	Very low	121 Å²	121	130.2 Å²	130.2	74%	0.742	75%	0.754	S	S	*	*			trans	79.1	143.5	153.2	44.7	0	0	0	0	120.8
2147	T	27.8	Very low	26.4	Very low	116 Å²	116	130.6 Å²	130.6	71%	0.712	74%	0.744	S	S	*	*			cis	-96.3	-112.3	6.6	-46.2	0	0	0	0	113.3
2148	T	26.8	Very low	26.6	Very low	128 Å²	128	132.9 Å²	132.9	79%	0.785	74%	0.736	S	S	*	*			cis	-149.5	157.4	-0.4	-54.5	0	0	0	0	109
2149	T	31.4	Very low	26.3	Very low	113 Å²	113	134.7 Å²	134.7	69%	0.693	73%	0.732	S	S	*	*			trans	-147.8	162.9	-164.7	20.5	0	0	0	0	110.8
2150	P	26.6	Very low	26.4	Very low	124 Å²	124	138.5 Å²	138.5	81%	0.805	74%	0.736	S	S	*	*			cis	-116.4	173.9	25.7	42.8	-33.5	0	0	0	115.2
2151	G	26.2	Very low	26.5	Very low	57 Å²	57	133 Å²	133	59%	0.588	72%	0.722	S	S	*	*			cis	114.9	145.8	-8.7	0	0	0	0	0	116.4
2152	I	21.3	Very low	26.7	Very low	149 Å²	149	128.4 Å²	128.4	76%	0.764	72%	0.719	S	S	*	*			trans	78.6	140.6	161.5	-55.6	170.3	0	0	0	117.5
2153	H	20.8	Very low	27	Very low	161 Å²	161	127.5 Å²	127.5	75%	0.745	71%	0.71	S	S	*	*			trans	67.4	135.3	170.8	-71.7	-21.9	0	0	0	117.7
2154	L	22	Very low	27.2	Very low	131 Å²	131	128.5 Å²	128.5	69%	0.686	70%	0.697	S	S	*	*				71.2	117.7	54	-87	167.5	0	0	0	114
2155	Q	23	Very low	26.5	Very low	158 Å²	158	128 Å²	128	74%	0.738	69%	0.694	S	S	*	*			trans	61.8	130.5	150.6	-70.7	-178.4	-0.8	0	0	120.6
2156	N	25	Very low	26.4	Very low	111 Å²	111	130.5 Å²	130.5	59%	0.594	69%	0.694	S	S	*	*			trans	73	126.7	153.7	-64.8	-47.7	0	0	0	117.1
2157	R	23.5	Very low	26.1	Very low	179 Å²	179	133.7 Å²	133.7	68%	0.675	69%	0.693	S	S	*	*				60.5	130.4	96.7	-49.5	178	-158.5	-162.2	-0.7	112.5
2158	Y	25.2	Very low	25.8	Very low	162 Å²	162	135.4 Å²	135.4	64%	0.635	70%	0.697	S	S	*	*			cis	-152.2	152.7	36.1	-89	-71.6	0	0	0	114.2
2159	Q	24.5	Very low	25.6	Very low	159 Å²	159	136.1 Å²	136.1	74%	0.743	70%	0.695	S	S	*	*			trans	23	143.7	131.5	-65.4	165.1	-17.2	0	0	119.7
2160	K	27.4	Very low	25.2	Very low	203 Å²	203	135.6 Å²	135.6	88%	0.883	70%	0.696	S	S	*	*			cis	-136.7	154.2	40.3	-67.4	177.7	176.9	-179.7	0	115.5
2161	S	29.9	Very low	25.3	Very low	76 Å²	76	134.5 Å²	134.5	53%	0.531	69%	0.689	S	S	.	*			trans	-88.2	-177.9	160.8	52.8	0	0	0	0	110.3	D2163	S2161-D2163 VanDerWaalsContact CB-OD1 3.26Å; S2161-D2163 WeakPolarHBondContact CB-OD1 3.31Å; S2161-D2163 PolarHBondContact OG-OD1 2.92Å
2162	P	30.3	Very low	25.1	Very low	120 Å²	120	137.1 Å²	137.1	78%	0.779	69%	0.694	S	S	*	*				-130.4	166.1	69.2	39.1	-28	0	0	0	114.7
2163	D	30	Very low	25.4	Very low	112 Å²	112	136.4 Å²	136.4	60%	0.599	70%	0.697	S	S	*	*			cis	-163.4	123.5	-32.2	-94.6	-25	0	0	0	107.2	S2161	S2161-D2163 VanDerWaalsContact CB-OD1 3.26Å; S2161-D2163 WeakPolarHBondContact CB-OD1 3.31Å; S2161-D2163 PolarHBondContact OG-OD1 2.92Å
2164	I	28.9	Very low	25.7	Very low	91 Å²	91	134 Å²	134	47%	0.467	70%	0.695	S	S	.	*				75.9	132	90.6	-72.5	-179.3	0	0	0	112.8	F2166	I2164-F2166 HydrophobicContact CD1-CE1 4.44Å; I2164-F2166 HydrophobicContact CG2-CD1 4Å; I2164-F2166 HydrophobicContact CG2-CE1 3.52Å; I2164-F2166 HydrophobicContact CG2-CZ 3.9Å
2165	P	27.9	Very low	25.7	Very low	112 Å²	112	135.4 Å²	135.4	73%	0.727	70%	0.703	S	S	*	*			cis	-123.9	180	27.9	32.2	-12.8	0	0	0	115.4
2166	F	27.4	Very low	25.9	Very low	157 Å²	157	133.8 Å²	133.8	69%	0.689	70%	0.703	S	S	*	*			cis	-162.7	166.6	-25.6	-87.2	-32.5	0	0	0	106.2	I2164	I2164-F2166 HydrophobicContact CD1-CE1 4.44Å; I2164-F2166 HydrophobicContact CG2-CD1 4Å; I2164-F2166 HydrophobicContact CG2-CE1 3.52Å; I2164-F2166 HydrophobicContact CG2-CZ 3.9Å
2167	R	22.1	Very low	25.9	Very low	188 Å²	188	135.9 Å²	135.9	71%	0.709	71%	0.709	S	S	*	*			cis	80.1	141.5	23.6	-52.2	173.2	-168.2	142.5	8.2	111.9
2168	L	20.9	Very low	26.3	Very low	153 Å²	153	135 Å²	135	80%	0.801	71%	0.712	S	S	*	*			cis	-136	158.7	14.5	-71.2	164.2	0	0	0	109.2
2169	L	22.3	Very low	26.7	Very low	142 Å²	142	132.1 Å²	132.1	74%	0.743	71%	0.714	S	S	*	*			cis	87.9	105.4	48.7	-124	-179.8	0	0	0	115.8
2170	S	23.8	Very low	26.8	Very low	103 Å²	103	130.6 Å²	130.6	72%	0.72	72%	0.718	S	S	*	*			trans	71.1	178.3	151.1	72.3	0	0	0	0	120.1
2171	P	28.7	Very low	26.8	Very low	100 Å²	100	129.3 Å²	129.3	65%	0.649	72%	0.715	S	S	*	*				-138.8	174.6	-61.6	39.4	-22.7	0	0	0	116.1
2172	T	22.5	Very low	26.7	Very low	113 Å²	113	130.3 Å²	130.3	69%	0.693	72%	0.72	S	S	*	*			trans	50.1	117.4	150.9	49.3	0	0	0	0	122.4
2173	T	27.2	Very low	26.4	Very low	134 Å²	134	133.8 Å²	133.8	82%	0.822	73%	0.728	S	S	*	*			trans	65	159.6	149.2	56.2	0	0	0	0	119.5
2174	P	27.6	Very low	26.3	Very low	109 Å²	109	135.5 Å²	135.5	71%	0.708	74%	0.735	S	S	*	*			cis	-127	177.3	-14.2	38.2	-21.6	0	0	0	115.1
2175	L	22.4	Very low	26.2	Very low	162 Å²	162	136.6 Å²	136.6	85%	0.848	75%	0.748	S	S	*	*			trans	23	124.8	147.2	-65.2	161.7	0	0	0	121.2
2176	V	26.1	Very low	26.3	Very low	124 Å²	124	137.7 Å²	137.7	75%	0.752	75%	0.753	S	S	*	*				178.9	107.9	110	153.6	0	0	0	0	112.4
2177	Q	26	Very low	26.1	Very low	154 Å²	154	139.3 Å²	139.3	72%	0.72	76%	0.763	S	S	*	*			trans	45.5	113.7	139.6	-68.5	171.5	-42.5	0	0	124.9
2178	H	31.6	Very low	26.3	Very low	160 Å²	160	135 Å²	135	74%	0.741	76%	0.761	S	S	*	*			trans	71.4	147.7	135.7	-63.2	-58.7	0	0	0	122.5
2179	P	34	Very low	26.5	Very low	102 Å²	102	134.7 Å²	134.7	66%	0.662	76%	0.759	S	S	*	*			cis	-137.6	130.6	-23.1	34.5	-15.5	0	0	0	115.8
2180	P	25.6	Very low	26.8	Very low	128 Å²	128	132.8 Å²	132.8	83%	0.831	76%	0.755	S	S	*	*			trans	-115.7	138.4	152.4	35.1	-25.6	0	0	0	111.9
2181	E	27.9	Very low	26.7	Very low	175 Å²	175	135.3 Å²	135.3	82%	0.818	76%	0.76	S	S	*	*			trans	-137	155.8	-178.2	-60.4	-166.9	155.2	0	0	111
2182	P	27.2	Very low	26.6	Very low	98 Å²	98	133.7 Å²	133.7	64%	0.636	76%	0.762	S	S	*	*				-133.8	155.5	-72.8	29.2	-9.8	0	0	0	113.9	I2184	P2182-I2184 HydrophobicContact CB-CG1 4.49Å; P2182-I2184 HydrophobicContact CG-CD1 4.45Å; P2182-I2184 HydrophobicContact CG-CG1 4.14Å
2183	M	24.6	Very low	26.6	Very low	192 Å²	192	133.1 Å²	133.1	95%	0.946	76%	0.762	S	S	*	*			trans	-78.9	123.2	152.7	-70.9	-168.9	74.9	0	0	108.8
2184	I	26.9	Very low	26.5	Very low	148 Å²	148	134.4 Å²	134.4	76%	0.759	76%	0.759	S	S	*	*			trans	-99.7	127.9	176.3	-61.7	179.9	0	0	0	109.1	P2182	P2182-I2184 HydrophobicContact CB-CG1 4.49Å; P2182-I2184 HydrophobicContact CG-CD1 4.45Å; P2182-I2184 HydrophobicContact CG-CG1 4.14Å
2185	P	27.1	Very low	26.3	Very low	114 Å²	114	133.8 Å²	133.8	74%	0.74	75%	0.749	S	S	*	*			trans	-93.2	178.9	-174.6	38.1	-37.7	0	0	0	114.1
2186	V	31.4	Very low	26.3	Very low	135 Å²	135	129.2 Å²	129.2	82%	0.818	73%	0.725	S	S	*	*			trans	-39.3	129	170.1	178.3	0	0	0	0	114.5
2187	Q	22.2	Very low	26.2	Very low	192 Å²	192	127.3 Å²	127.3	90%	0.897	71%	0.71	S	S	*	*			trans	-162	164.9	133.6	-108.6	159.6	27.8	0	0	113
2188	S	27.5	Very low	26.1	Very low	96 Å²	96	124.6 Å²	124.6	67%	0.671	71%	0.705	S	S	*	*			trans	-106.8	-175.8	-157.9	50.6	0	0	0	0	114.5
2189	I	24.7	Very low	25.7	Very low	147 Å²	147	121.5 Å²	121.5	75%	0.754	71%	0.707	S	S	*	*			trans	86	142.6	169	-53.3	155.7	0	0	0	113.9
2190	P	28	Very low	25.2	Very low	102 Å²	102	127.1 Å²	127.1	66%	0.662	72%	0.715	S	S	*	*			cis	-119.5	149.3	-3.9	22.7	-1.2	0	0	0	116.5
2191	D	22.7	Very low	25.2	Very low	157 Å²	157	128 Å²	128	84%	0.84	71%	0.708	S	S	*	*				33.4	140.9	119.1	-38.5	-40.9	0	0	0	122.5
2192	G	25.9	Very low	25.1	Very low	66 Å²	66	125.8 Å²	125.8	68%	0.68	71%	0.706	S	S	*	*			trans	135.3	48.8	166.8	0	0	0	0	0	115.4
