A0A087X5K8_POEFO Loading...

CAP-Gly domain containing linker protein 2

AlphaFold DB , UniProt , Accession A0A087X5K8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,006 aa.

						>A0A087X5K8_POEFO|A0A087X5K8
MNMLKSSGLKIPGRGAKHSSPVGRSSVGGTSSPVTTKDSTPPKAVTPAKISEEGDDVVGDYTVGEQVWVNGVKPGVISYLGETQFAPGQWAGVILNDLVGKNDGSVGGVRYFECQPLQGIFTRPSKLTRQPVGEGSDSHSTDSAQNQTQQGGSGAPAGQRVVVPLREGLLNSAVKTGNESGSNMSDSGSVKKGGDKDLRVGDRVLVGGSKMGVIRYMGETDFAKGEWCGVELDEPLGKNDGAVAGTRYFQCLPKFGLFAPIHKVIRIGFPSTSPAKAKKSKRVAMGVSSLAHSPSSSSISSVSSVASSVGGRPSRAGLLTETSSRYARKISGTTALQEALKEKQQHIEQLLAERDLERAEVAKATSHICEVEKELNVLRAQHVQYVTENESSLQQVQTMLASTQKDKLELANQLEEEKRKVEDLQFRVEEESITKGDLEGRRSHVAESLRLSNRTKQTTVEEQSRIMQLEEELALRRAEIKDLQGQLRRVDASSQQEAPGTDAPPETVLLREQLLTVGREHHKESSELKEKYETALAASQQEVESLRTVVKKQSAEIGEMKQKVQQATKENMEMMDSWKTKFDMLVTDHQRSLEELKASLNRSQSAPQGQEQDAQELRTTLESLKMEHQLEVENLKAKHKIEAAILIKEREDLCNRLQEARDQLNEGRSDMEAQSTKAALSEASQKLQRAEARLAEMEVLRVERDKTTTELRDRLELSEKKMTDYQALQKAQAESQEEIQKLEEKLRVTANQLQAVQADHFKPHDANMIEDNEISDEKKKLKQNIEETMEKLMKREKEVFTLSSQVEALKTQIGALESKVRSGEKKLEAVAKEKMRVEAELEAMTKKSHDASGQLVSISQELLKKERSLNELRVLLLESHRHSRDVEKDLSREVHKAEWKVKEQKLQDDIKTLREKLLLLGRERSSPDHRRYSMLDPSALDSEVNRLRQRLLNTEDALRNALEHNQQVDKLVQAMRRHPDKSQVLGANSANGIHHQESDSTQEEQH
					

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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	33.3	Very low	37.5	Very low	240 Å²	240	161.3 Å²	161.3	100%	1.182	87%	0.871	S	S	*	*				0	113.7	0	-70.7	170.2	172.5	0	0	106.8
2	N	33.3	Very low	37.5	Very low	151 Å²	151	158 Å²	158	81%	0.807	87%	0.865	S	S	*	*			trans	-103.2	138	178.4	-69.3	15.6	0	0	0	109	L4	N2-L4 PolarHBondContact O-N 3.36Å
3	M	35.5	Very low	37.1	Very low	181 Å²	181	151 Å²	151	89%	0.892	85%	0.851	S	S	*	*			trans	-76.2	112.9	174.9	-70.9	-160.1	-69.1	0	0	110.2
4	L	39.9	Very low	37.5	Very low	161 Å²	161	158.8 Å²	158.8	84%	0.843	86%	0.86	S	S	*	*			trans	-74.1	126.7	165.6	-75.7	85.1	0	0	0	109.6	N2	N2-L4 PolarHBondContact O-N 3.36Å
5	K	40	Very low	37.2	Very low	198 Å²	198	153.1 Å²	153.1	86%	0.861	85%	0.854	S	S	*	*			trans	-129.7	94.4	155.1	-77.2	-171.8	176.5	-179.6	0	108.1	S7	K5-S7 PolarHBondContact O-N 3.01Å
6	S	38.8	Very low	37.2	Very low	112 Å²	112	149.6 Å²	149.6	78%	0.783	85%	0.85	S	S	*	*			trans	-76.6	104.8	179.2	50.8	0	0	0	0	110.8	G8	S6-G8 PolarHBondContact O-N 3.01Å; S6-G8 VanDerWaalsContact O-N 3.12Å
7	S	40.3	Very low	37	Very low	125 Å²	125	152.8 Å²	152.8	87%	0.874	85%	0.853	S	S	*	*			trans	-68.1	101.3	162.4	-177.9	0	0	0	0	108.6	K5 L9	K5-S7 PolarHBondContact O-N 3.01Å; S7-L9 PolarHBondContact O-N 3.34Å
8	G	45	Very low	36.8	Very low	71 Å²	71	154.8 Å²	154.8	73%	0.732	85%	0.854	S	S	*	*			trans	-87.9	106.7	-171.3	0	0	0	0	0	113.4	S6	S6-G8 PolarHBondContact O-N 3.01Å; S6-G8 VanDerWaalsContact O-N 3.12Å
9	L	35.3	Very low	36.6	Very low	180 Å²	180	152.3 Å²	152.3	94%	0.942	85%	0.848	S	S	*	*			trans	-148.5	149.2	154.1	-105.4	165.1	0	0	0	109.4	S7	S7-L9 PolarHBondContact O-N 3.34Å
10	K	31	Very low	36.5	Very low	198 Å²	198	150.2 Å²	150.2	86%	0.861	84%	0.844	S	S	*	*			trans	-108.9	144.3	-160.7	-158.9	174.1	-176.7	179.9	0	112.1	P12	K10-P12 WeakPolarHBondContact O-CD 3.34Å
11	I	40.2	Very low	37.2	Very low	157 Å²	157	148.4 Å²	148.4	81%	0.805	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-64.4	132.5	-174.8	-56.6	165.7	0	0	0	112.4
12	P	38	Very low	37.1	Very low	122 Å²	122	144.1 Å²	144.1	79%	0.792	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-99.8	129.6	150.2	33.5	-24.3	0	0	0	110.6	K10	K10-P12 WeakPolarHBondContact O-CD 3.34Å
13	G	32.3	Very low	37.1	Very low	67 Å²	67	140.4 Å²	140.4	69%	0.691	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-97.2	160	-176.4	0	0	0	0	0	114.9
14	R	42.7	Very low	37	Very low	260 Å²	260	143.5 Å²	143.5	98%	0.981	83%	0.825	S	S	*	*			trans	33.6	116.2	163.2	-71.7	-171.3	172.6	-146.6	-1.6	118.7
15	G	31.9	Very low	36.5	Very low	74 Å²	74	141.9 Å²	141.9	76%	0.763	83%	0.827	S	S	*	*			trans	-174	107.6	157.1	0	0	0	0	0	113.2
16	A	38.4	Very low	36.2	Very low	96 Å²	96	137.6 Å²	137.6	79%	0.793	82%	0.822	S	S	*	*			trans	-76.7	144.6	166.8	0	0	0	0	0	109.8
17	K	32.9	Very low	35.9	Very low	205 Å²	205	139.8 Å²	139.8	89%	0.891	83%	0.83	S	S	*	*			trans	-124.4	116.8	177.7	-71.6	-173.9	176.4	-178.6	0	110.8
18	H	34	Very low	35.5	Very low	188 Å²	188	137.4 Å²	137.4	87%	0.87	83%	0.825	S	S	*	*			trans	-80.5	162.9	163.9	-59.8	-91.9	0	0	0	109.7
19	S	32.3	Very low	34.9	Very low	108 Å²	108	137.4 Å²	137.4	76%	0.755	83%	0.825	S	S	*	*			trans	-129.1	154	-173.4	59.1	0	0	0	0	113.8
20	S	34.6	Very low	34.7	Very low	110 Å²	110	135.8 Å²	135.8	77%	0.769	82%	0.823	S	S	*	*			trans	88.3	151.2	160.5	-44	0	0	0	0	117.6
21	P	51.4	Low	34.7	Very low	113 Å²	113	132.2 Å²	132.2	73%	0.734	82%	0.823	S	S	*	*			cis	-134.7	-172.5	-21.7	29.5	-7.1	0	0	0	114.5
22	V	32.5	Very low	34.4	Very low	150 Å²	150	129.6 Å²	129.6	91%	0.909	82%	0.819	S	S	*	*			trans	76.9	134.8	168.8	-167.1	0	0	0	0	115.2
23	G	31.9	Very low	34.3	Very low	72 Å²	72	130.1 Å²	130.1	74%	0.742	82%	0.822	S	S	*	*			cis	-159.8	-174.2	4.7	0	0	0	0	0	115.3
24	R	33.2	Very low	34.2	Very low	247 Å²	247	133.3 Å²	133.3	93%	0.932	83%	0.828	S	S	*	*			trans	-64.9	150.3	-162.5	-68.4	173.2	165.8	-179.4	-5.6	118.1
25	S	30.3	Very low	33.7	Very low	126 Å²	126	127.3 Å²	127.3	88%	0.881	82%	0.82	S	S	*	*				-143.6	165.9	123.1	66.2	0	0	0	0	109.5
26	S	33.3	Very low	33.5	Very low	108 Å²	108	129.9 Å²	129.9	76%	0.755	82%	0.821	S	S	*	*			trans	-147.7	118.2	-157.2	57.6	0	0	0	0	117.7
27	V	33.2	Very low	33.1	Very low	158 Å²	158	134.2 Å²	134.2	96%	0.958	82%	0.822	S	S	*	*			trans	-152.2	145.2	156.2	-176.9	0	0	0	0	105.8
28	G	30.9	Very low	32.8	Very low	75 Å²	75	130.8 Å²	130.8	77%	0.773	81%	0.814	S	S	*	*			cis	-160.6	-143.6	-1.3	0	0	0	0	0	108.9
29	G	31.8	Very low	32.4	Very low	71 Å²	71	126.1 Å²	126.1	73%	0.732	80%	0.802	S	S	*	*			trans	-167.3	155.7	174.2	0	0	0	0	0	118.1
30	T	32.2	Very low	32.3	Very low	147 Å²	147	127.6 Å²	127.6	90%	0.902	81%	0.807	S	S	*	*			trans	53.5	122.9	156.2	57.8	0	0	0	0	121.9
31	S	31	Very low	33.2	Very low	123 Å²	123	127.8 Å²	127.8	86%	0.86	81%	0.806	S	S	*	*				-165.6	155.4	120.2	53.1	0	0	0	0	112.3
32	S	34.6	Very low	32.3	Very low	102 Å²	102	128.6 Å²	128.6	71%	0.713	81%	0.811	S	S	*	*			trans	-83.9	-177.2	-179.7	-41.3	0	0	0	0	112.9
33	P	35.7	Very low	32	Very low	133 Å²	133	131.1 Å²	131.1	86%	0.864	81%	0.81	S	S	*	*				-122.9	163.5	123.1	35.7	-32.5	0	0	0	113.9
34	V	28.8	Very low	32	Very low	134 Å²	134	132.4 Å²	132.4	81%	0.812	81%	0.813	S	S	*	*			trans	-113	159	-174.7	169.6	0	0	0	0	110.5
35	T	33.3	Very low	31.6	Very low	133 Å²	133	127 Å²	127	82%	0.816	81%	0.807	S	S	*	*			trans	-97.6	139.9	-179.8	47.5	0	0	0	0	114.5
36	T	27.9	Very low	31.9	Very low	128 Å²	128	127.3 Å²	127.3	79%	0.785	80%	0.804	S	S	*	*			trans	-143.9	115.2	160	50.3	0	0	0	0	106.7
37	K	29.2	Very low	31.9	Very low	187 Å²	187	127.4 Å²	127.4	81%	0.813	80%	0.802	S	S	*	*				57.6	135.6	93.7	-71.5	-168.1	172.4	-164.9	0	113.8
38	D	27.6	Very low	31.7	Very low	134 Å²	134	123.9 Å²	123.9	72%	0.717	79%	0.79	S	S	*	*			cis	-155.7	-172.3	21.6	-138.5	-47.3	0	0	0	114.1
39	S	25.2	Very low	31.4	Very low	90 Å²	90	130.6 Å²	130.6	63%	0.629	80%	0.798	S	S	*	*			trans	88.7	89.4	158.3	71.6	0	0	0	0	122.5
40	T	30.1	Very low	31.3	Very low	139 Å²	139	134.5 Å²	134.5	85%	0.853	80%	0.8	S	S	*	*			trans	62.9	153.7	130	44.7	0	0	0	0	124
41	P	52.5	Low	31	Very low	114 Å²	114	132.4 Å²	132.4	74%	0.74	79%	0.791	S	S	*	*			trans	-110.6	173.2	-165.9	42.9	-35.7	0	0	0	115.9
42	P	34	Very low	30.8	Very low	130 Å²	130	134.8 Å²	134.8	84%	0.844	79%	0.789	S	S	*	*			trans	-135.9	175.7	132.7	38.3	-26.8	0	0	0	114.8
43	K	24.7	Very low	30.5	Very low	203 Å²	203	139 Å²	139	88%	0.883	80%	0.797	S	S	*	*			trans	-97.2	153.8	-177.7	-73	178.2	175.1	177.1	0	113.9
44	A	32.4	Very low	30	Very low	98 Å²	98	136.5 Å²	136.5	81%	0.81	80%	0.796	S	S	*	*			trans	6.3	131.5	150.4	0	0	0	0	0	121.1
45	V	24.8	Very low	30.2	Very low	133 Å²	133	137.7 Å²	137.7	81%	0.806	80%	0.798	S	S	*	*			trans	-140.4	126.9	145.9	174.4	0	0	0	0	109.7
46	T	35.9	Very low	30.6	Very low	134 Å²	134	137 Å²	137	82%	0.822	79%	0.789	S	S	*	*			trans	-110.8	141.3	149.7	46.3	0	0	0	0	107.5
47	P	34.3	Very low	30.9	Very low	109 Å²	109	136.6 Å²	136.6	71%	0.708	79%	0.786	S	S	*	*				-138.2	140.5	102.6	25.7	-6.9	0	0	0	111.8
48	A	28	Very low	31.5	Very low	85 Å²	85	134 Å²	134	70%	0.702	79%	0.786	S	S	*	*				67.5	116	63.2	0	0	0	0	0	114.1
49	K	25.3	Very low	32.7	Very low	216 Å²	216	129.6 Å²	129.6	94%	0.939	77%	0.772	S	S	*	*			trans	-145.7	149	150.9	-133	179.4	-175.6	-174.9	0	109.5
50	I	30.3	Very low	34.8	Very low	152 Å²	152	128.8 Å²	128.8	78%	0.779	76%	0.76	S	S	*	*			trans	-137.1	137.5	-159.9	-57.5	162.5	0	0	0	109.1
51	S	25.8	Very low	37.5	Very low	103 Å²	103	124 Å²	124	72%	0.72	73%	0.727	S	S	*	*			trans	-154.2	115.1	161.9	-52.3	0	0	0	0	105
52	E	26.7	Very low	39.2	Very low	173 Å²	173	121.8 Å²	121.8	81%	0.808	71%	0.712	S	S	*	*				61.5	127.4	88.4	-68	176.1	161.3	0	0	113.1
53	E	28.9	Very low	41.8	Very low	191 Å²	191	119.9 Å²	119.9	89%	0.893	70%	0.697	S	S	*	*			cis	-166.7	140.9	-20.4	-138	174.3	-151.6	0	0	107.5
54	G	25.1	Very low	44.8	Very low	81 Å²	81	113 Å²	113	84%	0.835	68%	0.684	S	S	*	*			trans	153.1	153.1	176.2	0	0	0	0	0	116.8
55	D	33	Very low	47.6	Very low	159 Å²	159	109.6 Å²	109.6	85%	0.85	65%	0.651	S	S	*	*			trans	-75.6	166.8	-172.2	-116.3	-35.2	0	0	0	115.8
56	D	40.5	Very low	50.9	Low	119 Å²	119	108.2 Å²	108.2	64%	0.636	64%	0.636	S	S	*	*			trans	54.7	100.6	164.6	-83.9	-48.1	0	0	0	119.9	V163	D56-V163 WeakPolarHBondContact OD2-CG2 3.45Å
57	V	33.8	Very low	53.7	Low	118 Å²	118	101.9 Å²	101.9	72%	0.715	60%	0.597	S	S	*	*				-169.6	124	125.1	139.1	0	0	0	0	110
58	V	43.3	Very low	56.6	Low	134 Å²	134	99.1 Å²	99.1	81%	0.812	57%	0.573	S	S	*	*			trans	-83.1	113.9	163.3	177.9	0	0	0	0	107.2
59	G	52.8	Low	59.6	Low	41 Å²	41	95.2 Å²	95.2	42%	0.423	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-56.7	144.1	-156.2	0	0	0	0	0	116.7	Y61	G59-Y61 PolarHBondContact O-N 3Å
60	D	69.5	Low	62.6	Low	73 Å²	73	89.8 Å²	89.8	39%	0.39	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-54.9	122.7	173.8	-84.8	-29.3	0	0	0	111.6	R129 Q159	D60-R129 PolarHBondContact O-NH2 3.18Å; D60-Q159 WeakPolarHBondContact OD1-CA 3.3Å; D60-Q159 WeakPolarHBondContact OD1-CG 3.5Å; D60-Q159 PolarHBondContact OD1-N 3.27Å; D60-Q159 WeakPolarHBondContact OD2-CG 3.5Å
61	Y	85.2	Confident	65.2	Low	37 Å²	37	82.7 Å²	82.7	15%	0.145	49%	0.485	C	S	.	.	P	Polyproline II helix	trans	-85.4	147.8	163.4	-75.3	-69.9	0	0	0	109.6	G59 E65 V67 I77 L80 P124 L127 T128 R129	G59-Y61 PolarHBondContact O-N 3Å; Y61-E65 VanDerWaalsContact CD1-OE1 3.23Å; Y61-E65 WeakPolarHBondContact CD1-OE1 3.29Å; Y61-V67 HydrophobicContact CD1-CG1 3.8Å; Y61-V67 HydrophobicContact CE1-CG1 3.65Å; Y61-I77 HydrophobicContact CD1-CD1 3.87Å; Y61-I77 HydrophobicContact CG-CD1 4.01Å; Y61-L80 WeakPolarHBondContact O-CD1 3.38Å; Y61-P124 HydrophobicContact CD2-CB 4.21Å; Y61-P124 WeakPolarHBondContact CE2-O 3.42Å; Y61-L127 HydrophobicContact CD1-CD1 4.4Å; Y61-L127 HydrophobicContact CD2-CB 4.48Å; Y61-L127 HydrophobicContact CD2-CD1 4.33Å; Y61-L127 HydrophobicContact CE1-CB 4.05Å; Y61-L127 HydrophobicContact CE2-CB 3.89Å; Y61-L127 HydrophobicContact CG-CD1 4.26Å; Y61-L127 PolarHBondContact OH-O 2.98Å; Y61-T128 PolarHBondContact OH-N 3.11Å; Y61-R129 HydrophobicContact CE1-CG 3.97Å
62	T	88.3	Confident	68.2	Low	69 Å²	69	81.1 Å²	81.1	42%	0.423	47%	0.471	S	S	.	.			trans	-122.2	150.6	179.8	54.8	0	0	0	0	112.4	G64 E65	T62-G64 PolarHBondContact O-N 2.93Å; T62-E65 PolarHBondContact N-OE2 2.89Å; T62-E65 WeakPolarHBondContact O-CB 3.44Å; T62-E65 PolarHBondContact O-N 3.37Å; T62-E65 VanDerWaalsContact O-N 3.16Å; T62-E65 PolarHBondContact OG1-OE2 2.84Å
63	V	89.4	Confident	71.3	Confident	89 Å²	89	76.9 Å²	76.9	54%	0.539	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	128.3	174.1	176.9	0	0	0	0	108.9	I77 S78 L80	V63-I77 HydrophobicContact CG2-CG2 4.37Å; V63-S78 WeakPolarHBondContact CG1-O 3.41Å; V63-L80 HydrophobicContact CG2-CB 4.06Å; V63-L80 HydrophobicContact CG2-CD1 4.26Å; V63-L80 HydrophobicContact CG2-CG 4.37Å
64	G	88.2	Confident	74.4	Confident	58 Å²	58	69.1 Å²	69.1	60%	0.598	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.4	-5.5	-168.1	0	0	0	0	0	114.1	T62 I77	T62-G64 PolarHBondContact O-N 2.93Å; G64-I77 PolarHBondContact N-O 3.26Å
65	E	91.3	Very high	77.7	Confident	28 Å²	28	65.2 Å²	65.2	13%	0.131	38%	0.376	C	S	.	.			trans	-84.8	141.2	-178.3	-160.6	-172.3	113.4	0	0	112.9	Y61 T62 V76 I77 R129	Y61-E65 VanDerWaalsContact CD1-OE1 3.23Å; Y61-E65 WeakPolarHBondContact CD1-OE1 3.29Å; T62-E65 PolarHBondContact N-OE2 2.89Å; T62-E65 WeakPolarHBondContact O-CB 3.44Å; T62-E65 PolarHBondContact O-N 3.37Å; T62-E65 VanDerWaalsContact O-N 3.16Å; T62-E65 PolarHBondContact OG1-OE2 2.84Å; E65-V76 CarbonylContact O-C 3.56Å; E65-V76 WeakPolarHBondContact O-CA 3.03Å; E65-I77 HydrophobicContact CB-CD1 4.4Å; E65-I77 PolarHBondContact O-N 3.37Å; E65-R129 VanDerWaalsContact CD-NH2 3.28Å; E65-R129 IonicContact OE1-CZ 3.57Å; E65-R129 IonicContact OE1-NE 3.07Å; E65-R129 PolarHBondContact OE1-NE 3.16Å; E65-R129 IonicContact OE1-NH1 2.89Å; E65-R129 PolarHBondContact OE1-NH1 2.78Å; E65-R129 IonicContact OE1-NH2 3.94Å; E65-R129 PolarHBondContact OE1-NH2 3.28Å; E65-R129 VanDerWaalsContact OE1-NH2 3.07Å; E65-R129 IonicContact OE2-CZ 2.94Å; E65-R129 VanDerWaalsContact OE2-CZ 3.27Å; E65-R129 IonicContact OE2-NH1 3.27Å; E65-R129 PolarHBondContact OE2-NH1 3.48Å; E65-R129 IonicContact OE2-NH2 2.88Å; E65-R129 PolarHBondContact OE2-NH2 3.01Å
