A0A087YAZ0_POEFO Loading...

SUN domain containing ossification factor

AlphaFold DB , UniProt , Accession A0A087YAZ0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,048 aa.

						>A0A087YAZ0_POEFO|A0A087YAZ0
MGDANAAREADPSVPSKDDIPTFDEWKKQVMEVEKEKSQTLHTSAGGSLHSAKKVQKNFKNNYASVECGAKILSANNEAKSMSAILMENMDLYMLNPCSTKIWFVIELCEPIQVKQLDIANFELFSSTPKDFLVSISDRYPTNKWVKLGTFHARDERIVQSFPLDEQLYAKYVKVELLSHFGAEHFCPLSLIRVFGTSMVEEYEEIADSQYPSDRLEYLDEDYDYPPGYQPSEEKVSKNLLGSATTDAILNMVNNIAANVLGGKPDMEGGAELGANYSVAACPCMPLQSLDPEKSEQPASEEGSNASSDSSSSSSLPESSEDRQIVTLVEEDEDEEPKQSTVTLPDRNQWESQAYCPFSSLSSLSLSCMATLPELLHRWCSARLAKERLRSLRRRQLHTRTQTDESIPVLTHTPPPIPVPSPTQEVLLPLTEKAPDPEVPQDKVNEGKPSAEVQTDIQLRVQPSDIYTPELNVVLEPSRTATIPPHSSSAPQSTLMRPTPTHEEKPLPPVKDESLDLVPTPPLQAASVPETQQAISAASTLSVSPPQQAPSPETASSVFLATPVKEQPVLSLPTASRPENLLPPPTELPAAVPAADSHTDSVKTATDVGGSKQKQRTDAPQIEAEQGSNLSQTGEPHRTEDSVEEELLNTNVQRTATDFYAELQNGGDYTGGTLNGNGMLLNGGGSVHGSSQKESVFMRLNNRIKALEMNMSLSSRYLEELSQRYRKQMEEMQKAFNKTIIKLQNTSRIAQEQDQKQTDSIQLLQSQLEDVTKLMLNLTATVSQLQREVSDRQSYLVLSLVLCLLLGVLLCLQCCRSSSPKPKANFTPLPKSNHYPSPKRCFSSYDDMSLRRRVASPLVRSKSFQLSSTEVGPDDLFIVEPLRFSPEKKKKRGKTKSLDKVETLMPFDPSLPLTNGDPKLSHPLPSADQVSSLPTVTSKEFPSETSSCSSSTHSEESYTSRLPPPPPICPSAGMCNGHGLSFPLTQPPAKSRQEKRSLKRRKSRQTELQFPPVPGGGVDSLPSLQQLMKGNKEMSVGTIRVTAVTGHV
					

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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	33.5	Very low	34.7	Very low	246 Å²	246	150.5 Å²	150.5	100%	1.212	88%	0.882	S	S	*	*				0	143.1	0	-64.6	66.7	168.7	0	0	107.4
2	G	38.2	Very low	35	Very low	61 Å²	61	147.8 Å²	147.8	63%	0.629	87%	0.872	S	S	*	*			cis	153.5	154.9	0.1	0	0	0	0	0	110.5
3	D	34.7	Very low	34.9	Very low	163 Å²	163	145.3 Å²	145.3	87%	0.872	87%	0.867	S	S	*	*			trans	69.7	107.6	175.6	-48.5	-24.5	0	0	0	115
4	A	37	Very low	35.1	Very low	98 Å²	98	144.5 Å²	144.5	81%	0.81	86%	0.863	S	S	*	*			cis	85.7	113	46	0	0	0	0	0	113.2
5	N	36.1	Very low	35.3	Very low	175 Å²	175	142.8 Å²	142.8	94%	0.936	86%	0.857	S	S	*	*			trans	-130	116.6	172.3	-115.5	-29.7	0	0	0	107.4
6	A	33.4	Very low	35.3	Very low	102 Å²	102	141.3 Å²	141.3	84%	0.843	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-97.9	119.5	179.3	0	0	0	0	0	110.1
7	A	36.2	Very low	35.8	Very low	102 Å²	102	143.5 Å²	143.5	84%	0.843	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-81.8	138.4	166.7	0	0	0	0	0	109.4
8	R	36.3	Very low	36.3	Very low	249 Å²	249	142.7 Å²	142.7	94%	0.94	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-84.3	134.9	172	-78.1	178.4	166.4	157.7	-5.3	110
9	E	31	Very low	36.7	Very low	198 Å²	198	143.9 Å²	143.9	93%	0.925	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-67.5	160.6	160.1	-66.8	174	116.6	0	0	110.6
10	A	34.3	Very low	37.6	Very low	99 Å²	99	144.5 Å²	144.5	82%	0.818	84%	0.842	S	S	*	*			trans	-132	136.6	172	0	0	0	0	0	108.8
11	D	31	Very low	38.7	Very low	163 Å²	163	140.3 Å²	140.3	87%	0.872	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-62	145.7	-175.6	-91.8	-53.9	0	0	0	113.3
12	P	37.8	Very low	40.6	Very low	117 Å²	117	132.8 Å²	132.8	76%	0.76	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-71.4	139.2	172.9	30.7	-34.1	0	0	0	111.6
13	S	33.7	Very low	41.2	Very low	116 Å²	116	136.4 Å²	136.4	81%	0.811	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-69.8	139.2	-178.9	52.4	0	0	0	0	113.4
14	V	38.4	Very low	42.8	Very low	134 Å²	134	133.4 Å²	133.4	81%	0.812	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-55.4	133.9	173.5	179.6	0	0	0	0	111.1
15	P	37.4	Very low	44.6	Very low	119 Å²	119	133.9 Å²	133.9	77%	0.773	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-69	139.2	177.3	28.4	-34.8	0	0	0	111.8
16	S	36	Very low	46.6	Very low	119 Å²	119	131.9 Å²	131.9	83%	0.832	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-71	156.4	171.1	49.5	0	0	0	0	111.8
17	K	44.4	Very low	48.5	Very low	179 Å²	179	130.6 Å²	130.6	78%	0.778	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-81.9	160.5	178.8	-100.9	-167.2	172	-158.9	0	113.2
18	D	44	Very low	50.6	Low	128 Å²	128	131.8 Å²	131.8	68%	0.684	70%	0.696	S	S	*	*			trans	65.2	72.2	153.4	-50.3	-24.4	0	0	0	117.3
19	D	43.9	Very low	52.4	Low	166 Å²	166	125.1 Å²	125.1	89%	0.888	68%	0.676	S	S	*	*			trans	-133.1	119.3	135.9	-102.6	-38.4	0	0	0	107.9
20	I	54.7	Low	54.6	Low	156 Å²	156	118 Å²	118	80%	0.8	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-100.9	116.6	175.2	-61.4	176	0	0	0	106.7
21	P	60.1	Low	56.1	Low	57 Å²	57	118.9 Å²	118.9	37%	0.37	64%	0.635	S	S	.	*	P	Polyproline II helix	trans	-63.5	142.7	-175.4	25.5	-34	0	0	0	111.3	E25 W26	P21-E25 HydrophobicContact CB-CB 4.12Å; P21-W26 HydrophobicContact CG-CB 4.34Å
22	T	74.1	Confident	58	Low	88 Å²	88	115.4 Å²	115.4	54%	0.54	61%	0.613	S	S	.	*	P	Polyproline II helix	trans	-58.1	150.3	176.4	-45.7	0	0	0	0	109.8	D24 E25 W26	T22-D24 PolarHBondContact O-N 3.23Å; T22-E25 WeakPolarHBondContact CB-OE2 3.49Å; T22-E25 PolarHBondContact N-OE2 2.78Å; T22-E25 WeakPolarHBondContact O-CA 3.48Å; T22-E25 WeakPolarHBondContact O-CB 3.37Å; T22-E25 PolarHBondContact O-N 3.44Å; T22-E25 PolarHBondContact OG1-OE2 3.33Å; T22-W26 PolarHBondContact O-N 2.92Å
23	F	49.9	Very low	59.8	Low	136 Å²	136	114 Å²	114	60%	0.596	60%	0.602	S	S	*	*	H	α-helix	trans	-52.6	-35	-177.2	178.7	-120.8	0	0	0	113.7	W26 K27	F23-W26 HydrophobicContact CD2-CE3 4.13Å; F23-W26 HydrophobicContact CE2-CE3 4.09Å; F23-W26 HydrophobicContact CE2-CZ3 4.08Å; F23-K27 WeakPolarHBondContact O-CB 3.41Å; F23-K27 PolarHBondContact O-N 3.46Å
24	D	70	Confident	61.2	Low	101 Å²	101	114.2 Å²	114.2	54%	0.54	59%	0.59	S	S	.	*	H	α-helix	trans	-76.5	-29.4	175.2	-69.5	-59.5	0	0	0	114.1	T22 K27 K28	T22-D24 PolarHBondContact O-N 3.23Å; D24-K27 IonicContact OD1-NZ 3.3Å; D24-K27 PolarHBondContact OD1-NZ 2.93Å; D24-K28 VanDerWaalsContact O-CB 3.22Å; D24-K28 WeakPolarHBondContact O-CB 3.32Å; D24-K28 PolarHBondContact O-N 3.45Å
25	E	73.9	Confident	62.5	Low	107 Å²	107	114.1 Å²	114.1	50%	0.5	58%	0.579	S	S	.	*	H	α-helix	trans	-72.3	-42.8	172.4	-62.7	175.5	116.7	0	0	110.9	P21 T22 K28 Q29	P21-E25 HydrophobicContact CB-CB 4.12Å; T22-E25 WeakPolarHBondContact CB-OE2 3.49Å; T22-E25 PolarHBondContact N-OE2 2.78Å; T22-E25 WeakPolarHBondContact O-CA 3.48Å; T22-E25 WeakPolarHBondContact O-CB 3.37Å; T22-E25 PolarHBondContact O-N 3.44Å; T22-E25 PolarHBondContact OG1-OE2 3.33Å; E25-K28 PolarHBondContact O-N 2.65Å; E25-Q29 WeakPolarHBondContact O-CB 3.48Å; E25-Q29 WeakPolarHBondContact O-CG 3.32Å; E25-Q29 PolarHBondContact O-N 3.28Å
26	W	77.4	Confident	63.3	Low	133 Å²	133	114.2 Å²	114.2	50%	0.504	57%	0.569	S	S	.	*	H	α-helix	trans	-61.5	-46.9	171.6	178	81.6	0	0	0	111.3	P21 T22 F23 K28 Q29 V30	P21-W26 HydrophobicContact CG-CB 4.34Å; T22-W26 PolarHBondContact O-N 2.92Å; F23-W26 HydrophobicContact CD2-CE3 4.13Å; F23-W26 HydrophobicContact CE2-CE3 4.09Å; F23-W26 HydrophobicContact CE2-CZ3 4.08Å; W26-K28 VanDerWaalsContact C-N 3.33Å; W26-K28 PolarHBondContact O-N 3.4Å; W26-Q29 CarbonylContact O-C 3.56Å; W26-Q29 PolarHBondContact O-N 3.4Å; W26-V30 HydrophobicContact CD2-CG2 3.98Å; W26-V30 HydrophobicContact CE3-CG2 4.3Å; W26-V30 HydrophobicContact CH2-CG2 4.03Å; W26-V30 HydrophobicContact CZ2-CG2 3.68Å; W26-V30 HydrophobicContact CZ3-CG2 4.33Å; W26-V30 WeakPolarHBondContact O-CG2 3.49Å; W26-V30 PolarHBondContact O-N 3.27Å
27	K	73.6	Confident	63.8	Low	75 Å²	75	115.8 Å²	115.8	33%	0.326	56%	0.561	S	S	.	*	H	α-helix	trans	-61.8	-39.3	176.4	-177.6	-166	-55.8	164.7	0	112	F23 D24 V30 M31	F23-K27 WeakPolarHBondContact O-CB 3.41Å; F23-K27 PolarHBondContact O-N 3.46Å; D24-K27 IonicContact OD1-NZ 3.3Å; D24-K27 PolarHBondContact OD1-NZ 2.93Å; K27-V30 PolarHBondContact O-N 3.33Å; K27-M31 HydrophobicContact CG-CE 4.42Å; K27-M31 WeakPolarHBondContact O-CG 3.48Å; K27-M31 PolarHBondContact O-N 2.84Å
28	K	81.1	Confident	63.8	Low	127 Å²	127	111.5 Å²	111.5	55%	0.552	55%	0.553	S	S	*	*	H	α-helix	trans	-63	-49.2	171.8	-176.1	-172.4	171.1	-165.2	0	110.8	D24 E25 W26 V30 M31 E32	D24-K28 VanDerWaalsContact O-CB 3.22Å; D24-K28 WeakPolarHBondContact O-CB 3.32Å; D24-K28 PolarHBondContact O-N 3.45Å; E25-K28 PolarHBondContact O-N 2.65Å; W26-K28 VanDerWaalsContact C-N 3.33Å; W26-K28 PolarHBondContact O-N 3.4Å; K28-V30 VanDerWaalsContact C-N 3.31Å; K28-V30 PolarHBondContact O-N 3.11Å; K28-M31 PolarHBondContact O-N 3.05Å; K28-E32 WeakPolarHBondContact CE-OE2 3.44Å; K28-E32 VanDerWaalsContact O-CB 3.23Å; K28-E32 WeakPolarHBondContact O-CB 3.27Å; K28-E32 PolarHBondContact O-N 2.85Å
29	Q	72.6	Confident	63.5	Low	109 Å²	109	111.7 Å²	111.7	51%	0.509	55%	0.55	S	S	.	*	H	α-helix	trans	-60.1	-38.1	176.2	-78.6	-178	-11.9	0	0	112.5	E25 W26 E32 V33	E25-Q29 WeakPolarHBondContact O-CB 3.48Å; E25-Q29 WeakPolarHBondContact O-CG 3.32Å; E25-Q29 PolarHBondContact O-N 3.28Å; W26-Q29 CarbonylContact O-C 3.56Å; W26-Q29 PolarHBondContact O-N 3.4Å; Q29-E32 PolarHBondContact O-N 3.49Å; Q29-V33 VanDerWaalsContact O-CB 3.25Å; Q29-V33 WeakPolarHBondContact O-CB 3.32Å; Q29-V33 VanDerWaalsContact O-CG2 3.23Å; Q29-V33 WeakPolarHBondContact O-CG2 3.39Å; Q29-V33 PolarHBondContact O-N 3.39Å
30	V	78.3	Confident	62.9	Low	50 Å²	50	109.2 Å²	109.2	30%	0.303	54%	0.541	S	S	.	.	H	α-helix	trans	-64	-47.6	174.8	169.6	0	0	0	0	110.7	W26 K27 K28 E32 V33 E34	W26-V30 HydrophobicContact CD2-CG2 3.98Å; W26-V30 HydrophobicContact CE3-CG2 4.3Å; W26-V30 HydrophobicContact CH2-CG2 4.03Å; W26-V30 HydrophobicContact CZ2-CG2 3.68Å; W26-V30 HydrophobicContact CZ3-CG2 4.33Å; W26-V30 WeakPolarHBondContact O-CG2 3.49Å; W26-V30 PolarHBondContact O-N 3.27Å; K27-V30 PolarHBondContact O-N 3.33Å; K28-V30 VanDerWaalsContact C-N 3.31Å; K28-V30 PolarHBondContact O-N 3.11Å; V30-E32 VanDerWaalsContact C-N 3.32Å; V30-E32 PolarHBondContact O-N 2.88Å; V30-V33 PolarHBondContact O-N 3.41Å; V30-E34 HydrophobicContact CG1-CG 4.5Å; V30-E34 WeakPolarHBondContact O-CB 3.26Å; V30-E34 WeakPolarHBondContact O-CG 3.41Å; V30-E34 PolarHBondContact O-N 3.28Å
31	M	65.3	Low	62.2	Low	117 Å²	117	108.5 Å²	108.5	58%	0.576	54%	0.538	S	S	*	.	H	α-helix	trans	-65.2	-33.9	175.5	-70.6	-171.8	-64	0	0	112.8	K27 K28 K35	K27-M31 HydrophobicContact CG-CE 4.42Å; K27-M31 WeakPolarHBondContact O-CG 3.48Å; K27-M31 PolarHBondContact O-N 2.84Å; K28-M31 PolarHBondContact O-N 3.05Å; M31-K35 WeakPolarHBondContact O-CB 3.47Å; M31-K35 PolarHBondContact O-N 3.31Å
32	E	70.8	Confident	61.1	Low	90 Å²	90	113.5 Å²	113.5	42%	0.421	56%	0.556	S	S	.	*	H	α-helix	trans	-72.5	-41.2	178.7	-162.9	144.5	-135.7	0	0	110.8	K28 Q29 V30 K35 E36	K28-E32 WeakPolarHBondContact CE-OE2 3.44Å; K28-E32 VanDerWaalsContact O-CB 3.23Å; K28-E32 WeakPolarHBondContact O-CB 3.27Å; K28-E32 PolarHBondContact O-N 2.85Å; Q29-E32 PolarHBondContact O-N 3.49Å; V30-E32 VanDerWaalsContact C-N 3.32Å; V30-E32 PolarHBondContact O-N 2.88Å; E32-K35 WeakPolarHBondContact O-CB 3.39Å; E32-K35 PolarHBondContact O-N 3.14Å; E32-E36 WeakPolarHBondContact O-CG 3.45Å; E32-E36 PolarHBondContact O-N 3.14Å
33	V	76.1	Confident	58.9	Low	88 Å²	88	115.8 Å²	115.8	53%	0.533	57%	0.57	S	S	.	*	H	α-helix	trans	-70.6	-37.1	172.7	169.7	0	0	0	0	112.2	Q29 V30 K35 E36 K37	Q29-V33 VanDerWaalsContact O-CB 3.25Å; Q29-V33 WeakPolarHBondContact O-CB 3.32Å; Q29-V33 VanDerWaalsContact O-CG2 3.23Å; Q29-V33 WeakPolarHBondContact O-CG2 3.39Å; Q29-V33 PolarHBondContact O-N 3.39Å; V30-V33 PolarHBondContact O-N 3.41Å; V33-K35 VanDerWaalsContact C-N 3.34Å; V33-E36 PolarHBondContact O-N 3.46Å; V33-K37 WeakPolarHBondContact O-CB 3.4Å; V33-K37 PolarHBondContact O-N 3.06Å
34	E	63	Low	57.9	Low	120 Å²	120	115.4 Å²	115.4	56%	0.561	59%	0.585	S	S	*	*	H	α-helix	trans	-66.9	-36.6	172.3	-76.8	-168.6	137.6	0	0	111.6	V30 S38	V30-E34 HydrophobicContact CG1-CG 4.5Å; V30-E34 WeakPolarHBondContact O-CB 3.26Å; V30-E34 WeakPolarHBondContact O-CG 3.41Å; V30-E34 PolarHBondContact O-N 3.28Å; E34-S38 WeakPolarHBondContact O-CB 3.32Å; E34-S38 PolarHBondContact O-N 3.24Å; E34-S38 PolarHBondContact O-OG 3.48Å
35	K	65.2	Low	55.9	Low	132 Å²	132	115.5 Å²	115.5	57%	0.574	60%	0.599	S	S	*	*	H	α-helix	trans	-65.9	-46.6	172.6	-178.7	-177.3	176.3	-170.2	0	111.6	M31 E32 V33 S38 Q39	M31-K35 WeakPolarHBondContact O-CB 3.47Å; M31-K35 PolarHBondContact O-N 3.31Å; E32-K35 WeakPolarHBondContact O-CB 3.39Å; E32-K35 PolarHBondContact O-N 3.14Å; V33-K35 VanDerWaalsContact C-N 3.34Å; K35-S38 CarbonylContact O-C 3.51Å; K35-S38 WeakPolarHBondContact O-CB 3.49Å; K35-S38 PolarHBondContact O-N 3.47Å; K35-Q39 VanDerWaalsContact O-CB 3.27Å; K35-Q39 WeakPolarHBondContact O-CB 3.31Å; K35-Q39 PolarHBondContact O-N 3.02Å
36	E	53.9	Low	53.7	Low	121 Å²	121	114.7 Å²	114.7	57%	0.565	62%	0.62	S	S	*	*	H	α-helix	trans	-65	-38.7	174.8	-74.8	-170.4	151.1	0	0	112.3	E32 V33 S38 Q39 T40	E32-E36 WeakPolarHBondContact O-CG 3.45Å; E32-E36 PolarHBondContact O-N 3.14Å; V33-E36 PolarHBondContact O-N 3.46Å; E36-S38 VanDerWaalsContact C-N 3.26Å; E36-S38 PolarHBondContact O-N 3.41Å; E36-Q39 PolarHBondContact O-N 3.23Å; E36-Q39 VanDerWaalsContact O-N 3.08Å; E36-T40 WeakPolarHBondContact O-CB 3.48Å; E36-T40 WeakPolarHBondContact O-CG2 3.2Å; E36-T40 PolarHBondContact O-N 2.89Å; E36-T40 PolarHBondContact O-OG1 3.27Å
37	K	47.8	Very low	51.4	Low	152 Å²	152	112.1 Å²	112.1	66%	0.661	64%	0.635	S	S	*	*	H	α-helix	trans	-66.2	-27.9	173.5	-171.2	176.6	-179.4	-175.7	0	112.7	V33	V33-K37 WeakPolarHBondContact O-CB 3.4Å; V33-K37 PolarHBondContact O-N 3.06Å
38	S	42.9	Very low	49.2	Very low	88 Å²	88	114.5 Å²	114.5	62%	0.615	66%	0.661	S	S	*	*	H	α-helix	trans	-77.3	-29.5	170.1	-56.6	0	0	0	0	112.5	E34 K35 E36	E34-S38 WeakPolarHBondContact O-CB 3.32Å; E34-S38 PolarHBondContact O-N 3.24Å; E34-S38 PolarHBondContact O-OG 3.48Å; K35-S38 CarbonylContact O-C 3.51Å; K35-S38 WeakPolarHBondContact O-CB 3.49Å; K35-S38 PolarHBondContact O-N 3.47Å; E36-S38 VanDerWaalsContact C-N 3.26Å; E36-S38 PolarHBondContact O-N 3.41Å
39	Q	38.8	Very low	46.9	Very low	133 Å²	133	116.1 Å²	116.1	62%	0.621	67%	0.674	S	S	*	*	H	α-helix	trans	-93.8	-24	-173.1	-162.4	155.8	32.2	0	0	113.6	K35 E36 L41 H42	K35-Q39 VanDerWaalsContact O-CB 3.27Å; K35-Q39 WeakPolarHBondContact O-CB 3.31Å; K35-Q39 PolarHBondContact O-N 3.02Å; E36-Q39 PolarHBondContact O-N 3.23Å; E36-Q39 VanDerWaalsContact O-N 3.08Å; Q39-L41 VanDerWaalsContact C-N 3.29Å; Q39-L41 PolarHBondContact O-N 2.94Å; Q39-H42 PolarHBondContact O-N 2.92Å
40	T	31.5	Very low	45.2	Very low	114 Å²	114	120 Å²	120	70%	0.699	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-10.9	177.9	42.4	0	0	0	0	114.4	E36 H42	E36-T40 WeakPolarHBondContact O-CB 3.48Å; E36-T40 WeakPolarHBondContact O-CG2 3.2Å; E36-T40 PolarHBondContact O-N 2.89Å; E36-T40 PolarHBondContact O-OG1 3.27Å; T40-H42 VanDerWaalsContact C-N 3.27Å; T40-H42 PolarHBondContact O-N 2.89Å
41	L	38.9	Very low	42.8	Very low	141 Å²	141	123.1 Å²	123.1	74%	0.738	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-5	173	-80.9	163.6	0	0	0	114.1	Q39	Q39-L41 VanDerWaalsContact C-N 3.29Å; Q39-L41 PolarHBondContact O-N 2.94Å
42	H	38	Very low	41.1	Very low	161 Å²	161	122.2 Å²	122.2	75%	0.745	73%	0.728	S	S	*	*	S	Bend	trans	-137.9	68.3	-177.4	-69.9	-62.1	0	0	0	114.6	Q39 T40	Q39-H42 PolarHBondContact O-N 2.92Å; T40-H42 VanDerWaalsContact C-N 3.27Å; T40-H42 PolarHBondContact O-N 2.89Å
43	T	27.5	Very low	39.5	Very low	136 Å²	136	128.1 Å²	128.1	83%	0.834	75%	0.752	S	S	*	*			trans	-160.5	97.8	151.5	-74	0	0	0	0	111.8
44	S	28.9	Very low	37.4	Very low	128 Å²	128	130.6 Å²	130.6	90%	0.895	76%	0.755	S	S	*	*			trans	-170.9	47.9	163.1	50.9	0	0	0	0	114.3
45	A	27.4	Very low	36.2	Very low	103 Å²	103	131 Å²	131	85%	0.851	77%	0.766	S	S	*	*			trans	-138.9	89.7	177.6	0	0	0	0	0	113.4	G47	A45-G47 PolarHBondContact O-N 2.85Å
46	G	28	Very low	35	Very low	90 Å²	90	132.9 Å²	132.9	93%	0.928	78%	0.777	S	S	*	*			trans	-93.1	82.2	178.7	0	0	0	0	0	114.4
47	G	29.5	Very low	34.8	Very low	79 Å²	79	129.8 Å²	129.8	81%	0.814	76%	0.761	S	S	*	*			trans	74.4	104.5	153.2	0	0	0	0	0	119.6	A45	A45-G47 PolarHBondContact O-N 2.85Å
48	S	26.9	Very low	34.9	Very low	125 Å²	125	128.8 Å²	128.8	87%	0.874	76%	0.763	S	S	*	*			trans	-151.1	173.9	145.5	-162.5	0	0	0	0	110.7
49	L	32.9	Very low	36.2	Very low	161 Å²	161	127.2 Å²	127.2	84%	0.843	75%	0.745	S	S	*	*			trans	-77.6	159.6	-161.4	-105	65.3	0	0	0	116.1
50	H	37.7	Very low	37.8	Very low	191 Å²	191	129.6 Å²	129.6	88%	0.884	75%	0.753	S	S	*	*			trans	-58.4	135.2	-176.4	-52.3	-88.3	0	0	0	115.2
51	S	28.5	Very low	40.5	Very low	116 Å²	116	129 Å²	129	81%	0.811	75%	0.746	S	S	*	*			trans	-134.5	167.8	143.6	65.6	0	0	0	0	108.9	K53	S51-K53 PolarHBondContact O-N 3.12Å
52	A	28.9	Very low	43.2	Very low	98 Å²	98	123.6 Å²	123.6	81%	0.81	72%	0.718	S	S	*	*			trans	-51.1	129.5	-159.4	0	0	0	0	0	115.9	K54	A52-K54 VanDerWaalsContact C-N 3.3Å; A52-K54 PolarHBondContact O-N 3.33Å
53	K	36.1	Very low	45.9	Very low	214 Å²	214	116.4 Å²	116.4	93%	0.93	68%	0.684	S	S	*	*			trans	-67.1	87.5	160.3	-78.8	-171.1	175.7	-175.1	0	109.3	S51	S51-K53 PolarHBondContact O-N 3.12Å
54	K	33.4	Very low	49.2	Very low	140 Å²	140	109.9 Å²	109.9	61%	0.609	64%	0.644	S	S	*	*			trans	-71.6	131.1	153.8	-153.9	-178.5	-176.6	-162.3	0	106.5	A52 Q56 D165	A52-K54 VanDerWaalsContact C-N 3.3Å; A52-K54 PolarHBondContact O-N 3.33Å; K54-Q56 PolarHBondContact O-N 2.94Å; K54-D165 IonicContact NZ-OD1 3.04Å; K54-D165 PolarHBondContact NZ-OD1 3.28Å; K54-D165 IonicContact NZ-OD2 2.71Å; K54-D165 PolarHBondContact NZ-OD2 3.28Å
55	V	36.8	Very low	52.4	Low	128 Å²	128	104.7 Å²	104.7	78%	0.776	61%	0.608	S	S	*	*			trans	-64.6	112.3	179.4	176.3	0	0	0	0	108	K57	V55-K57 HydrophobicContact CG1-CB 4.41Å; V55-K57 PolarHBondContact O-N 3.12Å
56	Q	39.7	Very low	55.6	Low	172 Å²	172	102.5 Å²	102.5	80%	0.804	58%	0.584	S	S	*	*			trans	-78.2	70.7	173.5	-167.4	169.2	1.5	0	0	108.3	K54 N58	K54-Q56 PolarHBondContact O-N 2.94Å; Q56-N58 PolarHBondContact O-N 2.95Å
57	K	50.4	Low	58.7	Low	56 Å²	56	107 Å²	107	24%	0.243	58%	0.581	C	S	.	*			trans	-58.5	122.7	176.5	-155.4	-170.6	-175.8	-159.8	0	107	V55 F59 E201 E205	V55-K57 HydrophobicContact CG1-CB 4.41Å; V55-K57 PolarHBondContact O-N 3.12Å; K57-F59 HydrophobicContact CB-CE1 4.41Å; K57-F59 PolarHBondContact O-N 2.91Å; K57-E201 IonicContact NZ-OE1 2.75Å; K57-E201 PolarHBondContact NZ-OE1 3.32Å; K57-E205 VanDerWaalsContact CE-CD 3.46Å; K57-E205 WeakPolarHBondContact CE-OE1 3.37Å; K57-E205 WeakPolarHBondContact CE-OE2 3.41Å; K57-E205 IonicContact NZ-OE1 3.61Å; K57-E205 PolarHBondContact NZ-OE1 3.23Å; K57-E205 IonicContact NZ-OE2 3.79Å; K57-E205 PolarHBondContact NZ-OE2 2.65Å
58	N	50.8	Low	61.8	Low	130 Å²	130	106.1 Å²	106.1	70%	0.695	56%	0.562	S	S	*	*			trans	-72.4	96.1	-179.2	-75.9	-64.6	0	0	0	108.8	Q56 K60	Q56-N58 PolarHBondContact O-N 2.95Å; N58-K60 VanDerWaalsContact C-N 3.28Å; N58-K60 HydrophobicContact CB-CG 4.46Å; N58-K60 PolarHBondContact O-N 2.91Å
59	F	69.6	Low	65	Low	56 Å²	56	102.6 Å²	102.6	25%	0.246	55%	0.545	C	S	.	.			trans	-65.9	87.2	171.1	-52.3	-65.4	0	0	0	108.9	K57 N61 K115 F195 T197	K57-F59 HydrophobicContact CB-CE1 4.41Å; K57-F59 PolarHBondContact O-N 2.91Å; F59-N61 VanDerWaalsContact C-N 3.32Å; F59-N61 PolarHBondContact O-N 3.37Å; F59-K115 HydrophobicContact CD1-CB 4.48Å; F59-K115 HydrophobicContact CD2-CB 4.17Å; F59-K115 HydrophobicContact CE1-CB 3.94Å; F59-K115 HydrophobicContact CE1-CG 3.8Å; F59-K115 HydrophobicContact CE2-CB 3.57Å; F59-K115 HydrophobicContact CE2-CG 4.29Å; F59-K115 HydrophobicContact CZ-CB 3.45Å; F59-K115 VanDerWaalsContact CZ-CB 3.45Å; F59-K115 HydrophobicContact CZ-CG 3.64Å; F59-F195 HydrophobicContact CB-CB 3.81Å; F59-F195 HydrophobicContact CB-CD1 4.18Å; F59-F195 HydrophobicContact CB-CG 4.33Å; F59-F195 HydrophobicContact CG-CB 4.45Å; F59-F195 WeakPolarHBondContact O-CD1 3.33Å; F59-F195 WeakPolarHBondContact O-CE1 3.5Å; F59-T197 HydrophobicContact CD1-CG2 4.39Å; F59-T197 HydrophobicContact CE1-CG2 3.97Å
60	K	72.7	Confident	68.1	Low	182 Å²	182	95.2 Å²	95.2	79%	0.791	51%	0.507	S	S	*	.			trans	-70.9	-25.7	-171.2	-74.8	173.8	-178.4	173.9	0	113.7	N58	N58-K60 VanDerWaalsContact C-N 3.28Å; N58-K60 HydrophobicContact CB-CG 4.46Å; N58-K60 PolarHBondContact O-N 2.91Å
61	N	88.5	Confident	70.9	Confident	101 Å²	101	90.6 Å²	90.6	54%	0.54	48%	0.484	S	S	.	.			trans	-101.5	120.9	-166.4	-65.3	5.4	0	0	0	111.5	F59 Y63 F195	F59-N61 VanDerWaalsContact C-N 3.32Å; F59-N61 PolarHBondContact O-N 3.37Å; N61-Y63 HydrophobicContact CB-CD2 4.42Å; N61-Y63 HydrophobicContact CB-CE2 3.9Å; N61-Y63 WeakPolarHBondContact O-CD2 3.43Å; N61-Y63 PolarHBondContact O-N 3.48Å; N61-F195 VanDerWaalsContact O-CD1 3.23Å; N61-F195 WeakPolarHBondContact O-CD1 3.38Å
62	N	94.6	Very high	74.2	Confident	28 Å²	28	86.5 Å²	86.5	15%	0.15	45%	0.453	C	S	.	.			trans	-82.5	98.2	171.6	176.2	15.9	0	0	0	110.4	A64 S65 R193 V194 F195	N62-A64 PolarHBondContact O-N 2.86Å; N62-A64 VanDerWaalsContact O-N 3.16Å; N62-A64 WeakPolarHBondContact OD1-CB 3.38Å; N62-A64 PolarHBondContact OD1-N 2.93Å; N62-S65 WeakPolarHBondContact O-CB 3.36Å; N62-S65 PolarHBondContact O-N 3.49Å; N62-R193 HydrophobicContact CB-CB 4.38Å; N62-R193 WeakPolarHBondContact ND2-CG 3.08Å; N62-R193 VanDerWaalsContact OD1-CA 3.29Å; N62-R193 WeakPolarHBondContact OD1-CA 3.33Å; N62-R193 WeakPolarHBondContact OD1-CB 3.38Å; N62-V194 PolarHBondContact OD1-N 2.84Å; N62-F195 HydrophobicContact CB-CE1 4.05Å; N62-F195 HydrophobicContact CB-CZ 4.3Å
63	Y	95.6	Very high	77.4	Confident	10 Å²	10	84.5 Å²	84.5	4%	0.039	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-6.4	179.7	-68.4	-87.9	0	0	0	114.2	N61 A70 L108 C109 E110 I112 V194	N61-Y63 HydrophobicContact CB-CD2 4.42Å; N61-Y63 HydrophobicContact CB-CE2 3.9Å; N61-Y63 WeakPolarHBondContact O-CD2 3.43Å; N61-Y63 PolarHBondContact O-N 3.48Å; Y63-A70 WeakPolarHBondContact O-CB 3.46Å; Y63-L108 WeakPolarHBondContact O-CA 3.4Å; Y63-C109 PolarHBondContact O-N 3.31Å; Y63-C109 PolarHBondContact O-SG 3.47Å; Y63-C109 VanDerWaalsContact O-SG 3.39Å; Y63-E110 HydrophobicContact CD1-CB 4.02Å; Y63-E110 HydrophobicContact CE1-CB 4.03Å; Y63-E110 HydrophobicContact CE1-CG 4.44Å; Y63-I112 HydrophobicContact CD1-CG2 3.62Å; Y63-I112 HydrophobicContact CD2-CD1 3.75Å; Y63-I112 HydrophobicContact CD2-CG2 4.01Å; Y63-I112 HydrophobicContact CE1-CG2 3.65Å; Y63-I112 HydrophobicContact CE2-CG2 4.03Å; Y63-I112 HydrophobicContact CG-CD1 3.84Å; Y63-I112 HydrophobicContact CG-CG2 3.81Å; Y63-V194 PolarHBondContact N-O 2.7Å
64	A	96.8	Very high	80.2	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99	4.4	170.5	0	0	0	0	0	113.7	N62 A70 L86 I106 L108 V194	N62-A64 PolarHBondContact O-N 2.86Å; N62-A64 VanDerWaalsContact O-N 3.16Å; N62-A64 WeakPolarHBondContact OD1-CB 3.38Å; N62-A64 PolarHBondContact OD1-N 2.93Å; A64-A70 VanDerWaalsContact C-CB 3.43Å; A64-A70 WeakPolarHBondContact O-CB 3.19Å; A64-L86 HydrophobicContact CB-CD2 4.29Å; A64-L86 WeakPolarHBondContact O-CB 3.31Å; A64-L86 VanDerWaalsContact O-CD2 3.32Å; A64-L86 WeakPolarHBondContact O-CD2 3.44Å; A64-I106 HydrophobicContact CB-CD1 4.45Å; A64-I106 HydrophobicContact CB-CG2 4.41Å; A64-L108 HydrophobicContact CB-CD2 4.01Å; A64-V194 HydrophobicContact CB-CB 3.91Å; A64-V194 HydrophobicContact CB-CG2 3.74Å
65	S	95.6	Very high	83.2	Confident	19 Å²	19	69.5 Å²	69.5	13%	0.133	37%	0.369	C	S	.	.			trans	-70.9	138.5	175.5	-179.9	0	0	0	0	112.2	N62 E67 C68 G69 A70	N62-S65 WeakPolarHBondContact O-CB 3.36Å; N62-S65 PolarHBondContact O-N 3.49Å; S65-E67 PolarHBondContact O-N 3.49Å; S65-E67 WeakPolarHBondContact OG-CB 3.44Å; S65-E67 PolarHBondContact OG-N 2.88Å; S65-E67 VanDerWaalsContact OG-N 3.1Å; S65-C68 WeakPolarHBondContact O-CB 3.41Å; S65-C68 PolarHBondContact O-N 2.97Å; S65-C68 VanDerWaalsContact O-N 3.11Å; S65-G69 PolarHBondContact O-N 3.32Å; S65-A70 VanDerWaalsContact O-CB 3.31Å; S65-A70 WeakPolarHBondContact O-CB 3.26Å; S65-A70 PolarHBondContact O-N 3.47Å; S65-A70 VanDerWaalsContact O-N 3.13Å
66	V	95.1	Very high	86	Confident	57 Å²	57	64 Å²	64	35%	0.345	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-57.4	-27.5	168	-63.7	0	0	0	0	112.7	C68 G69 L86 M87	V66-C68 VanDerWaalsContact C-N 3.32Å; V66-G69 WeakPolarHBondContact O-CA 3.4Å; V66-G69 PolarHBondContact O-N 3.22Å; V66-L86 HydrophobicContact CG1-CB 3.56Å; V66-L86 HydrophobicContact CG1-CD1 4.48Å; V66-L86 PolarHBondContact N-O 2.93Å; V66-M87 HydrophobicContact CG1-CG 4.05Å; V66-M87 HydrophobicContact CG2-CG 3.9Å
67	E	93.4	Very high	88.6	Confident	184 Å²	184	63.8 Å²	63.8	86%	0.86	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-73.5	-26.8	-180	-56.9	-175.7	152.1	0	0	112	S65 G69	S65-E67 PolarHBondContact O-N 3.49Å; S65-E67 WeakPolarHBondContact OG-CB 3.44Å; S65-E67 PolarHBondContact OG-N 2.88Å; S65-E67 VanDerWaalsContact OG-N 3.1Å; E67-G69 VanDerWaalsContact C-N 3.26Å
68	C	93.6	Very high	90.7	Very high	61 Å²	61	65.3 Å²	65.3	41%	0.412	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-76.8	-15.6	168.6	-162.8	0	0	0	0	111.9	S65 V66 C109	S65-C68 WeakPolarHBondContact O-CB 3.41Å; S65-C68 PolarHBondContact O-N 2.97Å; S65-C68 VanDerWaalsContact O-N 3.11Å; V66-C68 VanDerWaalsContact C-N 3.32Å; C68-C109 HydrophobicContact CB-CB 3.71Å; C68-C109 WeakPolarHBondContact CB-SG 3.36Å; C68-C109 WeakPolarHBondContact O-CB 3.35Å; C68-C109 WeakPolarHBondContact SG-CB 3.36Å; C68-C109 CovalentContact SG-SG 2.04Å; C68-C109 PolarHBondContact SG-SG 2.86Å
69	G	95.1	Very high	92.9	Very high	50 Å²	50	59.8 Å²	59.8	52%	0.515	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.9	12.2	-174.2	0	0	0	0	0	114.8	S65 V66 E67	S65-G69 PolarHBondContact O-N 3.32Å; V66-G69 WeakPolarHBondContact O-CA 3.4Å; V66-G69 PolarHBondContact O-N 3.22Å; E67-G69 VanDerWaalsContact C-N 3.26Å
70	A	97.4	Very high	94.1	Very high	6 Å²	6	63.3 Å²	63.3	5%	0.05	34%	0.335	C	S	.	.			trans	-69.1	154	174.3	0	0	0	0	0	112.2	Y63 A64 S65 E107	Y63-A70 WeakPolarHBondContact O-CB 3.46Å; A64-A70 VanDerWaalsContact C-CB 3.43Å; A64-A70 WeakPolarHBondContact O-CB 3.19Å; S65-A70 VanDerWaalsContact O-CB 3.31Å; S65-A70 WeakPolarHBondContact O-CB 3.26Å; S65-A70 PolarHBondContact O-N 3.47Å; S65-A70 VanDerWaalsContact O-N 3.13Å; A70-E107 VanDerWaalsContact CA-O 3.29Å; A70-E107 WeakPolarHBondContact CA-O 3.43Å; A70-E107 WeakPolarHBondContact CB-O 3.45Å
71	K	96.7	Very high	95.2	Very high	94 Å²	94	58 Å²	58	41%	0.409	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	152.4	-173.9	63.5	-168.1	170.5	-179.4	0	112.4	L73 I106 E107	K71-L73 HydrophobicContact CD-CD2 4.37Å; K71-L73 HydrophobicContact CG-CD2 4.38Å; K71-I106 WeakPolarHBondContact O-CA 3.37Å; K71-E107 WeakPolarHBondContact CE-OE2 3.48Å; K71-E107 HydrophobicContact CG-CB 4.05Å; K71-E107 PolarHBondContact N-O 2.98Å; K71-E107 IonicContact NZ-OE1 2.65Å; K71-E107 PolarHBondContact NZ-OE1 3.01Å; K71-E107 VanDerWaalsContact NZ-OE1 3.16Å; K71-E107 IonicContact NZ-OE2 3.17Å; K71-E107 PolarHBondContact NZ-OE2 2.87Å; K71-E107 PolarHBondContact O-N 2.85Å
72	I	97.1	Very high	95.5	Very high	31 Å²	31	56.8 Å²	56.8	16%	0.159	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	128.5	167.9	-53	-58.3	0	0	0	109.1	M82 I85 L86 F104 V105 I106	I72-M82 HydrophobicContact CB-CB 4.42Å; I72-M82 HydrophobicContact CG1-CB 4.25Å; I72-M82 HydrophobicContact CG2-CB 4.21Å; I72-M82 HydrophobicContact CG2-SD 4.41Å; I72-I85 HydrophobicContact CD1-CD1 4.01Å; I72-I85 HydrophobicContact CD1-CG1 4.22Å; I72-L86 HydrophobicContact CD1-CD1 3.76Å; I72-L86 HydrophobicContact CD1-CD2 3.93Å; I72-L86 HydrophobicContact CD1-CG 3.91Å; I72-L86 HydrophobicContact CG1-CD1 3.87Å; I72-L86 HydrophobicContact CG1-CG 4.28Å; I72-F104 HydrophobicContact CD1-CD2 4.45Å; I72-V105 WeakPolarHBondContact CA-O 3.25Å; I72-I106 HydrophobicContact CD1-CG1 3.9Å
73	L	95.6	Very high	95.5	Very high	55 Å²	55	58.8 Å²	58.8	29%	0.288	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	-36	176.3	-70.9	-176.3	0	0	0	113.4	K71 V105 E107 Y140 Y172	K71-L73 HydrophobicContact CD-CD2 4.37Å; K71-L73 HydrophobicContact CG-CD2 4.38Å; L73-V105 HydrophobicContact CB-CG1 4.41Å; L73-V105 HydrophobicContact CD1-CG1 4.48Å; L73-V105 PolarHBondContact N-O 3.23Å; L73-E107 HydrophobicContact CD1-CB 3.89Å; L73-E107 HydrophobicContact CD2-CB 4.3Å; L73-E107 HydrophobicContact CG-CB 3.91Å; L73-Y140 HydrophobicContact CB-CE1 4.15Å; L73-Y140 HydrophobicContact CB-CE2 4.39Å; L73-Y140 HydrophobicContact CD1-CD1 3.56Å; L73-Y140 HydrophobicContact CD1-CD2 3.98Å; L73-Y140 HydrophobicContact CD1-CE1 3.86Å; L73-Y140 HydrophobicContact CD1-CE2 4.26Å; L73-Y140 HydrophobicContact CD1-CG 3.6Å; L73-Y172 HydrophobicContact CD1-CD1 3.58Å; L73-Y172 HydrophobicContact CD1-CE1 3.57Å
74	S	95.3	Very high	95.5	Very high	27 Å²	27	58.4 Å²	58.4	19%	0.189	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	155.7	178.7	50.2	0	0	0	0	110.8	F104 V105 Y140	S74-F104 CarbonylContact O-C 3.55Å; S74-F104 VanDerWaalsContact O-CA 3.3Å; S74-F104 WeakPolarHBondContact O-CA 3.43Å; S74-V105 PolarHBondContact O-N 3.49Å; S74-Y140 WeakPolarHBondContact CB-OH 3.48Å; S74-Y140 PolarHBondContact OG-OH 3.39Å
75	A	96.4	Very high	95.4	Very high	12 Å²	12	58.4 Å²	58.4	10%	0.099	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	176.6	171.5	0	0	0	0	0	109.9	A79 M82 W103 F104	A75-A79 HydrophobicContact CB-CB 4.02Å; A75-M82 HydrophobicContact CB-CG 4.06Å; A75-M82 HydrophobicContact CB-SD 3.56Å; A75-M82 VanDerWaalsContact CB-SD 3.56Å; A75-W103 CarbonylContact C-O 3.56Å; A75-W103 WeakPolarHBondContact CA-O 3.39Å; A75-W103 WeakPolarHBondContact CB-O 3.17Å; A75-W103 WeakPolarHBondContact O-CH2 3.48Å; A75-W103 WeakPolarHBondContact O-CZ2 3.43Å; A75-F104 HydrophobicContact CB-CB 3.86Å
76	N	95.7	Very high	95.5	Very high	12 Å²	12	57.6 Å²	57.6	6%	0.064	32%	0.322	C	S	.	.			trans	-62.7	143.5	169.9	71	-70.2	0	0	0	111.3	E78 A79 N96 K101 W103	N76-E78 PolarHBondContact O-N 3.33Å; N76-A79 VanDerWaalsContact O-CB 3.27Å; N76-A79 WeakPolarHBondContact O-CB 3.41Å; N76-A79 PolarHBondContact O-N 3.29Å; N76-N96 PolarHBondContact ND2-OD1 2.98Å; N76-N96 PolarHBondContact OD1-ND2 2.93Å; N76-K101 WeakPolarHBondContact CB-O 3.1Å; N76-W103 HydrophobicContact CB-CG 4.41Å; N76-W103 PolarHBondContact N-O 2.95Å; N76-W103 PolarHBondContact OD1-N 3.26Å; N76-W103 PolarHBondContact OD1-O 3.45Å
77	N	95	Very high	95.4	Very high	169 Å²	169	58.2 Å²	58.2	90%	0.904	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-14.2	-169.6	-61.4	-5.9	0	0	0	115.8
78	E	95.1	Very high	95.3	Very high	87 Å²	87	56.1 Å²	56.1	41%	0.407	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-11.4	-178.6	-61.5	177.1	-179.3	0	0	113	N76 K80 P97 T100	N76-E78 PolarHBondContact O-N 3.33Å; E78-K80 PolarHBondContact O-N 3.25Å; E78-P97 HydrophobicContact CB-CG 4.26Å; E78-P97 WeakPolarHBondContact OE2-CG 3.45Å; E78-T100 WeakPolarHBondContact OE2-CB 3.38Å; E78-T100 WeakPolarHBondContact OE2-CG2 3.02Å; E78-T100 PolarHBondContact OE2-OG1 3.49Å
79	A	95.6	Very high	95.1	Very high	14 Å²	14	56.1 Å²	56.1	12%	0.116	31%	0.308	C	S	.	.			trans	-65.2	123.4	-179.9	0	0	0	0	0	111.5	A75 N76 M82 M94 N96	A75-A79 HydrophobicContact CB-CB 4.02Å; N76-A79 VanDerWaalsContact O-CB 3.27Å; N76-A79 WeakPolarHBondContact O-CB 3.41Å; N76-A79 PolarHBondContact O-N 3.29Å; A79-M82 HydrophobicContact CB-CG 3.83Å; A79-M82 HydrophobicContact CB-SD 4.47Å; A79-M94 HydrophobicContact CB-CG 4.34Å; A79-M94 HydrophobicContact CB-SD 4.06Å; A79-N96 WeakPolarHBondContact CB-ND2 3.48Å
80	K	95.7	Very high	94.7	Very high	130 Å²	130	59.5 Å²	59.5	57%	0.565	31%	0.312	S	S	*	.	B	Isolated β-bridge	trans	-107	144.7	175.2	-64.9	168	-171	168.9	0	109.5	E78 M82 M94 L95	E78-K80 PolarHBondContact O-N 3.25Å; K80-M82 VanDerWaalsContact C-N 3.3Å; K80-M82 PolarHBondContact O-N 3.47Å; K80-M94 CarbonylContact O-C 3.6Å; K80-M94 VanDerWaalsContact O-CA 3.3Å; K80-M94 WeakPolarHBondContact O-CA 3.31Å; K80-L95 HydrophobicContact CB-CB 4.39Å; K80-L95 PolarHBondContact N-O 3.4Å; K80-L95 PolarHBondContact O-N 3.49Å
81	S	95.1	Very high	94.3	Very high	70 Å²	70	66 Å²	66	49%	0.49	35%	0.346	S	S	.	.	S	Bend	trans	56.8	39.1	177.6	-162.2	0	0	0	0	114.2	S83 A84 Y93	S81-S83 PolarHBondContact O-N 2.95Å; S81-S83 VanDerWaalsContact O-N 3.08Å; S81-A84 VanDerWaalsContact O-CB 3.26Å; S81-A84 WeakPolarHBondContact O-CB 3.45Å; S81-A84 PolarHBondContact O-N 3Å; S81-Y93 WeakPolarHBondContact CB-O 3.33Å
82	M	95.4	Very high	94.1	Very high	76 Å²	76	64.6 Å²	64.6	37%	0.374	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-47.8	-39.9	-175.6	-63.9	171	-77	0	0	114.5	I72 A75 A79 K80 A84 M94	I72-M82 HydrophobicContact CB-CB 4.42Å; I72-M82 HydrophobicContact CG1-CB 4.25Å; I72-M82 HydrophobicContact CG2-CB 4.21Å; I72-M82 HydrophobicContact CG2-SD 4.41Å; A75-M82 HydrophobicContact CB-CG 4.06Å; A75-M82 HydrophobicContact CB-SD 3.56Å; A75-M82 VanDerWaalsContact CB-SD 3.56Å; A79-M82 HydrophobicContact CB-CG 3.83Å; A79-M82 HydrophobicContact CB-SD 4.47Å; K80-M82 VanDerWaalsContact C-N 3.3Å; K80-M82 PolarHBondContact O-N 3.47Å; M82-A84 PolarHBondContact O-N 2.89Å; M82-M94 HydrophobicContact CG-SD 4.43Å
83	S	93.7	Very high	94	Very high	70 Å²	70	66.6 Å²	66.6	49%	0.49	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-70.4	-12.9	-177.1	55.6	0	0	0	0	114.6	S81 I85 L86	S81-S83 PolarHBondContact O-N 2.95Å; S81-S83 VanDerWaalsContact O-N 3.08Å; S83-I85 VanDerWaalsContact C-N 3.3Å; S83-I85 PolarHBondContact O-N 3.31Å; S83-L86 PolarHBondContact O-N 3.4Å
84	A	95.6	Very high	94	Very high	2 Å²	2	64.1 Å²	64.1	2%	0.017	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-61.5	-36.1	-177.7	0	0	0	0	0	113	S81 M82 L86 M87 L92 Y93	S81-A84 VanDerWaalsContact O-CB 3.26Å; S81-A84 WeakPolarHBondContact O-CB 3.45Å; S81-A84 PolarHBondContact O-N 3Å; M82-A84 PolarHBondContact O-N 2.89Å; A84-L86 PolarHBondContact O-N 3.25Å; A84-L86 VanDerWaalsContact O-N 3.11Å; A84-M87 WeakPolarHBondContact O-CB 3.42Å; A84-M87 PolarHBondContact O-N 3.43Å; A84-L92 HydrophobicContact CB-CB 3.9Å; A84-Y93 VanDerWaalsContact CB-C 3.47Å
85	I	96.4	Very high	94	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-64.9	-18.3	-177.3	67.2	-176.5	0	0	0	113.8	I72 S83 M87 M94 F104 L189 I192	I72-I85 HydrophobicContact CD1-CD1 4.01Å; I72-I85 HydrophobicContact CD1-CG1 4.22Å; S83-I85 VanDerWaalsContact C-N 3.3Å; S83-I85 PolarHBondContact O-N 3.31Å; I85-M87 VanDerWaalsContact C-N 3.3Å; I85-M94 HydrophobicContact CD1-CE 4.44Å; I85-M94 HydrophobicContact CG2-CB 3.65Å; I85-F104 HydrophobicContact CD1-CD2 3.71Å; I85-F104 HydrophobicContact CD1-CE1 4.31Å; I85-F104 HydrophobicContact CD1-CE2 3.46Å; I85-F104 VanDerWaalsContact CD1-CE2 3.46Å; I85-F104 HydrophobicContact CD1-CG 4.24Å; I85-F104 HydrophobicContact CD1-CZ 3.78Å; I85-L189 HydrophobicContact CB-CD2 4.47Å; I85-L189 HydrophobicContact CD1-CD2 4.16Å; I85-L189 HydrophobicContact CG2-CB 3.95Å; I85-L189 HydrophobicContact CG2-CD2 3.97Å; I85-L189 HydrophobicContact CG2-CG 3.77Å; I85-L189 WeakPolarHBondContact CG2-O 3.39Å; I85-I192 HydrophobicContact CB-CG2 4.07Å; I85-I192 HydrophobicContact CD1-CG2 3.95Å; I85-I192 HydrophobicContact CG1-CG2 3.82Å; I85-I192 PolarHBondContact O-N 2.86Å
86	L	95.9	Very high	94	Very high	2 Å²	2	64.3 Å²	64.3	1%	0.01	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-89.8	3.1	177.7	-52.8	-176.6	0	0	0	112.2	A64 V66 I72 S83 A84 I106 I192	A64-L86 HydrophobicContact CB-CD2 4.29Å; A64-L86 WeakPolarHBondContact O-CB 3.31Å; A64-L86 VanDerWaalsContact O-CD2 3.32Å; A64-L86 WeakPolarHBondContact O-CD2 3.44Å; V66-L86 HydrophobicContact CG1-CB 3.56Å; V66-L86 HydrophobicContact CG1-CD1 4.48Å; V66-L86 PolarHBondContact N-O 2.93Å; I72-L86 HydrophobicContact CD1-CD1 3.76Å; I72-L86 HydrophobicContact CD1-CD2 3.93Å; I72-L86 HydrophobicContact CD1-CG 3.91Å; I72-L86 HydrophobicContact CG1-CD1 3.87Å; I72-L86 HydrophobicContact CG1-CG 4.28Å; S83-L86 PolarHBondContact O-N 3.4Å; A84-L86 PolarHBondContact O-N 3.25Å; A84-L86 VanDerWaalsContact O-N 3.11Å; L86-I106 HydrophobicContact CD1-CG2 4.47Å; L86-I106 HydrophobicContact CD2-CD1 3.91Å; L86-I106 HydrophobicContact CD2-CG1 4.27Å; L86-I106 HydrophobicContact CD2-CG2 3.94Å; L86-I192 HydrophobicContact CD2-CG2 3.89Å
87	M	93.3	Very high	94	Very high	70 Å²	70	65.2 Å²	65.2	35%	0.345	34%	0.339	S	S	.	.	S	Bend	trans	-113.9	139.1	179.3	-57	-175.9	65	0	0	110.2	V66 A84 I85 N89 L92	V66-M87 HydrophobicContact CG1-CG 4.05Å; V66-M87 HydrophobicContact CG2-CG 3.9Å; A84-M87 WeakPolarHBondContact O-CB 3.42Å; A84-M87 PolarHBondContact O-N 3.43Å; I85-M87 VanDerWaalsContact C-N 3.3Å; M87-N89 PolarHBondContact O-N 2.91Å; M87-L92 HydrophobicContact CE-CD1 4.17Å; M87-L92 HydrophobicContact SD-CD1 4.02Å
88	E	91.4	Very high	94	Very high	140 Å²	140	57.9 Å²	57.9	65%	0.654	30%	0.301	S	S	*	.			trans	-83.3	50.3	176.8	-164.5	144.7	147.6	0	0	112.2	R193	E88-R193 IonicContact OE1-CZ 3.81Å; E88-R193 IonicContact OE1-NH2 2.69Å; E88-R193 PolarHBondContact OE1-NH2 3.06Å; E88-R193 IonicContact OE2-CZ 2.65Å; E88-R193 VanDerWaalsContact OE2-CZ 3.29Å; E88-R193 IonicContact OE2-NE 2.72Å; E88-R193 PolarHBondContact OE2-NE 2.87Å; E88-R193 IonicContact OE2-NH2 2.65Å; E88-R193 PolarHBondContact OE2-NH2 2.75Å
89	N	89.7	Confident	93.9	Very high	62 Å²	62	59 Å²	59	33%	0.332	32%	0.318	S	S	.	.			trans	-119.7	117.5	-177.7	-173.7	-38.5	0	0	0	110.8	M87 D91 L92	M87-N89 PolarHBondContact O-N 2.91Å; N89-D91 VanDerWaalsContact C-N 3.32Å; N89-D91 PolarHBondContact O-N 3.23Å; N89-D91 WeakPolarHBondContact OD1-CB 3.38Å; N89-D91 PolarHBondContact OD1-N 3.13Å; N89-L92 HydrophobicContact CB-CB 4.31Å; N89-L92 HydrophobicContact CB-CD1 4.03Å; N89-L92 HydrophobicContact CB-CG 4.16Å; N89-L92 PolarHBondContact O-N 3.17Å
90	M	87.6	Confident	93.9	Very high	120 Å²	120	60.5 Å²	60.5	59%	0.591	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-22.8	-174.1	-53.5	-167.1	79.7	0	0	114.2	L92 F122	M90-L92 VanDerWaalsContact C-N 3.27Å; M90-F122 HydrophobicContact CB-CD2 4.14Å; M90-F122 HydrophobicContact CE-CB 4.11Å; M90-F122 HydrophobicContact CE-CD1 3.53Å; M90-F122 HydrophobicContact CE-CD2 3.6Å; M90-F122 HydrophobicContact CE-CE1 3.74Å; M90-F122 HydrophobicContact CE-CE2 3.82Å; M90-F122 HydrophobicContact CE-CG 3.47Å; M90-F122 VanDerWaalsContact CE-CG 3.47Å; M90-F122 HydrophobicContact CE-CZ 3.88Å; M90-F122 HydrophobicContact CG-CD2 4.1Å; M90-F122 HydrophobicContact CG-CE2 4.17Å
91	D	88.7	Confident	93.8	Very high	144 Å²	144	59.9 Å²	59.9	77%	0.77	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-8.1	176.4	-63.7	-33.5	0	0	0	112.6	N89	N89-D91 VanDerWaalsContact C-N 3.32Å; N89-D91 PolarHBondContact O-N 3.23Å; N89-D91 WeakPolarHBondContact OD1-CB 3.38Å; N89-D91 PolarHBondContact OD1-N 3.13Å