2193	S	23.2	Very low	25	Very low	101 Å²	101	128.5 Å²	128.5	71%	0.706	71%	0.714	S	S	*	*				74.6	127.4	76.8	87.8	0	0	0	0	115.3
2194	H	23.9	Very low	25.1	Very low	161 Å²	161	123.6 Å²	123.6	75%	0.745	70%	0.704	S	S	*	*			trans	71.3	143	167.2	-60.8	-79	0	0	0	122
2195	L	22.9	Very low	25	Very low	96 Å²	96	122 Å²	122	50%	0.503	71%	0.706	S	S	.	*			trans	27.9	129.3	130.1	-48.8	174.1	0	0	0	117.3	I2265	L2195-I2265 HydrophobicContact CD2-CD1 4.36Å
2196	N	23.3	Very low	25	Very low	66 Å²	66	122.5 Å²	122.5	35%	0.353	71%	0.707	S	S	.	*			cis	-167.3	-171.7	23.3	-117.7	-3.3	0	0	0	112.7	N2263 R2264	N2196-N2263 PolarHBondContact OD1-OD1 3.47Å; N2196-R2264 VanDerWaalsContact CA-CZ 3.49Å; N2196-R2264 PolarHBondContact O-NH2 2.76Å; N2196-R2264 WeakPolarHBondContact OD1-CD 3.43Å
2197	L	23.8	Very low	24.7	Very low	83 Å²	83	120.2 Å²	120.2	44%	0.435	71%	0.711	S	S	.	*			trans	46.3	122.3	145.8	-65.7	164.3	0	0	0	123.5	T2262	L2197-T2262 VanDerWaalsContact CD2-CB 3.49Å; L2197-T2262 HydrophobicContact CD2-CG2 3.53Å; L2197-T2262 WeakPolarHBondContact CD2-OG1 3.14Å
2198	T	23.5	Very low	24.8	Very low	98 Å²	98	116 Å²	116	60%	0.601	69%	0.691	S	S	*	*			trans	52.3	113.2	139.9	55	0	0	0	0	124.6	T2262	T2198-T2262 HydrophobicContact CG2-CG2 3.7Å
2199	A	24.4	Very low	24.7	Very low	95 Å²	95	116.8 Å²	116.8	79%	0.785	69%	0.694	S	S	*	*				83	147.6	118.1	0	0	0	0	0	123.8
2200	R	23.8	Very low	24.6	Very low	220 Å²	220	113 Å²	113	83%	0.83	68%	0.677	S	S	*	*			trans	80.6	111.6	158.5	-80.3	-176.6	159.1	-170.7	-6.1	121.9
2201	Q	25.7	Very low	24.3	Very low	147 Å²	147	114 Å²	114	69%	0.687	67%	0.671	S	S	*	*				79.8	164.3	129.5	-68.5	174.5	-95	0	0	120.2
2202	V	25.4	Very low	24.4	Very low	127 Å²	127	112.6 Å²	112.6	77%	0.77	67%	0.668	S	S	*	*			trans	66.7	89.2	-179.1	-163.9	0	0	0	0	113.4
2203	L	25.1	Very low	24.3	Very low	156 Å²	156	116.6 Å²	116.6	82%	0.817	67%	0.673	S	S	*	*				80.8	125.9	53.3	-67.4	163.3	0	0	0	115.8
2204	A	25.2	Very low	24.3	Very low	88 Å²	88	116.3 Å²	116.3	73%	0.727	67%	0.667	S	S	*	*			trans	79.5	138.3	139.4	0	0	0	0	0	120.9
2205	S	25.6	Very low	24.4	Very low	115 Å²	115	119.4 Å²	119.4	80%	0.804	67%	0.672	S	S	*	*			trans	67.3	133.2	170.1	79.9	0	0	0	0	115.3
2206	T	27.2	Very low	24.4	Very low	125 Å²	125	119.1 Å²	119.1	77%	0.767	67%	0.668	S	S	*	*			cis	-136.1	55.4	20.2	42.3	0	0	0	0	113.8	Q2208	T2206-Q2208 PolarHBondContact O-N 3.24Å
2207	G	25.1	Very low	24.5	Very low	86 Å²	86	123.1 Å²	123.1	89%	0.887	69%	0.686	S	S	*	*			trans	-69.2	91.8	169.2	0	0	0	0	0	112.5
2208	Q	24.7	Very low	24.7	Very low	104 Å²	104	126.2 Å²	126.2	49%	0.486	70%	0.696	S	S	.	*			trans	-94.9	139.9	172.3	-81.6	-160.3	-142.6	0	0	111.5	K732 T2206	K732-Q2208 VanDerWaalsContact NZ-OE1 3.12Å; T2206-Q2208 PolarHBondContact O-N 3.24Å
2209	P	24.9	Very low	25	Very low	113 Å²	113	126.5 Å²	126.5	73%	0.734	70%	0.698	S	S	*	*			trans	-118.6	109	-171.4	36.3	-20.6	0	0	0	113.7
2210	V	22.5	Very low	25.2	Very low	66 Å²	66	127 Å²	127	40%	0.4	69%	0.693	S	S	.	*			trans	-154.8	143.7	178	-126.9	0	0	0	0	108.3	E379	E379-V2210 HydrophobicContact CB-CG1 4.23Å
2211	F	22.4	Very low	25.5	Very low	124 Å²	124	121.1 Å²	121.1	54%	0.544	69%	0.686	S	S	.	*			cis	-115.9	156.5	4.5	-79.9	-117.9	0	0	0	112.1	E379	E379-F2211 HydrophobicContact CB-CE1 3.79Å; E379-F2211 HydrophobicContact CB-CE2 3.92Å; E379-F2211 HydrophobicContact CB-CZ 3.32Å; E379-F2211 HydrophobicContact CG-CZ 4.4Å; E379-F2211 WeakPolarHBondContact O-CE1 3.32Å; E379-F2211 WeakPolarHBondContact OE2-CE2 3.36Å
2212	V	23.2	Very low	25.7	Very low	127 Å²	127	117.8 Å²	117.8	77%	0.77	69%	0.691	S	S	*	*			trans	-94.7	118.6	159.4	174.6	0	0	0	0	107.6	T2214	V2212-T2214 PolarHBondContact O-N 2.85Å
2213	I	24.7	Very low	26	Very low	151 Å²	151	121 Å²	121	77%	0.774	70%	0.697	S	S	*	*			trans	-78.9	102.5	176.4	-60.9	177.1	0	0	0	109	R2215	I2213-R2215 PolarHBondContact O-N 3.31Å
2214	T	23.2	Very low	26	Very low	95 Å²	95	118.3 Å²	118.3	58%	0.583	68%	0.683	S	S	*	*			trans	-77.2	91.6	171.6	37.5	0	0	0	0	110.4	V2212 Q2216	V2212-T2214 PolarHBondContact O-N 2.85Å; T2214-Q2216 VanDerWaalsContact C-N 3.3Å; T2214-Q2216 PolarHBondContact O-N 3.46Å
2215	R	25.1	Very low	26.1	Very low	225 Å²	225	125.6 Å²	125.6	85%	0.849	69%	0.693	S	S	*	*			trans	-67	89.3	166.9	-99.9	-170.6	169.6	-166.6	-4.1	109.9	I2213	I2213-R2215 PolarHBondContact O-N 3.31Å
2216	Q	24.2	Very low	26.1	Very low	90 Å²	90	125.8 Å²	125.8	42%	0.421	68%	0.681	S	S	.	*			trans	-65.2	129.3	165.4	-61.7	-175.7	-0.2	0	0	109.2	E384 T2214	E384-Q2216 PolarHBondContact OE1-NE2 3.42Å; T2214-Q2216 VanDerWaalsContact C-N 3.3Å; T2214-Q2216 PolarHBondContact O-N 3.46Å
2217	M	25.4	Very low	26	Very low	151 Å²	151	125 Å²	125	74%	0.744	67%	0.669	S	S	*	*			trans	-106.1	107.9	165.2	-80.3	-160.2	174.1	0	0	109.3	T2219	M2217-T2219 PolarHBondContact O-N 3Å; M2217-T2219 VanDerWaalsContact O-N 3.16Å
2218	K	26.7	Very low	25.8	Very low	147 Å²	147	126 Å²	126	64%	0.639	65%	0.646	S	S	*	*			trans	-69.3	105.4	171.1	-79.1	179.5	173	171.2	0	110.8	E387	E387-K2218 WeakPolarHBondContact OE1-CE 3.37Å; E387-K2218 IonicContact OE1-NZ 2.81Å; E387-K2218 PolarHBondContact OE1-NZ 3.17Å
2219	T	30.6	Very low	25.9	Very low	104 Å²	104	126.1 Å²	126.1	64%	0.638	65%	0.645	S	S	*	*			trans	-79.1	159.8	151.5	43.6	0	0	0	0	109.7	M2217 S2221	M2217-T2219 PolarHBondContact O-N 3Å; M2217-T2219 VanDerWaalsContact O-N 3.16Å; T2219-S2221 PolarHBondContact O-N 3.12Å
2220	P	29.5	Very low	25.7	Very low	105 Å²	105	125.6 Å²	125.6	68%	0.682	64%	0.64	S	S	*	*	S	Bend	trans	-82.2	47.6	-171	34.6	-37.3	0	0	0	114.6
2221	S	28.4	Very low	25.9	Very low	98 Å²	98	130.1 Å²	130.1	69%	0.685	66%	0.657	S	S	*	*	S	Bend	trans	-165.5	122.4	167.8	56.7	0	0	0	0	108.7	T2219	T2219-S2221 PolarHBondContact O-N 3.12Å
2222	G	30.5	Very low	25.9	Very low	76 Å²	76	129.9 Å²	129.9	78%	0.784	67%	0.667	S	S	*	*			trans	-95.5	117.3	-168.6	0	0	0	0	0	114.5
2223	E	31.3	Very low	25.9	Very low	194 Å²	194	131 Å²	131	91%	0.907	67%	0.674	S	S	*	*			trans	-156.9	155.8	157	-121.1	174.6	-131.3	0	0	109.5
2224	I	26.5	Very low	26	Very low	100 Å²	100	127.9 Å²	127.9	51%	0.513	67%	0.671	S	S	.	*			trans	-136.5	118.1	-170.9	-57.2	176.3	0	0	0	111
2225	Y	25.6	Very low	26	Very low	241 Å²	241	128 Å²	128	95%	0.945	67%	0.673	S	S	*	*			trans	-128.9	135.6	160.6	-112.8	-99.2	0	0	0	111.8
2226	Q	25.6	Very low	26	Very low	120 Å²	120	120.3 Å²	120.3	56%	0.561	65%	0.652	S	S	*	*			trans	-102.6	122.9	-169.3	-67.2	-174.6	-3.1	0	0	113	R2228	Q2226-R2228 HydrophobicContact CB-CG 4.25Å; Q2226-R2228 VanDerWaalsContact O-CZ 3.3Å; Q2226-R2228 PolarHBondContact O-NH1 3.37Å
2227	Q	26.1	Very low	26	Very low	108 Å²	108	117.3 Å²	117.3	51%	0.505	64%	0.641	S	S	.	*			trans	-129.3	-1.8	163	-114.9	-179	9.8	0	0	116.3	C1982 L1983	C1982-Q2227 CarbonylContact C-O 3.51Å; C1982-Q2227 VanDerWaalsContact C-O 3.31Å; C1982-Q2227 VanDerWaalsContact CA-O 3.24Å; C1982-Q2227 WeakPolarHBondContact CA-O 3.25Å; L1983-Q2227 CarbonylContact C-O 3.49Å; L1983-Q2227 VanDerWaalsContact C-O 3.26Å; L1983-Q2227 VanDerWaalsContact CA-O 3.29Å; L1983-Q2227 WeakPolarHBondContact CA-O 3.45Å; L1983-Q2227 PolarHBondContact N-O 3.24Å; L1983-Q2227 WeakPolarHBondContact O-CB 3.28Å; L1983-Q2227 WeakPolarHBondContact O-CG 3.01Å; L1983-Q2227 PolarHBondContact O-OE1 3.19Å; L1983-Q2227 VanDerWaalsContact O-OE1 3.05Å