66	Q	93.4	Very high	80.7	Confident	104 Å²	104	60 Å²	60	49%	0.486	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	130	178.1	-168.6	171.1	-4.5	0	0	111.9	G75 V76	Q66-G75 CarbonylContact C-O 3.53Å; Q66-G75 WeakPolarHBondContact CA-O 3.42Å; Q66-V76 HydrophobicContact CB-CG2 4.33Å; Q66-V76 HydrophobicContact CG-CG2 4.32Å
67	V	94.6	Very high	83.3	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	163.6	-168.6	-67.3	0	0	0	0	112	Y61 P74 G75 I77 V93 L127 T128	Y61-V67 HydrophobicContact CD1-CG1 3.8Å; Y61-V67 HydrophobicContact CE1-CG1 3.65Å; V67-P74 CarbonylContact O-C 3.57Å; V67-P74 WeakPolarHBondContact O-CA 3.49Å; V67-G75 PolarHBondContact N-O 3.45Å; V67-G75 PolarHBondContact O-N 3.47Å; V67-G75 VanDerWaalsContact O-O 3.07Å; V67-I77 HydrophobicContact CG1-CD1 3.94Å; V67-I77 HydrophobicContact CG1-CG1 4.22Å; V67-I77 HydrophobicContact CG2-CD1 4.2Å; V67-I77 HydrophobicContact CG2-CG1 3.66Å; V67-V93 HydrophobicContact CG2-CG1 4.18Å; V67-V93 HydrophobicContact CG2-CG2 4.42Å; V67-L127 HydrophobicContact CB-CB 4.35Å; V67-L127 HydrophobicContact CG2-CD1 4.19Å; V67-L127 HydrophobicContact CG2-CD2 3.98Å; V67-L127 HydrophobicContact CG2-CG 4.48Å; V67-T128 CarbonylContact C-O 3.38Å; V67-T128 WeakPolarHBondContact CA-O 3.14Å
68	W	95	Very high	86.2	Confident	52 Å²	52	50.7 Å²	50.7	20%	0.197	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	117.9	172.1	-74	-103	0	0	0	110.9	G71 K73 P74 T128 R129 P131	W68-G71 PolarHBondContact O-N 2.84Å; W68-K73 CarbonylContact C-O 3.59Å; W68-K73 WeakPolarHBondContact CA-O 3.44Å; W68-P74 HydrophobicContact CZ2-CB 4.41Å; W68-T128 WeakPolarHBondContact CB-OG1 3.39Å; W68-T128 PolarHBondContact N-O 3.16Å; W68-T128 PolarHBondContact O-N 2.95Å; W68-T128 PolarHBondContact O-OG1 3.02Å; W68-R129 WeakPolarHBondContact CZ3-O 3.2Å; W68-P131 HydrophobicContact CD2-CB 4.37Å; W68-P131 HydrophobicContact CG-CB 4.28Å; W68-P131 HydrophobicContact CZ2-CG 4.31Å
69	V	91.8	Very high	88.6	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.012	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	123.5	174.6	-176.6	0	0	0	0	108.9	G71 V72 K73 V93 L95 I120 T122 L127	V69-G71 PolarHBondContact O-N 3.25Å; V69-V72 PolarHBondContact O-N 2.95Å; V69-K73 HydrophobicContact CB-CB 4.32Å; V69-K73 PolarHBondContact N-O 3.35Å; V69-K73 PolarHBondContact O-N 3.02Å; V69-K73 VanDerWaalsContact O-N 3.16Å; V69-V93 HydrophobicContact CG2-CB 4.2Å; V69-V93 HydrophobicContact CG2-CG1 4.08Å; V69-V93 HydrophobicContact CG2-CG2 4.21Å; V69-L95 HydrophobicContact CB-CD2 4.41Å; V69-L95 HydrophobicContact CG2-CD2 3.79Å; V69-I120 HydrophobicContact CG1-CD1 4.5Å; V69-I120 HydrophobicContact CG2-CG2 4.15Å; V69-T122 HydrophobicContact CG1-CG2 4.23Å; V69-L127 HydrophobicContact CB-CD2 4.45Å; V69-L127 HydrophobicContact CG2-CD2 3.75Å
70	N	87.3	Confident	90.6	Very high	102 Å²	102	46.9 Å²	46.9	55%	0.545	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	25.7	-171.5	-58.4	-46.5	0	0	0	114.1	V72 K126	N70-V72 PolarHBondContact O-N 2.79Å; N70-K126 PolarHBondContact N-O 2.77Å
71	G	85.3	Confident	91.6	Very high	3 Å²	3	44 Å²	44	3%	0.031	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.9	-10.9	-179.8	0	0	0	0	0	115.9	W68 V69 T128 P131 V132	W68-G71 PolarHBondContact O-N 2.84Å; V69-G71 PolarHBondContact O-N 3.25Å; G71-T128 WeakPolarHBondContact CA-OG1 3.42Å; G71-P131 CarbonylContact O-C 3.57Å; G71-P131 WeakPolarHBondContact O-CA 3.28Å; G71-V132 PolarHBondContact O-N 3.16Å
72	V	87.9	Confident	91.9	Very high	70 Å²	70	48.7 Å²	48.7	42%	0.424	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.3	-36.5	-173.2	-70.9	0	0	0	0	114.6	V69 N70 P74 E134	V69-V72 PolarHBondContact O-N 2.95Å; N70-V72 PolarHBondContact O-N 2.79Å; V72-P74 VanDerWaalsContact O-CD 3.3Å; V72-P74 WeakPolarHBondContact O-CD 3.45Å; V72-E134 HydrophobicContact CG1-CG 4.35Å
73	K	91.8	Very high	92.1	Very high	84 Å²	84	45.9 Å²	45.9	37%	0.365	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	107.1	-173.8	-76.8	-178.8	167.9	-170.9	0	112.2	W68 V69 L95 V99	W68-K73 CarbonylContact C-O 3.59Å; W68-K73 WeakPolarHBondContact CA-O 3.44Å; V69-K73 HydrophobicContact CB-CB 4.32Å; V69-K73 PolarHBondContact N-O 3.35Å; V69-K73 PolarHBondContact O-N 3.02Å; V69-K73 VanDerWaalsContact O-N 3.16Å; K73-L95 HydrophobicContact CB-CD1 4.4Å; K73-L95 HydrophobicContact CB-CD2 4.1Å; K73-L95 HydrophobicContact CD-CD1 4.11Å; K73-V99 HydrophobicContact CD-CG2 3.86Å; K73-V99 HydrophobicContact CG-CG2 4.35Å; K73-V99 PolarHBondContact NZ-O 2.66Å
74	P	94.6	Very high	92.1	Very high	28 Å²	28	49.2 Å²	49.2	18%	0.182	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	144.3	177.7	27.6	-33.6	0	0	0	112.2	V67 W68 V72 L95 N96	V67-P74 CarbonylContact O-C 3.57Å; V67-P74 WeakPolarHBondContact O-CA 3.49Å; W68-P74 HydrophobicContact CZ2-CB 4.41Å; V72-P74 VanDerWaalsContact O-CD 3.3Å; V72-P74 WeakPolarHBondContact O-CD 3.45Å; P74-L95 WeakPolarHBondContact O-CA 3.34Å; P74-N96 HydrophobicContact CG-CB 4.32Å; P74-N96 PolarHBondContact O-N 2.94Å
75	G	94.7	Very high	92.1	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.3	175.1	173.4	0	0	0	0	0	112.9	Q66 V67 I94	Q66-G75 CarbonylContact C-O 3.53Å; Q66-G75 WeakPolarHBondContact CA-O 3.42Å; V67-G75 PolarHBondContact N-O 3.45Å; V67-G75 PolarHBondContact O-N 3.47Å; V67-G75 VanDerWaalsContact O-O 3.07Å; G75-I94 CarbonylContact C-O 3.14Å; G75-I94 WeakPolarHBondContact CA-O 3.35Å
76	V	95.8	Very high	92	Very high	49 Å²	49	49 Å²	49	30%	0.297	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	131.4	177.1	-179.1	0	0	0	0	109.7	E65 Q66 S78 V93 I94	E65-V76 CarbonylContact O-C 3.56Å; E65-V76 WeakPolarHBondContact O-CA 3.03Å; Q66-V76 HydrophobicContact CB-CG2 4.33Å; Q66-V76 HydrophobicContact CG-CG2 4.32Å; V76-S78 PolarHBondContact O-N 2.97Å; V76-V93 WeakPolarHBondContact O-CA 3.42Å; V76-I94 PolarHBondContact N-O 2.86Å; V76-I94 PolarHBondContact O-N 2.86Å
77	I	95.8	Very high	91.5	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	120.1	176.5	-55.3	179.8	0	0	0	109	Y61 V63 G64 E65 V67 L80 V93 L127	Y61-I77 HydrophobicContact CD1-CD1 3.87Å; Y61-I77 HydrophobicContact CG-CD1 4.01Å; V63-I77 HydrophobicContact CG2-CG2 4.37Å; G64-I77 PolarHBondContact N-O 3.26Å; E65-I77 HydrophobicContact CB-CD1 4.4Å; E65-I77 PolarHBondContact O-N 3.37Å; V67-I77 HydrophobicContact CG1-CD1 3.94Å; V67-I77 HydrophobicContact CG1-CG1 4.22Å; V67-I77 HydrophobicContact CG2-CD1 4.2Å; V67-I77 HydrophobicContact CG2-CG1 3.66Å; I77-L80 HydrophobicContact CD1-CD1 4.42Å; I77-L80 HydrophobicContact CG2-CD1 3.82Å; I77-L80 HydrophobicContact CG2-CG 3.71Å; I77-V93 HydrophobicContact CG1-CG2 4.26Å; I77-L127 HydrophobicContact CD1-CD1 3.64Å; I77-L127 HydrophobicContact CG1-CD1 4.1Å
78	S	94	Very high	91	Very high	41 Å²	41	48.7 Å²	48.7	29%	0.287	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	-14.4	176.6	-167.2	0	0	0	0	113.1	V63 V76 G92 F112	V63-S78 WeakPolarHBondContact CG1-O 3.41Å; V76-S78 PolarHBondContact O-N 2.97Å; S78-G92 PolarHBondContact N-O 2.91Å; S78-F112 WeakPolarHBondContact OG-CB 3.28Å
79	Y	94.9	Very high	90.7	Very high	54 Å²	54	48.6 Å²	48.6	21%	0.212	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	138.6	176.3	-177.4	-99.4	0	0	0	111.8	G81 E82 T83 A91 G92 Y111 F112 F121	Y79-G81 VanDerWaalsContact CE1-O 3.28Å; Y79-G81 WeakPolarHBondContact CE1-O 3.5Å; Y79-E82 PolarHBondContact OH-O 2.87Å; Y79-T83 HydrophobicContact CE1-CG2 4.15Å; Y79-A91 CarbonylContact O-C 3.4Å; Y79-A91 WeakPolarHBondContact O-CA 3.19Å; Y79-G92 PolarHBondContact N-O 3.21Å; Y79-G92 PolarHBondContact O-N 3.39Å; Y79-Y111 WeakPolarHBondContact CD2-O 3.2Å; Y79-Y111 AromaticContact CE1-CD1 3.86Å; Y79-Y111 HydrophobicContact CE1-CD1 3.86Å; Y79-Y111 HydrophobicContact CE1-CG 4.39Å; Y79-Y111 HydrophobicContact CE2-CD1 4.11Å; Y79-Y111 AromaticContact CZ-CD1 3.65Å; Y79-F112 HydrophobicContact CG-CD1 4.49Å; Y79-F121 HydrophobicContact CD1-CE1 4.14Å
80	L	94.3	Very high	90.9	Very high	40 Å²	40	50.2 Å²	50.2	21%	0.209	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	109.8	169.2	-84.7	164.1	0	0	0	108.5	Y61 V63 I77 W90 A91 P124	Y61-L80 WeakPolarHBondContact O-CD1 3.38Å; V63-L80 HydrophobicContact CG2-CB 4.06Å; V63-L80 HydrophobicContact CG2-CD1 4.26Å; V63-L80 HydrophobicContact CG2-CG 4.37Å; I77-L80 HydrophobicContact CD1-CD1 4.42Å; I77-L80 HydrophobicContact CG2-CD1 3.82Å; I77-L80 HydrophobicContact CG2-CG 3.71Å; L80-W90 WeakPolarHBondContact CA-O 3.4Å; L80-A91 HydrophobicContact CD2-CB 3.81Å; L80-P124 HydrophobicContact CD2-CB 4.42Å; L80-P124 HydrophobicContact CD2-CG 4.01Å
81	G	90.4	Very high	91.2	Very high	12 Å²	12	45.4 Å²	45.4	12%	0.124	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.3	169	-173.8	0	0	0	0	0	113.5	Y79 Q89 W90	Y79-G81 VanDerWaalsContact CE1-O 3.28Å; Y79-G81 WeakPolarHBondContact CE1-O 3.5Å; G81-Q89 VanDerWaalsContact C-CA 3.46Å; G81-Q89 CarbonylContact O-C 3.6Å; G81-Q89 VanDerWaalsContact O-CA 3.25Å; G81-Q89 WeakPolarHBondContact O-CA 3.28Å; G81-W90 PolarHBondContact N-O 2.93Å; G81-W90 PolarHBondContact O-N 3.33Å
82	E	91.3	Very high	91.7	Very high	136 Å²	136	45.2 Å²	45.2	64%	0.636	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-69.1	143.7	-178.9	-57	-158.4	119	0	0	112.7	Y79 G88 Q89	Y79-E82 PolarHBondContact OH-O 2.87Å; E82-G88 WeakPolarHBondContact CA-O 3.48Å; E82-G88 WeakPolarHBondContact OE1-CA 3.27Å; E82-Q89 HydrophobicContact CG-CB 4.11Å
83	T	92.3	Very high	92.1	Very high	10 Å²	10	41.9 Å²	41.9	6%	0.061	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	147.4	-179.8	73.6	0	0	0	0	112.5	Y79 F85 A86 W90 Y111 F121	Y79-T83 HydrophobicContact CE1-CG2 4.15Å; T83-F85 HydrophobicContact CG2-CD1 4.3Å; T83-F85 HydrophobicContact CG2-CE1 3.57Å; T83-F85 HydrophobicContact CG2-CZ 3.88Å; T83-F85 PolarHBondContact O-N 3.41Å; T83-F85 WeakPolarHBondContact OG1-CD1 3.45Å; T83-F85 VanDerWaalsContact OG1-CE1 3.23Å; T83-F85 WeakPolarHBondContact OG1-CE1 3.44Å; T83-F85 VanDerWaalsContact OG1-CZ 3.31Å; T83-F85 WeakPolarHBondContact OG1-CZ 3.47Å; T83-A86 CarbonylContact O-C 3.6Å; T83-A86 PolarHBondContact O-N 2.87Å; T83-A86 PolarHBondContact OG1-O 2.85Å; T83-A86 VanDerWaalsContact OG1-O 3.09Å; T83-W90 HydrophobicContact CG2-CB 3.89Å; T83-W90 VanDerWaalsContact CG2-CD1 3.5Å; T83-W90 HydrophobicContact CG2-CG 3.85Å; T83-W90 PolarHBondContact OG1-NE1 3.47Å; T83-Y111 HydrophobicContact CG2-CD1 4.24Å; T83-Y111 HydrophobicContact CG2-CE1 3.93Å; T83-F121 HydrophobicContact CG2-CD1 4.15Å; T83-F121 HydrophobicContact CG2-CE1 4.1Å
84	Q	88.7	Confident	92.4	Very high	160 Å²	160	39.7 Å²	39.7	75%	0.748	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-15.8	-178.7	-56	-175.1	27.9	0	0	112.8	Y111	Q84-Y111 WeakPolarHBondContact CB-OH 3.42Å; Q84-Y111 PolarHBondContact N-OH 2.84Å
85	F	88.8	Confident	92.4	Very high	77 Å²	77	38.4 Å²	38.4	34%	0.338	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-19.2	178.7	65.6	-99.1	0	0	0	113.6	T83 W90 V106 Y111 F121	T83-F85 HydrophobicContact CG2-CD1 4.3Å; T83-F85 HydrophobicContact CG2-CE1 3.57Å; T83-F85 HydrophobicContact CG2-CZ 3.88Å; T83-F85 PolarHBondContact O-N 3.41Å; T83-F85 WeakPolarHBondContact OG1-CD1 3.45Å; T83-F85 VanDerWaalsContact OG1-CE1 3.23Å; T83-F85 WeakPolarHBondContact OG1-CE1 3.44Å; T83-F85 VanDerWaalsContact OG1-CZ 3.31Å; T83-F85 WeakPolarHBondContact OG1-CZ 3.47Å; F85-W90 HydrophobicContact CE2-CD2 4.3Å; F85-W90 AromaticContact CE2-CE2 3.78Å; F85-W90 HydrophobicContact CE2-CH2 4.3Å; F85-W90 AromaticContact CE2-CZ2 3.79Å; F85-W90 HydrophobicContact CE2-CZ2 3.79Å; F85-W90 HydrophobicContact CZ-CD2 4.25Å; F85-W90 HydrophobicContact CZ-CG 4.47Å; F85-V106 HydrophobicContact CB-CG1 3.91Å; F85-V106 HydrophobicContact CD1-CB 3.52Å; F85-V106 HydrophobicContact CD1-CG1 3.49Å; F85-V106 VanDerWaalsContact CD1-CG1 3.49Å; F85-V106 HydrophobicContact CD1-CG2 3.98Å; F85-V106 HydrophobicContact CD2-CG1 4.33Å; F85-V106 HydrophobicContact CE1-CB 3.76Å; F85-V106 HydrophobicContact CE1-CG1 4.03Å; F85-V106 HydrophobicContact CE1-CG2 3.67Å; F85-V106 HydrophobicContact CG-CB 4.24Å; F85-V106 HydrophobicContact CG-CG1 3.67Å; F85-V106 HydrophobicContact CZ-CG2 4.25Å; F85-Y111 HydrophobicContact CD1-CE2 4.24Å; F85-Y111 HydrophobicContact CE1-CE2 4.22Å; F85-F121 HydrophobicContact CE1-CD1 4.19Å; F85-F121 HydrophobicContact CE1-CD2 4.42Å; F85-F121 HydrophobicContact CE1-CE1 4.31Å; F85-F121 HydrophobicContact CE1-CG 4.24Å; F85-F121 HydrophobicContact CZ-CB 3.99Å; F85-F121 AromaticContact CZ-CD1 3.99Å; F85-F121 HydrophobicContact CZ-CD1 3.99Å; F85-F121 HydrophobicContact CZ-CD2 4.28Å; F85-F121 AromaticContact CZ-CG 3.82Å; F85-F121 HydrophobicContact CZ-CG 3.82Å