92	L	92.8	Very high	93.9	Very high	63 Å²	63	57 Å²	57	33%	0.33	30%	0.303	S	S	.	.			trans	-112.2	135.8	-177.3	-60.2	-178.2	0	0	0	110.6	A84 M87 N89 M90	A84-L92 HydrophobicContact CB-CB 3.9Å; M87-L92 HydrophobicContact CE-CD1 4.17Å; M87-L92 HydrophobicContact SD-CD1 4.02Å; N89-L92 HydrophobicContact CB-CB 4.31Å; N89-L92 HydrophobicContact CB-CD1 4.03Å; N89-L92 HydrophobicContact CB-CG 4.16Å; N89-L92 PolarHBondContact O-N 3.17Å; M90-L92 VanDerWaalsContact C-N 3.27Å
93	Y	94.8	Very high	93.9	Very high	74 Å²	74	56.8 Å²	56.8	29%	0.29	30%	0.298	S	S	.	.			trans	-148.7	153.1	176	44.2	-106.4	0	0	0	111.5	S81 A84 L95 E123 P188 L189	S81-Y93 WeakPolarHBondContact CB-O 3.33Å; A84-Y93 VanDerWaalsContact CB-C 3.47Å; Y93-L95 HydrophobicContact CD2-CB 4.22Å; Y93-L95 HydrophobicContact CD2-CD1 4.47Å; Y93-L95 HydrophobicContact CE2-CB 4.33Å; Y93-L95 HydrophobicContact CE2-CD1 4.1Å; Y93-E123 HydrophobicContact CE1-CB 4.44Å; Y93-E123 WeakPolarHBondContact CE1-OE2 3.38Å; Y93-E123 PolarHBondContact OH-OE2 3.5Å; Y93-P188 HydrophobicContact CD2-CB 3.97Å; Y93-P188 HydrophobicContact CE2-CB 4.48Å; Y93-P188 HydrophobicContact CG-CB 4.19Å; Y93-L189 CarbonylContact C-O 3.59Å; Y93-L189 VanDerWaalsContact CA-O 3.26Å; Y93-L189 WeakPolarHBondContact CA-O 3.45Å; Y93-L189 WeakPolarHBondContact CB-O 3.44Å
94	M	95.9	Very high	94.1	Very high	2 Å²	2	53.7 Å²	53.7	1%	0.01	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-75	129.7	160.3	175.9	-177	63.1	0	0	107.8	A79 K80 M82 I85 F104 P188 L189	A79-M94 HydrophobicContact CB-CG 4.34Å; A79-M94 HydrophobicContact CB-SD 4.06Å; K80-M94 CarbonylContact O-C 3.6Å; K80-M94 VanDerWaalsContact O-CA 3.3Å; K80-M94 WeakPolarHBondContact O-CA 3.31Å; M82-M94 HydrophobicContact CG-SD 4.43Å; I85-M94 HydrophobicContact CD1-CE 4.44Å; I85-M94 HydrophobicContact CG2-CB 3.65Å; M94-F104 HydrophobicContact CE-CD1 3.65Å; M94-F104 HydrophobicContact CE-CE1 3.72Å; M94-F104 HydrophobicContact SD-CD1 4.31Å; M94-P188 CarbonylContact O-C 3.59Å; M94-P188 WeakPolarHBondContact O-CA 3.36Å; M94-L189 HydrophobicContact CE-CB 4.07Å; M94-L189 HydrophobicContact CE-CD2 4.24Å; M94-L189 PolarHBondContact N-O 2.99Å; M94-L189 PolarHBondContact O-N 2.56Å
95	L	95	Very high	94.2	Very high	42 Å²	42	53.7 Å²	53.7	22%	0.22	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-109.1	133.5	179.6	-174.4	68.8	0	0	0	110.5	K80 Y93 F186 P188	K80-L95 HydrophobicContact CB-CB 4.39Å; K80-L95 PolarHBondContact N-O 3.4Å; K80-L95 PolarHBondContact O-N 3.49Å; Y93-L95 HydrophobicContact CD2-CB 4.22Å; Y93-L95 HydrophobicContact CD2-CD1 4.47Å; Y93-L95 HydrophobicContact CE2-CB 4.33Å; Y93-L95 HydrophobicContact CE2-CD1 4.1Å; L95-F186 HydrophobicContact CD1-CB 3.67Å; L95-F186 HydrophobicContact CD1-CD1 3.85Å; L95-F186 HydrophobicContact CD1-CG 3.81Å; L95-F186 HydrophobicContact CD2-CD1 4.26Å; L95-F186 HydrophobicContact CD2-CE1 4.36Å; L95-F186 HydrophobicContact CG-CD1 3.91Å; L95-F186 HydrophobicContact CG-CE1 4.4Å; L95-F186 HydrophobicContact CG-CG 4.35Å; L95-P188 HydrophobicContact CD1-CB 4.12Å
96	N	96.5	Very high	94.2	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.005	28%	0.275	C	S	.	.			trans	-146.2	141.9	-176.6	-127.5	-36	0	0	0	110.8	N76 A79 I102 F186 C187	N76-N96 PolarHBondContact ND2-OD1 2.98Å; N76-N96 PolarHBondContact OD1-ND2 2.93Å; A79-N96 WeakPolarHBondContact CB-ND2 3.48Å; N96-I102 HydrophobicContact CB-CD1 3.83Å; N96-I102 HydrophobicContact CB-CG1 3.83Å; N96-F186 WeakPolarHBondContact O-CA 3.49Å; N96-C187 PolarHBondContact O-N 2.97Å
97	P	95.7	Very high	94.3	Very high	31 Å²	31	54.9 Å²	54.9	20%	0.201	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-65.6	134.8	171	-19.9	34.5	0	0	0	111.3	E78 S99 H185 F186	E78-P97 HydrophobicContact CB-CG 4.26Å; E78-P97 WeakPolarHBondContact OE2-CG 3.45Å; P97-S99 PolarHBondContact O-N 3.45Å; P97-H185 WeakPolarHBondContact CA-O 3.42Å; P97-F186 HydrophobicContact CG-CE1 4.45Å
98	C	94.9	Very high	94.5	Very high	16 Å²	16	51.5 Å²	51.5	11%	0.108	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-16	178	-70.2	0	0	0	0	114.1	T100 S127 H180 E184 H185 F186 C187	C98-T100 VanDerWaalsContact C-N 3.33Å; C98-T100 PolarHBondContact O-N 3.42Å; C98-S127 WeakPolarHBondContact SG-CB 3.23Å; C98-H180 PolarHBondContact O-CE1 3.3Å; C98-E184 PolarHBondContact SG-O 3.29Å; C98-H185 PolarHBondContact N-O 2.97Å; C98-F186 PolarHBondContact SG-O 3.43Å; C98-C187 VanDerWaalsContact CA-SG 3.53Å; C98-C187 HydrophobicContact CB-CB 4.16Å; C98-C187 WeakPolarHBondContact CB-SG 3.38Å; C98-C187 WeakPolarHBondContact SG-CA 3.37Å; C98-C187 WeakPolarHBondContact SG-CB 3.33Å; C98-C187 PolarHBondContact SG-N 3.19Å; C98-C187 CovalentContact SG-SG 2.04Å; C98-C187 PolarHBondContact SG-SG 2.75Å
99	S	92.8	Very high	94.7	Very high	109 Å²	109	46.2 Å²	46.2	76%	0.762	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-6.7	-175.6	53.6	0	0	0	0	114.7	P97	P97-S99 PolarHBondContact O-N 3.45Å
100	T	94.1	Very high	94.9	Very high	47 Å²	47	46.9 Å²	46.9	29%	0.288	24%	0.243	S	C	.	.	S	Bend	trans	-125.2	165.1	-175.2	65.4	0	0	0	0	112	E78 C98 I102	E78-T100 WeakPolarHBondContact OE2-CB 3.38Å; E78-T100 WeakPolarHBondContact OE2-CG2 3.02Å; E78-T100 PolarHBondContact OE2-OG1 3.49Å; C98-T100 VanDerWaalsContact C-N 3.33Å; C98-T100 PolarHBondContact O-N 3.42Å; T100-I102 PolarHBondContact O-N 3Å
101	K	94.6	Very high	95.3	Very high	117 Å²	117	43.7 Å²	43.7	51%	0.509	23%	0.231	S	C	.	.			trans	-75.6	100.1	-177.4	-170.5	177	179.6	-178.7	0	110.4	N76 W103 E176	N76-K101 WeakPolarHBondContact CB-O 3.1Å; K101-W103 VanDerWaalsContact O-CD1 3.29Å; K101-E176 VanDerWaalsContact CE-OE2 3.23Å; K101-E176 WeakPolarHBondContact CE-OE2 3.49Å; K101-E176 IonicContact NZ-OE1 3.06Å; K101-E176 IonicContact NZ-OE2 3.6Å; K101-E176 PolarHBondContact NZ-OE2 2.72Å
102	I	96.5	Very high	95.5	Very high	9 Å²	9	36.8 Å²	36.8	5%	0.046	20%	0.195	C	C	.	.			trans	-73	121.7	176.5	-63.8	168	0	0	0	109.5	N96 T100 L177 C187	N96-I102 HydrophobicContact CB-CD1 3.83Å; N96-I102 HydrophobicContact CB-CG1 3.83Å; T100-I102 PolarHBondContact O-N 3Å; I102-L177 HydrophobicContact CB-CB 4.05Å; I102-L177 HydrophobicContact CD1-CD2 4.07Å; I102-L177 HydrophobicContact CG2-CB 4Å; I102-L177 HydrophobicContact CG2-CD2 4.37Å; I102-L177 PolarHBondContact O-N 3.06Å; I102-C187 HydrophobicContact CD1-CB 3.54Å
103	W	96.4	Very high	95.6	Very high	72 Å²	72	34.5 Å²	34.5	27%	0.273	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	153	173.7	64.4	-92.1	0	0	0	111.3	A75 N76 K101 V105 V175 E176	A75-W103 CarbonylContact C-O 3.56Å; A75-W103 WeakPolarHBondContact CA-O 3.39Å; A75-W103 WeakPolarHBondContact CB-O 3.17Å; A75-W103 WeakPolarHBondContact O-CH2 3.48Å; A75-W103 WeakPolarHBondContact O-CZ2 3.43Å; N76-W103 HydrophobicContact CB-CG 4.41Å; N76-W103 PolarHBondContact N-O 2.95Å; N76-W103 PolarHBondContact OD1-N 3.26Å; N76-W103 PolarHBondContact OD1-O 3.45Å; K101-W103 VanDerWaalsContact O-CD1 3.29Å; W103-V105 HydrophobicContact CE3-CG2 4.46Å; W103-V105 HydrophobicContact CZ3-CG2 4.27Å; W103-V175 CarbonylContact C-O 3.56Å; W103-V175 VanDerWaalsContact CA-O 3.23Å; W103-V175 WeakPolarHBondContact CA-O 3.44Å; W103-V175 WeakPolarHBondContact CB-O 3.48Å; W103-E176 HydrophobicContact CB-CB 4.26Å; W103-E176 HydrophobicContact CB-CG 3.96Å
104	F	97.2	Very high	95.5	Very high	4 Å²	4	31 Å²	31	2%	0.018	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	158.2	175.7	52.7	-87.4	0	0	0	112.1	I72 S74 A75 I85 M94 I106 K174 V175 L189 I192	I72-F104 HydrophobicContact CD1-CD2 4.45Å; S74-F104 CarbonylContact O-C 3.55Å; S74-F104 VanDerWaalsContact O-CA 3.3Å; S74-F104 WeakPolarHBondContact O-CA 3.43Å; A75-F104 HydrophobicContact CB-CB 3.86Å; I85-F104 HydrophobicContact CD1-CD2 3.71Å; I85-F104 HydrophobicContact CD1-CE1 4.31Å; I85-F104 HydrophobicContact CD1-CE2 3.46Å; I85-F104 VanDerWaalsContact CD1-CE2 3.46Å; I85-F104 HydrophobicContact CD1-CG 4.24Å; I85-F104 HydrophobicContact CD1-CZ 3.78Å; M94-F104 HydrophobicContact CE-CD1 3.65Å; M94-F104 HydrophobicContact CE-CE1 3.72Å; M94-F104 HydrophobicContact SD-CD1 4.31Å; F104-I106 HydrophobicContact CD2-CD1 4.45Å; F104-I106 HydrophobicContact CD2-CG1 4.13Å; F104-I106 HydrophobicContact CE2-CD1 4.19Å; F104-I106 HydrophobicContact CE2-CG1 4.37Å; F104-K174 WeakPolarHBondContact O-CA 3.1Å; F104-V175 HydrophobicContact CD2-CB 4.3Å; F104-V175 HydrophobicContact CE1-CB 4.06Å; F104-V175 HydrophobicContact CE1-CG1 4.19Å; F104-V175 HydrophobicContact CE2-CB 3.74Å; F104-V175 HydrophobicContact CE2-CG1 4.47Å; F104-V175 HydrophobicContact CE2-CG2 3.82Å; F104-V175 HydrophobicContact CZ-CB 3.6Å; F104-V175 HydrophobicContact CZ-CG1 3.87Å; F104-V175 HydrophobicContact CZ-CG2 4.02Å; F104-V175 PolarHBondContact N-O 3.05Å; F104-V175 PolarHBondContact O-N 3.27Å; F104-L189 HydrophobicContact CE1-CD2 3.77Å; F104-L189 HydrophobicContact CZ-CD2 3.5Å; F104-I192 HydrophobicContact CE2-CD1 3.86Å; F104-I192 HydrophobicContact CZ-CD1 4.08Å
105	V	97.6	Very high	95.3	Very high	3 Å²	3	32.7 Å²	32.7	2%	0.018	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	125.6	177.6	-179.7	0	0	0	0	109.6	I72 L73 S74 W103 Y140 W145 V173 K174	I72-V105 WeakPolarHBondContact CA-O 3.25Å; L73-V105 HydrophobicContact CB-CG1 4.41Å; L73-V105 HydrophobicContact CD1-CG1 4.48Å; L73-V105 PolarHBondContact N-O 3.23Å; S74-V105 PolarHBondContact O-N 3.49Å; W103-V105 HydrophobicContact CE3-CG2 4.46Å; W103-V105 HydrophobicContact CZ3-CG2 4.27Å; V105-Y140 HydrophobicContact CB-CE2 4.32Å; V105-Y140 HydrophobicContact CG1-CD2 3.94Å; V105-Y140 HydrophobicContact CG1-CE2 3.86Å; V105-Y140 HydrophobicContact CG2-CE2 4.36Å; V105-W145 HydrophobicContact CG1-CH2 3.76Å; V105-W145 HydrophobicContact CG1-CZ2 4.4Å; V105-W145 HydrophobicContact CG2-CH2 4.14Å; V105-W145 HydrophobicContact CG2-CZ2 4.17Å; V105-V173 CarbonylContact C-O 3.51Å; V105-V173 WeakPolarHBondContact CA-O 3.3Å; V105-K174 HydrophobicContact CG2-CB 4.1Å; V105-K174 HydrophobicContact CG2-CD 4.27Å; V105-K174 HydrophobicContact CG2-CG 3.87Å
106	I	97.8	Very high	95.3	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	132.3	175.7	-45.6	178	0	0	0	108.3	A64 K71 I72 L86 F104 L108 Y172 V173 I192	A64-I106 HydrophobicContact CB-CD1 4.45Å; A64-I106 HydrophobicContact CB-CG2 4.41Å; K71-I106 WeakPolarHBondContact O-CA 3.37Å; I72-I106 HydrophobicContact CD1-CG1 3.9Å; L86-I106 HydrophobicContact CD1-CG2 4.47Å; L86-I106 HydrophobicContact CD2-CD1 3.91Å; L86-I106 HydrophobicContact CD2-CG1 4.27Å; L86-I106 HydrophobicContact CD2-CG2 3.94Å; F104-I106 HydrophobicContact CD2-CD1 4.45Å; F104-I106 HydrophobicContact CD2-CG1 4.13Å; F104-I106 HydrophobicContact CE2-CD1 4.19Å; F104-I106 HydrophobicContact CE2-CG1 4.37Å; I106-L108 HydrophobicContact CG2-CD2 4.2Å; I106-Y172 VanDerWaalsContact O-CA 3.32Å; I106-Y172 WeakPolarHBondContact O-CA 3.36Å; I106-V173 PolarHBondContact N-O 2.61Å; I106-V173 PolarHBondContact O-N 2.68Å; I106-I192 HydrophobicContact CD1-CD1 4.05Å; I106-I192 HydrophobicContact CD1-CG2 3.74Å
107	E	97.8	Very high	95.2	Very high	26 Å²	26	33 Å²	33	12%	0.121	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	116.9	154.8	-178.6	173.1	152.1	0	0	107.7	A70 K71 L73 K171 Y172	A70-E107 VanDerWaalsContact CA-O 3.29Å; A70-E107 WeakPolarHBondContact CA-O 3.43Å; A70-E107 WeakPolarHBondContact CB-O 3.45Å; K71-E107 WeakPolarHBondContact CE-OE2 3.48Å; K71-E107 HydrophobicContact CG-CB 4.05Å; K71-E107 PolarHBondContact N-O 2.98Å; K71-E107 IonicContact NZ-OE1 2.65Å; K71-E107 PolarHBondContact NZ-OE1 3.01Å; K71-E107 VanDerWaalsContact NZ-OE1 3.16Å; K71-E107 IonicContact NZ-OE2 3.17Å; K71-E107 PolarHBondContact NZ-OE2 2.87Å; K71-E107 PolarHBondContact O-N 2.85Å; L73-E107 HydrophobicContact CD1-CB 3.89Å; L73-E107 HydrophobicContact CD2-CB 4.3Å; L73-E107 HydrophobicContact CG-CB 3.91Å; E107-K171 HydrophobicContact CG-CD 4.15Å; E107-K171 HydrophobicContact CG-CG 4.42Å; E107-K171 IonicContact OE1-NZ 2.88Å; E107-K171 PolarHBondContact OE1-NZ 3.47Å; E107-Y172 HydrophobicContact CB-CD1 3.81Å; E107-Y172 HydrophobicContact CB-CE1 3.69Å; E107-Y172 HydrophobicContact CG-CD1 3.97Å; E107-Y172 HydrophobicContact CG-CE1 3.44Å; E107-Y172 VanDerWaalsContact CG-CE1 3.44Å
108	L	96.9	Very high	95.2	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	155.2	171.8	-56.1	-179.4	0	0	0	109.7	Y63 A64 I106 E110 I112 K171 V173 V194	Y63-L108 WeakPolarHBondContact O-CA 3.4Å; A64-L108 HydrophobicContact CB-CD2 4.01Å; I106-L108 HydrophobicContact CG2-CD2 4.2Å; L108-E110 VanDerWaalsContact C-N 3.31Å; L108-E110 WeakPolarHBondContact CB-O 3.39Å; L108-E110 PolarHBondContact O-N 3.29Å; L108-I112 HydrophobicContact CD1-CD1 3.77Å; L108-I112 HydrophobicContact CD1-CG1 3.7Å; L108-K171 WeakPolarHBondContact CB-O 3.1Å; L108-K171 PolarHBondContact N-O 2.56Å; L108-K171 VanDerWaalsContact O-CE 3.25Å; L108-K171 WeakPolarHBondContact O-CE 3.25Å; L108-V173 HydrophobicContact CD1-CG2 3.8Å; L108-V173 HydrophobicContact CD2-CG2 4.07Å; L108-V173 HydrophobicContact CG-CG2 4.01Å; L108-V194 HydrophobicContact CD1-CG1 4.2Å; L108-V194 HydrophobicContact CD2-CB 3.95Å; L108-V194 HydrophobicContact CD2-CG1 4.14Å; L108-V194 HydrophobicContact CD2-CG2 4.15Å
109	C	95.4	Very high	95.3	Very high	28 Å²	28	31.2 Å²	31.2	19%	0.189	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	-39.1	176.5	46.8	0	0	0	0	112.6	Y63 C68	Y63-C109 PolarHBondContact O-N 3.31Å; Y63-C109 PolarHBondContact O-SG 3.47Å; Y63-C109 VanDerWaalsContact O-SG 3.39Å; C68-C109 HydrophobicContact CB-CB 3.71Å; C68-C109 WeakPolarHBondContact CB-SG 3.36Å; C68-C109 WeakPolarHBondContact O-CB 3.35Å; C68-C109 WeakPolarHBondContact SG-CB 3.36Å; C68-C109 CovalentContact SG-SG 2.04Å; C68-C109 PolarHBondContact SG-SG 2.86Å
110	E	95	Very high	95.4	Very high	77 Å²	77	26.1 Å²	26.1	36%	0.36	13%	0.128	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	156.2	177.8	-69.8	-177.4	-167.3	0	0	111.8	Y63 L108 I112 S198	Y63-E110 HydrophobicContact CD1-CB 4.02Å; Y63-E110 HydrophobicContact CE1-CB 4.03Å; Y63-E110 HydrophobicContact CE1-CG 4.44Å; L108-E110 VanDerWaalsContact C-N 3.31Å; L108-E110 WeakPolarHBondContact CB-O 3.39Å; L108-E110 PolarHBondContact O-N 3.29Å; E110-I112 HydrophobicContact CB-CG2 4.39Å; E110-S198 VanDerWaalsContact OE2-CB 3.25Å; E110-S198 WeakPolarHBondContact OE2-CB 3.44Å; E110-S198 PolarHBondContact OE2-OG 2.88Å
111	P	94.6	Very high	95.4	Very high	52 Å²	52	24 Å²	24	34%	0.338	12%	0.115	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	124	166.1	31.1	-32.4	0	0	0	110.4	A170 K171	P111-A170 WeakPolarHBondContact CA-O 3.47Å; P111-K171 HydrophobicContact CB-CB 4.32Å
112	I	94.3	Very high	95.3	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	155.4	-176.3	63.4	172.4	0	0	0	112	Y63 L108 E110 V114 Y169 A170 V194 T197	Y63-I112 HydrophobicContact CD1-CG2 3.62Å; Y63-I112 HydrophobicContact CD2-CD1 3.75Å; Y63-I112 HydrophobicContact CD2-CG2 4.01Å; Y63-I112 HydrophobicContact CE1-CG2 3.65Å; Y63-I112 HydrophobicContact CE2-CG2 4.03Å; Y63-I112 HydrophobicContact CG-CD1 3.84Å; Y63-I112 HydrophobicContact CG-CG2 3.81Å; L108-I112 HydrophobicContact CD1-CD1 3.77Å; L108-I112 HydrophobicContact CD1-CG1 3.7Å; E110-I112 HydrophobicContact CB-CG2 4.39Å; I112-V114 HydrophobicContact CD1-CG2 4.17Å; I112-V114 HydrophobicContact CG1-CG2 4.01Å; I112-V114 PolarHBondContact O-N 3.36Å; I112-Y169 VanDerWaalsContact C-CD1 3.46Å; I112-Y169 WeakPolarHBondContact O-CA 3.3Å; I112-A170 PolarHBondContact N-O 3.12Å; I112-A170 PolarHBondContact O-N 3.03Å; I112-V194 HydrophobicContact CD1-CG1 4.08Å; I112-T197 CarbonylContact C-O 3.6Å; I112-T197 VanDerWaalsContact CA-O 3.25Å; I112-T197 WeakPolarHBondContact CA-O 3.36Å; I112-T197 WeakPolarHBondContact CB-O 3.25Å
113	Q	93.3	Very high	95.2	Very high	15 Å²	15	22.4 Å²	22.4	7%	0.07	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	109	157.3	-55.8	178.5	36.9	0	0	107.3	K115 Y169 G196 T197 E202	Q113-K115 PolarHBondContact O-N 3.23Å; Q113-Y169 HydrophobicContact CG-CD1 4.09Å; Q113-Y169 HydrophobicContact CG-CD2 3.75Å; Q113-Y169 HydrophobicContact CG-CE1 3.79Å; Q113-Y169 HydrophobicContact CG-CE2 3.44Å; Q113-Y169 VanDerWaalsContact CG-CE2 3.44Å; Q113-Y169 HydrophobicContact CG-CG 4.06Å; Q113-Y169 VanDerWaalsContact CG-CZ 3.46Å; Q113-Y169 VanDerWaalsContact NE2-CE2 3.25Å; Q113-Y169 VanDerWaalsContact NE2-CZ 3.34Å; Q113-Y169 PolarHBondContact NE2-OH 3.5Å; Q113-G196 CarbonylContact O-C 3.52Å; Q113-G196 WeakPolarHBondContact O-CA 3.48Å; Q113-T197 PolarHBondContact N-O 3.35Å; Q113-T197 PolarHBondContact O-N 2.92Å; Q113-T197 VanDerWaalsContact O-N 3.12Å; Q113-E202 PolarHBondContact NE2-OE1 3.05Å
114	V	93.3	Very high	94.8	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.006	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	118.4	-177.8	-176.9	0	0	0	0	109.9	I112 I136 L148 L164 V173 V194	I112-V114 HydrophobicContact CD1-CG2 4.17Å; I112-V114 HydrophobicContact CG1-CG2 4.01Å; I112-V114 PolarHBondContact O-N 3.36Å; V114-I136 HydrophobicContact CG2-CG2 4.41Å; V114-L148 HydrophobicContact CB-CD1 4.5Å; V114-L164 HydrophobicContact CG1-CB 4.46Å; V114-L164 HydrophobicContact CG1-CD1 3.5Å; V114-L164 VanDerWaalsContact CG1-CD1 3.5Å; V114-L164 VanDerWaalsContact O-O 3.09Å; V114-V173 HydrophobicContact CG2-CG2 4.42Å; V114-V194 HydrophobicContact CG1-CG1 3.73Å; V114-V194 HydrophobicContact CG2-CG1 4.1Å
115	K	92.1	Very high	94.3	Very high	37 Å²	37	32 Å²	32	16%	0.161	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	-24	-178.2	-57.6	-53.8	179.8	-171.5	0	114.6	F59 Q113 L164 E166 F195	F59-K115 HydrophobicContact CD1-CB 4.48Å; F59-K115 HydrophobicContact CD2-CB 4.17Å; F59-K115 HydrophobicContact CE1-CB 3.94Å; F59-K115 HydrophobicContact CE1-CG 3.8Å; F59-K115 HydrophobicContact CE2-CB 3.57Å; F59-K115 HydrophobicContact CE2-CG 4.29Å; F59-K115 HydrophobicContact CZ-CB 3.45Å; F59-K115 VanDerWaalsContact CZ-CB 3.45Å; F59-K115 HydrophobicContact CZ-CG 3.64Å; Q113-K115 PolarHBondContact O-N 3.23Å; K115-L164 CarbonylContact C-O 3.48Å; K115-L164 VanDerWaalsContact CA-O 3.23Å; K115-L164 WeakPolarHBondContact CA-O 3.24Å; K115-L164 PolarHBondContact O-N 2.88Å; K115-E166 PolarHBondContact NZ-O 2.79Å; K115-F195 PolarHBondContact N-O 3.14Å
116	Q	93.9	Very high	94.1	Very high	48 Å²	48	32.1 Å²	32.1	22%	0.224	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	148.6	176.8	170.6	-179.9	-34.8	0	0	110.6	D118 S161 F162 F195	Q116-D118 PolarHBondContact NE2-OD1 2.76Å; Q116-S161 PolarHBondContact NE2-OG 2.75Å; Q116-F162 WeakPolarHBondContact CA-O 3.49Å; Q116-F195 HydrophobicContact CB-CB 4.12Å; Q116-F195 HydrophobicContact CG-CD2 4.28Å; Q116-F195 PolarHBondContact N-O 3.49Å; Q116-F195 PolarHBondContact O-N 2.92Å; Q116-F195 VanDerWaalsContact O-O 3.12Å
117	L	95.1	Very high	93.9	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	127.6	171	-178.2	154.3	0	0	0	109	I119 F132 V134 F162 L164 V173 I192 R193 V194	L117-I119 HydrophobicContact CD2-CB 4.39Å; L117-F132 HydrophobicContact CD2-CE2 4.11Å; L117-F132 HydrophobicContact CD2-CZ 4.46Å; L117-V134 HydrophobicContact CD1-CG1 4Å; L117-V134 HydrophobicContact CD1-CG2 3.98Å; L117-F162 PolarHBondContact N-O 3.15Å; L117-F162 PolarHBondContact O-N 3.43Å; L117-L164 HydrophobicContact CB-CD1 3.65Å; L117-V173 HydrophobicContact CD1-CG1 4.47Å; L117-I192 HydrophobicContact CD1-CD1 4.2Å; L117-I192 HydrophobicContact CD2-CD1 4.25Å; L117-I192 HydrophobicContact CD2-CG1 4.19Å; L117-I192 HydrophobicContact CG-CD1 4.36Å; L117-I192 HydrophobicContact CG-CG1 4.3Å; L117-R193 CarbonylContact C-O 3.59Å; L117-R193 WeakPolarHBondContact CA-O 3.42Å; L117-V194 HydrophobicContact CD1-CG2 4.32Å; L117-V194 HydrophobicContact CG-CG2 4.44Å
118	D	95.9	Very high	93.8	Very high	6 Å²	6	31.1 Å²	31.1	3%	0.032	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	144	170.3	-67.4	-5.3	0	0	0	109.9	Q116 V159 Q160 S161 I192 R193 F195	Q116-D118 PolarHBondContact NE2-OD1 2.76Å; D118-V159 HydrophobicContact CB-CG1 3.7Å; D118-Q160 CarbonylContact C-O 3.6Å; D118-Q160 WeakPolarHBondContact CA-O 3.44Å; D118-S161 WeakPolarHBondContact OD1-CA 3.08Å; D118-S161 VanDerWaalsContact OD1-CB 3.22Å; D118-S161 WeakPolarHBondContact OD1-CB 3.35Å; D118-S161 PolarHBondContact OD1-OG 2.95Å; D118-I192 CarbonylContact O-C 3.58Å; D118-I192 WeakPolarHBondContact O-CA 3.27Å; D118-I192 VanDerWaalsContact O-CG1 3.31Å; D118-I192 WeakPolarHBondContact O-CG1 3.25Å; D118-R193 HydrophobicContact CB-CB 3.93Å; D118-R193 HydrophobicContact CB-CG 4.16Å; D118-R193 PolarHBondContact N-O 2.83Å; D118-R193 PolarHBondContact O-N 3.09Å; D118-R193 IonicContact OD2-NH1 2.7Å; D118-R193 PolarHBondContact OD2-NH1 2.85Å; D118-F195 WeakPolarHBondContact OD2-CE2 3.23Å
119	I	95.9	Very high	93.7	Very high	4 Å²	4	31.5 Å²	31.5	2%	0.021	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	146.4	172.4	-157.1	170.9	0	0	0	109.7	L117 F132 Q160 F162 L189	L117-I119 HydrophobicContact CD2-CB 4.39Å; I119-F132 HydrophobicContact CD1-CE1 4.42Å; I119-F132 HydrophobicContact CD1-CE2 4.45Å; I119-F132 HydrophobicContact CD1-CZ 4.36Å; I119-F132 HydrophobicContact CG2-CE1 4.33Å; I119-F132 HydrophobicContact CG2-CZ 4.29Å; I119-Q160 HydrophobicContact CG2-CB 4.39Å; I119-Q160 PolarHBondContact N-O 3.24Å; I119-Q160 PolarHBondContact O-N 3.33Å; I119-F162 HydrophobicContact CG2-CD2 4.33Å; I119-F162 HydrophobicContact CG2-CE2 3.66Å; I119-L189 HydrophobicContact CD1-CD1 3.92Å; I119-L189 HydrophobicContact CD1-CD2 4.49Å; I119-L189 HydrophobicContact CG1-CD1 3.42Å; I119-L189 VanDerWaalsContact CG1-CD1 3.42Å; I119-L189 HydrophobicContact CG1-CD2 4.43Å
120	A	95.1	Very high	93.7	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.008	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	143.1	172.1	0	0	0	0	0	113.2	F122 V159 L189 S190 L191	A120-F122 HydrophobicContact CB-CD1 4.27Å; A120-F122 HydrophobicContact CB-CE1 3.53Å; A120-F122 HydrophobicContact CB-CE2 4.14Å; A120-F122 HydrophobicContact CB-CZ 3.46Å; A120-F122 VanDerWaalsContact CB-CZ 3.46Å; A120-V159 HydrophobicContact CB-CG2 4.18Å; A120-L189 VanDerWaalsContact O-CD1 3.31Å; A120-L189 WeakPolarHBondContact O-CD1 3.39Å; A120-S190 PolarHBondContact O-N 3.16Å; A120-L191 HydrophobicContact CB-CB 4Å; A120-L191 PolarHBondContact N-O 2.79Å; A120-L191 PolarHBondContact O-N 2.87Å
121	N	94.6	Very high	93.8	Very high	4 Å²	4	30.9 Å²	30.9	2%	0.021	15%	0.151	C	C	.	.			trans	-119.8	122.6	161.1	177.7	12.9	0	0	0	108.2	E123 S126 S127 R157	N121-E123 WeakPolarHBondContact OD1-CB 3.49Å; N121-E123 PolarHBondContact OD1-N 3.49Å; N121-S126 PolarHBondContact ND2-OG 3.34Å; N121-S127 PolarHBondContact ND2-O 3.3Å; N121-R157 VanDerWaalsContact O-CA 3.24Å; N121-R157 WeakPolarHBondContact O-CA 3.23Å; N121-R157 WeakPolarHBondContact O-CB 3.32Å
122	F	93.6	Very high	93.9	Very high	41 Å²	41	28.5 Å²	28.5	18%	0.18	14%	0.135	C	C	.	.			trans	-101.6	-7.2	179.1	-52.8	-52.6	0	0	0	113.2	M90 A120 L124 V159 S190 L191	M90-F122 HydrophobicContact CB-CD2 4.14Å; M90-F122 HydrophobicContact CE-CB 4.11Å; M90-F122 HydrophobicContact CE-CD1 3.53Å; M90-F122 HydrophobicContact CE-CD2 3.6Å; M90-F122 HydrophobicContact CE-CE1 3.74Å; M90-F122 HydrophobicContact CE-CE2 3.82Å; M90-F122 HydrophobicContact CE-CG 3.47Å; M90-F122 VanDerWaalsContact CE-CG 3.47Å; M90-F122 HydrophobicContact CE-CZ 3.88Å; M90-F122 HydrophobicContact CG-CD2 4.1Å; M90-F122 HydrophobicContact CG-CE2 4.17Å; A120-F122 HydrophobicContact CB-CD1 4.27Å; A120-F122 HydrophobicContact CB-CE1 3.53Å; A120-F122 HydrophobicContact CB-CE2 4.14Å; A120-F122 HydrophobicContact CB-CZ 3.46Å; A120-F122 VanDerWaalsContact CB-CZ 3.46Å; F122-L124 PolarHBondContact O-N 2.81Å; F122-V159 HydrophobicContact CE1-CG2 4.26Å; F122-V159 HydrophobicContact CZ-CG2 4.02Å; F122-S190 PolarHBondContact N-OG 2.79Å; F122-L191 HydrophobicContact CE2-CB 4.17Å; F122-L191 HydrophobicContact CZ-CB 4.45Å; F122-L191 HydrophobicContact CZ-CD2 4.3Å
123	E	92.8	Very high	94	Very high	50 Å²	50	29.3 Å²	29.3	23%	0.234	14%	0.139	C	C	.	.			trans	-73.5	120	-176.6	177.2	58	-90	0	0	111.6	Y93 N121 F125 S126 R157 P188	Y93-E123 HydrophobicContact CE1-CB 4.44Å; Y93-E123 WeakPolarHBondContact CE1-OE2 3.38Å; Y93-E123 PolarHBondContact OH-OE2 3.5Å; N121-E123 WeakPolarHBondContact OD1-CB 3.49Å; N121-E123 PolarHBondContact OD1-N 3.49Å; E123-F125 PolarHBondContact O-N 3.33Å; E123-F125 PolarHBondContact OE1-N 3.44Å; E123-S126 WeakPolarHBondContact CB-OG 3.49Å; E123-S126 PolarHBondContact O-OG 3.23Å; E123-R157 PolarHBondContact O-NE 3.38Å; E123-P188 HydrophobicContact CB-CG 3.85Å; E123-P188 HydrophobicContact CG-CG 4.1Å
124	L	88.3	Confident	94.2	Very high	103 Å²	103	28.7 Å²	28.7	54%	0.539	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-20.1	-169.2	-68.9	173.2	0	0	0	113.9	F122 R157	F122-L124 PolarHBondContact O-N 2.81Å; L124-R157 PolarHBondContact O-NH1 3.26Å; L124-R157 PolarHBondContact O-NH2 2.89Å
125	F	86.9	Confident	94.3	Very high	174 Å²	174	28.9 Å²	28.9	76%	0.763	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-119.9	51.1	-178	-56.7	-75.2	0	0	0	110.6	E123	E123-F125 PolarHBondContact O-N 3.33Å; E123-F125 PolarHBondContact OE1-N 3.44Å
126	S	92.8	Very high	94.5	Very high	7 Å²	7	27.2 Å²	27.2	5%	0.049	13%	0.131	C	C	.	.	S	Bend	trans	-147	161.3	-177.8	72.4	0	0	0	0	113.5	N121 E123 R157 P188	N121-S126 PolarHBondContact ND2-OG 3.34Å; E123-S126 WeakPolarHBondContact CB-OG 3.49Å; E123-S126 PolarHBondContact O-OG 3.23Å; S126-R157 PolarHBondContact O-NH2 2.94Å; S126-P188 VanDerWaalsContact CB-CG 3.46Å; S126-P188 VanDerWaalsContact OG-CG 3.29Å; S126-P188 WeakPolarHBondContact OG-CG 3.4Å
127	S	94.9	Very high	94.6	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.126	C	C	.	.	P	Polyproline II helix	trans	-73.7	128.3	170.6	-66	0	0	0	0	110	C98 N121 F181 E184 F186 C187	C98-S127 WeakPolarHBondContact SG-CB 3.23Å; N121-S127 PolarHBondContact ND2-O 3.3Å; S127-F181 WeakPolarHBondContact CA-O 3.43Å; S127-F181 WeakPolarHBondContact CB-O 3.37Å; S127-F181 PolarHBondContact OG-O 3.16Å; S127-E184 WeakPolarHBondContact OG-CA 3.33Å; S127-E184 WeakPolarHBondContact OG-CB 3.44Å; S127-E184 PolarHBondContact OG-N 2.81Å; S127-E184 PolarHBondContact OG-O 3.21Å; S127-E184 VanDerWaalsContact OG-O 3.08Å; S127-F186 PolarHBondContact N-O 2.99Å; S127-C187 VanDerWaalsContact CB-SG 3.58Å
128	T	94.9	Very high	94.6	Very high	4 Å²	4	29.6 Å²	29.6	3%	0.025	15%	0.146	C	C	.	.	P	Polyproline II helix	trans	-86.9	149.3	179.8	51.4	0	0	0	0	110.9	D155 R157 H180 F181	T128-D155 WeakPolarHBondContact CG2-OD1 3.4Å; T128-D155 PolarHBondContact OG1-OD1 3.11Å; T128-R157 HydrophobicContact CG2-CG 4.11Å; T128-H180 CarbonylContact O-C 3.54Å; T128-H180 WeakPolarHBondContact O-CA 3.18Å; T128-H180 VanDerWaalsContact O-CB 3.27Å; T128-H180 WeakPolarHBondContact O-CB 3.39Å; T128-F181 PolarHBondContact N-O 2.88Å; T128-F181 PolarHBondContact O-N 2.87Å; T128-F181 WeakPolarHBondContact OG1-CB 3.45Å; T128-F181 WeakPolarHBondContact OG1-CD2 3.24Å
129	P	95	Very high	94.4	Very high	9 Å²	9	37.8 Å²	37.8	6%	0.058	18%	0.177	C	C	.	.	B	Isolated β-bridge	trans	-62.5	140.8	174.3	27.5	-34.7	0	0	0	110.5	A153 L177	P129-A153 WeakPolarHBondContact O-CB 3.09Å; P129-L177 HydrophobicContact CB-CD1 3.51Å; P129-L177 HydrophobicContact CB-CD2 4.01Å; P129-L177 HydrophobicContact CB-CG 4.44Å
130	K	95.3	Very high	94.4	Very high	64 Å²	64	41.6 Å²	41.6	28%	0.278	19%	0.191	S	C	.	.			trans	-115.6	-88.4	178.1	178.3	179.3	177.1	-70.9	0	111	A153 S179 F181	K130-A153 PolarHBondContact O-N 3.14Å; K130-S179 WeakPolarHBondContact CB-OG 3.34Å; K130-S179 WeakPolarHBondContact CG-OG 3.46Å; K130-S179 PolarHBondContact N-O 2.8Å; K130-F181 HydrophobicContact CB-CD2 3.62Å; K130-F181 HydrophobicContact CB-CE1 4.48Å; K130-F181 HydrophobicContact CB-CE2 3.53Å; K130-F181 HydrophobicContact CB-CG 4.16Å; K130-F181 HydrophobicContact CB-CZ 4Å; K130-F181 HydrophobicContact CD-CD1 3.88Å; K130-F181 HydrophobicContact CD-CD2 4.43Å; K130-F181 HydrophobicContact CD-CE1 3.63Å; K130-F181 HydrophobicContact CD-CE2 4.21Å; K130-F181 HydrophobicContact CD-CG 4.28Å; K130-F181 HydrophobicContact CD-CZ 3.83Å; K130-F181 HydrophobicContact CG-CD1 4.32Å; K130-F181 HydrophobicContact CG-CD2 4.07Å; K130-F181 HydrophobicContact CG-CE1 3.88Å; K130-F181 HydrophobicContact CG-CE2 3.59Å; K130-F181 HydrophobicContact CG-CG 4.41Å; K130-F181 HydrophobicContact CG-CZ 3.5Å
131	D	96.8	Very high	94.3	Very high	28 Å²	28	47 Å²	47	15%	0.15	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	126	-178.4	-42.2	-50.4	0	0	0	108.8	F151 H152 L178 S179	D131-F151 CarbonylContact C-O 3.58Å; D131-F151 WeakPolarHBondContact CA-O 3.25Å; D131-H152 IonicContact OD1-CD2 3.79Å; D131-H152 PolarHBondContact OD1-CD2 2.93Å; D131-H152 IonicContact OD1-CG 3.22Å; D131-H152 IonicContact OD1-NE2 2.56Å; D131-L178 HydrophobicContact CB-CB 4.4Å; D131-L178 WeakPolarHBondContact O-CA 3.19Å; D131-L178 VanDerWaalsContact O-CB 3.27Å; D131-L178 WeakPolarHBondContact O-CB 3.41Å; D131-L178 PolarHBondContact O-N 3.47Å; D131-S179 VanDerWaalsContact CB-OG 3.32Å; D131-S179 WeakPolarHBondContact CB-OG 3.22Å; D131-S179 PolarHBondContact N-OG 3.06Å; D131-S179 PolarHBondContact O-N 3.12Å; D131-S179 VanDerWaalsContact O-N 3.16Å; D131-S179 WeakPolarHBondContact OD2-CB 3.34Å; D131-S179 PolarHBondContact OD2-OG 3.25Å
132	F	97	Very high	94.2	Very high	1 Å²	1	48.6 Å²	48.6	0%	0.004	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	140.3	-179.6	67.8	-84.9	0	0	0	113.2	L117 I119 V134 T150 F151 A153 F162 V175 E176 L177	L117-F132 HydrophobicContact CD2-CE2 4.11Å; L117-F132 HydrophobicContact CD2-CZ 4.46Å; I119-F132 HydrophobicContact CD1-CE1 4.42Å; I119-F132 HydrophobicContact CD1-CE2 4.45Å; I119-F132 HydrophobicContact CD1-CZ 4.36Å; I119-F132 HydrophobicContact CG2-CE1 4.33Å; I119-F132 HydrophobicContact CG2-CZ 4.29Å; F132-V134 HydrophobicContact CD2-CG2 3.78Å; F132-V134 HydrophobicContact CE2-CG2 3.65Å; F132-T150 CarbonylContact O-C 3.53Å; F132-T150 WeakPolarHBondContact O-CA 3.23Å; F132-F151 HydrophobicContact CD1-CB 4.2Å; F132-F151 HydrophobicContact CD2-CB 4.34Å; F132-F151 HydrophobicContact CE1-CB 3.71Å; F132-F151 HydrophobicContact CE2-CB 3.88Å; F132-F151 HydrophobicContact CE2-CD2 4.22Å; F132-F151 HydrophobicContact CE2-CG 4.35Å; F132-F151 HydrophobicContact CG-CB 4.49Å; F132-F151 HydrophobicContact CZ-CB 3.55Å; F132-F151 HydrophobicContact CZ-CG 4.33Å; F132-F151 PolarHBondContact N-O 3.36Å; F132-F151 PolarHBondContact O-N 3.27Å; F132-A153 HydrophobicContact CE1-CB 4.26Å; F132-F162 HydrophobicContact CE1-CD2 4.41Å; F132-F162 HydrophobicContact CE1-CE1 4.31Å; F132-F162 HydrophobicContact CE1-CE2 4.05Å; F132-F162 AromaticContact CE1-CZ 4Å; F132-F162 HydrophobicContact CE1-CZ 4Å; F132-F162 HydrophobicContact CZ-CD1 4.36Å; F132-F162 AromaticContact CZ-CD2 3.77Å; F132-F162 HydrophobicContact CZ-CD2 3.77Å; F132-F162 HydrophobicContact CZ-CE1 4.4Å; F132-F162 AromaticContact CZ-CE2 3.85Å; F132-F162 HydrophobicContact CZ-CE2 3.85Å; F132-F162 HydrophobicContact CZ-CG 4.05Å; F132-F162 HydrophobicContact CZ-CZ 4.17Å; F132-V175 HydrophobicContact CD2-CG1 4.16Å; F132-E176 CarbonylContact C-O 3.39Å; F132-E176 WeakPolarHBondContact CA-O 3.23Å; F132-L177 HydrophobicContact CB-CD1 3.88Å
133	L	96.8	Very high	94	Very high	18 Å²	18	53.7 Å²	53.7	9%	0.094	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	129.1	177.1	177.2	73.4	0	0	0	109.8	K147 V175 E176 L178	L133-K147 HydrophobicContact CD1-CB 4.42Å; L133-K147 HydrophobicContact CD1-CD 4.21Å; L133-K147 HydrophobicContact CD1-CG 4.34Å; L133-V175 WeakPolarHBondContact O-CA 3.46Å; L133-E176 HydrophobicContact CB-CB 4.35Å; L133-E176 PolarHBondContact N-O 3.16Å; L133-E176 PolarHBondContact O-N 2.92Å; L133-L178 HydrophobicContact CB-CD1 4.28Å; L133-L178 HydrophobicContact CB-CD2 4.31Å; L133-L178 HydrophobicContact CB-CG 4.44Å
134	V	96.8	Very high	93.9	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.006	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	137.3	169.8	-175.1	0	0	0	0	109.4	L117 F132 L148 G149 F151 V173	L117-V134 HydrophobicContact CD1-CG1 4Å; L117-V134 HydrophobicContact CD1-CG2 3.98Å; F132-V134 HydrophobicContact CD2-CG2 3.78Å; F132-V134 HydrophobicContact CE2-CG2 3.65Å; V134-L148 HydrophobicContact CB-CB 4.47Å; V134-L148 HydrophobicContact CG1-CB 4.5Å; V134-L148 HydrophobicContact CG1-CD1 3.96Å; V134-L148 HydrophobicContact CG1-CG 4.39Å; V134-L148 PolarHBondContact O-N 3.44Å; V134-G149 PolarHBondContact N-O 2.88Å; V134-F151 HydrophobicContact CB-CD2 4.29Å; V134-F151 HydrophobicContact CB-CE2 4.02Å; V134-F151 HydrophobicContact CG2-CD2 3.77Å; V134-F151 HydrophobicContact CG2-CE2 3.97Å; V134-V173 HydrophobicContact CG1-CG1 4.01Å
135	S	96.1	Very high	94.3	Very high	5 Å²	5	57.1 Å²	57.1	4%	0.035	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	153.4	176.9	-58	0	0	0	0	110.9	V146 K174	S135-V146 CarbonylContact C-O 3.5Å; S135-V146 WeakPolarHBondContact CA-O 3.49Å; S135-V146 VanDerWaalsContact CB-O 3.25Å; S135-V146 WeakPolarHBondContact CB-O 3.28Å; S135-K174 PolarHBondContact N-O 3.26Å; S135-K174 PolarHBondContact O-N 3.42Å
136	I	96.4	Very high	94.6	Very high	3 Å²	3	52 Å²	52	2%	0.015	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	162	-174.9	60.4	164.9	0	0	0	113.1	V114 V146 L148 E166 L168 A170 Y172 V173	V114-I136 HydrophobicContact CG2-CG2 4.41Å; I136-V146 HydrophobicContact CG1-CB 4.09Å; I136-V146 PolarHBondContact N-O 2.95Å; I136-V146 PolarHBondContact O-N 3.49Å; I136-L148 HydrophobicContact CD1-CD2 3.67Å; I136-L148 HydrophobicContact CG1-CD2 3.75Å; I136-L148 HydrophobicContact CG1-CG 4.25Å; I136-L148 HydrophobicContact CG2-CD1 3.75Å; I136-L148 HydrophobicContact CG2-CD2 4.28Å; I136-L148 HydrophobicContact CG2-CG 3.98Å; I136-E166 HydrophobicContact CD1-CG 4.07Å; I136-L168 HydrophobicContact CD1-CB 4.03Å; I136-A170 HydrophobicContact CB-CB 3.68Å; I136-A170 HydrophobicContact CD1-CB 3.87Å; I136-A170 HydrophobicContact CG1-CB 4.23Å; I136-A170 HydrophobicContact CG2-CB 4.28Å; I136-Y172 CarbonylContact C-O 3.51Å; I136-Y172 VanDerWaalsContact CA-O 3.3Å; I136-Y172 WeakPolarHBondContact CA-O 3.39Å; I136-V173 HydrophobicContact CG2-CG2 4.27Å
137	S	95.9	Very high	94.7	Very high	17 Å²	17	58.8 Å²	58.8	12%	0.119	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	151.2	165.7	-159.6	0	0	0	0	112.9	R139 A170 K171 Y172	S137-R139 VanDerWaalsContact C-N 3.29Å; S137-R139 PolarHBondContact OG-N 3.38Å; S137-R139 PolarHBondContact OG-O 2.86Å; S137-A170 WeakPolarHBondContact O-CB 3.3Å; S137-K171 PolarHBondContact O-N 2.96Å; S137-Y172 PolarHBondContact N-O 3.04Å; S137-Y172 PolarHBondContact O-N 3.01Å
138	D	93.9	Very high	94.6	Very high	82 Å²	82	60.3 Å²	60.3	44%	0.439	29%	0.293	S	S	.	.	S	Bend	trans	-67.2	-28	162.9	173.8	55	0	0	0	112	Y172	D138-Y172 WeakPolarHBondContact O-CD2 3.35Å; D138-Y172 WeakPolarHBondContact O-CE2 3.44Å
139	R	92.8	Very high	94.5	Very high	178 Å²	178	61.1 Å²	61.1	67%	0.672	30%	0.303	S	S	*	.	S	Bend	trans	-130.5	145.4	-168.1	-54.8	-167.2	-179.2	-133.4	-13.6	113.8	S137 T142 Y172	S137-R139 VanDerWaalsContact C-N 3.29Å; S137-R139 PolarHBondContact OG-N 3.38Å; S137-R139 PolarHBondContact OG-O 2.86Å; R139-T142 WeakPolarHBondContact O-CB 3.48Å; R139-T142 WeakPolarHBondContact O-CG2 3.49Å; R139-Y172 VanDerWaalsContact C-CD2 3.48Å
140	Y	94.9	Very high	94.5	Very high	83 Å²	83	63.9 Å²	63.9	33%	0.325	32%	0.319	S	S	.	.	S	Bend	trans	-137.3	139.1	173.1	-174.6	-85.2	0	0	0	110.5	L73 S74 V105 W145 Y172	L73-Y140 HydrophobicContact CB-CE1 4.15Å; L73-Y140 HydrophobicContact CB-CE2 4.39Å; L73-Y140 HydrophobicContact CD1-CD1 3.56Å; L73-Y140 HydrophobicContact CD1-CD2 3.98Å; L73-Y140 HydrophobicContact CD1-CE1 3.86Å; L73-Y140 HydrophobicContact CD1-CE2 4.26Å; L73-Y140 HydrophobicContact CD1-CG 3.6Å; S74-Y140 WeakPolarHBondContact CB-OH 3.48Å; S74-Y140 PolarHBondContact OG-OH 3.39Å; V105-Y140 HydrophobicContact CB-CE2 4.32Å; V105-Y140 HydrophobicContact CG1-CD2 3.94Å; V105-Y140 HydrophobicContact CG1-CE2 3.86Å; V105-Y140 HydrophobicContact CG2-CE2 4.36Å; Y140-W145 HydrophobicContact CD2-CH2 4.36Å; Y140-W145 HydrophobicContact CD2-CZ2 4.23Å; Y140-Y172 HydrophobicContact CG-CD1 4.39Å
141	P	93.7	Very high	94.6	Very high	115 Å²	115	62.6 Å²	62.6	75%	0.747	31%	0.314	S	S	*	.	S	Bend	cis	-69.5	146.9	-7.5	30.3	-35.3	0	0	0	111.8
142	T	92.2	Very high	94.6	Very high	37 Å²	37	67.2 Å²	67.2	23%	0.227	33%	0.334	C	S	.	.			trans	-131.7	144.7	173.8	-176.3	0	0	0	0	111.5	R139 K144 W145	R139-T142 WeakPolarHBondContact O-CB 3.48Å; R139-T142 WeakPolarHBondContact O-CG2 3.49Å; T142-K144 WeakPolarHBondContact CG2-O 3.4Å; T142-K144 PolarHBondContact OG1-N 2.82Å; T142-K144 PolarHBondContact OG1-O 3Å; T142-W145 HydrophobicContact CG2-CD2 3.86Å; T142-W145 VanDerWaalsContact CG2-CE2 3.44Å; T142-W145 HydrophobicContact CG2-CE3 4.47Å; T142-W145 HydrophobicContact CG2-CG 4.19Å; T142-W145 HydrophobicContact CG2-CH2 4.34Å; T142-W145 HydrophobicContact CG2-CZ2 3.73Å; T142-W145 PolarHBondContact O-NE1 3.28Å
143	N	89.3	Confident	94.5	Very high	149 Å²	149	67.5 Å²	67.5	80%	0.797	34%	0.336	S	S	*	.	S	Bend	trans	-90.4	-15	167.1	61.6	-5.4	0	0	0	112.7
144	K	91.7	Very high	94.4	Very high	166 Å²	166	73.3 Å²	73.3	72%	0.722	36%	0.357	S	S	*	.			trans	-111.6	109.7	179.2	-69	175.2	-176.9	179.5	0	109.5	T142	T142-K144 WeakPolarHBondContact CG2-O 3.4Å; T142-K144 PolarHBondContact OG1-N 2.82Å; T142-K144 PolarHBondContact OG1-O 3Å
145	W	95.2	Very high	94.4	Very high	59 Å²	59	77.7 Å²	77.7	22%	0.223	38%	0.381	C	S	.	.			trans	-108.7	131.1	175.6	-71.9	88.6	0	0	0	109.3	V105 Y140 T142 K174	V105-W145 HydrophobicContact CG1-CH2 3.76Å; V105-W145 HydrophobicContact CG1-CZ2 4.4Å; V105-W145 HydrophobicContact CG2-CH2 4.14Å; V105-W145 HydrophobicContact CG2-CZ2 4.17Å; Y140-W145 HydrophobicContact CD2-CH2 4.36Å; Y140-W145 HydrophobicContact CD2-CZ2 4.23Å; T142-W145 HydrophobicContact CG2-CD2 3.86Å; T142-W145 VanDerWaalsContact CG2-CE2 3.44Å; T142-W145 HydrophobicContact CG2-CE3 4.47Å; T142-W145 HydrophobicContact CG2-CG 4.19Å; T142-W145 HydrophobicContact CG2-CH2 4.34Å; T142-W145 HydrophobicContact CG2-CZ2 3.73Å; T142-W145 PolarHBondContact O-NE1 3.28Å; W145-K174 HydrophobicContact CD2-CB 4.23Å; W145-K174 HydrophobicContact CD2-CD 4.12Å; W145-K174 HydrophobicContact CE3-CB 3.72Å; W145-K174 HydrophobicContact CE3-CD 4.46Å; W145-K174 HydrophobicContact CH2-CB 3.92Å; W145-K174 HydrophobicContact CZ2-CB 4.39Å; W145-K174 HydrophobicContact CZ2-CD 4.36Å; W145-K174 HydrophobicContact CZ3-CB 3.56Å