2228	R	21.7	Very low	25.9	Very low	108 Å²	108	114.4 Å²	114.4	41%	0.408	63%	0.625	S	S	.	*			trans	54.8	-172.5	155.4	-37.6	110.8	178.4	154.1	5.8	117	A1981 C1982 L1983 Q2226	A1981-R2228 WeakPolarHBondContact O-CD 3.45Å; A1981-R2228 PolarHBondContact O-NH1 2.75Å; C1982-R2228 HydrophobicContact CB-CB 3.94Å; L1983-R2228 WeakPolarHBondContact CA-O 2.95Å; Q2226-R2228 HydrophobicContact CB-CG 4.25Å; Q2226-R2228 VanDerWaalsContact O-CZ 3.3Å; Q2226-R2228 PolarHBondContact O-NH1 3.37Å
2229	F	24.8	Very low	25.7	Very low	105 Å²	105	114.3 Å²	114.3	46%	0.461	63%	0.625	S	S	.	*			trans	-157.2	175.9	170.6	-168.1	61	0	0	0	110.9	L1983 H2231 Y2244	L1983-F2229 HydrophobicContact CD2-CD1 4.24Å; L1983-F2229 HydrophobicContact CG-CD1 4.22Å; L1983-F2229 HydrophobicContact CG-CE1 4.48Å; F2229-H2231 HydrophobicContact CE2-CB 4.13Å; F2229-H2231 AromaticContact CE2-CD2 3.83Å; F2229-H2231 AromaticContact CZ-CD2 4Å; F2229-Y2244 WeakPolarHBondContact CE1-OH 3.4Å
2230	T	22.5	Very low	25.3	Very low	103 Å²	103	112 Å²	112	63%	0.632	61%	0.611	S	S	*	*			trans	-139.5	117.2	166.6	56.4	0	0	0	0	112.9	C1982	C1982-T2230 HydrophobicContact CB-CG2 4.4Å
2231	H	25.5	Very low	25.1	Very low	161 Å²	161	117.2 Å²	117.2	75%	0.745	62%	0.617	S	S	*	*			trans	-155	154.6	155.1	-108	-84.9	0	0	0	109.4	F2229	F2229-H2231 HydrophobicContact CE2-CB 4.13Å; F2229-H2231 AromaticContact CE2-CD2 3.83Å; F2229-H2231 AromaticContact CZ-CD2 4Å
2232	P	23.7	Very low	24.8	Very low	118 Å²	118	118.7 Å²	118.7	77%	0.766	62%	0.615	S	S	*	*			trans	-91.8	172.2	-168.3	36.9	-35.8	0	0	0	114.8
2233	V	23.1	Very low	24.5	Very low	151 Å²	151	118 Å²	118	92%	0.915	60%	0.595	S	S	*	*			trans	-84.1	138.4	-169.9	175.8	0	0	0	0	114
2234	A	25.3	Very low	24.1	Very low	86 Å²	86	113.3 Å²	113.3	71%	0.711	57%	0.57	S	S	*	*			trans	-148.2	157.9	152.6	0	0	0	0	0	108.1
2235	P	24.8	Very low	23.9	Very low	97 Å²	97	110.1 Å²	110.1	63%	0.63	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-74.4	169	-167.6	28.5	-34.1	0	0	0	115.3
2236	P	24.1	Very low	23.8	Very low	63 Å²	63	101.4 Å²	101.4	41%	0.409	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-76.5	169.8	-173.1	29.5	-35.7	0	0	0	114.5	K80 Q2238	K80-P2236 HydrophobicContact CD-CB 4.35Å; K80-P2236 HydrophobicContact CD-CG 4.15Å; K80-P2236 WeakPolarHBondContact CD-O 3.45Å; P2236-Q2238 HydrophobicContact CB-CG 4.48Å
2237	P	24.2	Very low	23.6	Very low	28 Å²	28	101.5 Å²	101.5	18%	0.182	52%	0.521	C	S	.	.	P	Polyproline II helix	cis	-98.3	151.4	-0.9	34.3	-22.8	0	0	0	112.5	E73 E76 W77 K80	E73-P2237 HydrophobicContact CB-CB 4.25Å; E76-P2237 HydrophobicContact CB-CG 4.37Å; W77-P2237 HydrophobicContact CB-CG 3.62Å; W77-P2237 HydrophobicContact CG-CG 4.27Å; K80-P2237 HydrophobicContact CD-CG 4.2Å
2238	Q	23.3	Very low	23.8	Very low	89 Å²	89	105.6 Å²	105.6	42%	0.416	54%	0.537	S	S	.	.				67.3	141.8	63.2	-45.5	142.7	-135.4	0	0	113.2	S69 E73 P2236	S69-Q2238 PolarHBondContact OG-O 2.96Å; E73-Q2238 HydrophobicContact CG-CB 4.41Å; E73-Q2238 WeakPolarHBondContact OE1-CB 3.49Å; E73-Q2238 PolarHBondContact OE1-NE2 2.69Å; P2236-Q2238 HydrophobicContact CB-CG 4.48Å
2239	F	22.6	Very low	23.9	Very low	146 Å²	146	105.8 Å²	105.8	64%	0.64	55%	0.552	S	S	*	*			cis	-151	-77	2.4	-150.5	-36	0	0	0	115	G68 S69 E73	G68-F2239 CarbonylContact O-C 3.31Å; G68-F2239 VanDerWaalsContact O-C 3.29Å; S69-F2239 PolarHBondContact OG-N 2.8Å; E73-F2239 WeakPolarHBondContact OE1-CD2 3.18Å; E73-F2239 VanDerWaalsContact OE2-CB 3.23Å; E73-F2239 WeakPolarHBondContact OE2-CB 3.46Å
2240	T	22.9	Very low	23.7	Very low	54 Å²	54	105.6 Å²	105.6	33%	0.331	56%	0.564	S	S	.	*			trans	-108.6	91.3	-146.2	-49.1	0	0	0	0	117	G68	G68-T2240 CarbonylContact C-O 3.51Å; G68-T2240 CarbonylContact O-C 3.58Å; G68-T2240 WeakPolarHBondContact O-CA 3.48Å; G68-T2240 PolarHBondContact O-N 3.46Å
2241	R	24.2	Very low	23.8	Very low	216 Å²	216	104 Å²	104	82%	0.815	57%	0.568	S	S	*	*				-146.6	58.8	127.8	-116.8	169.1	-174.5	179.8	1.7	113.1	G68	G68-R2241 PolarHBondContact O-N 3.3Å
2242	M	22.3	Very low	23.6	Very low	129 Å²	129	104.1 Å²	104.1	64%	0.635	57%	0.572	S	S	*	*			trans	-9.3	113.7	159.5	-161.7	168.6	81.3	0	0	117.8	R251	R251-M2242 VanDerWaalsContact CZ-O 3.24Å; R251-M2242 PolarHBondContact NH1-O 2.75Å; R251-M2242 PolarHBondContact NH2-O 3.1Å
2243	V	23.9	Very low	23.5	Very low	60 Å²	60	101.7 Å²	101.7	36%	0.364	56%	0.562	S	S	.	*			trans	-172.9	137.7	166.7	-93.1	0	0	0	0	110.6	C244 D247 R251	C244-V2243 HydrophobicContact CB-CB 4.23Å; C244-V2243 HydrophobicContact CB-CG1 4.17Å; C244-V2243 HydrophobicContact CB-CG2 3.95Å; D247-V2243 HydrophobicContact CB-CG1 4.28Å; R251-V2243 VanDerWaalsContact NH2-CA 3.33Å
2244	Y	23.7	Very low	23.4	Very low	96 Å²	96	97.9 Å²	97.9	38%	0.376	54%	0.543	S	S	.	.			cis	88.1	152.5	-3.3	-101.7	-93.6	0	0	0	118.7	K243 D247 F2229	K243-Y2244 CarbonylContact C-O 3.43Å; K243-Y2244 WeakPolarHBondContact CG-O 3.36Å; D247-Y2244 VanDerWaalsContact CB-O 3.26Å; D247-Y2244 WeakPolarHBondContact CB-O 3.1Å; D247-Y2244 VanDerWaalsContact CG-C 3.42Å; D247-Y2244 VanDerWaalsContact CG-CB 3.46Å; D247-Y2244 VanDerWaalsContact OD2-CB 3.25Å; D247-Y2244 WeakPolarHBondContact OD2-CB 3.42Å; D247-Y2244 WeakPolarHBondContact OD2-CD1 3.45Å; F2229-Y2244 WeakPolarHBondContact CE1-OH 3.4Å
2245	R	22.2	Very low	23.3	Very low	33 Å²	33	101 Å²	101	13%	0.125	54%	0.536	C	S	.	.			trans	30.1	92.8	-162.2	-71.2	-155.4	-168.7	138.8	-3	124.5	K243 R246 D247 S249 E250	K243-R2245 CarbonylContact C-O 3.13Å; K243-R2245 VanDerWaalsContact CA-C 3.48Å; K243-R2245 WeakPolarHBondContact CA-O 3.48Å; K243-R2245 CarbonylContact O-C 3.48Å; R246-R2245 HydrophobicContact CB-CB 3.85Å; R246-R2245 VanDerWaalsContact CB-O 3.27Å; R246-R2245 WeakPolarHBondContact CB-O 3.25Å; R246-R2245 HydrophobicContact CG-CB 4.4Å; R246-R2245 VanDerWaalsContact CG-CD 3.47Å; R246-R2245 VanDerWaalsContact O-CD 3.25Å; R246-R2245 WeakPolarHBondContact O-CD 3.22Å; R246-R2245 PolarHBondContact O-NH1 3.21Å; D247-R2245 HydrophobicContact CB-CB 3.55Å; D247-R2245 HydrophobicContact CB-CG 3.95Å; D247-R2245 VanDerWaalsContact CB-N 3.33Å; D247-R2245 WeakPolarHBondContact OD2-CA 3.46Å; D247-R2245 WeakPolarHBondContact OD2-CB 3.3Å; D247-R2245 WeakPolarHBondContact OD2-CG 3.46Å; D247-R2245 PolarHBondContact OD2-N 3.32Å; S249-R2245 VanDerWaalsContact C-NH1 3.33Å; S249-R2245 PolarHBondContact OG-NH1 2.75Å; E250-R2245 VanDerWaalsContact CA-CZ 3.5Å; E250-R2245 HydrophobicContact CB-CG 3.87Å; E250-R2245 VanDerWaalsContact CB-CZ 3.48Å; E250-R2245 HydrophobicContact CG-CG 4.31Å; E250-R2245 IonicContact OE1-CZ 3.65Å; E250-R2245 IonicContact OE1-NE 2.75Å; E250-R2245 PolarHBondContact OE1-NE 3.21Å; E250-R2245 IonicContact OE1-NH2 2.81Å; E250-R2245 PolarHBondContact OE1-NH2 2.75Å; E250-R2245 WeakPolarHBondContact OE2-CG 3.06Å; E250-R2245 IonicContact OE2-NE 2.83Å; E250-R2245 PolarHBondContact OE2-NE 2.73Å
2246	L	22.5	Very low	23.2	Very low	59 Å²	59	102.3 Å²	102.3	31%	0.309	54%	0.542	S	S	.	.				-175.6	89.3	126.8	-107.7	169.1	0	0	0	102.2	L242 R246	L242-L2246 HydrophobicContact CB-CD1 3.81Å; L242-L2246 HydrophobicContact CD2-CD1 4.38Å; R246-L2246 HydrophobicContact CB-CD1 4.23Å; R246-L2246 HydrophobicContact CB-CG 4.12Å; R246-L2246 HydrophobicContact CG-CG 4.48Å; R246-L2246 VanDerWaalsContact NH1-CD2 3.31Å
2247	Q	22.9	Very low	23.1	Very low	121 Å²	121	104.1 Å²	104.1	57%	0.565	56%	0.556	S	S	*	*				60.2	129.3	52	-134.8	-169.6	36	0	0	110.8	R246	R246-Q2247 VanDerWaalsContact CZ-OE1 3.23Å; R246-Q2247 VanDerWaalsContact NH2-OE1 3.09Å