86	A	90.1	Very high	92.3	Very high	5 Å²	5	42.4 Å²	42.4	4%	0.041	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	119.5	-177.8	0	0	0	0	0	111	T83 W90 G152	T83-A86 CarbonylContact O-C 3.6Å; T83-A86 PolarHBondContact O-N 2.87Å; T83-A86 PolarHBondContact OG1-O 2.85Å; T83-A86 VanDerWaalsContact OG1-O 3.09Å; A86-W90 HydrophobicContact CB-CZ2 3.52Å; A86-W90 PolarHBondContact O-NE1 3.49Å; A86-G152 VanDerWaalsContact CB-O 3.24Å; A86-G152 WeakPolarHBondContact CB-O 3.32Å
87	P	81.8	Confident	92	Very high	92 Å²	92	44.4 Å²	44.4	60%	0.597	23%	0.229	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-58.4	154.1	-173.3	22.5	-34.8	0	0	0	114.8	G152 G154	P87-G152 WeakPolarHBondContact CD-O 3.41Å; P87-G154 CarbonylContact O-C 3.53Å; P87-G154 VanDerWaalsContact O-C 3.29Å; P87-G154 WeakPolarHBondContact O-CA 3.4Å
88	G	84.7	Confident	91.7	Very high	5 Å²	5	49 Å²	49	5%	0.052	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	88.5	162.6	-175	0	0	0	0	0	113.8	E82 W90 A155	E82-G88 WeakPolarHBondContact CA-O 3.48Å; E82-G88 WeakPolarHBondContact OE1-CA 3.27Å; G88-W90 VanDerWaalsContact O-CD1 3.25Å; G88-A155 WeakPolarHBondContact O-CB 3.5Å
89	Q	88.4	Confident	91.5	Very high	49 Å²	49	50 Å²	50	23%	0.229	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	108	-175.4	127.1	-145.3	81	0	0	117.6	G81 E82 A155 P156 A157 G158	G81-Q89 VanDerWaalsContact C-CA 3.46Å; G81-Q89 CarbonylContact O-C 3.6Å; G81-Q89 VanDerWaalsContact O-CA 3.25Å; G81-Q89 WeakPolarHBondContact O-CA 3.28Å; E82-Q89 HydrophobicContact CG-CB 4.11Å; Q89-A155 WeakPolarHBondContact O-CB 3.34Å; Q89-P156 HydrophobicContact CB-CB 4.27Å; Q89-P156 VanDerWaalsContact O-CA 3.32Å; Q89-P156 WeakPolarHBondContact O-CA 3.37Å; Q89-A157 VanDerWaalsContact CG-O 3.29Å; Q89-A157 WeakPolarHBondContact CG-O 3.5Å; Q89-A157 PolarHBondContact O-N 2.97Å; Q89-A157 VanDerWaalsContact OE1-CA 3.24Å; Q89-A157 VanDerWaalsContact OE1-N 3.12Å; Q89-A157 PolarHBondContact OE1-O 2.72Å; Q89-G158 PolarHBondContact NE2-O 3.12Å; Q89-G158 PolarHBondContact OE1-O 2.76Å
90	W	95.3	Very high	91.1	Very high	37 Å²	37	48.1 Å²	48.1	14%	0.14	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	151.8	-177.6	-69.6	78.6	0	0	0	111.7	L80 G81 T83 F85 A86 G88 F121 T122 A155	L80-W90 WeakPolarHBondContact CA-O 3.4Å; G81-W90 PolarHBondContact N-O 2.93Å; G81-W90 PolarHBondContact O-N 3.33Å; T83-W90 HydrophobicContact CG2-CB 3.89Å; T83-W90 VanDerWaalsContact CG2-CD1 3.5Å; T83-W90 HydrophobicContact CG2-CG 3.85Å; T83-W90 PolarHBondContact OG1-NE1 3.47Å; F85-W90 HydrophobicContact CE2-CD2 4.3Å; F85-W90 AromaticContact CE2-CE2 3.78Å; F85-W90 HydrophobicContact CE2-CH2 4.3Å; F85-W90 AromaticContact CE2-CZ2 3.79Å; F85-W90 HydrophobicContact CE2-CZ2 3.79Å; F85-W90 HydrophobicContact CZ-CD2 4.25Å; F85-W90 HydrophobicContact CZ-CG 4.47Å; A86-W90 HydrophobicContact CB-CZ2 3.52Å; A86-W90 PolarHBondContact O-NE1 3.49Å; G88-W90 VanDerWaalsContact O-CD1 3.25Å; W90-F121 HydrophobicContact CB-CD1 4.09Å; W90-F121 HydrophobicContact CD2-CB 4.38Å; W90-F121 HydrophobicContact CE3-CB 3.79Å; W90-F121 HydrophobicContact CZ3-CB 4.28Å; W90-T122 VanDerWaalsContact CE3-C 3.49Å; W90-A155 HydrophobicContact CB-CB 4.4Å; W90-A155 HydrophobicContact CD2-CB 4.17Å; W90-A155 HydrophobicContact CG-CB 3.78Å
91	A	94.9	Very high	90.9	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	116.1	160.1	0	0	0	0	0	109.5	Y79 L80 V93 F121 T122 P124 L127	Y79-A91 CarbonylContact O-C 3.4Å; Y79-A91 WeakPolarHBondContact O-CA 3.19Å; L80-A91 HydrophobicContact CD2-CB 3.81Å; A91-V93 HydrophobicContact CB-CG2 4.26Å; A91-F121 CarbonylContact O-C 3.29Å; A91-F121 WeakPolarHBondContact O-CA 3.26Å; A91-T122 HydrophobicContact CB-CG2 4.31Å; A91-T122 PolarHBondContact N-O 3.2Å; A91-T122 PolarHBondContact O-N 2.87Å; A91-P124 HydrophobicContact CB-CB 4.3Å; A91-P124 HydrophobicContact CB-CG 3.99Å; A91-L127 HydrophobicContact CB-CD1 3.64Å; A91-L127 HydrophobicContact CB-CG 4.43Å
92	G	95.9	Very high	90.9	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	115.1	162.9	0	0	0	0	0	109.6	S78 Y79 I120	S78-G92 PolarHBondContact N-O 2.91Å; Y79-G92 PolarHBondContact N-O 3.21Å; Y79-G92 PolarHBondContact O-N 3.39Å; G92-I120 WeakPolarHBondContact CA-O 3.48Å
93	V	96.1	Very high	91.1	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	132.3	-176.8	-173.3	0	0	0	0	109.3	V67 V69 V76 I77 A91 L95 G119 I120 L127	V67-V93 HydrophobicContact CG2-CG1 4.18Å; V67-V93 HydrophobicContact CG2-CG2 4.42Å; V69-V93 HydrophobicContact CG2-CB 4.2Å; V69-V93 HydrophobicContact CG2-CG1 4.08Å; V69-V93 HydrophobicContact CG2-CG2 4.21Å; V76-V93 WeakPolarHBondContact O-CA 3.42Å; I77-V93 HydrophobicContact CG1-CG2 4.26Å; A91-V93 HydrophobicContact CB-CG2 4.26Å; V93-L95 HydrophobicContact CG1-CD2 4.18Å; V93-G119 CarbonylContact O-C 3.6Å; V93-G119 WeakPolarHBondContact O-CA 3.24Å; V93-I120 HydrophobicContact CB-CG2 4.05Å; V93-I120 PolarHBondContact N-O 3.22Å; V93-I120 PolarHBondContact O-N 3.42Å; V93-L127 HydrophobicContact CG2-CD1 4.4Å; V93-L127 HydrophobicContact CG2-CD2 3.88Å
94	I	96.6	Very high	91	Very high	38 Å²	38	49.8 Å²	49.8	20%	0.195	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	110.3	167.2	-58.4	177.1	0	0	0	106.2	G75 V76 F112 C114 Q118	G75-I94 CarbonylContact C-O 3.14Å; G75-I94 WeakPolarHBondContact CA-O 3.35Å; V76-I94 PolarHBondContact N-O 2.86Å; V76-I94 PolarHBondContact O-N 2.86Å; I94-F112 HydrophobicContact CD1-CD2 4.15Å; I94-F112 HydrophobicContact CG1-CD2 3.71Å; I94-F112 HydrophobicContact CG1-CE2 3.65Å; I94-C114 HydrophobicContact CB-CB 4.36Å; I94-C114 HydrophobicContact CD1-CB 3.8Å; I94-C114 HydrophobicContact CG1-CB 3.69Å; I94-C114 HydrophobicContact CG2-CB 3.88Å; I94-Q118 VanDerWaalsContact CG2-CD 3.5Å; I94-Q118 HydrophobicContact CG2-CG 3.74Å
95	L	95.5	Very high	91.2	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	152.2	176	-62.4	-178.4	0	0	0	110.9	V69 K73 P74 V93 D97 V99 Q118 I120	V69-L95 HydrophobicContact CB-CD2 4.41Å; V69-L95 HydrophobicContact CG2-CD2 3.79Å; K73-L95 HydrophobicContact CB-CD1 4.4Å; K73-L95 HydrophobicContact CB-CD2 4.1Å; K73-L95 HydrophobicContact CD-CD1 4.11Å; P74-L95 WeakPolarHBondContact O-CA 3.34Å; V93-L95 HydrophobicContact CG1-CD2 4.18Å; L95-D97 VanDerWaalsContact C-N 3.26Å; L95-D97 WeakPolarHBondContact CB-O 3.34Å; L95-D97 PolarHBondContact O-N 3.17Å; L95-V99 HydrophobicContact CD1-CG2 3.99Å; L95-Q118 WeakPolarHBondContact CB-O 3.4Å; L95-Q118 PolarHBondContact N-O 3.35Å; L95-Q118 WeakPolarHBondContact O-CG 3.29Å; L95-Q118 PolarHBondContact O-NE2 3.29Å; L95-I120 HydrophobicContact CD1-CG2 4.05Å; L95-I120 HydrophobicContact CD2-CG2 3.99Å; L95-I120 HydrophobicContact CG-CG2 3.89Å
96	N	91.8	Very high	91.3	Very high	83 Å²	83	41.9 Å²	41.9	44%	0.444	23%	0.227	S	C	.	.	S	Bend	trans	-65.8	-35.9	176.6	-70.1	10	0	0	0	111	P74	P74-N96 HydrophobicContact CG-CB 4.32Å; P74-N96 PolarHBondContact O-N 2.94Å
97	D	90.1	Very high	91.1	Very high	92 Å²	92	45.5 Å²	45.5	49%	0.492	26%	0.264	S	S	.	.	S	Bend	trans	-107.4	157.1	180	-42.5	-68.8	0	0	0	111.5	L95 V99	L95-D97 VanDerWaalsContact C-N 3.26Å; L95-D97 WeakPolarHBondContact CB-O 3.34Å; L95-D97 PolarHBondContact O-N 3.17Å; D97-V99 HydrophobicContact CB-CG1 4.27Å; D97-V99 HydrophobicContact CB-CG2 4.09Å; D97-V99 PolarHBondContact O-N 2.92Å
98	L	90	Very high	91.3	Very high	96 Å²	96	45 Å²	45	50%	0.503	28%	0.275	S	S	.	.	S	Bend	trans	-76.4	52.1	-179.1	-58.2	-179.7	0	0	0	112.9	Q115 L117 Q118	L98-Q115 HydrophobicContact CD2-CB 4.12Å; L98-L117 CarbonylContact C-O 3.53Å; L98-L117 WeakPolarHBondContact CA-O 3.19Å; L98-Q118 HydrophobicContact CD2-CB 3.89Å; L98-Q118 HydrophobicContact CD2-CG 4.12Å
99	V	88.9	Confident	91.5	Very high	64 Å²	64	46.7 Å²	46.7	39%	0.388	29%	0.285	S	S	.	.			trans	-122.9	21	-174.4	-57.8	0	0	0	0	112.9	K73 L95 D97 L117	K73-V99 HydrophobicContact CD-CG2 3.86Å; K73-V99 HydrophobicContact CG-CG2 4.35Å; K73-V99 PolarHBondContact NZ-O 2.66Å; L95-V99 HydrophobicContact CD1-CG2 3.99Å; D97-V99 HydrophobicContact CB-CG1 4.27Å; D97-V99 HydrophobicContact CB-CG2 4.09Å; D97-V99 PolarHBondContact O-N 2.92Å; V99-L117 PolarHBondContact N-O 2.87Å
100	G	87.3	Confident	91.7	Very high	13 Å²	13	50.3 Å²	50.3	13%	0.134	30%	0.296	C	S	.	.	S	Bend	trans	-82.5	-152.2	172.1	0	0	0	0	0	112.5	L117	G100-L117 WeakPolarHBondContact CA-O 3.41Å; G100-L117 PolarHBondContact N-O 2.81Å
101	K	90.4	Very high	91.6	Very high	170 Å²	170	50.2 Å²	50.2	74%	0.739	30%	0.296	S	S	*	.	S	Bend	trans	-142.7	-6.6	-173.6	-64.4	-166.3	175.4	-166.5	0	115.3	G119	K101-G119 PolarHBondContact N-O 3.26Å
102	N	90.5	Very high	91.5	Very high	27 Å²	27	50.8 Å²	50.8	14%	0.144	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-155.4	-177.3	-178	56.9	80.7	0	0	0	110.1	G104 L117 Q118 G119 F121	N102-G104 WeakPolarHBondContact OD1-CA 3.22Å; N102-G104 PolarHBondContact OD1-N 2.68Å; N102-L117 PolarHBondContact O-N 2.98Å; N102-Q118 PolarHBondContact O-N 3.31Å; N102-G119 PolarHBondContact N-O 3.32Å; N102-G119 PolarHBondContact ND2-O 2.98Å; N102-G119 WeakPolarHBondContact O-CA 3.47Å; N102-G119 PolarHBondContact O-N 3.37Å; N102-G119 PolarHBondContact OD1-O 2.87Å; N102-F121 WeakPolarHBondContact ND2-CD2 3.3Å
103	D	94.6	Very high	91.4	Very high	36 Å²	36	58.2 Å²	58.2	19%	0.193	33%	0.334	C	S	.	.	S	Bend	trans	-107.9	15.5	178.3	74.2	-37.9	0	0	0	112.5	S105 R110 C114	D103-S105 VanDerWaalsContact OD1-CB 3.31Å; D103-S105 WeakPolarHBondContact OD1-CB 3.37Å; D103-S105 PolarHBondContact OD1-N 2.87Å; D103-S105 PolarHBondContact OD1-OG 3.43Å; D103-R110 PolarHBondContact O-NH1 3.05Å; D103-R110 IonicContact OD1-NH1 3.95Å; D103-R110 IonicContact OD2-CZ 3.53Å; D103-R110 IonicContact OD2-NH1 3.52Å; D103-R110 PolarHBondContact OD2-NH1 3.36Å; D103-R110 IonicContact OD2-NH2 2.85Å; D103-R110 PolarHBondContact OD2-NH2 3.44Å; D103-C114 PolarHBondContact O-N 2.95Å; D103-C114 PolarHBondContact O-SG 3.5Å; D103-C114 VanDerWaalsContact O-SG 3.35Å
104	G	90.2	Very high	91.3	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	34%	0.341	C	S	.	.	S	Bend	trans	89	2.5	-168.9	0	0	0	0	0	114.8	N102 Y111 F112	N102-G104 WeakPolarHBondContact OD1-CA 3.22Å; N102-G104 PolarHBondContact OD1-N 2.68Å; G104-Y111 PolarHBondContact O-N 2.9Å; G104-F112 CarbonylContact C-O 3.59Å; G104-F112 WeakPolarHBondContact CA-O 3.48Å; G104-F112 PolarHBondContact O-N 3.37Å; G104-F112 VanDerWaalsContact O-N 3.17Å
105	S	94	Very high	90.9	Very high	30 Å²	30	63.1 Å²	63.1	21%	0.21	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	152.7	169.3	79.7	0	0	0	0	113.1	D103 V109	D103-S105 VanDerWaalsContact OD1-CB 3.31Å; D103-S105 WeakPolarHBondContact OD1-CB 3.37Å; D103-S105 PolarHBondContact OD1-N 2.87Å; D103-S105 PolarHBondContact OD1-OG 3.43Å; S105-V109 CarbonylContact C-O 3.58Å; S105-V109 VanDerWaalsContact CA-O 3.24Å; S105-V109 WeakPolarHBondContact CA-O 3.22Å; S105-V109 WeakPolarHBondContact CB-O 3.48Å
106	V	90.5	Very high	90.6	Very high	42 Å²	42	67.8 Å²	67.8	26%	0.255	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	130.4	171.8	-177.5	0	0	0	0	108.8	F85 G108 V109 Y111 F121	F85-V106 HydrophobicContact CB-CG1 3.91Å; F85-V106 HydrophobicContact CD1-CB 3.52Å; F85-V106 HydrophobicContact CD1-CG1 3.49Å; F85-V106 VanDerWaalsContact CD1-CG1 3.49Å; F85-V106 HydrophobicContact CD1-CG2 3.98Å; F85-V106 HydrophobicContact CD2-CG1 4.33Å; F85-V106 HydrophobicContact CE1-CB 3.76Å; F85-V106 HydrophobicContact CE1-CG1 4.03Å; F85-V106 HydrophobicContact CE1-CG2 3.67Å; F85-V106 HydrophobicContact CG-CB 4.24Å; F85-V106 HydrophobicContact CG-CG1 3.67Å; F85-V106 HydrophobicContact CZ-CG2 4.25Å; V106-G108 VanDerWaalsContact C-N 3.27Å; V106-G108 PolarHBondContact O-N 3.32Å; V106-V109 PolarHBondContact N-O 3.12Å; V106-V109 PolarHBondContact O-N 2.88Å; V106-V109 VanDerWaalsContact O-N 3.12Å; V106-Y111 HydrophobicContact CB-CE2 4.43Å; V106-F121 HydrophobicContact CG2-CD2 3.72Å; V106-F121 HydrophobicContact CG2-CE2 3.49Å; V106-F121 VanDerWaalsContact CG2-CE2 3.49Å; V106-F121 HydrophobicContact CG2-CZ 4.27Å
107	G	85.3	Confident	90.6	Very high	81 Å²	81	68.6 Å²	68.6	84%	0.835	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	30.2	178.1	0	0	0	0	0	114.1	V109	G107-V109 PolarHBondContact O-N 3.4Å
108	G	86.4	Confident	90.7	Very high	80 Å²	80	65.9 Å²	65.9	83%	0.825	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	80	-9.7	-174.8	0	0	0	0	0	115	V106	V106-G108 VanDerWaalsContact C-N 3.27Å; V106-G108 PolarHBondContact O-N 3.32Å
109	V	88.1	Confident	90.9	Very high	41 Å²	41	61.3 Å²	61.3	25%	0.248	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	120.4	175.3	-176.7	0	0	0	0	109.4	S105 V106 G107 Y111	S105-V109 CarbonylContact C-O 3.58Å; S105-V109 VanDerWaalsContact CA-O 3.24Å; S105-V109 WeakPolarHBondContact CA-O 3.22Å; S105-V109 WeakPolarHBondContact CB-O 3.48Å; V106-V109 PolarHBondContact N-O 3.12Å; V106-V109 PolarHBondContact O-N 2.88Å; V106-V109 VanDerWaalsContact O-N 3.12Å; G107-V109 PolarHBondContact O-N 3.4Å; V109-Y111 HydrophobicContact CB-CE2 3.86Å; V109-Y111 HydrophobicContact CG1-CD2 4.36Å; V109-Y111 HydrophobicContact CG1-CE1 4.02Å; V109-Y111 HydrophobicContact CG1-CE2 3.74Å; V109-Y111 WeakPolarHBondContact O-CD2 3.49Å; V109-Y111 VanDerWaalsContact O-CE2 3.24Å; V109-Y111 WeakPolarHBondContact O-CE2 3.48Å