146	V	94.9	Very high	94.2	Very high	66 Å²	66	80.8 Å²	80.8	40%	0.4	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	126.1	172.9	-177.8	0	0	0	0	107.8	S135 I136 L168	S135-V146 CarbonylContact C-O 3.5Å; S135-V146 WeakPolarHBondContact CA-O 3.49Å; S135-V146 VanDerWaalsContact CB-O 3.25Å; S135-V146 WeakPolarHBondContact CB-O 3.28Å; I136-V146 HydrophobicContact CG1-CB 4.09Å; I136-V146 PolarHBondContact N-O 2.95Å; I136-V146 PolarHBondContact O-N 3.49Å; V146-L168 HydrophobicContact CG1-CD1 3.91Å; V146-L168 HydrophobicContact CG2-CD1 4.4Å
147	K	94.3	Very high	93.9	Very high	149 Å²	149	85.3 Å²	85.3	65%	0.648	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89	119.5	-178.5	-64.3	179.6	178.2	-178	0	109.6	L133	L133-K147 HydrophobicContact CD1-CB 4.42Å; L133-K147 HydrophobicContact CD1-CD 4.21Å; L133-K147 HydrophobicContact CD1-CG 4.34Å
148	L	92.8	Very high	93.8	Very high	32 Å²	32	88.9 Å²	88.9	17%	0.168	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	-36.8	174.7	-61	-168.2	0	0	0	111.8	V114 V134 I136 L164 E166	V114-L148 HydrophobicContact CB-CD1 4.5Å; V134-L148 HydrophobicContact CB-CB 4.47Å; V134-L148 HydrophobicContact CG1-CB 4.5Å; V134-L148 HydrophobicContact CG1-CD1 3.96Å; V134-L148 HydrophobicContact CG1-CG 4.39Å; V134-L148 PolarHBondContact O-N 3.44Å; I136-L148 HydrophobicContact CD1-CD2 3.67Å; I136-L148 HydrophobicContact CG1-CD2 3.75Å; I136-L148 HydrophobicContact CG1-CG 4.25Å; I136-L148 HydrophobicContact CG2-CD1 3.75Å; I136-L148 HydrophobicContact CG2-CD2 4.28Å; I136-L148 HydrophobicContact CG2-CG 3.98Å; L148-L164 HydrophobicContact CB-CD2 4.18Å; L148-L164 HydrophobicContact CD1-CD1 3.91Å; L148-L164 HydrophobicContact CD1-CD2 4.08Å; L148-L164 HydrophobicContact CD1-CG 4.41Å; L148-E166 HydrophobicContact CD2-CB 3.81Å; L148-E166 HydrophobicContact CD2-CG 3.57Å
149	G	92.3	Very high	93.9	Very high	22 Å²	22	87.3 Å²	87.3	23%	0.227	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.9	172.9	-179.5	0	0	0	0	0	112.9	V134 F151	V134-G149 PolarHBondContact N-O 2.88Å; G149-F151 VanDerWaalsContact O-CE2 3.23Å; G149-F151 WeakPolarHBondContact O-CE2 3.23Å
150	T	95.6	Very high	94.1	Very high	66 Å²	66	79.4 Å²	79.4	41%	0.405	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	122.8	169.4	-55.7	0	0	0	0	108.7	F132 L178	F132-T150 CarbonylContact O-C 3.53Å; F132-T150 WeakPolarHBondContact O-CA 3.23Å; T150-L178 HydrophobicContact CG2-CD1 3.71Å
151	F	96.4	Very high	94.1	Very high	37 Å²	37	78.5 Å²	78.5	16%	0.162	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	149.1	-174.5	-58.7	-82.8	0	0	0	109.8	D131 F132 V134 G149 F162 L164	D131-F151 CarbonylContact C-O 3.58Å; D131-F151 WeakPolarHBondContact CA-O 3.25Å; F132-F151 HydrophobicContact CD1-CB 4.2Å; F132-F151 HydrophobicContact CD2-CB 4.34Å; F132-F151 HydrophobicContact CE1-CB 3.71Å; F132-F151 HydrophobicContact CE2-CB 3.88Å; F132-F151 HydrophobicContact CE2-CD2 4.22Å; F132-F151 HydrophobicContact CE2-CG 4.35Å; F132-F151 HydrophobicContact CG-CB 4.49Å; F132-F151 HydrophobicContact CZ-CB 3.55Å; F132-F151 HydrophobicContact CZ-CG 4.33Å; F132-F151 PolarHBondContact N-O 3.36Å; F132-F151 PolarHBondContact O-N 3.27Å; V134-F151 HydrophobicContact CB-CD2 4.29Å; V134-F151 HydrophobicContact CB-CE2 4.02Å; V134-F151 HydrophobicContact CG2-CD2 3.77Å; V134-F151 HydrophobicContact CG2-CE2 3.97Å; G149-F151 VanDerWaalsContact O-CE2 3.23Å; G149-F151 WeakPolarHBondContact O-CE2 3.23Å; F151-F162 HydrophobicContact CB-CD1 3.81Å; F151-F162 HydrophobicContact CB-CE1 4.19Å; F151-F162 HydrophobicContact CB-CG 4.35Å; F151-F162 HydrophobicContact CD1-CB 4.13Å; F151-F162 HydrophobicContact CD1-CD1 4Å; F151-F162 HydrophobicContact CD1-CG 4.4Å; F151-F162 HydrophobicContact CG-CB 4.5Å; F151-F162 HydrophobicContact CG-CD1 4.22Å; F151-L164 HydrophobicContact CE1-CD2 3.77Å; F151-L164 HydrophobicContact CE2-CD2 3.68Å; F151-L164 HydrophobicContact CZ-CD2 3.16Å
152	H	96.7	Very high	94.2	Very high	126 Å²	126	74.2 Å²	74.2	58%	0.583	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.3	105.4	-175.4	-60.3	69.1	0	0	0	107.4	D131	D131-H152 IonicContact OD1-CD2 3.79Å; D131-H152 PolarHBondContact OD1-CD2 2.93Å; D131-H152 IonicContact OD1-CG 3.22Å; D131-H152 IonicContact OD1-NE2 2.56Å
153	A	96.2	Very high	94.2	Very high	6 Å²	6	77.3 Å²	77.3	5%	0.05	39%	0.388	C	S	.	.			trans	-73.5	156.2	173.6	0	0	0	0	0	111.4	P129 K130 F132 F162 F181	P129-A153 WeakPolarHBondContact O-CB 3.09Å; K130-A153 PolarHBondContact O-N 3.14Å; F132-A153 HydrophobicContact CE1-CB 4.26Å; A153-F162 HydrophobicContact CB-CZ 4.13Å; A153-F181 WeakPolarHBondContact O-CE2 3.3Å; A153-F181 WeakPolarHBondContact O-CZ 3.41Å
154	R	95.3	Very high	94.2	Very high	140 Å²	140	70.5 Å²	70.5	53%	0.528	35%	0.352	S	S	.	.			trans	-88.5	157.1	170	-54.8	-166.7	-61.4	-95.3	-4	109.1	E156 Q160	R154-E156 HydrophobicContact CB-CB 4.45Å; R154-E156 HydrophobicContact CB-CG 3.93Å; R154-E156 WeakPolarHBondContact CD-OE1 3.38Å; R154-E156 IonicContact CZ-OE1 2.61Å; R154-E156 IonicContact CZ-OE2 2.68Å; R154-E156 VanDerWaalsContact CZ-OE2 3.29Å; R154-E156 IonicContact NE-OE1 3.29Å; R154-E156 PolarHBondContact NE-OE1 3.34Å; R154-E156 IonicContact NE-OE2 3.79Å; R154-E156 PolarHBondContact NE-OE2 2.8Å; R154-E156 IonicContact NH2-OE1 2.8Å; R154-E156 IonicContact NH2-OE2 2.75Å; R154-E156 PolarHBondContact NH2-OE2 3.49Å; R154-E156 PolarHBondContact O-N 3.28Å; R154-Q160 PolarHBondContact O-NE2 3.09Å
155	D	94.9	Very high	93.4	Very high	94 Å²	94	68.9 Å²	68.9	50%	0.503	35%	0.351	S	S	.	.	S	Bend	trans	-78.4	66	173.4	-165.4	10.3	0	0	0	110.5	T128 F181	T128-D155 WeakPolarHBondContact CG2-OD1 3.4Å; T128-D155 PolarHBondContact OG1-OD1 3.11Å; D155-F181 HydrophobicContact CB-CB 4.3Å; D155-F181 HydrophobicContact CB-CD1 4.21Å; D155-F181 HydrophobicContact CB-CD2 3.8Å; D155-F181 HydrophobicContact CB-CE1 4.44Å; D155-F181 HydrophobicContact CB-CE2 4.06Å; D155-F181 HydrophobicContact CB-CG 3.88Å; D155-F181 HydrophobicContact CB-CZ 4.36Å
156	E	92.8	Very high	92.7	Very high	70 Å²	70	68.5 Å²	68.5	33%	0.327	35%	0.352	S	S	.	.			trans	-132.2	124.9	-174.9	-66.4	174.5	-170.9	0	0	110.1	R154 I158 Q160	R154-E156 HydrophobicContact CB-CB 4.45Å; R154-E156 HydrophobicContact CB-CG 3.93Å; R154-E156 WeakPolarHBondContact CD-OE1 3.38Å; R154-E156 IonicContact CZ-OE1 2.61Å; R154-E156 IonicContact CZ-OE2 2.68Å; R154-E156 VanDerWaalsContact CZ-OE2 3.29Å; R154-E156 IonicContact NE-OE1 3.29Å; R154-E156 PolarHBondContact NE-OE1 3.34Å; R154-E156 IonicContact NE-OE2 3.79Å; R154-E156 PolarHBondContact NE-OE2 2.8Å; R154-E156 IonicContact NH2-OE1 2.8Å; R154-E156 IonicContact NH2-OE2 2.75Å; R154-E156 PolarHBondContact NH2-OE2 3.49Å; R154-E156 PolarHBondContact O-N 3.28Å; E156-I158 HydrophobicContact CB-CD1 4.44Å; E156-I158 HydrophobicContact CB-CG1 4.05Å; E156-I158 PolarHBondContact O-N 3.09Å; E156-Q160 PolarHBondContact O-NE2 3.12Å
157	R	90.9	Very high	92	Very high	97 Å²	97	72.9 Å²	72.9	37%	0.366	37%	0.368	S	S	.	.	S	Bend	trans	-85.7	47.9	-177.2	-63.7	177.4	-176.6	152.4	-7.4	112.6	N121 E123 L124 S126 T128	N121-R157 VanDerWaalsContact O-CA 3.24Å; N121-R157 WeakPolarHBondContact O-CA 3.23Å; N121-R157 WeakPolarHBondContact O-CB 3.32Å; E123-R157 PolarHBondContact O-NE 3.38Å; L124-R157 PolarHBondContact O-NH1 3.26Å; L124-R157 PolarHBondContact O-NH2 2.89Å; S126-R157 PolarHBondContact O-NH2 2.94Å; T128-R157 HydrophobicContact CG2-CG 4.11Å
158	I	93.9	Very high	91.7	Very high	92 Å²	92	69.8 Å²	69.8	47%	0.472	36%	0.358	S	S	.	.	S	Bend	trans	-128.4	174.1	178.5	67.7	179.1	0	0	0	109.5	E156 Q160	E156-I158 HydrophobicContact CB-CD1 4.44Å; E156-I158 HydrophobicContact CB-CG1 4.05Å; E156-I158 PolarHBondContact O-N 3.09Å; I158-Q160 HydrophobicContact CG1-CG 4.4Å; I158-Q160 PolarHBondContact O-N 2.97Å
159	V	95.7	Very high	91.7	Very high	49 Å²	49	71 Å²	71	30%	0.297	36%	0.361	S	S	.	.			trans	-69.8	124.2	170.2	-173.1	0	0	0	0	109.4	D118 A120 F122 L191	D118-V159 HydrophobicContact CB-CG1 3.7Å; A120-V159 HydrophobicContact CB-CG2 4.18Å; F122-V159 HydrophobicContact CE1-CG2 4.26Å; F122-V159 HydrophobicContact CZ-CG2 4.02Å; V159-L191 HydrophobicContact CG2-CD2 4.1Å
160	Q	95.5	Very high	91.9	Very high	12 Å²	12	69.9 Å²	69.9	6%	0.056	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	123.2	177.8	-61.4	-177.7	43.6	0	0	109.7	D118 I119 R154 E156 I158 F162	D118-Q160 CarbonylContact C-O 3.6Å; D118-Q160 WeakPolarHBondContact CA-O 3.44Å; I119-Q160 HydrophobicContact CG2-CB 4.39Å; I119-Q160 PolarHBondContact N-O 3.24Å; I119-Q160 PolarHBondContact O-N 3.33Å; R154-Q160 PolarHBondContact O-NE2 3.09Å; E156-Q160 PolarHBondContact O-NE2 3.12Å; I158-Q160 HydrophobicContact CG1-CG 4.4Å; I158-Q160 PolarHBondContact O-N 2.97Å; Q160-F162 HydrophobicContact CB-CE2 3.68Å; Q160-F162 HydrophobicContact CB-CZ 4.03Å; Q160-F162 WeakPolarHBondContact O-CD2 3.41Å; Q160-F162 WeakPolarHBondContact O-CE2 3.17Å
161	S	95.5	Very high	91.9	Very high	65 Å²	65	69.3 Å²	69.3	46%	0.455	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	132.3	-175.8	-59.3	0	0	0	0	112.3	Q116 D118	Q116-S161 PolarHBondContact NE2-OG 2.75Å; D118-S161 WeakPolarHBondContact OD1-CA 3.08Å; D118-S161 VanDerWaalsContact OD1-CB 3.22Å; D118-S161 WeakPolarHBondContact OD1-CB 3.35Å; D118-S161 PolarHBondContact OD1-OG 2.95Å
162	F	95.2	Very high	91.9	Very high	25 Å²	25	69 Å²	69	11%	0.11	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	112.3	-179.1	-61.7	-89.5	0	0	0	109.6	Q116 L117 I119 F132 F151 A153 Q160	Q116-F162 WeakPolarHBondContact CA-O 3.49Å; L117-F162 PolarHBondContact N-O 3.15Å; L117-F162 PolarHBondContact O-N 3.43Å; I119-F162 HydrophobicContact CG2-CD2 4.33Å; I119-F162 HydrophobicContact CG2-CE2 3.66Å; F132-F162 HydrophobicContact CE1-CD2 4.41Å; F132-F162 HydrophobicContact CE1-CE1 4.31Å; F132-F162 HydrophobicContact CE1-CE2 4.05Å; F132-F162 AromaticContact CE1-CZ 4Å; F132-F162 HydrophobicContact CE1-CZ 4Å; F132-F162 HydrophobicContact CZ-CD1 4.36Å; F132-F162 AromaticContact CZ-CD2 3.77Å; F132-F162 HydrophobicContact CZ-CD2 3.77Å; F132-F162 HydrophobicContact CZ-CE1 4.4Å; F132-F162 AromaticContact CZ-CE2 3.85Å; F132-F162 HydrophobicContact CZ-CE2 3.85Å; F132-F162 HydrophobicContact CZ-CG 4.05Å; F132-F162 HydrophobicContact CZ-CZ 4.17Å; F151-F162 HydrophobicContact CB-CD1 3.81Å; F151-F162 HydrophobicContact CB-CE1 4.19Å; F151-F162 HydrophobicContact CB-CG 4.35Å; F151-F162 HydrophobicContact CD1-CB 4.13Å; F151-F162 HydrophobicContact CD1-CD1 4Å; F151-F162 HydrophobicContact CD1-CG 4.4Å; F151-F162 HydrophobicContact CG-CB 4.5Å; F151-F162 HydrophobicContact CG-CD1 4.22Å; A153-F162 HydrophobicContact CB-CZ 4.13Å; Q160-F162 HydrophobicContact CB-CE2 3.68Å; Q160-F162 HydrophobicContact CB-CZ 4.03Å; Q160-F162 WeakPolarHBondContact O-CD2 3.41Å; Q160-F162 WeakPolarHBondContact O-CE2 3.17Å
163	P	92.9	Very high	91.9	Very high	101 Å²	101	63 Å²	63	66%	0.656	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.8	143.4	176.1	29.5	-33.9	0	0	0	110.9
164	L	88.6	Confident	92	Very high	7 Å²	7	64.4 Å²	64.4	4%	0.037	32%	0.317	C	S	.	.			trans	-132	105.6	-174.9	-66.1	170.3	0	0	0	108.4	V114 K115 L117 L148 F151 E166	V114-L164 HydrophobicContact CG1-CB 4.46Å; V114-L164 HydrophobicContact CG1-CD1 3.5Å; V114-L164 VanDerWaalsContact CG1-CD1 3.5Å; V114-L164 VanDerWaalsContact O-O 3.09Å; K115-L164 CarbonylContact C-O 3.48Å; K115-L164 VanDerWaalsContact CA-O 3.23Å; K115-L164 WeakPolarHBondContact CA-O 3.24Å; K115-L164 PolarHBondContact O-N 2.88Å; L117-L164 HydrophobicContact CB-CD1 3.65Å; L148-L164 HydrophobicContact CB-CD2 4.18Å; L148-L164 HydrophobicContact CD1-CD1 3.91Å; L148-L164 HydrophobicContact CD1-CD2 4.08Å; L148-L164 HydrophobicContact CD1-CG 4.41Å; F151-L164 HydrophobicContact CE1-CD2 3.77Å; F151-L164 HydrophobicContact CE2-CD2 3.68Å; F151-L164 HydrophobicContact CZ-CD2 3.16Å; L164-E166 VanDerWaalsContact C-N 3.32Å; L164-E166 PolarHBondContact O-N 3.47Å
165	D	76.7	Confident	92	Very high	131 Å²	131	57.8 Å²	57.8	70%	0.701	29%	0.292	S	S	*	.			trans	-92.5	60	-177.8	-99.3	-38.5	0	0	0	112.1	K54	K54-D165 IonicContact NZ-OD1 3.04Å; K54-D165 PolarHBondContact NZ-OD1 3.28Å; K54-D165 IonicContact NZ-OD2 2.71Å; K54-D165 PolarHBondContact NZ-OD2 3.28Å
166	E	80.4	Confident	92.1	Very high	51 Å²	51	54.6 Å²	54.6	24%	0.238	27%	0.274	C	S	.	.			trans	-103.5	146.3	177.4	-173	58.6	-96.5	0	0	111.7	K115 I136 L148 L164 L168	K115-E166 PolarHBondContact NZ-O 2.79Å; I136-E166 HydrophobicContact CD1-CG 4.07Å; L148-E166 HydrophobicContact CD2-CB 3.81Å; L148-E166 HydrophobicContact CD2-CG 3.57Å; L164-E166 VanDerWaalsContact C-N 3.32Å; L164-E166 PolarHBondContact O-N 3.47Å; E166-L168 HydrophobicContact CG-CB 3.98Å; E166-L168 HydrophobicContact CG-CG 4.43Å; E166-L168 PolarHBondContact OE1-N 3.43Å
167	Q	78.9	Confident	92.3	Very high	159 Å²	159	52.4 Å²	52.4	74%	0.743	27%	0.265	S	S	*	.			trans	-107.4	-10.1	177.8	-69.2	-176.1	-18.4	0	0	113.2	Y169	Q167-Y169 PolarHBondContact O-N 2.84Å
168	L	89.1	Confident	92.5	Very high	84 Å²	84	52 Å²	52	44%	0.44	27%	0.269	S	S	.	.			trans	-71.6	124.8	175.8	-65.6	169.7	0	0	0	111.8	I136 V146 E166	I136-L168 HydrophobicContact CD1-CB 4.03Å; V146-L168 HydrophobicContact CG1-CD1 3.91Å; V146-L168 HydrophobicContact CG2-CD1 4.4Å; E166-L168 HydrophobicContact CG-CB 3.98Å; E166-L168 HydrophobicContact CG-CG 4.43Å; E166-L168 PolarHBondContact OE1-N 3.43Å
169	Y	92.9	Very high	92.6	Very high	56 Å²	56	49 Å²	49	22%	0.22	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	134.6	165.3	-80	-85.8	0	0	0	111	I112 Q113 Q167 S198 M199 E202	I112-Y169 VanDerWaalsContact C-CD1 3.46Å; I112-Y169 WeakPolarHBondContact O-CA 3.3Å; Q113-Y169 HydrophobicContact CG-CD1 4.09Å; Q113-Y169 HydrophobicContact CG-CD2 3.75Å; Q113-Y169 HydrophobicContact CG-CE1 3.79Å; Q113-Y169 HydrophobicContact CG-CE2 3.44Å; Q113-Y169 VanDerWaalsContact CG-CE2 3.44Å; Q113-Y169 HydrophobicContact CG-CG 4.06Å; Q113-Y169 VanDerWaalsContact CG-CZ 3.46Å; Q113-Y169 VanDerWaalsContact NE2-CE2 3.25Å; Q113-Y169 VanDerWaalsContact NE2-CZ 3.34Å; Q113-Y169 PolarHBondContact NE2-OH 3.5Å; Q167-Y169 PolarHBondContact O-N 2.84Å; Y169-S198 PolarHBondContact OH-O 2.75Å; Y169-M199 HydrophobicContact CD1-CG 3.96Å; Y169-M199 HydrophobicContact CD1-SD 3.89Å; Y169-M199 HydrophobicContact CD2-SD 3.74Å; Y169-M199 HydrophobicContact CE1-CB 4.35Å; Y169-M199 HydrophobicContact CE1-CG 3.68Å; Y169-M199 HydrophobicContact CE1-SD 3.6Å; Y169-M199 HydrophobicContact CE2-SD 3.41Å; Y169-M199 WeakPolarHBondContact CE2-SD 3.37Å; Y169-M199 HydrophobicContact CG-SD 3.96Å; Y169-E202 PolarHBondContact OH-OE2 3.02Å
170	A	94.9	Very high	92.6	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	143.9	174.9	0	0	0	0	0	112.1	P111 I112 I136 S137	P111-A170 WeakPolarHBondContact CA-O 3.47Å; I112-A170 PolarHBondContact N-O 3.12Å; I112-A170 PolarHBondContact O-N 3.03Å; I136-A170 HydrophobicContact CB-CB 3.68Å; I136-A170 HydrophobicContact CD1-CB 3.87Å; I136-A170 HydrophobicContact CG1-CB 4.23Å; I136-A170 HydrophobicContact CG2-CB 4.28Å; S137-A170 WeakPolarHBondContact O-CB 3.3Å
171	K	95.8	Very high	92.6	Very high	54 Å²	54	52 Å²	52	24%	0.235	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	-20.6	171.1	-154.3	-167.2	-177.8	-166.9	0	112.7	E107 L108 P111 S137	E107-K171 HydrophobicContact CG-CD 4.15Å; E107-K171 HydrophobicContact CG-CG 4.42Å; E107-K171 IonicContact OE1-NZ 2.88Å; E107-K171 PolarHBondContact OE1-NZ 3.47Å; L108-K171 WeakPolarHBondContact CB-O 3.1Å; L108-K171 PolarHBondContact N-O 2.56Å; L108-K171 VanDerWaalsContact O-CE 3.25Å; L108-K171 WeakPolarHBondContact O-CE 3.25Å; P111-K171 HydrophobicContact CB-CB 4.32Å; S137-K171 PolarHBondContact O-N 2.96Å
172	Y	97.3	Very high	92.4	Very high	31 Å²	31	51.7 Å²	51.7	12%	0.122	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	125.4	-174.5	-53.1	-77.5	0	0	0	111.2	L73 I106 E107 I136 S137 D138 R139 Y140	L73-Y172 HydrophobicContact CD1-CD1 3.58Å; L73-Y172 HydrophobicContact CD1-CE1 3.57Å; I106-Y172 VanDerWaalsContact O-CA 3.32Å; I106-Y172 WeakPolarHBondContact O-CA 3.36Å; E107-Y172 HydrophobicContact CB-CD1 3.81Å; E107-Y172 HydrophobicContact CB-CE1 3.69Å; E107-Y172 HydrophobicContact CG-CD1 3.97Å; E107-Y172 HydrophobicContact CG-CE1 3.44Å; E107-Y172 VanDerWaalsContact CG-CE1 3.44Å; I136-Y172 CarbonylContact C-O 3.51Å; I136-Y172 VanDerWaalsContact CA-O 3.3Å; I136-Y172 WeakPolarHBondContact CA-O 3.39Å; S137-Y172 PolarHBondContact N-O 3.04Å; S137-Y172 PolarHBondContact O-N 3.01Å; D138-Y172 WeakPolarHBondContact O-CD2 3.35Å; D138-Y172 WeakPolarHBondContact O-CE2 3.44Å; R139-Y172 VanDerWaalsContact C-CD2 3.48Å; Y140-Y172 HydrophobicContact CG-CD1 4.39Å
173	V	97.1	Very high	92.3	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	126.1	177	-175.1	0	0	0	0	108.9	V105 I106 L108 V114 L117 V134 I136 V175 V194	V105-V173 CarbonylContact C-O 3.51Å; V105-V173 WeakPolarHBondContact CA-O 3.3Å; I106-V173 PolarHBondContact N-O 2.61Å; I106-V173 PolarHBondContact O-N 2.68Å; L108-V173 HydrophobicContact CD1-CG2 3.8Å; L108-V173 HydrophobicContact CD2-CG2 4.07Å; L108-V173 HydrophobicContact CG-CG2 4.01Å; V114-V173 HydrophobicContact CG2-CG2 4.42Å; L117-V173 HydrophobicContact CD1-CG1 4.47Å; V134-V173 HydrophobicContact CG1-CG1 4.01Å; I136-V173 HydrophobicContact CG2-CG2 4.27Å; V173-V175 HydrophobicContact CG1-CG2 4.46Å; V173-V194 HydrophobicContact CG2-CG1 4.38Å
174	K	96.7	Very high	92.3	Very high	34 Å²	34	55.2 Å²	55.2	15%	0.148	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	133.1	172.3	-174.3	-179.9	-164.7	-163.2	0	109.9	F104 V105 S135 W145 E176	F104-K174 WeakPolarHBondContact O-CA 3.1Å; V105-K174 HydrophobicContact CG2-CB 4.1Å; V105-K174 HydrophobicContact CG2-CD 4.27Å; V105-K174 HydrophobicContact CG2-CG 3.87Å; S135-K174 PolarHBondContact N-O 3.26Å; S135-K174 PolarHBondContact O-N 3.42Å; W145-K174 HydrophobicContact CD2-CB 4.23Å; W145-K174 HydrophobicContact CD2-CD 4.12Å; W145-K174 HydrophobicContact CE3-CB 3.72Å; W145-K174 HydrophobicContact CE3-CD 4.46Å; W145-K174 HydrophobicContact CH2-CB 3.92Å; W145-K174 HydrophobicContact CZ2-CB 4.39Å; W145-K174 HydrophobicContact CZ2-CD 4.36Å; W145-K174 HydrophobicContact CZ3-CB 3.56Å; K174-E176 HydrophobicContact CD-CG 4.37Å; K174-E176 VanDerWaalsContact CE-OE1 3.23Å; K174-E176 WeakPolarHBondContact CE-OE1 3.27Å; K174-E176 HydrophobicContact CG-CG 4.39Å; K174-E176 IonicContact NZ-OE1 2.64Å; K174-E176 PolarHBondContact NZ-OE1 3.33Å
175	V	97.2	Very high	92.6	Very high	2 Å²	2	62.3 Å²	62.3	1%	0.012	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	132.1	171.5	-175.9	0	0	0	0	108.6	W103 F104 F132 L133 V173 I192	W103-V175 CarbonylContact C-O 3.56Å; W103-V175 VanDerWaalsContact CA-O 3.23Å; W103-V175 WeakPolarHBondContact CA-O 3.44Å; W103-V175 WeakPolarHBondContact CB-O 3.48Å; F104-V175 HydrophobicContact CD2-CB 4.3Å; F104-V175 HydrophobicContact CE1-CB 4.06Å; F104-V175 HydrophobicContact CE1-CG1 4.19Å; F104-V175 HydrophobicContact CE2-CB 3.74Å; F104-V175 HydrophobicContact CE2-CG1 4.47Å; F104-V175 HydrophobicContact CE2-CG2 3.82Å; F104-V175 HydrophobicContact CZ-CB 3.6Å; F104-V175 HydrophobicContact CZ-CG1 3.87Å; F104-V175 HydrophobicContact CZ-CG2 4.02Å; F104-V175 PolarHBondContact N-O 3.05Å; F104-V175 PolarHBondContact O-N 3.27Å; F132-V175 HydrophobicContact CD2-CG1 4.16Å; L133-V175 WeakPolarHBondContact O-CA 3.46Å; V173-V175 HydrophobicContact CG1-CG2 4.46Å; V175-I192 HydrophobicContact CG2-CD1 3.81Å
176	E	96.8	Very high	93.5	Very high	26 Å²	26	60.4 Å²	60.4	12%	0.121	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	117.2	170.4	-49.8	-170.2	160.8	0	0	108.7	K101 W103 F132 L133 K174 L178	K101-E176 VanDerWaalsContact CE-OE2 3.23Å; K101-E176 WeakPolarHBondContact CE-OE2 3.49Å; K101-E176 IonicContact NZ-OE1 3.06Å; K101-E176 IonicContact NZ-OE2 3.6Å; K101-E176 PolarHBondContact NZ-OE2 2.72Å; W103-E176 HydrophobicContact CB-CB 4.26Å; W103-E176 HydrophobicContact CB-CG 3.96Å; F132-E176 CarbonylContact C-O 3.39Å; F132-E176 WeakPolarHBondContact CA-O 3.23Å; L133-E176 HydrophobicContact CB-CB 4.35Å; L133-E176 PolarHBondContact N-O 3.16Å; L133-E176 PolarHBondContact O-N 2.92Å; K174-E176 HydrophobicContact CD-CG 4.37Å; K174-E176 VanDerWaalsContact CE-OE1 3.23Å; K174-E176 WeakPolarHBondContact CE-OE1 3.27Å; K174-E176 HydrophobicContact CG-CG 4.39Å; K174-E176 IonicContact NZ-OE1 2.64Å; K174-E176 PolarHBondContact NZ-OE1 3.33Å; E176-L178 HydrophobicContact CB-CD2 4.38Å
177	L	96.3	Very high	94.2	Very high	25 Å²	25	58.1 Å²	58.1	13%	0.131	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	124.5	174.5	-176.4	63.2	0	0	0	108.3	I102 P129 F132 S179	I102-L177 HydrophobicContact CB-CB 4.05Å; I102-L177 HydrophobicContact CD1-CD2 4.07Å; I102-L177 HydrophobicContact CG2-CB 4Å; I102-L177 HydrophobicContact CG2-CD2 4.37Å; I102-L177 PolarHBondContact O-N 3.06Å; P129-L177 HydrophobicContact CB-CD1 3.51Å; P129-L177 HydrophobicContact CB-CD2 4.01Å; P129-L177 HydrophobicContact CB-CG 4.44Å; F132-L177 HydrophobicContact CB-CD1 3.88Å; L177-S179 VanDerWaalsContact CD1-O 3.25Å; L177-S179 WeakPolarHBondContact CD1-O 3.44Å
178	L	95.5	Very high	95	Very high	89 Å²	89	50.8 Å²	50.8	47%	0.466	27%	0.272	S	S	.	.			trans	-99	-32.2	-173.2	-49.3	178.7	0	0	0	112	D131 L133 T150 E176	D131-L178 HydrophobicContact CB-CB 4.4Å; D131-L178 WeakPolarHBondContact O-CA 3.19Å; D131-L178 VanDerWaalsContact O-CB 3.27Å; D131-L178 WeakPolarHBondContact O-CB 3.41Å; D131-L178 PolarHBondContact O-N 3.47Å; L133-L178 HydrophobicContact CB-CD1 4.28Å; L133-L178 HydrophobicContact CB-CD2 4.31Å; L133-L178 HydrophobicContact CB-CG 4.44Å; T150-L178 HydrophobicContact CG2-CD1 3.71Å; E176-L178 HydrophobicContact CB-CD2 4.38Å
179	S	95.9	Very high	95.3	Very high	29 Å²	29	47.3 Å²	47.3	20%	0.203	25%	0.254	C	S	.	.			trans	-152.3	170.4	178.5	74.9	0	0	0	0	112.1	K130 D131 L177	K130-S179 WeakPolarHBondContact CB-OG 3.34Å; K130-S179 WeakPolarHBondContact CG-OG 3.46Å; K130-S179 PolarHBondContact N-O 2.8Å; D131-S179 VanDerWaalsContact CB-OG 3.32Å; D131-S179 WeakPolarHBondContact CB-OG 3.22Å; D131-S179 PolarHBondContact N-OG 3.06Å; D131-S179 PolarHBondContact O-N 3.12Å; D131-S179 VanDerWaalsContact O-N 3.16Å; D131-S179 WeakPolarHBondContact OD2-CB 3.34Å; D131-S179 PolarHBondContact OD2-OG 3.25Å; L177-S179 VanDerWaalsContact CD1-O 3.25Å; L177-S179 WeakPolarHBondContact CD1-O 3.44Å
180	H	95.5	Very high	95.4	Very high	68 Å²	68	44.7 Å²	44.7	32%	0.315	24%	0.244	S	C	.	.	B	Isolated β-bridge	trans	-138.2	161.9	179.6	50.9	-90.1	0	0	0	110.9	C98 T128 C187	C98-H180 PolarHBondContact O-CE1 3.3Å; T128-H180 CarbonylContact O-C 3.54Å; T128-H180 WeakPolarHBondContact O-CA 3.18Å; T128-H180 VanDerWaalsContact O-CB 3.27Å; T128-H180 WeakPolarHBondContact O-CB 3.39Å; H180-C187 VanDerWaalsContact CB-SG 3.51Å
181	F	94.8	Very high	95.5	Very high	55 Å²	55	44.9 Å²	44.9	24%	0.241	25%	0.245	C	C	.	.	S	Bend	trans	-95	164.3	161.3	-53.4	-88.6	0	0	0	110	S127 T128 K130 A153 D155	S127-F181 WeakPolarHBondContact CA-O 3.43Å; S127-F181 WeakPolarHBondContact CB-O 3.37Å; S127-F181 PolarHBondContact OG-O 3.16Å; T128-F181 PolarHBondContact N-O 2.88Å; T128-F181 PolarHBondContact O-N 2.87Å; T128-F181 WeakPolarHBondContact OG1-CB 3.45Å; T128-F181 WeakPolarHBondContact OG1-CD2 3.24Å; K130-F181 HydrophobicContact CB-CD2 3.62Å; K130-F181 HydrophobicContact CB-CE1 4.48Å; K130-F181 HydrophobicContact CB-CE2 3.53Å; K130-F181 HydrophobicContact CB-CG 4.16Å; K130-F181 HydrophobicContact CB-CZ 4Å; K130-F181 HydrophobicContact CD-CD1 3.88Å; K130-F181 HydrophobicContact CD-CD2 4.43Å; K130-F181 HydrophobicContact CD-CE1 3.63Å; K130-F181 HydrophobicContact CD-CE2 4.21Å; K130-F181 HydrophobicContact CD-CG 4.28Å; K130-F181 HydrophobicContact CD-CZ 3.83Å; K130-F181 HydrophobicContact CG-CD1 4.32Å; K130-F181 HydrophobicContact CG-CD2 4.07Å; K130-F181 HydrophobicContact CG-CE1 3.88Å; K130-F181 HydrophobicContact CG-CE2 3.59Å; K130-F181 HydrophobicContact CG-CG 4.41Å; K130-F181 HydrophobicContact CG-CZ 3.5Å; A153-F181 WeakPolarHBondContact O-CE2 3.3Å; A153-F181 WeakPolarHBondContact O-CZ 3.41Å; D155-F181 HydrophobicContact CB-CB 4.3Å; D155-F181 HydrophobicContact CB-CD1 4.21Å; D155-F181 HydrophobicContact CB-CD2 3.8Å; D155-F181 HydrophobicContact CB-CE1 4.44Å; D155-F181 HydrophobicContact CB-CE2 4.06Å; D155-F181 HydrophobicContact CB-CG 3.88Å; D155-F181 HydrophobicContact CB-CZ 4.36Å
182	G	92.6	Very high	95.5	Very high	59 Å²	59	42.3 Å²	42.3	61%	0.608	23%	0.234	S	C	*	.	S	Bend	trans	79.2	-178.4	-174.1	0	0	0	0	0	113.2
183	A	91.6	Very high	95.4	Very high	96 Å²	96	42.9 Å²	42.9	79%	0.793	24%	0.236	S	C	*	.			trans	-131.1	16	178.1	0	0	0	0	0	112.1
184	E	94.6	Very high	95.4	Very high	104 Å²	104	42.9 Å²	42.9	49%	0.486	24%	0.236	S	C	.	.			trans	-71.6	149.1	-179.4	-56.6	-59.4	158.7	0	0	110.9	C98 S127 F186	C98-E184 PolarHBondContact SG-O 3.29Å; S127-E184 WeakPolarHBondContact OG-CA 3.33Å; S127-E184 WeakPolarHBondContact OG-CB 3.44Å; S127-E184 PolarHBondContact OG-N 2.81Å; S127-E184 PolarHBondContact OG-O 3.21Å; S127-E184 VanDerWaalsContact OG-O 3.08Å; E184-F186 PolarHBondContact O-N 3Å; E184-F186 VanDerWaalsContact O-N 3.14Å
185	H	93.6	Very high	95.3	Very high	155 Å²	155	42.4 Å²	42.4	72%	0.718	23%	0.233	S	C	*	.	S	Bend	trans	-62.8	-22.5	-177.6	-64.9	-58.2	0	0	0	114.3	P97 C98	P97-H185 WeakPolarHBondContact CA-O 3.42Å; C98-H185 PolarHBondContact N-O 2.97Å
186	F	95.3	Very high	95.1	Very high	91 Å²	91	42.3 Å²	42.3	40%	0.399	23%	0.233	S	C	.	.	B	Isolated β-bridge	trans	-121.4	136.8	-174.4	-66.5	-70.3	0	0	0	112.7	L95 N96 P97 C98 S127 E184 P188	L95-F186 HydrophobicContact CD1-CB 3.67Å; L95-F186 HydrophobicContact CD1-CD1 3.85Å; L95-F186 HydrophobicContact CD1-CG 3.81Å; L95-F186 HydrophobicContact CD2-CD1 4.26Å; L95-F186 HydrophobicContact CD2-CE1 4.36Å; L95-F186 HydrophobicContact CG-CD1 3.91Å; L95-F186 HydrophobicContact CG-CE1 4.4Å; L95-F186 HydrophobicContact CG-CG 4.35Å; N96-F186 WeakPolarHBondContact O-CA 3.49Å; P97-F186 HydrophobicContact CG-CE1 4.45Å; C98-F186 PolarHBondContact SG-O 3.43Å; S127-F186 PolarHBondContact N-O 2.99Å; E184-F186 PolarHBondContact O-N 3Å; E184-F186 VanDerWaalsContact O-N 3.14Å; F186-P188 VanDerWaalsContact C-CD 3.46Å; F186-P188 VanDerWaalsContact O-CD 3.26Å; F186-P188 WeakPolarHBondContact O-CD 3.25Å
187	C	95.8	Very high	94.8	Very high	4 Å²	4	41.6 Å²	41.6	3%	0.027	23%	0.23	C	C	.	.			trans	-115.8	78.4	177.7	-78.8	0	0	0	0	107.2	N96 C98 I102 S127 H180	N96-C187 PolarHBondContact O-N 2.97Å; C98-C187 VanDerWaalsContact CA-SG 3.53Å; C98-C187 HydrophobicContact CB-CB 4.16Å; C98-C187 WeakPolarHBondContact CB-SG 3.38Å; C98-C187 WeakPolarHBondContact SG-CA 3.37Å; C98-C187 WeakPolarHBondContact SG-CB 3.33Å; C98-C187 PolarHBondContact SG-N 3.19Å; C98-C187 CovalentContact SG-SG 2.04Å; C98-C187 PolarHBondContact SG-SG 2.75Å; I102-C187 HydrophobicContact CD1-CB 3.54Å; S127-C187 VanDerWaalsContact CB-SG 3.58Å; H180-C187 VanDerWaalsContact CB-SG 3.51Å
188	P	95.5	Very high	94.5	Very high	4 Å²	4	40.6 Å²	40.6	3%	0.026	23%	0.226	C	C	.	.			trans	-73.7	158.9	176.7	32.5	-33.2	0	0	0	110.8	Y93 M94 L95 E123 S126 F186	Y93-P188 HydrophobicContact CD2-CB 3.97Å; Y93-P188 HydrophobicContact CE2-CB 4.48Å; Y93-P188 HydrophobicContact CG-CB 4.19Å; M94-P188 CarbonylContact O-C 3.59Å; M94-P188 WeakPolarHBondContact O-CA 3.36Å; L95-P188 HydrophobicContact CD1-CB 4.12Å; E123-P188 HydrophobicContact CB-CG 3.85Å; E123-P188 HydrophobicContact CG-CG 4.1Å; S126-P188 VanDerWaalsContact CB-CG 3.46Å; S126-P188 VanDerWaalsContact OG-CG 3.29Å; S126-P188 WeakPolarHBondContact OG-CG 3.4Å; F186-P188 VanDerWaalsContact C-CD 3.46Å; F186-P188 VanDerWaalsContact O-CD 3.26Å; F186-P188 WeakPolarHBondContact O-CD 3.25Å
189	L	95.9	Very high	93.9	Very high	12 Å²	12	40 Å²	40	6%	0.063	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-129.8	127.2	168.6	-178.4	63.9	0	0	0	107.7	I85 Y93 M94 F104 I119 A120	I85-L189 HydrophobicContact CB-CD2 4.47Å; I85-L189 HydrophobicContact CD1-CD2 4.16Å; I85-L189 HydrophobicContact CG2-CB 3.95Å; I85-L189 HydrophobicContact CG2-CD2 3.97Å; I85-L189 HydrophobicContact CG2-CG 3.77Å; I85-L189 WeakPolarHBondContact CG2-O 3.39Å; Y93-L189 CarbonylContact C-O 3.59Å; Y93-L189 VanDerWaalsContact CA-O 3.26Å; Y93-L189 WeakPolarHBondContact CA-O 3.45Å; Y93-L189 WeakPolarHBondContact CB-O 3.44Å; M94-L189 HydrophobicContact CE-CB 4.07Å; M94-L189 HydrophobicContact CE-CD2 4.24Å; M94-L189 PolarHBondContact N-O 2.99Å; M94-L189 PolarHBondContact O-N 2.56Å; F104-L189 HydrophobicContact CE1-CD2 3.77Å; F104-L189 HydrophobicContact CZ-CD2 3.5Å; I119-L189 HydrophobicContact CD1-CD1 3.92Å; I119-L189 HydrophobicContact CD1-CD2 4.49Å; I119-L189 HydrophobicContact CG1-CD1 3.42Å; I119-L189 VanDerWaalsContact CG1-CD1 3.42Å; I119-L189 HydrophobicContact CG1-CD2 4.43Å; A120-L189 VanDerWaalsContact O-CD1 3.31Å; A120-L189 WeakPolarHBondContact O-CD1 3.39Å
190	S	95.4	Very high	93.3	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.007	24%	0.236	C	C	.	.			trans	-93.3	-40.5	-176.1	-54.3	0	0	0	0	112.1	A120 F122	A120-S190 PolarHBondContact O-N 3.16Å; F122-S190 PolarHBondContact N-OG 2.79Å
191	L	95.7	Very high	92.6	Very high	4 Å²	4	41.5 Å²	41.5	2%	0.021	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	143.4	-173.1	-177.2	64.8	0	0	0	111.3	A120 F122 V159 R193	A120-L191 HydrophobicContact CB-CB 4Å; A120-L191 PolarHBondContact N-O 2.79Å; A120-L191 PolarHBondContact O-N 2.87Å; F122-L191 HydrophobicContact CE2-CB 4.17Å; F122-L191 HydrophobicContact CZ-CB 4.45Å; F122-L191 HydrophobicContact CZ-CD2 4.3Å; V159-L191 HydrophobicContact CG2-CD2 4.1Å; L191-R193 HydrophobicContact CD1-CG 4.27Å; L191-R193 HydrophobicContact CD2-CG 4.32Å; L191-R193 HydrophobicContact CG-CG 4.22Å
192	I	96.6	Very high	91.8	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	138	158.7	-162.3	172.4	0	0	0	109.5	I85 L86 F104 I106 L117 D118 V175	I85-I192 HydrophobicContact CB-CG2 4.07Å; I85-I192 HydrophobicContact CD1-CG2 3.95Å; I85-I192 HydrophobicContact CG1-CG2 3.82Å; I85-I192 PolarHBondContact O-N 2.86Å; L86-I192 HydrophobicContact CD2-CG2 3.89Å; F104-I192 HydrophobicContact CE2-CD1 3.86Å; F104-I192 HydrophobicContact CZ-CD1 4.08Å; I106-I192 HydrophobicContact CD1-CD1 4.05Å; I106-I192 HydrophobicContact CD1-CG2 3.74Å; L117-I192 HydrophobicContact CD1-CD1 4.2Å; L117-I192 HydrophobicContact CD2-CD1 4.25Å; L117-I192 HydrophobicContact CD2-CG1 4.19Å; L117-I192 HydrophobicContact CG-CD1 4.36Å; L117-I192 HydrophobicContact CG-CG1 4.3Å; D118-I192 CarbonylContact O-C 3.58Å; D118-I192 WeakPolarHBondContact O-CA 3.27Å; D118-I192 VanDerWaalsContact O-CG1 3.31Å; D118-I192 WeakPolarHBondContact O-CG1 3.25Å; V175-I192 HydrophobicContact CG2-CD1 3.81Å
193	R	96.1	Very high	91.2	Very high	43 Å²	43	47 Å²	47	16%	0.162	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	146.9	169.5	-47.6	-166.6	-176.1	118	-12.6	109.8	N62 E88 L117 D118 L191 F195	N62-R193 HydrophobicContact CB-CB 4.38Å; N62-R193 WeakPolarHBondContact ND2-CG 3.08Å; N62-R193 VanDerWaalsContact OD1-CA 3.29Å; N62-R193 WeakPolarHBondContact OD1-CA 3.33Å; N62-R193 WeakPolarHBondContact OD1-CB 3.38Å; E88-R193 IonicContact OE1-CZ 3.81Å; E88-R193 IonicContact OE1-NH2 2.69Å; E88-R193 PolarHBondContact OE1-NH2 3.06Å; E88-R193 IonicContact OE2-CZ 2.65Å; E88-R193 VanDerWaalsContact OE2-CZ 3.29Å; E88-R193 IonicContact OE2-NE 2.72Å; E88-R193 PolarHBondContact OE2-NE 2.87Å; E88-R193 IonicContact OE2-NH2 2.65Å; E88-R193 PolarHBondContact OE2-NH2 2.75Å; L117-R193 CarbonylContact C-O 3.59Å; L117-R193 WeakPolarHBondContact CA-O 3.42Å; D118-R193 HydrophobicContact CB-CB 3.93Å; D118-R193 HydrophobicContact CB-CG 4.16Å; D118-R193 PolarHBondContact N-O 2.83Å; D118-R193 PolarHBondContact O-N 3.09Å; D118-R193 IonicContact OD2-NH1 2.7Å; D118-R193 PolarHBondContact OD2-NH1 2.85Å; L191-R193 HydrophobicContact CD1-CG 4.27Å; L191-R193 HydrophobicContact CD2-CG 4.32Å; L191-R193 HydrophobicContact CG-CG 4.22Å; R193-F195 HydrophobicContact CB-CD2 4.21Å; R193-F195 HydrophobicContact CB-CE2 3.55Å; R193-F195 HydrophobicContact CB-CZ 3.98Å; R193-F195 HydrophobicContact CG-CE2 4.33Å; R193-F195 HydrophobicContact CG-CZ 4.47Å
194	V	96.1	Very high	90.6	Very high	0 Å²	0	48 Å²	48	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	124.3	175	-175.3	0	0	0	0	108.5	N62 Y63 A64 L108 I112 V114 L117 V173	N62-V194 PolarHBondContact OD1-N 2.84Å; Y63-V194 PolarHBondContact N-O 2.7Å; A64-V194 HydrophobicContact CB-CB 3.91Å; A64-V194 HydrophobicContact CB-CG2 3.74Å; L108-V194 HydrophobicContact CD1-CG1 4.2Å; L108-V194 HydrophobicContact CD2-CB 3.95Å; L108-V194 HydrophobicContact CD2-CG1 4.14Å; L108-V194 HydrophobicContact CD2-CG2 4.15Å; I112-V194 HydrophobicContact CD1-CG1 4.08Å; V114-V194 HydrophobicContact CG1-CG1 3.73Å; V114-V194 HydrophobicContact CG2-CG1 4.1Å; L117-V194 HydrophobicContact CD1-CG2 4.32Å; L117-V194 HydrophobicContact CG-CG2 4.44Å; V173-V194 HydrophobicContact CG2-CG1 4.38Å
195	F	94.7	Very high	89.5	Confident	23 Å²	23	47.2 Å²	47.2	10%	0.101	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	147.8	-175.4	-66.1	-74.4	0	0	0	109.8	F59 N61 N62 K115 Q116 D118 R193	F59-F195 HydrophobicContact CB-CB 3.81Å; F59-F195 HydrophobicContact CB-CD1 4.18Å; F59-F195 HydrophobicContact CB-CG 4.33Å; F59-F195 HydrophobicContact CG-CB 4.45Å; F59-F195 WeakPolarHBondContact O-CD1 3.33Å; F59-F195 WeakPolarHBondContact O-CE1 3.5Å; N61-F195 VanDerWaalsContact O-CD1 3.23Å; N61-F195 WeakPolarHBondContact O-CD1 3.38Å; N62-F195 HydrophobicContact CB-CE1 4.05Å; N62-F195 HydrophobicContact CB-CZ 4.3Å; K115-F195 PolarHBondContact N-O 3.14Å; Q116-F195 HydrophobicContact CB-CB 4.12Å; Q116-F195 HydrophobicContact CG-CD2 4.28Å; Q116-F195 PolarHBondContact N-O 3.49Å; Q116-F195 PolarHBondContact O-N 2.92Å; Q116-F195 VanDerWaalsContact O-O 3.12Å; D118-F195 WeakPolarHBondContact OD2-CE2 3.23Å; R193-F195 HydrophobicContact CB-CD2 4.21Å; R193-F195 HydrophobicContact CB-CE2 3.55Å; R193-F195 HydrophobicContact CB-CZ 3.98Å; R193-F195 HydrophobicContact CG-CE2 4.33Å; R193-F195 HydrophobicContact CG-CZ 4.47Å
196	G	92.5	Very high	88.7	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.01	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177	-167.9	-177.7	0	0	0	0	0	111.8	Q113	Q113-G196 CarbonylContact O-C 3.52Å; Q113-G196 WeakPolarHBondContact O-CA 3.48Å
197	T	89.9	Confident	87.5	Confident	10 Å²	10	41.4 Å²	41.4	6%	0.061	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	130.5	174	50.4	0	0	0	0	110.9	F59 I112 Q113 E201	F59-T197 HydrophobicContact CD1-CG2 4.39Å; F59-T197 HydrophobicContact CE1-CG2 3.97Å; I112-T197 CarbonylContact C-O 3.6Å; I112-T197 VanDerWaalsContact CA-O 3.25Å; I112-T197 WeakPolarHBondContact CA-O 3.36Å; I112-T197 WeakPolarHBondContact CB-O 3.25Å; Q113-T197 PolarHBondContact N-O 3.35Å; Q113-T197 PolarHBondContact O-N 2.92Å; Q113-T197 VanDerWaalsContact O-N 3.12Å; T197-E201 WeakPolarHBondContact CA-OE2 3.41Å
198	S	90.9	Very high	86.1	Confident	5 Å²	5	47.4 Å²	47.4	4%	0.035	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	163.1	170.4	-174.5	0	0	0	0	111.2	E110 Y169 V200 E201 E202	E110-S198 VanDerWaalsContact OE2-CB 3.25Å; E110-S198 WeakPolarHBondContact OE2-CB 3.44Å; E110-S198 PolarHBondContact OE2-OG 2.88Å; Y169-S198 PolarHBondContact OH-O 2.75Å; S198-V200 PolarHBondContact O-N 2.82Å; S198-E201 PolarHBondContact O-N 3.4Å; S198-E202 PolarHBondContact O-N 2.87Å; S198-E202 VanDerWaalsContact O-N 3.09Å
199	M	83.3	Confident	84.6	Confident	77 Å²	77	50.8 Å²	50.8	38%	0.379	26%	0.261	S	S	.	.	H	α-helix	trans	-56.9	-40.6	169.9	-73.5	-67.9	-47.6	0	0	110.5	Y169 E202 Y203	Y169-M199 HydrophobicContact CD1-CG 3.96Å; Y169-M199 HydrophobicContact CD1-SD 3.89Å; Y169-M199 HydrophobicContact CD2-SD 3.74Å; Y169-M199 HydrophobicContact CE1-CB 4.35Å; Y169-M199 HydrophobicContact CE1-CG 3.68Å; Y169-M199 HydrophobicContact CE1-SD 3.6Å; Y169-M199 HydrophobicContact CE2-SD 3.41Å; Y169-M199 WeakPolarHBondContact CE2-SD 3.37Å; Y169-M199 HydrophobicContact CG-SD 3.96Å; M199-E202 PolarHBondContact O-N 3.42Å; M199-Y203 HydrophobicContact CE-CE2 4.13Å; M199-Y203 VanDerWaalsContact O-CD2 3.25Å; M199-Y203 WeakPolarHBondContact O-CD2 3.42Å; M199-Y203 PolarHBondContact O-N 2.88Å
200	V	81.9	Confident	82.7	Confident	84 Å²	84	57.3 Å²	57.3	51%	0.509	29%	0.291	S	S	.	.	H	α-helix	trans	-68.8	-43.4	-179	-176.4	0	0	0	0	110.9	S198 E202 Y203 E204	S198-V200 PolarHBondContact O-N 2.82Å; V200-E202 VanDerWaalsContact C-N 3.29Å; V200-E202 PolarHBondContact O-N 3.25Å; V200-Y203 PolarHBondContact O-N 2.98Å; V200-Y203 VanDerWaalsContact O-N 3.13Å; V200-E204 HydrophobicContact CG1-CG 4.45Å; V200-E204 WeakPolarHBondContact O-CG 3.3Å; V200-E204 PolarHBondContact O-N 3.02Å
201	E	81.9	Confident	80.6	Confident	44 Å²	44	66.8 Å²	66.8	21%	0.206	33%	0.328	C	S	.	.	H	α-helix	trans	-64	-33.3	178	-164.5	-161.8	152.6	0	0	112.2	K57 T197 S198 E204 E205	K57-E201 IonicContact NZ-OE1 2.75Å; K57-E201 PolarHBondContact NZ-OE1 3.32Å; T197-E201 WeakPolarHBondContact CA-OE2 3.41Å; S198-E201 PolarHBondContact O-N 3.4Å; E201-E204 PolarHBondContact O-N 2.65Å; E201-E205 VanDerWaalsContact O-CB 3.3Å; E201-E205 WeakPolarHBondContact O-CB 3.45Å; E201-E205 PolarHBondContact O-N 3.3Å
202	E	78.4	Confident	78	Confident	68 Å²	68	70.6 Å²	70.6	32%	0.318	35%	0.353	S	S	.	.	H	α-helix	trans	-67.9	-40.5	173.3	-172.4	171.2	-109.5	0	0	111.3	Q113 Y169 S198 M199 V200 E205 I206	Q113-E202 PolarHBondContact NE2-OE1 3.05Å; Y169-E202 PolarHBondContact OH-OE2 3.02Å; S198-E202 PolarHBondContact O-N 2.87Å; S198-E202 VanDerWaalsContact O-N 3.09Å; M199-E202 PolarHBondContact O-N 3.42Å; V200-E202 VanDerWaalsContact C-N 3.29Å; V200-E202 PolarHBondContact O-N 3.25Å; E202-E205 PolarHBondContact O-N 2.95Å; E202-I206 HydrophobicContact CG-CD1 3.96Å; E202-I206 WeakPolarHBondContact O-CB 3.39Å; E202-I206 WeakPolarHBondContact O-CD1 3.26Å; E202-I206 WeakPolarHBondContact O-CG1 3.5Å; E202-I206 PolarHBondContact O-N 2.76Å
203	Y	80.1	Confident	75.5	Confident	162 Å²	162	76 Å²	76	64%	0.635	39%	0.391	S	S	*	.	H	α-helix	trans	-65.4	-39	172.5	-83.4	-67.7	0	0	0	113.2	M199 V200 I206 A207	M199-Y203 HydrophobicContact CE-CE2 4.13Å; M199-Y203 VanDerWaalsContact O-CD2 3.25Å; M199-Y203 WeakPolarHBondContact O-CD2 3.42Å; M199-Y203 PolarHBondContact O-N 2.88Å; V200-Y203 PolarHBondContact O-N 2.98Å; V200-Y203 VanDerWaalsContact O-N 3.13Å; Y203-I206 PolarHBondContact O-N 2.78Å; Y203-A207 WeakPolarHBondContact O-CB 3.41Å; Y203-A207 PolarHBondContact O-N 2.92Å
204	E	79	Confident	72.9	Confident	117 Å²	117	81.3 Å²	81.3	55%	0.547	42%	0.423	S	S	.	.	H	α-helix	trans	-65.8	-45.4	175.1	-71.7	174	171.2	0	0	111	V200 E201 I206 A207 D208	V200-E204 HydrophobicContact CG1-CG 4.45Å; V200-E204 WeakPolarHBondContact O-CG 3.3Å; V200-E204 PolarHBondContact O-N 3.02Å; E201-E204 PolarHBondContact O-N 2.65Å; E204-I206 VanDerWaalsContact C-N 3.31Å; E204-I206 PolarHBondContact O-N 3.47Å; E204-A207 PolarHBondContact O-N 2.88Å; E204-D208 WeakPolarHBondContact O-CB 3.49Å; E204-D208 PolarHBondContact O-N 3.38Å