2248	K	29.7	Very low	23	Very low	194 Å²	194	108.5 Å²	108.5	84%	0.843	58%	0.583	S	S	*	*			trans	-57.5	156.7	-165.9	-53.7	163.8	-175.4	167.2	0	111.7
2249	P	23.9	Very low	23	Very low	112 Å²	112	111.2 Å²	111.2	73%	0.727	60%	0.6	S	S	*	*				-125.5	173	87.4	38.3	-35	0	0	0	114.5
2250	S	21.1	Very low	23	Very low	102 Å²	102	110.2 Å²	110.2	71%	0.713	60%	0.6	S	S	*	*			trans	35.1	124.2	155.3	57.8	0	0	0	0	119.5
2251	G	23.3	Very low	23	Very low	68 Å²	68	114 Å²	114	70%	0.701	61%	0.614	S	S	*	*			cis	90.3	163.4	30.6	0	0	0	0	0	111
2252	I	21.5	Very low	22.9	Very low	164 Å²	164	107.2 Å²	107.2	84%	0.841	60%	0.597	S	S	*	*			trans	66.3	85.4	-166.7	-51.4	171.3	0	0	0	109.6
2253	A	21.7	Very low	23	Very low	68 Å²	68	105.4 Å²	105.4	56%	0.562	59%	0.59	S	S	*	*				54.7	134.9	66.4	0	0	0	0	0	111.7
2254	S	21.8	Very low	22.9	Very low	71 Å²	71	109 Å²	109	50%	0.497	60%	0.597	S	S	.	*			cis	178.5	179.5	45.7	53	0	0	0	0	109.5
2255	R	22.5	Very low	22.9	Very low	150 Å²	150	109.9 Å²	109.9	57%	0.566	61%	0.607	S	S	*	*			trans	73.4	122.7	166.3	-61.7	143.9	177.8	-86.1	-17.5	114.8	L1889	L1889-R2255 PolarHBondContact O-NH1 2.84Å; L1889-R2255 PolarHBondContact O-NH2 3.09Å
2256	T	23.1	Very low	23	Very low	125 Å²	125	117.4 Å²	117.4	77%	0.767	64%	0.635	S	S	*	*			cis	70.9	82	30.9	86.7	0	0	0	0	115.9
2257	S	22.1	Very low	23.6	Very low	101 Å²	101	122 Å²	122	71%	0.706	66%	0.655	S	S	*	*			trans	-172.6	99.7	137.7	51.6	0	0	0	0	107.8
2258	T	21.8	Very low	23.8	Very low	121 Å²	121	120.6 Å²	120.6	74%	0.742	66%	0.656	S	S	*	*				63.2	136.2	89.2	61.9	0	0	0	0	114.9
2259	L	22.6	Very low	23.4	Very low	146 Å²	146	114.9 Å²	114.9	76%	0.764	63%	0.633	S	S	*	*			trans	92.9	124.7	168.6	-55.6	162.1	0	0	0	116
2260	L	23.2	Very low	23.7	Very low	124 Å²	124	111.4 Å²	111.4	65%	0.649	61%	0.608	S	S	*	*				45.9	144.7	123.5	-47	-179.9	0	0	0	119.6
2261	E	22.5	Very low	23.9	Very low	135 Å²	135	108.5 Å²	108.5	63%	0.631	59%	0.586	S	S	*	*			cis	-160	110.2	-5.9	-113.5	158.6	161.8	0	0	106.2
2262	T	23	Very low	23.9	Very low	73 Å²	73	106.7 Å²	106.7	45%	0.448	56%	0.562	S	S	.	*				88	153.5	89.5	58.7	0	0	0	0	116.8	L2197 T2198	L2197-T2262 VanDerWaalsContact CD2-CB 3.49Å; L2197-T2262 HydrophobicContact CD2-CG2 3.53Å; L2197-T2262 WeakPolarHBondContact CD2-OG1 3.14Å; T2198-T2262 HydrophobicContact CG2-CG2 3.7Å
2263	N	23.4	Very low	24.1	Very low	91 Å²	91	103.7 Å²	103.7	49%	0.487	54%	0.544	S	S	.	.			trans	75.5	119.3	174.6	-51.6	-31	0	0	0	114.2	N2196	N2196-N2263 PolarHBondContact OD1-OD1 3.47Å
2264	R	23.1	Very low	24.4	Very low	135 Å²	135	104.8 Å²	104.8	51%	0.509	55%	0.548	S	S	.	.			cis	93	122.4	39	-79.7	-175.8	176.1	-147.8	12.3	112.4	N2196	N2196-R2264 VanDerWaalsContact CA-CZ 3.49Å; N2196-R2264 PolarHBondContact O-NH2 2.76Å; N2196-R2264 WeakPolarHBondContact OD1-CD 3.43Å
2265	I	23.8	Very low	24.4	Very low	114 Å²	114	106.1 Å²	106.1	59%	0.585	56%	0.557	S	S	*	*			trans	72	132.7	138.8	-66.6	171	0	0	0	115.9	L2195	L2195-I2265 HydrophobicContact CD2-CD1 4.36Å
2266	R	24.7	Very low	24.7	Very low	192 Å²	192	106.2 Å²	106.2	73%	0.725	57%	0.567	S	S	*	*			cis	-166.3	151.3	-4.8	-114.9	179.4	-172.4	179.4	-0.5	109.4
2267	Q	34.1	Very low	24.8	Very low	156 Å²	156	105.6 Å²	105.6	73%	0.729	56%	0.563	S	S	*	*			trans	60	176.4	148	-68.7	167.8	-42.1	0	0	118.2
2268	P	26.9	Very low	25.2	Very low	90 Å²	90	106.1 Å²	106.1	58%	0.584	57%	0.566	S	S	*	*			cis	-115.7	172.5	-38.8	38.9	-27.9	0	0	0	111.6	R206	R206-P2268 PolarHBondContact NH1-O 3Å
2269	Q	20.5	Very low	25.2	Very low	75 Å²	75	111.1 Å²	111.1	35%	0.35	57%	0.571	S	S	.	*			trans	60.3	122.7	168.8	-54.8	179.7	5.4	0	0	115.9	R206 Y211 P2271	R206-Q2269 HydrophobicContact CB-CB 3.98Å; R206-Q2269 VanDerWaalsContact CD-O 3.26Å; R206-Q2269 WeakPolarHBondContact CD-O 3.22Å; R206-Q2269 PolarHBondContact NH1-O 3.26Å; Y211-Q2269 HydrophobicContact CE2-CB 4.16Å; Y211-Q2269 HydrophobicContact CE2-CG 3.94Å; Y211-Q2269 WeakPolarHBondContact OH-CG 3.5Å; Y211-Q2269 PolarHBondContact OH-NE2 2.98Å; Q2269-P2271 VanDerWaalsContact O-CD 3.3Å; Q2269-P2271 WeakPolarHBondContact O-CD 3.1Å
2270	L	30.9	Very low	25.5	Very low	39 Å²	39	109.8 Å²	109.8	20%	0.204	57%	0.571	C	S	.	*				30.2	95	106.9	-70.5	156	0	0	0	114.7	R206 D210 Y211 A214 E215	R206-L2270 WeakPolarHBondContact CD-O 3.33Å; D210-L2270 WeakPolarHBondContact CB-O 3.25Å; D210-L2270 CarbonylContact O-C 3.59Å; D210-L2270 VanDerWaalsContact O-C 3.24Å; D210-L2270 VanDerWaalsContact O-CA 3.32Å; D210-L2270 WeakPolarHBondContact O-CA 3.3Å; D210-L2270 WeakPolarHBondContact O-CB 3.14Å; Y211-L2270 HydrophobicContact CD1-CD1 3.4Å; Y211-L2270 VanDerWaalsContact CD1-CD1 3.4Å; Y211-L2270 HydrophobicContact CD2-CB 3.88Å; Y211-L2270 HydrophobicContact CD2-CD1 4.07Å; Y211-L2270 HydrophobicContact CE1-CD1 3.62Å; Y211-L2270 HydrophobicContact CE2-CB 4.23Å; Y211-L2270 HydrophobicContact CE2-CD1 4.27Å; Y211-L2270 HydrophobicContact CG-CB 4.16Å; Y211-L2270 HydrophobicContact CG-CD1 3.64Å; Y211-L2270 HydrophobicContact CG-CG 4.34Å; A214-L2270 VanDerWaalsContact CB-CA 3.44Å; A214-L2270 HydrophobicContact CB-CB 4.21Å; A214-L2270 HydrophobicContact CB-CD2 3.47Å; A214-L2270 VanDerWaalsContact CB-CD2 3.47Å; A214-L2270 HydrophobicContact CB-CG 3.82Å; E215-L2270 HydrophobicContact CG-CD2 4.19Å
2271	P	24.9	Very low	25.5	Very low	41 Å²	41	109.6 Å²	109.6	27%	0.266	58%	0.575	S	S	.	*				-146.3	178	110.1	24.1	-1.2	0	0	0	116.1	R206 D210 Q2269	R206-P2271 HydrophobicContact CG-CG 4.14Å; D210-P2271 HydrophobicContact CB-CB 3.99Å; D210-P2271 WeakPolarHBondContact O-CA 3.42Å; D210-P2271 WeakPolarHBondContact OD1-CB 3.49Å; D210-P2271 WeakPolarHBondContact OD1-CG 3.31Å; Q2269-P2271 VanDerWaalsContact O-CD 3.3Å; Q2269-P2271 WeakPolarHBondContact O-CD 3.1Å
2272	T	24.4	Very low	25.5	Very low	30 Å²	30	109 Å²	109	18%	0.184	58%	0.58	C	S	.	*			cis	120.8	127.8	-3.8	99.8	0	0	0	0	117.4	S209 D210 F213	S209-T2272 VanDerWaalsContact C-CB 3.47Å; S209-T2272 WeakPolarHBondContact O-CB 3.14Å; S209-T2272 WeakPolarHBondContact O-CG2 3.13Å; D210-T2272 WeakPolarHBondContact CA-OG1 3.38Å; D210-T2272 PolarHBondContact N-OG1 3.09Å; D210-T2272 VanDerWaalsContact N-OG1 3.16Å; F213-T2272 VanDerWaalsContact CB-CB 3.47Å; F213-T2272 HydrophobicContact CB-CG2 3.52Å; F213-T2272 HydrophobicContact CD1-CG2 4.3Å; F213-T2272 HydrophobicContact CD2-CG2 3.26Å; F213-T2272 HydrophobicContact CE2-CG2 3.86Å; F213-T2272 VanDerWaalsContact CG-CA 3.46Å; F213-T2272 HydrophobicContact CG-CG2 3.51Å
2273	E	25	Very low	25.5	Very low	100 Å²	100	112.9 Å²	112.9	47%	0.467	60%	0.598	S	S	.	*			trans	42.9	114.7	145.2	-85.6	156	-142.6	0	0	115.5	F213	F213-E2273 HydrophobicContact CE2-CG 3.8Å; F213-E2273 WeakPolarHBondContact CE2-OE1 3.49Å; F213-E2273 HydrophobicContact CZ-CG 3.91Å
2274	S	27.5	Very low	25.4	Very low	92 Å²	92	112.4 Å²	112.4	64%	0.643	60%	0.601	S	S	*	*			cis	177.5	-174.9	38	46.5	0	0	0	0	108.6
2275	S	22.8	Very low	25.4	Very low	98 Å²	98	113.2 Å²	113.2	69%	0.685	62%	0.616	S	S	*	*	S	Bend		173	165.4	64.7	51.1	0	0	0	0	109.8
2276	I	27.3	Very low	25.8	Very low	152 Å²	152	112.8 Å²	112.8	78%	0.779	62%	0.623	S	S	*	*	S	Bend	cis	-140.1	134.1	22.8	-61.4	165.5	0	0	0	110.4
2277	T	26.4	Very low	26	Very low	113 Å²	113	109.2 Å²	109.2	69%	0.693	63%	0.625	S	S	*	*			cis	-135.9	-60.1	-20.2	16.9	0	0	0	0	113.4