110	R	94.1	Very high	91.2	Very high	126 Å²	126	59.3 Å²	59.3	48%	0.475	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	127.7	173.1	-174.1	173.2	-64.9	-67.9	-1.2	110.6	D103 F112	D103-R110 PolarHBondContact O-NH1 3.05Å; D103-R110 IonicContact OD1-NH1 3.95Å; D103-R110 IonicContact OD2-CZ 3.53Å; D103-R110 IonicContact OD2-NH1 3.52Å; D103-R110 PolarHBondContact OD2-NH1 3.36Å; D103-R110 IonicContact OD2-NH2 2.85Å; D103-R110 PolarHBondContact OD2-NH2 3.44Å; R110-F112 WeakPolarHBondContact CD-O 3.21Å; R110-F112 WeakPolarHBondContact CG-O 3.38Å; R110-F112 PolarHBondContact NH1-O 2.94Å
111	Y	92.5	Very high	91.7	Very high	35 Å²	35	59.8 Å²	59.8	14%	0.137	34%	0.338	C	S	.	.	S	Bend	trans	-108.1	-32.8	177	-56.7	-95.2	0	0	0	111.6	Y79 T83 Q84 F85 G104 V106 V109 F121	Y79-Y111 WeakPolarHBondContact CD2-O 3.2Å; Y79-Y111 AromaticContact CE1-CD1 3.86Å; Y79-Y111 HydrophobicContact CE1-CD1 3.86Å; Y79-Y111 HydrophobicContact CE1-CG 4.39Å; Y79-Y111 HydrophobicContact CE2-CD1 4.11Å; Y79-Y111 AromaticContact CZ-CD1 3.65Å; T83-Y111 HydrophobicContact CG2-CD1 4.24Å; T83-Y111 HydrophobicContact CG2-CE1 3.93Å; Q84-Y111 WeakPolarHBondContact CB-OH 3.42Å; Q84-Y111 PolarHBondContact N-OH 2.84Å; F85-Y111 HydrophobicContact CD1-CE2 4.24Å; F85-Y111 HydrophobicContact CE1-CE2 4.22Å; G104-Y111 PolarHBondContact O-N 2.9Å; V106-Y111 HydrophobicContact CB-CE2 4.43Å; V109-Y111 HydrophobicContact CB-CE2 3.86Å; V109-Y111 HydrophobicContact CG1-CD2 4.36Å; V109-Y111 HydrophobicContact CG1-CE1 4.02Å; V109-Y111 HydrophobicContact CG1-CE2 3.74Å; V109-Y111 WeakPolarHBondContact O-CD2 3.49Å; V109-Y111 VanDerWaalsContact O-CE2 3.24Å; V109-Y111 WeakPolarHBondContact O-CE2 3.48Å; Y111-F121 HydrophobicContact CD2-CE1 4.03Å; Y111-F121 AromaticContact CD2-CZ 3.56Å; Y111-F121 HydrophobicContact CD2-CZ 3.56Å; Y111-F121 HydrophobicContact CE2-CZ 4.4Å; Y111-F121 HydrophobicContact CG-CE1 4.01Å; Y111-F121 AromaticContact CG-CZ 3.89Å; Y111-F121 HydrophobicContact CG-CZ 3.89Å
112	F	93.4	Very high	91.9	Very high	11 Å²	11	52.4 Å²	52.4	5%	0.048	31%	0.307	C	S	.	.	S	Bend	trans	-147.8	175.3	170.5	60.2	-79.7	0	0	0	110.7	S78 Y79 I94 G104 R110 C114 F121	S78-F112 WeakPolarHBondContact OG-CB 3.28Å; Y79-F112 HydrophobicContact CG-CD1 4.49Å; I94-F112 HydrophobicContact CD1-CD2 4.15Å; I94-F112 HydrophobicContact CG1-CD2 3.71Å; I94-F112 HydrophobicContact CG1-CE2 3.65Å; G104-F112 CarbonylContact C-O 3.59Å; G104-F112 WeakPolarHBondContact CA-O 3.48Å; G104-F112 PolarHBondContact O-N 3.37Å; G104-F112 VanDerWaalsContact O-N 3.17Å; R110-F112 WeakPolarHBondContact CD-O 3.21Å; R110-F112 WeakPolarHBondContact CG-O 3.38Å; R110-F112 PolarHBondContact NH1-O 2.94Å; F112-C114 HydrophobicContact CD2-CB 4.45Å; F112-C114 HydrophobicContact CE2-CB 4.45Å; F112-C114 VanDerWaalsContact CE2-SG 3.56Å; F112-F121 HydrophobicContact CD1-CE1 4.37Å; F112-F121 AromaticContact CD1-CZ 3.99Å; F112-F121 HydrophobicContact CD1-CZ 3.99Å; F112-F121 HydrophobicContact CE1-CD1 4.49Å; F112-F121 HydrophobicContact CE1-CD2 4.47Å; F112-F121 AromaticContact CE1-CE1 3.84Å; F112-F121 HydrophobicContact CE1-CE1 3.84Å; F112-F121 AromaticContact CE1-CE2 3.79Å; F112-F121 HydrophobicContact CE1-CE2 3.79Å; F112-F121 AromaticContact CE1-CZ 3.45Å; F112-F121 HydrophobicContact CE1-CZ 3.45Å; F112-F121 VanDerWaalsContact CE1-CZ 3.45Å; F112-F121 HydrophobicContact CZ-CE2 4.4Å; F112-F121 HydrophobicContact CZ-CZ 4.46Å
113	E	94.1	Very high	92	Very high	157 Å²	157	54.8 Å²	54.8	73%	0.734	31%	0.314	S	S	*	.			trans	-122	125.6	-179.1	-172.9	172.1	-172.9	0	0	109.8
114	C	92.4	Very high	91.8	Very high	24 Å²	24	53.2 Å²	53.2	16%	0.162	31%	0.305	C	S	.	.			trans	-158	178.4	174.1	62.4	0	0	0	0	109.9	I94 D103 F112 Q118 G119	I94-C114 HydrophobicContact CB-CB 4.36Å; I94-C114 HydrophobicContact CD1-CB 3.8Å; I94-C114 HydrophobicContact CG1-CB 3.69Å; I94-C114 HydrophobicContact CG2-CB 3.88Å; D103-C114 PolarHBondContact O-N 2.95Å; D103-C114 PolarHBondContact O-SG 3.5Å; D103-C114 VanDerWaalsContact O-SG 3.35Å; F112-C114 HydrophobicContact CD2-CB 4.45Å; F112-C114 HydrophobicContact CE2-CB 4.45Å; F112-C114 VanDerWaalsContact CE2-SG 3.56Å; C114-Q118 HydrophobicContact CB-CB 4.34Å; C114-G119 VanDerWaalsContact SG-CA 3.53Å; C114-G119 PolarHBondContact SG-N 2.84Å; C114-G119 VanDerWaalsContact SG-N 3.38Å
115	Q	89.1	Confident	91.6	Very high	117 Å²	117	57.3 Å²	57.3	55%	0.547	33%	0.334	S	S	.	.			trans	-69.3	152.6	178.5	-61.1	-174	-0.9	0	0	111.3	L98 L117 Q118	L98-Q115 HydrophobicContact CD2-CB 4.12Å; Q115-L117 PolarHBondContact O-N 2.87Å; Q115-Q118 HydrophobicContact CB-CB 4.09Å; Q115-Q118 VanDerWaalsContact N-OE1 3.16Å; Q115-Q118 WeakPolarHBondContact O-CB 3.3Å; Q115-Q118 PolarHBondContact O-N 3.43Å
116	P	89.2	Confident	91.4	Very high	98 Å²	98	61.2 Å²	61.2	64%	0.636	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	141.6	168.9	-25.7	35.3	0	0	0	111.1	Q118	P116-Q118 PolarHBondContact O-N 3.42Å; P116-Q118 VanDerWaalsContact O-N 3.14Å
117	L	90.7	Very high	91.4	Very high	101 Å²	101	59.5 Å²	59.5	53%	0.529	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.3	12.9	-172.8	-53	177.5	0	0	0	115	L98 V99 G100 N102 Q115	L98-L117 CarbonylContact C-O 3.53Å; L98-L117 WeakPolarHBondContact CA-O 3.19Å; V99-L117 PolarHBondContact N-O 2.87Å; G100-L117 WeakPolarHBondContact CA-O 3.41Å; G100-L117 PolarHBondContact N-O 2.81Å; N102-L117 PolarHBondContact O-N 2.98Å; Q115-L117 PolarHBondContact O-N 2.87Å
118	Q	93.4	Very high	91.6	Very high	34 Å²	34	58 Å²	58	16%	0.159	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-32.8	173.8	-157.9	178.2	20.3	0	0	112.5	I94 L95 L98 N102 C114 Q115 P116	I94-Q118 VanDerWaalsContact CG2-CD 3.5Å; I94-Q118 HydrophobicContact CG2-CG 3.74Å; L95-Q118 WeakPolarHBondContact CB-O 3.4Å; L95-Q118 PolarHBondContact N-O 3.35Å; L95-Q118 WeakPolarHBondContact O-CG 3.29Å; L95-Q118 PolarHBondContact O-NE2 3.29Å; L98-Q118 HydrophobicContact CD2-CB 3.89Å; L98-Q118 HydrophobicContact CD2-CG 4.12Å; N102-Q118 PolarHBondContact O-N 3.31Å; C114-Q118 HydrophobicContact CB-CB 4.34Å; Q115-Q118 HydrophobicContact CB-CB 4.09Å; Q115-Q118 VanDerWaalsContact N-OE1 3.16Å; Q115-Q118 WeakPolarHBondContact O-CB 3.3Å; Q115-Q118 PolarHBondContact O-N 3.43Å; P116-Q118 PolarHBondContact O-N 3.42Å; P116-Q118 VanDerWaalsContact O-N 3.14Å
119	G	93.9	Very high	91.8	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	141.9	-180	0	0	0	0	0	113.1	V93 K101 N102 C114	V93-G119 CarbonylContact O-C 3.6Å; V93-G119 WeakPolarHBondContact O-CA 3.24Å; K101-G119 PolarHBondContact N-O 3.26Å; N102-G119 PolarHBondContact N-O 3.32Å; N102-G119 PolarHBondContact ND2-O 2.98Å; N102-G119 WeakPolarHBondContact O-CA 3.47Å; N102-G119 PolarHBondContact O-N 3.37Å; N102-G119 PolarHBondContact OD1-O 2.87Å; C114-G119 VanDerWaalsContact SG-CA 3.53Å; C114-G119 PolarHBondContact SG-N 2.84Å; C114-G119 VanDerWaalsContact SG-N 3.38Å
120	I	96.1	Very high	91.4	Very high	23 Å²	23	65.7 Å²	65.7	12%	0.118	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	133.2	168.9	-168.3	166.1	0	0	0	110.8	V69 G92 V93 L95	V69-I120 HydrophobicContact CG1-CD1 4.5Å; V69-I120 HydrophobicContact CG2-CG2 4.15Å; G92-I120 WeakPolarHBondContact CA-O 3.48Å; V93-I120 HydrophobicContact CB-CG2 4.05Å; V93-I120 PolarHBondContact N-O 3.22Å; V93-I120 PolarHBondContact O-N 3.42Å; L95-I120 HydrophobicContact CD1-CG2 4.05Å; L95-I120 HydrophobicContact CD2-CG2 3.99Å; L95-I120 HydrophobicContact CG-CG2 3.89Å
121	F	96.3	Very high	90.8	Very high	23 Å²	23	63.5 Å²	63.5	10%	0.101	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	130.5	167.8	-69.4	-93.8	0	0	0	109.1	Y79 T83 F85 W90 A91 N102 V106 Y111 F112	Y79-F121 HydrophobicContact CD1-CE1 4.14Å; T83-F121 HydrophobicContact CG2-CD1 4.15Å; T83-F121 HydrophobicContact CG2-CE1 4.1Å; F85-F121 HydrophobicContact CE1-CD1 4.19Å; F85-F121 HydrophobicContact CE1-CD2 4.42Å; F85-F121 HydrophobicContact CE1-CE1 4.31Å; F85-F121 HydrophobicContact CE1-CG 4.24Å; F85-F121 HydrophobicContact CZ-CB 3.99Å; F85-F121 AromaticContact CZ-CD1 3.99Å; F85-F121 HydrophobicContact CZ-CD1 3.99Å; F85-F121 HydrophobicContact CZ-CD2 4.28Å; F85-F121 AromaticContact CZ-CG 3.82Å; F85-F121 HydrophobicContact CZ-CG 3.82Å; W90-F121 HydrophobicContact CB-CD1 4.09Å; W90-F121 HydrophobicContact CD2-CB 4.38Å; W90-F121 HydrophobicContact CE3-CB 3.79Å; W90-F121 HydrophobicContact CZ3-CB 4.28Å; A91-F121 CarbonylContact O-C 3.29Å; A91-F121 WeakPolarHBondContact O-CA 3.26Å; N102-F121 WeakPolarHBondContact ND2-CD2 3.3Å; V106-F121 HydrophobicContact CG2-CD2 3.72Å; V106-F121 HydrophobicContact CG2-CE2 3.49Å; V106-F121 VanDerWaalsContact CG2-CE2 3.49Å; V106-F121 HydrophobicContact CG2-CZ 4.27Å; Y111-F121 HydrophobicContact CD2-CE1 4.03Å; Y111-F121 AromaticContact CD2-CZ 3.56Å; Y111-F121 HydrophobicContact CD2-CZ 3.56Å; Y111-F121 HydrophobicContact CE2-CZ 4.4Å; Y111-F121 HydrophobicContact CG-CE1 4.01Å; Y111-F121 AromaticContact CG-CZ 3.89Å; Y111-F121 HydrophobicContact CG-CZ 3.89Å; F112-F121 HydrophobicContact CD1-CE1 4.37Å; F112-F121 AromaticContact CD1-CZ 3.99Å; F112-F121 HydrophobicContact CD1-CZ 3.99Å; F112-F121 HydrophobicContact CE1-CD1 4.49Å; F112-F121 HydrophobicContact CE1-CD2 4.47Å; F112-F121 AromaticContact CE1-CE1 3.84Å; F112-F121 HydrophobicContact CE1-CE1 3.84Å; F112-F121 AromaticContact CE1-CE2 3.79Å; F112-F121 HydrophobicContact CE1-CE2 3.79Å; F112-F121 AromaticContact CE1-CZ 3.45Å; F112-F121 HydrophobicContact CE1-CZ 3.45Å; F112-F121 VanDerWaalsContact CE1-CZ 3.45Å; F112-F121 HydrophobicContact CZ-CE2 4.4Å; F112-F121 HydrophobicContact CZ-CZ 4.46Å
122	T	94.4	Very high	89.8	Confident	15 Å²	15	66.5 Å²	66.5	9%	0.092	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	164.4	177.1	-167.3	0	0	0	0	112.4	V69 W90 A91 K126 L127	V69-T122 HydrophobicContact CG1-CG2 4.23Å; W90-T122 VanDerWaalsContact CE3-C 3.49Å; A91-T122 HydrophobicContact CB-CG2 4.31Å; A91-T122 PolarHBondContact N-O 3.2Å; A91-T122 PolarHBondContact O-N 2.87Å; T122-K126 WeakPolarHBondContact OG1-CB 3.48Å; T122-L127 HydrophobicContact CG2-CD2 3.6Å; T122-L127 HydrophobicContact CG2-CG 4.21Å
123	R	92.9	Very high	87.7	Confident	77 Å²	77	69.7 Å²	69.7	29%	0.291	38%	0.377	S	S	.	.			trans	-64.3	133.6	167	-41.2	-72.8	-68	-135.7	-168.1	106.6	S125 K126 S153 G154 A155	R123-S125 PolarHBondContact O-N 2.88Å; R123-S125 VanDerWaalsContact O-N 3.14Å; R123-K126 HydrophobicContact CB-CG 4.26Å; R123-K126 HydrophobicContact CG-CG 4.48Å; R123-K126 WeakPolarHBondContact O-CB 3.29Å; R123-K126 PolarHBondContact O-N 3.41Å; R123-S153 PolarHBondContact NH2-O 3.2Å; R123-S153 PolarHBondContact NH2-OG 3.04Å; R123-G154 PolarHBondContact NH1-O 3.46Å; R123-G154 PolarHBondContact NH2-O 3.11Å; R123-A155 VanDerWaalsContact CZ-N 3.29Å; R123-A155 PolarHBondContact NE-O 3.26Å; R123-A155 PolarHBondContact NH1-O 2.92Å
124	P	90.6	Very high	85.2	Confident	2 Å²	2	70.4 Å²	70.4	1%	0.013	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-61.7	-24	177.7	-20.4	30.9	0	0	0	113	Y61 L80 A91 K126 L127 A157	Y61-P124 HydrophobicContact CD2-CB 4.21Å; Y61-P124 WeakPolarHBondContact CE2-O 3.42Å; L80-P124 HydrophobicContact CD2-CB 4.42Å; L80-P124 HydrophobicContact CD2-CG 4.01Å; A91-P124 HydrophobicContact CB-CB 4.3Å; A91-P124 HydrophobicContact CB-CG 3.99Å; P124-K126 PolarHBondContact O-N 3.34Å; P124-K126 VanDerWaalsContact O-N 3.13Å; P124-L127 VanDerWaalsContact O-CB 3.3Å; P124-L127 WeakPolarHBondContact O-CB 3.3Å; P124-L127 PolarHBondContact O-N 3.4Å; P124-A157 HydrophobicContact CB-CB 3.87Å; P124-A157 HydrophobicContact CG-CB 3.99Å; P124-A157 WeakPolarHBondContact CG-O 3.22Å
125	S	86.3	Confident	82.3	Confident	86 Å²	86	73 Å²	73	60%	0.601	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-67.1	-0.8	168.2	55.4	0	0	0	0	115.5	R123	R123-S125 PolarHBondContact O-N 2.88Å; R123-S125 VanDerWaalsContact O-N 3.14Å
126	K	89	Confident	79.9	Confident	112 Å²	112	72.2 Å²	72.2	49%	0.487	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-105.3	7.3	168.1	-67.1	-62.5	-166.5	174.9	0	112.8	N70 T122 R123 P124	N70-K126 PolarHBondContact N-O 2.77Å; T122-K126 WeakPolarHBondContact OG1-CB 3.48Å; R123-K126 HydrophobicContact CB-CG 4.26Å; R123-K126 HydrophobicContact CG-CG 4.48Å; R123-K126 WeakPolarHBondContact O-CB 3.29Å; R123-K126 PolarHBondContact O-N 3.41Å; P124-K126 PolarHBondContact O-N 3.34Å; P124-K126 VanDerWaalsContact O-N 3.13Å
127	L	90.7	Very high	77.2	Confident	7 Å²	7	73.6 Å²	73.6	4%	0.037	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	153	170.3	-55.8	-178.5	0	0	0	110.4	Y61 V67 V69 I77 A91 V93 T122 P124	Y61-L127 HydrophobicContact CD1-CD1 4.4Å; Y61-L127 HydrophobicContact CD2-CB 4.48Å; Y61-L127 HydrophobicContact CD2-CD1 4.33Å; Y61-L127 HydrophobicContact CE1-CB 4.05Å; Y61-L127 HydrophobicContact CE2-CB 3.89Å; Y61-L127 HydrophobicContact CG-CD1 4.26Å; Y61-L127 PolarHBondContact OH-O 2.98Å; V67-L127 HydrophobicContact CB-CB 4.35Å; V67-L127 HydrophobicContact CG2-CD1 4.19Å; V67-L127 HydrophobicContact CG2-CD2 3.98Å; V67-L127 HydrophobicContact CG2-CG 4.48Å; V69-L127 HydrophobicContact CB-CD2 4.45Å; V69-L127 HydrophobicContact CG2-CD2 3.75Å; I77-L127 HydrophobicContact CD1-CD1 3.64Å; I77-L127 HydrophobicContact CG1-CD1 4.1Å; A91-L127 HydrophobicContact CB-CD1 3.64Å; A91-L127 HydrophobicContact CB-CG 4.43Å; V93-L127 HydrophobicContact CG2-CD1 4.4Å; V93-L127 HydrophobicContact CG2-CD2 3.88Å; T122-L127 HydrophobicContact CG2-CD2 3.6Å; T122-L127 HydrophobicContact CG2-CG 4.21Å; P124-L127 VanDerWaalsContact O-CB 3.3Å; P124-L127 WeakPolarHBondContact O-CB 3.3Å; P124-L127 PolarHBondContact O-N 3.4Å