205	E	71.8	Confident	70.3	Confident	86 Å²	86	92.2 Å²	92.2	40%	0.402	46%	0.464	S	S	.	.	H	α-helix	trans	-64.2	-33.3	174.8	-179.3	163.4	-138	0	0	112.7	K57 E201 E202 S209	K57-E205 VanDerWaalsContact CE-CD 3.46Å; K57-E205 WeakPolarHBondContact CE-OE1 3.37Å; K57-E205 WeakPolarHBondContact CE-OE2 3.41Å; K57-E205 IonicContact NZ-OE1 3.61Å; K57-E205 PolarHBondContact NZ-OE1 3.23Å; K57-E205 IonicContact NZ-OE2 3.79Å; K57-E205 PolarHBondContact NZ-OE2 2.65Å; E201-E205 VanDerWaalsContact O-CB 3.3Å; E201-E205 WeakPolarHBondContact O-CB 3.45Å; E201-E205 PolarHBondContact O-N 3.3Å; E202-E205 PolarHBondContact O-N 2.95Å; E205-S209 VanDerWaalsContact O-CB 3.23Å; E205-S209 WeakPolarHBondContact O-CB 3.4Å; E205-S209 PolarHBondContact O-N 3.12Å; E205-S209 PolarHBondContact O-OG 2.8Å
206	I	75.8	Confident	67.8	Low	71 Å²	71	98.3 Å²	98.3	36%	0.364	50%	0.497	S	S	.	.	H	α-helix	trans	-70.7	-39.9	172.8	-70.6	165.5	0	0	0	111.2	E202 Y203 E204 S209 Q210	E202-I206 HydrophobicContact CG-CD1 3.96Å; E202-I206 WeakPolarHBondContact O-CB 3.39Å; E202-I206 WeakPolarHBondContact O-CD1 3.26Å; E202-I206 WeakPolarHBondContact O-CG1 3.5Å; E202-I206 PolarHBondContact O-N 2.76Å; Y203-I206 PolarHBondContact O-N 2.78Å; E204-I206 VanDerWaalsContact C-N 3.31Å; E204-I206 PolarHBondContact O-N 3.47Å; I206-S209 WeakPolarHBondContact CA-OG 3.31Å; I206-S209 PolarHBondContact O-N 3.22Å; I206-S209 PolarHBondContact O-OG 2.92Å; I206-Q210 HydrophobicContact CG2-CG 4.4Å; I206-Q210 VanDerWaalsContact O-CB 3.3Å; I206-Q210 WeakPolarHBondContact O-CB 3.08Å; I206-Q210 VanDerWaalsContact O-CG 3.24Å; I206-Q210 WeakPolarHBondContact O-CG 3.09Å; I206-Q210 PolarHBondContact O-N 2.81Å
207	A	69.6	Low	65.3	Low	53 Å²	53	105.6 Å²	105.6	44%	0.438	53%	0.53	S	S	.	.	H	α-helix	trans	-66.3	-47.3	176.4	0	0	0	0	0	111.8	Y203 E204 S209 Q210 Y211	Y203-A207 WeakPolarHBondContact O-CB 3.41Å; Y203-A207 PolarHBondContact O-N 2.92Å; E204-A207 PolarHBondContact O-N 2.88Å; A207-S209 VanDerWaalsContact C-N 3.29Å; A207-S209 PolarHBondContact O-N 3.24Å; A207-Q210 PolarHBondContact O-N 2.91Å; A207-Y211 PolarHBondContact O-N 3.43Å; A207-Y211 VanDerWaalsContact O-N 3.14Å
208	D	67.4	Low	62.9	Low	130 Å²	130	114 Å²	114	70%	0.695	56%	0.562	S	S	*	*	H	α-helix	trans	-65.2	-29.3	177.3	-79.4	-4.3	0	0	0	112.5	E204 Y211	E204-D208 WeakPolarHBondContact O-CB 3.49Å; E204-D208 PolarHBondContact O-N 3.38Å; D208-Y211 CarbonylContact O-C 3.57Å
209	S	63.7	Low	60.5	Low	75 Å²	75	120.2 Å²	120.2	52%	0.524	59%	0.594	S	S	.	*	H	α-helix	trans	-87.5	-21.1	174.8	59.7	0	0	0	0	114.2	E205 I206 A207 Y211	E205-S209 VanDerWaalsContact O-CB 3.23Å; E205-S209 WeakPolarHBondContact O-CB 3.4Å; E205-S209 PolarHBondContact O-N 3.12Å; E205-S209 PolarHBondContact O-OG 2.8Å; I206-S209 WeakPolarHBondContact CA-OG 3.31Å; I206-S209 PolarHBondContact O-N 3.22Å; I206-S209 PolarHBondContact O-OG 2.92Å; A207-S209 VanDerWaalsContact C-N 3.29Å; A207-S209 PolarHBondContact O-N 3.24Å; S209-Y211 VanDerWaalsContact C-N 3.29Å
210	Q	55.5	Low	58.5	Low	149 Å²	149	122.7 Å²	122.7	70%	0.696	61%	0.609	S	S	*	*	H	α-helix	trans	-77.5	-14.4	168.6	-75.8	179.9	6.5	0	0	113.1	I206 A207 P212	I206-Q210 HydrophobicContact CG2-CG 4.4Å; I206-Q210 VanDerWaalsContact O-CB 3.3Å; I206-Q210 WeakPolarHBondContact O-CB 3.08Å; I206-Q210 VanDerWaalsContact O-CG 3.24Å; I206-Q210 WeakPolarHBondContact O-CG 3.09Å; I206-Q210 PolarHBondContact O-N 2.81Å; A207-Q210 PolarHBondContact O-N 2.91Å; Q210-P212 WeakPolarHBondContact O-CD 3.08Å
211	Y	51.4	Low	56.6	Low	201 Å²	201	126.7 Å²	126.7	79%	0.788	62%	0.622	S	S	*	*	S	Bend	trans	-97.1	78	156.1	-93.2	-91.8	0	0	0	110	A207 D208 S209 S213	A207-Y211 PolarHBondContact O-N 3.43Å; A207-Y211 VanDerWaalsContact O-N 3.14Å; D208-Y211 CarbonylContact O-C 3.57Å; S209-Y211 VanDerWaalsContact C-N 3.29Å; Y211-S213 PolarHBondContact O-N 3.39Å; Y211-S213 VanDerWaalsContact O-N 3.1Å
212	P	41.6	Very low	55.3	Low	84 Å²	84	131.2 Å²	131.2	55%	0.545	65%	0.648	S	S	.	*			trans	-56.8	122	-175.2	24.3	-35.2	0	0	0	110.8	Q210 D214	Q210-P212 WeakPolarHBondContact O-CD 3.08Å; P212-D214 PolarHBondContact O-N 3.49Å
213	S	44.1	Very low	53.5	Low	114 Å²	114	139.5 Å²	139.5	80%	0.797	68%	0.678	S	S	*	*			trans	-76.9	41.7	179.5	-144.3	0	0	0	0	112.3	Y211 R215	Y211-S213 PolarHBondContact O-N 3.39Å; Y211-S213 VanDerWaalsContact O-N 3.1Å; S213-R215 PolarHBondContact O-N 3.3Å
214	D	40.3	Very low	52.1	Low	154 Å²	154	138.6 Å²	138.6	82%	0.824	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	32.9	178.8	-73.4	-26.2	0	0	0	112.3	P212	P212-D214 PolarHBondContact O-N 3.49Å
215	R	41.7	Very low	50.1	Low	228 Å²	228	142.8 Å²	142.8	86%	0.86	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.6	28	177.6	-152	-167.5	155.5	123.7	0.1	113.1	S213	S213-R215 PolarHBondContact O-N 3.3Å
216	L	43.2	Very low	48.7	Very low	152 Å²	152	143 Å²	143	80%	0.796	71%	0.706	S	S	*	*	S	Bend	trans	-149.1	72.8	164.4	-147.4	91.2	0	0	0	113.5
217	E	39.2	Very low	47.5	Very low	154 Å²	154	146 Å²	146	72%	0.72	73%	0.729	S	S	*	*	S	Bend		169	135	118.7	-92.7	-172.4	174.9	0	0	114.6
218	Y	40.7	Very low	46	Very low	186 Å²	186	146.8 Å²	146.8	73%	0.729	74%	0.743	S	S	*	*			trans	66.1	104.2	158.4	-63.9	-61	0	0	0	123.7
219	L	40	Very low	44.3	Very low	135 Å²	135	151.7 Å²	151.7	71%	0.707	75%	0.753	S	S	*	*				88.5	129.7	123.1	-70.8	162.8	0	0	0	123.4
220	D	40.2	Very low	43.2	Very low	130 Å²	130	156.3 Å²	156.3	70%	0.695	77%	0.766	S	S	*	*			trans	68.1	114.6	141.1	-62.1	-7.2	0	0	0	123.7
221	E	43.1	Very low	42.1	Very low	168 Å²	168	155.4 Å²	155.4	79%	0.785	77%	0.774	S	S	*	*			trans	70.3	113.7	137.7	-62	-169.8	159	0	0	121.3
222	D	55.5	Low	41.2	Very low	138 Å²	138	151.2 Å²	151.2	74%	0.738	77%	0.774	S	S	*	*			trans	60	112.8	132.3	-63	9	0	0	0	120.9
223	Y	38.9	Very low	41.1	Very low	243 Å²	243	156.2 Å²	156.2	95%	0.953	79%	0.79	S	S	*	*				-149.8	152.1	110.2	-110	-72.9	0	0	0	111.8
224	D	51.7	Low	40.8	Very low	143 Å²	143	157.9 Å²	157.9	77%	0.765	79%	0.785	S	S	*	*			trans	-101	167.4	-161.5	-159.6	-8.6	0	0	0	113.9
225	Y	35.9	Very low	40.6	Very low	204 Å²	204	158.3 Å²	158.3	80%	0.8	78%	0.78	S	S	*	*			trans	79.9	144.3	156.8	-127.6	-117.4	0	0	0	120
226	P	44.2	Very low	40.4	Very low	92 Å²	92	154.5 Å²	154.5	60%	0.597	78%	0.781	S	S	*	*			cis	-126.7	166	-32.5	35.9	-21.6	0	0	0	114.2
227	P	49.5	Very low	40.9	Very low	133 Å²	133	152 Å²	152	86%	0.864	78%	0.776	S	S	*	*			trans	-80.5	145.8	173.7	33.2	-35.1	0	0	0	113
228	G	37.8	Very low	41.3	Very low	70 Å²	70	153.2 Å²	153.2	72%	0.722	78%	0.779	S	S	*	*			trans	167.1	78	166.7	0	0	0	0	0	118.5
229	Y	31.5	Very low	41.7	Very low	232 Å²	232	151.8 Å²	151.8	91%	0.91	78%	0.784	S	S	*	*				-163.6	150.3	125.8	-131.5	-104.7	0	0	0	111.8
230	Q	41.6	Very low	42.2	Very low	172 Å²	172	152.3 Å²	152.3	80%	0.804	79%	0.787	S	S	*	*			trans	-84	139	169.2	-70.9	180	-56	0	0	110.3
231	P	32.7	Very low	42.5	Very low	131 Å²	131	153.6 Å²	153.6	85%	0.851	79%	0.793	S	S	*	*			trans	-77.8	112.6	151.9	-5.2	23.9	0	0	0	108.6
232	S	32.3	Very low	42.7	Very low	112 Å²	112	147.9 Å²	147.9	78%	0.783	78%	0.779	S	S	*	*			trans	-69.9	154.3	161.7	52.7	0	0	0	0	110.1	E234	S232-E234 PolarHBondContact O-N 2.91Å
233	E	39.2	Very low	42.6	Very low	189 Å²	189	144.8 Å²	144.8	88%	0.883	77%	0.768	S	S	*	*			trans	-58.6	133.6	173.7	-57	178.4	157	0	0	111.6
234	E	37.6	Very low	43.3	Very low	150 Å²	150	136.1 Å²	136.1	70%	0.701	75%	0.747	S	S	*	*				-174.9	148.6	128.6	-105.6	-165.6	152.7	0	0	114.6	S232	S232-E234 PolarHBondContact O-N 2.91Å
235	K	36.6	Very low	43.6	Very low	163 Å²	163	133.2 Å²	133.2	71%	0.709	73%	0.734	S	S	*	*			trans	65	82.8	148.7	-69.6	162.8	-174.6	150	0	119.6
236	V	36.8	Very low	44.8	Very low	148 Å²	148	127.3 Å²	127.3	90%	0.897	72%	0.72	S	S	*	*			trans	-46.6	136	148.3	170.8	0	0	0	0	112.6
237	S	53.6	Low	45.5	Very low	98 Å²	98	127.1 Å²	127.1	69%	0.685	71%	0.714	S	S	*	*			trans	-160.2	157.8	140.8	63.2	0	0	0	0	111.8
238	K	48.9	Very low	46.1	Very low	181 Å²	181	123.6 Å²	123.6	79%	0.787	70%	0.696	S	S	*	*	S	Bend	trans	78.9	67.2	177.7	-54.6	178.5	-178.2	176.3	0	117.7
239	N	48.3	Very low	47.6	Very low	156 Å²	156	125.1 Å²	125.1	83%	0.834	69%	0.686	S	S	*	*			trans	-151.7	55.1	146.2	-99.6	-28.5	0	0	0	110.1
240	L	50.8	Low	49.4	Very low	145 Å²	145	118.7 Å²	118.7	76%	0.759	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-1.2	-160.6	-90.6	166.8	0	0	0	116.8
241	L	45.5	Very low	50.2	Low	157 Å²	157	115.3 Å²	115.3	82%	0.822	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.4	-8.8	177.8	-84.6	75.7	0	0	0	114.1	T245	L241-T245 PolarHBondContact O-OG1 3.3Å
242	G	46.9	Very low	51.6	Low	48 Å²	48	115.1 Å²	115.1	50%	0.495	64%	0.644	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.6	-69.8	175.7	0	0	0	0	0	112.4	A244 T245 T246	G242-A244 PolarHBondContact O-N 3.38Å; G242-T245 PolarHBondContact O-N 2.69Å; G242-T246 PolarHBondContact O-N 3.01Å; G242-T246 PolarHBondContact O-OG1 2.92Å
243	S	54.4	Low	53.3	Low	73 Å²	73	113.8 Å²	113.8	51%	0.51	63%	0.631	S	S	.	*	H	α-helix	trans	-56.2	-47.6	-168.1	-158.3	0	0	0	0	113.4	T245 T246 D247	S243-T245 PolarHBondContact O-N 2.72Å; S243-T245 VanDerWaalsContact O-N 3.14Å; S243-T246 WeakPolarHBondContact CA-OG1 3.31Å; S243-T246 PolarHBondContact O-N 2.85Å; S243-T246 VanDerWaalsContact O-N 3.08Å; S243-T246 PolarHBondContact O-OG1 3.05Å; S243-D247 WeakPolarHBondContact O-CB 3.33Å; S243-D247 PolarHBondContact O-N 2.82Å; S243-D247 PolarHBondContact OG-OD2 3Å
244	A	53.3	Low	54.4	Low	61 Å²	61	109.6 Å²	109.6	50%	0.504	61%	0.614	S	S	.	*	H	α-helix	trans	-59	-32	-175.7	0	0	0	0	0	113.1	G242 A248	G242-A244 PolarHBondContact O-N 3.38Å; A244-A248 WeakPolarHBondContact O-CB 3.29Å; A244-A248 PolarHBondContact O-N 3.39Å
245	T	57.7	Low	55.3	Low	82 Å²	82	106.6 Å²	106.6	50%	0.503	60%	0.603	S	S	.	*	H	α-helix	trans	-74.5	-42.8	177.7	-46.4	0	0	0	0	111.2	L241 G242 S243 I249	L241-T245 PolarHBondContact O-OG1 3.3Å; G242-T245 PolarHBondContact O-N 2.69Å; S243-T245 PolarHBondContact O-N 2.72Å; S243-T245 VanDerWaalsContact O-N 3.14Å; T245-I249 HydrophobicContact CG2-CD1 4.19Å; T245-I249 WeakPolarHBondContact O-CB 3.45Å; T245-I249 WeakPolarHBondContact O-CD1 3.24Å; T245-I249 VanDerWaalsContact O-CG1 3.23Å; T245-I249 WeakPolarHBondContact O-CG1 3.4Å; T245-I249 PolarHBondContact O-N 3.1Å; T245-I249 VanDerWaalsContact O-N 3.09Å
246	T	62	Low	56.5	Low	81 Å²	81	103.8 Å²	103.8	50%	0.497	60%	0.595	S	S	.	*	H	α-helix	trans	-65.3	-41.8	173.4	34.1	0	0	0	0	112.7	G242 S243 I249 L250	G242-T246 PolarHBondContact O-N 3.01Å; G242-T246 PolarHBondContact O-OG1 2.92Å; S243-T246 WeakPolarHBondContact CA-OG1 3.31Å; S243-T246 PolarHBondContact O-N 2.85Å; S243-T246 VanDerWaalsContact O-N 3.08Å; S243-T246 PolarHBondContact O-OG1 3.05Å; T246-I249 PolarHBondContact O-N 3.14Å; T246-L250 WeakPolarHBondContact O-CB 3.47Å; T246-L250 WeakPolarHBondContact O-CG 3.36Å; T246-L250 PolarHBondContact O-N 2.93Å
247	D	59.1	Low	57.3	Low	87 Å²	87	98.8 Å²	98.8	47%	0.465	57%	0.569	S	S	.	*	H	α-helix	trans	-66.2	-41.2	178.1	-71.7	-50.8	0	0	0	111.6	S243 I249 L250 N251	S243-D247 WeakPolarHBondContact O-CB 3.33Å; S243-D247 PolarHBondContact O-N 2.82Å; S243-D247 PolarHBondContact OG-OD2 3Å; D247-I249 PolarHBondContact O-N 3.26Å; D247-L250 PolarHBondContact O-N 2.83Å; D247-N251 VanDerWaalsContact O-CB 3.23Å; D247-N251 WeakPolarHBondContact O-CB 3.09Å; D247-N251 PolarHBondContact O-N 2.66Å
248	A	62.5	Low	57.3	Low	59 Å²	59	96.9 Å²	96.9	49%	0.488	56%	0.56	S	S	.	*	H	α-helix	trans	-63.4	-40.4	174.6	0	0	0	0	0	112.4	A244 M252	A244-A248 WeakPolarHBondContact O-CB 3.29Å; A244-A248 PolarHBondContact O-N 3.39Å; A248-M252 WeakPolarHBondContact O-CB 3.46Å; A248-M252 PolarHBondContact O-N 3.25Å
249	I	67.8	Low	57.4	Low	102 Å²	102	95 Å²	95	52%	0.523	56%	0.558	S	S	.	*	H	α-helix	trans	-67.1	-46.4	176.4	-69.9	166.3	0	0	0	110.7	T245 T246 D247 N251 M252 V253	T245-I249 HydrophobicContact CG2-CD1 4.19Å; T245-I249 WeakPolarHBondContact O-CB 3.45Å; T245-I249 WeakPolarHBondContact O-CD1 3.24Å; T245-I249 VanDerWaalsContact O-CG1 3.23Å; T245-I249 WeakPolarHBondContact O-CG1 3.4Å; T245-I249 PolarHBondContact O-N 3.1Å; T245-I249 VanDerWaalsContact O-N 3.09Å; T246-I249 PolarHBondContact O-N 3.14Å; D247-I249 PolarHBondContact O-N 3.26Å; I249-N251 PolarHBondContact O-N 2.89Å; I249-M252 PolarHBondContact O-N 3.35Å; I249-V253 WeakPolarHBondContact O-CG2 3.42Å; I249-V253 PolarHBondContact O-N 2.99Å
250	L	69.7	Low	57.8	Low	98 Å²	98	93 Å²	93	51%	0.513	55%	0.551	S	S	.	*	H	α-helix	trans	-61.2	-42.7	176.7	-77.4	165.9	0	0	0	112	T246 D247 V253 N254	T246-L250 WeakPolarHBondContact O-CB 3.47Å; T246-L250 WeakPolarHBondContact O-CG 3.36Å; T246-L250 PolarHBondContact O-N 2.93Å; D247-L250 PolarHBondContact O-N 2.83Å; L250-V253 PolarHBondContact O-N 2.86Å; L250-N254 WeakPolarHBondContact O-CB 3.3Å; L250-N254 VanDerWaalsContact O-CG 3.27Å; L250-N254 PolarHBondContact O-N 2.64Å; L250-N254 PolarHBondContact O-ND2 2.82Å
251	N	58.5	Low	57.6	Low	100 Å²	100	92.7 Å²	92.7	54%	0.535	55%	0.55	S	S	.	.	H	α-helix	trans	-70.3	-33.8	179.2	-160.4	5.2	0	0	0	112.1	D247 I249 N255	D247-N251 VanDerWaalsContact O-CB 3.23Å; D247-N251 WeakPolarHBondContact O-CB 3.09Å; D247-N251 PolarHBondContact O-N 2.66Å; I249-N251 PolarHBondContact O-N 2.89Å; N251-N255 WeakPolarHBondContact O-CB 3.41Å; N251-N255 PolarHBondContact O-N 3.31Å; N251-N255 PolarHBondContact O-ND2 2.9Å; N251-N255 PolarHBondContact OD1-ND2 2.95Å; N251-N255 VanDerWaalsContact OD1-ND2 3.17Å
252	M	61.2	Low	57.5	Low	128 Å²	128	89.2 Å²	89.2	63%	0.631	55%	0.551	S	S	*	*	H	α-helix	trans	-66	-45	171.1	-172.1	-179.7	-65.8	0	0	111.7	A248 I249 N254 N255 I256	A248-M252 WeakPolarHBondContact O-CB 3.46Å; A248-M252 PolarHBondContact O-N 3.25Å; I249-M252 PolarHBondContact O-N 3.35Å; M252-N254 PolarHBondContact O-N 2.6Å; M252-N255 PolarHBondContact O-N 2.97Å; M252-I256 HydrophobicContact CG-CD1 4.16Å; M252-I256 WeakPolarHBondContact O-CG1 3.27Å; M252-I256 PolarHBondContact O-N 2.8Å
253	V	69.8	Low	56.9	Low	83 Å²	83	90 Å²	90	50%	0.503	56%	0.56	S	S	.	*	H	α-helix	trans	-61.9	-42.5	175.8	169.3	0	0	0	0	111.2	I249 L250 I256 A257	I249-V253 WeakPolarHBondContact O-CG2 3.42Å; I249-V253 PolarHBondContact O-N 2.99Å; L250-V253 PolarHBondContact O-N 2.86Å; V253-I256 PolarHBondContact O-N 2.94Å; V253-A257 WeakPolarHBondContact O-CB 3.28Å; V253-A257 PolarHBondContact O-N 3.21Å
254	N	60.8	Low	56.1	Low	101 Å²	101	95.7 Å²	95.7	54%	0.54	58%	0.575	S	S	.	*	H	α-helix	trans	-66.6	-37.5	177	-74.4	-17.4	0	0	0	112.7	L250 M252 A257 A258	L250-N254 WeakPolarHBondContact O-CB 3.3Å; L250-N254 VanDerWaalsContact O-CG 3.27Å; L250-N254 PolarHBondContact O-N 2.64Å; L250-N254 PolarHBondContact O-ND2 2.82Å; M252-N254 PolarHBondContact O-N 2.6Å; N254-A257 PolarHBondContact O-N 2.93Å; N254-A258 WeakPolarHBondContact O-CB 3.46Å; N254-A258 PolarHBondContact O-N 3.41Å
255	N	57.5	Low	55.3	Low	88 Å²	88	98.5 Å²	98.5	47%	0.471	59%	0.588	S	S	.	*	H	α-helix	trans	-65.5	-37.5	172.7	-88.1	-87.8	0	0	0	112.3	N251 M252 N259	N251-N255 WeakPolarHBondContact O-CB 3.41Å; N251-N255 PolarHBondContact O-N 3.31Å; N251-N255 PolarHBondContact O-ND2 2.9Å; N251-N255 PolarHBondContact OD1-ND2 2.95Å; N251-N255 VanDerWaalsContact OD1-ND2 3.17Å; M252-N255 PolarHBondContact O-N 2.97Å; N255-N259 WeakPolarHBondContact O-CB 3.41Å; N255-N259 PolarHBondContact O-N 3.49Å; N255-N259 VanDerWaalsContact O-N 3.08Å; N255-N259 PolarHBondContact O-ND2 3.29Å; N255-N259 VanDerWaalsContact O-ND2 3.07Å
256	I	60.6	Low	54.1	Low	103 Å²	103	102.2 Å²	102.2	53%	0.528	61%	0.605	S	S	.	*	H	α-helix	trans	-66.6	-42.4	174.1	-67.5	164.4	0	0	0	110.4	M252 V253 N259 V260	M252-I256 HydrophobicContact CG-CD1 4.16Å; M252-I256 WeakPolarHBondContact O-CG1 3.27Å; M252-I256 PolarHBondContact O-N 2.8Å; V253-I256 PolarHBondContact O-N 2.94Å; I256-N259 PolarHBondContact O-N 3.49Å; I256-V260 VanDerWaalsContact O-CG2 3.32Å; I256-V260 WeakPolarHBondContact O-CG2 3.35Å; I256-V260 PolarHBondContact O-N 2.98Å
257	A	55.3	Low	52.8	Low	43 Å²	43	107.3 Å²	107.3	36%	0.355	63%	0.625	S	S	.	*	H	α-helix	trans	-62.5	-45.1	176	0	0	0	0	0	112.4	V253 N254 N259 V260 L261	V253-A257 WeakPolarHBondContact O-CB 3.28Å; V253-A257 PolarHBondContact O-N 3.21Å; N254-A257 PolarHBondContact O-N 2.93Å; A257-N259 VanDerWaalsContact C-N 3.34Å; A257-N259 PolarHBondContact O-N 2.68Å; A257-V260 PolarHBondContact O-N 3.44Å; A257-L261 WeakPolarHBondContact O-CB 3.43Å; A257-L261 PolarHBondContact O-N 3.39Å
258	A	53	Low	51.4	Low	59 Å²	59	112.4 Å²	112.4	49%	0.488	65%	0.647	S	S	.	*	H	α-helix	trans	-63.7	-36.5	178.1	0	0	0	0	0	113	N254 V260	N254-A258 WeakPolarHBondContact O-CB 3.46Å; N254-A258 PolarHBondContact O-N 3.41Å; A258-V260 VanDerWaalsContact C-N 3.3Å; A258-V260 PolarHBondContact O-N 3.44Å
259	N	51.7	Low	49.8	Very low	140 Å²	140	113.1 Å²	113.1	75%	0.749	66%	0.659	S	S	*	*	H	α-helix	trans	-77	-13.4	176.8	-72.4	-34.7	0	0	0	113.9	N255 I256 A257	N255-N259 WeakPolarHBondContact O-CB 3.41Å; N255-N259 PolarHBondContact O-N 3.49Å; N255-N259 VanDerWaalsContact O-N 3.08Å; N255-N259 PolarHBondContact O-ND2 3.29Å; N255-N259 VanDerWaalsContact O-ND2 3.07Å; I256-N259 PolarHBondContact O-N 3.49Å; A257-N259 VanDerWaalsContact C-N 3.34Å; A257-N259 PolarHBondContact O-N 2.68Å
260	V	56.3	Low	48	Very low	114 Å²	114	111.7 Å²	111.7	69%	0.691	67%	0.67	S	S	*	*	H	α-helix	trans	-99.9	-29.6	175.9	171.9	0	0	0	0	112	I256 A257 A258	I256-V260 VanDerWaalsContact O-CG2 3.32Å; I256-V260 WeakPolarHBondContact O-CG2 3.35Å; I256-V260 PolarHBondContact O-N 2.98Å; A257-V260 PolarHBondContact O-N 3.44Å; A258-V260 VanDerWaalsContact C-N 3.3Å; A258-V260 PolarHBondContact O-N 3.44Å
261	L	46.8	Very low	46.1	Very low	140 Å²	140	111.8 Å²	111.8	73%	0.733	69%	0.685	S	S	*	*	S	Bend	trans	-106.2	76.4	176.5	-63.8	175.2	0	0	0	110	A257 G263	A257-L261 WeakPolarHBondContact O-CB 3.43Å; A257-L261 PolarHBondContact O-N 3.39Å; L261-G263 PolarHBondContact O-N 2.8Å
262	G	43.7	Very low	44.7	Very low	83 Å²	83	115 Å²	115	86%	0.856	70%	0.697	S	S	*	*			trans	-59.9	99.7	-168.9	0	0	0	0	0	115.1
263	G	34.2	Very low	43.3	Very low	65 Å²	65	116.5 Å²	116.5	67%	0.67	71%	0.706	S	S	*	*			trans	-136.8	123.9	168.1	0	0	0	0	0	110.6	L261	L261-G263 PolarHBondContact O-N 2.8Å
264	K	37	Very low	41.3	Very low	192 Å²	192	116 Å²	116	84%	0.835	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-86.3	137.3	171.7	-74	-174.3	175	-174.9	0	110.4
265	P	37.3	Very low	39.8	Very low	121 Å²	121	115.7 Å²	115.7	79%	0.786	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-79.9	146.1	145.3	33.9	-29.8	0	0	0	109.8
266	D	30.7	Very low	38.5	Very low	159 Å²	159	119.1 Å²	119.1	85%	0.85	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-79.9	159.5	179.8	-61.8	-68.5	0	0	0	113
267	M	34.5	Very low	36.9	Very low	188 Å²	188	125.2 Å²	125.2	93%	0.926	77%	0.766	S	S	*	*			trans	-137	128	171.2	-163.9	175.4	86.6	0	0	109.5
268	E	30.6	Very low	35.5	Very low	195 Å²	195	127.7 Å²	127.7	91%	0.911	78%	0.781	S	S	*	*			trans	-105.5	123.7	-168.2	-173.8	176.7	-171.9	0	0	112.5
269	G	29	Very low	34.1	Very low	73 Å²	73	131.5 Å²	131.5	75%	0.753	80%	0.798	S	S	*	*			trans	78.3	136.4	168.8	0	0	0	0	0	116.3
270	G	29.2	Very low	32.9	Very low	73 Å²	73	129 Å²	129	75%	0.753	80%	0.796	S	S	*	*			cis	165.1	151.3	-7.8	0	0	0	0	0	112.2
271	A	30.9	Very low	31.5	Very low	99 Å²	99	127.9 Å²	127.9	82%	0.818	80%	0.799	S	S	*	*			trans	66	146.5	176.5	0	0	0	0	0	116.8
272	E	29.5	Very low	30.8	Very low	169 Å²	169	127.1 Å²	127.1	79%	0.79	80%	0.804	S	S	*	*			cis	-158.9	157	-11.9	-119.8	-171	174.4	0	0	111.3
273	L	30.4	Very low	30.7	Very low	158 Å²	158	129.3 Å²	129.3	83%	0.827	80%	0.803	S	S	*	*			trans	48.9	153.2	160.8	-83.6	71.9	0	0	0	120.8
274	G	27.6	Very low	30.6	Very low	74 Å²	74	131.9 Å²	131.9	76%	0.763	81%	0.81	S	S	*	*			trans	-173.6	-62.4	172.5	0	0	0	0	0	118.3
275	A	29.6	Very low	30.5	Very low	94 Å²	94	128.2 Å²	128.2	78%	0.777	80%	0.797	S	S	*	*			trans	61.2	102	178.6	0	0	0	0	0	119.2
276	N	30.2	Very low	30.9	Very low	159 Å²	159	128 Å²	128	85%	0.85	80%	0.795	S	S	*	*			trans	23.3	124.4	130.4	-49.8	-9.5	0	0	0	120.3
277	Y	27.8	Very low	30.8	Very low	232 Å²	232	127.5 Å²	127.5	91%	0.91	79%	0.792	S	S	*	*				-152.2	-178	112.3	71.2	-82.3	0	0	0	111.3
278	S	25.7	Very low	30.5	Very low	95 Å²	95	126.4 Å²	126.4	66%	0.664	79%	0.785	S	S	*	*			trans	-167.9	167.4	-158.7	54.6	0	0	0	0	112.2
279	V	24.1	Very low	30.4	Very low	139 Å²	139	122 Å²	122	84%	0.842	78%	0.775	S	S	*	*			trans	74.2	152	171.6	-168	0	0	0	0	114.3
280	A	25.5	Very low	30.4	Very low	86 Å²	86	126.8 Å²	126.8	71%	0.711	78%	0.783	S	S	*	*				-173.6	152.2	-52.6	0	0	0	0	0	109.6
281	A	26.6	Very low	30.1	Very low	92 Å²	92	130 Å²	130	76%	0.76	78%	0.783	S	S	*	*			trans	67.3	119.3	154.7	0	0	0	0	0	123.7
282	C	33.5	Very low	30.9	Very low	124 Å²	124	130.5 Å²	130.5	84%	0.838	78%	0.778	S	S	*	*			trans	64.2	167.6	141.9	-58.2	0	0	0	0	119.9
283	P	40.2	Very low	30.7	Very low	129 Å²	129	129.3 Å²	129.3	84%	0.838	77%	0.772	S	S	*	*			cis	-129.5	-144.9	4.8	42.6	-22.7	0	0	0	114.9
284	C	33.3	Very low	30.5	Very low	119 Å²	119	128.9 Å²	128.9	80%	0.804	76%	0.763	S	S	*	*			trans	-112.9	153.2	-161.5	-49.2	0	0	0	0	118.3
285	M	35.1	Very low	30.6	Very low	114 Å²	114	129 Å²	129	56%	0.562	75%	0.752	S	S	*	*			trans	57.6	154.4	151.3	-76.7	-58.3	-153.1	0	0	120.2	G303	M285-G303 WeakPolarHBondContact CE-O 3.34Å
286	P	45	Very low	30.4	Very low	116 Å²	116	132.3 Å²	132.3	75%	0.753	75%	0.752	S	S	*	*			cis	-158.1	172.8	46.2	46.2	-24	0	0	0	122.3
287	L	28.1	Very low	30.1	Very low	149 Å²	149	133.1 Å²	133.1	78%	0.78	75%	0.751	S	S	*	*			trans	52.1	133.9	144.3	-111.6	80	0	0	0	128.6
288	Q	29.3	Very low	30.4	Very low	166 Å²	166	127.4 Å²	127.4	78%	0.776	74%	0.742	S	S	*	*				121.8	98.1	120.9	-154.7	159.8	61.1	0	0	123.8
289	S	27.7	Very low	30.4	Very low	102 Å²	102	126.6 Å²	126.6	71%	0.713	74%	0.741	S	S	*	*			trans	39.5	134.4	141.6	71.3	0	0	0	0	127
290	L	28.7	Very low	30.5	Very low	174 Å²	174	124.2 Å²	124.2	91%	0.911	73%	0.731	S	S	*	*				-162.5	164.4	116.2	-113.2	173	0	0	0	112.9
291	D	24.6	Very low	30.6	Very low	140 Å²	140	128.6 Å²	128.6	75%	0.749	74%	0.737	S	S	*	*			trans	-132.6	-157.7	-162.9	-132.4	-13.8	0	0	0	109.4
292	P	46.8	Very low	30.5	Very low	110 Å²	110	132.1 Å²	132.1	71%	0.714	74%	0.737	S	S	*	*			cis	-119.3	-175.7	-3.6	47.6	-33.9	0	0	0	111.8
293	E	25.6	Very low	30.1	Very low	143 Å²	143	127.8 Å²	127.8	67%	0.668	71%	0.714	S	S	*	*			cis	-157	-178.5	0.7	-140.7	-174.4	-158	0	0	106
294	K	26.1	Very low	29.4	Very low	149 Å²	149	126.8 Å²	126.8	65%	0.648	71%	0.71	S	S	*	*			cis	-167.9	147.6	9.2	-165.3	173.6	-155.6	65.9	0	106.1
295	S	28.7	Very low	28.9	Very low	76 Å²	76	127.8 Å²	127.8	53%	0.531	71%	0.707	S	S	.	*			cis	-156.9	176.3	-8.6	-103.4	0	0	0	0	105.7
296	E	25.2	Very low	28.5	Very low	164 Å²	164	126.6 Å²	126.6	77%	0.766	72%	0.715	S	S	*	*			cis	-134.9	-130.7	9.5	-157.3	79.2	98.8	0	0	109.8
297	Q	24.7	Very low	27.5	Very low	176 Å²	176	126.1 Å²	126.1	82%	0.822	72%	0.715	S	S	*	*			trans	-160.5	171.9	-164.9	-105.8	-172.2	-19.4	0	0	112.7
298	P	33.4	Very low	27.5	Very low	113 Å²	113	124.1 Å²	124.1	73%	0.734	71%	0.713	S	S	*	*			cis	-129.4	-168.5	-19.4	42.4	-25.8	0	0	0	110.9
299	A	25.4	Very low	27.1	Very low	78 Å²	78	123 Å²	123	65%	0.645	71%	0.712	S	S	*	*			cis	-156.6	143.1	7.9	0	0	0	0	0	112.9
300	S	27.2	Very low	26.9	Very low	89 Å²	89	123.2 Å²	123.2	62%	0.622	71%	0.714	S	S	*	*			trans	40.5	139.5	133.9	64.4	0	0	0	0	123
301	E	26.8	Very low	26.7	Very low	178 Å²	178	119.3 Å²	119.3	83%	0.832	70%	0.701	S	S	*	*			cis	-162.6	-178.3	-6.3	-126.8	86.2	-102.1	0	0	105.9
302	E	24.5	Very low	26.7	Very low	166 Å²	166	117.5 Å²	117.5	78%	0.776	70%	0.7	S	S	*	*			cis	-148.8	-167.9	7.1	-138.1	-153.1	111.8	0	0	106.9
303	G	25.8	Very low	25.6	Very low	33 Å²	33	116.9 Å²	116.9	34%	0.34	70%	0.698	S	S	.	*			cis	176.6	-35.1	3.5	0	0	0	0	0	117.3	M285 N305	M285-G303 WeakPolarHBondContact CE-O 3.34Å; G303-N305 PolarHBondContact O-ND2 2.86Å
304	S	25.5	Very low	25.5	Very low	108 Å²	108	115.7 Å²	115.7	76%	0.755	71%	0.705	S	S	*	*			trans	-140	121.2	-172.5	44.8	0	0	0	0	115
305	N	23.8	Very low	25.4	Very low	140 Å²	140	114 Å²	114	75%	0.749	71%	0.712	S	S	*	*				83.9	137.6	50.8	-59.4	-18.7	0	0	0	112	G303	G303-N305 PolarHBondContact O-ND2 2.86Å
306	A	26.1	Very low	25.1	Very low	88 Å²	88	118.1 Å²	118.1	73%	0.727	73%	0.727	S	S	*	*			cis	-138.5	163.5	12.7	0	0	0	0	0	109.5
307	S	24.4	Very low	25.7	Very low	107 Å²	107	115 Å²	115	75%	0.748	72%	0.721	S	S	*	*			cis	83.8	81.8	25.7	85.3	0	0	0	0	117.4
308	S	27.1	Very low	25.6	Very low	106 Å²	106	114.8 Å²	114.8	74%	0.741	72%	0.72	S	S	*	*			trans	-165.3	118.1	150.3	56.5	0	0	0	0	107.5
309	D	20.8	Very low	25.2	Very low	142 Å²	142	114.1 Å²	114.1	76%	0.759	72%	0.718	S	S	*	*				51.5	116.9	66.3	-70.6	-46.6	0	0	0	112.6
310	S	23.3	Very low	25.2	Very low	107 Å²	107	114.7 Å²	114.7	75%	0.748	72%	0.718	S	S	*	*				68.3	142.4	81.4	104.1	0	0	0	0	112.3
311	S	24.8	Very low	25.3	Very low	92 Å²	92	119.3 Å²	119.3	64%	0.643	73%	0.729	S	S	*	*			cis	-151.7	173.7	9.4	67.9	0	0	0	0	109.8
312	S	24.3	Very low	25.4	Very low	103 Å²	103	116.8 Å²	116.8	72%	0.72	72%	0.721	S	S	*	*				51.9	153.8	103.4	99.7	0	0	0	0	117.1
313	S	24.6	Very low	25.7	Very low	96 Å²	96	116.6 Å²	116.6	67%	0.671	71%	0.714	S	S	*	*			cis	-164.8	177	12.9	55.4	0	0	0	0	112.9
314	S	23.3	Very low	25.7	Very low	118 Å²	118	122.2 Å²	122.2	83%	0.825	73%	0.731	S	S	*	*			trans	76.2	151.1	160.4	80	0	0	0	0	118.3
315	S	23.8	Very low	25.8	Very low	115 Å²	115	123.6 Å²	123.6	80%	0.804	73%	0.729	S	S	*	*			cis	-139.8	157	10.1	58.5	0	0	0	0	115.1
316	L	22.5	Very low	26.1	Very low	161 Å²	161	123.2 Å²	123.2	84%	0.843	73%	0.731	S	S	*	*			trans	-78.8	179.7	173.6	-81.7	162.1	0	0	0	112.6
317	P	38	Very low	26.1	Very low	98 Å²	98	125.1 Å²	125.1	64%	0.636	73%	0.734	S	S	*	*			cis	-116.1	-161.1	2.4	43.1	-28.6	0	0	0	112.2
318	E	22.1	Very low	26.4	Very low	173 Å²	173	127.7 Å²	127.7	81%	0.808	74%	0.738	S	S	*	*			cis	-154.2	-175.5	7	-141.9	144.2	-96	0	0	107.4
319	S	25.5	Very low	26.6	Very low	99 Å²	99	128.4 Å²	128.4	69%	0.692	74%	0.738	S	S	*	*			cis	-159.6	-153.6	14.9	58.8	0	0	0	0	111.5
320	S	25.1	Very low	27	Very low	90 Å²	90	130.9 Å²	130.9	63%	0.629	75%	0.745	S	S	*	*			trans	-48.5	127.3	176.9	47.5	0	0	0	0	115.9
321	E	28.4	Very low	27.2	Very low	186 Å²	186	134.3 Å²	134.3	87%	0.869	75%	0.749	S	S	*	*				74.6	133.8	71.1	-72.2	179.9	155.3	0	0	114.2
322	D	30.1	Very low	27.4	Very low	124 Å²	124	138.1 Å²	138.1	66%	0.663	76%	0.762	S	S	*	*			cis	-163.5	169.8	-11.6	-173.3	22	0	0	0	109.9
323	R	29.5	Very low	27.6	Very low	162 Å²	162	141.8 Å²	141.8	61%	0.611	77%	0.768	S	S	*	*			trans	70	149.5	162.5	-74.1	162.3	-164.6	-162	2.6	119.9	V1048	R323-V1048 PolarHBondContact NH1-O 3.21Å
324	Q	27.4	Very low	27.8	Very low	151 Å²	151	143.8 Å²	143.8	71%	0.706	77%	0.771	S	S	*	*			cis	-160.9	132.1	-14.1	173.9	166.3	2.5	0	0	112.8
325	I	27.6	Very low	28.1	Very low	137 Å²	137	146.4 Å²	146.4	70%	0.703	77%	0.77	S	S	*	*			trans	28.8	127.3	149.9	-56.9	170	0	0	0	120.3
326	V	28.6	Very low	28.6	Very low	132 Å²	132	146.1 Å²	146.1	80%	0.8	76%	0.757	S	S	*	*			trans	-90.2	137	157.5	173.7	0	0	0	0	110.1
327	T	27.2	Very low	29.1	Very low	128 Å²	128	144.3 Å²	144.3	79%	0.785	75%	0.754	S	S	*	*			trans	-117.8	138.5	164.1	-57.4	0	0	0	0	109
328	L	29.4	Very low	28.7	Very low	161 Å²	161	147.9 Å²	147.9	84%	0.843	76%	0.76	S	S	*	*			trans	-82.9	161.4	178.3	-79.5	159.2	0	0	0	111.7
329	V	31.7	Very low	28.8	Very low	121 Å²	121	149.4 Å²	149.4	73%	0.733	77%	0.767	S	S	*	*			trans	-77.9	130.6	177	175.6	0	0	0	0	110.6	E331	V329-E331 HydrophobicContact CG1-CG 4.12Å
330	E	30	Very low	28.9	Very low	194 Å²	194	149.8 Å²	149.8	91%	0.907	77%	0.77	S	S	*	*			trans	-116.5	137.3	147	-70.3	179.1	131.3	0	0	106.6
331	E	27.2	Very low	29.1	Very low	180 Å²	180	151.9 Å²	151.9	84%	0.841	78%	0.779	S	S	*	*			trans	-134.5	148.4	165.9	-79.4	-169.9	135.4	0	0	107.5	V329	V329-E331 HydrophobicContact CG1-CG 4.12Å
332	D	28.1	Very low	29.1	Very low	171 Å²	171	149.3 Å²	149.3	91%	0.914	78%	0.775	S	S	*	*			trans	-84	179.6	-153	-55.1	-90.3	0	0	0	117.2
333	E	30.1	Very low	28.9	Very low	180 Å²	180	149.5 Å²	149.5	84%	0.841	78%	0.782	S	S	*	*			trans	-88.4	168	-170.8	-57.1	-179.3	115.3	0	0	115.5
334	D	27.9	Very low	28.7	Very low	139 Å²	139	148.8 Å²	148.8	74%	0.743	79%	0.789	S	S	*	*			trans	75.4	106.5	146.3	-72.4	-5.3	0	0	0	124.6
335	E	30.4	Very low	29.6	Very low	172 Å²	172	147 Å²	147	80%	0.804	79%	0.791	S	S	*	*				70.9	157.8	117.4	-77.5	-68.5	112.2	0	0	125
336	E	33.9	Very low	29.4	Very low	110 Å²	110	146.3 Å²	146.3	51%	0.514	79%	0.788	S	S	.	*			trans	-55.5	160.7	-165	-119.4	-160.9	166.3	0	0	118.8	K338	E336-K338 WeakPolarHBondContact OE1-CG 3.18Å; E336-K338 IonicContact OE1-NZ 3.16Å; E336-K338 PolarHBondContact OE1-NZ 3.25Å
337	P	32.3	Very low	29.4	Very low	123 Å²	123	149.2 Å²	149.2	80%	0.799	79%	0.785	S	S	*	*				-148.4	160.9	71.4	39.5	-20.6	0	0	0	118.4
338	K	29.1	Very low	29.3	Very low	172 Å²	172	149.7 Å²	149.7	75%	0.748	78%	0.783	S	S	*	*			trans	-91.4	141.6	166.1	-64.2	174	-174.2	81.1	0	111.7	E336	E336-K338 WeakPolarHBondContact OE1-CG 3.18Å; E336-K338 IonicContact OE1-NZ 3.16Å; E336-K338 PolarHBondContact OE1-NZ 3.25Å
339	Q	25.2	Very low	29.3	Very low	205 Å²	205	149 Å²	149	96%	0.958	78%	0.775	S	S	*	*			trans	-137.5	156.3	159.4	-97.4	-167.7	2.2	0	0	112
340	S	28.4	Very low	29	Very low	107 Å²	107	153.5 Å²	153.5	75%	0.748	78%	0.779	S	S	*	*			trans	-121	157.1	-173.7	57.5	0	0	0	0	112
341	T	28.2	Very low	28.7	Very low	135 Å²	135	151.9 Å²	151.9	83%	0.828	77%	0.771	S	S	*	*			trans	-152.4	139.3	165.9	-72.5	0	0	0	0	109.1
342	V	29.6	Very low	28.7	Very low	131 Å²	131	148.3 Å²	148.3	79%	0.794	77%	0.766	S	S	*	*			trans	-140.4	137.1	-176.8	171.1	0	0	0	0	109.1
343	T	25.3	Very low	28.4	Very low	129 Å²	129	147.8 Å²	147.8	79%	0.791	76%	0.758	S	S	*	*			trans	-136.7	97.6	170.2	-47.3	0	0	0	0	111.7
344	L	25.7	Very low	28.3	Very low	147 Å²	147	143.1 Å²	143.1	77%	0.77	75%	0.751	S	S	*	*			trans	-0.8	166.4	134.5	-71.8	175.1	0	0	0	120.4
345	P	46.3	Very low	28.2	Very low	114 Å²	114	147.4 Å²	147.4	74%	0.74	76%	0.758	S	S	*	*			cis	-141.7	-179.8	-5.9	32.3	-9.6	0	0	0	117.8
346	D	22.9	Very low	28.2	Very low	121 Å²	121	144.7 Å²	144.7	65%	0.647	76%	0.757	S	S	*	*			trans	110.9	141.9	132.3	-153.4	32.7	0	0	0	121.4
347	R	27.8	Very low	28	Very low	193 Å²	193	145.2 Å²	145.2	73%	0.728	77%	0.77	S	S	*	*			trans	81.9	87.2	147.7	-129.6	172	-178.7	102.5	-4.1	122.4
348	N	26.8	Very low	27.6	Very low	139 Å²	139	149.1 Å²	149.1	74%	0.743	78%	0.775	S	S	*	*				30.4	137.2	114	-46.2	-21	0	0	0	120.3
349	Q	28.5	Very low	27.5	Very low	146 Å²	146	146.6 Å²	146.6	68%	0.682	78%	0.779	S	S	*	*				137.3	117.7	116.6	-169.6	165.8	22.8	0	0	115.9
350	W	25.7	Very low	27.6	Very low	215 Å²	215	142.6 Å²	142.6	81%	0.814	77%	0.774	S	S	*	*			trans	62.3	126.7	153.7	-66.5	8	0	0	0	117.5
351	E	23.7	Very low	27.7	Very low	160 Å²	160	146.1 Å²	146.1	75%	0.748	78%	0.783	S	S	*	*				87.5	128.2	66.3	-163.6	173.1	-130.1	0	0	113.6
352	S	26	Very low	27.7	Very low	105 Å²	105	144.8 Å²	144.8	73%	0.734	78%	0.779	S	S	*	*			trans	13.2	125.1	164.3	-55.1	0	0	0	0	120.8
353	Q	23.5	Very low	27.7	Very low	160 Å²	160	144.1 Å²	144.1	75%	0.748	78%	0.78	S	S	*	*				167.9	162	94.4	-167.6	152.4	-7.4	0	0	111.8
354	A	28.1	Very low	28.1	Very low	83 Å²	83	146.1 Å²	146.1	69%	0.686	79%	0.785	S	S	*	*			trans	-75.4	150.9	-170.7	0	0	0	0	0	115.1
355	Y	24.5	Very low	28.4	Very low	228 Å²	228	144.6 Å²	144.6	89%	0.894	79%	0.787	S	S	*	*			trans	-161.4	131.9	130.4	-114.1	-74.9	0	0	0	112
356	C	30	Very low	27.9	Very low	116 Å²	116	146.2 Å²	146.2	78%	0.784	79%	0.788	S	S	*	*			trans	-102.3	140.7	166.3	-62.7	0	0	0	0	110.2
357	P	29.6	Very low	28.5	Very low	121 Å²	121	145.1 Å²	145.1	79%	0.786	79%	0.79	S	S	*	*			trans	-123.5	125.2	148	13.1	7.8	0	0	0	111.6	S359	P357-S359 PolarHBondContact O-N 3.25Å
358	F	25.3	Very low	29.1	Very low	205 Å²	205	141.6 Å²	141.6	90%	0.899	79%	0.794	S	S	*	*			trans	-67.1	125.9	161.2	-87.6	-103.5	0	0	0	109.8
359	S	25.6	Very low	29.6	Very low	119 Å²	119	143.1 Å²	143.1	83%	0.832	80%	0.799	S	S	*	*			trans	-177.2	90.4	144.1	-84.4	0	0	0	0	113.8	P357	P357-S359 PolarHBondContact O-N 3.25Å
360	S	27.7	Very low	30.1	Very low	121 Å²	121	139.6 Å²	139.6	85%	0.846	80%	0.795	S	S	*	*			trans	173.9	119.5	130.7	39.2	0	0	0	0	110.6
361	L	30.9	Very low	31.7	Very low	180 Å²	180	133.8 Å²	133.8	94%	0.942	78%	0.783	S	S	*	*			trans	-96.5	119	162.7	-79.1	167.2	0	0	0	107.4
362	S	28.2	Very low	33.1	Very low	108 Å²	108	132.1 Å²	132.1	76%	0.755	78%	0.779	S	S	*	*			trans	-157.9	153.7	168	-81.8	0	0	0	0	109.9
363	S	30.4	Very low	34.6	Very low	117 Å²	117	131.4 Å²	131.4	82%	0.818	77%	0.772	S	S	*	*			trans	47.4	83	177.5	53.9	0	0	0	0	116.3
364	L	32.9	Very low	36.2	Very low	170 Å²	170	127.8 Å²	127.8	89%	0.89	76%	0.755	S	S	*	*			trans	-70.6	119.8	147.1	-84.5	158.9	0	0	0	108.6
365	S	32.3	Very low	37.8	Very low	115 Å²	115	128.5 Å²	128.5	80%	0.804	75%	0.747	S	S	*	*			trans	-114.1	112.3	158.1	54.8	0	0	0	0	107.5
366	L	36.4	Very low	39.8	Very low	148 Å²	148	122.3 Å²	122.3	78%	0.775	73%	0.728	S	S	*	*			trans	-96.5	121.7	-162.7	-170	75.6	0	0	0	112.3
367	S	35.6	Very low	41.4	Very low	98 Å²	98	123.2 Å²	123.2	69%	0.685	72%	0.721	S	S	*	*			trans	-151.4	169.7	162	61.5	0	0	0	0	109.9
368	C	39.6	Very low	43.3	Very low	119 Å²	119	125.1 Å²	125.1	80%	0.804	71%	0.712	S	S	*	*	S	Bend	trans	70.5	118.3	-171	-53	0	0	0	0	113.6
369	M	37	Very low	45.3	Very low	171 Å²	171	124.4 Å²	124.4	84%	0.842	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-83	134.2	-176.7	-65.4	-77.1	96.1	0	0	111.4
370	A	39.9	Very low	47.2	Very low	73 Å²	73	122.5 Å²	122.5	60%	0.603	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-102.2	139.5	160.8	0	0	0	0	0	108.7
371	T	58.8	Low	49.2	Very low	93 Å²	93	119.5 Å²	119.5	57%	0.571	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-76	151.9	-173.8	59.7	0	0	0	0	112.2	P373 E374 L375	T371-P373 VanDerWaalsContact C-CD 3.44Å; T371-P373 VanDerWaalsContact C-N 3.34Å; T371-E374 WeakPolarHBondContact O-CB 3.44Å; T371-E374 PolarHBondContact O-N 2.96Å; T371-L375 PolarHBondContact O-N 3.05Å
372	L	53.3	Low	51.2	Low	124 Å²	124	113.6 Å²	113.6	65%	0.649	65%	0.646	S	S	*	*	H	α-helix	trans	-54.7	-39.4	-175.9	-146.3	161.7	0	0	0	113.5	E374 L375 L376	L372-E374 VanDerWaalsContact C-N 3.33Å; L372-E374 PolarHBondContact O-N 2.9Å; L372-L375 WeakPolarHBondContact O-CB 3.49Å; L372-L375 PolarHBondContact O-N 2.93Å; L372-L376 HydrophobicContact CD2-CD1 3.58Å; L372-L376 HydrophobicContact CD2-CG 3.9Å; L372-L376 PolarHBondContact O-N 3.47Å
373	P	56.9	Low	53.4	Low	91 Å²	91	117.8 Å²	117.8	59%	0.591	65%	0.645	S	S	*	*	H	α-helix	trans	-60.5	-36.8	174.1	-25.4	36.2	0	0	0	113.9	T371 L376 H377	T371-P373 VanDerWaalsContact C-CD 3.44Å; T371-P373 VanDerWaalsContact C-N 3.34Å; P373-L376 PolarHBondContact O-N 3.19Å; P373-H377 WeakPolarHBondContact O-CB 3.3Å; P373-H377 PolarHBondContact O-N 2.99Å
374	E	57.5	Low	55.2	Low	83 Å²	83	116.9 Å²	116.9	39%	0.388	63%	0.631	S	S	.	*	H	α-helix	trans	-68.4	-39	177.9	-121.3	-147.4	114.5	0	0	111.4	T371 L372 H377 R378	T371-E374 WeakPolarHBondContact O-CB 3.44Å; T371-E374 PolarHBondContact O-N 2.96Å; L372-E374 VanDerWaalsContact C-N 3.33Å; L372-E374 PolarHBondContact O-N 2.9Å; E374-H377 PolarHBondContact O-N 2.95Å; E374-R378 WeakPolarHBondContact O-CB 3.32Å; E374-R378 VanDerWaalsContact O-CG 3.31Å; E374-R378 WeakPolarHBondContact O-CG 3.45Å; E374-R378 PolarHBondContact O-N 3.23Å; E374-R378 IonicContact OE1-CZ 3.38Å; E374-R378 IonicContact OE1-NE 3.15Å; E374-R378 PolarHBondContact OE1-NE 3.4Å; E374-R378 VanDerWaalsContact OE1-NE 3.15Å; E374-R378 IonicContact OE1-NH2 2.75Å; E374-R378 PolarHBondContact OE1-NH2 2.98Å
375	L	61.3	Low	57.1	Low	99 Å²	99	111.4 Å²	111.4	52%	0.518	61%	0.61	S	S	.	*	H	α-helix	trans	-61.8	-47.4	173.7	-165.3	80.7	0	0	0	110.7	T371 L372 R378 W379	T371-L375 PolarHBondContact O-N 3.05Å; L372-L375 WeakPolarHBondContact O-CB 3.49Å; L372-L375 PolarHBondContact O-N 2.93Å; L375-R378 PolarHBondContact O-N 3.02Å; L375-W379 VanDerWaalsContact O-CD1 3.28Å; L375-W379 PolarHBondContact O-N 2.95Å
376	L	66.6	Low	59	Low	98 Å²	98	112.6 Å²	112.6	51%	0.513	60%	0.6	S	S	.	*	H	α-helix	trans	-62.8	-41.7	177.2	-73.5	171.5	0	0	0	112	L372 P373 R378 W379 C380	L372-L376 HydrophobicContact CD2-CD1 3.58Å; L372-L376 HydrophobicContact CD2-CG 3.9Å; L372-L376 PolarHBondContact O-N 3.47Å; P373-L376 PolarHBondContact O-N 3.19Å; L376-R378 PolarHBondContact O-N 3.48Å; L376-W379 PolarHBondContact O-N 2.81Å; L376-C380 WeakPolarHBondContact O-CB 3.44Å; L376-C380 PolarHBondContact O-N 2.91Å; L376-C380 PolarHBondContact O-SG 3.43Å
377	H	64.3	Low	60.8	Low	135 Å²	135	109.5 Å²	109.5	63%	0.625	58%	0.582	S	S	*	*	H	α-helix	trans	-64.1	-40.7	176.5	-174.5	-128	0	0	0	112.2	P373 E374 C380 S381	P373-H377 WeakPolarHBondContact O-CB 3.3Å; P373-H377 PolarHBondContact O-N 2.99Å; E374-H377 PolarHBondContact O-N 2.95Å; H377-C380 PolarHBondContact O-N 2.62Å; H377-S381 WeakPolarHBondContact O-CB 3.33Å; H377-S381 PolarHBondContact O-N 3.09Å; H377-S381 PolarHBondContact O-OG 3.4Å
378	R	69.4	Low	62.4	Low	160 Å²	160	112.7 Å²	112.7	60%	0.604	58%	0.579	S	S	*	*	H	α-helix	trans	-65.7	-37.8	173.2	-71.1	176.7	-172.3	-132.2	5.9	112.3	E374 L375 L376 S381 A382	E374-R378 WeakPolarHBondContact O-CB 3.32Å; E374-R378 VanDerWaalsContact O-CG 3.31Å; E374-R378 WeakPolarHBondContact O-CG 3.45Å; E374-R378 PolarHBondContact O-N 3.23Å; E374-R378 IonicContact OE1-CZ 3.38Å; E374-R378 IonicContact OE1-NE 3.15Å; E374-R378 PolarHBondContact OE1-NE 3.4Å; E374-R378 VanDerWaalsContact OE1-NE 3.15Å; E374-R378 IonicContact OE1-NH2 2.75Å; E374-R378 PolarHBondContact OE1-NH2 2.98Å; L375-R378 PolarHBondContact O-N 3.02Å; L376-R378 PolarHBondContact O-N 3.48Å; R378-S381 WeakPolarHBondContact CA-OG 3.4Å; R378-S381 PolarHBondContact O-OG 3.49Å; R378-S381 VanDerWaalsContact O-OG 3.09Å; R378-A382 WeakPolarHBondContact O-CB 3.14Å; R378-A382 PolarHBondContact O-N 2.88Å
379	W	65.8	Low	64	Low	191 Å²	191	112.6 Å²	112.6	72%	0.723	57%	0.57	S	S	*	*	H	α-helix	trans	-70.3	-41.8	174.8	-88.9	71.1	0	0	0	112.9	L375 L376 A382 R383	L375-W379 VanDerWaalsContact O-CD1 3.28Å; L375-W379 PolarHBondContact O-N 2.95Å; L376-W379 PolarHBondContact O-N 2.81Å; W379-A382 PolarHBondContact O-N 3.13Å; W379-R383 VanDerWaalsContact O-CB 3.26Å; W379-R383 WeakPolarHBondContact O-CB 3.46Å; W379-R383 PolarHBondContact O-N 2.87Å