2278	C	29.3	Very low	25.6	Very low	112 Å²	112	107.8 Å²	107.8	76%	0.757	63%	0.627	S	S	*	*			cis	-141.2	-164.5	-3.7	-154.5	0	0	0	0	111.5
2279	R	23.6	Very low	25.4	Very low	225 Å²	225	108.2 Å²	108.2	85%	0.849	64%	0.638	S	S	*	*			trans	-153.5	171.1	-174.9	-66	174.9	170.2	166.4	-5.3	111.3
2280	P	28.3	Very low	25.6	Very low	118 Å²	118	107.7 Å²	107.7	77%	0.766	65%	0.653	S	S	*	*			cis	-110.9	169.2	-21.2	12.4	12.2	0	0	0	111
2281	T	22.7	Very low	25.4	Very low	120 Å²	120	112 Å²	112	74%	0.736	68%	0.681	S	S	*	*			cis	82.4	107.3	42.9	-35.6	0	0	0	0	115.4
2282	V	22.2	Very low	25.3	Very low	122 Å²	122	117.3 Å²	117.3	74%	0.739	71%	0.707	S	S	*	*			trans	86.3	141.3	140.8	105.8	0	0	0	0	122.4
2283	L	22.9	Very low	25.4	Very low	155 Å²	155	121.2 Å²	121.2	81%	0.812	73%	0.73	S	S	*	*			trans	62.6	158.3	165.1	-63	169.7	0	0	0	117.8
2284	S	22.8	Very low	25.4	Very low	81 Å²	81	122.7 Å²	122.7	57%	0.566	74%	0.738	S	S	*	*			cis	-167.5	160.7	-33.4	56.4	0	0	0	0	110.8
2285	N	22.4	Very low	25.3	Very low	153 Å²	153	128 Å²	128	82%	0.818	75%	0.745	S	S	*	*			trans	66.7	142.5	158.2	-57.7	-12.8	0	0	0	120.6
2286	S	33.3	Very low	25.6	Very low	104 Å²	104	129 Å²	129	73%	0.727	75%	0.748	S	S	*	*			trans	-64.4	149.8	162.3	52.8	0	0	0	0	112.3
2287	P	28.1	Very low	25.5	Very low	118 Å²	118	125.2 Å²	125.2	77%	0.766	74%	0.74	S	S	*	*				-127.6	167.7	80.8	6.1	17.9	0	0	0	112.7
2288	T	24.6	Very low	25.4	Very low	125 Å²	125	125.8 Å²	125.8	77%	0.767	74%	0.743	S	S	*	*			cis	82.9	115.6	42.8	-43.8	0	0	0	0	115.1
2289	A	23.8	Very low	25.2	Very low	100 Å²	100	128.8 Å²	128.8	83%	0.826	74%	0.743	S	S	*	*			trans	66.2	166.2	164.2	0	0	0	0	0	119
2290	G	24.6	Very low	25.3	Very low	64 Å²	64	122.8 Å²	122.8	66%	0.66	73%	0.732	S	S	*	*			trans	85.9	102.9	-176.2	0	0	0	0	0	112.1
2291	T	26.8	Very low	25	Very low	130 Å²	130	123.6 Å²	123.6	80%	0.798	73%	0.728	S	S	*	*			cis	67.1	128.6	23.6	-36.6	0	0	0	0	113.5
2292	L	23.2	Very low	25	Very low	152 Å²	152	124 Å²	124	80%	0.796	73%	0.726	S	S	*	*			trans	68.2	111.2	178.2	-66.7	154.7	0	0	0	114.9
2293	V	26.5	Very low	25.2	Very low	111 Å²	111	121.6 Å²	121.6	67%	0.673	72%	0.719	S	S	*	*				96.9	160.3	64.5	150.3	0	0	0	0	111.6
2294	M	24	Very low	25.2	Very low	132 Å²	132	121.2 Å²	121.2	65%	0.65	72%	0.718	S	S	*	*			trans	84.7	137	-168.2	-52	-74.4	108.7	0	0	112.8
2295	R	26	Very low	25.4	Very low	204 Å²	204	123.4 Å²	123.4	77%	0.77	73%	0.728	S	S	*	*			cis	170.4	171.3	-22.7	-117.4	-177	-169.1	154.2	-6.3	106
2296	P	29.6	Very low	25.7	Very low	118 Å²	118	119.8 Å²	119.8	77%	0.766	71%	0.714	S	S	*	*				-98.9	-144.1	-58	28.7	-6.6	0	0	0	106.6
2297	A	24.3	Very low	25.6	Very low	72 Å²	72	120.4 Å²	120.4	60%	0.595	72%	0.716	S	S	*	*			cis	-150.8	148.1	0.3	0	0	0	0	0	107.1
2298	T	24.9	Very low	25.5	Very low	125 Å²	125	120.9 Å²	120.9	77%	0.767	71%	0.712	S	S	*	*			cis	55.5	63.1	45.4	73.8	0	0	0	0	114.7
2299	K	24	Very low	25.7	Very low	175 Å²	175	120.5 Å²	120.5	76%	0.761	71%	0.711	S	S	*	*			trans	-165.1	124.6	148.4	-104	152.6	-171.8	-177.9	0	106.9
2300	T	26.3	Very low	25.8	Very low	99 Å²	99	119 Å²	119	61%	0.607	71%	0.706	S	S	*	*			cis	49.6	139.1	37.1	72.9	0	0	0	0	113.1
2301	I	22.7	Very low	25.9	Very low	135 Å²	135	122.6 Å²	122.6	69%	0.692	71%	0.709	S	S	*	*			trans	69.7	118.5	-167.9	-45.4	161.1	0	0	0	110.9
2302	N	22.3	Very low	25.7	Very low	128 Å²	128	123.5 Å²	123.5	68%	0.684	71%	0.705	S	S	*	*			cis	-151.6	156.8	-11.2	-109.3	-3.4	0	0	0	106
2303	A	26.1	Very low	25.7	Very low	73 Å²	73	122.6 Å²	122.6	60%	0.603	70%	0.701	S	S	*	*				42.6	133.9	81.2	0	0	0	0	0	115
2304	N	23.3	Very low	25.5	Very low	146 Å²	146	125.1 Å²	125.1	78%	0.781	71%	0.707	S	S	*	*			trans	70.2	141.2	-178.6	-34.4	-40.6	0	0	0	112.9
2305	V	26	Very low	25.5	Very low	128 Å²	128	122.6 Å²	122.6	78%	0.776	71%	0.707	S	S	*	*			cis	-129.5	126.4	12.9	-167.3	0	0	0	0	106.1
2306	S	28.6	Very low	25.4	Very low	77 Å²	77	119.2 Å²	119.2	54%	0.538	71%	0.709	S	S	.	*				58.4	146.3	73.1	161.3	0	0	0	0	112.6	D2308	S2306-D2308 WeakPolarHBondContact CB-OD2 3.31Å; S2306-D2308 PolarHBondContact OG-OD2 3.03Å
2307	P	31	Very low	25.1	Very low	116 Å²	116	119 Å²	119	75%	0.753	71%	0.711	S	S	*	*			cis	-101	151.6	9.8	5.9	18	0	0	0	114.3
2308	D	26	Very low	25.2	Very low	129 Å²	129	121 Å²	121	69%	0.69	72%	0.715	S	S	*	*				70.2	152.1	56.9	-52.3	-57	0	0	0	113.8	S2306	S2306-D2308 WeakPolarHBondContact CB-OD2 3.31Å; S2306-D2308 PolarHBondContact OG-OD2 3.03Å
2309	P	29.1	Very low	25.3	Very low	116 Å²	116	122.2 Å²	122.2	75%	0.753	71%	0.712	S	S	*	*			cis	-118.9	160.5	-20.4	37.7	-23.1	0	0	0	111.6
2310	G	26.1	Very low	25.5	Very low	70 Å²	70	120 Å²	120	72%	0.722	70%	0.704	S	S	*	*				94.6	168.2	86.9	0	0	0	0	0	112.1
2311	L	26.1	Very low	25.5	Very low	138 Å²	138	123.2 Å²	123.2	72%	0.723	71%	0.71	S	S	*	*			cis	-152.6	162.3	-6.2	-143.6	78.8	0	0	0	109.4
2312	Q	23.5	Very low	25.9	Very low	149 Å²	149	119.5 Å²	119.5	70%	0.696	70%	0.7	S	S	*	*			trans	-7.3	131.5	144.2	-71.8	145	-13.5	0	0	115.1
2313	D	23.7	Very low	26.1	Very low	133 Å²	133	120.3 Å²	120.3	71%	0.711	70%	0.699	S	S	*	*				-170.8	147.2	64.5	-104.4	-28.2	0	0	0	115.5
2314	M	22.5	Very low	26.2	Very low	164 Å²	164	121.8 Å²	121.8	81%	0.808	70%	0.703	S	S	*	*				46.8	122.7	124.7	-54.8	-83.2	-167.9	0	0	123.3
2315	A	24.2	Very low	26.3	Very low	79 Å²	79	116.9 Å²	116.9	65%	0.653	68%	0.679	S	S	*	*				63.1	134.3	121.4	0	0	0	0	0	123.6
2316	T	23.8	Very low	26.4	Very low	133 Å²	133	119.6 Å²	119.6	82%	0.816	68%	0.675	S	S	*	*			trans	74.8	140.5	147.5	50.4	0	0	0	0	122.1
2317	S	23.1	Very low	26.4	Very low	115 Å²	115	123.3 Å²	123.3	80%	0.804	68%	0.682	S	S	*	*			trans	72.2	155.2	162.4	-63.4	0	0	0	0	119.3
2318	V	25.8	Very low	26.2	Very low	112 Å²	112	120.4 Å²	120.4	68%	0.679	66%	0.664	S	S	*	*			cis	-169.1	139.2	-44.6	121.3	0	0	0	0	109.4
2319	Q	26.4	Very low	26.2	Very low	152 Å²	152	118.2 Å²	118.2	71%	0.71	66%	0.664	S	S	*	*			trans	65.8	144.6	160.6	-78	170.1	-21	0	0	124.1
2320	H	28.7	Very low	26	Very low	127 Å²	127	120.3 Å²	120.3	59%	0.588	67%	0.669	S	S	*	*			trans	72.6	101.4	151.2	-79.1	-69.3	0	0	0	126.2	S1853	S1853-H2320 WeakPolarHBondContact CA-O 3.44Å; S1853-H2320 WeakPolarHBondContact CB-O 3.46Å
2321	F	27.2	Very low	25.9	Very low	167 Å²	167	120.7 Å²	120.7	73%	0.732	67%	0.673	S	S	*	*				74.6	124.6	118.5	-101.4	-107.8	0	0	0	126.2	D1852 S1853	D1852-F2321 CarbonylContact C-O 2.98Å; D1852-F2321 WeakPolarHBondContact CB-O 3.22Å; D1852-F2321 CarbonylContact O-C 3.57Å; D1852-F2321 VanDerWaalsContact O-C 3.28Å; S1853-F2321 VanDerWaalsContact N-C 3.31Å; S1853-F2321 PolarHBondContact N-O 3.43Å
2322	A	29.4	Very low	25.8	Very low	57 Å²	57	121.2 Å²	121.2	47%	0.471	68%	0.675	S	S	.	*			trans	88.7	89	140.8	0	0	0	0	0	126.6	Y1851 D1852	Y1851-A2322 CarbonylContact C-O 3.52Å; D1852-A2322 VanDerWaalsContact N-C 3.31Å; D1852-A2322 PolarHBondContact N-O 3.49Å; D1852-A2322 CarbonylContact O-C 3.28Å; D1852-A2322 WeakPolarHBondContact O-CA 3.33Å; D1852-A2322 PolarHBondContact O-N 2.87Å
2323	Q	26.6	Very low	25.7	Very low	145 Å²	145	122.5 Å²	122.5	68%	0.678	68%	0.678	S	S	*	*			trans	117.7	155.7	133.2	-67.5	-162.8	-6.9	0	0	123.6	R1849 D1852	R1849-Q2323 PolarHBondContact NH1-O 3.42Å; D1852-Q2323 PolarHBondContact O-N 2.85Å
2324	P	29.6	Very low	25.6	Very low	104 Å²	104	119.7 Å²	119.7	68%	0.675	67%	0.668	S	S	*	*			trans	-134.8	169.5	-171	44	-25.7	0	0	0	118.3