128	T	90.4	Very high	74.4	Confident	48 Å²	48	72.6 Å²	72.6	29%	0.294	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	148.6	177.4	47.3	0	0	0	0	109.2	Y61 V67 W68 G71 Q130	Y61-T128 PolarHBondContact OH-N 3.11Å; V67-T128 CarbonylContact C-O 3.38Å; V67-T128 WeakPolarHBondContact CA-O 3.14Å; W68-T128 WeakPolarHBondContact CB-OG1 3.39Å; W68-T128 PolarHBondContact N-O 3.16Å; W68-T128 PolarHBondContact O-N 2.95Å; W68-T128 PolarHBondContact O-OG1 3.02Å; G71-T128 WeakPolarHBondContact CA-OG1 3.42Å; T128-Q130 VanDerWaalsContact C-N 3.35Å; T128-Q130 PolarHBondContact OG1-O 3.46Å
129	R	90	Very high	71.4	Confident	131 Å²	131	79.5 Å²	79.5	49%	0.494	46%	0.455	S	S	.	.	S	Bend	trans	-87.6	1.5	-177.9	-66.6	177.3	178.2	-98.1	-3.4	114	D60 Y61 E65 W68	D60-R129 PolarHBondContact O-NH2 3.18Å; Y61-R129 HydrophobicContact CE1-CG 3.97Å; E65-R129 VanDerWaalsContact CD-NH2 3.28Å; E65-R129 IonicContact OE1-CZ 3.57Å; E65-R129 IonicContact OE1-NE 3.07Å; E65-R129 PolarHBondContact OE1-NE 3.16Å; E65-R129 IonicContact OE1-NH1 2.89Å; E65-R129 PolarHBondContact OE1-NH1 2.78Å; E65-R129 IonicContact OE1-NH2 3.94Å; E65-R129 PolarHBondContact OE1-NH2 3.28Å; E65-R129 VanDerWaalsContact OE1-NH2 3.07Å; E65-R129 IonicContact OE2-CZ 2.94Å; E65-R129 VanDerWaalsContact OE2-CZ 3.27Å; E65-R129 IonicContact OE2-NH1 3.27Å; E65-R129 PolarHBondContact OE2-NH1 3.48Å; E65-R129 IonicContact OE2-NH2 2.88Å; E65-R129 PolarHBondContact OE2-NH2 3.01Å; W68-R129 WeakPolarHBondContact CZ3-O 3.2Å
130	Q	79.9	Confident	68	Low	152 Å²	152	84.5 Å²	84.5	71%	0.71	49%	0.49	S	S	*	.	S	Bend	trans	-148.6	152.1	178.4	-67.6	-174.5	-2.7	0	0	110.1	T128	T128-Q130 VanDerWaalsContact C-N 3.35Å; T128-Q130 PolarHBondContact OG1-O 3.46Å
131	P	81	Confident	64.8	Low	80 Å²	80	88.1 Å²	88.1	52%	0.519	51%	0.513	S	S	.	.			trans	-70.8	147.8	174.7	27.7	-32.4	0	0	0	112.4	W68 G71	W68-P131 HydrophobicContact CD2-CB 4.37Å; W68-P131 HydrophobicContact CG-CB 4.28Å; W68-P131 HydrophobicContact CZ2-CG 4.31Å; G71-P131 CarbonylContact O-C 3.57Å; G71-P131 WeakPolarHBondContact O-CA 3.28Å
132	V	72.7	Confident	61.6	Low	98 Å²	98	91.6 Å²	91.6	59%	0.594	53%	0.533	S	S	*	.			trans	-104.2	116.3	169.7	-176.8	0	0	0	0	107.9	G71	G71-V132 PolarHBondContact O-N 3.16Å
133	G	49.2	Very low	58.6	Low	78 Å²	78	95.3 Å²	95.3	80%	0.804	56%	0.559	S	S	*	*			trans	-67.5	144.9	-171	0	0	0	0	0	114.7
134	E	41	Very low	55.8	Low	172 Å²	172	95.9 Å²	95.9	80%	0.804	58%	0.58	S	S	*	*			trans	-93.3	162.6	-174.3	-62.9	-176.3	126.6	0	0	114.3	V72	V72-E134 HydrophobicContact CG1-CG 4.35Å
135	G	32.6	Very low	53.1	Low	80 Å²	80	103.9 Å²	103.9	83%	0.825	62%	0.617	S	S	*	*			trans	-143.5	117.8	151.6	0	0	0	0	0	108.6
136	S	36.7	Very low	50.5	Low	100 Å²	100	104.7 Å²	104.7	70%	0.699	62%	0.615	S	S	*	*			trans	-90.6	172.2	-178.4	71.9	0	0	0	0	111.2
137	D	32.5	Very low	48	Very low	127 Å²	127	106.9 Å²	106.9	68%	0.679	63%	0.627	S	S	*	*			cis	-135.6	146.1	7.9	-94.4	-70.1	0	0	0	108.7
138	S	33.1	Very low	45	Very low	80 Å²	80	112 Å²	112	56%	0.559	66%	0.659	S	S	*	*				71.1	136.5	61.8	106.2	0	0	0	0	113.3
139	H	29.5	Very low	41.9	Very low	178 Å²	178	117.6 Å²	117.6	82%	0.824	68%	0.681	S	S	*	*			cis	-140.6	163.3	5.7	-98.1	-79	0	0	0	112.3
140	S	23.9	Very low	38.9	Very low	105 Å²	105	120.1 Å²	120.1	73%	0.734	70%	0.699	S	S	*	*			trans	-158.6	117.6	160.5	-87.1	0	0	0	0	115.9
141	T	29.1	Very low	36.2	Very low	100 Å²	100	116 Å²	116	61%	0.613	70%	0.697	S	S	*	*			trans	64.6	138.4	141.6	69.3	0	0	0	0	123.7	K263	T141-K263 PolarHBondContact OG1-NZ 3.49Å
142	D	28.3	Very low	33.7	Very low	96 Å²	96	114.3 Å²	114.3	51%	0.513	69%	0.694	S	S	.	*			trans	86	112.6	137.3	-75.8	-42.8	0	0	0	123.2	K263	D142-K263 IonicContact OD2-NZ 3.84Å; D142-K263 PolarHBondContact OD2-NZ 2.76Å
143	S	31.4	Very low	31.5	Very low	93 Å²	93	114 Å²	114	65%	0.65	70%	0.697	S	S	*	*				48.5	113.1	103	-43.2	0	0	0	0	118.3
144	A	33	Very low	30.3	Very low	88 Å²	88	110.5 Å²	110.5	73%	0.727	66%	0.66	S	S	*	*				67.9	142.5	83.2	0	0	0	0	0	114.3
145	Q	35.5	Very low	30.1	Very low	170 Å²	170	102.4 Å²	102.4	79%	0.794	62%	0.623	S	S	*	*			cis	-169.6	172	3	-120.4	-168.3	86.7	0	0	107.6
146	N	31.9	Very low	30.2	Very low	104 Å²	104	102.2 Å²	102.2	56%	0.556	61%	0.607	S	S	*	*			cis	-164.2	157.4	-11.6	-157.7	-23.9	0	0	0	109.7
147	Q	35.8	Very low	29.8	Very low	158 Å²	158	99.2 Å²	99.2	74%	0.738	59%	0.589	S	S	*	*			trans	59.7	156.8	163.2	-82.4	155.1	78.8	0	0	119.6
148	T	26.8	Very low	29.7	Very low	114 Å²	114	94.1 Å²	94.1	70%	0.699	57%	0.566	S	S	*	*			cis	-142.1	151.7	12.8	-28.8	0	0	0	0	113
149	Q	27	Very low	29.3	Very low	165 Å²	165	97 Å²	97	77%	0.771	57%	0.57	S	S	*	*			trans	57.5	128.3	162	-86.2	-179.7	13.2	0	0	121.8
150	Q	25.7	Very low	29.1	Very low	184 Å²	184	99.5 Å²	99.5	86%	0.86	57%	0.573	S	S	*	*			trans	35.3	114.7	135.4	-61.8	179.7	1.4	0	0	118.8
151	G	24.2	Very low	29.1	Very low	66 Å²	66	100 Å²	100	68%	0.68	57%	0.571	S	S	*	*			cis	-157.9	149.4	0.2	0	0	0	0	0	111.5	S153	G151-S153 PolarHBondContact O-N 2.9Å
152	G	27.5	Very low	28.9	Very low	44 Å²	44	101 Å²	101	45%	0.454	58%	0.577	S	S	.	*			trans	-68.7	129.7	-173.1	0	0	0	0	0	111.8	A86 P87 G154	A86-G152 VanDerWaalsContact CB-O 3.24Å; A86-G152 WeakPolarHBondContact CB-O 3.32Å; P87-G152 WeakPolarHBondContact CD-O 3.41Å; G152-G154 PolarHBondContact O-N 3.28Å
153	S	26.3	Very low	28.9	Very low	92 Å²	92	101.4 Å²	101.4	64%	0.643	58%	0.582	S	S	*	*			trans	-72.4	117.5	144.7	73.3	0	0	0	0	106.3	R123 G151	R123-S153 PolarHBondContact NH2-O 3.2Å; R123-S153 PolarHBondContact NH2-OG 3.04Å; G151-S153 PolarHBondContact O-N 2.9Å
154	G	23.9	Very low	29	Very low	4 Å²	4	101.6 Å²	101.6	4%	0.041	58%	0.581	C	S	.	*			cis	86.7	85.1	19.3	0	0	0	0	0	109.9	P87 R123 G152	P87-G154 CarbonylContact O-C 3.53Å; P87-G154 VanDerWaalsContact O-C 3.29Å; P87-G154 WeakPolarHBondContact O-CA 3.4Å; R123-G154 PolarHBondContact NH1-O 3.46Å; R123-G154 PolarHBondContact NH2-O 3.11Å; G152-G154 PolarHBondContact O-N 3.28Å
155	A	37.3	Very low	28.5	Very low	2 Å²	2	104.3 Å²	104.3	2%	0.017	58%	0.583	C	S	.	*			trans	54.3	-117.3	141.7	0	0	0	0	0	119.7	G88 Q89 W90 R123	G88-A155 WeakPolarHBondContact O-CB 3.5Å; Q89-A155 WeakPolarHBondContact O-CB 3.34Å; W90-A155 HydrophobicContact CB-CB 4.4Å; W90-A155 HydrophobicContact CD2-CB 4.17Å; W90-A155 HydrophobicContact CG-CB 3.78Å; R123-A155 VanDerWaalsContact CZ-N 3.29Å; R123-A155 PolarHBondContact NE-O 3.26Å; R123-A155 PolarHBondContact NH1-O 2.92Å
156	P	35.9	Very low	28	Very low	77 Å²	77	104.8 Å²	104.8	50%	0.5	58%	0.577	S	S	.	*				-54.7	145.9	-85.6	3.2	16.7	0	0	0	115.3	Q89	Q89-P156 HydrophobicContact CB-CB 4.27Å; Q89-P156 VanDerWaalsContact O-CA 3.32Å; Q89-P156 WeakPolarHBondContact O-CA 3.37Å
157	A	26.5	Very low	27.6	Very low	37 Å²	37	106.2 Å²	106.2	31%	0.306	58%	0.581	S	S	.	*			trans	-161.4	146	143.7	0	0	0	0	0	112	Q89 P124	Q89-A157 VanDerWaalsContact CG-O 3.29Å; Q89-A157 WeakPolarHBondContact CG-O 3.5Å; Q89-A157 PolarHBondContact O-N 2.97Å; Q89-A157 VanDerWaalsContact OE1-CA 3.24Å; Q89-A157 VanDerWaalsContact OE1-N 3.12Å; Q89-A157 PolarHBondContact OE1-O 2.72Å; P124-A157 HydrophobicContact CB-CB 3.87Å; P124-A157 HydrophobicContact CG-CB 3.99Å; P124-A157 WeakPolarHBondContact CG-O 3.22Å
158	G	30.8	Very low	27.1	Very low	20 Å²	20	102 Å²	102	21%	0.206	58%	0.58	C	S	.	*	S	Bend	trans	132.9	122.4	-176.3	0	0	0	0	0	111.4	Q89 R160	Q89-G158 PolarHBondContact NE2-O 3.12Å; Q89-G158 PolarHBondContact OE1-O 2.76Å; G158-R160 PolarHBondContact O-N 2.93Å
159	Q	25.6	Very low	27.1	Very low	139 Å²	139	103.3 Å²	103.3	65%	0.65	58%	0.582	S	S	*	*	S	Bend	trans	44.5	62.1	167.6	-67.5	-167.8	-18.9	0	0	116.7	D60	D60-Q159 WeakPolarHBondContact OD1-CA 3.3Å; D60-Q159 WeakPolarHBondContact OD1-CG 3.5Å; D60-Q159 PolarHBondContact OD1-N 3.27Å; D60-Q159 WeakPolarHBondContact OD2-CG 3.5Å
160	R	24.6	Very low	27.2	Very low	232 Å²	232	102.1 Å²	102.1	88%	0.875	58%	0.58	S	S	*	*				-179.8	124.7	124.4	-93	152.4	177.4	-164.8	-4.8	109.3	G158	G158-R160 PolarHBondContact O-N 2.93Å
161	V	24	Very low	27.3	Very low	116 Å²	116	99.8 Å²	99.8	70%	0.703	57%	0.574	S	S	*	*				71.1	125.1	67.9	170.7	0	0	0	0	111.7
162	V	25.3	Very low	27.5	Very low	120 Å²	120	101.1 Å²	101.1	73%	0.727	57%	0.573	S	S	*	*			trans	77.4	87.3	164.7	167.5	0	0	0	0	116.5	P164	V162-P164 HydrophobicContact CG1-CG 4.49Å
163	V	28.1	Very low	27.5	Very low	104 Å²	104	103.1 Å²	103.1	63%	0.63	59%	0.585	S	S	*	*			trans	-41.7	126.3	131.4	167.4	0	0	0	0	109.3	D56	D56-V163 WeakPolarHBondContact OD2-CG2 3.45Å
164	P	32.4	Very low	27.7	Very low	97 Å²	97	104.7 Å²	104.7	63%	0.63	59%	0.591	S	S	*	*				-150	135.1	100.3	36.2	-16.4	0	0	0	116.6	V162	V162-P164 HydrophobicContact CG1-CG 4.49Å
165	L	22.9	Very low	28.1	Very low	145 Å²	145	112.7 Å²	112.7	76%	0.759	62%	0.624	S	S	*	*				55.5	130.2	112.7	-153.3	73.3	0	0	0	120.9
166	R	25.3	Very low	27.7	Very low	180 Å²	180	118.5 Å²	118.5	68%	0.679	66%	0.66	S	S	*	*			trans	81.4	150.1	144.7	-95.5	167.9	-176.2	-105.1	0.8	121.8
167	E	23.6	Very low	27.2	Very low	134 Å²	134	117.8 Å²	117.8	63%	0.626	67%	0.666	S	S	*	*			trans	30.1	120.4	140.3	-64.5	155.9	162.1	0	0	119.6	L169	E167-L169 HydrophobicContact CB-CD1 4.4Å
168	G	26.2	Very low	27.4	Very low	71 Å²	71	122 Å²	122	73%	0.732	68%	0.684	S	S	*	*			trans	153.2	49.3	-171.8	0	0	0	0	0	108.3
169	L	26.3	Very low	27.2	Very low	141 Å²	141	128.6 Å²	128.6	74%	0.738	71%	0.709	S	S	*	*				51.9	134.3	69.1	-77	174.5	0	0	0	112.3	E167	E167-L169 HydrophobicContact CB-CD1 4.4Å
170	L	28	Very low	27.4	Very low	139 Å²	139	127.2 Å²	127.2	73%	0.728	71%	0.714	S	S	*	*			trans	73.7	148.4	168.6	-41.3	-167.1	0	0	0	114.8
171	N	28.3	Very low	27.5	Very low	136 Å²	136	119.6 Å²	119.6	73%	0.727	71%	0.709	S	S	*	*			cis	-167.6	169.6	-19.1	-104.9	-7.3	0	0	0	107.4
172	S	27.9	Very low	27.8	Very low	94 Å²	94	119 Å²	119	66%	0.657	71%	0.71	S	S	*	*			cis	178.3	148.9	-29.4	173.1	0	0	0	0	108.5
173	A	27.9	Very low	28	Very low	86 Å²	86	119.6 Å²	119.6	71%	0.711	71%	0.709	S	S	*	*			trans	64.6	169.7	165.1	0	0	0	0	0	114.3
174	V	31.7	Very low	28	Very low	125 Å²	125	122.1 Å²	122.1	76%	0.758	72%	0.715	S	S	*	*			cis	-138.6	156.8	10.3	-122.6	0	0	0	0	108
175	K	31.5	Very low	28.1	Very low	171 Å²	171	122 Å²	122	74%	0.743	72%	0.717	S	S	*	*			cis	-160.7	137	12.8	-153.1	163.7	-179.4	177.1	0	110.9
176	T	28	Very low	28.2	Very low	125 Å²	125	122.3 Å²	122.3	77%	0.767	72%	0.719	S	S	*	*			trans	47.5	155.7	144.2	58.6	0	0	0	0	123.4
177	G	26.9	Very low	28.4	Very low	61 Å²	61	119 Å²	119	63%	0.629	72%	0.724	S	S	*	*			trans	119.2	81	160.4	0	0	0	0	0	111.7
178	N	29.9	Very low	28.6	Very low	127 Å²	127	116.2 Å²	116.2	68%	0.679	73%	0.731	S	S	*	*				59.6	126.5	70.8	-60.5	59.3	0	0	0	112.1
179	E	26	Very low	28.9	Very low	157 Å²	157	118.2 Å²	118.2	73%	0.734	73%	0.734	S	S	*	*			cis	-161.2	176.5	0.1	-125.8	161.5	146.3	0	0	111.6
180	S	31.3	Very low	29.5	Very low	110 Å²	110	117.9 Å²	117.9	77%	0.769	74%	0.737	S	S	*	*			trans	14.7	127.2	152.1	-54.6	0	0	0	0	118.6
181	G	25.4	Very low	29.7	Very low	73 Å²	73	121.3 Å²	121.3	75%	0.753	75%	0.746	S	S	*	*			cis	107.7	139.1	48.6	0	0	0	0	0	108.4
182	S	31.5	Very low	30	Very low	104 Å²	104	124.8 Å²	124.8	73%	0.727	76%	0.755	S	S	*	*				176.4	158.2	62.3	47.2	0	0	0	0	111.6
183	N	28.1	Very low	30.2	Very low	132 Å²	132	123.7 Å²	123.7	71%	0.706	76%	0.759	S	S	*	*			trans	62	151.1	149.6	-58.7	-9.9	0	0	0	119.6
184	M	29.7	Very low	30.5	Very low	156 Å²	156	124 Å²	124	77%	0.768	77%	0.77	S	S	*	*			cis	-128	143.2	14.4	-87.8	-63.5	172.8	0	0	115.4
185	S	33	Very low	30.9	Very low	95 Å²	95	124.4 Å²	124.4	66%	0.664	77%	0.768	S	S	*	*			trans	0.2	153.9	152.3	-46.4	0	0	0	0	125.7
186	D	24.9	Very low	32.2	Very low	151 Å²	151	124.2 Å²	124.2	81%	0.807	77%	0.767	S	S	*	*			trans	70.1	142.3	143.7	-90.6	-16.6	0	0	0	121.3
187	S	30.3	Very low	34.1	Very low	111 Å²	111	122.7 Å²	122.7	78%	0.776	75%	0.754	S	S	*	*			cis	-164.6	152	-17	-134.2	0	0	0	0	109.7
188	G	27.3	Very low	36.6	Very low	76 Å²	76	120.6 Å²	120.6	78%	0.784	73%	0.729	S	S	*	*			trans	160.2	50.5	174.7	0	0	0	0	0	122.2
189	S	33.9	Very low	39.3	Very low	113 Å²	113	121.2 Å²	121.2	79%	0.79	72%	0.721	S	S	*	*			trans	35.7	101.5	154	-155.7	0	0	0	0	122.2
190	V	37	Very low	42.2	Very low	133 Å²	133	117.8 Å²	117.8	81%	0.806	71%	0.711	S	S	*	*			trans	42.5	111.2	136	-169	0	0	0	0	120.4
191	K	32.6	Very low	44.8	Very low	211 Å²	211	115 Å²	115	92%	0.917	70%	0.7	S	S	*	*			trans	-149.2	113.7	139.6	-120.3	174.5	-174.2	177.8	0	113.9
192	K	35.3	Very low	47.8	Very low	209 Å²	209	112.5 Å²	112.5	91%	0.909	67%	0.669	S	S	*	*			trans	-9.9	117.7	160.9	-175.6	-175.5	-176	-178.3	0	118.1