380	C	67	Low	65.6	Low	78 Å²	78	110.9 Å²	110.9	53%	0.527	55%	0.554	S	S	.	*	H	α-helix	trans	-64.9	-46.1	176.9	-78.5	0	0	0	0	111.7	L376 H377 R383 L384	L376-C380 WeakPolarHBondContact O-CB 3.44Å; L376-C380 PolarHBondContact O-N 2.91Å; L376-C380 PolarHBondContact O-SG 3.43Å; H377-C380 PolarHBondContact O-N 2.62Å; C380-R383 PolarHBondContact O-N 2.9Å; C380-L384 WeakPolarHBondContact O-CB 3.27Å; C380-L384 PolarHBondContact O-N 3.2Å
381	S	69.6	Low	67	Low	59 Å²	59	110 Å²	110	41%	0.413	54%	0.543	S	S	.	.	H	α-helix	trans	-63.7	-42.1	175	54.1	0	0	0	0	112.3	H377 R378 R383 L384 A385	H377-S381 WeakPolarHBondContact O-CB 3.33Å; H377-S381 PolarHBondContact O-N 3.09Å; H377-S381 PolarHBondContact O-OG 3.4Å; R378-S381 WeakPolarHBondContact CA-OG 3.4Å; R378-S381 PolarHBondContact O-OG 3.49Å; R378-S381 VanDerWaalsContact O-OG 3.09Å; S381-R383 PolarHBondContact O-N 3.19Å; S381-L384 PolarHBondContact O-N 3.37Å; S381-A385 WeakPolarHBondContact O-CB 3.5Å; S381-A385 PolarHBondContact O-N 3.39Å
382	A	73.1	Confident	67.5	Low	56 Å²	56	110.6 Å²	110.6	46%	0.463	54%	0.542	S	S	.	.	H	α-helix	trans	-63.2	-37.1	173.3	0	0	0	0	0	113.1	R378 W379 K386	R378-A382 WeakPolarHBondContact O-CB 3.14Å; R378-A382 PolarHBondContact O-N 2.88Å; W379-A382 PolarHBondContact O-N 3.13Å; A382-K386 PolarHBondContact O-N 3.49Å
383	R	72.8	Confident	68	Low	196 Å²	196	114 Å²	114	74%	0.74	55%	0.547	S	S	*	.	H	α-helix	trans	-67.1	-44.4	174.4	-170.5	176.6	-176.6	176.6	1.4	111	W379 C380 S381 A385 K386 E387	W379-R383 VanDerWaalsContact O-CB 3.26Å; W379-R383 WeakPolarHBondContact O-CB 3.46Å; W379-R383 PolarHBondContact O-N 2.87Å; C380-R383 PolarHBondContact O-N 2.9Å; S381-R383 PolarHBondContact O-N 3.19Å; R383-A385 VanDerWaalsContact C-N 3.34Å; R383-A385 PolarHBondContact O-N 3Å; R383-K386 PolarHBondContact O-N 2.91Å; R383-E387 PolarHBondContact O-N 2.87Å
384	L	69.4	Low	68.2	Low	98 Å²	98	117.2 Å²	117.2	51%	0.513	55%	0.547	S	S	.	.	H	α-helix	trans	-63.1	-39.5	176.3	-146.8	93	0	0	0	111.7	C380 S381 E387 R388	C380-L384 WeakPolarHBondContact O-CB 3.27Å; C380-L384 PolarHBondContact O-N 3.2Å; S381-L384 PolarHBondContact O-N 3.37Å; L384-E387 PolarHBondContact O-N 2.97Å; L384-R388 WeakPolarHBondContact O-CG 3.43Å; L384-R388 PolarHBondContact O-N 3.14Å
385	A	72.4	Confident	68.2	Low	55 Å²	55	122.9 Å²	122.9	46%	0.455	57%	0.565	S	S	.	*	H	α-helix	trans	-64.3	-42.8	173.5	0	0	0	0	0	112	S381 R383 E387 R388 L389	S381-A385 WeakPolarHBondContact O-CB 3.5Å; S381-A385 PolarHBondContact O-N 3.39Å; R383-A385 VanDerWaalsContact C-N 3.34Å; R383-A385 PolarHBondContact O-N 3Å; A385-E387 VanDerWaalsContact C-N 3.3Å; A385-E387 PolarHBondContact O-N 2.85Å; A385-R388 PolarHBondContact O-N 3.08Å; A385-L389 WeakPolarHBondContact O-CB 3.41Å; A385-L389 PolarHBondContact O-N 3.16Å
386	K	73.3	Confident	67.6	Low	139 Å²	139	124.6 Å²	124.6	60%	0.604	57%	0.57	S	S	*	*	H	α-helix	trans	-61.1	-36.9	171.3	-102.8	171.7	179.6	165.6	0	112.3	A382 R383 L389 R390	A382-K386 PolarHBondContact O-N 3.49Å; R383-K386 PolarHBondContact O-N 2.91Å; K386-L389 PolarHBondContact O-N 3.47Å; K386-R390 WeakPolarHBondContact O-CB 3.45Å; K386-R390 WeakPolarHBondContact O-CD 3.25Å; K386-R390 WeakPolarHBondContact O-CG 3.41Å; K386-R390 PolarHBondContact O-N 3.39Å
387	E	73	Confident	66.7	Low	83 Å²	83	125.9 Å²	125.9	39%	0.388	58%	0.577	S	S	.	*	H	α-helix	trans	-70.5	-42.8	177.9	-147.4	54.7	-123.1	0	0	111.9	R383 L384 A385 L389 R390 S391 R394	R383-E387 PolarHBondContact O-N 2.87Å; L384-E387 PolarHBondContact O-N 2.97Å; A385-E387 VanDerWaalsContact C-N 3.3Å; A385-E387 PolarHBondContact O-N 2.85Å; E387-L389 PolarHBondContact O-N 3.21Å; E387-R390 PolarHBondContact O-N 3Å; E387-R390 IonicContact OE2-NH1 3.13Å; E387-R390 PolarHBondContact OE2-NH1 3.43Å; E387-R390 VanDerWaalsContact OE2-NH1 3.13Å; E387-S391 PolarHBondContact O-N 2.97Å; E387-R394 IonicContact OE1-NH2 3.47Å; E387-R394 PolarHBondContact OE1-NH2 2.99Å
388	R	70	Confident	65.7	Low	166 Å²	166	126.6 Å²	126.6	63%	0.626	58%	0.58	S	S	*	*	H	α-helix	trans	-60.9	-40.8	170.9	-71.8	176.2	179.4	-175.6	0.2	112.2	L384 A385 S391 L392	L384-R388 WeakPolarHBondContact O-CG 3.43Å; L384-R388 PolarHBondContact O-N 3.14Å; A385-R388 PolarHBondContact O-N 3.08Å; R388-S391 PolarHBondContact O-N 3.22Å; R388-S391 PolarHBondContact O-OG 2.04Å; R388-L392 WeakPolarHBondContact O-CD1 3.42Å; R388-L392 PolarHBondContact O-N 2.92Å
389	L	71.6	Confident	64.5	Low	116 Å²	116	123.8 Å²	123.8	61%	0.607	58%	0.581	S	S	*	*	H	α-helix	trans	-66.6	-37.7	175.2	-172.7	63.1	0	0	0	111.8	A385 K386 E387 R393	A385-L389 WeakPolarHBondContact O-CB 3.41Å; A385-L389 PolarHBondContact O-N 3.16Å; K386-L389 PolarHBondContact O-N 3.47Å; E387-L389 PolarHBondContact O-N 3.21Å; L389-R393 VanDerWaalsContact O-CB 3.26Å; L389-R393 WeakPolarHBondContact O-CB 3.41Å; L389-R393 PolarHBondContact O-N 2.94Å
390	R	71.3	Confident	63.3	Low	135 Å²	135	125.1 Å²	125.1	51%	0.509	59%	0.586	S	S	.	*	H	α-helix	trans	-69.2	-30.5	173.7	-74.5	164.7	174.3	170.1	-4.4	113.2	K386 E387 R394	K386-R390 WeakPolarHBondContact O-CB 3.45Å; K386-R390 WeakPolarHBondContact O-CD 3.25Å; K386-R390 WeakPolarHBondContact O-CG 3.41Å; K386-R390 PolarHBondContact O-N 3.39Å; E387-R390 PolarHBondContact O-N 3Å; E387-R390 IonicContact OE2-NH1 3.13Å; E387-R390 PolarHBondContact OE2-NH1 3.43Å; E387-R390 VanDerWaalsContact OE2-NH1 3.13Å; R390-R394 WeakPolarHBondContact O-CB 3.32Å; R390-R394 WeakPolarHBondContact O-CG 3.49Å; R390-R394 PolarHBondContact O-N 2.93Å; R390-R394 VanDerWaalsContact O-N 3.12Å; R390-R394 PolarHBondContact O-NE 3.02Å
391	S	69.2	Low	61.9	Low	55 Å²	55	126.5 Å²	126.5	39%	0.385	59%	0.592	S	S	.	*	H	α-helix	trans	-77.5	-40.4	174.8	71.1	0	0	0	0	111.6	E387 R388 R394 R395	E387-S391 PolarHBondContact O-N 2.97Å; R388-S391 PolarHBondContact O-N 3.22Å; R388-S391 PolarHBondContact O-OG 2.04Å; S391-R394 PolarHBondContact O-N 2.93Å; S391-R395 PolarHBondContact O-N 2.8Å
392	L	69	Low	60.6	Low	105 Å²	105	131.9 Å²	131.9	55%	0.55	61%	0.61	S	S	.	*	H	α-helix	trans	-58.1	-47.8	168.3	-102.9	91.2	0	0	0	111.5	R388 R394 R395 Q396	R388-L392 WeakPolarHBondContact O-CD1 3.42Å; R388-L392 PolarHBondContact O-N 2.92Å; L392-R394 VanDerWaalsContact C-N 3.26Å; L392-R394 PolarHBondContact O-N 2.85Å; L392-R395 PolarHBondContact O-N 3.42Å; L392-R395 VanDerWaalsContact O-N 3.12Å; L392-Q396 WeakPolarHBondContact O-CB 3.29Å; L392-Q396 WeakPolarHBondContact O-CG 3.34Å; L392-Q396 PolarHBondContact O-N 3.35Å
393	R	64.4	Low	58.7	Low	195 Å²	195	135.5 Å²	135.5	74%	0.736	63%	0.627	S	S	*	*	H	α-helix	trans	-63.4	-32.2	179.8	-157.2	174.1	-160.8	165.8	5.8	112.2	L389 L397	L389-R393 VanDerWaalsContact O-CB 3.26Å; L389-R393 WeakPolarHBondContact O-CB 3.41Å; L389-R393 PolarHBondContact O-N 2.94Å; R393-L397 WeakPolarHBondContact O-CB 3.23Å; R393-L397 PolarHBondContact O-N 3.4Å
394	R	60.8	Low	56.6	Low	159 Å²	159	134 Å²	134	60%	0.6	63%	0.634	S	S	*	*	H	α-helix	trans	-71.1	-39.5	171.5	-81.4	-178.1	-85.2	-157.3	1.3	112.8	E387 R390 S391 L392 L397 H398	E387-R394 IonicContact OE1-NH2 3.47Å; E387-R394 PolarHBondContact OE1-NH2 2.99Å; R390-R394 WeakPolarHBondContact O-CB 3.32Å; R390-R394 WeakPolarHBondContact O-CG 3.49Å; R390-R394 PolarHBondContact O-N 2.93Å; R390-R394 VanDerWaalsContact O-N 3.12Å; R390-R394 PolarHBondContact O-NE 3.02Å; S391-R394 PolarHBondContact O-N 2.93Å; L392-R394 VanDerWaalsContact C-N 3.26Å; L392-R394 PolarHBondContact O-N 2.85Å; R394-L397 PolarHBondContact O-N 3.45Å; R394-H398 PolarHBondContact O-N 3.36Å
395	R	58.4	Low	54.6	Low	203 Å²	203	138.1 Å²	138.1	77%	0.766	65%	0.65	S	S	*	*	H	α-helix	trans	-62.5	-48.1	171.9	-75.3	-176.1	172.5	-175.5	-2.6	111.8	S391 L392 L397 H398 T399	S391-R395 PolarHBondContact O-N 2.8Å; L392-R395 PolarHBondContact O-N 3.42Å; L392-R395 VanDerWaalsContact O-N 3.12Å; R395-L397 VanDerWaalsContact C-N 3.33Å; R395-L397 PolarHBondContact O-N 2.97Å; R395-H398 WeakPolarHBondContact O-CB 3.47Å; R395-H398 PolarHBondContact O-N 3.45Å; R395-T399 PolarHBondContact O-N 3.46Å; R395-T399 VanDerWaalsContact O-N 3.14Å; R395-T399 PolarHBondContact O-OG1 2.94Å
396	Q	47.7	Very low	52.6	Low	134 Å²	134	140.3 Å²	140.3	63%	0.626	66%	0.662	S	S	*	*	H	α-helix	trans	-58.7	-38.7	176.2	-77.5	-86.6	-27	0	0	113.2	L392 H398 T399 R400	L392-Q396 WeakPolarHBondContact O-CB 3.29Å; L392-Q396 WeakPolarHBondContact O-CG 3.34Å; L392-Q396 PolarHBondContact O-N 3.35Å; Q396-H398 VanDerWaalsContact C-N 3.28Å; Q396-H398 PolarHBondContact O-N 3.48Å; Q396-T399 PolarHBondContact O-OG1 3.3Å; Q396-T399 VanDerWaalsContact O-OG1 3.14Å; Q396-R400 PolarHBondContact O-N 2.73Å
397	L	47.5	Very low	50.7	Low	125 Å²	125	141.2 Å²	141.2	65%	0.654	67%	0.672	S	S	*	*	H	α-helix	trans	-68.3	-30.2	175.9	-158.7	74	0	0	0	111.9	R393 R394 R395 T401	R393-L397 WeakPolarHBondContact O-CB 3.23Å; R393-L397 PolarHBondContact O-N 3.4Å; R394-L397 PolarHBondContact O-N 3.45Å; R395-L397 VanDerWaalsContact C-N 3.33Å; R395-L397 PolarHBondContact O-N 2.97Å; L397-T401 PolarHBondContact O-OG1 2.96Å
398	H	44.7	Very low	49.6	Very low	151 Å²	151	142.4 Å²	142.4	70%	0.699	69%	0.687	S	S	*	*	H	α-helix	trans	-77.4	-35.5	-179.3	-137.8	23.2	0	0	0	112.8	R394 R395 Q396 R400 T401	R394-H398 PolarHBondContact O-N 3.36Å; R395-H398 WeakPolarHBondContact O-CB 3.47Å; R395-H398 PolarHBondContact O-N 3.45Å; Q396-H398 VanDerWaalsContact C-N 3.28Å; Q396-H398 PolarHBondContact O-N 3.48Å; H398-R400 VanDerWaalsContact C-N 3.33Å; H398-T401 PolarHBondContact O-N 2.8Å; H398-T401 PolarHBondContact O-OG1 2.9Å
399	T	44.6	Very low	47.6	Very low	100 Å²	100	140.7 Å²	140.7	61%	0.613	70%	0.695	S	S	*	*	H	α-helix	trans	-68.4	-30.2	170.4	34.7	0	0	0	0	112.8	R395 Q396 T401	R395-T399 PolarHBondContact O-N 3.46Å; R395-T399 VanDerWaalsContact O-N 3.14Å; R395-T399 PolarHBondContact O-OG1 2.94Å; Q396-T399 PolarHBondContact O-OG1 3.3Å; Q396-T399 VanDerWaalsContact O-OG1 3.14Å; T399-T401 VanDerWaalsContact C-N 3.29Å; T399-T401 PolarHBondContact O-N 3.03Å
400	R	39.4	Very low	45.6	Very low	220 Å²	220	142.3 Å²	142.3	83%	0.83	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-9.6	178.7	-163.6	163	-176.6	128.1	4.9	114.5	Q396 H398 Q402	Q396-R400 PolarHBondContact O-N 2.73Å; H398-R400 VanDerWaalsContact C-N 3.33Å; R400-Q402 VanDerWaalsContact C-N 3.34Å
401	T	37.9	Very low	43.6	Very low	106 Å²	106	141 Å²	141	65%	0.65	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	15	176.1	41.1	0	0	0	0	114.8	L397 H398 T399	L397-T401 PolarHBondContact O-OG1 2.96Å; H398-T401 PolarHBondContact O-N 2.8Å; H398-T401 PolarHBondContact O-OG1 2.9Å; T399-T401 VanDerWaalsContact C-N 3.29Å; T399-T401 PolarHBondContact O-N 3.03Å
402	Q	41.3	Very low	41.9	Very low	172 Å²	172	146.9 Å²	146.9	80%	0.804	73%	0.731	S	S	*	*	S	Bend	trans	-142.5	35.1	-175.3	-157.5	170.1	97	0	0	114.2	R400	R400-Q402 VanDerWaalsContact C-N 3.34Å
403	T	34.8	Very low	39.9	Very low	133 Å²	133	148 Å²	148	82%	0.816	74%	0.743	S	S	*	*			trans	-162.4	88.4	165.2	-4.7	0	0	0	0	111.3
404	D	27.8	Very low	38.9	Very low	163 Å²	163	144.3 Å²	144.3	87%	0.872	74%	0.744	S	S	*	*			trans	-162.5	99.6	159.9	-162.7	-3.7	0	0	0	110.6
405	E	28.6	Very low	38.3	Very low	185 Å²	185	142 Å²	142	86%	0.864	75%	0.75	S	S	*	*			trans	-158.1	126.6	155.3	-153.8	164.6	-146.2	0	0	110.8
406	S	29.5	Very low	37.6	Very low	101 Å²	101	138 Å²	138	71%	0.706	75%	0.75	S	S	*	*			trans	66	113.4	178.4	64.8	0	0	0	0	118.6
407	I	34.2	Very low	36.7	Very low	158 Å²	158	139 Å²	139	81%	0.81	76%	0.758	S	S	*	*			cis	86.3	131.4	49.1	-70.4	170.8	0	0	0	112.7
408	P	49.7	Very low	36.3	Very low	109 Å²	109	139 Å²	139	71%	0.708	77%	0.766	S	S	*	*			cis	-146.3	-157.6	-19.9	38.8	-15.7	0	0	0	115.8
409	V	28.2	Very low	35.5	Very low	130 Å²	130	137.8 Å²	137.8	79%	0.788	77%	0.769	S	S	*	*			trans	111.5	126.1	152.8	-165.2	0	0	0	0	119.3
410	L	29.5	Very low	35.2	Very low	150 Å²	150	137.7 Å²	137.7	79%	0.785	77%	0.769	S	S	*	*			trans	-34.9	157.7	162.3	-90.7	58.4	0	0	0	116.1
411	T	29.5	Very low	34.5	Very low	108 Å²	108	132.2 Å²	132.2	66%	0.663	77%	0.765	S	S	*	*				-166.8	152.8	56.6	32	0	0	0	0	115.7
412	H	32.3	Very low	34.4	Very low	177 Å²	177	132.4 Å²	132.4	82%	0.819	77%	0.768	S	S	*	*			trans	68.5	164.8	147.8	-64	-52.3	0	0	0	123.2
413	T	27.3	Very low	33.6	Very low	129 Å²	129	130.2 Å²	130.2	79%	0.791	77%	0.766	S	S	*	*			trans	-144.7	177.4	-159.8	23.6	0	0	0	0	110.5
414	P	43.1	Very low	33.1	Very low	118 Å²	118	132.2 Å²	132.2	77%	0.766	77%	0.767	S	S	*	*			cis	-125.6	-112	-9.7	23.5	4.3	0	0	0	116.3
415	P	47.5	Very low	32.9	Very low	111 Å²	111	133.3 Å²	133.3	72%	0.721	77%	0.766	S	S	*	*			trans	-122.8	-160.8	-132.6	45.1	-25	0	0	0	114.5
416	P	43.8	Very low	32.9	Very low	117 Å²	117	129.5 Å²	129.5	76%	0.76	76%	0.756	S	S	*	*			cis	-136	178.1	-5.6	43.1	-24.5	0	0	0	118.4
417	I	29.9	Very low	32.7	Very low	157 Å²	157	132.1 Å²	132.1	81%	0.805	76%	0.761	S	S	*	*			trans	-17.7	149	152.7	-71	160.8	0	0	0	117.4
418	P	38.8	Very low	32.2	Very low	124 Å²	124	131.3 Å²	131.3	81%	0.805	76%	0.758	S	S	*	*			cis	-137.8	-166.2	35.7	25.8	1.2	0	0	0	119.2
419	V	26.9	Very low	32	Very low	126 Å²	126	130.9 Å²	130.9	76%	0.764	76%	0.755	S	S	*	*			trans	-129.3	141.5	-173.4	163.8	0	0	0	0	107.4
420	P	40.2	Very low	31.9	Very low	97 Å²	97	132.1 Å²	132.1	63%	0.63	76%	0.756	S	S	*	*				-148.7	176.5	76.5	38	-15.4	0	0	0	119.2
421	S	23.8	Very low	31.7	Very low	106 Å²	106	130.5 Å²	130.5	74%	0.741	75%	0.752	S	S	*	*			trans	-75.7	169.2	177.7	52.4	0	0	0	0	114.1
422	P	35.8	Very low	31.6	Very low	110 Å²	110	132.3 Å²	132.3	71%	0.714	75%	0.754	S	S	*	*			cis	-153.5	176.5	32.4	47	-26.5	0	0	0	121
423	T	24.1	Very low	31.1	Very low	125 Å²	125	132.8 Å²	132.8	77%	0.767	75%	0.753	S	S	*	*			trans	74.3	135.8	151.4	-42.4	0	0	0	0	122.5
424	Q	24.5	Very low	31	Very low	175 Å²	175	130.8 Å²	130.8	82%	0.818	75%	0.75	S	S	*	*			trans	77.7	124.8	155.3	-105.8	178.8	-1.4	0	0	123.4
425	E	24.6	Very low	30.8	Very low	186 Å²	186	131.1 Å²	131.1	87%	0.869	75%	0.752	S	S	*	*			trans	-177.7	145.9	139.3	-100.2	174.2	-170.4	0	0	106.4
426	V	27.3	Very low	29.6	Very low	106 Å²	106	133 Å²	133	64%	0.642	76%	0.756	S	S	*	*			cis	92.6	105.5	16.3	-176.2	0	0	0	0	116.3
427	L	25.2	Very low	29.6	Very low	156 Å²	156	132 Å²	132	82%	0.817	75%	0.75	S	S	*	*			trans	-170	142.6	151.5	-126	61.3	0	0	0	107.8
428	L	24.5	Very low	29.3	Very low	141 Å²	141	132.4 Å²	132.4	74%	0.738	75%	0.748	S	S	*	*			cis	75.3	149.7	26.5	-65.2	-179.9	0	0	0	115.2
429	P	45.1	Very low	28.6	Very low	100 Å²	100	132.7 Å²	132.7	65%	0.649	75%	0.747	S	S	*	*			cis	-143	178.9	-10.2	36.5	-15.4	0	0	0	118.3
430	L	25.2	Very low	29.2	Very low	156 Å²	156	131.5 Å²	131.5	82%	0.817	74%	0.742	S	S	*	*			trans	68.3	159.1	153	-70	156	0	0	0	119.5
431	T	25.3	Very low	28.6	Very low	115 Å²	115	134.5 Å²	134.5	71%	0.706	75%	0.748	S	S	*	*			cis	-155.8	153.5	18.8	-24.5	0	0	0	0	114.9
432	E	28	Very low	28.7	Very low	147 Å²	147	134.2 Å²	134.2	69%	0.687	74%	0.738	S	S	*	*			trans	63.2	134.9	145.4	-115.5	-170.4	112.4	0	0	128.3
433	K	22.8	Very low	28.3	Very low	187 Å²	187	137.2 Å²	137.2	81%	0.813	74%	0.74	S	S	*	*			trans	87.3	154.3	142.2	-104.8	-174.6	-174.4	101.3	0	123.8
434	A	25.5	Very low	28.4	Very low	86 Å²	86	137 Å²	137	71%	0.711	74%	0.738	S	S	*	*			trans	-129.2	-179.2	-176.5	0	0	0	0	0	109.8
435	P	38.6	Very low	28.5	Very low	126 Å²	126	134.8 Å²	134.8	82%	0.818	73%	0.731	S	S	*	*			cis	-147.3	-168.3	46	43.4	-21.2	0	0	0	117.7
436	D	22.1	Very low	28.6	Very low	149 Å²	149	134.7 Å²	134.7	80%	0.797	73%	0.731	S	S	*	*			trans	-68.7	177.4	167.9	-122.1	-34.7	0	0	0	113.2
437	P	42.6	Very low	28.6	Very low	98 Å²	98	133.5 Å²	133.5	64%	0.636	74%	0.74	S	S	*	*			cis	-155.6	176.4	48.9	44.9	-22.9	0	0	0	120.8
438	E	24.3	Very low	28.5	Very low	165 Å²	165	135.9 Å²	135.9	77%	0.771	74%	0.744	S	S	*	*			trans	45.7	133.9	139.6	-65.9	172	136.7	0	0	122.3
439	V	24.8	Very low	29.3	Very low	130 Å²	130	134.4 Å²	134.4	79%	0.788	74%	0.743	S	S	*	*				70.9	141.3	55.2	172.7	0	0	0	0	111.9
440	P	40	Very low	28.3	Very low	101 Å²	101	134.9 Å²	134.9	66%	0.656	75%	0.749	S	S	*	*			cis	-142	-176.8	13.5	38.7	-16	0	0	0	119.6
441	Q	25.9	Very low	28.5	Very low	160 Å²	160	131.5 Å²	131.5	75%	0.748	74%	0.743	S	S	*	*				85	130.7	129.7	-97	175.5	-30.2	0	0	128.3
442	D	26.9	Very low	28.9	Very low	100 Å²	100	134.4 Å²	134.4	54%	0.535	75%	0.749	S	S	.	*				77.8	129.1	128.4	-86.9	4.5	0	0	0	126.2
443	K	26.7	Very low	28.9	Very low	173 Å²	173	133.6 Å²	133.6	75%	0.752	75%	0.754	S	S	*	*			trans	71.4	156.1	136.6	-71	168.6	-178.4	135.2	0	120.2
444	V	27.1	Very low	29.5	Very low	119 Å²	119	132.7 Å²	132.7	72%	0.721	75%	0.752	S	S	*	*			cis	-179.8	160	-37	125	0	0	0	0	108
445	N	27	Very low	29.4	Very low	129 Å²	129	135.3 Å²	135.3	69%	0.69	76%	0.76	S	S	*	*			trans	78.4	119.8	167	-78.8	3.6	0	0	0	121.9
446	E	26.3	Very low	29.2	Very low	184 Å²	184	134.4 Å²	134.4	86%	0.86	75%	0.748	S	S	*	*				51.1	145.9	123.1	-55.7	-164.6	110.3	0	0	123.9
447	G	25.9	Very low	29.6	Very low	81 Å²	81	135.3 Å²	135.3	84%	0.835	75%	0.751	S	S	*	*			trans	148.6	81.1	155.6	0	0	0	0	0	118.1
448	K	23.8	Very low	29.3	Very low	206 Å²	206	137 Å²	137	90%	0.896	75%	0.75	S	S	*	*			trans	-91.7	175.1	156.2	-116.1	-172.1	173.9	178	0	108.6
449	P	41.5	Very low	29.6	Very low	110 Å²	110	135.2 Å²	135.2	71%	0.714	75%	0.745	S	S	*	*			cis	-143.2	-154.5	19.1	43.7	-21.7	0	0	0	116
450	S	23.4	Very low	29.8	Very low	110 Å²	110	139.5 Å²	139.5	77%	0.769	75%	0.747	S	S	*	*			trans	81.1	129.7	172.3	-60.5	0	0	0	0	117
451	A	30.7	Very low	29.2	Very low	85 Å²	85	140.4 Å²	140.4	70%	0.702	75%	0.751	S	S	*	*			cis	93.9	145.8	35.4	0	0	0	0	0	112.2
452	E	32.3	Very low	29.3	Very low	176 Å²	176	140 Å²	140	82%	0.822	75%	0.749	S	S	*	*			cis	-165.3	-166.5	8.3	-138.7	169.5	-165.3	0	0	112
453	V	28.8	Very low	30.3	Very low	131 Å²	131	140.1 Å²	140.1	79%	0.794	76%	0.755	S	S	*	*			trans	79.4	147.8	161.6	-161	0	0	0	0	118.5
454	Q	34.8	Very low	30.5	Very low	167 Å²	167	136.3 Å²	136.3	78%	0.78	75%	0.75	S	S	*	*				178.6	149.9	-55.6	173	172.2	9.9	0	0	111.9
455	T	25.1	Very low	30.6	Very low	141 Å²	141	136.5 Å²	136.5	87%	0.865	75%	0.747	S	S	*	*			trans	-158.2	168.9	159.7	-19.4	0	0	0	0	112.2
456	D	34.3	Very low	30.8	Very low	108 Å²	108	136.8 Å²	136.8	58%	0.578	75%	0.748	S	S	*	*			trans	-155.7	173.1	171	-176.4	32.3	0	0	0	110.2	Q458	D456-Q458 PolarHBondContact OD2-NE2 3.08Å
457	I	29.5	Very low	30.8	Very low	167 Å²	167	137.6 Å²	137.6	86%	0.856	74%	0.744	S	S	*	*			trans	145.6	141.5	142.8	-72.5	163.2	0	0	0	111.8
458	Q	35.7	Very low	30.7	Very low	134 Å²	134	139.5 Å²	139.5	63%	0.626	74%	0.74	S	S	*	*				-161.8	174.5	-84.8	-159.4	-168.7	93.7	0	0	110.9	D456	D456-Q458 PolarHBondContact OD2-NE2 3.08Å
459	L	32.1	Very low	31.6	Very low	127 Å²	127	135.4 Å²	135.4	67%	0.665	73%	0.734	S	S	*	*			trans	86.4	138.7	162.1	-55.2	155	0	0	0	115.4
460	R	29.1	Very low	31.1	Very low	220 Å²	220	138.3 Å²	138.3	83%	0.83	74%	0.738	S	S	*	*			cis	-167.4	164.4	8.8	-116.4	174.7	-178.9	-178.2	2.4	108.9
461	V	26.1	Very low	31.3	Very low	121 Å²	121	140.5 Å²	140.5	73%	0.733	74%	0.741	S	S	*	*			cis	-159.6	169	-5.5	84	0	0	0	0	112.4
462	Q	28	Very low	31.4	Very low	151 Å²	151	143.5 Å²	143.5	71%	0.706	75%	0.745	S	S	*	*			trans	-33	166.8	166.2	-68.7	-77	74.6	0	0	121.7
463	P	48.5	Very low	31.2	Very low	102 Å²	102	141.2 Å²	141.2	66%	0.662	74%	0.742	S	S	*	*			cis	-107.2	-154.3	-2.4	44.2	-35.7	0	0	0	111.2
464	S	30.3	Very low	31.1	Very low	93 Å²	93	140.6 Å²	140.6	65%	0.65	74%	0.739	S	S	*	*			cis	-161.2	-172.6	9.5	-104.6	0	0	0	0	106.9
465	D	28.8	Very low	30.7	Very low	123 Å²	123	139.8 Å²	139.8	66%	0.658	74%	0.739	S	S	*	*			cis	162.1	144.2	-36.1	-77.8	-45.9	0	0	0	105
466	I	31	Very low	30.7	Very low	136 Å²	136	141.4 Å²	141.4	70%	0.697	74%	0.737	S	S	*	*			cis	-162.5	157.6	-3.8	-122.1	169.9	0	0	0	104.9
467	Y	26.3	Very low	31.6	Very low	201 Å²	201	141.1 Å²	141.1	79%	0.788	74%	0.741	S	S	*	*			cis	-153.2	-153.5	21.6	-141.5	-23.1	0	0	0	111.8
468	T	24.6	Very low	31.6	Very low	120 Å²	120	137.8 Å²	137.8	74%	0.736	73%	0.732	S	S	*	*			trans	-154.7	-172.8	-174.1	20.1	0	0	0	0	109.2
469	P	43.7	Very low	31.5	Very low	121 Å²	121	142.1 Å²	142.1	79%	0.786	74%	0.743	S	S	*	*			cis	-142.4	-172.7	16.1	45.1	-24.8	0	0	0	118
470	E	31.1	Very low	31.2	Very low	170 Å²	170	142.8 Å²	142.8	79%	0.794	75%	0.753	S	S	*	*			trans	-82.5	170.6	169	-52.1	172.9	96.6	0	0	113.7
471	L	27.3	Very low	31.3	Very low	157 Å²	157	136 Å²	136	82%	0.822	74%	0.743	S	S	*	*			trans	-157	145.9	130.2	-141.4	89.1	0	0	0	112.8	V473	L471-V473 HydrophobicContact CD2-CG2 3.97Å
472	N	31.8	Very low	31.2	Very low	147 Å²	147	136.3 Å²	136.3	79%	0.786	75%	0.746	S	S	*	*			trans	-112.3	146.7	166.7	-99.7	-59.7	0	0	0	109.9
473	V	28.6	Very low	31.3	Very low	128 Å²	128	136.2 Å²	136.2	78%	0.776	75%	0.749	S	S	*	*			trans	-139.9	145.6	171.4	-175.6	0	0	0	0	110.3	L471	L471-V473 HydrophobicContact CD2-CG2 3.97Å
474	V	27	Very low	31.2	Very low	118 Å²	118	136.7 Å²	136.7	72%	0.715	75%	0.751	S	S	*	*			trans	-126.2	152.1	-172.7	173.3	0	0	0	0	109.1
475	L	25.2	Very low	32.3	Very low	150 Å²	150	136.5 Å²	136.5	79%	0.785	75%	0.748	S	S	*	*			trans	171.1	122.1	131.8	-90.8	165	0	0	0	115.9
476	E	26.9	Very low	32.1	Very low	175 Å²	175	138.8 Å²	138.8	82%	0.818	75%	0.754	S	S	*	*			trans	32	159.4	142.6	-75.8	-156.6	92.7	0	0	127.7
477	P	52.8	Low	31.9	Very low	103 Å²	103	136.9 Å²	136.9	67%	0.669	75%	0.753	S	S	*	*			trans	-116.7	170.4	-179.8	43.6	-33.3	0	0	0	116
478	S	29.1	Very low	31.9	Very low	97 Å²	97	132.6 Å²	132.6	68%	0.678	75%	0.753	S	S	*	*			trans	-176.5	123.2	143.1	-94.4	0	0	0	0	119.2
479	R	33.5	Very low	32	Very low	225 Å²	225	133 Å²	133	85%	0.849	76%	0.76	S	S	*	*			trans	76.5	147.9	130.1	-60	171.6	-174.8	-146.1	-2.9	124.3
480	T	26.1	Very low	31.1	Very low	141 Å²	141	131.6 Å²	131.6	87%	0.865	76%	0.759	S	S	*	*			trans	93	136.7	151.2	-32.8	0	0	0	0	118.1
481	A	30.2	Very low	31.5	Very low	77 Å²	77	129 Å²	129	64%	0.636	76%	0.757	S	S	*	*			cis	-169.4	168.7	-33.6	0	0	0	0	0	111.9
482	T	25.5	Very low	31.4	Very low	127 Å²	127	130.1 Å²	130.1	78%	0.779	76%	0.758	S	S	*	*			trans	73.5	99.4	152.4	-46.8	0	0	0	0	120.1
483	I	29.8	Very low	31	Very low	150 Å²	150	128.1 Å²	128.1	77%	0.769	76%	0.756	S	S	*	*				60	134.7	73.5	-66.8	176.9	0	0	0	114.9
484	P	45.6	Very low	30.9	Very low	111 Å²	111	128.7 Å²	128.7	72%	0.721	76%	0.759	S	S	*	*			cis	-140	-135.2	-23.6	38.8	-14	0	0	0	113
485	P	52.7	Low	31.5	Very low	90 Å²	90	130.6 Å²	130.6	58%	0.584	77%	0.765	S	S	*	*				-125.3	-156.3	-74	33.3	-10.5	0	0	0	115.4
486	H	26.1	Very low	31.6	Very low	170 Å²	170	131.2 Å²	131.2	79%	0.787	77%	0.766	S	S	*	*			trans	90.1	150	165.1	-45.6	-67.4	0	0	0	118.3
487	S	27	Very low	31.6	Very low	96 Å²	96	132.1 Å²	132.1	67%	0.671	76%	0.762	S	S	*	*			cis	-168.7	140.4	-32.1	-95.6	0	0	0	0	111.4
488	S	26.1	Very low	30.8	Very low	112 Å²	112	133.2 Å²	133.2	78%	0.783	77%	0.769	S	S	*	*			trans	37.1	126.1	151.6	62.5	0	0	0	0	123.1
489	S	26	Very low	30.7	Very low	127 Å²	127	133.1 Å²	133.1	89%	0.888	76%	0.764	S	S	*	*				175.2	159.8	116.8	45.5	0	0	0	0	113.8
490	A	25.7	Very low	31.3	Very low	92 Å²	92	127.6 Å²	127.6	76%	0.76	76%	0.757	S	S	*	*			trans	-119.5	161.1	161.5	0	0	0	0	0	108
491	P	37.8	Very low	31.3	Very low	116 Å²	116	127 Å²	127	75%	0.753	75%	0.754	S	S	*	*				-157.1	173.7	90.9	41.1	-21.6	0	0	0	117.7
492	Q	25.4	Very low	31.4	Very low	180 Å²	180	130.5 Å²	130.5	84%	0.841	76%	0.757	S	S	*	*			trans	39.2	114.4	144.1	-68.2	179.1	-5.2	0	0	122.9
493	S	25.1	Very low	31.6	Very low	106 Å²	106	131.7 Å²	131.7	74%	0.741	75%	0.754	S	S	*	*				40.9	145.8	110.4	-166.1	0	0	0	0	123.2
494	T	25.6	Very low	31.3	Very low	139 Å²	139	132 Å²	132	85%	0.853	75%	0.752	S	S	*	*			trans	100.6	154.5	144.6	-3.4	0	0	0	0	120
495	L	39.2	Very low	30.4	Very low	159 Å²	159	134.4 Å²	134.4	83%	0.832	75%	0.751	S	S	*	*			trans	-112.1	144.8	-159.7	178.2	79.1	0	0	0	112.3
496	M	27.4	Very low	29.6	Very low	162 Å²	162	135.5 Å²	135.5	80%	0.798	76%	0.758	S	S	*	*			trans	-135	139.7	158.3	-69.5	-173.2	66.5	0	0	108.6
497	R	27.4	Very low	29.7	Very low	194 Å²	194	134 Å²	134	73%	0.732	76%	0.755	S	S	*	*			cis	72.8	138.3	49.3	-143.2	-156.4	-170.6	138	8	112.5	T499	R497-T499 PolarHBondContact NE-OG1 3.19Å
498	P	36.3	Very low	31.2	Very low	127 Å²	127	134.9 Å²	134.9	83%	0.825	76%	0.759	S	S	*	*				-138.9	171.7	98.2	38.4	-26.3	0	0	0	115.2
499	T	26.7	Very low	31.9	Very low	95 Å²	95	135.3 Å²	135.3	58%	0.583	76%	0.759	S	S	*	*			trans	-153	144.4	174.8	-37.3	0	0	0	0	110.1	R497	R497-T499 PolarHBondContact NE-OG1 3.19Å
500	P	46	Very low	32	Very low	108 Å²	108	135.6 Å²	135.6	70%	0.701	76%	0.755	S	S	*	*			trans	-131.3	178.5	156.6	40.4	-27.4	0	0	0	111.5
501	T	26.6	Very low	32.3	Very low	130 Å²	130	138.8 Å²	138.8	80%	0.798	75%	0.751	S	S	*	*			cis	-175	149.1	-32.2	36.5	0	0	0	0	105.8
502	H	31.6	Very low	31.7	Very low	150 Å²	150	138 Å²	138	69%	0.694	74%	0.741	S	S	*	*			cis	-168.6	-168.9	-17.2	-162.8	-110.6	0	0	0	107.3
503	E	28.6	Very low	31.9	Very low	152 Å²	152	137.3 Å²	137.3	71%	0.71	74%	0.738	S	S	*	*			trans	64.7	165.3	174.6	-94.3	52.2	-98	0	0	116.4
504	E	25.3	Very low	32.1	Very low	157 Å²	157	136.7 Å²	136.7	73%	0.734	73%	0.734	S	S	*	*			cis	-141.6	-176.1	-4.9	-149.7	-120.5	79.3	0	0	110.1	P506	E504-P506 WeakPolarHBondContact OE1-CD 3.21Å
505	K	26.5	Very low	32.2	Very low	160 Å²	160	138 Å²	138	70%	0.696	73%	0.734	S	S	*	*			trans	-166.5	129.6	176	-173.2	-165.2	177.6	-175.9	0	114.8
506	P	34.9	Very low	31.6	Very low	113 Å²	113	137 Å²	137	73%	0.734	73%	0.73	S	S	*	*			trans	-138	179.2	134.1	19.7	3	0	0	0	116.7	E504	E504-P506 WeakPolarHBondContact OE1-CD 3.21Å
507	L	29	Very low	31.6	Very low	140 Å²	140	136.7 Å²	136.7	73%	0.733	73%	0.731	S	S	*	*			trans	-140.7	177.2	179.5	-81.9	167.9	0	0	0	109
508	P	57.9	Low	31.4	Very low	114 Å²	114	133.7 Å²	133.7	74%	0.74	73%	0.733	S	S	*	*			cis	-113	-115	1	31.9	-8.7	0	0	0	112.3
509	P	40.4	Very low	32.2	Very low	121 Å²	121	132.8 Å²	132.8	79%	0.786	73%	0.728	S	S	*	*			cis	-117.3	-158	7.2	45.1	-30.5	0	0	0	115.2
510	V	29.2	Very low	32.2	Very low	133 Å²	133	134 Å²	134	81%	0.806	74%	0.735	S	S	*	*			trans	-152.7	153	-173.4	-174.3	0	0	0	0	112.4
511	K	31.2	Very low	32.5	Very low	158 Å²	158	134 Å²	134	69%	0.687	74%	0.736	S	S	*	*			trans	139.4	159.5	152.7	-87.5	173.2	145	-78.8	0	114.4
512	D	25.9	Very low	33.5	Very low	101 Å²	101	132.9 Å²	132.9	54%	0.54	73%	0.73	S	S	.	*			cis	-152.7	168.1	12.1	-126.8	-26.9	0	0	0	116.9
513	E	29.8	Very low	33.1	Very low	164 Å²	164	132.2 Å²	132.2	77%	0.766	73%	0.731	S	S	*	*			trans	24.5	154.2	146.7	-78.4	170.5	158	0	0	124.2
514	S	27.9	Very low	33	Very low	94 Å²	94	133.3 Å²	133.3	66%	0.657	74%	0.736	S	S	*	*			cis	-171.1	-175.9	-2.5	51.3	0	0	0	0	113.1
515	L	29	Very low	32.9	Very low	165 Å²	165	130.3 Å²	130.3	86%	0.864	74%	0.738	S	S	*	*			trans	83.9	160.2	168.6	-51.2	-179.7	0	0	0	119.2
516	D	25.1	Very low	32.7	Very low	140 Å²	140	127.2 Å²	127.2	75%	0.749	74%	0.743	S	S	*	*				-174.7	173.7	-69.7	-174.4	22.1	0	0	0	109.5
517	L	27.4	Very low	32.2	Very low	154 Å²	154	127.5 Å²	127.5	81%	0.806	75%	0.747	S	S	*	*			trans	96.7	154	169.6	-57.6	174.2	0	0	0	121.5
518	V	24.9	Very low	32.4	Very low	131 Å²	131	127 Å²	127	79%	0.794	75%	0.749	S	S	*	*			trans	-163.6	166.8	-160.9	172.4	0	0	0	0	107.4
519	P	52.5	Low	31.3	Very low	108 Å²	108	127 Å²	127	70%	0.701	75%	0.749	S	S	*	*			cis	-123	-157.4	-29.7	36.1	-16.4	0	0	0	112.9
520	T	26.7	Very low	30.6	Very low	120 Å²	120	129.1 Å²	129.1	74%	0.736	75%	0.749	S	S	*	*				145.4	138.6	124.9	-54.8	0	0	0	0	116.6
521	P	52.9	Low	30.5	Very low	110 Å²	110	127.4 Å²	127.4	71%	0.714	74%	0.739	S	S	*	*			trans	-118.5	-147.1	167.2	44.4	-32.1	0	0	0	111.4
522	P	46.5	Very low	30.4	Very low	106 Å²	106	127.4 Å²	127.4	69%	0.688	74%	0.741	S	S	*	*			cis	-134.9	-157.9	-19.4	33	-8.8	0	0	0	114.4
523	L	24.3	Very low	30.4	Very low	135 Å²	135	130.8 Å²	130.8	71%	0.707	75%	0.754	S	S	*	*			trans	116.3	124.1	146.1	-59.4	179.7	0	0	0	123.3
524	Q	25.3	Very low	30.2	Very low	175 Å²	175	127 Å²	127	82%	0.818	75%	0.751	S	S	*	*				74.6	161.4	124	-69.9	-179.3	-10.1	0	0	127.1
525	A	24	Very low	30.1	Very low	94 Å²	94	129.9 Å²	129.9	78%	0.777	76%	0.757	S	S	*	*			trans	82.3	137.8	168.1	0	0	0	0	0	117.8
526	A	22.5	Very low	29.8	Very low	96 Å²	96	127.3 Å²	127.3	79%	0.793	75%	0.753	S	S	*	*			cis	78.7	137.6	21.3	0	0	0	0	0	115
527	S	24.1	Very low	29.9	Very low	119 Å²	119	125.2 Å²	125.2	83%	0.832	76%	0.755	S	S	*	*			cis	-160	-177.7	2.1	45.2	0	0	0	0	112.6
528	V	31.8	Very low	29.8	Very low	128 Å²	128	122.6 Å²	122.6	78%	0.776	76%	0.755	S	S	*	*			trans	-75.2	167.3	-174.8	-135	0	0	0	0	115.1
529	P	34.7	Very low	29.7	Very low	114 Å²	114	121.8 Å²	121.8	74%	0.74	76%	0.756	S	S	*	*				-135.6	146.7	91.8	30.9	-14.2	0	0	0	113.8
530	E	27.2	Very low	28.2	Very low	166 Å²	166	123.8 Å²	123.8	78%	0.776	77%	0.766	S	S	*	*				74.5	125.2	61.2	-160	172.6	174.8	0	0	112.7
531	T	26.8	Very low	28.2	Very low	97 Å²	97	126 Å²	126	60%	0.595	77%	0.773	S	S	*	*				-179.6	130.6	86	-57	0	0	0	0	115.1
532	Q	28.7	Very low	26.7	Very low	158 Å²	158	126 Å²	126	74%	0.738	78%	0.775	S	S	*	*			trans	65.5	158.5	154.2	-70.2	168.2	39	0	0	120.7
533	Q	26.9	Very low	25.7	Very low	173 Å²	173	126.8 Å²	126.8	81%	0.808	78%	0.778	S	S	*	*			cis	-148.4	175.5	6.2	-134.7	167.4	53.6	0	0	112.7
534	A	24.2	Very low	25.8	Very low	84 Å²	84	125.7 Å²	125.7	69%	0.694	78%	0.781	S	S	*	*			trans	-110.3	178.4	-173.8	0	0	0	0	0	114.4
535	I	25.5	Very low	27.2	Very low	154 Å²	154	122.9 Å²	122.9	79%	0.79	78%	0.778	S	S	*	*				178.2	148.1	91.3	-88.2	169	0	0	0	111.9
536	S	24.5	Very low	27.9	Very low	112 Å²	112	124.4 Å²	124.4	78%	0.783	78%	0.78	S	S	*	*			trans	17.1	161.1	150.1	-58.3	0	0	0	0	123.5
537	A	26.5	Very low	28.3	Very low	95 Å²	95	127.8 Å²	127.8	79%	0.785	78%	0.78	S	S	*	*			cis	-170.5	-175.8	-13.5	0	0	0	0	0	106.7
538	A	24.5	Very low	28.5	Very low	99 Å²	99	130.7 Å²	130.7	82%	0.818	78%	0.78	S	S	*	*			cis	-162.5	-175.9	24.3	0	0	0	0	0	112.4
539	S	23.7	Very low	28.1	Very low	114 Å²	114	128.8 Å²	128.8	80%	0.797	78%	0.778	S	S	*	*			trans	-125.6	149.5	-178.3	-45.1	0	0	0	0	112.9
540	T	21.6	Very low	28.5	Very low	150 Å²	150	128.6 Å²	128.6	92%	0.92	78%	0.776	S	S	*	*			trans	-159.4	147.7	157.4	17.3	0	0	0	0	112.8
541	L	25.1	Very low	28.3	Very low	167 Å²	167	125.7 Å²	125.7	87%	0.874	78%	0.775	S	S	*	*			trans	-100.8	164.7	164.2	-70	78.8	0	0	0	109.9
542	S	22.7	Very low	29.3	Very low	109 Å²	109	126.1 Å²	126.1	76%	0.762	78%	0.779	S	S	*	*				158.3	116.4	123.2	-175.2	0	0	0	0	117
543	V	25.2	Very low	29.2	Very low	124 Å²	124	126.9 Å²	126.9	75%	0.752	78%	0.783	S	S	*	*			trans	47.9	100.4	131.7	-169	0	0	0	0	122.6
544	S	25.3	Very low	29.2	Very low	111 Å²	111	124 Å²	124	78%	0.776	78%	0.777	S	S	*	*				68.9	-173.9	124.9	-38.5	0	0	0	0	121.5
545	P	55.6	Low	29.2	Very low	117 Å²	117	124.2 Å²	124.2	76%	0.76	78%	0.778	S	S	*	*				-126.5	-175.1	-119.9	36.8	-13.3	0	0	0	116
546	P	39.8	Very low	29.2	Very low	125 Å²	125	122.5 Å²	122.5	81%	0.812	78%	0.78	S	S	*	*				-157.5	-152.5	102.5	43.5	-22.2	0	0	0	117.3
547	Q	28.9	Very low	29.3	Very low	167 Å²	167	121.6 Å²	121.6	78%	0.78	77%	0.774	S	S	*	*			trans	-86	-166.8	-163.9	-55.5	148.7	-53.8	0	0	114.4
548	Q	28.5	Very low	29.2	Very low	180 Å²	180	122.8 Å²	122.8	84%	0.841	77%	0.771	S	S	*	*			cis	-163.2	-172.6	16.6	-150.3	161.8	-10.1	0	0	113.1
549	A	24.2	Very low	29.3	Very low	88 Å²	88	126.3 Å²	126.3	73%	0.727	77%	0.769	S	S	*	*			trans	-110.8	-146.3	-178.9	0	0	0	0	0	112.2
550	P	43.1	Very low	29.4	Very low	110 Å²	110	127.6 Å²	127.6	71%	0.714	77%	0.766	S	S	*	*			cis	-149.1	168.7	7.5	44.9	-23.9	0	0	0	120.8
551	S	22.4	Very low	29.6	Very low	106 Å²	106	124.9 Å²	124.9	74%	0.741	76%	0.759	S	S	*	*			trans	68.1	179.7	139.9	77.2	0	0	0	0	122.3
552	P	49.5	Very low	29.8	Very low	105 Å²	105	123.2 Å²	123.2	68%	0.682	76%	0.755	S	S	*	*			cis	-137.1	-166.9	-18.4	25.1	1.4	0	0	0	116.2
553	E	25.3	Very low	30.5	Very low	175 Å²	175	123.6 Å²	123.6	82%	0.818	76%	0.755	S	S	*	*			trans	83	150.1	153.6	-57.7	-146.1	173.2	0	0	121.7
554	T	26.4	Very low	30.5	Very low	112 Å²	112	124 Å²	124	69%	0.687	76%	0.757	S	S	*	*			cis	-167.8	148.4	-17.1	-90.9	0	0	0	0	112.2
555	A	25.8	Very low	30.6	Very low	88 Å²	88	126.9 Å²	126.9	73%	0.727	76%	0.756	S	S	*	*			trans	63.9	147.3	167.3	0	0	0	0	0	118.8
556	S	25.3	Very low	29.2	Very low	118 Å²	118	128.8 Å²	128.8	83%	0.825	76%	0.755	S	S	*	*			cis	78.7	138.2	33.4	-135.4	0	0	0	0	113.5
557	S	25.7	Very low	28.5	Very low	94 Å²	94	131.6 Å²	131.6	66%	0.657	76%	0.757	S	S	*	*			cis	-166.9	156.3	19.4	65.9	0	0	0	0	115.8
558	V	25.8	Very low	29.1	Very low	120 Å²	120	129 Å²	129	73%	0.727	76%	0.755	S	S	*	*				81	124.8	128	154.3	0	0	0	0	124.8
559	F	25.7	Very low	28.9	Very low	173 Å²	173	127 Å²	127	76%	0.759	75%	0.754	S	S	*	*			trans	80.3	112.3	140	-84.3	-141.9	0	0	0	125.9
560	L	25.6	Very low	29.1	Very low	141 Å²	141	129.9 Å²	129.9	74%	0.738	76%	0.757	S	S	*	*				65.2	108.8	100.7	-148.8	177.7	0	0	0	120.8
561	A	25.4	Very low	28.2	Very low	93 Å²	93	130.7 Å²	130.7	77%	0.769	77%	0.765	S	S	*	*			trans	-165	140.2	140.7	0	0	0	0	0	112.5
562	T	31	Very low	28.3	Very low	132 Å²	132	132.8 Å²	132.8	81%	0.81	77%	0.767	S	S	*	*			trans	-116.2	153.4	160.8	50.4	0	0	0	0	109.3
563	P	35.4	Very low	27.6	Very low	117 Å²	117	133 Å²	133	76%	0.76	77%	0.768	S	S	*	*				-152.4	135.4	120.5	34.6	-15.7	0	0	0	117.7
564	V	25.4	Very low	27.6	Very low	131 Å²	131	130.1 Å²	130.1	79%	0.794	76%	0.763	S	S	*	*				55.7	102.9	120	-172.7	0	0	0	0	121.2
565	K	27.5	Very low	27.5	Very low	173 Å²	173	129 Å²	129	75%	0.752	77%	0.765	S	S	*	*				83.4	152.5	125.8	-153.8	-156.8	172.1	-155.7	0	121.8
566	E	25.9	Very low	27.5	Very low	156 Å²	156	130.2 Å²	130.2	73%	0.729	77%	0.768	S	S	*	*			trans	101.6	106.6	158.1	-54.5	-160.7	164	0	0	120.5
567	Q	25.9	Very low	27.6	Very low	185 Å²	185	135.8 Å²	135.8	86%	0.864	77%	0.771	S	S	*	*			trans	-76	173.9	142.6	-78.9	-175.8	-22.1	0	0	109.6
568	P	40.8	Very low	28.3	Very low	112 Å²	112	136.2 Å²	136.2	73%	0.727	77%	0.772	S	S	*	*			cis	-137.9	-159.4	12.8	31.4	-6.3	0	0	0	115
569	V	24.6	Very low	28.3	Very low	137 Å²	137	137.5 Å²	137.5	83%	0.83	77%	0.77	S	S	*	*			trans	125.7	137.8	145	178.5	0	0	0	0	116.7
570	L	28.7	Very low	28.3	Very low	149 Å²	149	134.5 Å²	134.5	78%	0.78	76%	0.762	S	S	*	*			trans	-70.3	164.8	175.2	-98.6	79.2	0	0	0	113.9
571	S	24.1	Very low	28.3	Very low	127 Å²	127	134.4 Å²	134.4	89%	0.888	76%	0.761	S	S	*	*			trans	-148.7	124.9	141.6	-73.9	0	0	0	0	111.6
572	L	24.3	Very low	28.3	Very low	150 Å²	150	137 Å²	137	79%	0.785	76%	0.762	S	S	*	*			trans	-90.7	163.9	162.4	-153.8	80.1	0	0	0	108.2
573	P	35.5	Very low	28.6	Very low	109 Å²	109	135.7 Å²	135.7	71%	0.708	76%	0.755	S	S	*	*				-149.1	145.1	104	30.2	-10.4	0	0	0	117.1
574	T	24.7	Very low	29.1	Very low	115 Å²	115	135.5 Å²	135.5	71%	0.706	75%	0.754	S	S	*	*				65.7	116	129.3	-53.8	0	0	0	0	118.3
575	A	25.6	Very low	29.7	Very low	89 Å²	89	134.5 Å²	134.5	74%	0.736	75%	0.75	S	S	*	*				66.9	148.3	64.1	0	0	0	0	0	113.6
576	S	25.2	Very low	29.7	Very low	113 Å²	113	131.9 Å²	131.9	79%	0.79	75%	0.749	S	S	*	*			cis	-165.1	179.3	-6	41.9	0	0	0	0	110.9
577	R	26	Very low	29.6	Very low	235 Å²	235	132.4 Å²	132.4	89%	0.887	75%	0.751	S	S	*	*			trans	-29.3	159.2	157.3	-105.9	-169.5	158.6	156.4	-5.5	115.5
578	P	40.8	Very low	29.5	Very low	103 Å²	103	130.7 Å²	130.7	67%	0.669	75%	0.747	S	S	*	*			cis	-134.4	-154.1	36.1	38.1	-14.7	0	0	0	113.7
579	E	26.2	Very low	29.9	Very low	148 Å²	148	131.1 Å²	131.1	69%	0.692	75%	0.75	S	S	*	*			cis	-168.3	163.9	22.1	-143.8	-178	139.8	0	0	113.6
580	N	26.7	Very low	29.9	Very low	109 Å²	109	129 Å²	129	58%	0.583	75%	0.747	S	S	*	*			trans	61.9	139	161.4	-61	-42.2	0	0	0	120.1
581	L	24.4	Very low	29.6	Very low	140 Å²	140	126 Å²	126	73%	0.733	74%	0.744	S	S	*	*			cis	77.5	131.9	35.3	-59.3	178.6	0	0	0	112.9
582	L	25.6	Very low	29.9	Very low	147 Å²	147	126.4 Å²	126.4	77%	0.77	74%	0.741	S	S	*	*			cis	-147.8	-139.7	-1	-95.1	155.8	0	0	0	110.3
583	P	37.1	Very low	31	Very low	105 Å²	105	125 Å²	125	68%	0.682	74%	0.741	S	S	*	*				-122.9	-172.4	-106.8	42.1	-23.1	0	0	0	115
584	P	46.1	Very low	30.6	Very low	112 Å²	112	124 Å²	124	73%	0.727	74%	0.742	S	S	*	*			trans	-70.8	177.3	167.3	34	-41.2	0	0	0	112.1
585	P	38.9	Very low	30.8	Very low	111 Å²	111	122.6 Å²	122.6	72%	0.721	74%	0.742	S	S	*	*			cis	-160.7	-172	38.1	40.7	-14	0	0	0	121.3
586	T	26	Very low	30.8	Very low	118 Å²	118	125.6 Å²	125.6	72%	0.724	75%	0.745	S	S	*	*			trans	77.3	149.8	147.4	-10.6	0	0	0	0	125.4
587	E	24.7	Very low	30.9	Very low	166 Å²	166	124.6 Å²	124.6	78%	0.776	74%	0.738	S	S	*	*			trans	79.2	122.1	160.6	-57.5	-159.5	-173.9	0	0	118.7
588	L	24.6	Very low	31	Very low	149 Å²	149	121.7 Å²	121.7	78%	0.78	73%	0.734	S	S	*	*			cis	90.3	160	49.3	-78	175.3	0	0	0	113.4
589	P	48.2	Very low	30.5	Very low	121 Å²	121	122.7 Å²	122.7	79%	0.786	74%	0.739	S	S	*	*			cis	-91.4	-154.7	-4.4	40.1	-36.1	0	0	0	112.3
590	A	24	Very low	30.4	Very low	93 Å²	93	122.9 Å²	122.9	77%	0.769	75%	0.745	S	S	*	*			cis	-156.3	-173.6	5.8	0	0	0	0	0	109.7
591	A	22.5	Very low	30.5	Very low	87 Å²	87	122.6 Å²	122.6	72%	0.719	75%	0.751	S	S	*	*			cis	-145.9	131.7	-0.6	0	0	0	0	0	112.9
592	V	30.3	Very low	30.5	Very low	135 Å²	135	122.6 Å²	122.6	82%	0.818	76%	0.756	S	S	*	*			trans	12.3	145.1	137.1	-169.3	0	0	0	0	119.1
593	P	47.9	Very low	30.6	Very low	121 Å²	121	125.2 Å²	125.2	79%	0.786	76%	0.761	S	S	*	*			cis	-127.4	-177.5	12.7	15.4	11.4	0	0	0	115.3
594	A	27.2	Very low	30	Very low	88 Å²	88	126.3 Å²	126.3	73%	0.727	77%	0.766	S	S	*	*			cis	-173.9	159.7	-25.6	0	0	0	0	0	110.7
595	A	29.2	Very low	29.1	Very low	85 Å²	85	124.7 Å²	124.7	70%	0.702	76%	0.763	S	S	*	*			trans	58.3	148.9	154.9	0	0	0	0	0	120.4
596	D	24.8	Very low	28.6	Very low	152 Å²	152	126.2 Å²	126.2	81%	0.813	77%	0.77	S	S	*	*			cis	-173.1	164.5	-13.1	-97.8	-20.7	0	0	0	107.8
597	S	28.2	Very low	28.8	Very low	91 Å²	91	127.3 Å²	127.3	64%	0.636	77%	0.772	S	S	*	*			cis	-167.6	-124.8	-22.2	61.8	0	0	0	0	109.4
598	H	28.7	Very low	29.1	Very low	174 Å²	174	125.6 Å²	125.6	81%	0.806	77%	0.772	S	S	*	*			trans	68.8	153.1	173.9	-71.3	-67.9	0	0	0	120.9
599	T	29	Very low	29.2	Very low	124 Å²	124	122 Å²	122	76%	0.761	77%	0.771	S	S	*	*			trans	-158.5	144.5	-151.7	51	0	0	0	0	113.2
600	D	24.2	Very low	28.2	Very low	153 Å²	153	120.1 Å²	120.1	82%	0.818	77%	0.773	S	S	*	*			trans	-165.5	138.8	138.7	-98.4	-31.6	0	0	0	107.2
601	S	28.4	Very low	28.4	Very low	102 Å²	102	120.9 Å²	120.9	71%	0.713	77%	0.773	S	S	*	*			cis	91.6	109.3	38.9	-168	0	0	0	0	113.4
602	V	25.3	Very low	28.8	Very low	140 Å²	140	127.1 Å²	127.1	85%	0.848	78%	0.784	S	S	*	*			trans	178.4	158.4	143.1	142.5	0	0	0	0	110.7
603	K	27.5	Very low	28.9	Very low	202 Å²	202	128.6 Å²	128.6	88%	0.878	78%	0.782	S	S	*	*			trans	-152.7	109.4	-170.4	173.1	-169.9	174.1	-177.1	0	112.6
604	T	24	Very low	28.3	Very low	128 Å²	128	129.5 Å²	129.5	79%	0.785	77%	0.774	S	S	*	*			trans	-159.7	152.4	168.3	33.9	0	0	0	0	108.1
605	A	27.1	Very low	28.4	Very low	79 Å²	79	132.1 Å²	132.1	65%	0.653	77%	0.771	S	S	*	*			cis	118.2	121.5	4.3	0	0	0	0	0	113