2325	P	25.4	Very low	25.8	Very low	43 Å²	43	114.4 Å²	114.4	28%	0.279	65%	0.65	S	S	.	*			trans	-157.1	179.4	-170.8	43.3	-20.9	0	0	0	120.5	K1848 R1849	K1848-P2325 HydrophobicContact CB-CB 4.48Å; K1848-P2325 HydrophobicContact CD-CG 4.36Å; K1848-P2325 WeakPolarHBondContact CE-O 3.33Å; K1848-P2325 HydrophobicContact CG-CB 3.63Å; K1848-P2325 HydrophobicContact CG-CG 3.52Å; R1849-P2325 VanDerWaalsContact CA-CG 3.44Å; R1849-P2325 HydrophobicContact CB-CB 4.29Å; R1849-P2325 HydrophobicContact CB-CG 3.59Å; R1849-P2325 HydrophobicContact CG-CG 3.5Å; R1849-P2325 WeakPolarHBondContact O-CB 3.43Å
2326	R	26.7	Very low	25.8	Very low	185 Å²	185	114.1 Å²	114.1	70%	0.698	64%	0.641	S	S	*	*			trans	-113.8	157	-163.4	-63	172.2	163.4	171.5	-7.9	118.7	R1847 K1848	R1847-R2326 CarbonylContact C-O 3.52Å; K1848-R2326 WeakPolarHBondContact CB-O 3.37Å; K1848-R2326 WeakPolarHBondContact CD-O 3.39Å; K1848-R2326 WeakPolarHBondContact CG-O 3.46Å
2327	F	30.1	Very low	25.8	Very low	156 Å²	156	108.6 Å²	108.6	68%	0.684	61%	0.608	S	S	*	*			trans	58.4	164.6	157.1	-64	-56.6	0	0	0	120.9
2328	S	25.5	Very low	25.8	Very low	54 Å²	54	106.8 Å²	106.8	38%	0.378	59%	0.588	S	S	.	*			cis	-153.9	148.2	14.6	64.5	0	0	0	0	114.7	R1847	R1847-S2328 PolarHBondContact NE-OG 3.03Å; R1847-S2328 PolarHBondContact NH2-OG 2.87Å
2329	A	27.5	Very low	25.9	Very low	84 Å²	84	105.1 Å²	105.1	69%	0.694	58%	0.58	S	S	*	*			trans	42.2	146.4	140.1	0	0	0	0	0	122
2330	N	24	Very low	25.9	Very low	160 Å²	160	101.2 Å²	101.2	86%	0.856	57%	0.566	S	S	*	*			cis	-149.7	143.8	39	-62.7	-54.2	0	0	0	114.4
2331	G	24.4	Very low	25.7	Very low	77 Å²	77	101.3 Å²	101.3	79%	0.794	57%	0.57	S	S	*	*			trans	70.7	146.3	153.3	0	0	0	0	0	117.9
2332	I	23.6	Very low	25.5	Very low	150 Å²	150	103.6 Å²	103.6	77%	0.769	57%	0.573	S	S	*	*			cis	-134.6	153.2	7.4	-68.6	174.3	0	0	0	110.1	K163	K163-I2332 WeakPolarHBondContact CE-O 3.41Å; K163-I2332 PolarHBondContact NZ-O 3.43Å
2333	K	22.6	Very low	25.2	Very low	175 Å²	175	107.1 Å²	107.1	76%	0.761	58%	0.581	S	S	*	*			trans	-47.2	158.8	-177.3	-49	-176.9	179.7	-169.8	0	114.5	K163	K163-K2333 WeakPolarHBondContact CE-O 3.07Å
2334	C	21.6	Very low	25	Very low	74 Å²	74	106.4 Å²	106.4	50%	0.5	58%	0.581	S	S	.	*			cis	-108.2	-159	2.4	-55.3	0	0	0	0	112	V156 V159	V156-C2334 HydrophobicContact CG2-CB 4.42Å; V156-C2334 WeakPolarHBondContact CG2-O 3.31Å; V159-C2334 HydrophobicContact CB-CB 4.09Å; V159-C2334 HydrophobicContact CG1-CB 3.75Å; V159-C2334 HydrophobicContact CG2-CB 3.98Å
2335	A	25.8	Very low	24.7	Very low	53 Å²	53	107.9 Å²	107.9	44%	0.438	58%	0.583	S	S	.	*			trans	-126.3	150.6	-167.5	0	0	0	0	0	116.4	L152 A155 V156	L152-A2335 HydrophobicContact CD2-CB 3.93Å; A155-A2335 CarbonylContact C-O 3.42Å; V156-A2335 VanDerWaalsContact CB-O 3.28Å; V156-A2335 WeakPolarHBondContact CB-O 3.49Å; V156-A2335 VanDerWaalsContact CG2-CA 3.42Å; V156-A2335 VanDerWaalsContact CG2-O 3.31Å; V156-A2335 WeakPolarHBondContact CG2-O 3.23Å; V156-A2335 PolarHBondContact N-O 3.1Å; V156-A2335 VanDerWaalsContact N-O 3.14Å
2336	T	23.4	Very low	24.6	Very low	74 Å²	74	110.9 Å²	110.9	45%	0.454	60%	0.604	S	S	.	*			trans	-93.8	166.7	-169.5	0.1	0	0	0	0	112.8	L152 V156	L152-T2336 CarbonylContact O-C 3.16Å; L152-T2336 VanDerWaalsContact O-C 3.29Å; V156-T2336 HydrophobicContact CB-CG2 3.86Å; V156-T2336 HydrophobicContact CG1-CG2 3.25Å
2337	S	25	Very low	24.4	Very low	17 Å²	17	109 Å²	109	12%	0.119	61%	0.608	C	S	.	*			cis	82.3	123.4	27.8	134.7	0	0	0	0	119.7	L152 K153 D157	L152-S2337 PolarHBondContact O-N 3.03Å; K153-S2337 VanDerWaalsContact O-CB 3.29Å; K153-S2337 WeakPolarHBondContact O-CB 3.42Å; D157-S2337 PolarHBondContact OD1-OG 3.45Å; D157-S2337 VanDerWaalsContact OD1-OG 3.09Å; D157-S2337 PolarHBondContact OD2-OG 2.82Å
2338	I	23.7	Very low	24.2	Very low	76 Å²	76	105.3 Å²	105.3	39%	0.39	61%	0.606	S	S	.	*			trans	67.8	135.7	160.2	-60.7	163.6	0	0	0	115.3	E138	E138-I2338 HydrophobicContact CB-CD1 3.99Å; E138-I2338 WeakPolarHBondContact O-CD1 3.36Å; E138-I2338 VanDerWaalsContact O-CG1 3.28Å; E138-I2338 WeakPolarHBondContact O-CG1 3.48Å
2339	P	27.7	Very low	24.3	Very low	78 Å²	78	109.3 Å²	109.3	51%	0.506	62%	0.623	S	S	.	*			cis	-149.9	-172.8	-33.8	46.1	-26.2	0	0	0	114.5	D140	D140-P2339 WeakPolarHBondContact OD2-CA 3.4Å; D140-P2339 WeakPolarHBondContact OD2-CB 3.32Å
2340	V	25.2	Very low	24.3	Very low	70 Å²	70	113.8 Å²	113.8	42%	0.424	63%	0.627	S	S	.	*				37.3	130.1	128.2	171.5	0	0	0	0	123.1	D140	D140-V2340 WeakPolarHBondContact OD1-CG2 3.41Å
2341	I	24.5	Very low	24.5	Very low	129 Å²	129	111.9 Å²	111.9	66%	0.662	62%	0.622	S	S	*	*			trans	65	118.4	152.5	-72.4	165.1	0	0	0	120.5
2342	R	23	Very low	24.8	Very low	215 Å²	215	113.1 Å²	113.1	81%	0.811	62%	0.618	S	S	*	*				-178.7	114.9	112.7	-90.6	-151.8	176.5	78.6	7.7	111.2
2343	M	22.6	Very low	25.3	Very low	130 Å²	130	111.5 Å²	111.5	64%	0.64	62%	0.617	S	S	*	*				78	111.7	84.5	-75.1	173.3	66.5	0	0	116.2
2344	I	23.2	Very low	25.5	Very low	130 Å²	130	110.2 Å²	110.2	67%	0.667	62%	0.617	S	S	*	*				79.6	133.3	129.2	-64.7	178.7	0	0	0	119.9
2345	N	23	Very low	25.4	Very low	136 Å²	136	115.1 Å²	115.1	73%	0.727	64%	0.636	S	S	*	*			trans	71.4	120.4	166.4	-69.6	-1.3	0	0	0	116.9
2346	C	24	Very low	25.2	Very low	106 Å²	106	123 Å²	123	72%	0.716	66%	0.655	S	S	*	*				72.5	135.6	85.5	-56.9	0	0	0	0	112.3
2347	D	23.3	Very low	25.2	Very low	146 Å²	146	126.9 Å²	126.9	78%	0.781	67%	0.672	S	S	*	*			cis	-124.3	155.6	15.4	-83.7	-62.2	0	0	0	111.4
2348	A	25.6	Very low	25.4	Very low	78 Å²	78	132.1 Å²	132.1	65%	0.645	70%	0.703	S	S	*	*				52.9	145.9	86.7	0	0	0	0	0	114.4
2349	N	27.1	Very low	25.4	Very low	138 Å²	138	134 Å²	134	74%	0.738	72%	0.718	S	S	*	*			cis	-166.8	158.6	33.3	-141.4	-37	0	0	0	113.2
2350	K	27.2	Very low	25.1	Very low	178 Å²	178	134.8 Å²	134.8	77%	0.774	73%	0.725	S	S	*	*			trans	69.7	138.5	168.3	-54.9	173.6	-178	179.2	0	116.2
2351	T	28.8	Very low	25	Very low	120 Å²	120	139.6 Å²	139.6	74%	0.736	74%	0.743	S	S	*	*			cis	-164.3	148.5	-4	11.7	0	0	0	0	106.3
2352	S	29.5	Very low	25	Very low	102 Å²	102	139.8 Å²	139.8	71%	0.713	74%	0.744	S	S	*	*			cis	69.2	124.2	17.6	79.9	0	0	0	0	116.5
2353	P	35	Very low	25.1	Very low	116 Å²	116	135.8 Å²	135.8	75%	0.753	74%	0.739	S	S	*	*				-129.1	-178.4	74.6	43.8	-32.7	0	0	0	112.8
2354	I	25.6	Very low	25.3	Very low	149 Å²	149	137.1 Å²	137.1	76%	0.764	74%	0.743	S	S	*	*	S	Bend	cis	-131.5	111.5	11.3	-52.9	163.1	0	0	0	111.8
2355	I	20.9	Very low	25.5	Very low	176 Å²	176	137 Å²	137	90%	0.903	74%	0.742	S	S	*	*				-133.7	125.5	125.3	-64.5	-173.8	0	0	0	106
2356	R	21.3	Very low	25.8	Very low	219 Å²	219	137.1 Å²	137.1	83%	0.826	74%	0.743	S	S	*	*			trans	-154.4	150.5	174.9	-134.4	-179.3	-169.7	-176.2	3.8	111.1
2357	L	22.3	Very low	26.1	Very low	155 Å²	155	137.8 Å²	137.8	81%	0.812	74%	0.74	S	S	*	*			trans	71.9	94.5	169.1	-57.8	177.3	0	0	0	117.4
2358	V	30.5	Very low	26.3	Very low	128 Å²	128	136.7 Å²	136.7	78%	0.776	73%	0.734	S	S	*	*			trans	-59.2	163.1	135.6	-178.4	0	0	0	0	109.6
2359	T	22.3	Very low	26.3	Very low	116 Å²	116	138.6 Å²	138.6	71%	0.712	74%	0.737	S	S	*	*			trans	98.9	144.5	167	70.8	0	0	0	0	117.4
2360	S	22.6	Very low	26.2	Very low	93 Å²	93	137.1 Å²	137.1	65%	0.65	73%	0.733	S	S	*	*			trans	54.9	109.2	170.5	41.4	0	0	0	0	116.7
2361	E	22.6	Very low	26.2	Very low	172 Å²	172	136.4 Å²	136.4	80%	0.804	73%	0.732	S	S	*	*				71.6	124.9	75.6	-73.6	-178.3	142.2	0	0	114.3
2362	I	24.9	Very low	26	Very low	132 Å²	132	134.6 Å²	134.6	68%	0.677	72%	0.724	S	S	*	*			trans	77.1	106.3	139.8	-64.5	170.4	0	0	0	118.2