193	G	31.6	Very low	50.6	Low	72 Å²	72	112.6 Å²	112.6	74%	0.742	65%	0.653	S	S	*	*			trans	139.9	118.3	160	0	0	0	0	0	113.7
194	G	35.2	Very low	53.6	Low	91 Å²	91	106.3 Å²	106.3	94%	0.938	62%	0.62	S	S	*	*			trans	-93.2	102.4	170.2	0	0	0	0	0	109.6
195	D	38.6	Very low	56.6	Low	134 Å²	134	100.9 Å²	100.9	72%	0.717	59%	0.594	S	S	*	*			trans	-101.3	159.2	-163.3	-157.5	7.9	0	0	0	114.7	D197	D195-D197 PolarHBondContact O-N 2.86Å
196	K	60.2	Low	59.1	Low	168 Å²	168	96.8 Å²	96.8	73%	0.73	57%	0.565	S	S	*	*			trans	-85.7	83.7	174.6	-64.7	177.2	-179.5	177.9	0	109.4	L198	K196-L198 PolarHBondContact O-N 3.01Å
197	D	66.6	Low	61.7	Low	93 Å²	93	91.6 Å²	91.6	50%	0.497	55%	0.547	S	S	.	.			trans	-62.2	77.9	-180	-170.9	45.9	0	0	0	113	D195 R199 R266	D195-D197 PolarHBondContact O-N 2.86Å; D197-R199 WeakPolarHBondContact OD1-CG 3.42Å; D197-R199 WeakPolarHBondContact OD2-CD 3.35Å; D197-R199 IonicContact OD2-CZ 2.58Å; D197-R199 IonicContact OD2-NE 2.98Å; D197-R199 IonicContact OD2-NH1 2.67Å; D197-R199 PolarHBondContact OD2-NH1 3.47Å; D197-R266 PolarHBondContact O-NH1 3.48Å
198	L	80.6	Confident	63.9	Low	16 Å²	16	88.7 Å²	88.7	8%	0.084	53%	0.534	C	S	.	.			trans	-76.9	139.5	159.2	-66.7	-179.1	0	0	0	107.7	K196 V204 I214 M217 I261 V264 R266	K196-L198 PolarHBondContact O-N 3.01Å; L198-V204 HydrophobicContact CD2-CG1 4.47Å; L198-I214 HydrophobicContact CB-CD1 3.94Å; L198-I214 HydrophobicContact CD1-CD1 4.38Å; L198-M217 HydrophobicContact CB-CE 3.62Å; L198-M217 WeakPolarHBondContact O-CE 3.38Å; L198-M217 VanDerWaalsContact O-SD 3.4Å; L198-I261 HydrophobicContact CD1-CG2 4.33Å; L198-V264 HydrophobicContact CD1-CB 4.16Å; L198-V264 HydrophobicContact CD1-CG1 4.04Å; L198-R266 HydrophobicContact CD2-CB 3.7Å; L198-R266 HydrophobicContact CD2-CG 4.2Å
199	R	86.2	Confident	66.4	Low	140 Å²	140	90.1 Å²	90.1	53%	0.528	53%	0.532	S	S	.	.			trans	-133.1	156.8	179.8	-59.7	-170.9	-61	-131.6	8.8	112.5	D197 G201 D202	D197-R199 WeakPolarHBondContact OD1-CG 3.42Å; D197-R199 WeakPolarHBondContact OD2-CD 3.35Å; D197-R199 IonicContact OD2-CZ 2.58Å; D197-R199 IonicContact OD2-NE 2.98Å; D197-R199 IonicContact OD2-NH1 2.67Å; D197-R199 PolarHBondContact OD2-NH1 3.47Å; R199-G201 PolarHBondContact O-N 3.09Å; R199-D202 PolarHBondContact N-OD2 3.43Å; R199-D202 VanDerWaalsContact O-CB 3.3Å; R199-D202 WeakPolarHBondContact O-CB 3.29Å; R199-D202 PolarHBondContact O-N 2.95Å
200	V	87.9	Confident	69.1	Low	86 Å²	86	88.3 Å²	88.3	52%	0.521	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	128.3	172.2	179.2	0	0	0	0	109.1	I214 M217	V200-I214 HydrophobicContact CG2-CG2 4.17Å; V200-M217 HydrophobicContact CG2-CB 4.17Å
201	G	85.3	Confident	71.6	Confident	51 Å²	51	86.4 Å²	86.4	53%	0.526	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.2	-10.8	-170.6	0	0	0	0	0	115.2	R199 I214	R199-G201 PolarHBondContact O-N 3.09Å; G201-I214 PolarHBondContact N-O 3.1Å
202	D	88.4	Confident	74.4	Confident	21 Å²	21	76.4 Å²	76.4	11%	0.112	45%	0.45	C	S	.	.			trans	-72.4	139.9	175.2	-84.4	-46.5	0	0	0	112.9	R199 V204 V213 I214 R266	R199-D202 PolarHBondContact N-OD2 3.43Å; R199-D202 VanDerWaalsContact O-CB 3.3Å; R199-D202 WeakPolarHBondContact O-CB 3.29Å; R199-D202 PolarHBondContact O-N 2.95Å; D202-V204 HydrophobicContact CB-CG1 4.41Å; D202-V213 WeakPolarHBondContact O-CA 3.25Å; D202-I214 HydrophobicContact CB-CD1 4.48Å; D202-I214 PolarHBondContact O-N 2.92Å; D202-R266 VanDerWaalsContact CG-CZ 3.45Å; D202-R266 VanDerWaalsContact CG-NE 3.26Å; D202-R266 IonicContact OD1-CZ 3.82Å; D202-R266 IonicContact OD1-NE 3.78Å; D202-R266 PolarHBondContact OD1-NE 3.36Å; D202-R266 IonicContact OD1-NH2 3.68Å; D202-R266 PolarHBondContact OD1-NH2 3.45Å; D202-R266 IonicContact OD2-CZ 2.65Å; D202-R266 IonicContact OD2-NE 2.64Å; D202-R266 PolarHBondContact OD2-NE 2.85Å; D202-R266 IonicContact OD2-NH1 2.79Å; D202-R266 IonicContact OD2-NH2 3.75Å; D202-R266 PolarHBondContact OD2-NH2 3.25Å
203	R	90.6	Very high	77.2	Confident	105 Å²	105	67.9 Å²	67.9	40%	0.396	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	126.7	168.5	-82.9	-83.2	172.6	-178.9	-10.4	109.9	G212 V213 D233 I267	R203-G212 WeakPolarHBondContact CA-O 3.35Å; R203-V213 HydrophobicContact CG-CG2 4.36Å; R203-D233 IonicContact CZ-OD1 2.83Å; R203-D233 IonicContact CZ-OD2 3.16Å; R203-D233 IonicContact NH1-OD1 3.24Å; R203-D233 PolarHBondContact NH1-OD1 2.97Å; R203-D233 IonicContact NH1-OD2 3.9Å; R203-D233 PolarHBondContact NH1-OD2 2.9Å; R203-D233 IonicContact NH2-OD1 3.73Å; R203-D233 PolarHBondContact NH2-OD1 3.28Å; R203-I267 HydrophobicContact CB-CB 4.49Å; R203-I267 PolarHBondContact O-N 3.46Å
204	V	91.2	Very high	80.1	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	154.4	-172.7	-65.9	0	0	0	0	113.6	L198 D202 V206 M211 G212 I214 V230 V264 I265	L198-V204 HydrophobicContact CD2-CG1 4.47Å; D202-V204 HydrophobicContact CB-CG1 4.41Å; V204-V206 HydrophobicContact CG2-CG2 4.46Å; V204-M211 WeakPolarHBondContact O-CA 3.24Å; V204-G212 PolarHBondContact N-O 3.34Å; V204-G212 PolarHBondContact O-N 3.03Å; V204-I214 HydrophobicContact CB-CG1 4.47Å; V204-I214 HydrophobicContact CG1-CD1 3.8Å; V204-I214 HydrophobicContact CG1-CG1 3.76Å; V204-I214 HydrophobicContact CG2-CG1 3.84Å; V204-V230 HydrophobicContact CG2-CG1 3.79Å; V204-V230 HydrophobicContact CG2-CG2 3.99Å; V204-V264 HydrophobicContact CB-CG1 3.58Å; V204-V264 HydrophobicContact CG1-CG1 3.68Å; V204-V264 HydrophobicContact CG2-CG1 3.83Å; V204-I265 CarbonylContact C-O 3.57Å; V204-I265 VanDerWaalsContact CA-O 3.24Å; V204-I265 WeakPolarHBondContact CA-O 3.49Å; V204-I265 WeakPolarHBondContact CB-O 3.28Å
205	L	90.9	Very high	82.9	Confident	42 Å²	42	65.6 Å²	65.6	22%	0.22	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	128.7	168.7	-167.4	66.9	0	0	0	108.9	M211 I265 I267	L205-M211 HydrophobicContact CD1-CG 3.69Å; L205-I265 PolarHBondContact N-O 2.88Å; L205-I265 PolarHBondContact O-N 3.48Å; L205-I267 HydrophobicContact CB-CD1 4.02Å; L205-I267 HydrophobicContact CB-CG1 4.08Å
206	V	87.3	Confident	85.4	Confident	10 Å²	10	62.1 Å²	62.1	6%	0.061	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	125.9	177.2	-172.7	0	0	0	0	108.7	V204 G208 K210 V230 L257 A259 V264	V204-V206 HydrophobicContact CG2-CG2 4.46Å; V206-G208 VanDerWaalsContact C-N 3.29Å; V206-G208 PolarHBondContact O-N 2.85Å; V206-K210 PolarHBondContact N-O 2.66Å; V206-K210 PolarHBondContact O-N 2.83Å; V206-K210 VanDerWaalsContact O-N 3.12Å; V206-V230 HydrophobicContact CG2-CB 4.29Å; V206-V230 HydrophobicContact CG2-CG1 4.17Å; V206-V230 HydrophobicContact CG2-CG2 3.95Å; V206-L257 HydrophobicContact CB-CD2 4.35Å; V206-L257 HydrophobicContact CG1-CD2 3.89Å; V206-A259 HydrophobicContact CG1-CB 3.55Å; V206-V264 HydrophobicContact CG2-CG2 4.31Å
207	G	78.6	Confident	86.9	Confident	41 Å²	41	57 Å²	57	42%	0.423	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.5	36	177.2	0	0	0	0	0	114.3	S209	G207-S209 PolarHBondContact O-N 2.98Å
208	G	76.5	Confident	87.9	Confident	50 Å²	50	53.2 Å²	53.2	52%	0.515	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.7	-8.9	173	0	0	0	0	0	117.1	V206	V206-G208 VanDerWaalsContact C-N 3.29Å; V206-G208 PolarHBondContact O-N 2.85Å
209	S	80.1	Confident	88.3	Confident	106 Å²	106	59.5 Å²	59.5	74%	0.741	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-144.4	-16.2	-178.2	-52.1	0	0	0	0	116.1	G207	G207-S209 PolarHBondContact O-N 2.98Å
210	K	89.9	Confident	88.4	Confident	75 Å²	75	53.3 Å²	53.3	33%	0.326	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	109.7	-177.6	-64.3	-170.1	174.8	-171.6	0	111	V206 L232 L236 L257	V206-K210 PolarHBondContact N-O 2.66Å; V206-K210 PolarHBondContact O-N 2.83Å; V206-K210 VanDerWaalsContact O-N 3.12Å; K210-L232 HydrophobicContact CB-CD1 4.25Å; K210-L232 HydrophobicContact CB-CD2 4.01Å; K210-L232 HydrophobicContact CD-CD1 4.04Å; K210-L236 HydrophobicContact CD-CB 4.23Å; K210-L236 PolarHBondContact NZ-O 3.29Å; K210-L257 HydrophobicContact CD-CD2 4.23Å
211	M	90.7	Very high	88.2	Confident	93 Å²	93	55 Å²	55	46%	0.458	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	146	177.3	-72.2	-178.4	50.4	0	0	112.2	V204 L205 L232 D233 I267	V204-M211 WeakPolarHBondContact O-CA 3.24Å; L205-M211 HydrophobicContact CD1-CG 3.69Å; M211-L232 VanDerWaalsContact O-CA 3.28Å; M211-L232 WeakPolarHBondContact O-CA 3.17Å; M211-L232 WeakPolarHBondContact O-CD2 3.38Å; M211-D233 PolarHBondContact O-N 3.41Å; M211-D233 VanDerWaalsContact O-N 3.12Å; M211-I267 HydrophobicContact CE-CD1 3.92Å; M211-I267 HydrophobicContact CG-CD1 3.82Å; M211-I267 HydrophobicContact SD-CD1 4.14Å
212	G	91.6	Very high	88.2	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.01	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.4	-165.4	175.3	0	0	0	0	0	113.9	R203 V204 E231	R203-G212 WeakPolarHBondContact CA-O 3.35Å; V204-G212 PolarHBondContact N-O 3.34Å; V204-G212 PolarHBondContact O-N 3.03Å; G212-E231 CarbonylContact C-O 3.58Å; G212-E231 WeakPolarHBondContact CA-O 3.04Å
213	V	92.9	Very high	88.1	Confident	31 Å²	31	56.3 Å²	56.3	19%	0.188	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	134.6	178.5	-178.4	0	0	0	0	109.6	D202 R203 R215 V230 E231	D202-V213 WeakPolarHBondContact O-CA 3.25Å; R203-V213 HydrophobicContact CG-CG2 4.36Å; V213-R215 PolarHBondContact O-N 3.32Å; V213-V230 WeakPolarHBondContact O-CA 3.15Å; V213-E231 PolarHBondContact N-O 3.33Å; V213-E231 PolarHBondContact O-N 2.88Å
214	I	93.8	Very high	87.6	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	125.2	173.3	-57.8	-178.9	0	0	0	109.2	L198 V200 G201 D202 V204 Y216 M217 V230	L198-I214 HydrophobicContact CB-CD1 3.94Å; L198-I214 HydrophobicContact CD1-CD1 4.38Å; V200-I214 HydrophobicContact CG2-CG2 4.17Å; G201-I214 PolarHBondContact N-O 3.1Å; D202-I214 HydrophobicContact CB-CD1 4.48Å; D202-I214 PolarHBondContact O-N 2.92Å; V204-I214 HydrophobicContact CB-CG1 4.47Å; V204-I214 HydrophobicContact CG1-CD1 3.8Å; V204-I214 HydrophobicContact CG1-CG1 3.76Å; V204-I214 HydrophobicContact CG2-CG1 3.84Å; I214-Y216 WeakPolarHBondContact CG2-O 3.5Å; I214-M217 HydrophobicContact CD1-CE 3.83Å; I214-M217 HydrophobicContact CG2-CE 4.37Å; I214-V230 HydrophobicContact CG1-CG2 4.43Å
215	R	92.5	Very high	87.2	Confident	115 Å²	115	63 Å²	63	43%	0.434	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	-21.9	176	-56.3	-62.5	-101.8	122.5	8.3	113.3	V213 G229 E231 F249	V213-R215 PolarHBondContact O-N 3.32Å; R215-G229 PolarHBondContact N-O 3.04Å; R215-E231 HydrophobicContact CG-CB 3.49Å; R215-E231 VanDerWaalsContact CG-CB 3.49Å; R215-E231 IonicContact CZ-OE2 3.24Å; R215-E231 IonicContact NE-OE2 2.87Å; R215-E231 PolarHBondContact NE-OE2 2.92Å; R215-E231 IonicContact NH2-OE2 2.74Å; R215-E231 PolarHBondContact NH2-OE2 3.48Å; R215-F249 HydrophobicContact CB-CB 3.84Å; R215-F249 HydrophobicContact CB-CD1 4.44Å; R215-F249 HydrophobicContact CB-CD2 3.62Å; R215-F249 HydrophobicContact CB-CE2 4.22Å; R215-F249 HydrophobicContact CB-CG 3.75Å; R215-F249 HydrophobicContact CG-CD2 4.08Å; R215-F249 HydrophobicContact CG-CE2 4.44Å
216	Y	92.4	Very high	87	Confident	60 Å²	60	66.5 Å²	66.5	24%	0.235	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	148.5	175.1	178.9	-92.6	0	0	0	110.5	I214 E219 T220 C228 G229 Y248 F258	I214-Y216 WeakPolarHBondContact CG2-O 3.5Å; Y216-E219 PolarHBondContact OH-O 3.01Å; Y216-E219 VanDerWaalsContact OH-O 3.07Å; Y216-T220 HydrophobicContact CE1-CG2 4.29Å; Y216-C228 CarbonylContact O-C 3.46Å; Y216-C228 WeakPolarHBondContact O-CA 3.49Å; Y216-G229 PolarHBondContact N-O 3.47Å; Y216-G229 PolarHBondContact O-N 3.1Å; Y216-Y248 HydrophobicContact CD1-CD1 4.08Å; Y216-Y248 HydrophobicContact CD2-CD1 4.31Å; Y216-Y248 AromaticContact CE1-CD1 3.7Å; Y216-Y248 HydrophobicContact CE1-CD1 3.7Å; Y216-Y248 HydrophobicContact CE1-CE1 4.37Å; Y216-Y248 AromaticContact CE2-CD1 3.95Å; Y216-Y248 HydrophobicContact CE2-CD1 3.95Å; Y216-Y248 HydrophobicContact CG-CD1 4.38Å; Y216-Y248 AromaticContact CZ-CD1 3.65Å; Y216-F258 HydrophobicContact CD1-CE1 4.17Å
217	M	89.9	Confident	87.3	Confident	60 Å²	60	68.6 Å²	68.6	30%	0.296	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	127.1	173.3	-177.6	173.5	-80.2	0	0	109	L198 V200 I214 W227 C228 I261	L198-M217 HydrophobicContact CB-CE 3.62Å; L198-M217 WeakPolarHBondContact O-CE 3.38Å; L198-M217 VanDerWaalsContact O-SD 3.4Å; V200-M217 HydrophobicContact CG2-CB 4.17Å; I214-M217 HydrophobicContact CD1-CE 3.83Å; I214-M217 HydrophobicContact CG2-CE 4.37Å; M217-W227 WeakPolarHBondContact CA-O 3.37Å; M217-C228 WeakPolarHBondContact CE-SG 3.45Å; M217-I261 HydrophobicContact CG-CD1 4.39Å
218	G	89.1	Confident	88	Confident	15 Å²	15	66.6 Å²	66.6	16%	0.155	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.1	-172.1	-179.3	0	0	0	0	0	113.1	W227	G218-W227 PolarHBondContact N-O 2.89Å; G218-W227 PolarHBondContact O-N 3.24Å
219	E	87.5	Confident	88.8	Confident	148 Å²	148	64.2 Å²	64.2	69%	0.692	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.4	154.5	170.9	-60.2	-167.1	138.7	0	0	111.6	Y216	Y216-E219 PolarHBondContact OH-O 3.01Å; Y216-E219 VanDerWaalsContact OH-O 3.07Å