606	T	30	Very low	28.3	Very low	142 Å²	142	137.6 Å²	137.6	87%	0.871	77%	0.773	S	S	*	*			trans	65.8	150.4	170.6	24.9	0	0	0	0	117.1
607	D	29.7	Very low	28.4	Very low	142 Å²	142	134.6 Å²	134.6	76%	0.759	76%	0.761	S	S	*	*			cis	-162	173.3	-6.6	-165.3	14.2	0	0	0	112
608	V	30.1	Very low	28.3	Very low	130 Å²	130	137.6 Å²	137.6	79%	0.788	77%	0.77	S	S	*	*			trans	65.3	140	162.2	-163.2	0	0	0	0	119.1
609	G	27.9	Very low	28.1	Very low	73 Å²	73	133.8 Å²	133.8	75%	0.753	77%	0.768	S	S	*	*			trans	177.3	-37.6	153.4	0	0	0	0	0	123.9
610	G	25.6	Very low	29	Very low	81 Å²	81	133.2 Å²	133.2	84%	0.835	77%	0.766	S	S	*	*			trans	77.1	172.3	-173	0	0	0	0	0	115.6
611	S	29.3	Very low	29	Very low	110 Å²	110	133.7 Å²	133.7	77%	0.769	76%	0.764	S	S	*	*			cis	-148.3	115.5	-5.7	63	0	0	0	0	114.4
612	K	30	Very low	29	Very low	217 Å²	217	135.2 Å²	135.2	94%	0.943	76%	0.763	S	S	*	*			trans	66.7	152.5	158.7	-62.1	-173.4	177.3	-178.8	0	118.2
613	Q	33.7	Very low	28.8	Very low	166 Å²	166	137.2 Å²	137.2	78%	0.776	76%	0.763	S	S	*	*			trans	-157.5	170.8	-159.6	-162.1	-164.7	16.9	0	0	108.7
614	K	33.5	Very low	28.8	Very low	141 Å²	141	131.9 Å²	131.9	61%	0.613	76%	0.756	S	S	*	*			trans	88.9	121.9	139.4	-108.5	-175.6	175.1	-131.7	0	120.6
615	Q	31.2	Very low	28.9	Very low	142 Å²	142	134.5 Å²	134.5	66%	0.664	76%	0.76	S	S	*	*				73.2	148.8	123.8	-88.6	179.4	-11.9	0	0	119.3
616	R	26.5	Very low	28.9	Very low	200 Å²	200	140.1 Å²	140.1	76%	0.755	77%	0.772	S	S	*	*			cis	-169	155.8	0.4	-153.3	-169.2	171.3	-177.2	-4.6	112.4
617	T	26.9	Very low	28.7	Very low	89 Å²	89	137 Å²	137	55%	0.546	77%	0.768	S	S	.	*			trans	59.2	135.4	143.3	38.9	0	0	0	0	124.9
618	D	26.6	Very low	28.6	Very low	155 Å²	155	136 Å²	136	83%	0.829	77%	0.772	S	S	*	*			trans	78.8	160.9	136.2	-53.8	-19.9	0	0	0	122.8
619	A	23.4	Very low	28.3	Very low	93 Å²	93	137.7 Å²	137.7	77%	0.769	78%	0.777	S	S	*	*			trans	-141.2	-167.3	-168.4	0	0	0	0	0	109.4
620	P	47.7	Very low	28	Very low	112 Å²	112	142.5 Å²	142.5	73%	0.727	78%	0.784	S	S	*	*			cis	-138.7	-161.7	-2.4	39.7	-17.5	0	0	0	115.4
621	Q	25.4	Very low	27.9	Very low	164 Å²	164	144 Å²	144	77%	0.766	78%	0.782	S	S	*	*			trans	90	117.2	153.6	-80	-173.4	-32.2	0	0	123.8
622	I	26.6	Very low	27.7	Very low	134 Å²	134	147.7 Å²	147.7	69%	0.687	79%	0.787	S	S	*	*				91.7	138	126.4	-69.3	170.8	0	0	0	122.3
623	E	22.8	Very low	27.4	Very low	182 Å²	182	143.9 Å²	143.9	85%	0.85	78%	0.782	S	S	*	*			trans	92.3	119.7	157.1	-97.4	169.2	-173	0	0	124.6
624	A	26.1	Very low	27	Very low	90 Å²	90	139 Å²	139	74%	0.744	78%	0.776	S	S	*	*			trans	60.3	114.3	139.5	0	0	0	0	0	123.7
625	E	25.9	Very low	26.8	Very low	183 Å²	183	138.6 Å²	138.6	86%	0.855	78%	0.776	S	S	*	*			trans	14.1	120.8	146.1	-54.8	-163.2	113.2	0	0	121.8
626	Q	27.8	Very low	27.1	Very low	197 Å²	197	137 Å²	137	92%	0.921	78%	0.778	S	S	*	*				-165.8	157.7	97.6	-99.3	171	29.1	0	0	111.4
627	G	25.5	Very low	27.2	Very low	75 Å²	75	133.7 Å²	133.7	77%	0.773	77%	0.771	S	S	*	*			trans	-79.2	171.4	179.4	0	0	0	0	0	113.8
628	S	27.4	Very low	27.1	Very low	122 Å²	122	136.4 Å²	136.4	85%	0.853	77%	0.772	S	S	*	*			cis	-153.8	153.6	9.5	50.6	0	0	0	0	111.4
629	N	23.5	Very low	27.1	Very low	166 Å²	166	136.1 Å²	136.1	89%	0.888	78%	0.776	S	S	*	*			trans	-112.3	139.3	-166.5	-65.7	-59.3	0	0	0	113.9
630	L	22.3	Very low	27.2	Very low	173 Å²	173	137 Å²	137	91%	0.906	76%	0.764	S	S	*	*			trans	-164.7	94	143.5	-163.4	64.4	0	0	0	114.6
631	S	23.7	Very low	26.2	Very low	113 Å²	113	138.2 Å²	138.2	79%	0.79	76%	0.764	S	S	*	*			trans	173.9	117.3	155.2	24	0	0	0	0	107.8
632	Q	24.1	Very low	26.3	Very low	187 Å²	187	134.8 Å²	134.8	87%	0.874	76%	0.758	S	S	*	*				95.3	133.3	52.3	-172.4	175.7	58.3	0	0	112.1
633	T	24.1	Very low	26.5	Very low	138 Å²	138	133.3 Å²	133.3	85%	0.847	76%	0.755	S	S	*	*			trans	84.4	130.8	-174.4	-33.9	0	0	0	0	114.9
634	G	26.3	Very low	26.7	Very low	62 Å²	62	133.4 Å²	133.4	64%	0.639	76%	0.756	S	S	*	*			cis	134.6	130.7	-17.5	0	0	0	0	0	115.8
635	E	28.5	Very low	26.8	Very low	133 Å²	133	138.1 Å²	138.1	62%	0.621	76%	0.762	S	S	*	*			trans	60.8	-178.5	160.1	-84.1	-77.9	87	0	0	116.3	H637	E635-H637 IonicContact OE2-CE1 2.94Å; E635-H637 PolarHBondContact OE2-CE1 3.4Å; E635-H637 IonicContact OE2-CG 2.68Å; E635-H637 IonicContact OE2-ND1 3.23Å; E635-H637 PolarHBondContact OE2-ND1 2.9Å
636	P	38.1	Very low	26.9	Very low	108 Å²	108	137.7 Å²	137.7	70%	0.701	76%	0.76	S	S	*	*			cis	-113.5	175.6	-5.5	41.9	-30.4	0	0	0	113.4
637	H	28.1	Very low	27.1	Very low	131 Å²	131	134.7 Å²	134.7	61%	0.606	75%	0.75	S	S	*	*			cis	-165.9	173.7	-8	-110.9	18.4	0	0	0	106.6	E635	E635-H637 IonicContact OE2-CE1 2.94Å; E635-H637 PolarHBondContact OE2-CE1 3.4Å; E635-H637 IonicContact OE2-CG 2.68Å; E635-H637 IonicContact OE2-ND1 3.23Å; E635-H637 PolarHBondContact OE2-ND1 2.9Å
638	R	26	Very low	27.3	Very low	147 Å²	147	138.2 Å²	138.2	56%	0.555	75%	0.75	S	S	*	*			cis	168.8	124.1	-28.5	-179.1	-177.1	-165.2	158.6	13.6	110.1	E640	R638-E640 HydrophobicContact CG-CG 3.8Å; R638-E640 IonicContact CZ-OE1 3.79Å; R638-E640 IonicContact CZ-OE2 3.93Å; R638-E640 IonicContact NE-OE1 2.66Å; R638-E640 PolarHBondContact NE-OE1 2.84Å; R638-E640 IonicContact NE-OE2 3.43Å; R638-E640 PolarHBondContact NE-OE2 3.48Å; R638-E640 IonicContact NH2-OE1 3.36Å; R638-E640 IonicContact NH2-OE2 3.78Å; R638-E640 PolarHBondContact NH2-OE2 2.82Å
639	T	26.8	Very low	27.2	Very low	149 Å²	149	139.2 Å²	139.2	91%	0.914	75%	0.746	S	S	*	*			trans	-146	87.5	155.5	39.3	0	0	0	0	109.5
640	E	25.3	Very low	27.4	Very low	112 Å²	112	137 Å²	137	52%	0.523	74%	0.738	S	S	.	*			trans	-101.5	179.8	171.9	-38.5	157.8	166.3	0	0	107.2	R638	R638-E640 HydrophobicContact CG-CG 3.8Å; R638-E640 IonicContact CZ-OE1 3.79Å; R638-E640 IonicContact CZ-OE2 3.93Å; R638-E640 IonicContact NE-OE1 2.66Å; R638-E640 PolarHBondContact NE-OE1 2.84Å; R638-E640 IonicContact NE-OE2 3.43Å; R638-E640 PolarHBondContact NE-OE2 3.48Å; R638-E640 IonicContact NH2-OE1 3.36Å; R638-E640 IonicContact NH2-OE2 3.78Å; R638-E640 PolarHBondContact NH2-OE2 2.82Å
641	D	26.1	Very low	27.7	Very low	137 Å²	137	136.1 Å²	136.1	73%	0.733	74%	0.735	S	S	*	*			cis	-158.3	-178.4	-10.1	-139.2	-27.6	0	0	0	109.8
642	S	27.6	Very low	27.9	Very low	92 Å²	92	135.6 Å²	135.6	64%	0.643	73%	0.727	S	S	*	*			trans	15.1	175.4	131.4	-118.9	0	0	0	0	122.1
643	V	30.5	Very low	28	Very low	103 Å²	103	135 Å²	135	62%	0.624	72%	0.724	S	S	*	*			cis	-158.7	165.9	24.4	-125.1	0	0	0	0	111.5
644	E	28	Very low	28.2	Very low	183 Å²	183	139.7 Å²	139.7	86%	0.855	73%	0.726	S	S	*	*			trans	66.4	153.1	140.1	-72.6	158.5	-171	0	0	124.2
645	E	28.3	Very low	28.3	Very low	190 Å²	190	143.2 Å²	143.2	89%	0.888	74%	0.736	S	S	*	*			trans	-129.8	117.1	168.3	169.8	-176.6	-164.5	0	0	107.9
646	E	27.3	Very low	28.3	Very low	173 Å²	173	141.1 Å²	141.1	81%	0.808	74%	0.741	S	S	*	*			trans	-171.1	137.5	132.2	-158.2	167.2	142	0	0	112.8
647	L	32.6	Very low	27.9	Very low	135 Å²	135	142.9 Å²	142.9	71%	0.707	75%	0.75	S	S	*	*			trans	9.9	129	159.9	-53	170.8	0	0	0	120.1
648	L	28.5	Very low	27.9	Very low	149 Å²	149	144.8 Å²	144.8	78%	0.78	77%	0.765	S	S	*	*				-177.1	127.2	72.3	-88.4	179.9	0	0	0	115.2
649	N	26.1	Very low	27.9	Very low	143 Å²	143	147 Å²	147	77%	0.765	78%	0.779	S	S	*	*			trans	69.4	158.9	131	-143.6	0.9	0	0	0	123.6
650	T	26.8	Very low	28.1	Very low	118 Å²	118	150.5 Å²	150.5	72%	0.724	78%	0.777	S	S	*	*			trans	71.9	83.4	164.6	51.1	0	0	0	0	122.8
651	N	28.1	Very low	28.4	Very low	156 Å²	156	150 Å²	150	83%	0.834	79%	0.791	S	S	*	*				60.3	146.5	111.6	-158.2	19.1	0	0	0	123.1
652	V	28.3	Very low	28.6	Very low	102 Å²	102	152.8 Å²	152.8	62%	0.618	80%	0.8	S	S	*	*			trans	97.9	125.2	160.1	-172	0	0	0	0	119.4
653	Q	27	Very low	28.8	Very low	175 Å²	175	155.1 Å²	155.1	82%	0.818	81%	0.805	S	S	*	*			trans	62.7	126.5	166.7	-71.6	161.5	19.3	0	0	117.3
654	R	28.6	Very low	28.8	Very low	235 Å²	235	157.5 Å²	157.5	89%	0.887	81%	0.809	S	S	*	*			cis	70.1	109.8	47.1	-77.5	-160.7	175.9	100.2	-2.5	115.8
655	T	27.8	Very low	28.8	Very low	137 Å²	137	155.9 Å²	155.9	84%	0.84	81%	0.806	S	S	*	*			trans	169.5	103.8	131.5	-69.4	0	0	0	0	105.8
656	A	27.8	Very low	28.8	Very low	89 Å²	89	150.4 Å²	150.4	74%	0.736	80%	0.801	S	S	*	*				83.6	99.3	58.3	0	0	0	0	0	114.4
657	T	30.6	Very low	28.8	Very low	145 Å²	145	145.5 Å²	145.5	89%	0.89	80%	0.796	S	S	*	*			trans	-151.4	92.4	150.7	45.2	0	0	0	0	109.3
658	D	26.9	Very low	28.7	Very low	171 Å²	171	146.8 Å²	146.8	91%	0.914	80%	0.804	S	S	*	*			trans	-149.3	103	156.5	-137.8	-17	0	0	0	106.4
659	F	26.7	Very low	28.7	Very low	194 Å²	194	149.9 Å²	149.9	85%	0.851	81%	0.807	S	S	*	*			trans	-154.8	80.7	-162	-163.3	-85.3	0	0	0	111.9
660	Y	30.8	Very low	29	Very low	222 Å²	222	150 Å²	150	87%	0.871	81%	0.813	S	S	*	*			trans	-160.8	93.2	153.4	-140.2	-86.2	0	0	0	113.6
661	A	32.8	Very low	29.1	Very low	101 Å²	101	147.6 Å²	147.6	84%	0.835	81%	0.812	S	S	*	*			trans	174.4	66.8	150.4	0	0	0	0	0	112.7
662	E	30.4	Very low	29.1	Very low	195 Å²	195	143.7 Å²	143.7	91%	0.911	81%	0.808	S	S	*	*			trans	-148.5	121.7	167.1	-160.2	167	-144.2	0	0	112
663	L	31.3	Very low	29.2	Very low	142 Å²	142	145 Å²	145	74%	0.743	82%	0.817	S	S	*	*			trans	-145.1	100.8	178.1	-96.6	175.3	0	0	0	112.8
664	Q	30.5	Very low	29.4	Very low	152 Å²	152	143.8 Å²	143.8	71%	0.71	82%	0.815	S	S	*	*			trans	73.5	126.9	135.8	-75	178.8	12.9	0	0	123.1
665	N	28.4	Very low	29.6	Very low	150 Å²	150	140 Å²	140	80%	0.802	81%	0.812	S	S	*	*			trans	76.7	137	144.2	-54.4	-21.6	0	0	0	119.1
666	G	26.9	Very low	29.8	Very low	75 Å²	75	136.8 Å²	136.8	77%	0.773	81%	0.806	S	S	*	*			cis	166.5	164.3	-6.5	0	0	0	0	0	113.7
667	G	27.4	Very low	30	Very low	69 Å²	69	141 Å²	141	71%	0.711	82%	0.816	S	S	*	*			trans	82.9	146.9	178.2	0	0	0	0	0	114.4
668	D	30.9	Very low	30	Very low	163 Å²	163	137.6 Å²	137.6	87%	0.872	81%	0.811	S	S	*	*			cis	-147.9	178.1	0.5	-97.3	-38.1	0	0	0	113
669	Y	29.2	Very low	30.1	Very low	214 Å²	214	137.2 Å²	137.2	84%	0.839	81%	0.805	S	S	*	*			trans	-85.5	174.9	-160	-88.2	-105.4	0	0	0	117.5
670	T	31.6	Very low	30.4	Very low	145 Å²	145	134.8 Å²	134.8	89%	0.89	80%	0.8	S	S	*	*			trans	89.8	149	162.8	76.4	0	0	0	0	117.4
671	G	30.1	Very low	30.7	Very low	68 Å²	68	131.2 Å²	131.2	70%	0.701	80%	0.795	S	S	*	*			cis	-178.3	9	1.2	0	0	0	0	0	119.6
672	G	27.3	Very low	30.9	Very low	74 Å²	74	133.8 Å²	133.8	76%	0.763	80%	0.795	S	S	*	*			trans	68	-177.9	168.6	0	0	0	0	0	118.8
673	T	30.2	Very low	31	Very low	130 Å²	130	128.1 Å²	128.1	80%	0.798	79%	0.789	S	S	*	*			trans	83	121.6	164.1	-21.6	0	0	0	0	120
674	L	30.6	Very low	30.9	Very low	149 Å²	149	125.4 Å²	125.4	78%	0.78	80%	0.796	S	S	*	*			trans	18.6	125.2	154.2	-83.9	79.4	0	0	0	123.5
675	N	34	Very low	30.9	Very low	155 Å²	155	122.1 Å²	122.1	83%	0.829	80%	0.803	S	S	*	*				47.2	119.6	107.8	-177.2	79.5	0	0	0	120.9
676	G	30.6	Very low	31.3	Very low	69 Å²	69	120.4 Å²	120.4	71%	0.711	80%	0.802	S	S	*	*			trans	176.1	134.5	161.2	0	0	0	0	0	114.4
677	N	32.3	Very low	31.7	Very low	177 Å²	177	122.9 Å²	122.9	95%	0.947	80%	0.802	S	S	*	*			trans	-107.8	151.5	179.3	-80.9	-19.6	0	0	0	112.6
678	G	30.7	Very low	32.4	Very low	75 Å²	75	128.7 Å²	128.7	77%	0.773	81%	0.81	S	S	*	*			trans	104.7	165.4	158.6	0	0	0	0	0	116.5
679	M	29.7	Very low	32.7	Very low	162 Å²	162	124.2 Å²	124.2	80%	0.798	80%	0.803	S	S	*	*			cis	-169.1	121.9	-8.8	177.9	64.5	164.9	0	0	110.9
680	L	33.6	Very low	33.5	Very low	143 Å²	143	119.8 Å²	119.8	75%	0.749	80%	0.803	S	S	*	*			trans	60.8	157.4	170.5	-62.1	174.5	0	0	0	116.1
681	L	36.8	Very low	34.3	Very low	147 Å²	147	118.8 Å²	118.8	77%	0.77	80%	0.802	S	S	*	*			cis	-145.2	169.7	35.1	-79.7	162.3	0	0	0	113.7
682	N	37.4	Very low	35.4	Very low	156 Å²	156	123.6 Å²	123.6	83%	0.834	81%	0.806	S	S	*	*			trans	-2.3	143.8	165.9	-58.4	-7.4	0	0	0	120.9
683	G	30.8	Very low	36.5	Very low	75 Å²	75	129.9 Å²	129.9	77%	0.773	81%	0.813	S	S	*	*			cis	149.1	140.8	-7.9	0	0	0	0	0	115.3
684	G	30.7	Very low	37.8	Very low	86 Å²	86	128.6 Å²	128.6	89%	0.887	80%	0.797	S	S	*	*			trans	78.3	137.6	161.1	0	0	0	0	0	117.7
685	G	30.5	Very low	39.8	Very low	83 Å²	83	124.8 Å²	124.8	86%	0.856	78%	0.784	S	S	*	*			trans	136.8	61	168.2	0	0	0	0	0	117.7
686	S	36.5	Very low	41.7	Very low	113 Å²	113	123.1 Å²	123.1	79%	0.79	78%	0.779	S	S	*	*			trans	-18.6	154.5	165.6	-150.7	0	0	0	0	121.8
687	V	35.6	Very low	43.7	Very low	128 Å²	128	127.3 Å²	127.3	78%	0.776	78%	0.778	S	S	*	*			trans	86.2	136.9	159.5	-160.3	0	0	0	0	119.4
688	H	40.8	Very low	45.7	Very low	190 Å²	190	124.1 Å²	124.1	88%	0.88	76%	0.758	S	S	*	*			trans	-38.3	152.7	-174.2	-56.4	-44.1	0	0	0	121
689	G	38	Very low	47.9	Very low	70 Å²	70	126.3 Å²	126.3	72%	0.722	74%	0.743	S	S	*	*			trans	156.1	86.7	135	0	0	0	0	0	118.8
690	S	44.8	Very low	50.2	Low	120 Å²	120	123.1 Å²	123.1	84%	0.839	73%	0.729	S	S	*	*			trans	178.6	87.4	145.4	36.9	0	0	0	0	113.9	Q692	S690-Q692 PolarHBondContact O-N 2.81Å
691	S	50.3	Low	52.4	Low	124 Å²	124	119.4 Å²	119.4	87%	0.867	71%	0.71	S	S	*	*			trans	-83	29.9	171	50.6	0	0	0	0	113.6
692	Q	52.2	Low	54.3	Low	170 Å²	170	116.2 Å²	116.2	79%	0.794	69%	0.693	S	S	*	*			trans	-131.2	69.3	-168.2	-70.1	-172.6	-16.8	0	0	113	S690	S690-Q692 PolarHBondContact O-N 2.81Å
693	K	50.6	Low	56.3	Low	205 Å²	205	117 Å²	117	89%	0.891	69%	0.685	S	S	*	*			trans	-161.8	21.1	157.5	-113.5	155.8	-169.4	176.3	0	117.3	S695	K693-S695 PolarHBondContact O-N 2.85Å
694	E	57.6	Low	58.6	Low	103 Å²	103	116.9 Å²	116.9	48%	0.481	67%	0.666	S	S	.	*	S	Bend	trans	-61.1	109.7	149.9	-89.2	-159.1	142.7	0	0	107.5	R699	E694-R699 IonicContact OE2-CZ 2.79Å; E694-R699 VanDerWaalsContact OE2-CZ 3.23Å; E694-R699 IonicContact OE2-NE 2.74Å; E694-R699 PolarHBondContact OE2-NE 2.61Å; E694-R699 IonicContact OE2-NH2 2.88Å; E694-R699 PolarHBondContact OE2-NH2 2.86Å
695	S	73.3	Confident	60.6	Low	70 Å²	70	118.5 Å²	118.5	49%	0.49	65%	0.648	S	S	.	*			trans	-58.5	140.4	172.3	176.8	0	0	0	0	109.5	K693 F697 M698 R699	K693-S695 PolarHBondContact O-N 2.85Å; S695-F697 PolarHBondContact O-N 3.48Å; S695-F697 VanDerWaalsContact O-N 3.09Å; S695-F697 PolarHBondContact OG-N 2.83Å; S695-M698 WeakPolarHBondContact O-CA 3.18Å; S695-M698 WeakPolarHBondContact O-CB 3.26Å; S695-M698 PolarHBondContact O-N 2.91Å; S695-R699 PolarHBondContact O-N 2.86Å; S695-R699 VanDerWaalsContact O-N 3.1Å
696	V	73.9	Confident	62.4	Low	120 Å²	120	117.3 Å²	117.3	73%	0.727	63%	0.63	S	S	*	*	H	α-helix	trans	-51.6	-35.3	172.9	-179.2	0	0	0	0	110.3	M698 R699 L700	V696-M698 PolarHBondContact O-N 2.81Å; V696-R699 PolarHBondContact O-N 3.44Å; V696-L700 WeakPolarHBondContact O-CB 3.21Å; V696-L700 PolarHBondContact O-N 3Å
697	F	72.3	Confident	64	Low	157 Å²	157	117.5 Å²	117.5	69%	0.689	62%	0.622	S	S	*	*	H	α-helix	trans	-64	-36.9	176.1	-142.5	-87.7	0	0	0	113.4	S695 N701	S695-F697 PolarHBondContact O-N 3.48Å; S695-F697 VanDerWaalsContact O-N 3.09Å; S695-F697 PolarHBondContact OG-N 2.83Å; F697-N701 WeakPolarHBondContact O-CB 3.21Å; F697-N701 PolarHBondContact O-N 3.03Å
698	M	73.5	Confident	65.8	Low	109 Å²	109	116.8 Å²	116.8	54%	0.537	61%	0.61	S	S	.	*	H	α-helix	trans	-73.4	-39.4	177.5	-164.6	174.2	-167.9	0	0	111	S695 V696 L700 N701 N702	S695-M698 WeakPolarHBondContact O-CA 3.18Å; S695-M698 WeakPolarHBondContact O-CB 3.26Å; S695-M698 PolarHBondContact O-N 2.91Å; V696-M698 PolarHBondContact O-N 2.81Å; M698-L700 VanDerWaalsContact C-N 3.35Å; M698-N701 PolarHBondContact O-N 3Å; M698-N702 WeakPolarHBondContact O-CB 3.37Å; M698-N702 PolarHBondContact O-N 3.16Å
699	R	77.4	Confident	67.1	Low	122 Å²	122	113.5 Å²	113.5	46%	0.46	60%	0.596	S	S	.	*	H	α-helix	trans	-67.9	-34.4	174.4	-165.8	173	-64.7	151.7	-0.7	112.3	E694 S695 V696 R703	E694-R699 IonicContact OE2-CZ 2.79Å; E694-R699 VanDerWaalsContact OE2-CZ 3.23Å; E694-R699 IonicContact OE2-NE 2.74Å; E694-R699 PolarHBondContact OE2-NE 2.61Å; E694-R699 IonicContact OE2-NH2 2.88Å; E694-R699 PolarHBondContact OE2-NH2 2.86Å; S695-R699 PolarHBondContact O-N 2.86Å; S695-R699 VanDerWaalsContact O-N 3.1Å; V696-R699 PolarHBondContact O-N 3.44Å; R699-R703 WeakPolarHBondContact O-CB 3.49Å; R699-R703 WeakPolarHBondContact O-CG 3.08Å; R699-R703 PolarHBondContact O-N 3.44Å; R699-R703 VanDerWaalsContact O-N 3.12Å
700	L	78.3	Confident	68.3	Low	95 Å²	95	115.1 Å²	115.1	50%	0.497	59%	0.588	S	S	.	*	H	α-helix	trans	-68.9	-47.8	172.2	-164.2	76.8	0	0	0	111.1	V696 M698 N702 R703 I704	V696-L700 WeakPolarHBondContact O-CB 3.21Å; V696-L700 PolarHBondContact O-N 3Å; M698-L700 VanDerWaalsContact C-N 3.35Å; L700-N702 PolarHBondContact O-N 3.3Å; L700-R703 CarbonylContact O-C 3.56Å; L700-R703 PolarHBondContact O-N 3.03Å; L700-R703 VanDerWaalsContact O-N 3.1Å; L700-I704 HydrophobicContact CD2-CD1 4.18Å; L700-I704 HydrophobicContact CG-CD1 3.91Å; L700-I704 HydrophobicContact CG-CG1 4.49Å; L700-I704 WeakPolarHBondContact O-CB 3.36Å; L700-I704 WeakPolarHBondContact O-CG1 3.25Å; L700-I704 PolarHBondContact O-N 2.94Å
701	N	78.6	Confident	69.3	Low	64 Å²	64	116.2 Å²	116.2	34%	0.342	58%	0.582	S	S	.	*	H	α-helix	trans	-59.4	-44.3	177.1	-171	-24.1	0	0	0	111.8	F697 M698 R703 I704 K705	F697-N701 WeakPolarHBondContact O-CB 3.21Å; F697-N701 PolarHBondContact O-N 3.03Å; M698-N701 PolarHBondContact O-N 3Å; N701-R703 VanDerWaalsContact C-N 3.32Å; N701-R703 PolarHBondContact O-N 2.92Å; N701-I704 PolarHBondContact O-N 2.83Å; N701-K705 WeakPolarHBondContact O-CB 3.13Å; N701-K705 WeakPolarHBondContact O-CG 3.23Å; N701-K705 PolarHBondContact O-N 3.07Å; N701-K705 WeakPolarHBondContact OD1-CD 3.48Å; N701-K705 WeakPolarHBondContact OD1-CE 2.8Å
702	N	77.1	Confident	70.1	Confident	80 Å²	80	112.3 Å²	112.3	43%	0.428	56%	0.555	S	S	.	*	H	α-helix	trans	-64	-35.1	174.7	-70.3	-9.4	0	0	0	112.4	M698 L700 A706	M698-N702 WeakPolarHBondContact O-CB 3.37Å; M698-N702 PolarHBondContact O-N 3.16Å; L700-N702 PolarHBondContact O-N 3.3Å; N702-A706 VanDerWaalsContact O-CB 3.3Å; N702-A706 WeakPolarHBondContact O-CB 3.25Å; N702-A706 PolarHBondContact O-N 2.97Å
703	R	80.1	Confident	70.9	Confident	172 Å²	172	108.2 Å²	108.2	65%	0.649	54%	0.538	S	S	*	.	H	α-helix	trans	-72	-38.7	173.1	-79.8	178.8	170.4	-169.9	-4.9	113	R699 L700 N701 A706 L707	R699-R703 WeakPolarHBondContact O-CB 3.49Å; R699-R703 WeakPolarHBondContact O-CG 3.08Å; R699-R703 PolarHBondContact O-N 3.44Å; R699-R703 VanDerWaalsContact O-N 3.12Å; L700-R703 CarbonylContact O-C 3.56Å; L700-R703 PolarHBondContact O-N 3.03Å; L700-R703 VanDerWaalsContact O-N 3.1Å; N701-R703 VanDerWaalsContact C-N 3.32Å; N701-R703 PolarHBondContact O-N 2.92Å; R703-A706 PolarHBondContact O-N 2.85Å; R703-L707 WeakPolarHBondContact O-CB 3.29Å; R703-L707 VanDerWaalsContact O-CG 3.31Å; R703-L707 WeakPolarHBondContact O-CG 3.39Å; R703-L707 PolarHBondContact O-N 3.39Å
704	I	78.2	Confident	72.2	Confident	74 Å²	74	101.3 Å²	101.3	38%	0.379	52%	0.516	S	S	.	.	H	α-helix	trans	-62.1	-50.6	174.7	-72.2	165.1	0	0	0	109.2	L700 N701 A706 L707 E708	L700-I704 HydrophobicContact CD2-CD1 4.18Å; L700-I704 HydrophobicContact CG-CD1 3.91Å; L700-I704 HydrophobicContact CG-CG1 4.49Å; L700-I704 WeakPolarHBondContact O-CB 3.36Å; L700-I704 WeakPolarHBondContact O-CG1 3.25Å; L700-I704 PolarHBondContact O-N 2.94Å; N701-I704 PolarHBondContact O-N 2.83Å; I704-A706 VanDerWaalsContact C-N 3.31Å; I704-A706 PolarHBondContact O-N 2.79Å; I704-L707 CarbonylContact O-C 3.53Å; I704-L707 WeakPolarHBondContact O-CA 3.45Å; I704-L707 WeakPolarHBondContact O-CB 3.29Å; I704-L707 PolarHBondContact O-N 3.38Å; I704-E708 HydrophobicContact CG2-CG 4.27Å; I704-E708 VanDerWaalsContact CG2-OE1 3.3Å; I704-E708 WeakPolarHBondContact CG2-OE1 3.45Å; I704-E708 WeakPolarHBondContact O-CG 3.23Å; I704-E708 PolarHBondContact O-N 2.85Å
705	K	74.1	Confident	73.3	Confident	120 Å²	120	100 Å²	100	52%	0.522	52%	0.517	S	S	.	.	H	α-helix	trans	-60.1	-36.8	174.9	-73	177.9	174.7	178.2	0	113.5	N701 E708 M709	N701-K705 WeakPolarHBondContact O-CB 3.13Å; N701-K705 WeakPolarHBondContact O-CG 3.23Å; N701-K705 PolarHBondContact O-N 3.07Å; N701-K705 WeakPolarHBondContact OD1-CD 3.48Å; N701-K705 WeakPolarHBondContact OD1-CE 2.8Å; K705-E708 WeakPolarHBondContact CA-OE2 3.49Å; K705-M709 WeakPolarHBondContact O-CB 3.07Å; K705-M709 PolarHBondContact O-N 2.89Å
706	A	67.5	Low	73.7	Confident	57 Å²	57	104.4 Å²	104.4	47%	0.471	52%	0.524	S	S	.	.	H	α-helix	trans	-67.1	-36	173.1	0	0	0	0	0	112.3	N702 R703 I704 N710	N702-A706 VanDerWaalsContact O-CB 3.3Å; N702-A706 WeakPolarHBondContact O-CB 3.25Å; N702-A706 PolarHBondContact O-N 2.97Å; R703-A706 PolarHBondContact O-N 2.85Å; I704-A706 VanDerWaalsContact C-N 3.31Å; I704-A706 PolarHBondContact O-N 2.79Å; A706-N710 VanDerWaalsContact O-CB 3.29Å; A706-N710 WeakPolarHBondContact O-CB 3Å; A706-N710 PolarHBondContact O-N 2.88Å
707	L	71	Confident	74.2	Confident	117 Å²	117	106 Å²	106	61%	0.613	52%	0.518	S	S	*	.	H	α-helix	trans	-74.3	-38.8	175.7	-74.1	165.8	0	0	0	112.4	R703 I704 M709 N710 M711	R703-L707 WeakPolarHBondContact O-CB 3.29Å; R703-L707 VanDerWaalsContact O-CG 3.31Å; R703-L707 WeakPolarHBondContact O-CG 3.39Å; R703-L707 PolarHBondContact O-N 3.39Å; I704-L707 CarbonylContact O-C 3.53Å; I704-L707 WeakPolarHBondContact O-CA 3.45Å; I704-L707 WeakPolarHBondContact O-CB 3.29Å; I704-L707 PolarHBondContact O-N 3.38Å; L707-M709 VanDerWaalsContact C-N 3.33Å; L707-N710 PolarHBondContact O-N 2.72Å; L707-M711 VanDerWaalsContact O-CB 3.25Å; L707-M711 WeakPolarHBondContact O-CB 3.31Å; L707-M711 PolarHBondContact O-N 3.44Å
708	E	72.4	Confident	74.8	Confident	114 Å²	114	104 Å²	104	53%	0.533	51%	0.513	S	S	.	.	H	α-helix	trans	-61.2	-42.6	170.5	-70.2	166	167.9	0	0	110.8	I704 K705 S712	I704-E708 HydrophobicContact CG2-CG 4.27Å; I704-E708 VanDerWaalsContact CG2-OE1 3.3Å; I704-E708 WeakPolarHBondContact CG2-OE1 3.45Å; I704-E708 WeakPolarHBondContact O-CG 3.23Å; I704-E708 PolarHBondContact O-N 2.85Å; K705-E708 WeakPolarHBondContact CA-OE2 3.49Å; E708-S712 WeakPolarHBondContact O-CB 3.5Å; E708-S712 PolarHBondContact O-N 2.87Å; E708-S712 PolarHBondContact O-OG 3.5Å
709	M	67.4	Low	75.5	Confident	120 Å²	120	103.7 Å²	103.7	59%	0.591	51%	0.511	S	S	*	.	H	α-helix	trans	-65.4	-39.3	173.1	-177.8	170.1	144.5	0	0	112	K705 L707 S712 L713	K705-M709 WeakPolarHBondContact O-CB 3.07Å; K705-M709 PolarHBondContact O-N 2.89Å; L707-M709 VanDerWaalsContact C-N 3.33Å; M709-S712 WeakPolarHBondContact CA-OG 3.4Å; M709-S712 PolarHBondContact O-N 3.18Å; M709-S712 PolarHBondContact O-OG 2.96Å; M709-L713 HydrophobicContact CE-CD1 4.29Å; M709-L713 HydrophobicContact CG-CD1 4.26Å; M709-L713 WeakPolarHBondContact O-CB 3.48Å; M709-L713 WeakPolarHBondContact O-CG 3.41Å; M709-L713 PolarHBondContact O-N 3.43Å
710	N	64.1	Low	76.1	Confident	104 Å²	104	102.1 Å²	102.1	56%	0.556	51%	0.508	S	S	*	.	H	α-helix	trans	-72.5	-40.2	178.9	-156.5	3.2	0	0	0	112.3	A706 L707 S712 L713 S714	A706-N710 VanDerWaalsContact O-CB 3.29Å; A706-N710 WeakPolarHBondContact O-CB 3Å; A706-N710 PolarHBondContact O-N 2.88Å; L707-N710 PolarHBondContact O-N 2.72Å; N710-S712 VanDerWaalsContact C-N 3.3Å; N710-S712 PolarHBondContact O-N 3.44Å; N710-L713 WeakPolarHBondContact O-CB 3.03Å; N710-L713 PolarHBondContact O-N 2.9Å; N710-S714 PolarHBondContact O-N 3.31Å
711	M	65.4	Low	76.6	Confident	143 Å²	143	101.7 Å²	101.7	70%	0.704	51%	0.506	S	S	*	.	H	α-helix	trans	-66.9	-30.4	174.2	-164.2	68.1	73	0	0	112.3	L707 S714	L707-M711 VanDerWaalsContact O-CB 3.25Å; L707-M711 WeakPolarHBondContact O-CB 3.31Å; L707-M711 PolarHBondContact O-N 3.44Å; M711-S714 PolarHBondContact O-OG 3Å; M711-S714 VanDerWaalsContact O-OG 3.05Å
712	S	66.4	Low	77.1	Confident	43 Å²	43	100.7 Å²	100.7	30%	0.301	50%	0.504	S	S	.	.	H	α-helix	trans	-84	-20	171.6	56.3	0	0	0	0	113.7	E708 M709 N710 R716	E708-S712 WeakPolarHBondContact O-CB 3.5Å; E708-S712 PolarHBondContact O-N 2.87Å; E708-S712 PolarHBondContact O-OG 3.5Å; M709-S712 WeakPolarHBondContact CA-OG 3.4Å; M709-S712 PolarHBondContact O-N 3.18Å; M709-S712 PolarHBondContact O-OG 2.96Å; N710-S712 VanDerWaalsContact C-N 3.3Å; N710-S712 PolarHBondContact O-N 3.44Å; S712-R716 WeakPolarHBondContact O-CB 3.3Å; S712-R716 WeakPolarHBondContact O-CG 3.26Å; S712-R716 PolarHBondContact O-N 3.2Å
713	L	70.2	Confident	77.7	Confident	84 Å²	84	101.5 Å²	101.5	44%	0.44	51%	0.505	S	S	.	.	H	α-helix	trans	-68.9	-42.9	171.4	-83.8	166.3	0	0	0	112	M709 N710 R716 Y717	M709-L713 HydrophobicContact CE-CD1 4.29Å; M709-L713 HydrophobicContact CG-CD1 4.26Å; M709-L713 WeakPolarHBondContact O-CB 3.48Å; M709-L713 WeakPolarHBondContact O-CG 3.41Å; M709-L713 PolarHBondContact O-N 3.43Å; N710-L713 WeakPolarHBondContact O-CB 3.03Å; N710-L713 PolarHBondContact O-N 2.9Å; L713-R716 PolarHBondContact O-N 3.05Å; L713-Y717 WeakPolarHBondContact O-CB 3.41Å; L713-Y717 PolarHBondContact O-N 3.38Å
714	S	78	Confident	78.2	Confident	60 Å²	60	100.8 Å²	100.8	42%	0.42	50%	0.503	S	S	.	.	H	α-helix	trans	-64.5	-41.5	174.1	58.8	0	0	0	0	111.9	N710 M711 Y717 L718	N710-S714 PolarHBondContact O-N 3.31Å; M711-S714 PolarHBondContact O-OG 3Å; M711-S714 VanDerWaalsContact O-OG 3.05Å; S714-Y717 PolarHBondContact O-N 2.93Å; S714-L718 WeakPolarHBondContact O-CG 3.39Å; S714-L718 PolarHBondContact O-N 3.43Å
715	S	79.5	Confident	78.8	Confident	74 Å²	74	104.8 Å²	104.8	52%	0.517	51%	0.514	S	S	.	.	H	α-helix	trans	-59.6	-49.5	173.7	-174.2	0	0	0	0	112.1	Y717 L718 E719	S715-Y717 VanDerWaalsContact C-N 3.33Å; S715-Y717 PolarHBondContact O-N 2.8Å; S715-L718 PolarHBondContact O-N 3.37Å; S715-E719 WeakPolarHBondContact O-CB 3.47Å; S715-E719 PolarHBondContact O-N 3.38Å
716	R	81.6	Confident	79.8	Confident	164 Å²	164	106 Å²	106	62%	0.619	52%	0.515	S	S	*	.	H	α-helix	trans	-61.4	-37	175.7	-76.1	171.7	-178.6	-177.9	2.7	113.1	S712 L713 E719 E720	S712-R716 WeakPolarHBondContact O-CB 3.3Å; S712-R716 WeakPolarHBondContact O-CG 3.26Å; S712-R716 PolarHBondContact O-N 3.2Å; L713-R716 PolarHBondContact O-N 3.05Å; R716-E719 PolarHBondContact O-N 2.7Å; R716-E720 WeakPolarHBondContact O-CB 3.4Å; R716-E720 PolarHBondContact O-N 2.85Å
717	Y	84.8	Confident	81	Confident	154 Å²	154	109.1 Å²	109.1	60%	0.604	52%	0.518	S	S	*	.	H	α-helix	trans	-65.5	-44.1	176.2	176.5	-99.6	0	0	0	111.9	L713 S714 S715 E720 L721	L713-Y717 WeakPolarHBondContact O-CB 3.41Å; L713-Y717 PolarHBondContact O-N 3.38Å; S714-Y717 PolarHBondContact O-N 2.93Å; S715-Y717 VanDerWaalsContact C-N 3.33Å; S715-Y717 PolarHBondContact O-N 2.8Å; Y717-E720 PolarHBondContact O-N 3.43Å; Y717-L721 HydrophobicContact CE1-CD2 4.5Å; Y717-L721 VanDerWaalsContact O-CB 3.27Å; Y717-L721 WeakPolarHBondContact O-CB 3.41Å; Y717-L721 PolarHBondContact O-N 2.79Å
718	L	85	Confident	81.9	Confident	113 Å²	113	109.4 Å²	109.4	59%	0.592	52%	0.516	S	S	*	.	H	α-helix	trans	-66	-38.8	174.6	-69.7	172.4	0	0	0	111.8	S714 S715 L721 S722	S714-L718 WeakPolarHBondContact O-CG 3.39Å; S714-L718 PolarHBondContact O-N 3.43Å; S715-L718 PolarHBondContact O-N 3.37Å; L718-L721 PolarHBondContact O-N 2.71Å; L718-S722 WeakPolarHBondContact O-CB 3.5Å; L718-S722 PolarHBondContact O-N 3.39Å
719	E	87.6	Confident	82.7	Confident	104 Å²	104	107.6 Å²	107.6	49%	0.486	51%	0.509	S	S	.	.	H	α-helix	trans	-61.3	-52	173.7	-171	-178.7	-175.5	0	0	110.8	S715 R716 L721 S722 Q723	S715-E719 WeakPolarHBondContact O-CB 3.47Å; S715-E719 PolarHBondContact O-N 3.38Å; R716-E719 PolarHBondContact O-N 2.7Å; E719-L721 VanDerWaalsContact C-N 3.33Å; E719-L721 PolarHBondContact O-N 3.05Å; E719-S722 CarbonylContact O-C 3.59Å; E719-S722 WeakPolarHBondContact O-CB 3.43Å; E719-S722 PolarHBondContact O-N 3.22Å; E719-S722 VanDerWaalsContact O-N 3.09Å; E719-S722 PolarHBondContact O-OG 2.88Å; E719-Q723 WeakPolarHBondContact O-CG 3.4Å; E719-Q723 PolarHBondContact O-N 2.81Å; E719-Q723 PolarHBondContact OE1-NE2 3.27Å
720	E	90	Very high	84	Confident	88 Å²	88	107 Å²	107	41%	0.411	51%	0.505	S	S	.	.	H	α-helix	trans	-61.8	-39.8	179.1	-161.6	-168.8	153.9	0	0	111.7	R716 Y717 S722 Q723 R724	R716-E720 WeakPolarHBondContact O-CB 3.4Å; R716-E720 PolarHBondContact O-N 2.85Å; Y717-E720 PolarHBondContact O-N 3.43Å; E720-S722 VanDerWaalsContact C-N 3.35Å; E720-S722 PolarHBondContact O-N 3.38Å; E720-Q723 PolarHBondContact O-N 2.74Å; E720-R724 WeakPolarHBondContact O-CB 3.46Å; E720-R724 VanDerWaalsContact O-CG 3.25Å; E720-R724 WeakPolarHBondContact O-CG 3.22Å; E720-R724 PolarHBondContact O-N 3.16Å; E720-R724 IonicContact OE1-CZ 3.29Å; E720-R724 IonicContact OE1-NE 2.85Å; E720-R724 PolarHBondContact OE1-NE 3Å; E720-R724 IonicContact OE1-NH2 3.89Å; E720-R724 PolarHBondContact OE1-NH2 3.08Å
721	L	89.2	Confident	85.3	Confident	87 Å²	87	105.9 Å²	105.9	46%	0.455	50%	0.496	S	S	.	.	H	α-helix	trans	-61.4	-42.3	173.4	-175.9	61.8	0	0	0	111.5	Y717 L718 E719 Q723 R724 Y725	Y717-L721 HydrophobicContact CE1-CD2 4.5Å; Y717-L721 VanDerWaalsContact O-CB 3.27Å; Y717-L721 WeakPolarHBondContact O-CB 3.41Å; Y717-L721 PolarHBondContact O-N 2.79Å; L718-L721 PolarHBondContact O-N 2.71Å; E719-L721 VanDerWaalsContact C-N 3.33Å; E719-L721 PolarHBondContact O-N 3.05Å; L721-Q723 VanDerWaalsContact C-N 3.34Å; L721-Q723 PolarHBondContact O-N 3.13Å; L721-R724 PolarHBondContact O-N 2.04Å; L721-Y725 WeakPolarHBondContact O-CB 3.37Å; L721-Y725 PolarHBondContact O-N 3.32Å
722	S	89.3	Confident	86.3	Confident	42 Å²	42	104.4 Å²	104.4	29%	0.294	49%	0.489	S	S	.	.	H	α-helix	trans	-68.7	-30.4	176.3	83.4	0	0	0	0	113.4	L718 E719 E720 R726	L718-S722 WeakPolarHBondContact O-CB 3.5Å; L718-S722 PolarHBondContact O-N 3.39Å; E719-S722 CarbonylContact O-C 3.59Å; E719-S722 WeakPolarHBondContact O-CB 3.43Å; E719-S722 PolarHBondContact O-N 3.22Å; E719-S722 VanDerWaalsContact O-N 3.09Å; E719-S722 PolarHBondContact O-OG 2.88Å; E720-S722 VanDerWaalsContact C-N 3.35Å; E720-S722 PolarHBondContact O-N 3.38Å; S722-R726 WeakPolarHBondContact O-CB 3.5Å; S722-R726 WeakPolarHBondContact O-CG 3.47Å; S722-R726 PolarHBondContact O-N 3.11Å; S722-R726 VanDerWaalsContact O-N 3.08Å; S722-R726 PolarHBondContact O-NE 3.37Å; S722-R726 PolarHBondContact OG-NH2 2.9Å
723	Q	89.2	Confident	87.5	Confident	98 Å²	98	106.7 Å²	106.7	46%	0.458	50%	0.495	S	S	.	.	H	α-helix	trans	-74.2	-43.3	174.6	-70.5	179.4	13.2	0	0	110.4	E719 E720 L721 R726 K727	E719-Q723 WeakPolarHBondContact O-CG 3.4Å; E719-Q723 PolarHBondContact O-N 2.81Å; E719-Q723 PolarHBondContact OE1-NE2 3.27Å; E720-Q723 PolarHBondContact O-N 2.74Å; L721-Q723 VanDerWaalsContact C-N 3.34Å; L721-Q723 PolarHBondContact O-N 3.13Å; Q723-R726 PolarHBondContact O-N 3.35Å; Q723-K727 VanDerWaalsContact O-CB 3.3Å; Q723-K727 WeakPolarHBondContact O-CB 3.48Å; Q723-K727 PolarHBondContact O-N 3.03Å
724	R	90.9	Very high	88.7	Confident	157 Å²	157	108.5 Å²	108.5	59%	0.592	50%	0.499	S	S	*	.	H	α-helix	trans	-58.9	-45.4	172.3	-72.6	169.3	178.3	-137.9	8.6	111.3	E720 L721 K727 Q728	E720-R724 WeakPolarHBondContact O-CB 3.46Å; E720-R724 VanDerWaalsContact O-CG 3.25Å; E720-R724 WeakPolarHBondContact O-CG 3.22Å; E720-R724 PolarHBondContact O-N 3.16Å; E720-R724 IonicContact OE1-CZ 3.29Å; E720-R724 IonicContact OE1-NE 2.85Å; E720-R724 PolarHBondContact OE1-NE 3Å; E720-R724 IonicContact OE1-NH2 3.89Å; E720-R724 PolarHBondContact OE1-NH2 3.08Å; L721-R724 PolarHBondContact O-N 2.04Å; R724-K727 PolarHBondContact O-N 3.4Å; R724-Q728 WeakPolarHBondContact O-CB 3.28Å; R724-Q728 VanDerWaalsContact O-CG 3.26Å; R724-Q728 WeakPolarHBondContact O-CG 3.48Å; R724-Q728 PolarHBondContact O-N 2.96Å
725	Y	91.9	Very high	89.3	Confident	157 Å²	157	108.2 Å²	108.2	62%	0.616	50%	0.5	S	S	*	.	H	α-helix	trans	-63.2	-47.8	176.9	-176.3	-99.8	0	0	0	112.5	L721 K727 Q728 M729	L721-Y725 WeakPolarHBondContact O-CB 3.37Å; L721-Y725 PolarHBondContact O-N 3.32Å; Y725-K727 VanDerWaalsContact C-N 3.35Å; Y725-K727 PolarHBondContact O-N 3.2Å; Y725-Q728 PolarHBondContact O-N 2.96Å; Y725-M729 HydrophobicContact CE1-CE 4.13Å; Y725-M729 WeakPolarHBondContact O-CB 3.36Å; Y725-M729 PolarHBondContact O-N 3.38Å; Y725-M729 WeakPolarHBondContact OH-CE 3.44Å
726	R	93.4	Very high	89.9	Confident	145 Å²	145	110.3 Å²	110.3	55%	0.547	50%	0.501	S	S	.	.	H	α-helix	trans	-59.2	-44.5	175.6	-81.6	177.7	-83.3	-168.4	-4	112.2	S722 Q723 Q728 M729 E730	S722-R726 WeakPolarHBondContact O-CB 3.5Å; S722-R726 WeakPolarHBondContact O-CG 3.47Å; S722-R726 PolarHBondContact O-N 3.11Å; S722-R726 VanDerWaalsContact O-N 3.08Å; S722-R726 PolarHBondContact O-NE 3.37Å; S722-R726 PolarHBondContact OG-NH2 2.9Å; Q723-R726 PolarHBondContact O-N 3.35Å; R726-Q728 PolarHBondContact O-N 3.22Å; R726-M729 WeakPolarHBondContact O-CB 3.08Å; R726-M729 PolarHBondContact O-N 2.88Å; R726-E730 PolarHBondContact O-N 3.42Å
727	K	93.2	Very high	90.5	Very high	124 Å²	124	106.1 Å²	106.1	54%	0.539	49%	0.49	S	S	.	.	H	α-helix	trans	-61.2	-43.9	176.1	179.3	173.1	172.4	177.7	0	112.3	Q723 R724 Y725 E730 E731	Q723-K727 VanDerWaalsContact O-CB 3.3Å; Q723-K727 WeakPolarHBondContact O-CB 3.48Å; Q723-K727 PolarHBondContact O-N 3.03Å; R724-K727 PolarHBondContact O-N 3.4Å; Y725-K727 VanDerWaalsContact C-N 3.35Å; Y725-K727 PolarHBondContact O-N 3.2Å; K727-E730 PolarHBondContact O-N 2.88Å; K727-E731 WeakPolarHBondContact CE-OE1 3.42Å; K727-E731 HydrophobicContact CG-CG 4.43Å; K727-E731 IonicContact NZ-OE1 3.02Å; K727-E731 WeakPolarHBondContact O-CB 3.47Å; K727-E731 VanDerWaalsContact O-CG 3.27Å; K727-E731 WeakPolarHBondContact O-CG 3.36Å; K727-E731 PolarHBondContact O-N 3.11Å
728	Q	89.6	Confident	90.9	Very high	122 Å²	122	106.5 Å²	106.5	57%	0.57	50%	0.495	S	S	*	.	H	α-helix	trans	-65.9	-38.4	176.6	-72.2	-80.7	-90.1	0	0	112.2	R724 Y725 R726 E731 M732	R724-Q728 WeakPolarHBondContact O-CB 3.28Å; R724-Q728 VanDerWaalsContact O-CG 3.26Å; R724-Q728 WeakPolarHBondContact O-CG 3.48Å; R724-Q728 PolarHBondContact O-N 2.96Å; Y725-Q728 PolarHBondContact O-N 2.96Å; R726-Q728 PolarHBondContact O-N 3.22Å; Q728-E731 PolarHBondContact NE2-OE2 3.34Å; Q728-E731 PolarHBondContact O-N 2.96Å; Q728-M732 VanDerWaalsContact O-CB 3.28Å; Q728-M732 WeakPolarHBondContact O-CB 3.24Å; Q728-M732 PolarHBondContact O-N 3.02Å
729	M	90.3	Very high	91.3	Very high	77 Å²	77	105.2 Å²	105.2	38%	0.379	49%	0.492	S	S	.	.	H	α-helix	trans	-62.2	-44.2	172.9	-173.2	62.6	65.9	0	0	111.5	Y725 R726 M732 Q733	Y725-M729 HydrophobicContact CE1-CE 4.13Å; Y725-M729 WeakPolarHBondContact O-CB 3.36Å; Y725-M729 PolarHBondContact O-N 3.38Å; Y725-M729 WeakPolarHBondContact OH-CE 3.44Å; R726-M729 WeakPolarHBondContact O-CB 3.08Å; R726-M729 PolarHBondContact O-N 2.88Å; M729-M732 HydrophobicContact CE-CE 4.25Å; M729-M732 PolarHBondContact O-N 2.78Å; M729-M732 HydrophobicContact SD-CE 3.57Å; M729-M732 VanDerWaalsContact SD-CE 3.57Å; M729-Q733 WeakPolarHBondContact O-CB 3.44Å; M729-Q733 PolarHBondContact O-N 3.1Å
730	E	93.9	Very high	91.6	Very high	107 Å²	107	103.2 Å²	103.2	50%	0.5	48%	0.484	S	S	.	.	H	α-helix	trans	-63.5	-42.4	173.9	-80.7	-173.4	-132	0	0	113.2	R726 K727 Q733 K734	R726-E730 PolarHBondContact O-N 3.42Å; K727-E730 PolarHBondContact O-N 2.88Å; E730-Q733 PolarHBondContact O-N 2.77Å; E730-K734 WeakPolarHBondContact O-CB 3.41Å; E730-K734 VanDerWaalsContact O-CD 3.27Å; E730-K734 WeakPolarHBondContact O-CD 3.49Å; E730-K734 WeakPolarHBondContact O-CG 3.11Å; E730-K734 PolarHBondContact O-N 3.23Å; E730-K734 IonicContact OE2-NZ 2.7Å; E730-K734 PolarHBondContact OE2-NZ 3.37Å
731	E	91.6	Very high	91.8	Very high	80 Å²	80	104.4 Å²	104.4	37%	0.374	49%	0.492	S	S	.	.	H	α-helix	trans	-65.5	-40.4	178.1	-74.6	168.3	160.7	0	0	110.9	K727 Q728 K734 A735	K727-E731 WeakPolarHBondContact CE-OE1 3.42Å; K727-E731 HydrophobicContact CG-CG 4.43Å; K727-E731 IonicContact NZ-OE1 3.02Å; K727-E731 WeakPolarHBondContact O-CB 3.47Å; K727-E731 VanDerWaalsContact O-CG 3.27Å; K727-E731 WeakPolarHBondContact O-CG 3.36Å; K727-E731 PolarHBondContact O-N 3.11Å; Q728-E731 PolarHBondContact NE2-OE2 3.34Å; Q728-E731 PolarHBondContact O-N 2.96Å; E731-K734 PolarHBondContact O-N 3.06Å; E731-A735 WeakPolarHBondContact O-CB 3.36Å; E731-A735 PolarHBondContact O-N 2.78Å
732	M	87.3	Confident	92	Very high	112 Å²	112	107.5 Å²	107.5	55%	0.552	50%	0.502	S	S	*	.	H	α-helix	trans	-64.4	-45.4	172.3	-172.2	176.6	72.6	0	0	111.9	Q728 M729 K734 A735 F736	Q728-M732 VanDerWaalsContact O-CB 3.28Å; Q728-M732 WeakPolarHBondContact O-CB 3.24Å; Q728-M732 PolarHBondContact O-N 3.02Å; M729-M732 HydrophobicContact CE-CE 4.25Å; M729-M732 PolarHBondContact O-N 2.78Å; M729-M732 HydrophobicContact SD-CE 3.57Å; M729-M732 VanDerWaalsContact SD-CE 3.57Å; M732-K734 VanDerWaalsContact C-N 3.33Å; M732-K734 PolarHBondContact O-N 3.47Å; M732-A735 WeakPolarHBondContact O-CB 3.31Å; M732-A735 PolarHBondContact O-N 2.89Å; M732-F736 WeakPolarHBondContact O-CB 3.46Å; M732-F736 PolarHBondContact O-N 2.84Å
733	Q	91.3	Very high	92.1	Very high	92 Å²	92	111.2 Å²	111.2	43%	0.43	52%	0.518	S	S	.	.	H	α-helix	trans	-64.6	-36.9	177.8	-166.5	67.4	11.4	0	0	111.9	M729 E730 F736 N737	M729-Q733 WeakPolarHBondContact O-CB 3.44Å; M729-Q733 PolarHBondContact O-N 3.1Å; E730-Q733 PolarHBondContact O-N 2.77Å; Q733-F736 PolarHBondContact O-N 3.47Å; Q733-N737 WeakPolarHBondContact O-CB 3.21Å; Q733-N737 VanDerWaalsContact O-CG 3.29Å; Q733-N737 PolarHBondContact O-N 3.37Å
734	K	94.6	Very high	92.2	Very high	121 Å²	121	112.4 Å²	112.4	53%	0.526	52%	0.523	S	S	.	.	H	α-helix	trans	-65.9	-39.7	173.5	-71.9	159.5	-165.3	163.7	0	111.3	E730 E731 M732 K738	E730-K734 WeakPolarHBondContact O-CB 3.41Å; E730-K734 VanDerWaalsContact O-CD 3.27Å; E730-K734 WeakPolarHBondContact O-CD 3.49Å; E730-K734 WeakPolarHBondContact O-CG 3.11Å; E730-K734 PolarHBondContact O-N 3.23Å; E730-K734 IonicContact OE2-NZ 2.7Å; E730-K734 PolarHBondContact OE2-NZ 3.37Å; E731-K734 PolarHBondContact O-N 3.06Å; M732-K734 VanDerWaalsContact C-N 3.33Å; M732-K734 PolarHBondContact O-N 3.47Å; K734-K738 WeakPolarHBondContact O-CB 3.23Å; K734-K738 PolarHBondContact O-N 3.03Å; K734-K738 VanDerWaalsContact O-N 3.08Å
735	A	91.4	Very high	92.3	Very high	54 Å²	54	109.4 Å²	109.4	45%	0.446	52%	0.519	S	S	.	.	H	α-helix	trans	-66.5	-40.3	173.1	0	0	0	0	0	112.6	E731 M732 K738 T739	E731-A735 WeakPolarHBondContact O-CB 3.36Å; E731-A735 PolarHBondContact O-N 2.78Å; M732-A735 WeakPolarHBondContact O-CB 3.31Å; M732-A735 PolarHBondContact O-N 2.89Å; A735-K738 PolarHBondContact O-N 3.4Å; A735-T739 WeakPolarHBondContact O-CB 3.29Å; A735-T739 PolarHBondContact O-N 3.43Å; A735-T739 PolarHBondContact O-OG1 2.98Å