2363	N	25.3	Very low	25.7	Very low	131 Å²	131	137.4 Å²	137.4	70%	0.701	73%	0.726	S	S	*	*			trans	92	149.9	141.1	-66.8	-4.7	0	0	0	123.2
2364	H	27.2	Very low	25.2	Very low	159 Å²	159	137.7 Å²	137.7	74%	0.736	72%	0.721	S	S	*	*			trans	71.8	134.1	169.6	-63.1	-75.3	0	0	0	118.2
2365	I	27.1	Very low	25.1	Very low	126 Å²	126	135 Å²	135	65%	0.646	72%	0.716	S	S	*	*			cis	138.8	119.9	-12	-85.8	164.9	0	0	0	107.4
2366	N	29	Very low	25.1	Very low	139 Å²	139	135 Å²	135	74%	0.743	71%	0.712	S	S	*	*			trans	64.7	147.8	164.5	-65.2	13.3	0	0	0	116.1
2367	N	29.9	Very low	25.1	Very low	120 Å²	120	129.4 Å²	129.4	64%	0.642	71%	0.706	S	S	*	*			cis	-149.9	163.8	4.3	-115.9	19.1	0	0	0	107.2
2368	D	27.1	Very low	25.1	Very low	124 Å²	124	127.9 Å²	127.9	66%	0.663	70%	0.704	S	S	*	*			cis	-140.4	146.1	15.3	-101.1	-55.1	0	0	0	112.5
2369	V	26	Very low	24.8	Very low	118 Å²	118	126.5 Å²	126.5	72%	0.715	70%	0.699	S	S	*	*			trans	39.8	128.1	136.7	177.6	0	0	0	0	119.9
2370	T	24.9	Very low	24.8	Very low	106 Å²	106	125.1 Å²	125.1	65%	0.65	70%	0.7	S	S	*	*			cis	-168.1	154.1	-15.8	35.2	0	0	0	0	105
2371	H	27.6	Very low	24.9	Very low	163 Å²	163	127.6 Å²	127.6	76%	0.755	71%	0.705	S	S	*	*			cis	-156.1	156.1	36.9	-118.5	-74.2	0	0	0	111.7
2372	S	24	Very low	24.9	Very low	82 Å²	82	125.9 Å²	125.9	57%	0.573	70%	0.7	S	S	*	*			trans	-23.1	151.2	148.5	55	0	0	0	0	117.5
2373	H	24.1	Very low	24.8	Very low	161 Å²	161	125.6 Å²	125.6	75%	0.745	71%	0.705	S	S	*	*			cis	-173.3	170	-7.1	-120.7	-72.6	0	0	0	108.4
2374	N	23.1	Very low	25.1	Very low	123 Å²	123	124 Å²	124	66%	0.658	70%	0.702	S	S	*	*			trans	46.6	111.5	146.7	-60.1	-10.4	0	0	0	118.9
2375	S	24	Very low	24.9	Very low	93 Å²	93	122 Å²	122	65%	0.65	70%	0.701	S	S	*	*				71.3	164.7	65.5	85.3	0	0	0	0	114.7
2376	Q	22.1	Very low	24.9	Very low	174 Å²	174	121.9 Å²	121.9	81%	0.813	70%	0.702	S	S	*	*			trans	71	92.4	-174.4	-56.1	-177.6	3.6	0	0	112.8
2377	S	20.6	Very low	24.8	Very low	102 Å²	102	120 Å²	120	71%	0.713	70%	0.696	S	S	*	*				83.1	-170.2	83.6	73	0	0	0	0	111.6
2378	V	23	Very low	24.7	Very low	124 Å²	124	120.4 Å²	120.4	75%	0.752	70%	0.702	S	S	*	*			trans	59.1	74.7	179.4	-168.4	0	0	0	0	113.2
2379	S	23	Very low	24.6	Very low	98 Å²	98	124 Å²	124	69%	0.685	71%	0.706	S	S	*	*				71.3	138.5	75.4	80.1	0	0	0	0	116
2380	A	23.1	Very low	24.5	Very low	87 Å²	87	125.4 Å²	125.4	72%	0.719	71%	0.708	S	S	*	*			trans	69.7	169.8	152.6	0	0	0	0	0	118.3
2381	L	23.6	Very low	24.5	Very low	146 Å²	146	121.9 Å²	121.9	76%	0.764	69%	0.693	S	S	*	*			trans	62.9	103.9	173.2	-60.9	129.2	0	0	0	114.9
2382	L	23.2	Very low	24.3	Very low	135 Å²	135	120.2 Å²	120.2	71%	0.707	69%	0.69	S	S	*	*				65.1	113.9	74.6	-72.7	159.5	0	0	0	113
2383	T	24.1	Very low	24.2	Very low	126 Å²	126	119.9 Å²	119.9	77%	0.773	68%	0.684	S	S	*	*			trans	72.6	160.1	141.5	67.4	0	0	0	0	117.9
2384	P	29.8	Very low	24.1	Very low	97 Å²	97	116.2 Å²	116.2	63%	0.63	67%	0.673	S	S	*	*			cis	-139.9	-171.3	-49.9	38.7	-23.4	0	0	0	111.4
2385	T	24.6	Very low	24	Very low	117 Å²	117	118.3 Å²	118.3	72%	0.718	67%	0.672	S	S	*	*			trans	66.8	163.1	150.5	59.2	0	0	0	0	117.4
2386	N	26.5	Very low	24	Very low	125 Å²	125	121 Å²	121	67%	0.668	68%	0.678	S	S	*	*			cis	-150.6	164.8	1.7	-134.1	-19.9	0	0	0	112.6
2387	T	27.1	Very low	24.2	Very low	100 Å²	100	119.7 Å²	119.7	61%	0.613	68%	0.675	S	S	*	*			trans	46.4	126.5	152.1	55.9	0	0	0	0	118.8
2388	V	27.4	Very low	24.7	Very low	128 Å²	128	119.8 Å²	119.8	78%	0.776	67%	0.673	S	S	*	*				-168.2	146	77.7	144.6	0	0	0	0	106.6
2389	R	25.4	Very low	24.7	Very low	198 Å²	198	119.5 Å²	119.5	75%	0.747	67%	0.668	S	S	*	*			cis	171.4	140.7	-16.8	-130	178.4	-175.9	165.8	-1.1	104.6
2390	I	23.6	Very low	24.9	Very low	149 Å²	149	122.1 Å²	122.1	76%	0.764	67%	0.668	S	S	*	*			trans	85.9	115.3	153.4	-58.5	160.1	0	0	0	119.9	R1598	R1598-I2390 PolarHBondContact NH2-O 3.31Å; R1598-I2390 VanDerWaalsContact NH2-O 3.12Å
2391	G	24.8	Very low	25	Very low	32 Å²	32	124.9 Å²	124.9	33%	0.33	67%	0.67	S	S	.	*			trans	104.6	126.6	165.6	0	0	0	0	0	114.9	R1598	R1598-G2391 PolarHBondContact NE-O 3.39Å
2392	N	24.2	Very low	25	Very low	128 Å²	128	120.3 Å²	120.3	68%	0.684	65%	0.65	S	S	*	*			cis	88.9	132.4	14.8	-53	80.1	0	0	0	117.4	I1597 R1598	I1597-N2392 WeakPolarHBondContact CG2-O 3.45Å; R1598-N2392 WeakPolarHBondContact CB-O 3.46Å; R1598-N2392 WeakPolarHBondContact CD-O 3.32Å; R1598-N2392 PolarHBondContact NH1-O 3.11Å
2393	T	21.7	Very low	25.2	Very low	75 Å²	75	115.4 Å²	115.4	46%	0.46	63%	0.625	S	S	.	*			trans	89.2	-161.4	163.3	45.2	0	0	0	0	122.4	I1597 R1598	I1597-T2393 WeakPolarHBondContact CB-OG1 3.3Å; I1597-T2393 WeakPolarHBondContact CG2-OG1 3.5Å; I1597-T2393 CarbonylContact O-C 3.4Å; I1597-T2393 WeakPolarHBondContact O-CA 3.31Å; I1597-T2393 WeakPolarHBondContact O-CB 3.28Å; I1597-T2393 PolarHBondContact O-OG1 3.23Å; R1598-T2393 CarbonylContact C-O 3.54Å; R1598-T2393 CarbonylContact O-C 3.37Å; R1598-T2393 VanDerWaalsContact O-O 3.13Å
2394	V	21.9	Very low	25.1	Very low	84 Å²	84	112 Å²	112	51%	0.509	61%	0.605	S	S	.	*			trans	-139.1	161.3	-148.6	-68.2	0	0	0	0	117	I1597 R1598	I1597-V2394 PolarHBondContact O-N 2.66Å; R1598-V2394 CarbonylContact O-C 3.6Å; R1598-V2394 WeakPolarHBondContact O-CA 3.42Å; R1598-V2394 PolarHBondContact O-N 3.26Å; R1598-V2394 VanDerWaalsContact O-N 3.13Å
2395	R	20.8	Very low	25	Very low	167 Å²	167	112.7 Å²	112.7	63%	0.63	60%	0.604	S	S	*	*			trans	95.4	144.8	164.1	-56.8	-175.4	-168.9	-179.8	5	120.9	R1598 E2082	R1598-R2395 PolarHBondContact O-N 2.87Å; E2082-R2395 IonicContact OE1-CZ 3.63Å; E2082-R2395 IonicContact OE1-NH2 3.21Å; E2082-R2395 PolarHBondContact OE1-NH2 2.87Å
2396	L	23.8	Very low	24.9	Very low	148 Å²	148	112.4 Å²	112.4	78%	0.775	60%	0.602	S	S	*	*			trans	19.5	118.1	145	-77.6	166.4	0	0	0	121.7
2397	I	27	Very low	25	Very low	148 Å²	148	113.8 Å²	113.8	76%	0.759	61%	0.605	S	S	*	*			trans	55.4	-161.8	156.8	-16.4	171.5	0	0	0	110.8
2398	P	30.1	Very low	24.8	Very low	103 Å²	103	113.1 Å²	113.1	67%	0.669	60%	0.601	S	S	*	*			cis	-125.9	172.2	-16.5	44.6	-29.1	0	0	0	115.9
2399	N	23.9	Very low	24.7	Very low	119 Å²	119	109.8 Å²	109.8	64%	0.636	58%	0.578	S	S	*	*			trans	38.8	128.7	135.9	-67.5	25	0	0	0	122.8
2400	H	26.1	Very low	24.6	Very low	152 Å²	152	102.4 Å²	102.4	70%	0.704	55%	0.55	S	S	*	.			trans	68.2	157.9	147.2	-54.3	-162.6	0	0	0	114.3
2401	I	25.5	Very low	24.6	Very low	146 Å²	146	100.3 Å²	100.3	75%	0.749	54%	0.54	S	S	*	.			cis	-117.9	101.9	6.3	-66	166.4	0	0	0	106.3
2402	S	23.6	Very low	24.7	Very low	50 Å²	50	99.7 Å²	99.7	35%	0.35	53%	0.528	S	S	.	.				74.9	140.7	64.3	87.1	0	0	0	0	113.9	K1663	K1663-S2402 PolarHBondContact NZ-O 3.2Å
2403	N	26.5	Very low	24.7	Very low	32 Å²	32	99.4 Å²	99.4	17%	0.171	52%	0.517	C	S	.	.			trans	85.9	129.6	151.8	-50.2	-11.8	0	0	0	116.9	E1662 K1663	E1662-N2403 HydrophobicContact CB-CB 3.5Å; E1662-N2403 VanDerWaalsContact CB-CB 3.5Å; E1662-N2403 WeakPolarHBondContact CB-ND2 3.24Å; E1662-N2403 CarbonylContact O-C 3.45Å; E1662-N2403 PolarHBondContact OE1-ND2 3.15Å; E1662-N2403 PolarHBondContact OE2-ND2 3.4Å; E1662-N2403 PolarHBondContact OE2-OD1 2.65Å; K1663-N2403 HydrophobicContact CB-CB 4.42Å; K1663-N2403 HydrophobicContact CD-CB 4.35Å; K1663-N2403 HydrophobicContact CG-CB 3.35Å; K1663-N2403 PolarHBondContact NZ-O 2.8Å