220	T	89.1	Confident	89.5	Confident	10 Å²	10	59.2 Å²	59.2	6%	0.061	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	139.7	-178.5	57.5	0	0	0	0	113	Y216 F222 A223 W227 Y248 F258	Y216-T220 HydrophobicContact CE1-CG2 4.29Å; T220-F222 VanDerWaalsContact CB-CE1 3.48Å; T220-F222 HydrophobicContact CG2-CE1 3.72Å; T220-F222 HydrophobicContact CG2-CZ 3.84Å; T220-F222 PolarHBondContact O-N 3.37Å; T220-F222 VanDerWaalsContact O-N 3.12Å; T220-A223 CarbonylContact O-C 3.38Å; T220-A223 PolarHBondContact O-N 3.24Å; T220-A223 VanDerWaalsContact O-N 3.12Å; T220-A223 PolarHBondContact OG1-O 3.47Å; T220-W227 HydrophobicContact CG2-CB 3.88Å; T220-W227 HydrophobicContact CG2-CG 4.21Å; T220-Y248 HydrophobicContact CG2-CD1 4.37Å; T220-Y248 HydrophobicContact CG2-CE1 3.82Å; T220-F258 HydrophobicContact CG2-CD1 4.15Å; T220-F258 HydrophobicContact CG2-CE1 4.16Å
221	D	83.6	Confident	89.7	Confident	121 Å²	121	58 Å²	58	65%	0.647	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-31	-178.1	-53.2	-37.4	0	0	0	112.9	T246 Y248	D221-T246 WeakPolarHBondContact OD2-CB 3.37Å; D221-T246 VanDerWaalsContact OD2-CG2 3.3Å; D221-T246 WeakPolarHBondContact OD2-CG2 3.36Å; D221-T246 PolarHBondContact OD2-OG1 3.3Å; D221-Y248 WeakPolarHBondContact CB-OH 3.48Å; D221-Y248 VanDerWaalsContact CG-OH 3.31Å; D221-Y248 PolarHBondContact N-OH 3.09Å; D221-Y248 PolarHBondContact OD2-OH 2.79Å; D221-Y248 VanDerWaalsContact OD2-OH 3.07Å
222	F	86.3	Confident	89.8	Confident	76 Å²	76	53.9 Å²	53.9	33%	0.333	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-16	-176.5	64.6	-97.9	0	0	0	113.9	T220 W227 V243 Y248 F258	T220-F222 VanDerWaalsContact CB-CE1 3.48Å; T220-F222 HydrophobicContact CG2-CE1 3.72Å; T220-F222 HydrophobicContact CG2-CZ 3.84Å; T220-F222 PolarHBondContact O-N 3.37Å; T220-F222 VanDerWaalsContact O-N 3.12Å; F222-W227 HydrophobicContact CE2-CD2 4.39Å; F222-W227 HydrophobicContact CE2-CE3 4.35Å; F222-W227 HydrophobicContact CE2-CZ3 4.45Å; F222-V243 HydrophobicContact CB-CG1 4.21Å; F222-V243 HydrophobicContact CD1-CB 3.73Å; F222-V243 HydrophobicContact CD1-CG1 3.43Å; F222-V243 VanDerWaalsContact CD1-CG1 3.43Å; F222-V243 HydrophobicContact CD1-CG2 4.35Å; F222-V243 HydrophobicContact CE1-CB 3.85Å; F222-V243 HydrophobicContact CE1-CG1 3.88Å; F222-V243 HydrophobicContact CE1-CG2 3.99Å; F222-V243 HydrophobicContact CG-CG1 3.81Å; F222-Y248 HydrophobicContact CD1-CE2 4.45Å; F222-Y248 HydrophobicContact CE1-CE2 4.28Å; F222-F258 HydrophobicContact CE1-CD1 4.1Å; F222-F258 HydrophobicContact CE1-CE1 4.25Å; F222-F258 HydrophobicContact CE1-CG 4.25Å; F222-F258 HydrophobicContact CZ-CB 3.87Å; F222-F258 AromaticContact CZ-CD1 3.78Å; F222-F258 HydrophobicContact CZ-CD1 3.78Å; F222-F258 HydrophobicContact CZ-CD2 4.34Å; F222-F258 HydrophobicContact CZ-CE1 4.39Å; F222-F258 AromaticContact CZ-CG 3.74Å; F222-F258 HydrophobicContact CZ-CG 3.74Å
223	A	85.4	Confident	89.8	Confident	24 Å²	24	57.5 Å²	57.5	20%	0.198	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	130.3	-178.4	0	0	0	0	0	112.5	T220 W227	T220-A223 CarbonylContact O-C 3.38Å; T220-A223 PolarHBondContact O-N 3.24Å; T220-A223 VanDerWaalsContact O-N 3.12Å; T220-A223 PolarHBondContact OG1-O 3.47Å; A223-W227 HydrophobicContact CB-CH2 4.39Å; A223-W227 HydrophobicContact CB-CZ2 3.46Å; A223-W227 VanDerWaalsContact CB-CZ2 3.46Å; A223-W227 PolarHBondContact O-NE1 3.14Å
224	K	79.4	Confident	89.6	Confident	208 Å²	208	61.7 Å²	61.7	90%	0.904	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.9	153.8	178.4	-64.4	-174.5	177.6	-177	0	112.3
225	G	83.7	Confident	89.4	Confident	36 Å²	36	65.4 Å²	65.4	37%	0.371	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	88.4	179.8	-173.7	0	0	0	0	0	112.3	W227	G225-W227 VanDerWaalsContact O-CD1 3.3Å
226	E	86.8	Confident	89.2	Confident	117 Å²	117	63.9 Å²	63.9	55%	0.547	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	132.2	-175.4	-62.3	176.5	132.6	0	0	112.6	I261	E226-I261 HydrophobicContact CB-CD1 3.55Å; E226-I261 HydrophobicContact CB-CG1 4.2Å; E226-I261 PolarHBondContact O-N 2.94Å
227	W	93	Very high	89	Confident	53 Å²	53	61.7 Å²	61.7	20%	0.201	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	141.1	-177.4	-67.7	73.9	0	0	0	111.3	M217 G218 T220 F222 A223 G225 F258 P260	M217-W227 WeakPolarHBondContact CA-O 3.37Å; G218-W227 PolarHBondContact N-O 2.89Å; G218-W227 PolarHBondContact O-N 3.24Å; T220-W227 HydrophobicContact CG2-CB 3.88Å; T220-W227 HydrophobicContact CG2-CG 4.21Å; F222-W227 HydrophobicContact CE2-CD2 4.39Å; F222-W227 HydrophobicContact CE2-CE3 4.35Å; F222-W227 HydrophobicContact CE2-CZ3 4.45Å; A223-W227 HydrophobicContact CB-CH2 4.39Å; A223-W227 HydrophobicContact CB-CZ2 3.46Å; A223-W227 VanDerWaalsContact CB-CZ2 3.46Å; A223-W227 PolarHBondContact O-NE1 3.14Å; G225-W227 VanDerWaalsContact O-CD1 3.3Å; W227-F258 HydrophobicContact CB-CD1 4.48Å; W227-F258 HydrophobicContact CE3-CB 3.95Å; W227-F258 HydrophobicContact CZ3-CB 4.48Å; W227-P260 HydrophobicContact CD2-CG 4.32Å; W227-P260 HydrophobicContact CE3-CG 4.1Å; W227-P260 HydrophobicContact CH2-CG 3.78Å; W227-P260 HydrophobicContact CZ2-CG 3.99Å; W227-P260 VanDerWaalsContact CZ3-CD 3.48Å; W227-P260 HydrophobicContact CZ3-CG 3.85Å
228	C	92.8	Very high	89	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	123.1	164.7	-68.8	0	0	0	0	109.2	Y216 M217 V230 F258 A259 V264	Y216-C228 CarbonylContact O-C 3.46Å; Y216-C228 WeakPolarHBondContact O-CA 3.49Å; M217-C228 WeakPolarHBondContact CE-SG 3.45Å; C228-V230 HydrophobicContact CB-CG2 4.05Å; C228-F258 WeakPolarHBondContact O-CA 3.42Å; C228-A259 PolarHBondContact N-O 3.26Å; C228-A259 PolarHBondContact O-N 3.38Å; C228-V264 HydrophobicContact CB-CG2 3.98Å
229	G	93.9	Very high	89	Confident	0 Å²	0	68 Å²	68	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	117.2	159.8	0	0	0	0	0	109.3	R215 Y216 F249	R215-G229 PolarHBondContact N-O 3.04Å; Y216-G229 PolarHBondContact N-O 3.47Å; Y216-G229 PolarHBondContact O-N 3.1Å; G229-F249 VanDerWaalsContact CA-CE1 3.5Å
230	V	94.3	Very high	89.2	Confident	1 Å²	1	63 Å²	63	1%	0.006	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	130.5	-175.4	-176	0	0	0	0	109.1	V204 V206 V213 I214 C228 L232 L257	V204-V230 HydrophobicContact CG2-CG1 3.79Å; V204-V230 HydrophobicContact CG2-CG2 3.99Å; V206-V230 HydrophobicContact CG2-CB 4.29Å; V206-V230 HydrophobicContact CG2-CG1 4.17Å; V206-V230 HydrophobicContact CG2-CG2 3.95Å; V213-V230 WeakPolarHBondContact O-CA 3.15Å; I214-V230 HydrophobicContact CG1-CG2 4.43Å; C228-V230 HydrophobicContact CB-CG2 4.05Å; V230-L232 HydrophobicContact CG1-CD2 4Å; V230-L257 PolarHBondContact N-O 3.49Å; V230-L257 PolarHBondContact O-N 3.07Å
231	E	94.8	Very high	89.1	Confident	49 Å²	49	62.5 Å²	62.5	23%	0.229	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	111.9	165.9	175.5	167.3	-148.9	0	0	107.3	G212 V213 R215 F249 C251	G212-E231 CarbonylContact C-O 3.58Å; G212-E231 WeakPolarHBondContact CA-O 3.04Å; V213-E231 PolarHBondContact N-O 3.33Å; V213-E231 PolarHBondContact O-N 2.88Å; R215-E231 HydrophobicContact CG-CB 3.49Å; R215-E231 VanDerWaalsContact CG-CB 3.49Å; R215-E231 IonicContact CZ-OE2 3.24Å; R215-E231 IonicContact NE-OE2 2.87Å; R215-E231 PolarHBondContact NE-OE2 2.92Å; R215-E231 IonicContact NH2-OE2 2.74Å; R215-E231 PolarHBondContact NH2-OE2 3.48Å; E231-F249 HydrophobicContact CB-CE2 4.19Å; E231-C251 HydrophobicContact CB-CB 4.18Å; E231-C251 HydrophobicContact CG-CB 3.66Å; E231-C251 WeakPolarHBondContact OE1-CA 3.11Å; E231-C251 WeakPolarHBondContact OE1-CB 3.42Å
232	L	93.6	Very high	89.4	Confident	7 Å²	7	57.7 Å²	57.7	4%	0.037	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	157	179.1	-58.3	-178.9	0	0	0	110.9	K210 M211 V230 E234 L236 F255 L257	K210-L232 HydrophobicContact CB-CD1 4.25Å; K210-L232 HydrophobicContact CB-CD2 4.01Å; K210-L232 HydrophobicContact CD-CD1 4.04Å; M211-L232 VanDerWaalsContact O-CA 3.28Å; M211-L232 WeakPolarHBondContact O-CA 3.17Å; M211-L232 WeakPolarHBondContact O-CD2 3.38Å; V230-L232 HydrophobicContact CG1-CD2 4Å; L232-E234 VanDerWaalsContact C-N 3.27Å; L232-E234 WeakPolarHBondContact CB-O 3.4Å; L232-L236 HydrophobicContact CD1-CB 4.18Å; L232-F255 PolarHBondContact N-O 3.07Å; L232-F255 WeakPolarHBondContact O-CD1 3.46Å; L232-L257 HydrophobicContact CD1-CB 4.22Å; L232-L257 HydrophobicContact CD1-CD2 4.17Å; L232-L257 HydrophobicContact CD2-CD2 4.38Å; L232-L257 HydrophobicContact CG-CB 4.29Å
233	D	91.4	Very high	89.5	Confident	76 Å²	76	55.8 Å²	55.8	41%	0.406	29%	0.29	S	S	.	.	S	Bend	trans	-74.1	-20.9	172.3	-59.7	-79.1	0	0	0	112.6	R203 M211	R203-D233 IonicContact CZ-OD1 2.83Å; R203-D233 IonicContact CZ-OD2 3.16Å; R203-D233 IonicContact NH1-OD1 3.24Å; R203-D233 PolarHBondContact NH1-OD1 2.97Å; R203-D233 IonicContact NH1-OD2 3.9Å; R203-D233 PolarHBondContact NH1-OD2 2.9Å; R203-D233 IonicContact NH2-OD1 3.73Å; R203-D233 PolarHBondContact NH2-OD1 3.28Å; M211-D233 PolarHBondContact O-N 3.41Å; M211-D233 VanDerWaalsContact O-N 3.12Å
234	E	89.3	Confident	89.4	Confident	120 Å²	120	59.4 Å²	59.4	56%	0.561	32%	0.32	S	S	*	.	S	Bend	trans	-119.3	156	-176.9	-68.5	-171.5	169.1	0	0	112	L232 L236	L232-E234 VanDerWaalsContact C-N 3.27Å; L232-E234 WeakPolarHBondContact CB-O 3.4Å; E234-L236 HydrophobicContact CB-CD1 4.28Å; E234-L236 HydrophobicContact CB-CG 4.06Å; E234-L236 PolarHBondContact O-N 3.32Å; E234-L236 VanDerWaalsContact OE2-CD1 3.24Å; E234-L236 WeakPolarHBondContact OE2-CD1 3.47Å
235	P	87.9	Confident	89.6	Confident	78 Å²	78	53.1 Å²	53.1	51%	0.506	31%	0.313	S	S	.	.	S	Bend	trans	-73	42.7	179.7	32	-37.8	0	0	0	114.2	K254 F255	P235-K254 CarbonylContact C-O 3.56Å; P235-K254 VanDerWaalsContact CA-O 3.26Å; P235-K254 WeakPolarHBondContact CA-O 3.42Å; P235-K254 HydrophobicContact CB-CB 4.42Å; P235-F255 HydrophobicContact CB-CD2 4.32Å; P235-F255 HydrophobicContact CB-CE1 4.42Å; P235-F255 HydrophobicContact CB-CE2 3.74Å; P235-F255 HydrophobicContact CB-CZ 3.8Å; P235-F255 HydrophobicContact CG-CZ 4.31Å
236	L	88.3	Confident	89.8	Confident	83 Å²	83	53.9 Å²	53.9	44%	0.435	31%	0.311	S	S	.	.			trans	-102.7	9.7	-178.8	-60.6	-177.5	0	0	0	113.3	K210 L232 E234 K254	K210-L236 HydrophobicContact CD-CB 4.23Å; K210-L236 PolarHBondContact NZ-O 3.29Å; L232-L236 HydrophobicContact CD1-CB 4.18Å; E234-L236 HydrophobicContact CB-CD1 4.28Å; E234-L236 HydrophobicContact CB-CG 4.06Å; E234-L236 PolarHBondContact O-N 3.32Å; E234-L236 VanDerWaalsContact OE2-CD1 3.24Å; E234-L236 WeakPolarHBondContact OE2-CD1 3.47Å; L236-K254 PolarHBondContact N-O 3.28Å
237	G	88.6	Confident	90	Very high	13 Å²	13	54 Å²	54	13%	0.134	31%	0.307	C	S	.	.			trans	-79.6	171.2	175.7	0	0	0	0	0	112.9	K254 G256	G237-K254 WeakPolarHBondContact CA-O 3.41Å; G237-K254 PolarHBondContact N-O 2.88Å; G237-G256 CarbonylContact C-O 3.55Å; G237-G256 WeakPolarHBondContact CA-O 3.26Å
238	K	89.6	Confident	89.9	Confident	182 Å²	182	53.1 Å²	53.1	79%	0.791	30%	0.303	S	S	*	.	S	Bend	trans	-104.4	-11.4	-177.8	-66.5	-174.7	178.4	-175.1	0	113.6	G256 L257	K238-G256 PolarHBondContact N-O 2.99Å; K238-L257 HydrophobicContact CB-CD1 4.45Å; K238-L257 HydrophobicContact CD-CD1 4.1Å; K238-L257 HydrophobicContact CG-CD1 3.98Å
239	N	89.3	Confident	89.9	Confident	26 Å²	26	53.9 Å²	53.9	14%	0.139	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-151.9	-170.1	-176.3	57.4	69	0	0	0	112	G241 A242 K254 F255 G256 F258	N239-G241 WeakPolarHBondContact OD1-CA 3.41Å; N239-G241 PolarHBondContact OD1-N 3.16Å; N239-A242 VanDerWaalsContact CB-O 3.27Å; N239-A242 WeakPolarHBondContact CB-O 3.41Å; N239-K254 WeakPolarHBondContact O-CA 3.34Å; N239-K254 PolarHBondContact O-N 2.84Å; N239-K254 VanDerWaalsContact O-N 3.1Å; N239-F255 PolarHBondContact O-N 2.83Å; N239-G256 PolarHBondContact N-O 2.87Å; N239-G256 PolarHBondContact ND2-O 3.06Å; N239-G256 WeakPolarHBondContact O-CA 3.45Å; N239-G256 PolarHBondContact O-N 2.84Å; N239-G256 WeakPolarHBondContact OD1-CA 3.45Å; N239-G256 PolarHBondContact OD1-O 3.42Å; N239-F258 WeakPolarHBondContact ND2-CD2 3.45Å
240	D	91.9	Very high	89.9	Confident	42 Å²	42	59.1 Å²	59.1	23%	0.225	33%	0.331	C	S	.	.	S	Bend	trans	-111.7	15.7	177.2	74.7	-40.8	0	0	0	112.5	A242 R247 C251	D240-A242 PolarHBondContact OD1-N 2.71Å; D240-A242 VanDerWaalsContact OD1-N 3.15Å; D240-R247 PolarHBondContact O-NH1 3.01Å; D240-R247 IonicContact OD1-NH1 2.66Å; D240-R247 IonicContact OD2-CZ 2.72Å; D240-R247 IonicContact OD2-NH1 2.79Å; D240-R247 PolarHBondContact OD2-NH1 3.18Å; D240-R247 IonicContact OD2-NH2 2.94Å; D240-R247 PolarHBondContact OD2-NH2 2.97Å; D240-C251 PolarHBondContact O-N 3.43Å; D240-C251 VanDerWaalsContact O-N 3.1Å; D240-C251 PolarHBondContact O-SG 3.36Å
241	G	86.9	Confident	89.7	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	33%	0.334	C	S	.	.	S	Bend	trans	97	-0.9	-170.9	0	0	0	0	0	114.7	N239 Y248 F249	N239-G241 WeakPolarHBondContact OD1-CA 3.41Å; N239-G241 PolarHBondContact OD1-N 3.16Å; G241-Y248 PolarHBondContact O-N 2.88Å; G241-F249 CarbonylContact C-O 3.59Å; G241-F249 WeakPolarHBondContact CA-O 3.4Å; G241-F249 PolarHBondContact O-N 2.96Å; G241-F249 VanDerWaalsContact O-N 3.16Å