736	F	91.4	Very high	92.3	Very high	119 Å²	119	105.8 Å²	105.8	52%	0.522	51%	0.514	S	S	.	.	H	α-helix	trans	-65.3	-49.2	177.1	-172.5	-112.9	0	0	0	112.1	M732 Q733 K738 T739 I740	M732-F736 WeakPolarHBondContact O-CB 3.46Å; M732-F736 PolarHBondContact O-N 2.84Å; Q733-F736 PolarHBondContact O-N 3.47Å; F736-K738 VanDerWaalsContact C-N 3.31Å; F736-K738 PolarHBondContact O-N 2.83Å; F736-T739 CarbonylContact O-C 3.59Å; F736-T739 WeakPolarHBondContact O-CA 3.23Å; F736-T739 WeakPolarHBondContact O-CB 3.44Å; F736-T739 PolarHBondContact O-N 3.04Å; F736-I740 HydrophobicContact CD1-CD1 3.86Å; F736-I740 HydrophobicContact CE1-CD1 3.54Å; F736-I740 HydrophobicContact CE1-CG1 4.36Å; F736-I740 HydrophobicContact CZ-CD1 4.05Å; F736-I740 HydrophobicContact CZ-CG1 4.48Å; F736-I740 PolarHBondContact O-N 3.19Å
737	N	93.8	Very high	92.1	Very high	76 Å²	76	102.4 Å²	102.4	41%	0.406	51%	0.512	S	S	.	.	H	α-helix	trans	-59.1	-41.1	174.7	-72	-4.1	0	0	0	111.9	Q733 T739 I740 I741	Q733-N737 WeakPolarHBondContact O-CB 3.21Å; Q733-N737 VanDerWaalsContact O-CG 3.29Å; Q733-N737 PolarHBondContact O-N 3.37Å; N737-T739 VanDerWaalsContact C-N 3.25Å; N737-T739 PolarHBondContact O-N 3.1Å; N737-I740 PolarHBondContact O-N 2.89Å; N737-I741 WeakPolarHBondContact O-CG1 3.4Å; N737-I741 PolarHBondContact O-N 2.88Å
738	K	94	Very high	92.1	Very high	161 Å²	161	103.9 Å²	103.9	70%	0.7	51%	0.514	S	S	*	.	H	α-helix	trans	-62.6	-32.8	173.3	-174.7	176.6	-178.8	179.6	0	112.3	K734 A735 F736 K742	K734-K738 WeakPolarHBondContact O-CB 3.23Å; K734-K738 PolarHBondContact O-N 3.03Å; K734-K738 VanDerWaalsContact O-N 3.08Å; A735-K738 PolarHBondContact O-N 3.4Å; F736-K738 VanDerWaalsContact C-N 3.31Å; F736-K738 PolarHBondContact O-N 2.83Å; K738-K742 WeakPolarHBondContact O-CB 3.34Å; K738-K742 PolarHBondContact O-N 3.11Å
739	T	92.6	Very high	92.2	Very high	86 Å²	86	102.2 Å²	102.2	53%	0.528	51%	0.508	S	S	.	.	H	α-helix	trans	-73.7	-42	177.6	-56.1	0	0	0	0	111	A735 F736 N737 K742 L743	A735-T739 WeakPolarHBondContact O-CB 3.29Å; A735-T739 PolarHBondContact O-N 3.43Å; A735-T739 PolarHBondContact O-OG1 2.98Å; F736-T739 CarbonylContact O-C 3.59Å; F736-T739 WeakPolarHBondContact O-CA 3.23Å; F736-T739 WeakPolarHBondContact O-CB 3.44Å; F736-T739 PolarHBondContact O-N 3.04Å; N737-T739 VanDerWaalsContact C-N 3.25Å; N737-T739 PolarHBondContact O-N 3.1Å; T739-K742 PolarHBondContact O-N 3.31Å; T739-L743 VanDerWaalsContact O-CB 3.29Å; T739-L743 WeakPolarHBondContact O-CB 3.43Å; T739-L743 PolarHBondContact O-N 3.46Å
740	I	94.3	Very high	92	Very high	62 Å²	62	100.6 Å²	100.6	32%	0.318	51%	0.507	S	S	.	.	H	α-helix	trans	-57.4	-51.2	171.5	-68.8	171	0	0	0	110.6	F736 N737 K742 L743 Q744	F736-I740 HydrophobicContact CD1-CD1 3.86Å; F736-I740 HydrophobicContact CE1-CD1 3.54Å; F736-I740 HydrophobicContact CE1-CG1 4.36Å; F736-I740 HydrophobicContact CZ-CD1 4.05Å; F736-I740 HydrophobicContact CZ-CG1 4.48Å; F736-I740 PolarHBondContact O-N 3.19Å; N737-I740 PolarHBondContact O-N 2.89Å; I740-K742 VanDerWaalsContact C-N 3.31Å; I740-K742 PolarHBondContact O-N 3.38Å; I740-L743 PolarHBondContact O-N 2.81Å; I740-L743 VanDerWaalsContact O-N 3.16Å; I740-Q744 HydrophobicContact CG2-CG 4.24Å; I740-Q744 WeakPolarHBondContact O-CB 3.34Å; I740-Q744 WeakPolarHBondContact O-CG 3.43Å; I740-Q744 PolarHBondContact O-N 3.32Å
741	I	94.2	Very high	91.8	Very high	114 Å²	114	102.1 Å²	102.1	59%	0.585	51%	0.514	S	S	*	.	H	α-helix	trans	-61.4	-40.3	-179.6	-66.5	164.9	0	0	0	111.1	N737 N745	N737-I741 WeakPolarHBondContact O-CG1 3.4Å; N737-I741 PolarHBondContact O-N 2.88Å; I741-N745 WeakPolarHBondContact O-CB 3.4Å; I741-N745 PolarHBondContact O-N 2.89Å
742	K	93.7	Very high	91.9	Very high	151 Å²	151	102 Å²	102	66%	0.657	51%	0.514	S	S	*	.	H	α-helix	trans	-64.4	-45.5	174.9	-170.1	-177.1	178.2	-170.7	0	111.5	K738 T739 I740 N745 T746	K738-K742 WeakPolarHBondContact O-CB 3.34Å; K738-K742 PolarHBondContact O-N 3.11Å; T739-K742 PolarHBondContact O-N 3.31Å; I740-K742 VanDerWaalsContact C-N 3.31Å; I740-K742 PolarHBondContact O-N 3.38Å; K742-N745 PolarHBondContact O-N 3.27Å; K742-T746 PolarHBondContact O-N 2.86Å; K742-T746 PolarHBondContact O-OG1 2.67Å
743	L	91.3	Very high	91.9	Very high	120 Å²	120	102.2 Å²	102.2	63%	0.628	51%	0.514	S	S	*	.	H	α-helix	trans	-64	-41.8	179.9	-177.3	63.8	0	0	0	111.9	T739 I740 T746 S747	T739-L743 VanDerWaalsContact O-CB 3.29Å; T739-L743 WeakPolarHBondContact O-CB 3.43Å; T739-L743 PolarHBondContact O-N 3.46Å; I740-L743 PolarHBondContact O-N 2.81Å; I740-L743 VanDerWaalsContact O-N 3.16Å; L743-T746 PolarHBondContact O-N 3.04Å; L743-S747 VanDerWaalsContact O-CB 3.24Å; L743-S747 WeakPolarHBondContact O-CB 3.37Å; L743-S747 PolarHBondContact O-N 2.68Å
744	Q	91.1	Very high	91.7	Very high	123 Å²	123	102.4 Å²	102.4	58%	0.575	52%	0.518	S	S	*	.	H	α-helix	trans	-62.6	-41.4	174.2	-74.3	175.3	-34.8	0	0	111.8	I740 S747 R748	I740-Q744 HydrophobicContact CG2-CG 4.24Å; I740-Q744 WeakPolarHBondContact O-CB 3.34Å; I740-Q744 WeakPolarHBondContact O-CG 3.43Å; I740-Q744 PolarHBondContact O-N 3.32Å; Q744-S747 PolarHBondContact O-N 3.25Å; Q744-R748 WeakPolarHBondContact O-CB 3.34Å; Q744-R748 PolarHBondContact O-N 3.34Å
745	N	92.8	Very high	91.7	Very high	94 Å²	94	101.7 Å²	101.7	50%	0.503	52%	0.516	S	S	.	.	H	α-helix	trans	-66.5	-45.4	176.3	-165.6	5	0	0	0	111.6	I741 K742 S747 R748 I749	I741-N745 WeakPolarHBondContact O-CB 3.4Å; I741-N745 PolarHBondContact O-N 2.89Å; K742-N745 PolarHBondContact O-N 3.27Å; N745-S747 PolarHBondContact O-N 3.14Å; N745-R748 PolarHBondContact O-N 2.9Å; N745-I749 VanDerWaalsContact O-CG1 3.31Å; N745-I749 WeakPolarHBondContact O-CG1 3.32Å; N745-I749 PolarHBondContact O-N 2.85Å
746	T	92.4	Very high	91.8	Very high	82 Å²	82	105.2 Å²	105.2	50%	0.503	52%	0.521	S	S	.	.	H	α-helix	trans	-61.1	-41.9	174	-63.1	0	0	0	0	112.2	K742 L743 I749 A750	K742-T746 PolarHBondContact O-N 2.86Å; K742-T746 PolarHBondContact O-OG1 2.67Å; L743-T746 PolarHBondContact O-N 3.04Å; T746-I749 PolarHBondContact O-N 2.88Å; T746-A750 PolarHBondContact O-N 2.79Å
747	S	88.8	Confident	91.5	Very high	73 Å²	73	105.1 Å²	105.1	51%	0.51	52%	0.522	S	S	.	.	H	α-helix	trans	-61.7	-44.2	175.8	-177.3	0	0	0	0	112	L743 Q744 N745 I749 A750 Q751	L743-S747 VanDerWaalsContact O-CB 3.24Å; L743-S747 WeakPolarHBondContact O-CB 3.37Å; L743-S747 PolarHBondContact O-N 2.68Å; Q744-S747 PolarHBondContact O-N 3.25Å; N745-S747 PolarHBondContact O-N 3.14Å; S747-I749 PolarHBondContact O-N 3.19Å; S747-A750 PolarHBondContact O-N 3.08Å; S747-Q751 PolarHBondContact O-N 2.82Å
748	R	93.8	Very high	91.3	Very high	155 Å²	155	104.6 Å²	104.6	59%	0.585	52%	0.522	S	S	*	.	H	α-helix	trans	-59.7	-45.4	173.5	177.5	-178.7	167.1	149	6.7	112.1	Q744 N745 A750 Q751 E752	Q744-R748 WeakPolarHBondContact O-CB 3.34Å; Q744-R748 PolarHBondContact O-N 3.34Å; N745-R748 PolarHBondContact O-N 2.9Å; R748-A750 VanDerWaalsContact C-N 3.32Å; R748-A750 PolarHBondContact O-N 3.36Å; R748-Q751 PolarHBondContact O-N 3.42Å; R748-E752 IonicContact CZ-OE1 2.69Å; R748-E752 VanDerWaalsContact CZ-OE1 3.22Å; R748-E752 IonicContact NE-OE1 3.13Å; R748-E752 PolarHBondContact NE-OE1 3.43Å; R748-E752 IonicContact NH2-OE1 2.71Å; R748-E752 PolarHBondContact NH2-OE1 2.91Å; R748-E752 WeakPolarHBondContact O-CG 3.48Å; R748-E752 PolarHBondContact O-N 3.31Å
749	I	91.1	Very high	91.3	Very high	88 Å²	88	100.6 Å²	100.6	45%	0.451	51%	0.508	S	S	.	.	H	α-helix	trans	-63.5	-39.5	179.7	-67.8	163.5	0	0	0	110.8	N745 T746 S747 E752 Q753	N745-I749 VanDerWaalsContact O-CG1 3.31Å; N745-I749 WeakPolarHBondContact O-CG1 3.32Å; N745-I749 PolarHBondContact O-N 2.85Å; T746-I749 PolarHBondContact O-N 2.88Å; S747-I749 PolarHBondContact O-N 3.19Å; I749-E752 PolarHBondContact O-N 2.86Å; I749-Q753 PolarHBondContact O-N 3.48Å; I749-Q753 VanDerWaalsContact O-N 3.11Å
750	A	86.8	Confident	91.3	Very high	43 Å²	43	99.1 Å²	99.1	36%	0.355	50%	0.502	S	S	.	.	H	α-helix	trans	-62.8	-46.8	173.3	0	0	0	0	0	111.7	T746 S747 R748 E752 Q753 D754	T746-A750 PolarHBondContact O-N 2.79Å; S747-A750 PolarHBondContact O-N 3.08Å; R748-A750 VanDerWaalsContact C-N 3.32Å; R748-A750 PolarHBondContact O-N 3.36Å; A750-E752 VanDerWaalsContact C-N 3.28Å; A750-E752 PolarHBondContact O-N 3.23Å; A750-Q753 CarbonylContact O-C 3.57Å; A750-Q753 WeakPolarHBondContact O-CA 3.45Å; A750-Q753 WeakPolarHBondContact O-CB 3.4Å; A750-Q753 PolarHBondContact O-N 2.93Å; A750-D754 PolarHBondContact O-N 2.83Å
751	Q	90.1	Very high	91.2	Very high	139 Å²	139	100.2 Å²	100.2	65%	0.65	51%	0.507	S	S	*	.	H	α-helix	trans	-59.8	-37.4	175.2	-170.1	-179.8	6.9	0	0	112.4	S747 R748 Q753 D754 Q755	S747-Q751 PolarHBondContact O-N 2.82Å; R748-Q751 PolarHBondContact O-N 3.42Å; Q751-Q753 PolarHBondContact O-N 3.46Å; Q751-D754 PolarHBondContact O-N 3.46Å; Q751-Q755 WeakPolarHBondContact O-CB 3.45Å; Q751-Q755 PolarHBondContact O-N 3.31Å
752	E	93	Very high	91.1	Very high	78 Å²	78	100.4 Å²	100.4	36%	0.364	51%	0.505	S	S	.	.	H	α-helix	trans	-71.2	-12.6	172.9	-73.5	-175.7	-160.1	0	0	113.7	R748 I749 A750 K756	R748-E752 IonicContact CZ-OE1 2.69Å; R748-E752 VanDerWaalsContact CZ-OE1 3.22Å; R748-E752 IonicContact NE-OE1 3.13Å; R748-E752 PolarHBondContact NE-OE1 3.43Å; R748-E752 IonicContact NH2-OE1 2.71Å; R748-E752 PolarHBondContact NH2-OE1 2.91Å; R748-E752 WeakPolarHBondContact O-CG 3.48Å; R748-E752 PolarHBondContact O-N 3.31Å; I749-E752 PolarHBondContact O-N 2.86Å; A750-E752 VanDerWaalsContact C-N 3.28Å; A750-E752 PolarHBondContact O-N 3.23Å; E752-K756 WeakPolarHBondContact O-CD 3.35Å; E752-K756 WeakPolarHBondContact O-CE 3.33Å; E752-K756 VanDerWaalsContact O-CG 3.28Å; E752-K756 WeakPolarHBondContact O-CG 3.39Å; E752-K756 PolarHBondContact O-NZ 3.29Å
753	Q	86.8	Confident	91.1	Very high	116 Å²	116	98.1 Å²	98.1	54%	0.542	50%	0.5	S	S	.	.	H	α-helix	trans	-90.3	-45	168.4	-70.9	-174.5	-61.8	0	0	111.3	I749 A750 Q751 Q755 K756 Q757	I749-Q753 PolarHBondContact O-N 3.48Å; I749-Q753 VanDerWaalsContact O-N 3.11Å; A750-Q753 CarbonylContact O-C 3.57Å; A750-Q753 WeakPolarHBondContact O-CA 3.45Å; A750-Q753 WeakPolarHBondContact O-CB 3.4Å; A750-Q753 PolarHBondContact O-N 2.93Å; Q751-Q753 PolarHBondContact O-N 3.46Å; Q753-Q755 VanDerWaalsContact C-N 3.28Å; Q753-Q755 PolarHBondContact O-N 2.8Å; Q753-K756 PolarHBondContact O-N 2.64Å; Q753-Q757 PolarHBondContact O-N 3.16Å
754	D	88.3	Confident	91.1	Very high	96 Å²	96	97 Å²	97	51%	0.513	49%	0.494	S	S	.	.	H	α-helix	trans	-58.9	-38.6	177	-71.3	-0.8	0	0	0	111.9	A750 Q751 Q757 T758	A750-D754 PolarHBondContact O-N 2.83Å; Q751-D754 PolarHBondContact O-N 3.46Å; D754-Q757 PolarHBondContact O-N 3.49Å; D754-T758 WeakPolarHBondContact O-CB 3.28Å; D754-T758 PolarHBondContact O-N 3.34Å; D754-T758 PolarHBondContact O-OG1 2.97Å
755	Q	93.1	Very high	91.2	Very high	105 Å²	105	97 Å²	97	49%	0.491	49%	0.494	S	S	.	.	H	α-helix	trans	-61.5	-48.4	172.5	-173.2	64.1	57.4	0	0	111.4	Q751 Q753 Q757 T758 D759	Q751-Q755 WeakPolarHBondContact O-CB 3.45Å; Q751-Q755 PolarHBondContact O-N 3.31Å; Q753-Q755 VanDerWaalsContact C-N 3.28Å; Q753-Q755 PolarHBondContact O-N 2.8Å; Q755-Q757 VanDerWaalsContact C-N 3.3Å; Q755-Q757 PolarHBondContact O-N 2.92Å; Q755-T758 WeakPolarHBondContact O-CB 3.49Å; Q755-T758 PolarHBondContact O-N 3.09Å; Q755-T758 VanDerWaalsContact O-N 3.1Å; Q755-D759 PolarHBondContact NE2-OD1 2.85Å; Q755-D759 PolarHBondContact O-N 2.75Å
756	K	93.6	Very high	91.2	Very high	129 Å²	129	95.3 Å²	95.3	56%	0.561	49%	0.49	S	S	*	.	H	α-helix	trans	-63.1	-36.2	179	-68	177.2	-172.6	103.4	0	112.1	E752 Q753 S760	E752-K756 WeakPolarHBondContact O-CD 3.35Å; E752-K756 WeakPolarHBondContact O-CE 3.33Å; E752-K756 VanDerWaalsContact O-CG 3.28Å; E752-K756 WeakPolarHBondContact O-CG 3.39Å; E752-K756 PolarHBondContact O-NZ 3.29Å; Q753-K756 PolarHBondContact O-N 2.64Å; K756-S760 WeakPolarHBondContact O-CB 3.49Å; K756-S760 PolarHBondContact O-N 3.33Å; K756-S760 PolarHBondContact O-OG 3.36Å
757	Q	85.5	Confident	91.3	Very high	117 Å²	117	96.3 Å²	96.3	55%	0.547	49%	0.489	S	S	.	.	H	α-helix	trans	-64.2	-47.7	171.6	-69.4	-172	12.6	0	0	110.8	Q753 D754 Q755 D759 S760 I761	Q753-Q757 PolarHBondContact O-N 3.16Å; D754-Q757 PolarHBondContact O-N 3.49Å; Q755-Q757 VanDerWaalsContact C-N 3.3Å; Q755-Q757 PolarHBondContact O-N 2.92Å; Q757-D759 PolarHBondContact O-N 3.01Å; Q757-S760 PolarHBondContact O-N 2.88Å; Q757-S760 PolarHBondContact O-OG 3.28Å; Q757-I761 VanDerWaalsContact O-CG1 3.29Å; Q757-I761 WeakPolarHBondContact O-CG1 3.41Å; Q757-I761 PolarHBondContact O-N 3.44Å
758	T	89.4	Confident	91.4	Very high	65 Å²	65	98.7 Å²	98.7	40%	0.399	50%	0.495	S	S	.	.	H	α-helix	trans	-57.5	-47.5	177.4	-57.1	0	0	0	0	111.9	D754 Q755 S760 I761 Q762	D754-T758 WeakPolarHBondContact O-CB 3.28Å; D754-T758 PolarHBondContact O-N 3.34Å; D754-T758 PolarHBondContact O-OG1 2.97Å; Q755-T758 WeakPolarHBondContact O-CB 3.49Å; Q755-T758 PolarHBondContact O-N 3.09Å; Q755-T758 VanDerWaalsContact O-N 3.1Å; T758-S760 VanDerWaalsContact C-N 3.33Å; T758-S760 PolarHBondContact O-N 3.5Å; T758-I761 PolarHBondContact O-N 3.05Å; T758-Q762 PolarHBondContact O-N 2.87Å
759	D	93.8	Very high	91.4	Very high	76 Å²	76	98 Å²	98	41%	0.406	50%	0.499	S	S	.	.	H	α-helix	trans	-60.8	-42.3	177.2	-59.3	-19.9	0	0	0	111.1	Q755 Q757 I761 Q762 L763	Q755-D759 PolarHBondContact NE2-OD1 2.85Å; Q755-D759 PolarHBondContact O-N 2.75Å; Q757-D759 PolarHBondContact O-N 3.01Å; D759-I761 PolarHBondContact O-N 2.82Å; D759-Q762 PolarHBondContact O-N 2.92Å; D759-L763 PolarHBondContact O-N 3.37Å
760	S	92.6	Very high	91.5	Very high	56 Å²	56	98.3 Å²	98.3	39%	0.392	50%	0.501	S	S	.	.	H	α-helix	trans	-66.6	-35	176.9	77.6	0	0	0	0	112.9	K756 Q757 T758 L763 L764	K756-S760 WeakPolarHBondContact O-CB 3.49Å; K756-S760 PolarHBondContact O-N 3.33Å; K756-S760 PolarHBondContact O-OG 3.36Å; Q757-S760 PolarHBondContact O-N 2.88Å; Q757-S760 PolarHBondContact O-OG 3.28Å; T758-S760 VanDerWaalsContact C-N 3.33Å; T758-S760 PolarHBondContact O-N 3.5Å; S760-L763 PolarHBondContact O-N 3.07Å; S760-L764 WeakPolarHBondContact O-CB 3.36Å; S760-L764 VanDerWaalsContact O-CG 3.3Å; S760-L764 WeakPolarHBondContact O-CG 3.32Å; S760-L764 PolarHBondContact O-N 3.47Å
761	I	92.7	Very high	91.8	Very high	84 Å²	84	100.9 Å²	100.9	43%	0.431	51%	0.512	S	S	.	.	H	α-helix	trans	-68.3	-42.4	175.7	-70.2	162.2	0	0	0	110.2	Q757 T758 D759 L764 Q765	Q757-I761 VanDerWaalsContact O-CG1 3.29Å; Q757-I761 WeakPolarHBondContact O-CG1 3.41Å; Q757-I761 PolarHBondContact O-N 3.44Å; T758-I761 PolarHBondContact O-N 3.05Å; D759-I761 PolarHBondContact O-N 2.82Å; I761-L764 PolarHBondContact O-N 3.16Å; I761-Q765 HydrophobicContact CG2-CG 4.48Å; I761-Q765 WeakPolarHBondContact O-CB 3.41Å; I761-Q765 VanDerWaalsContact O-CG 3.28Å; I761-Q765 WeakPolarHBondContact O-CG 3.26Å; I761-Q765 PolarHBondContact O-N 2.92Å
762	Q	93.4	Very high	92	Very high	118 Å²	118	97.1 Å²	97.1	55%	0.551	50%	0.499	S	S	*	.	H	α-helix	trans	-62.8	-41.6	174.6	-71.2	-175.3	6.6	0	0	112	T758 D759 Q765 S766	T758-Q762 PolarHBondContact O-N 2.87Å; D759-Q762 PolarHBondContact O-N 2.92Å; Q762-Q765 PolarHBondContact O-N 3.17Å; Q762-S766 PolarHBondContact O-N 2.87Å
763	L	93.4	Very high	92	Very high	103 Å²	103	100.2 Å²	100.2	54%	0.539	51%	0.511	S	S	.	.	H	α-helix	trans	-61.9	-43.6	174.7	-179.4	61.2	0	0	0	111.9	D759 S760 S766 Q767	D759-L763 PolarHBondContact O-N 3.37Å; S760-L763 PolarHBondContact O-N 3.07Å; L763-S766 PolarHBondContact O-N 3.32Å; L763-Q767 WeakPolarHBondContact O-CG 3.36Å; L763-Q767 PolarHBondContact O-N 2.97Å
764	L	91.7	Very high	92.3	Very high	98 Å²	98	100.2 Å²	100.2	51%	0.513	51%	0.514	S	S	.	.	H	α-helix	trans	-66	-35.9	176.1	-74.1	168.3	0	0	0	112.5	S760 I761 Q767 L768	S760-L764 WeakPolarHBondContact O-CB 3.36Å; S760-L764 VanDerWaalsContact O-CG 3.3Å; S760-L764 WeakPolarHBondContact O-CG 3.32Å; S760-L764 PolarHBondContact O-N 3.47Å; I761-L764 PolarHBondContact O-N 3.16Å; L764-Q767 PolarHBondContact O-N 2.73Å; L764-L768 WeakPolarHBondContact O-CB 3.33Å; L764-L768 PolarHBondContact O-N 3.37Å
765	Q	91.6	Very high	92.5	Very high	121 Å²	121	100.4 Å²	100.4	57%	0.565	51%	0.513	S	S	*	.	H	α-helix	trans	-64.4	-44.8	173.1	-75.2	170	-10.6	0	0	111.5	I761 Q762 Q767 L768 E769	I761-Q765 HydrophobicContact CG2-CG 4.48Å; I761-Q765 WeakPolarHBondContact O-CB 3.41Å; I761-Q765 VanDerWaalsContact O-CG 3.28Å; I761-Q765 WeakPolarHBondContact O-CG 3.26Å; I761-Q765 PolarHBondContact O-N 2.92Å; Q762-Q765 PolarHBondContact O-N 3.17Å; Q765-Q767 PolarHBondContact O-N 2.95Å; Q765-L768 WeakPolarHBondContact O-CB 3.36Å; Q765-L768 PolarHBondContact O-N 3.35Å; Q765-E769 PolarHBondContact O-N 3.44Å
766	S	92.9	Very high	92.4	Very high	59 Å²	59	100.8 Å²	100.8	41%	0.413	52%	0.518	S	S	.	.	H	α-helix	trans	-61	-42.9	174.7	-172	0	0	0	0	112.1	Q762 L763 L768 E769 D770	Q762-S766 PolarHBondContact O-N 2.87Å; L763-S766 PolarHBondContact O-N 3.32Å; S766-L768 VanDerWaalsContact C-N 3.33Å; S766-L768 PolarHBondContact O-N 2.87Å; S766-E769 PolarHBondContact O-N 3.35Å; S766-D770 PolarHBondContact O-N 3.47Å
767	Q	94.4	Very high	92.4	Very high	103 Å²	103	100 Å²	100	48%	0.481	52%	0.52	S	S	.	.	H	α-helix	trans	-64.3	-37.8	175.5	-73.4	-179.1	1.3	0	0	112.1	L763 L764 Q765 E769 D770 V771	L763-Q767 WeakPolarHBondContact O-CG 3.36Å; L763-Q767 PolarHBondContact O-N 2.97Å; L764-Q767 PolarHBondContact O-N 2.73Å; Q765-Q767 PolarHBondContact O-N 2.95Å; Q767-E769 VanDerWaalsContact C-N 3.34Å; Q767-D770 PolarHBondContact O-N 2.96Å; Q767-V771 WeakPolarHBondContact O-CB 3.46Å; Q767-V771 VanDerWaalsContact O-CG2 3.28Å; Q767-V771 WeakPolarHBondContact O-CG2 3.44Å; Q767-V771 PolarHBondContact O-N 3Å
768	L	92	Very high	92.6	Very high	123 Å²	123	99.1 Å²	99.1	64%	0.644	52%	0.519	S	S	*	.	H	α-helix	trans	-64	-39.7	175	-160.3	85	0	0	0	111.5	L764 Q765 S766 T772	L764-L768 WeakPolarHBondContact O-CB 3.33Å; L764-L768 PolarHBondContact O-N 3.37Å; Q765-L768 WeakPolarHBondContact O-CB 3.36Å; Q765-L768 PolarHBondContact O-N 3.35Å; S766-L768 VanDerWaalsContact C-N 3.33Å; S766-L768 PolarHBondContact O-N 2.87Å; L768-T772 VanDerWaalsContact O-CB 3.24Å; L768-T772 WeakPolarHBondContact O-CB 3.27Å; L768-T772 PolarHBondContact O-N 3.49Å; L768-T772 PolarHBondContact O-OG1 2.86Å
769	E	92.6	Very high	92.7	Very high	142 Å²	142	100 Å²	100	66%	0.664	52%	0.524	S	S	*	.	H	α-helix	trans	-66.2	-45.7	176.8	-170.8	172.4	-178.6	0	0	111.7	Q765 S766 Q767 T772 K773	Q765-E769 PolarHBondContact O-N 3.44Å; S766-E769 PolarHBondContact O-N 3.35Å; Q767-E769 VanDerWaalsContact C-N 3.34Å; E769-T772 PolarHBondContact O-N 3.33Å; E769-K773 VanDerWaalsContact O-CB 3.25Å; E769-K773 WeakPolarHBondContact O-CB 3.5Å; E769-K773 PolarHBondContact O-N 2.97Å
770	D	93.9	Very high	92.6	Very high	93 Å²	93	99 Å²	99	50%	0.497	53%	0.526	S	S	.	.	H	α-helix	trans	-63.5	-41.5	176	-84.2	-37.1	0	0	0	112.6	S766 Q767 K773 L774	S766-D770 PolarHBondContact O-N 3.47Å; Q767-D770 PolarHBondContact O-N 2.96Å; D770-K773 PolarHBondContact O-N 3.46Å; D770-L774 WeakPolarHBondContact O-CB 2.83Å; D770-L774 PolarHBondContact O-N 2.81Å
771	V	94.2	Very high	92.5	Very high	98 Å²	98	99.2 Å²	99.2	59%	0.594	53%	0.525	S	S	*	.	H	α-helix	trans	-65.9	-41.7	174.5	170.2	0	0	0	0	111.1	Q767 K773 L774 M775	Q767-V771 WeakPolarHBondContact O-CB 3.46Å; Q767-V771 VanDerWaalsContact O-CG2 3.28Å; Q767-V771 WeakPolarHBondContact O-CG2 3.44Å; Q767-V771 PolarHBondContact O-N 3Å; V771-K773 VanDerWaalsContact C-N 3.31Å; V771-K773 PolarHBondContact O-N 2.85Å; V771-L774 PolarHBondContact O-N 3Å; V771-M775 WeakPolarHBondContact O-CB 3.16Å; V771-M775 PolarHBondContact O-N 2.88Å
772	T	93.4	Very high	92.4	Very high	60 Å²	60	98.8 Å²	98.8	37%	0.368	53%	0.526	S	S	.	.	H	α-helix	trans	-61.9	-40.9	176.2	-60.5	0	0	0	0	111.2	L768 E769 M775 L776	L768-T772 VanDerWaalsContact O-CB 3.24Å; L768-T772 WeakPolarHBondContact O-CB 3.27Å; L768-T772 PolarHBondContact O-N 3.49Å; L768-T772 PolarHBondContact O-OG1 2.86Å; E769-T772 PolarHBondContact O-N 3.33Å; T772-M775 PolarHBondContact O-N 3.35Å; T772-L776 HydrophobicContact CG2-CD1 4.22Å; T772-L776 WeakPolarHBondContact O-CB 3.32Å; T772-L776 VanDerWaalsContact O-CG 3.3Å; T772-L776 WeakPolarHBondContact O-CG 3.41Å; T772-L776 PolarHBondContact O-N 2.89Å
773	K	93.3	Very high	92.1	Very high	142 Å²	142	95.4 Å²	95.4	62%	0.617	52%	0.515	S	S	*	.	H	α-helix	trans	-66	-38.5	176.2	-176.5	178.6	179.3	-177.9	0	112.4	E769 D770 V771 N777	E769-K773 VanDerWaalsContact O-CB 3.25Å; E769-K773 WeakPolarHBondContact O-CB 3.5Å; E769-K773 PolarHBondContact O-N 2.97Å; D770-K773 PolarHBondContact O-N 3.46Å; V771-K773 VanDerWaalsContact C-N 3.31Å; V771-K773 PolarHBondContact O-N 2.85Å; K773-N777 PolarHBondContact O-N 3.39Å
774	L	93.6	Very high	91.9	Very high	116 Å²	116	95.8 Å²	95.8	61%	0.607	51%	0.514	S	S	*	.	H	α-helix	trans	-66.8	-44.2	172.3	-170.9	153.4	0	0	0	111.3	D770 V771 N777 L778	D770-L774 WeakPolarHBondContact O-CB 2.83Å; D770-L774 PolarHBondContact O-N 2.81Å; V771-L774 PolarHBondContact O-N 3Å; L774-N777 WeakPolarHBondContact O-CB 3.27Å; L774-N777 PolarHBondContact O-N 3.43Å; L774-L778 WeakPolarHBondContact O-CB 3.43Å; L774-L778 PolarHBondContact O-N 3.18Å
775	M	90.9	Very high	91.7	Very high	101 Å²	101	96 Å²	96	50%	0.498	52%	0.515	S	S	.	.	H	α-helix	trans	-59.4	-48.5	175.9	-176.2	-170.8	72.8	0	0	111.4	V771 T772 N777 L778 T779	V771-M775 WeakPolarHBondContact O-CB 3.16Å; V771-M775 PolarHBondContact O-N 2.88Å; T772-M775 PolarHBondContact O-N 3.35Å; M775-N777 VanDerWaalsContact C-N 3.29Å; M775-N777 PolarHBondContact O-N 3.27Å; M775-L778 PolarHBondContact O-N 2.88Å; M775-L778 VanDerWaalsContact O-N 3.16Å; M775-T779 WeakPolarHBondContact O-CB 3.49Å; M775-T779 PolarHBondContact O-N 2.97Å; M775-T779 PolarHBondContact O-OG1 3.46Å; M775-T779 VanDerWaalsContact O-OG1 3.06Å
776	L	91.1	Very high	91.5	Very high	113 Å²	113	96.8 Å²	96.8	59%	0.592	52%	0.519	S	S	*	.	H	α-helix	trans	-58.8	-39.5	177.6	-73.9	170.7	0	0	0	112.3	T772 A780	T772-L776 HydrophobicContact CG2-CD1 4.22Å; T772-L776 WeakPolarHBondContact O-CB 3.32Å; T772-L776 VanDerWaalsContact O-CG 3.3Å; T772-L776 WeakPolarHBondContact O-CG 3.41Å; T772-L776 PolarHBondContact O-N 2.89Å; L776-A780 WeakPolarHBondContact O-CB 3.25Å; L776-A780 PolarHBondContact O-N 2.9Å
777	N	93.3	Very high	91.2	Very high	111 Å²	111	101.3 Å²	101.3	59%	0.594	53%	0.527	S	S	*	.	H	α-helix	trans	-66.1	-46.8	174.3	-171.9	18.9	0	0	0	111.6	K773 L774 M775 A780 T781	K773-N777 PolarHBondContact O-N 3.39Å; L774-N777 WeakPolarHBondContact O-CB 3.27Å; L774-N777 PolarHBondContact O-N 3.43Å; M775-N777 VanDerWaalsContact C-N 3.29Å; M775-N777 PolarHBondContact O-N 3.27Å; N777-A780 WeakPolarHBondContact O-CB 3.39Å; N777-A780 PolarHBondContact O-N 3.41Å; N777-T781 PolarHBondContact O-N 2.79Å; N777-T781 VanDerWaalsContact O-N 3.12Å
778	L	91	Very high	91	Very high	100 Å²	100	100.5 Å²	100.5	52%	0.524	52%	0.523	S	S	.	.	H	α-helix	trans	-62.6	-48.6	178.9	-171.3	63.7	0	0	0	111.3	L774 M775 A780 T781 V782	L774-L778 WeakPolarHBondContact O-CB 3.43Å; L774-L778 PolarHBondContact O-N 3.18Å; M775-L778 PolarHBondContact O-N 2.88Å; M775-L778 VanDerWaalsContact O-N 3.16Å; L778-A780 VanDerWaalsContact C-N 3.27Å; L778-A780 PolarHBondContact O-N 3.07Å; L778-T781 PolarHBondContact O-N 2.93Å; L778-T781 PolarHBondContact O-OG1 3.33Å; L778-V782 HydrophobicContact CG-CG2 4.42Å; L778-V782 WeakPolarHBondContact O-CG2 3.39Å; L778-V782 PolarHBondContact O-N 2.92Å
779	T	91.6	Very high	90.9	Very high	84 Å²	84	98.5 Å²	98.5	52%	0.515	52%	0.516	S	S	.	.	H	α-helix	trans	-57.2	-37.6	175.2	-62.1	0	0	0	0	112	M775 V782 S783	M775-T779 WeakPolarHBondContact O-CB 3.49Å; M775-T779 PolarHBondContact O-N 2.97Å; M775-T779 PolarHBondContact O-OG1 3.46Å; M775-T779 VanDerWaalsContact O-OG1 3.06Å; T779-V782 PolarHBondContact O-N 3.08Å; T779-S783 WeakPolarHBondContact O-CB 3.3Å; T779-S783 PolarHBondContact O-N 2.88Å
780	A	91.4	Very high	90.4	Very high	53 Å²	53	95.1 Å²	95.1	44%	0.438	51%	0.508	S	S	.	.	H	α-helix	trans	-60.7	-49.3	172.4	0	0	0	0	0	111.6	L776 N777 L778 V782 S783 Q784	L776-A780 WeakPolarHBondContact O-CB 3.25Å; L776-A780 PolarHBondContact O-N 2.9Å; N777-A780 WeakPolarHBondContact O-CB 3.39Å; N777-A780 PolarHBondContact O-N 3.41Å; L778-A780 VanDerWaalsContact C-N 3.27Å; L778-A780 PolarHBondContact O-N 3.07Å; A780-V782 PolarHBondContact O-N 2.86Å; A780-S783 PolarHBondContact O-N 3.18Å; A780-S783 PolarHBondContact O-OG 3.48Å; A780-Q784 PolarHBondContact O-N 3.42Å; A780-Q784 VanDerWaalsContact O-N 3.09Å
781	T	90	Very high	90.2	Very high	61 Å²	61	94.6 Å²	94.6	37%	0.374	51%	0.505	S	S	.	.	H	α-helix	trans	-64.5	-38.8	177.5	67.6	0	0	0	0	113.1	N777 L778 Q784 L785	N777-T781 PolarHBondContact O-N 2.79Å; N777-T781 VanDerWaalsContact O-N 3.12Å; L778-T781 PolarHBondContact O-N 2.93Å; L778-T781 PolarHBondContact O-OG1 3.33Å; T781-Q784 WeakPolarHBondContact O-CB 3.42Å; T781-Q784 PolarHBondContact O-N 3.49Å; T781-L785 WeakPolarHBondContact O-CG 3.49Å; T781-L785 PolarHBondContact O-N 3.26Å
782	V	90.9	Very high	90	Very high	75 Å²	75	98.2 Å²	98.2	46%	0.455	51%	0.508	S	S	.	.	H	α-helix	trans	-64	-42.2	175	172.5	0	0	0	0	110.4	L778 T779 A780 Q784 L785 Q786	L778-V782 HydrophobicContact CG-CG2 4.42Å; L778-V782 WeakPolarHBondContact O-CG2 3.39Å; L778-V782 PolarHBondContact O-N 2.92Å; T779-V782 PolarHBondContact O-N 3.08Å; A780-V782 PolarHBondContact O-N 2.86Å; V782-Q784 VanDerWaalsContact C-N 3.27Å; V782-Q784 PolarHBondContact O-N 3.29Å; V782-L785 PolarHBondContact O-N 2.89Å; V782-Q786 VanDerWaalsContact O-CB 3.25Å; V782-Q786 WeakPolarHBondContact O-CB 3.27Å; V782-Q786 PolarHBondContact O-N 3.37Å
783	S	87	Confident	89.7	Confident	47 Å²	47	101.3 Å²	101.3	33%	0.329	52%	0.519	S	S	.	.	H	α-helix	trans	-63.7	-31.9	176	85.3	0	0	0	0	112.9	T779 A780 R787	T779-S783 WeakPolarHBondContact O-CB 3.3Å; T779-S783 PolarHBondContact O-N 2.88Å; A780-S783 PolarHBondContact O-N 3.18Å; A780-S783 PolarHBondContact O-OG 3.48Å; S783-R787 WeakPolarHBondContact O-CB 3.36Å; S783-R787 PolarHBondContact O-N 2.95Å; S783-R787 VanDerWaalsContact O-N 3.11Å; S783-R787 PolarHBondContact O-NH1 3.19Å
784	Q	89.2	Confident	89.5	Confident	111 Å²	111	97.4 Å²	97.4	52%	0.519	51%	0.509	S	S	.	.	H	α-helix	trans	-69.4	-51.3	173.4	-177.1	-176.7	-32.2	0	0	110.7	A780 T781 V782 Q786 R787 E788	A780-Q784 PolarHBondContact O-N 3.42Å; A780-Q784 VanDerWaalsContact O-N 3.09Å; T781-Q784 WeakPolarHBondContact O-CB 3.42Å; T781-Q784 PolarHBondContact O-N 3.49Å; V782-Q784 VanDerWaalsContact C-N 3.27Å; V782-Q784 PolarHBondContact O-N 3.29Å; Q784-Q786 VanDerWaalsContact C-N 3.31Å; Q784-Q786 PolarHBondContact O-N 3.08Å; Q784-R787 WeakPolarHBondContact O-CB 3.38Å; Q784-R787 PolarHBondContact O-N 2.89Å; Q784-R787 VanDerWaalsContact O-N 3.09Å; Q784-E788 PolarHBondContact NE2-OE1 3.42Å; Q784-E788 VanDerWaalsContact NE2-OE1 3.12Å; Q784-E788 PolarHBondContact O-N 2.88Å
785	L	87.1	Confident	89.4	Confident	102 Å²	102	99.7 Å²	99.7	53%	0.534	51%	0.511	S	S	.	.	H	α-helix	trans	-60.8	-39.3	178.2	-70.4	170.4	0	0	0	112	T781 V782 R787 E788 V789	T781-L785 WeakPolarHBondContact O-CG 3.49Å; T781-L785 PolarHBondContact O-N 3.26Å; V782-L785 PolarHBondContact O-N 2.89Å; L785-R787 VanDerWaalsContact C-N 3.34Å; L785-R787 PolarHBondContact O-N 2.65Å; L785-E788 PolarHBondContact O-N 3.49Å; L785-V789 WeakPolarHBondContact O-CB 3.38Å; L785-V789 VanDerWaalsContact O-CG2 3.3Å; L785-V789 WeakPolarHBondContact O-CG2 3.41Å; L785-V789 PolarHBondContact O-N 3.43Å
786	Q	87.6	Confident	89.4	Confident	138 Å²	138	100.5 Å²	100.5	65%	0.645	52%	0.516	S	S	*	.	H	α-helix	trans	-63.8	-38.3	174.8	-174.2	179.1	0.5	0	0	111.6	V782 Q784 V789 S790	V782-Q786 VanDerWaalsContact O-CB 3.25Å; V782-Q786 WeakPolarHBondContact O-CB 3.27Å; V782-Q786 PolarHBondContact O-N 3.37Å; Q784-Q786 VanDerWaalsContact C-N 3.31Å; Q784-Q786 PolarHBondContact O-N 3.08Å; Q786-V789 PolarHBondContact O-N 3.45Å; Q786-S790 WeakPolarHBondContact O-CB 3.21Å; Q786-S790 PolarHBondContact O-N 3.44Å
787	R	87.7	Confident	89.6	Confident	155 Å²	155	99.4 Å²	99.4	59%	0.585	51%	0.514	S	S	*	.	H	α-helix	trans	-66.4	-45.3	174.3	-169.9	175.7	-70.7	102.2	-2.6	111.4	S783 Q784 L785 V789 S790 D791	S783-R787 WeakPolarHBondContact O-CB 3.36Å; S783-R787 PolarHBondContact O-N 2.95Å; S783-R787 VanDerWaalsContact O-N 3.11Å; S783-R787 PolarHBondContact O-NH1 3.19Å; Q784-R787 WeakPolarHBondContact O-CB 3.38Å; Q784-R787 PolarHBondContact O-N 2.89Å; Q784-R787 VanDerWaalsContact O-N 3.09Å; L785-R787 VanDerWaalsContact C-N 3.34Å; L785-R787 PolarHBondContact O-N 2.65Å; R787-V789 PolarHBondContact O-N 2.88Å; R787-S790 WeakPolarHBondContact O-CB 3.39Å; R787-S790 PolarHBondContact O-N 3.42Å; R787-D791 PolarHBondContact O-N 2.69Å
788	E	89.9	Confident	89.6	Confident	86 Å²	86	99.2 Å²	99.2	40%	0.402	51%	0.513	S	S	.	.	H	α-helix	trans	-61.3	-40.7	174.7	-70.6	-178.3	-145.9	0	0	112.6	Q784 L785 R792	Q784-E788 PolarHBondContact NE2-OE1 3.42Å; Q784-E788 VanDerWaalsContact NE2-OE1 3.12Å; Q784-E788 PolarHBondContact O-N 2.88Å; L785-E788 PolarHBondContact O-N 3.49Å; E788-R792 WeakPolarHBondContact O-CG 3.45Å; E788-R792 PolarHBondContact O-N 2.71Å; E788-R792 VanDerWaalsContact O-N 3.12Å
789	V	88.6	Confident	89.6	Confident	80 Å²	80	97.2 Å²	97.2	49%	0.485	51%	0.507	S	S	.	.	H	α-helix	trans	-70.2	-39.2	175.8	170.8	0	0	0	0	111.6	L785 Q786 R787 R792 Q793	L785-V789 WeakPolarHBondContact O-CB 3.38Å; L785-V789 VanDerWaalsContact O-CG2 3.3Å; L785-V789 WeakPolarHBondContact O-CG2 3.41Å; L785-V789 PolarHBondContact O-N 3.43Å; Q786-V789 PolarHBondContact O-N 3.45Å; R787-V789 PolarHBondContact O-N 2.88Å; V789-R792 PolarHBondContact O-N 2.9Å; V789-Q793 WeakPolarHBondContact O-CG 3.49Å; V789-Q793 PolarHBondContact O-N 3.43Å
790	S	83.8	Confident	89.8	Confident	71 Å²	71	98.5 Å²	98.5	50%	0.497	51%	0.51	S	S	.	.	H	α-helix	trans	-59.4	-47.2	174.9	178.6	0	0	0	0	111.1	Q786 R787 R792 Q793 S794	Q786-S790 WeakPolarHBondContact O-CB 3.21Å; Q786-S790 PolarHBondContact O-N 3.44Å; R787-S790 WeakPolarHBondContact O-CB 3.39Å; R787-S790 PolarHBondContact O-N 3.42Å; S790-R792 PolarHBondContact O-N 3.08Å; S790-Q793 PolarHBondContact O-N 2.66Å; S790-S794 WeakPolarHBondContact O-CB 3.29Å; S790-S794 PolarHBondContact O-N 3.46Å
791	D	88.8	Confident	90	Very high	83 Å²	83	99.4 Å²	99.4	44%	0.444	51%	0.51	S	S	.	.	H	α-helix	trans	-61.2	-45.4	176.1	-76.2	-5.2	0	0	0	111.2	R787 Q793 S794 Y795	R787-D791 PolarHBondContact O-N 2.69Å; D791-Q793 VanDerWaalsContact C-N 3.3Å; D791-Q793 PolarHBondContact O-N 3.36Å; D791-S794 WeakPolarHBondContact O-CB 3.2Å; D791-S794 PolarHBondContact O-N 2.89Å; D791-S794 VanDerWaalsContact O-N 3.16Å; D791-Y795 HydrophobicContact CB-CE2 4.28Å; D791-Y795 WeakPolarHBondContact O-CD2 3.44Å; D791-Y795 PolarHBondContact O-N 2.84Å
792	R	89.2	Confident	90.2	Very high	174 Å²	174	101.4 Å²	101.4	66%	0.657	52%	0.518	S	S	*	.	H	α-helix	trans	-58.3	-39.7	176	-66.4	-86.2	179.4	74.2	10.6	112.3	E788 V789 S790 L796	E788-R792 WeakPolarHBondContact O-CG 3.45Å; E788-R792 PolarHBondContact O-N 2.71Å; E788-R792 VanDerWaalsContact O-N 3.12Å; V789-R792 PolarHBondContact O-N 2.9Å; S790-R792 PolarHBondContact O-N 3.08Å; R792-L796 WeakPolarHBondContact O-CG 3.35Å; R792-L796 PolarHBondContact O-N 2.7Å
793	Q	87.3	Confident	90.4	Very high	125 Å²	125	101.8 Å²	101.8	58%	0.584	52%	0.523	S	S	*	.	H	α-helix	trans	-73	-37.9	175.2	-69.4	-166.1	19.2	0	0	112.5	V789 S790 D791 Y795 L796 V797	V789-Q793 WeakPolarHBondContact O-CG 3.49Å; V789-Q793 PolarHBondContact O-N 3.43Å; S790-Q793 PolarHBondContact O-N 2.66Å; D791-Q793 VanDerWaalsContact C-N 3.3Å; D791-Q793 PolarHBondContact O-N 3.36Å; Q793-Y795 PolarHBondContact O-N 2.69Å; Q793-L796 WeakPolarHBondContact O-CB 3.33Å; Q793-L796 PolarHBondContact O-N 2.83Å; Q793-L796 VanDerWaalsContact O-N 3.14Å; Q793-V797 WeakPolarHBondContact O-CG2 3.31Å; Q793-V797 PolarHBondContact O-N 3.09Å
794	S	88.8	Confident	90.8	Very high	59 Å²	59	104.8 Å²	104.8	41%	0.413	54%	0.535	S	S	.	.	H	α-helix	trans	-58	-47.8	174.3	-174.4	0	0	0	0	111.4	S790 D791 L796 V797 L798	S790-S794 WeakPolarHBondContact O-CB 3.29Å; S790-S794 PolarHBondContact O-N 3.46Å; D791-S794 WeakPolarHBondContact O-CB 3.2Å; D791-S794 PolarHBondContact O-N 2.89Å; D791-S794 VanDerWaalsContact O-N 3.16Å; S794-L796 VanDerWaalsContact C-N 3.31Å; S794-L796 PolarHBondContact O-N 3.48Å; S794-V797 PolarHBondContact O-N 2.92Å; S794-L798 WeakPolarHBondContact O-CB 3.4Å; S794-L798 VanDerWaalsContact O-CG 3.31Å; S794-L798 WeakPolarHBondContact O-CG 3.21Å; S794-L798 PolarHBondContact O-N 2.83Å
795	Y	92.2	Very high	91	Very high	164 Å²	164	104.3 Å²	104.3	64%	0.643	54%	0.536	S	S	*	.	H	α-helix	trans	-60.1	-38	174.2	-72	-61.8	0	0	0	112.9	D791 Q793 S799	D791-Y795 HydrophobicContact CB-CE2 4.28Å; D791-Y795 WeakPolarHBondContact O-CD2 3.44Å; D791-Y795 PolarHBondContact O-N 2.84Å; Q793-Y795 PolarHBondContact O-N 2.69Å; Y795-S799 WeakPolarHBondContact O-CB 3.44Å; Y795-S799 PolarHBondContact O-N 2.88Å
796	L	92	Very high	91.4	Very high	118 Å²	118	103.9 Å²	103.9	62%	0.618	53%	0.533	S	S	*	.	H	α-helix	trans	-65.8	-44.9	175.4	-73.9	168.9	0	0	0	111.9	R792 Q793 S794 S799 L800	R792-L796 WeakPolarHBondContact O-CG 3.35Å; R792-L796 PolarHBondContact O-N 2.7Å; Q793-L796 WeakPolarHBondContact O-CB 3.33Å; Q793-L796 PolarHBondContact O-N 2.83Å; Q793-L796 VanDerWaalsContact O-N 3.14Å; S794-L796 VanDerWaalsContact C-N 3.31Å; S794-L796 PolarHBondContact O-N 3.48Å; L796-S799 PolarHBondContact O-N 3.19Å; L796-S799 PolarHBondContact O-OG 3.06Å; L796-L800 PolarHBondContact O-N 3.02Å
797	V	94.3	Very high	91.6	Very high	91 Å²	91	99.1 Å²	99.1	55%	0.552	52%	0.521	S	S	*	.	H	α-helix	trans	-62.6	-45.3	176.3	173.4	0	0	0	0	111.1	Q793 S794 S799 L800 V801	Q793-V797 WeakPolarHBondContact O-CG2 3.31Å; Q793-V797 PolarHBondContact O-N 3.09Å; S794-V797 PolarHBondContact O-N 2.92Å; V797-S799 VanDerWaalsContact C-N 3.31Å; V797-S799 PolarHBondContact O-N 3.39Å; V797-L800 PolarHBondContact O-N 3.49Å; V797-L800 VanDerWaalsContact O-N 3.17Å; V797-V801 WeakPolarHBondContact O-CG2 3.3Å; V797-V801 PolarHBondContact O-N 3.26Å
798	L	94	Very high	91.9	Very high	107 Å²	107	95.7 Å²	95.7	56%	0.56	52%	0.518	S	S	*	.	H	α-helix	trans	-59.1	-41.3	174.9	-71.6	168.8	0	0	0	111.9	S794 L800 V801 L802	S794-L798 WeakPolarHBondContact O-CB 3.4Å; S794-L798 VanDerWaalsContact O-CG 3.31Å; S794-L798 WeakPolarHBondContact O-CG 3.21Å; S794-L798 PolarHBondContact O-N 2.83Å; L798-L800 PolarHBondContact O-N 3.26Å; L798-V801 PolarHBondContact O-N 3.44Å; L798-L802 WeakPolarHBondContact O-CB 3.49Å; L798-L802 PolarHBondContact O-N 2.85Å
799	S	91.3	Very high	91.9	Very high	58 Å²	58	96.7 Å²	96.7	41%	0.406	53%	0.525	S	S	.	.	H	α-helix	trans	-65.2	-36.7	176.3	79.6	0	0	0	0	112.7	Y795 L796 V797 L802 C803	Y795-S799 WeakPolarHBondContact O-CB 3.44Å; Y795-S799 PolarHBondContact O-N 2.88Å; L796-S799 PolarHBondContact O-N 3.19Å; L796-S799 PolarHBondContact O-OG 3.06Å; V797-S799 VanDerWaalsContact C-N 3.31Å; V797-S799 PolarHBondContact O-N 3.39Å; S799-L802 PolarHBondContact O-N 3.2Å; S799-C803 PolarHBondContact O-N 3.19Å; S799-C803 PolarHBondContact O-SG 3.44Å
800	L	95.3	Very high	92.1	Very high	111 Å²	111	98 Å²	98	58%	0.581	53%	0.528	S	S	*	.	H	α-helix	trans	-67.7	-44.2	176.5	-178.6	62.9	0	0	0	111.3	L796 V797 L798 L802 C803 L804	L796-L800 PolarHBondContact O-N 3.02Å; V797-L800 PolarHBondContact O-N 3.49Å; V797-L800 VanDerWaalsContact O-N 3.17Å; L798-L800 PolarHBondContact O-N 3.26Å; L800-L802 VanDerWaalsContact C-N 3.34Å; L800-L802 PolarHBondContact O-N 3.32Å; L800-C803 PolarHBondContact O-N 2.92Å; L800-L804 HydrophobicContact CG-CD1 4.46Å; L800-L804 WeakPolarHBondContact O-CG 3.33Å; L800-L804 PolarHBondContact O-N 3.38Å
801	V	95.6	Very high	92.3	Very high	72 Å²	72	98.2 Å²	98.2	44%	0.436	53%	0.529	S	S	.	.	H	α-helix	trans	-61.3	-42.6	175.1	173	0	0	0	0	111	V797 L798 C803 L804 L805	V797-V801 WeakPolarHBondContact O-CG2 3.3Å; V797-V801 PolarHBondContact O-N 3.26Å; L798-V801 PolarHBondContact O-N 3.44Å; V801-C803 PolarHBondContact O-N 3.43Å; V801-L804 PolarHBondContact O-N 3.23Å; V801-L805 HydrophobicContact CG1-CD1 4.07Å; V801-L805 HydrophobicContact CG1-CG 4.45Å; V801-L805 WeakPolarHBondContact O-CG 3.25Å; V801-L805 PolarHBondContact O-N 3.15Å
802	L	94.6	Very high	92.2	Very high	102 Å²	102	98.8 Å²	98.8	53%	0.534	53%	0.532	S	S	.	.	H	α-helix	trans	-61.5	-43.7	175.7	-176.8	62.4	0	0	0	112.1	L798 S799 L800 L804 L805 L806	L798-L802 WeakPolarHBondContact O-CB 3.49Å; L798-L802 PolarHBondContact O-N 2.85Å; S799-L802 PolarHBondContact O-N 3.2Å; L800-L802 VanDerWaalsContact C-N 3.34Å; L800-L802 PolarHBondContact O-N 3.32Å; L802-L804 VanDerWaalsContact C-N 3.35Å; L802-L804 PolarHBondContact O-N 2.88Å; L802-L805 PolarHBondContact O-N 2.71Å; L802-L806 HydrophobicContact CG-CD1 4.21Å; L802-L806 WeakPolarHBondContact O-CG 3.46Å; L802-L806 PolarHBondContact O-N 3.49Å
803	C	94.4	Very high	92	Very high	84 Å²	84	96.9 Å²	96.9	57%	0.568	53%	0.53	S	S	*	.	H	α-helix	trans	-61.1	-40.4	174.7	-74.6	0	0	0	0	112.6	S799 L800 V801 G807	S799-C803 PolarHBondContact O-N 3.19Å; S799-C803 PolarHBondContact O-SG 3.44Å; L800-C803 PolarHBondContact O-N 2.92Å; V801-C803 PolarHBondContact O-N 3.43Å; C803-G807 PolarHBondContact O-N 3.05Å
804	L	94.7	Very high	91.5	Very high	110 Å²	110	95 Å²	95	58%	0.576	53%	0.53	S	S	*	.	H	α-helix	trans	-65.5	-43.9	175.6	-70.6	170.3	0	0	0	111.8	L800 V801 L802 G807 V808	L800-L804 HydrophobicContact CG-CD1 4.46Å; L800-L804 WeakPolarHBondContact O-CG 3.33Å; L800-L804 PolarHBondContact O-N 3.38Å; V801-L804 PolarHBondContact O-N 3.23Å; L802-L804 VanDerWaalsContact C-N 3.35Å; L802-L804 PolarHBondContact O-N 2.88Å; L804-G807 PolarHBondContact O-N 2.91Å; L804-V808 WeakPolarHBondContact O-CG2 3.46Å; L804-V808 PolarHBondContact O-N 2.95Å
805	L	94.3	Very high	90.9	Very high	101 Å²	101	96 Å²	96	53%	0.529	54%	0.536	S	S	.	.	H	α-helix	trans	-61.4	-44	176.1	-71.5	170.2	0	0	0	111.8	V801 L802 V808 L809	V801-L805 HydrophobicContact CG1-CD1 4.07Å; V801-L805 HydrophobicContact CG1-CG 4.45Å; V801-L805 WeakPolarHBondContact O-CG 3.25Å; V801-L805 PolarHBondContact O-N 3.15Å; L802-L805 PolarHBondContact O-N 2.71Å; L805-V808 PolarHBondContact O-N 2.88Å; L805-L809 WeakPolarHBondContact O-CB 3.34Å; L805-L809 VanDerWaalsContact O-CG 3.32Å; L805-L809 WeakPolarHBondContact O-CG 3.35Å; L805-L809 PolarHBondContact O-N 3Å
806	L	94.3	Very high	90.1	Very high	92 Å²	92	98.9 Å²	98.9	48%	0.482	55%	0.546	S	S	.	.	H	α-helix	trans	-62.6	-41.1	174.5	-70.9	169.6	0	0	0	111.8	L802 L809 L810	L802-L806 HydrophobicContact CG-CD1 4.21Å; L802-L806 WeakPolarHBondContact O-CG 3.46Å; L802-L806 PolarHBondContact O-N 3.49Å; L806-L809 PolarHBondContact O-N 2.89Å; L806-L810 WeakPolarHBondContact O-CB 3.44Å; L806-L810 VanDerWaalsContact O-CG 3.31Å; L806-L810 WeakPolarHBondContact O-CG 3.46Å; L806-L810 PolarHBondContact O-N 3.34Å
807	G	93.3	Very high	88.3	Confident	39 Å²	39	98 Å²	98	40%	0.402	55%	0.549	S	S	.	.	H	α-helix	trans	-61.5	-41.8	174.2	0	0	0	0	0	113.3	C803 L804 C811	C803-G807 PolarHBondContact O-N 3.05Å; L804-G807 PolarHBondContact O-N 2.91Å; G807-C811 WeakPolarHBondContact O-CB 3.32Å; G807-C811 PolarHBondContact O-N 3Å