2404	S	23.7	Very low	24.9	Very low	53 Å²	53	97.9 Å²	97.9	37%	0.371	51%	0.508	S	S	.	.			trans	36.7	148.9	170.6	64.8	0	0	0	0	121.9	E1662 K1663	E1662-S2404 WeakPolarHBondContact O-CA 3.4Å; E1662-S2404 VanDerWaalsContact O-CB 3.24Å; E1662-S2404 WeakPolarHBondContact O-CB 3.2Å; E1662-S2404 PolarHBondContact O-N 2.82Å; K1663-S2404 WeakPolarHBondContact CB-OG 3.46Å; K1663-S2404 WeakPolarHBondContact CG-OG 3.37Å; K1663-S2404 PolarHBondContact N-OG 3.47Å
2405	N	26	Very low	25.2	Very low	113 Å²	113	99.1 Å²	99.1	60%	0.604	52%	0.515	S	S	*	.			cis	-164.8	170.7	-20	-102.7	-35	0	0	0	105.9
2406	T	24.3	Very low	25.3	Very low	111 Å²	111	95 Å²	95	68%	0.681	51%	0.512	S	S	*	.			trans	61.2	127	-170.9	57.1	0	0	0	0	113.8
2407	Q	27.7	Very low	25.4	Very low	153 Å²	153	94.8 Å²	94.8	72%	0.715	51%	0.512	S	S	*	.				75	152.8	50.4	-66.4	-169.1	38.3	0	0	114.5
2408	V	23	Very low	25.2	Very low	87 Å²	87	95 Å²	95	53%	0.527	51%	0.514	S	S	.	.			trans	66.5	137.6	-178.8	-135.5	0	0	0	0	110.2
2409	I	25.1	Very low	25	Very low	57 Å²	57	94.7 Å²	94.7	29%	0.292	51%	0.51	S	S	.	.			cis	-150.9	125.9	32.7	-76.1	176.2	0	0	0	104.6	R1750 L1754	R1750-I2409 HydrophobicContact CG-CG2 3.67Å; R1750-I2409 PolarHBondContact NH2-O 3.33Å; L1754-I2409 HydrophobicContact CD1-CG2 4.39Å
2410	R	22.7	Very low	25	Very low	44 Å²	44	95.6 Å²	95.6	17%	0.166	51%	0.51	C	S	.	.				62.7	126.1	92	-66.7	141.4	118.5	-161.8	-4.9	111.1	R1750 E1751 L1754 Q2412 R2413 V2414	R1750-R2410 PolarHBondContact NH2-O 3.4Å; E1751-R2410 IonicContact OE1-NH1 3.24Å; L1754-R2410 HydrophobicContact CD1-CB 4.24Å; L1754-R2410 HydrophobicContact CD1-CG 4.26Å; L1754-R2410 VanDerWaalsContact CD1-NH1 3.34Å; L1754-R2410 HydrophobicContact CD2-CB 4.36Å; L1754-R2410 HydrophobicContact CD2-CG 4.07Å; R2410-Q2412 HydrophobicContact CB-CB 4.31Å; R2410-Q2412 HydrophobicContact CB-CG 3.62Å; R2410-Q2412 HydrophobicContact CG-CG 4.49Å; R2410-R2413 HydrophobicContact CG-CB 3.61Å; R2410-R2413 HydrophobicContact CG-CG 4.41Å; R2410-R2413 PolarHBondContact NE-O 3Å; R2410-R2413 PolarHBondContact NH2-O 3.06Å; R2410-V2414 VanDerWaalsContact NH2-CG1 3.28Å
2411	L	24.3	Very low	25.2	Very low	105 Å²	105	90.2 Å²	90.2	55%	0.55	49%	0.489	S	S	.	.	S	Bend	cis	-57.2	123	40.1	-62.6	-167.6	0	0	0	118.5	M1753 L2008	M1753-L2411 HydrophobicContact CE-CD2 4.36Å; L2008-L2411 HydrophobicContact CD1-CD1 4.47Å; L2008-L2411 HydrophobicContact CD2-CB 3.99Å; L2008-L2411 HydrophobicContact CD2-CD1 4.02Å
2412	Q	26.7	Very low	25.1	Very low	19 Å²	19	86.7 Å²	86.7	9%	0.089	47%	0.468	C	S	.	.	S	Bend	cis	-140.6	49.2	-46.8	-112.9	174	-28.7	0	0	113.6	R1750 L1754 Q1757 R2410	R1750-Q2412 PolarHBondContact O-NE2 2.85Å; L1754-Q2412 HydrophobicContact CD1-CG 4.28Å; L1754-Q2412 HydrophobicContact CD2-CB 3.78Å; L1754-Q2412 HydrophobicContact CD2-CG 3.51Å; L1754-Q2412 WeakPolarHBondContact CD2-O 3.24Å; L1754-Q2412 HydrophobicContact CG-CB 4.31Å; L1754-Q2412 HydrophobicContact CG-CG 3.52Å; Q1757-Q2412 HydrophobicContact CB-CB 4.45Å; Q1757-Q2412 VanDerWaalsContact OE1-OE1 3.06Å; R2410-Q2412 HydrophobicContact CB-CB 4.31Å; R2410-Q2412 HydrophobicContact CB-CG 3.62Å; R2410-Q2412 HydrophobicContact CG-CG 4.49Å
2413	R	24.4	Very low	25.2	Very low	122 Å²	122	85.8 Å²	85.8	46%	0.46	46%	0.459	S	S	.	.			trans	-19	126.3	162.6	167.3	-143	-135.5	-175.4	6.8	117.2	L1754 R2410	L1754-R2413 WeakPolarHBondContact CD2-O 3.35Å; R2410-R2413 HydrophobicContact CG-CB 3.61Å; R2410-R2413 HydrophobicContact CG-CG 4.41Å; R2410-R2413 PolarHBondContact NE-O 3Å; R2410-R2413 PolarHBondContact NH2-O 3.06Å
2414	V	25.1	Very low	25.3	Very low	43 Å²	43	90 Å²	90	26%	0.261	49%	0.486	S	S	.	.			trans	-157.8	179.1	137.6	-111.7	0	0	0	0	106.2	L1754 L1758 R2410	L1754-V2414 HydrophobicContact CD2-CG2 4.17Å; L1758-V2414 HydrophobicContact CB-CG2 3.74Å; L1758-V2414 HydrophobicContact CD1-CG2 4.1Å; L1758-V2414 WeakPolarHBondContact CD1-O 3.43Å; L1758-V2414 HydrophobicContact CD2-CB 3.84Å; L1758-V2414 HydrophobicContact CD2-CG2 3.76Å; L1758-V2414 HydrophobicContact CG-CG2 4.04Å; R2410-V2414 VanDerWaalsContact NH2-CG1 3.28Å
2415	V	28.6	Very low	25.4	Very low	109 Å²	109	91.9 Å²	91.9	66%	0.661	49%	0.492	S	S	*	.			cis	-95.4	118.9	-6.2	180	0	0	0	0	110.4	L1758 N2417	L1758-V2415 HydrophobicContact CD2-CG2 3.88Å; V2415-N2417 HydrophobicContact CG1-CB 4.38Å; V2415-N2417 PolarHBondContact O-N 2.78Å
2416	S	23.7	Very low	25.4	Very low	82 Å²	82	90.7 Å²	90.7	57%	0.573	49%	0.486	S	S	*	.			trans	-91.6	89.4	169.3	53.9	0	0	0	0	110.4
2417	N	24.6	Very low	25.5	Very low	143 Å²	143	89.6 Å²	89.6	77%	0.765	48%	0.475	S	S	*	.			trans	-158.4	155	165.5	-100.7	-40.4	0	0	0	110.2	V2415	V2415-N2417 HydrophobicContact CG1-CB 4.38Å; V2415-N2417 PolarHBondContact O-N 2.78Å
2418	L	24.7	Very low	25.3	Very low	153 Å²	153	85.9 Å²	85.9	80%	0.801	46%	0.461	S	S	*	.			trans	62.7	85.1	-178.2	-56	173.3	0	0	0	114.8
2419	T	25.8	Very low	25.5	Very low	95 Å²	95	85.8 Å²	85.8	58%	0.583	46%	0.457	S	S	*	.				58.1	97.9	90.7	68.4	0	0	0	0	116.2
2420	H	23.8	Very low	25.5	Very low	138 Å²	138	87.7 Å²	87.7	64%	0.639	47%	0.468	S	S	*	.			trans	73.9	160.3	155.8	-58.2	-62.6	0	0	0	118.6	W277	W277-H2420 HydrophobicContact CD2-CB 4.48Å; W277-H2420 HydrophobicContact CZ2-CB 3.85Å
2421	P	30.1	Very low	25.7	Very low	40 Å²	40	90.9 Å²	90.9	26%	0.26	49%	0.49	S	S	.	.				-152.2	-166.9	-51.3	45.6	-28.5	0	0	0	114.8	M273 W277	M273-P2421 VanDerWaalsContact CE-O 3.32Å; M273-P2421 WeakPolarHBondContact CE-O 3.47Å; W277-P2421 HydrophobicContact CB-CG 3.62Å; W277-P2421 VanDerWaalsContact CD2-CD 3.43Å; W277-P2421 HydrophobicContact CD2-CG 4.16Å; W277-P2421 HydrophobicContact CG-CG 3.35Å
2422	K	22.8	Very low	25.8	Very low	71 Å²	71	89.8 Å²	89.8	31%	0.309	49%	0.485	S	S	.	.			trans	70.4	79.7	153.8	-67.7	172.4	72.5	164.4	0	119.4	M273 D276 W277 Q280	M273-K2422 WeakPolarHBondContact CA-O 3.43Å; M273-K2422 WeakPolarHBondContact CB-O 3.4Å; M273-K2422 WeakPolarHBondContact CG-O 3.35Å; D276-K2422 PolarHBondContact O-NZ 3.04Å; W277-K2422 HydrophobicContact CB-CD 4.42Å; Q280-K2422 VanDerWaalsContact OE1-CD 3.28Å
2423	N	25.3	Very low	25.7	Very low	32 Å²	32	95.7 Å²	95.7	17%	0.171	52%	0.518	C	S	.	.			trans	85.2	92.6	153.9	65.9	-118.4	0	0	0	123.7	F269 M273 K1995	F269-N2423 WeakPolarHBondContact CD1-O 3.48Å; F269-N2423 VanDerWaalsContact CD2-ND2 3.31Å; F269-N2423 WeakPolarHBondContact CD2-ND2 3.47Å; F269-N2423 HydrophobicContact CE1-CB 4.25Å; F269-N2423 HydrophobicContact CE2-CB 4.01Å; F269-N2423 WeakPolarHBondContact CE2-ND2 3.21Å; F269-N2423 HydrophobicContact CZ-CB 3.72Å; M273-N2423 VanDerWaalsContact CG-C 3.41Å; M273-N2423 WeakPolarHBondContact CG-O 3.11Å; M273-N2423 VanDerWaalsContact SD-O 3.37Å; K1995-N2423 HydrophobicContact CD-CB 3.62Å; K1995-N2423 WeakPolarHBondContact CD-OD1 3.37Å; K1995-N2423 VanDerWaalsContact CE-OD1 3.24Å; K1995-N2423 WeakPolarHBondContact CE-OD1 3.17Å; K1995-N2423 PolarHBondContact NZ-OD1 2.67Å
2424	T	29.8	Very low	25.9	Very low	120 Å²	120	93.3 Å²	93.3	74%	0.736	52%	0.523	S	S	*	.			trans	-116.2	0	132	-57.6	0	0	0	0	108.4	M266 F269 I270	M266-T2424 HydrophobicContact CG-CG2 3.64Å; M266-T2424 HydrophobicContact SD-CG2 4.18Å; F269-T2424 HydrophobicContact CD1-CG2 4.36Å; F269-T2424 WeakPolarHBondContact CE1-OXT 3.23Å; I270-T2424 WeakPolarHBondContact CG1-OG1 3.45Å

Retrieved 2,424 of 2,424 residues in 2941.3 ms (Link to these results)

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