808	V	93.2	Very high	86.5	Confident	83 Å²	83	97.5 Å²	97.5	50%	0.503	55%	0.55	S	S	.	*	H	α-helix	trans	-66.5	-43.3	175.1	171	0	0	0	0	111.3	L804 L805 C811 L812	L804-V808 WeakPolarHBondContact O-CG2 3.46Å; L804-V808 PolarHBondContact O-N 2.95Å; L805-V808 PolarHBondContact O-N 2.88Å; V808-C811 WeakPolarHBondContact O-CB 3.5Å; V808-C811 PolarHBondContact O-N 3.32Å; V808-L812 HydrophobicContact CG1-CD1 3.95Å; V808-L812 HydrophobicContact CG1-CG 4.38Å; V808-L812 WeakPolarHBondContact O-CB 3.42Å; V808-L812 VanDerWaalsContact O-CG 3.32Å; V808-L812 WeakPolarHBondContact O-CG 3.44Å; V808-L812 PolarHBondContact O-N 2.78Å
809	L	90.8	Very high	84.2	Confident	107 Å²	107	97.8 Å²	97.8	56%	0.56	56%	0.561	S	S	*	*	H	α-helix	trans	-62.1	-44	176.7	-73.1	170.2	0	0	0	111.9	L805 L806 L812 Q813	L805-L809 WeakPolarHBondContact O-CB 3.34Å; L805-L809 VanDerWaalsContact O-CG 3.32Å; L805-L809 WeakPolarHBondContact O-CG 3.35Å; L805-L809 PolarHBondContact O-N 3Å; L806-L809 PolarHBondContact O-N 2.89Å; L809-L812 PolarHBondContact O-N 2.9Å; L809-Q813 WeakPolarHBondContact O-CB 3.36Å; L809-Q813 PolarHBondContact O-N 2.68Å
810	L	91.4	Very high	82.2	Confident	106 Å²	106	100.7 Å²	100.7	56%	0.555	58%	0.579	S	S	*	*	H	α-helix	trans	-62.1	-43.7	173.9	-72.9	169.9	0	0	0	111.6	L806 Q813 C814	L806-L810 WeakPolarHBondContact O-CB 3.44Å; L806-L810 VanDerWaalsContact O-CG 3.31Å; L806-L810 WeakPolarHBondContact O-CG 3.46Å; L806-L810 PolarHBondContact O-N 3.34Å; L810-Q813 PolarHBondContact O-N 2.94Å; L810-C814 WeakPolarHBondContact O-CB 3.3Å; L810-C814 PolarHBondContact O-N 2.88Å; L810-C814 PolarHBondContact O-SG 3.12Å; L810-C814 VanDerWaalsContact O-SG 3.33Å
811	C	88.3	Confident	79.4	Confident	76 Å²	76	105.1 Å²	105.1	51%	0.514	59%	0.593	S	S	.	*	H	α-helix	trans	-59.1	-48.2	175.6	-174.2	0	0	0	0	111.8	G807 V808 Q813 C814 C815	G807-C811 WeakPolarHBondContact O-CB 3.32Å; G807-C811 PolarHBondContact O-N 3Å; V808-C811 WeakPolarHBondContact O-CB 3.5Å; V808-C811 PolarHBondContact O-N 3.32Å; C811-Q813 VanDerWaalsContact C-N 3.32Å; C811-Q813 PolarHBondContact O-N 2.8Å; C811-C814 WeakPolarHBondContact O-CB 3.14Å; C811-C814 PolarHBondContact O-N 3.25Å; C811-C815 PolarHBondContact O-N 3.1Å; C811-C815 PolarHBondContact O-SG 3.28Å; C811-C815 VanDerWaalsContact O-SG 3.33Å
812	L	87.6	Confident	77.2	Confident	96 Å²	96	108 Å²	108	50%	0.503	61%	0.613	S	S	.	*	H	α-helix	trans	-62.1	-37.9	175.8	-70.2	171.2	0	0	0	112.1	V808 L809 C815 R816	V808-L812 HydrophobicContact CG1-CD1 3.95Å; V808-L812 HydrophobicContact CG1-CG 4.38Å; V808-L812 WeakPolarHBondContact O-CB 3.42Å; V808-L812 VanDerWaalsContact O-CG 3.32Å; V808-L812 WeakPolarHBondContact O-CG 3.44Å; V808-L812 PolarHBondContact O-N 2.78Å; L809-L812 PolarHBondContact O-N 2.9Å; L812-C815 PolarHBondContact O-N 3.42Å; L812-R816 WeakPolarHBondContact O-CB 3.45Å; L812-R816 VanDerWaalsContact O-CG 3.27Å; L812-R816 WeakPolarHBondContact O-CG 3.49Å; L812-R816 PolarHBondContact O-N 3.1Å
813	Q	85	Confident	74.7	Confident	133 Å²	133	113.1 Å²	113.1	62%	0.621	63%	0.632	S	S	*	*	H	α-helix	trans	-69.3	-39	177	-166.2	170.2	12.2	0	0	111.9	L809 L810 C811 R816 S817	L809-Q813 WeakPolarHBondContact O-CB 3.36Å; L809-Q813 PolarHBondContact O-N 2.68Å; L810-Q813 PolarHBondContact O-N 2.94Å; C811-Q813 VanDerWaalsContact C-N 3.32Å; C811-Q813 PolarHBondContact O-N 2.8Å; Q813-R816 PolarHBondContact O-N 3.41Å; Q813-S817 PolarHBondContact O-N 2.87Å
814	C	76.5	Confident	72	Confident	86 Å²	86	114 Å²	114	58%	0.581	65%	0.645	S	S	*	*	H	α-helix	trans	-60.2	-50.2	170.2	-72.3	0	0	0	0	111.3	L810 C811 R816 S817	L810-C814 WeakPolarHBondContact O-CB 3.3Å; L810-C814 PolarHBondContact O-N 2.88Å; L810-C814 PolarHBondContact O-SG 3.12Å; L810-C814 VanDerWaalsContact O-SG 3.33Å; C811-C814 WeakPolarHBondContact O-CB 3.14Å; C811-C814 PolarHBondContact O-N 3.25Å; C814-R816 PolarHBondContact O-N 2.88Å; C814-S817 WeakPolarHBondContact O-CB 3.34Å; C814-S817 PolarHBondContact O-N 3.45Å; C814-S817 VanDerWaalsContact O-N 3.11Å; C814-S817 PolarHBondContact O-OG 3.18Å
815	C	76.4	Confident	69.2	Low	79 Å²	79	115.4 Å²	115.4	53%	0.534	65%	0.653	S	S	.	*	H	α-helix	trans	-57.1	-46.3	176.5	-69.4	0	0	0	0	112.1	C811 L812 S817 S818	C811-C815 PolarHBondContact O-N 3.1Å; C811-C815 PolarHBondContact O-SG 3.28Å; C811-C815 VanDerWaalsContact O-SG 3.33Å; L812-C815 PolarHBondContact O-N 3.42Å; C815-S817 PolarHBondContact O-N 2.78Å; C815-S818 PolarHBondContact O-N 3.48Å; C815-S818 PolarHBondContact O-OG 3.38Å
816	R	73.9	Confident	66.2	Low	225 Å²	225	119.4 Å²	119.4	85%	0.849	67%	0.666	S	S	*	*	H	α-helix	trans	-69.1	-14.1	178.3	-71.7	-179.6	71.3	151.9	4.1	114.6	L812 Q813 C814 S818	L812-R816 WeakPolarHBondContact O-CB 3.45Å; L812-R816 VanDerWaalsContact O-CG 3.27Å; L812-R816 WeakPolarHBondContact O-CG 3.49Å; L812-R816 PolarHBondContact O-N 3.1Å; Q813-R816 PolarHBondContact O-N 3.41Å; C814-R816 PolarHBondContact O-N 2.88Å; R816-S818 PolarHBondContact O-N 2.85Å
817	S	55.7	Low	63.3	Low	99 Å²	99	121.1 Å²	121.1	69%	0.692	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-3.7	173.9	75.7	0	0	0	0	113.8	Q813 C814 C815	Q813-S817 PolarHBondContact O-N 2.87Å; C814-S817 WeakPolarHBondContact O-CB 3.34Å; C814-S817 PolarHBondContact O-N 3.45Å; C814-S817 VanDerWaalsContact O-N 3.11Å; C814-S817 PolarHBondContact O-OG 3.18Å; C815-S817 PolarHBondContact O-N 2.78Å
818	S	55.9	Low	61.2	Low	81 Å²	81	124 Å²	124	57%	0.566	69%	0.692	S	S	*	*			trans	-98.1	123.6	-177.1	70.4	0	0	0	0	113.8	C815 R816	C815-S818 PolarHBondContact O-N 3.48Å; C815-S818 PolarHBondContact O-OG 3.38Å; R816-S818 PolarHBondContact O-N 2.85Å
819	S	45.2	Very low	58.1	Low	114 Å²	114	127.6 Å²	127.6	80%	0.797	71%	0.708	S	S	*	*			trans	72.9	162.1	174.1	92.6	0	0	0	0	115.7
820	P	49.8	Very low	55.8	Low	119 Å²	119	127.4 Å²	127.4	77%	0.773	71%	0.713	S	S	*	*			cis	-115.1	175.3	10.5	41.5	-31.7	0	0	0	116
821	K	36.4	Very low	53	Low	204 Å²	204	131.8 Å²	131.8	89%	0.887	73%	0.728	S	S	*	*			trans	-142.9	136	167.4	-79	-172.7	176.6	-179.8	0	111.4
822	P	49.5	Very low	50.1	Low	132 Å²	132	134 Å²	134	86%	0.857	74%	0.744	S	S	*	*			trans	-89.9	177.5	169.7	36.2	-34.3	0	0	0	113.1
823	K	42.2	Very low	47.4	Very low	210 Å²	210	135.9 Å²	135.9	91%	0.913	75%	0.754	S	S	*	*			trans	-114.3	140.6	178.7	-61.9	177.1	179.8	176.4	0	112.1
824	A	37.5	Very low	45	Very low	102 Å²	102	138.3 Å²	138.3	84%	0.843	77%	0.765	S	S	*	*			trans	-161.2	157.5	157.8	0	0	0	0	0	110.5
825	N	36.1	Very low	42.9	Very low	140 Å²	140	144.5 Å²	144.5	75%	0.749	78%	0.778	S	S	*	*			trans	-117.1	154.5	-159.5	-61.4	-29.1	0	0	0	116.4
826	F	31.8	Very low	41	Very low	184 Å²	184	145.9 Å²	145.9	81%	0.807	79%	0.786	S	S	*	*			trans	72.3	140.3	145.5	-75.2	-56.9	0	0	0	124.9
827	T	32	Very low	38.9	Very low	128 Å²	128	140.6 Å²	140.6	79%	0.785	78%	0.783	S	S	*	*			trans	85	151.2	144.8	37.5	0	0	0	0	120.5
828	P	49.3	Very low	38.4	Very low	100 Å²	100	141 Å²	141	65%	0.649	78%	0.784	S	S	*	*				-144.6	172.6	-103.8	42.7	-21.9	0	0	0	119.9
829	L	28.7	Very low	37.3	Very low	158 Å²	158	147.1 Å²	147.1	83%	0.827	80%	0.8	S	S	*	*			trans	66	167.3	156.8	-68	158.1	0	0	0	118.2
830	P	43.3	Very low	36.8	Very low	103 Å²	103	153 Å²	153	67%	0.669	81%	0.805	S	S	*	*			cis	-135	157.2	-47.2	37.3	-22.3	0	0	0	116.2
831	K	31.7	Very low	36	Very low	199 Å²	199	152 Å²	152	87%	0.865	80%	0.8	S	S	*	*			trans	47.6	117.6	148.7	-67.4	-179.7	177.8	178.6	0	121.3
832	S	28.7	Very low	35.7	Very low	122 Å²	122	152 Å²	152	85%	0.853	80%	0.8	S	S	*	*			trans	-140.7	161.3	130.9	-171	0	0	0	0	109.4
833	N	30.8	Very low	34.9	Very low	135 Å²	135	150.9 Å²	150.9	72%	0.722	80%	0.795	S	S	*	*			trans	-119.3	136.4	-172.7	-52.4	-76.8	0	0	0	111.8
834	H	34.3	Very low	34.6	Very low	184 Å²	184	146.3 Å²	146.3	85%	0.852	79%	0.79	S	S	*	*				-166.3	125.7	126.6	-113	-68.2	0	0	0	114
835	Y	31.5	Very low	34.4	Very low	216 Å²	216	152.1 Å²	152.1	85%	0.847	79%	0.792	S	S	*	*			trans	56.3	140.7	149.8	-128.6	-116.5	0	0	0	121.7
836	P	37.1	Very low	34.2	Very low	109 Å²	109	153.1 Å²	153.1	71%	0.708	80%	0.797	S	S	*	*			trans	-100.7	137	-160.4	37.3	-32.6	0	0	0	115.5
837	S	30.4	Very low	34.2	Very low	113 Å²	113	150.6 Å²	150.6	79%	0.79	79%	0.792	S	S	*	*			trans	-151.7	168.6	159.5	79.4	0	0	0	0	108.9
838	P	45.2	Very low	34.8	Very low	109 Å²	109	152.1 Å²	152.1	71%	0.708	79%	0.792	S	S	*	*				-118.6	140.4	-92.4	35.7	-25.1	0	0	0	114.4
839	K	32.3	Very low	34	Very low	208 Å²	208	152.4 Å²	152.4	90%	0.904	80%	0.797	S	S	*	*			trans	-179.7	128	152.4	-102	145.2	-170.7	172.1	0	112.7
840	R	34.5	Very low	34.2	Very low	238 Å²	238	151.4 Å²	151.4	90%	0.898	79%	0.791	S	S	*	*			trans	-154	96.1	144.7	-133.5	-179.7	-166.4	178.9	4.9	111.9
841	C	33.1	Very low	33.7	Very low	98 Å²	98	155.9 Å²	155.9	66%	0.662	80%	0.795	S	S	*	*			trans	48.8	136.2	146	-53.3	0	0	0	0	121.7
842	F	30.6	Very low	33.9	Very low	203 Å²	203	154.4 Å²	154.4	89%	0.89	78%	0.784	S	S	*	*			trans	67.2	150.5	169.7	-50.8	-75.2	0	0	0	116.3
843	S	32.3	Very low	34.3	Very low	109 Å²	109	158.7 Å²	158.7	76%	0.762	78%	0.781	S	S	*	*			cis	166.4	161.8	-22.7	-171	0	0	0	0	104.6
844	S	36.2	Very low	34.3	Very low	114 Å²	114	158.2 Å²	158.2	80%	0.797	78%	0.783	S	S	*	*			trans	72.6	119.2	-172.4	-150.7	0	0	0	0	113.6
845	Y	31.7	Very low	34.1	Very low	224 Å²	224	153.2 Å²	153.2	88%	0.878	77%	0.774	S	S	*	*			trans	-92.8	133.6	177.2	-126.7	-105.7	0	0	0	108.5
846	D	32.5	Very low	34.4	Very low	161 Å²	161	148 Å²	148	86%	0.861	77%	0.769	S	S	*	*			trans	-160.7	98.8	160.7	-111.3	-36.3	0	0	0	108.5
847	D	32	Very low	34.8	Very low	131 Å²	131	148.8 Å²	148.8	70%	0.701	77%	0.774	S	S	*	*			trans	-140.1	72.8	174.7	-161.8	22.4	0	0	0	112.5
848	M	43.8	Very low	34.8	Very low	161 Å²	161	151.1 Å²	151.1	79%	0.793	78%	0.776	S	S	*	*				26.3	104.8	121	-173.3	170.2	50.7	0	0	117.9
849	S	32.9	Very low	34.1	Very low	106 Å²	106	151.2 Å²	151.2	74%	0.741	78%	0.775	S	S	*	*			trans	-122.6	103.7	156.4	44.7	0	0	0	0	110.2
850	L	33.6	Very low	33.9	Very low	136 Å²	136	152.3 Å²	152.3	71%	0.712	77%	0.774	S	S	*	*				76.6	114	98.4	-69.5	165.5	0	0	0	112.7
851	R	32	Very low	33.9	Very low	198 Å²	198	145.9 Å²	145.9	75%	0.747	77%	0.765	S	S	*	*				61.1	136.4	78.8	-70.6	-165.5	-165.4	-93.7	16	111.9
852	R	36.3	Very low	33.8	Very low	167 Å²	167	149.6 Å²	149.6	63%	0.63	77%	0.77	S	S	*	*			cis	175.4	138	10.7	148	-153.4	-80.5	-176.1	-0	109.9
853	R	37.1	Very low	33.8	Very low	213 Å²	213	145 Å²	145	80%	0.804	76%	0.763	S	S	*	*			trans	65.4	166.8	160.4	-69.4	-177.7	-139.1	-106.7	11.8	116.3
854	V	30.8	Very low	33.7	Very low	124 Å²	124	147.1 Å²	147.1	75%	0.752	76%	0.759	S	S	*	*			cis	-164.7	152.9	-16.8	133.2	0	0	0	0	110.6
855	A	30.3	Very low	33.5	Very low	80 Å²	80	149.4 Å²	149.4	66%	0.661	76%	0.757	S	S	*	*			trans	59.5	120.9	156.8	0	0	0	0	0	123.3
856	S	36.8	Very low	33.3	Very low	107 Å²	107	145.9 Å²	145.9	75%	0.748	75%	0.752	S	S	*	*				14.2	147.9	121.1	60.7	0	0	0	0	120.4
857	P	45.8	Very low	33.2	Very low	125 Å²	125	144.1 Å²	144.1	81%	0.812	75%	0.753	S	S	*	*				-153.1	174.9	52.9	43.7	-23	0	0	0	121.5
858	L	31.3	Very low	33.2	Very low	161 Å²	161	142.8 Å²	142.8	84%	0.843	75%	0.754	S	S	*	*			trans	-40.1	155.3	162.1	-156.6	82.8	0	0	0	117.3
859	V	30.9	Very low	32.8	Very low	112 Å²	112	141.4 Å²	141.4	68%	0.679	75%	0.754	S	S	*	*			trans	140.5	121.5	135.2	166.4	0	0	0	0	117.2
860	R	27.8	Very low	32.9	Very low	231 Å²	231	144.2 Å²	144.2	87%	0.872	76%	0.756	S	S	*	*			trans	61.2	163.7	152.9	-82.6	174.6	137.4	80.6	-5.7	119.9
861	S	34.4	Very low	33.2	Very low	102 Å²	102	144.8 Å²	144.8	71%	0.713	76%	0.764	S	S	*	*			cis	-160.5	152	-11.3	38.4	0	0	0	0	115.3
862	K	31	Very low	33.1	Very low	176 Å²	176	138.4 Å²	138.4	77%	0.765	76%	0.761	S	S	*	*			trans	-22.6	142.4	156.8	-61.4	176.9	169.2	-173.7	0	120.8	F864	K862-F864 HydrophobicContact CB-CE2 4.42Å; K862-F864 HydrophobicContact CD-CE2 3.93Å; K862-F864 HydrophobicContact CD-CZ 4.27Å
863	S	29.8	Very low	33.6	Very low	107 Å²	107	135.7 Å²	135.7	75%	0.748	77%	0.765	S	S	*	*				-165.3	123	124.1	50.1	0	0	0	0	108.7
864	F	30	Very low	33.7	Very low	153 Å²	153	132.7 Å²	132.7	67%	0.671	77%	0.765	S	S	*	*				66.4	132.4	69.3	-68.2	-49.9	0	0	0	113.2	K862	K862-F864 HydrophobicContact CB-CE2 4.42Å; K862-F864 HydrophobicContact CD-CE2 3.93Å; K862-F864 HydrophobicContact CD-CZ 4.27Å
865	Q	32	Very low	33.8	Very low	163 Å²	163	134 Å²	134	76%	0.762	77%	0.767	S	S	*	*			cis	-149	141.8	9.4	-108.9	157.9	-32.8	0	0	110.7
866	L	29.2	Very low	34.1	Very low	149 Å²	149	136.9 Å²	136.9	78%	0.78	77%	0.771	S	S	*	*				58.1	132.3	100.9	-58.8	-174.2	0	0	0	116.5
867	S	29.1	Very low	33.9	Very low	125 Å²	125	140.5 Å²	140.5	87%	0.874	77%	0.774	S	S	*	*				-125.5	177.6	73.1	52.6	0	0	0	0	116.4
868	S	32.9	Very low	33.1	Very low	103 Å²	103	142.4 Å²	142.4	72%	0.72	78%	0.775	S	S	*	*			trans	-159.9	148.4	-169.8	179.9	0	0	0	0	113.9
869	T	34	Very low	33	Very low	131 Å²	131	140.7 Å²	140.7	80%	0.804	77%	0.771	S	S	*	*			trans	-161.6	97.3	161.1	-46.9	0	0	0	0	106.8
870	E	35.2	Very low	33.1	Very low	165 Å²	165	142.5 Å²	142.5	77%	0.771	77%	0.772	S	S	*	*				79.1	87.5	85.5	-159.8	163.2	-160.1	0	0	112.9
871	V	40.8	Very low	33.5	Very low	148 Å²	148	136.7 Å²	136.7	90%	0.897	76%	0.764	S	S	*	*				80.1	133.4	95.6	167.7	0	0	0	0	113.2
872	G	29.2	Very low	33.2	Very low	65 Å²	65	138.8 Å²	138.8	67%	0.67	77%	0.767	S	S	*	*			cis	-179.2	-159.1	0.1	0	0	0	0	0	108.7
873	P	47.4	Very low	33	Very low	110 Å²	110	140.4 Å²	140.4	71%	0.714	77%	0.768	S	S	*	*			cis	-131.7	166.8	-9.1	42.4	-26.6	0	0	0	115.5
874	D	38.3	Very low	32.9	Very low	150 Å²	150	144 Å²	144	80%	0.802	77%	0.77	S	S	*	*			trans	49.6	136	141.3	-55.2	5.4	0	0	0	122.7
875	D	33.6	Very low	32.9	Very low	150 Å²	150	141.5 Å²	141.5	80%	0.802	77%	0.772	S	S	*	*			cis	-163.7	163.4	-18.4	-146	-3.7	0	0	0	111.9
876	L	36.5	Very low	33.3	Very low	141 Å²	141	139.8 Å²	139.8	74%	0.738	78%	0.775	S	S	*	*			trans	-153.1	167.4	179.5	-98.3	178.6	0	0	0	115.2
877	F	33.2	Very low	33.3	Very low	184 Å²	184	139.3 Å²	139.3	81%	0.807	77%	0.769	S	S	*	*			trans	93.6	136	165.1	-63.3	-79.5	0	0	0	120.5
878	I	29.2	Very low	33.4	Very low	165 Å²	165	141 Å²	141	85%	0.846	76%	0.76	S	S	*	*			trans	-141.6	131.9	172.3	-63.5	175.4	0	0	0	107.8
879	V	29.5	Very low	33.3	Very low	124 Å²	124	144.8 Å²	144.8	75%	0.752	76%	0.764	S	S	*	*			trans	-147.6	116.4	176.2	176.2	0	0	0	0	111.9
880	E	31.5	Very low	33.1	Very low	150 Å²	150	147.5 Å²	147.5	70%	0.701	77%	0.765	S	S	*	*			trans	59.2	172.9	161	-96.7	-141.5	95.1	0	0	118.9	L882	E880-L882 WeakPolarHBondContact OE1-CD1 3.19Å; E880-L882 PolarHBondContact OE1-N 3.03Å; E880-L882 VanDerWaalsContact OE1-N 3.14Å
881	P	37.1	Very low	32.9	Very low	110 Å²	110	149 Å²	149	71%	0.714	77%	0.768	S	S	*	*			cis	-136.4	167.1	16.9	43.3	-25.5	0	0	0	120.3
882	L	28.1	Very low	32.3	Very low	146 Å²	146	153 Å²	153	76%	0.764	77%	0.768	S	S	*	*			trans	18	151.3	146.3	-78.6	132.9	0	0	0	124.9	E880	E880-L882 WeakPolarHBondContact OE1-CD1 3.19Å; E880-L882 PolarHBondContact OE1-N 3.03Å; E880-L882 VanDerWaalsContact OE1-N 3.14Å
883	R	27.5	Very low	32.2	Very low	210 Å²	210	153.5 Å²	153.5	79%	0.792	77%	0.773	S	S	*	*			trans	-77.5	158.1	172.9	-41.6	174.5	-172.8	170.5	0.5	113.7
884	F	26.3	Very low	31.4	Very low	181 Å²	181	158.1 Å²	158.1	79%	0.794	78%	0.781	S	S	*	*				166.5	134.7	108	-102.9	-75.1	0	0	0	116
885	S	31.7	Very low	31.1	Very low	101 Å²	101	158 Å²	158	71%	0.706	79%	0.786	S	S	*	*			trans	64.2	153	153.5	-142.9	0	0	0	0	119
886	P	40.1	Very low	31.1	Very low	128 Å²	128	160.6 Å²	160.6	83%	0.831	79%	0.79	S	S	*	*				-148.9	176.6	88.1	39.5	-21.5	0	0	0	116.6
887	E	28.5	Very low	30.7	Very low	138 Å²	138	159.2 Å²	159.2	65%	0.645	79%	0.792	S	S	*	*			trans	-98.3	147	177.1	-74.7	-162.2	95.5	0	0	115.8
888	K	30.5	Very low	30.6	Very low	160 Å²	160	158 Å²	158	70%	0.696	79%	0.794	S	S	*	*			trans	20.3	124	138.5	-47.2	163.7	-171.9	148.6	0	119.1
889	K	30.8	Very low	30.6	Very low	184 Å²	184	156.1 Å²	156.1	80%	0.8	79%	0.785	S	S	*	*				165.6	121.5	109.9	-88.3	153.9	-171.3	160.9	0	117.1
890	K	31.2	Very low	30.6	Very low	188 Å²	188	158.5 Å²	158.5	82%	0.817	79%	0.785	S	S	*	*			trans	64.5	150.1	130.7	-67.4	-171.6	171.9	-175.6	0	123.2
891	K	30.6	Very low	30.6	Very low	195 Å²	195	157 Å²	157	85%	0.848	79%	0.786	S	S	*	*			trans	81.7	150.1	157.8	-71	170.3	178.9	179.9	0	117.2
892	R	28.4	Very low	30.1	Very low	234 Å²	234	159.3 Å²	159.3	88%	0.883	79%	0.788	S	S	*	*			cis	-174.9	131.8	-17	169.6	-171.8	-173.8	-156.9	4.8	111.7
893	G	26.6	Very low	30.1	Very low	75 Å²	75	157 Å²	157	77%	0.773	78%	0.78	S	S	*	*			trans	87.8	136.6	163.1	0	0	0	0	0	115.1
894	K	30.7	Very low	30.2	Very low	206 Å²	206	154.1 Å²	154.1	90%	0.896	78%	0.779	S	S	*	*			cis	107.5	86.2	3.6	-161.7	-176.1	-173.6	178.9	0	117
895	T	31	Very low	30.2	Very low	147 Å²	147	152.8 Å²	152.8	90%	0.902	78%	0.777	S	S	*	*			trans	-166.3	165.5	150.7	21.9	0	0	0	0	111.1
896	K	34.3	Very low	30.2	Very low	205 Å²	205	153 Å²	153	89%	0.891	78%	0.777	S	S	*	*				-167.3	116.6	-74.9	-159.6	-168.3	-175.3	-159.3	0	112.1
897	S	28.1	Very low	29.5	Very low	112 Å²	112	156.9 Å²	156.9	78%	0.783	78%	0.781	S	S	*	*			trans	-171.6	116.9	158.9	46.8	0	0	0	0	108.3
898	L	30.9	Very low	29.2	Very low	160 Å²	160	157.6 Å²	157.6	84%	0.838	79%	0.789	S	S	*	*				73.8	122.5	83	-156.8	73.8	0	0	0	111.3
899	D	29	Very low	29.6	Very low	124 Å²	124	155.9 Å²	155.9	66%	0.663	79%	0.794	S	S	*	*			cis	-139.1	-165.4	18.3	-141.3	-42.9	0	0	0	114.5
900	K	30.4	Very low	29.3	Very low	174 Å²	174	152.9 Å²	152.9	76%	0.757	80%	0.796	S	S	*	*			trans	-50.9	156.5	-175.5	-68.1	156.4	179.3	176.6	0	117.3
901	V	30.4	Very low	29.3	Very low	118 Å²	118	151.5 Å²	151.5	72%	0.715	80%	0.797	S	S	*	*			cis	75.3	136.5	35.3	-176.6	0	0	0	0	111.5
902	E	27.5	Very low	29.6	Very low	160 Å²	160	148.2 Å²	148.2	75%	0.748	80%	0.796	S	S	*	*			cis	-129.6	-140.2	30.6	-159.3	56.6	-91	0	0	113.4
903	T	27.9	Very low	29.6	Very low	97 Å²	97	143.9 Å²	143.9	60%	0.595	79%	0.789	S	S	*	*			trans	-155.7	134.7	-132.3	-58.4	0	0	0	0	116.2
904	L	28.8	Very low	29.7	Very low	150 Å²	150	146.7 Å²	146.7	79%	0.785	79%	0.791	S	S	*	*			trans	78.5	128.5	156	-70.2	166.1	0	0	0	125.7
905	M	27.5	Very low	29.7	Very low	152 Å²	152	144 Å²	144	75%	0.749	79%	0.787	S	S	*	*			trans	79.1	172.7	131.2	-60.7	-66.4	-78.3	0	0	119.6
906	P	30.4	Very low	29.4	Very low	107 Å²	107	141.1 Å²	141.1	70%	0.695	79%	0.786	S	S	*	*				-120.5	-178	-118.9	20.8	7.5	0	0	0	114.3
907	F	25.2	Very low	29	Very low	209 Å²	209	138.4 Å²	138.4	92%	0.917	78%	0.781	S	S	*	*			trans	-122.5	131.5	-178.5	-82.9	-89.2	0	0	0	114.1
908	D	23.8	Very low	29.7	Very low	152 Å²	152	138 Å²	138	81%	0.813	78%	0.776	S	S	*	*			trans	-85.7	156.3	157.2	-86.4	-54.2	0	0	0	111
909	P	37.3	Very low	29.5	Very low	125 Å²	125	139.2 Å²	139.2	81%	0.812	78%	0.775	S	S	*	*			trans	-80.6	156.7	172	34.3	-34.7	0	0	0	112.4
910	S	25.1	Very low	29.3	Very low	121 Å²	121	140.1 Å²	140.1	85%	0.846	78%	0.779	S	S	*	*			trans	-132.7	154.4	177.6	53.2	0	0	0	0	113.5
911	L	30.6	Very low	28.9	Very low	159 Å²	159	137 Å²	137	83%	0.832	78%	0.779	S	S	*	*			trans	-96.9	158.9	-178.2	-67.8	162.8	0	0	0	112
912	P	38.4	Very low	28.9	Very low	126 Å²	126	140 Å²	140	82%	0.818	78%	0.784	S	S	*	*			trans	-94.4	155.2	156.2	35.2	-29.7	0	0	0	112.8
913	L	28.3	Very low	29.2	Very low	143 Å²	143	138.2 Å²	138.2	75%	0.749	79%	0.787	S	S	*	*			trans	-122.3	149.8	-175.1	-117.6	78.5	0	0	0	112.5
914	T	27.3	Very low	29.1	Very low	133 Å²	133	140.5 Å²	140.5	82%	0.816	80%	0.795	S	S	*	*			trans	-154.6	123.2	140.7	40.2	0	0	0	0	107.7
915	N	30.8	Very low	29.6	Very low	151 Å²	151	138.7 Å²	138.7	81%	0.807	79%	0.792	S	S	*	*				85.9	115.3	57	-79.3	-11.8	0	0	0	114.4
916	G	25.7	Very low	29.5	Very low	85 Å²	85	136.6 Å²	136.6	88%	0.876	79%	0.792	S	S	*	*			trans	164	96.1	170.6	0	0	0	0	0	114.8
917	D	25.6	Very low	29.4	Very low	148 Å²	148	135.9 Å²	135.9	79%	0.791	80%	0.795	S	S	*	*			trans	-150.2	144.3	177.6	-172.3	20.1	0	0	0	107.4
918	P	42	Very low	29.4	Very low	105 Å²	105	132.1 Å²	132.1	68%	0.682	79%	0.785	S	S	*	*				-160.4	143	96.3	38.5	-17	0	0	0	119.2
919	K	27.2	Very low	29.5	Very low	184 Å²	184	132.9 Å²	132.9	80%	0.8	78%	0.784	S	S	*	*			trans	67.1	161.5	139.6	-67.1	173.8	178.8	173.6	0	118.4
920	L	24.5	Very low	28.9	Very low	144 Å²	144	133 Å²	133	75%	0.754	78%	0.782	S	S	*	*			cis	-154.4	159.6	20.8	-163.5	76.7	0	0	0	113.6
921	S	23	Very low	28.8	Very low	107 Å²	107	132.2 Å²	132.2	75%	0.748	78%	0.776	S	S	*	*			trans	76.5	130	147.5	43.9	0	0	0	0	124
922	H	30.4	Very low	28.5	Very low	181 Å²	181	130 Å²	130	84%	0.838	77%	0.774	S	S	*	*			trans	-80.8	168.8	164.5	-88.1	-63	0	0	0	111.9
923	P	33.4	Very low	27.8	Very low	124 Å²	124	131 Å²	131	81%	0.805	77%	0.772	S	S	*	*				-153.3	-178.6	54.5	42.9	-20.1	0	0	0	120.4
924	L	26.3	Very low	28.2	Very low	145 Å²	145	129.8 Å²	129.8	76%	0.759	77%	0.772	S	S	*	*			trans	-76	173.8	165.9	-109.5	78	0	0	0	111.8
925	P	39.7	Very low	28	Very low	112 Å²	112	128.3 Å²	128.3	73%	0.727	76%	0.763	S	S	*	*			cis	-153.7	167.7	42.5	42.9	-20.7	0	0	0	121.7
926	S	25.2	Very low	27.7	Very low	108 Å²	108	127 Å²	127	76%	0.755	76%	0.761	S	S	*	*			trans	37.6	134.4	140.8	-50.5	0	0	0	0	125.5
927	A	27.1	Very low	27.6	Very low	91 Å²	91	129.4 Å²	129.4	75%	0.752	76%	0.758	S	S	*	*				147.5	129.9	107.3	0	0	0	0	0	117.6
928	D	25.6	Very low	27.5	Very low	131 Å²	131	127.1 Å²	127.1	70%	0.701	75%	0.754	S	S	*	*			trans	68.2	130.2	137.7	-78.5	36.3	0	0	0	128.1
929	Q	25.7	Very low	26.6	Very low	168 Å²	168	130.3 Å²	130.3	79%	0.785	76%	0.757	S	S	*	*			trans	65	146.1	139.7	-66.1	178.6	64.4	0	0	120.5
930	V	25	Very low	26.3	Very low	127 Å²	127	127.7 Å²	127.7	77%	0.77	75%	0.748	S	S	*	*			cis	164.9	128.7	-22.4	136.4	0	0	0	0	105.5
931	S	22.9	Very low	26.4	Very low	104 Å²	104	129.3 Å²	129.3	73%	0.727	75%	0.749	S	S	*	*			trans	157.7	139.8	136.5	63.3	0	0	0	0	117.2
932	S	24.1	Very low	27.1	Very low	113 Å²	113	129.6 Å²	129.6	79%	0.79	75%	0.748	S	S	*	*			trans	65.2	128.1	146.6	53.5	0	0	0	0	124.1
933	L	24.5	Very low	26.9	Very low	148 Å²	148	125.6 Å²	125.6	78%	0.775	74%	0.741	S	S	*	*			trans	-86.5	175	159.4	-135.6	72.8	0	0	0	110.2
934	P	36	Very low	26.6	Very low	117 Å²	117	127.7 Å²	127.7	76%	0.76	74%	0.74	S	S	*	*				-155.6	140.9	65.7	39	-16.2	0	0	0	120.3
935	T	23.1	Very low	26.6	Very low	101 Å²	101	127 Å²	127	62%	0.62	74%	0.742	S	S	*	*				41.6	110.9	115.2	-40	0	0	0	0	123.7
936	V	25	Very low	26	Very low	125 Å²	125	126.6 Å²	126.6	76%	0.758	74%	0.742	S	S	*	*			trans	69.6	146.5	137.6	-179.6	0	0	0	0	116.9
937	T	22.7	Very low	26.2	Very low	134 Å²	134	126 Å²	126	82%	0.822	74%	0.737	S	S	*	*			cis	-156.3	-168.6	49.7	-26.9	0	0	0	0	113.6
938	S	23.7	Very low	26.1	Very low	100 Å²	100	127.4 Å²	127.4	70%	0.699	74%	0.74	S	S	*	*			trans	-118.8	155.4	-172	50.5	0	0	0	0	115.3
939	K	23.3	Very low	26.1	Very low	173 Å²	173	126.2 Å²	126.2	75%	0.752	74%	0.742	S	S	*	*				162.7	133.5	123.9	-98.5	-169.9	163.3	-131.4	0	116.7
940	E	22.3	Very low	26.2	Very low	129 Å²	129	123 Å²	123	60%	0.603	74%	0.739	S	S	*	*			trans	48.7	121.8	134.2	-67.6	175	142.8	0	0	126.4
941	F	25.2	Very low	26.4	Very low	177 Å²	177	121.9 Å²	121.9	78%	0.776	74%	0.736	S	S	*	*			trans	56.6	173.3	139.9	-63.4	-60.4	0	0	0	121
942	P	39.3	Very low	26.7	Very low	113 Å²	113	122.2 Å²	122.2	73%	0.734	73%	0.734	S	S	*	*			cis	-104.1	-177.8	-5.6	7.7	18.8	0	0	0	113.9
943	S	25.4	Very low	26.9	Very low	98 Å²	98	125.1 Å²	125.1	69%	0.685	74%	0.735	S	S	*	*				71.1	145.9	50.9	-26.6	0	0	0	0	114.1
944	E	27.2	Very low	27	Very low	168 Å²	168	124 Å²	124	79%	0.785	74%	0.739	S	S	*	*			cis	-168.8	178.1	7.8	-148.3	172.1	-145.4	0	0	114.4
945	T	26.3	Very low	26.7	Very low	130 Å²	130	127 Å²	127	80%	0.798	74%	0.743	S	S	*	*			trans	73.2	161.8	165.6	76.5	0	0	0	0	118.1
946	S	27.7	Very low	26.9	Very low	104 Å²	104	130.3 Å²	130.3	73%	0.727	75%	0.751	S	S	*	*			cis	-153.2	170.1	12.3	81.2	0	0	0	0	110.7
947	S	28.6	Very low	27.1	Very low	94 Å²	94	128.9 Å²	128.9	66%	0.657	75%	0.747	S	S	*	*			cis	-174.5	140.9	-18.9	44.7	0	0	0	0	112.4
948	C	24.2	Very low	27.5	Very low	121 Å²	121	131.1 Å²	131.1	82%	0.818	74%	0.742	S	S	*	*			trans	65.7	157.9	151.1	-57.4	0	0	0	0	119.3
949	S	26.5	Very low	27.7	Very low	106 Å²	106	131.9 Å²	131.9	74%	0.741	74%	0.742	S	S	*	*			cis	-140.9	140.8	15.9	-59.4	0	0	0	0	114.9
950	S	28	Very low	28	Very low	102 Å²	102	128.6 Å²	128.6	71%	0.713	74%	0.741	S	S	*	*			trans	42.6	116.8	132.8	-40.8	0	0	0	0	120.4
951	S	28.6	Very low	28.5	Very low	103 Å²	103	134 Å²	134	72%	0.72	76%	0.756	S	S	*	*				92	142.2	90	72.3	0	0	0	0	113.8
952	T	29.6	Very low	28.8	Very low	111 Å²	111	133.5 Å²	133.5	68%	0.681	76%	0.76	S	S	*	*			cis	-168	156.8	-1.6	10.8	0	0	0	0	109.3
953	H	27.6	Very low	28.9	Very low	174 Å²	174	133.5 Å²	133.5	81%	0.806	76%	0.761	S	S	*	*			trans	38.9	133.3	158.5	-55.6	-68.5	0	0	0	121.8
954	S	27.8	Very low	29.5	Very low	124 Å²	124	134.7 Å²	134.7	87%	0.867	77%	0.766	S	S	*	*				-179.5	158.6	121.7	-77.6	0	0	0	0	111
955	E	28.7	Very low	30.2	Very low	181 Å²	181	132.3 Å²	132.3	85%	0.846	77%	0.765	S	S	*	*			trans	-106.1	162	-180	-63.4	-170.1	92.6	0	0	113.2
956	E	28	Very low	30.9	Very low	169 Å²	169	131.3 Å²	131.3	79%	0.79	76%	0.761	S	S	*	*			trans	57	135.6	149.6	78.5	164.4	130.6	0	0	125.1
957	S	29.8	Very low	31.7	Very low	96 Å²	96	132.7 Å²	132.7	67%	0.671	77%	0.767	S	S	*	*			trans	90.5	132.7	133.5	-72.5	0	0	0	0	123.7
958	Y	29.6	Very low	31.9	Very low	181 Å²	181	135.4 Å²	135.4	71%	0.71	77%	0.773	S	S	*	*			trans	92.8	83.3	146.9	-102	-108.4	0	0	0	124.5
959	T	28.9	Very low	32.4	Very low	115 Å²	115	134.9 Å²	134.9	71%	0.706	77%	0.769	S	S	*	*				82.7	146.5	127.2	61.2	0	0	0	0	124.6
960	S	28.1	Very low	33.3	Very low	105 Å²	105	136 Å²	136	73%	0.734	77%	0.774	S	S	*	*			trans	88.2	90.3	148.4	-157.5	0	0	0	0	120.1
961	R	33.3	Very low	33.6	Very low	243 Å²	243	136.3 Å²	136.3	92%	0.917	78%	0.776	S	S	*	*				-169.7	168.8	116.1	-101.1	165.9	-142.9	-96.6	1.1	113
962	L	33	Very low	34	Very low	165 Å²	165	136.6 Å²	136.6	86%	0.864	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-78.1	158.1	-178.1	-72.1	162.6	0	0	0	112.8
963	P	39.9	Very low	33.9	Very low	114 Å²	114	134.6 Å²	134.6	74%	0.74	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-86.2	151.2	-169.8	33.9	-36.9	0	0	0	115.2
964	P	38.9	Very low	34.3	Very low	123 Å²	123	134.9 Å²	134.9	80%	0.799	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-90.1	165.8	166.9	36.3	-33.6	0	0	0	113.4
965	P	41	Very low	34.4	Very low	117 Å²	117	135.3 Å²	135.3	76%	0.76	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-97.3	169.2	-168.6	38.6	-37.4	0	0	0	115.6
966	P	41.8	Very low	34.5	Very low	110 Å²	110	134.1 Å²	134.1	71%	0.714	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-71.9	159.3	169.4	31	-36.3	0	0	0	113.7
967	P	44.8	Very low	34.6	Very low	133 Å²	133	129.6 Å²	129.6	86%	0.864	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-80	169.3	-172.9	33.2	-37.3	0	0	0	115
968	I	32.7	Very low	34.6	Very low	151 Å²	151	134.7 Å²	134.7	77%	0.774	80%	0.803	S	S	*	*			trans	-142.8	141.9	-159.6	-92.9	173.2	0	0	0	113.1
969	C	33.4	Very low	34.5	Very low	109 Å²	109	129.1 Å²	129.1	74%	0.736	80%	0.8	S	S	*	*			trans	69	170.2	157.7	-88	0	0	0	0	119.2
970	P	46.7	Very low	34.5	Very low	129 Å²	129	131.9 Å²	131.9	84%	0.838	81%	0.81	S	S	*	*			cis	-122.5	-176.3	15.3	42.1	-27.3	0	0	0	117.5
971	S	33.5	Very low	34.4	Very low	109 Å²	109	132 Å²	132	76%	0.762	81%	0.81	S	S	*	*			trans	-154.6	152.2	-164.4	53.7	0	0	0	0	114.3
972	A	37	Very low	34.2	Very low	109 Å²	109	129.8 Å²	129.8	90%	0.901	81%	0.808	S	S	*	*			trans	-170.8	147.2	159.6	0	0	0	0	0	109.4
973	G	28.3	Very low	34.7	Very low	70 Å²	70	127.1 Å²	127.1	72%	0.722	80%	0.8	S	S	*	*			cis	-177.1	156.5	-8.5	0	0	0	0	0	113.8
974	M	34.7	Very low	34.1	Very low	179 Å²	179	128.7 Å²	128.7	88%	0.882	80%	0.802	S	S	*	*			trans	37.9	124.1	155.3	-56.5	-177.1	72.3	0	0	122.6
975	C	29.5	Very low	33.7	Very low	133 Å²	133	129.4 Å²	129.4	90%	0.899	80%	0.804	S	S	*	*				-160.2	165.9	121.6	-136.5	0	0	0	0	112.4
976	N	32.7	Very low	33	Very low	157 Å²	157	132.6 Å²	132.6	84%	0.84	81%	0.809	S	S	*	*			trans	-105.7	159.8	-169	-67.1	-31.6	0	0	0	114.5
977	G	29.2	Very low	33.4	Very low	74 Å²	74	132.1 Å²	132.1	76%	0.763	81%	0.806	S	S	*	*			trans	-169.9	131.6	167.3	0	0	0	0	0	115
978	H	30.1	Very low	33.3	Very low	203 Å²	203	132.1 Å²	132.1	94%	0.94	81%	0.806	S	S	*	*			trans	-74.4	167	174.4	-60.5	-106.2	0	0	0	111.4
979	G	26.9	Very low	33.2	Very low	63 Å²	63	129.2 Å²	129.2	65%	0.649	80%	0.804	S	S	*	*			cis	155.2	179.9	1.1	0	0	0	0	0	110.9
980	L	28.5	Very low	33	Very low	174 Å²	174	133.4 Å²	133.4	91%	0.911	81%	0.81	S	S	*	*			trans	71.1	152.8	178.8	-46.8	174.2	0	0	0	116.2
981	S	26.9	Very low	32.2	Very low	106 Å²	106	132.6 Å²	132.6	74%	0.741	81%	0.808	S	S	*	*			cis	-165.1	144.3	-34.9	50.4	0	0	0	0	111.4
982	F	28.9	Very low	32.2	Very low	198 Å²	198	137.5 Å²	137.5	87%	0.868	81%	0.809	S	S	*	*			trans	-67.6	173.5	170.9	-80.2	-78.7	0	0	0	112.7
983	P	43	Very low	31.9	Very low	108 Å²	108	138.4 Å²	138.4	70%	0.701	80%	0.795	S	S	*	*			cis	-154.5	176.7	34.5	44.9	-22.7	0	0	0	121.6
984	L	28.2	Very low	32	Very low	148 Å²	148	141 Å²	141	78%	0.775	79%	0.788	S	S	*	*			trans	33.4	137.7	146.3	-85.4	63.1	0	0	0	121.4
985	T	28.8	Very low	31.9	Very low	137 Å²	137	141 Å²	141	84%	0.84	78%	0.783	S	S	*	*				-164.4	171.7	80	22.8	0	0	0	0	114
986	Q	28.2	Very low	32	Very low	185 Å²	185	146.1 Å²	146.1	86%	0.864	78%	0.784	S	S	*	*			trans	-143.1	-177.2	-179.7	-136.2	-165.7	54.8	0	0	111.3
987	P	48.8	Very low	32	Very low	100 Å²	100	143.7 Å²	143.7	65%	0.649	78%	0.779	S	S	*	*				-95	-177.5	-120.5	43.2	-32.3	0	0	0	115.3
988	P	43.2	Very low	32	Very low	133 Å²	133	147.9 Å²	147.9	86%	0.864	78%	0.783	S	S	*	*				-139.6	-175.1	102.5	38.4	-25.2	0	0	0	114.2
989	A	29.5	Very low	32.4	Very low	90 Å²	90	147.8 Å²	147.8	74%	0.744	78%	0.78	S	S	*	*			trans	-133.6	162.9	-163.1	0	0	0	0	0	115.5
990	K	29.4	Very low	32.5	Very low	196 Å²	196	155.4 Å²	155.4	85%	0.852	79%	0.789	S	S	*	*			trans	177.9	142.4	135.1	-99.3	160.6	-175	179.9	0	113.8
991	S	31.8	Very low	32.7	Very low	113 Å²	113	158 Å²	158	79%	0.79	79%	0.787	S	S	*	*			trans	42.5	137.6	153.9	62.1	0	0	0	0	120.3
992	R	31.5	Very low	32.8	Very low	212 Å²	212	163.4 Å²	163.4	80%	0.8	80%	0.797	S	S	*	*				-174	153.3	53.4	-175.1	176.4	171.3	168.7	-1.2	111.6
993	Q	30.8	Very low	32.8	Very low	127 Å²	127	158.7 Å²	158.7	59%	0.593	79%	0.789	S	S	*	*			trans	40.2	112.4	160.8	-76.1	178.9	-98.1	0	0	122.1
994	E	30.9	Very low	32.4	Very low	126 Å²	126	164.9 Å²	164.9	59%	0.589	80%	0.798	S	S	*	*				90.8	121.2	111.1	-159.3	166.8	175.4	0	0	122
995	K	32.9	Very low	32.4	Very low	177 Å²	177	166.5 Å²	166.5	77%	0.77	80%	0.802	S	S	*	*			trans	50.4	99.4	156	-68.1	166.6	-173	153.6	0	119.5
996	R	31.9	Very low	32.4	Very low	241 Å²	241	166 Å²	166	91%	0.909	80%	0.798	S	S	*	*			trans	-151.3	134.4	130.2	-117.6	177.2	-173.1	-173.2	2	112.1
997	S	31.9	Very low	32.3	Very low	106 Å²	106	166.4 Å²	166.4	74%	0.741	80%	0.8	S	S	*	*			trans	49.3	140.2	160.2	62.4	0	0	0	0	120.7
998	L	29.2	Very low	31.3	Very low	162 Å²	162	169.4 Å²	169.4	85%	0.848	81%	0.81	S	S	*	*				-164.6	139.3	109.8	-108.3	168.2	0	0	0	115
999	K	38.4	Very low	30.4	Very low	201 Å²	201	171 Å²	171	87%	0.874	81%	0.806	S	S	*	*			trans	-75.6	123	170	-176.6	176.4	-174.7	172.4	0	109.2
1000	R	30.2	Very low	30.2	Very low	223 Å²	223	176.4 Å²	176.4	84%	0.842	81%	0.813	S	S	*	*			trans	-137.6	104.1	171.8	-161.7	179.6	174.6	175.3	-1	109.4
1001	R	32.1	Very low	30.3	Very low	229 Å²	229	172.2 Å²	172.2	86%	0.864	81%	0.806	S	S	*	*				51.8	101.5	89	-82.5	-175.8	166.4	179.3	-3.7	113.3
1002	K	29.9	Very low	30.3	Very low	220 Å²	220	173 Å²	173	96%	0.957	81%	0.808	S	S	*	*			trans	-91.6	129	160.1	-161	172.1	-174.3	177.3	0	107.6
1003	S	27.1	Very low	30.3	Very low	99 Å²	99	169.6 Å²	169.6	69%	0.692	81%	0.81	S	S	*	*			trans	-131	143.7	-173.7	50.8	0	0	0	0	111.4
1004	R	36.5	Very low	30.7	Very low	238 Å²	238	168.6 Å²	168.6	90%	0.898	82%	0.815	S	S	*	*			trans	-77.9	136.5	174.3	-81	-177.5	166.4	-163.3	-2.8	112
1005	Q	27.6	Very low	30.6	Very low	182 Å²	182	166.3 Å²	166.3	85%	0.85	83%	0.825	S	S	*	*			trans	-152.3	136	141.8	-101.9	165.4	-36.8	0	0	103.8
1006	T	28.2	Very low	30.4	Very low	125 Å²	125	162 Å²	162	77%	0.767	83%	0.832	S	S	*	*			cis	68.7	96.3	39.8	-49.8	0	0	0	0	111.3
1007	E	26.4	Very low	30.3	Very low	195 Å²	195	153.7 Å²	153.7	91%	0.911	82%	0.821	S	S	*	*			trans	-120.5	156.7	170.2	-172	157.4	-155.1	0	0	109.4
1008	L	28	Very low	30.3	Very low	163 Å²	163	155 Å²	155	85%	0.853	82%	0.824	S	S	*	*			trans	-118.7	169.4	-167.1	-96.2	165.3	0	0	0	112.9
1009	Q	24.3	Very low	30.3	Very low	167 Å²	167	154.8 Å²	154.8	78%	0.78	82%	0.824	S	S	*	*			trans	-106.5	132.5	-161.1	173.6	-171.6	19.2	0	0	113.1
1010	F	24.9	Very low	30.1	Very low	202 Å²	202	151 Å²	151	89%	0.886	82%	0.823	S	S	*	*			trans	-160.7	160.4	161.5	-71.2	-67.1	0	0	0	110
1011	P	32	Very low	30.3	Very low	109 Å²	109	148.6 Å²	148.6	71%	0.708	83%	0.825	S	S	*	*			cis	-125.3	164.3	-48.9	38.6	-25.9	0	0	0	112
1012	P	32.5	Very low	30.7	Very low	128 Å²	128	142.5 Å²	142.5	83%	0.831	82%	0.816	S	S	*	*			trans	-89.2	153.5	-177	34.9	-35.3	0	0	0	114.9
1013	V	31.5	Very low	31	Very low	141 Å²	141	136.5 Å²	136.5	86%	0.855	80%	0.802	S	S	*	*			trans	-131.6	140	165	176.9	0	0	0	0	107.3
1014	P	37.5	Very low	31.5	Very low	106 Å²	106	138.8 Å²	138.8	69%	0.688	81%	0.805	S	S	*	*			trans	-106	161.9	-154.1	39.4	-35.9	0	0	0	116
1015	G	29.1	Very low	31.9	Very low	78 Å²	78	136 Å²	136	80%	0.804	80%	0.802	S	S	*	*			trans	140.3	107.3	149.3	0	0	0	0	0	116.7
1016	G	28.2	Very low	32.5	Very low	88 Å²	88	135.1 Å²	135.1	91%	0.907	80%	0.798	S	S	*	*			trans	80.7	144.6	168.7	0	0	0	0	0	115.5
1017	G	30.2	Very low	33.2	Very low	66 Å²	66	136.2 Å²	136.2	68%	0.68	80%	0.799	S	S	*	*			cis	164.4	158.7	-6.2	0	0	0	0	0	112.1
1018	V	31.6	Very low	33.8	Very low	134 Å²	134	135.5 Å²	135.5	81%	0.812	80%	0.797	S	S	*	*			trans	63.5	121.7	173.8	-59.3	0	0	0	0	119.9
1019	D	30.7	Very low	34.7	Very low	156 Å²	156	137.4 Å²	137.4	83%	0.834	80%	0.799	S	S	*	*			trans	67.5	107.8	134.7	-52.4	-8.2	0	0	0	121.3
1020	S	32.7	Very low	35.1	Very low	123 Å²	123	132.1 Å²	132.1	86%	0.86	79%	0.79	S	S	*	*			trans	-91.1	132.5	165.3	52.6	0	0	0	0	111.7
1021	L	35.8	Very low	35.4	Very low	171 Å²	171	130.8 Å²	130.8	90%	0.895	79%	0.792	S	S	*	*			trans	-109.7	149.4	162.7	-83.9	168.6	0	0	0	110.2
1022	P	39.4	Very low	35.5	Very low	101 Å²	101	134.2 Å²	134.2	66%	0.656	80%	0.795	S	S	*	*			trans	-80.4	160.9	-162.9	31.6	-36.7	0	0	0	114.7
1023	S	37.8	Very low	35.6	Very low	95 Å²	95	134.8 Å²	134.8	66%	0.664	79%	0.787	S	S	*	*			trans	-65.7	149.7	174	-178.6	0	0	0	0	112.7	Q1025 Q1026	S1023-Q1025 PolarHBondContact O-N 2.86Å; S1023-Q1026 PolarHBondContact O-N 3.09Å
1024	L	37.2	Very low	35.6	Very low	146 Å²	146	136.5 Å²	136.5	76%	0.764	79%	0.788	S	S	*	*	G	3₁₀ helix	trans	-53.8	-19.1	-175.8	-166.2	67.4	0	0	0	115	Q1026	L1024-Q1026 PolarHBondContact O-N 3.3Å; L1024-Q1026 VanDerWaalsContact O-N 3.16Å
1025	Q	43.9	Very low	35.2	Very low	179 Å²	179	136.2 Å²	136.2	84%	0.836	79%	0.788	S	S	*	*	G	3₁₀ helix	trans	-70.8	-7.4	-173.2	-158.7	167.5	9.9	0	0	114.8	S1023	S1023-Q1025 PolarHBondContact O-N 2.86Å
1026	Q	41.5	Very low	35.3	Very low	164 Å²	164	139.2 Å²	139.2	77%	0.766	79%	0.791	S	S	*	*	G	3₁₀ helix	trans	-104.6	-6	-176.1	-156	159	-0.5	0	0	114.6	S1023 L1024	S1023-Q1026 PolarHBondContact O-N 3.09Å; L1024-Q1026 PolarHBondContact O-N 3.3Å; L1024-Q1026 VanDerWaalsContact O-N 3.16Å
1027	L	42	Very low	35.3	Very low	149 Å²	149	138.7 Å²	138.7	78%	0.78	79%	0.785	S	S	*	*	S	Bend	trans	-85.9	-21.5	-177.6	-163.5	66.7	0	0	0	114
1028	M	39.2	Very low	35.5	Very low	179 Å²	179	141.8 Å²	141.8	88%	0.882	79%	0.791	S	S	*	*	S	Bend	trans	-96.9	19	-171.1	-64.8	-173.8	70.4	0	0	115
1029	K	46.4	Very low	35.4	Very low	203 Å²	203	143.3 Å²	143.3	88%	0.883	79%	0.793	S	S	*	*	S	Bend	trans	-140.2	26	-173.4	-144.1	-172.8	178.5	-175.9	0	116.3
1030	G	33.3	Very low	35.2	Very low	57 Å²	57	146.6 Å²	146.6	59%	0.588	79%	0.794	S	S	*	*			trans	-156.8	105.1	175.1	0	0	0	0	0	113.1
1031	N	31.9	Very low	35.1	Very low	174 Å²	174	147 Å²	147	93%	0.93	79%	0.79	S	S	*	*				178.9	122.5	123.2	-90.3	-9.4	0	0	0	110.6
1032	K	33.3	Very low	34.7	Very low	181 Å²	181	145.1 Å²	145.1	79%	0.787	79%	0.786	S	S	*	*			trans	-142.6	130.7	159.3	-137	179.1	176.6	-105	0	108.2
1033	E	34.5	Very low	34.2	Very low	140 Å²	140	144.7 Å²	144.7	65%	0.654	79%	0.791	S	S	*	*			trans	82.2	144.4	156.8	-73	154	-134.5	0	0	123
1034	M	31.4	Very low	33.7	Very low	177 Å²	177	146.2 Å²	146.2	87%	0.872	80%	0.796	S	S	*	*			trans	78.5	135.2	161	-65.5	149	60.2	0	0	121.1
1035	S	29.1	Very low	33.3	Very low	99 Å²	99	145.8 Å²	145.8	69%	0.692	80%	0.8	S	S	*	*			cis	-169.4	155.9	-22.4	73.7	0	0	0	0	113.6
1036	V	32	Very low	32.6	Very low	142 Å²	142	140.4 Å²	140.4	86%	0.861	79%	0.792	S	S	*	*			trans	71.4	132.3	150.4	173.4	0	0	0	0	120.8
1037	G	27.2	Very low	32	Very low	76 Å²	76	141.7 Å²	141.7	78%	0.784	80%	0.798	S	S	*	*			trans	177.3	101.1	162.9	0	0	0	0	0	113.5
1038	T	34.4	Very low	31.6	Very low	131 Å²	131	142.9 Å²	142.9	80%	0.804	81%	0.811	S	S	*	*			trans	-112.6	146.2	-171.6	-49.2	0	0	0	0	113
1039	I	30.3	Very low	31.2	Very low	167 Å²	167	141.1 Å²	141.1	86%	0.856	81%	0.807	S	S	*	*			trans	-157.1	149.4	157.5	-105.5	145.8	0	0	0	113.9
1040	R	26.9	Very low	30.4	Very low	225 Å²	225	137.8 Å²	137.8	85%	0.849	80%	0.803	S	S	*	*			trans	-23.8	144.2	177.7	-69.6	173.6	-179.3	172	-0.3	119.4
1041	V	29.5	Very low	30.3	Very low	131 Å²	131	142.3 Å²	142.3	79%	0.794	82%	0.815	S	S	*	*			cis	97.5	108.1	38.8	166.8	0	0	0	0	114.9
1042	T	27.7	Very low	30.2	Very low	131 Å²	131	140.4 Å²	140.4	80%	0.804	81%	0.809	S	S	*	*			trans	175.9	128.6	140	32.7	0	0	0	0	107.6
1043	A	27.8	Very low	30	Very low	92 Å²	92	137.9 Å²	137.9	76%	0.76	81%	0.81	S	S	*	*				72	133.4	63.9	0	0	0	0	0	112.8
1044	V	28.3	Very low	29.7	Very low	127 Å²	127	137.7 Å²	137.7	77%	0.77	82%	0.82	S	S	*	*			cis	-164.8	163.9	-0	87.3	0	0	0	0	112.5
1045	T	29.3	Very low	29.6	Very low	138 Å²	138	134.9 Å²	134.9	85%	0.847	82%	0.817	S	S	*	*			trans	59	135.9	165.3	50.5	0	0	0	0	122
1046	G	29.3	Very low	29.6	Very low	66 Å²	66	137.7 Å²	137.7	68%	0.68	83%	0.826	S	S	*	*			trans	167	111.7	157.1	0	0	0	0	0	113.9
1047	H	28.2	Very low	29.4	Very low	191 Å²	191	137.3 Å²	137.3	88%	0.884	82%	0.823	S	S	*	*			trans	-67.6	156.9	155	-78.7	-60	0	0	0	108.7
1048	V	34	Very low	29.6	Very low	173 Å²	173	142.9 Å²	142.9	100%	1.048	83%	0.827	S	S	*	*			cis	-105.2	0	15.4	176.9	0	0	0	0	112.2	R323	R323-V1048 PolarHBondContact NH1-O 3.21Å

Retrieved 1,048 of 1,048 residues in 178 ms (Link to these results)

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