242	A	90.8	Very high	89.3	Confident	21 Å²	21	62.4 Å²	62.4	17%	0.174	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	146.7	169.3	0	0	0	0	0	113	N239 D240 T246 R247	N239-A242 VanDerWaalsContact CB-O 3.27Å; N239-A242 WeakPolarHBondContact CB-O 3.41Å; D240-A242 PolarHBondContact OD1-N 2.71Å; D240-A242 VanDerWaalsContact OD1-N 3.15Å; A242-T246 CarbonylContact C-O 3.6Å; A242-T246 VanDerWaalsContact CA-O 3.24Å; A242-T246 WeakPolarHBondContact CA-O 3.18Å; A242-T246 WeakPolarHBondContact CB-O 3.44Å; A242-R247 HydrophobicContact CB-CB 4.05Å; A242-R247 HydrophobicContact CB-CG 4.32Å
243	V	88.8	Confident	89	Confident	36 Å²	36	66.6 Å²	66.6	22%	0.218	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	133	176.1	-177.5	0	0	0	0	109	F222 G245 T246 Y248 F258	F222-V243 HydrophobicContact CB-CG1 4.21Å; F222-V243 HydrophobicContact CD1-CB 3.73Å; F222-V243 HydrophobicContact CD1-CG1 3.43Å; F222-V243 VanDerWaalsContact CD1-CG1 3.43Å; F222-V243 HydrophobicContact CD1-CG2 4.35Å; F222-V243 HydrophobicContact CE1-CB 3.85Å; F222-V243 HydrophobicContact CE1-CG1 3.88Å; F222-V243 HydrophobicContact CE1-CG2 3.99Å; F222-V243 HydrophobicContact CG-CG1 3.81Å; V243-G245 PolarHBondContact O-N 3.44Å; V243-T246 PolarHBondContact N-O 3.24Å; V243-T246 PolarHBondContact O-N 3Å; V243-Y248 HydrophobicContact CB-CE2 4.33Å; V243-F258 HydrophobicContact CG2-CD2 3.72Å; V243-F258 HydrophobicContact CG2-CE2 3.43Å; V243-F258 VanDerWaalsContact CG2-CE2 3.43Å; V243-F258 HydrophobicContact CG2-CZ 4.15Å
244	A	83	Confident	88.9	Confident	100 Å²	100	69.6 Å²	69.6	83%	0.826	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	19.9	179.8	0	0	0	0	0	115.8
245	G	84.1	Confident	89	Confident	75 Å²	75	66.1 Å²	66.1	77%	0.773	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.4	-25.3	-177.4	0	0	0	0	0	114.1	V243	V243-G245 PolarHBondContact O-N 3.44Å
246	T	87.1	Confident	89.2	Confident	53 Å²	53	62.4 Å²	62.4	33%	0.325	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	126.7	173.7	-56.3	0	0	0	0	110.2	D221 A242 V243 Y248	D221-T246 WeakPolarHBondContact OD2-CB 3.37Å; D221-T246 VanDerWaalsContact OD2-CG2 3.3Å; D221-T246 WeakPolarHBondContact OD2-CG2 3.36Å; D221-T246 PolarHBondContact OD2-OG1 3.3Å; A242-T246 CarbonylContact C-O 3.6Å; A242-T246 VanDerWaalsContact CA-O 3.24Å; A242-T246 WeakPolarHBondContact CA-O 3.18Å; A242-T246 WeakPolarHBondContact CB-O 3.44Å; V243-T246 PolarHBondContact N-O 3.24Å; V243-T246 PolarHBondContact O-N 3Å; T246-Y248 HydrophobicContact CG2-CD2 4.14Å; T246-Y248 HydrophobicContact CG2-CE1 4.15Å; T246-Y248 HydrophobicContact CG2-CE2 3.62Å; T246-Y248 WeakPolarHBondContact O-CD2 3.49Å; T246-Y248 WeakPolarHBondContact O-CE2 3.41Å
247	R	91.6	Very high	89.5	Confident	120 Å²	120	59.3 Å²	59.3	45%	0.453	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	122.7	171.7	-175.9	174.1	-65.5	-72.1	1.6	110.3	D240 A242 F249 Q250	D240-R247 PolarHBondContact O-NH1 3.01Å; D240-R247 IonicContact OD1-NH1 2.66Å; D240-R247 IonicContact OD2-CZ 2.72Å; D240-R247 IonicContact OD2-NH1 2.79Å; D240-R247 PolarHBondContact OD2-NH1 3.18Å; D240-R247 IonicContact OD2-NH2 2.94Å; D240-R247 PolarHBondContact OD2-NH2 2.97Å; A242-R247 HydrophobicContact CB-CB 4.05Å; A242-R247 HydrophobicContact CB-CG 4.32Å; R247-F249 WeakPolarHBondContact CG-O 3.4Å; R247-F249 PolarHBondContact NH1-O 2.83Å; R247-Q250 VanDerWaalsContact CZ-OE1 3.24Å
248	Y	90.6	Very high	89.7	Confident	33 Å²	33	59.7 Å²	59.7	13%	0.129	33%	0.328	C	S	.	.			trans	-103.6	-33.8	-179.3	-60.4	-99.1	0	0	0	111.8	Y216 T220 D221 F222 G241 V243 T246 F258	Y216-Y248 HydrophobicContact CD1-CD1 4.08Å; Y216-Y248 HydrophobicContact CD2-CD1 4.31Å; Y216-Y248 AromaticContact CE1-CD1 3.7Å; Y216-Y248 HydrophobicContact CE1-CD1 3.7Å; Y216-Y248 HydrophobicContact CE1-CE1 4.37Å; Y216-Y248 AromaticContact CE2-CD1 3.95Å; Y216-Y248 HydrophobicContact CE2-CD1 3.95Å; Y216-Y248 HydrophobicContact CG-CD1 4.38Å; Y216-Y248 AromaticContact CZ-CD1 3.65Å; T220-Y248 HydrophobicContact CG2-CD1 4.37Å; T220-Y248 HydrophobicContact CG2-CE1 3.82Å; D221-Y248 WeakPolarHBondContact CB-OH 3.48Å; D221-Y248 VanDerWaalsContact CG-OH 3.31Å; D221-Y248 PolarHBondContact N-OH 3.09Å; D221-Y248 PolarHBondContact OD2-OH 2.79Å; D221-Y248 VanDerWaalsContact OD2-OH 3.07Å; F222-Y248 HydrophobicContact CD1-CE2 4.45Å; F222-Y248 HydrophobicContact CE1-CE2 4.28Å; G241-Y248 PolarHBondContact O-N 2.88Å; V243-Y248 HydrophobicContact CB-CE2 4.33Å; T246-Y248 HydrophobicContact CG2-CD2 4.14Å; T246-Y248 HydrophobicContact CG2-CE1 4.15Å; T246-Y248 HydrophobicContact CG2-CE2 3.62Å; T246-Y248 WeakPolarHBondContact O-CD2 3.49Å; T246-Y248 WeakPolarHBondContact O-CE2 3.41Å; Y248-F258 HydrophobicContact CD1-CE1 4.28Å; Y248-F258 HydrophobicContact CD2-CE1 4.1Å; Y248-F258 AromaticContact CD2-CZ 3.6Å; Y248-F258 HydrophobicContact CD2-CZ 3.6Å; Y248-F258 HydrophobicContact CE2-CZ 4.36Å; Y248-F258 AromaticContact CG-CE1 3.9Å; Y248-F258 HydrophobicContact CG-CE1 3.9Å; Y248-F258 AromaticContact CG-CZ 3.71Å; Y248-F258 HydrophobicContact CG-CZ 3.71Å
249	F	92.7	Very high	89.8	Confident	16 Å²	16	51.4 Å²	51.4	7%	0.07	29%	0.294	C	S	.	.			trans	-149	176.8	171.8	60.8	-79.6	0	0	0	110.7	R215 G229 E231 G241 R247 C251 F258	R215-F249 HydrophobicContact CB-CB 3.84Å; R215-F249 HydrophobicContact CB-CD1 4.44Å; R215-F249 HydrophobicContact CB-CD2 3.62Å; R215-F249 HydrophobicContact CB-CE2 4.22Å; R215-F249 HydrophobicContact CB-CG 3.75Å; R215-F249 HydrophobicContact CG-CD2 4.08Å; R215-F249 HydrophobicContact CG-CE2 4.44Å; G229-F249 VanDerWaalsContact CA-CE1 3.5Å; E231-F249 HydrophobicContact CB-CE2 4.19Å; G241-F249 CarbonylContact C-O 3.59Å; G241-F249 WeakPolarHBondContact CA-O 3.4Å; G241-F249 PolarHBondContact O-N 2.96Å; G241-F249 VanDerWaalsContact O-N 3.16Å; R247-F249 WeakPolarHBondContact CG-O 3.4Å; R247-F249 PolarHBondContact NH1-O 2.83Å; F249-C251 HydrophobicContact CD2-CB 4.29Å; F249-C251 HydrophobicContact CE2-CB 4.18Å; F249-F258 HydrophobicContact CD1-CZ 4.15Å; F249-F258 HydrophobicContact CE1-CE1 4.27Å; F249-F258 AromaticContact CE1-CE2 3.78Å; F249-F258 HydrophobicContact CE1-CE2 3.78Å; F249-F258 AromaticContact CE1-CZ 3.64Å; F249-F258 HydrophobicContact CE1-CZ 3.64Å; F249-F258 HydrophobicContact CZ-CE2 4.49Å
250	Q	92.6	Very high	89.9	Confident	110 Å²	110	51.5 Å²	51.5	51%	0.514	30%	0.296	S	S	.	.			trans	-119.5	125.4	173.5	-173	64.8	65.3	0	0	109.2	R247	R247-Q250 VanDerWaalsContact CZ-OE1 3.24Å
251	C	90.4	Very high	89.6	Confident	10 Å²	10	51.1 Å²	51.1	7%	0.068	29%	0.293	C	S	.	.			trans	-142.6	-172.6	167.5	62.2	0	0	0	0	109.2	E231 D240 F249 F255 G256	E231-C251 HydrophobicContact CB-CB 4.18Å; E231-C251 HydrophobicContact CG-CB 3.66Å; E231-C251 WeakPolarHBondContact OE1-CA 3.11Å; E231-C251 WeakPolarHBondContact OE1-CB 3.42Å; D240-C251 PolarHBondContact O-N 3.43Å; D240-C251 VanDerWaalsContact O-N 3.1Å; D240-C251 PolarHBondContact O-SG 3.36Å; F249-C251 HydrophobicContact CD2-CB 4.29Å; F249-C251 HydrophobicContact CE2-CB 4.18Å; C251-F255 HydrophobicContact CB-CB 4.41Å; C251-G256 VanDerWaalsContact SG-CA 3.51Å; C251-G256 PolarHBondContact SG-N 2.79Å
252	L	86.6	Confident	89.4	Confident	109 Å²	109	58.2 Å²	58.2	57%	0.571	33%	0.326	S	S	*	.			trans	-76.1	153.9	173.4	-72.1	173.3	0	0	0	111.9	K254 F255	L252-K254 PolarHBondContact O-N 2.84Å; L252-F255 HydrophobicContact CB-CB 4.41Å; L252-F255 HydrophobicContact CB-CD2 3.37Å; L252-F255 HydrophobicContact CB-CE2 3.77Å; L252-F255 HydrophobicContact CB-CG 3.99Å; L252-F255 HydrophobicContact CD1-CD2 4.49Å; L252-F255 HydrophobicContact CD1-CE2 4.18Å; L252-F255 HydrophobicContact CD1-CZ 4.41Å; L252-F255 WeakPolarHBondContact O-CB 3.23Å; L252-F255 PolarHBondContact O-N 3.01Å
253	P	87.1	Confident	89.1	Confident	95 Å²	95	60.5 Å²	60.5	62%	0.617	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	130	175.4	-24.2	34.5	0	0	0	112.1	F255	P253-F255 WeakPolarHBondContact O-CD2 3.19Å
254	K	89.3	Confident	88.9	Confident	140 Å²	140	59.3 Å²	59.3	61%	0.609	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.2	14.7	-172.7	-46.4	176.9	-177.9	176.9	0	115.5	P235 L236 G237 N239 L252	P235-K254 CarbonylContact C-O 3.56Å; P235-K254 VanDerWaalsContact CA-O 3.26Å; P235-K254 WeakPolarHBondContact CA-O 3.42Å; P235-K254 HydrophobicContact CB-CB 4.42Å; L236-K254 PolarHBondContact N-O 3.28Å; G237-K254 WeakPolarHBondContact CA-O 3.41Å; G237-K254 PolarHBondContact N-O 2.88Å; N239-K254 WeakPolarHBondContact O-CA 3.34Å; N239-K254 PolarHBondContact O-N 2.84Å; N239-K254 VanDerWaalsContact O-N 3.1Å; L252-K254 PolarHBondContact O-N 2.84Å
255	F	91.3	Very high	89.1	Confident	46 Å²	46	59.7 Å²	59.7	20%	0.202	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-20.4	172.1	-70	-106.4	0	0	0	112.7	L232 P235 N239 C251 L252 P253	L232-F255 PolarHBondContact N-O 3.07Å; L232-F255 WeakPolarHBondContact O-CD1 3.46Å; P235-F255 HydrophobicContact CB-CD2 4.32Å; P235-F255 HydrophobicContact CB-CE1 4.42Å; P235-F255 HydrophobicContact CB-CE2 3.74Å; P235-F255 HydrophobicContact CB-CZ 3.8Å; P235-F255 HydrophobicContact CG-CZ 4.31Å; N239-F255 PolarHBondContact O-N 2.83Å; C251-F255 HydrophobicContact CB-CB 4.41Å; L252-F255 HydrophobicContact CB-CB 4.41Å; L252-F255 HydrophobicContact CB-CD2 3.37Å; L252-F255 HydrophobicContact CB-CE2 3.77Å; L252-F255 HydrophobicContact CB-CG 3.99Å; L252-F255 HydrophobicContact CD1-CD2 4.49Å; L252-F255 HydrophobicContact CD1-CE2 4.18Å; L252-F255 HydrophobicContact CD1-CZ 4.41Å; L252-F255 WeakPolarHBondContact O-CB 3.23Å; L252-F255 PolarHBondContact O-N 3.01Å; P253-F255 WeakPolarHBondContact O-CD2 3.19Å
256	G	92.8	Very high	89.2	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	133.5	179.8	0	0	0	0	0	113.2	G237 K238 N239 C251	G237-G256 CarbonylContact C-O 3.55Å; G237-G256 WeakPolarHBondContact CA-O 3.26Å; K238-G256 PolarHBondContact N-O 2.99Å; N239-G256 PolarHBondContact N-O 2.87Å; N239-G256 PolarHBondContact ND2-O 3.06Å; N239-G256 WeakPolarHBondContact O-CA 3.45Å; N239-G256 PolarHBondContact O-N 2.84Å; N239-G256 WeakPolarHBondContact OD1-CA 3.45Å; N239-G256 PolarHBondContact OD1-O 3.42Å; C251-G256 VanDerWaalsContact SG-CA 3.51Å; C251-G256 PolarHBondContact SG-N 2.79Å
257	L	94.1	Very high	88.9	Confident	18 Å²	18	61.4 Å²	61.4	9%	0.094	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	137	175.2	-177.9	64.2	0	0	0	110.2	V206 K210 V230 L232 K238	V206-L257 HydrophobicContact CB-CD2 4.35Å; V206-L257 HydrophobicContact CG1-CD2 3.89Å; K210-L257 HydrophobicContact CD-CD2 4.23Å; V230-L257 PolarHBondContact N-O 3.49Å; V230-L257 PolarHBondContact O-N 3.07Å; L232-L257 HydrophobicContact CD1-CB 4.22Å; L232-L257 HydrophobicContact CD1-CD2 4.17Å; L232-L257 HydrophobicContact CD2-CD2 4.38Å; L232-L257 HydrophobicContact CG-CB 4.29Å; K238-L257 HydrophobicContact CB-CD1 4.45Å; K238-L257 HydrophobicContact CD-CD1 4.1Å; K238-L257 HydrophobicContact CG-CD1 3.98Å
258	F	93.6	Very high	86.9	Confident	22 Å²	22	58.7 Å²	58.7	10%	0.096	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	137.1	169.3	-70.3	-103.3	0	0	0	110	Y216 T220 F222 W227 C228 N239 V243 Y248 F249	Y216-F258 HydrophobicContact CD1-CE1 4.17Å; T220-F258 HydrophobicContact CG2-CD1 4.15Å; T220-F258 HydrophobicContact CG2-CE1 4.16Å; F222-F258 HydrophobicContact CE1-CD1 4.1Å; F222-F258 HydrophobicContact CE1-CE1 4.25Å; F222-F258 HydrophobicContact CE1-CG 4.25Å; F222-F258 HydrophobicContact CZ-CB 3.87Å; F222-F258 AromaticContact CZ-CD1 3.78Å; F222-F258 HydrophobicContact CZ-CD1 3.78Å; F222-F258 HydrophobicContact CZ-CD2 4.34Å; F222-F258 HydrophobicContact CZ-CE1 4.39Å; F222-F258 AromaticContact CZ-CG 3.74Å; F222-F258 HydrophobicContact CZ-CG 3.74Å; W227-F258 HydrophobicContact CB-CD1 4.48Å; W227-F258 HydrophobicContact CE3-CB 3.95Å; W227-F258 HydrophobicContact CZ3-CB 4.48Å; C228-F258 WeakPolarHBondContact O-CA 3.42Å; N239-F258 WeakPolarHBondContact ND2-CD2 3.45Å; V243-F258 HydrophobicContact CG2-CD2 3.72Å; V243-F258 HydrophobicContact CG2-CE2 3.43Å; V243-F258 VanDerWaalsContact CG2-CE2 3.43Å; V243-F258 HydrophobicContact CG2-CZ 4.15Å; Y248-F258 HydrophobicContact CD1-CE1 4.28Å; Y248-F258 HydrophobicContact CD2-CE1 4.1Å; Y248-F258 AromaticContact CD2-CZ 3.6Å; Y248-F258 HydrophobicContact CD2-CZ 3.6Å; Y248-F258 HydrophobicContact CE2-CZ 4.36Å; Y248-F258 AromaticContact CG-CE1 3.9Å; Y248-F258 HydrophobicContact CG-CE1 3.9Å; Y248-F258 AromaticContact CG-CZ 3.71Å; Y248-F258 HydrophobicContact CG-CZ 3.71Å; F249-F258 HydrophobicContact CD1-CZ 4.15Å; F249-F258 HydrophobicContact CE1-CE1 4.27Å; F249-F258 AromaticContact CE1-CE2 3.78Å; F249-F258 HydrophobicContact CE1-CE2 3.78Å; F249-F258 AromaticContact CE1-CZ 3.64Å; F249-F258 HydrophobicContact CE1-CZ 3.64Å; F249-F258 HydrophobicContact CZ-CE2 4.49Å
259	A	91.6	Very high	84.6	Confident	8 Å²	8	66 Å²	66	7%	0.066	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	147.2	172	0	0	0	0	0	110.6	V206 C228 V264	V206-A259 HydrophobicContact CG1-CB 3.55Å; C228-A259 PolarHBondContact N-O 3.26Å; C228-A259 PolarHBondContact O-N 3.38Å; A259-V264 HydrophobicContact CB-CG2 3.82Å
260	P	90.9	Very high	82.2	Confident	28 Å²	28	71 Å²	71	18%	0.182	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	146	172.6	-20.1	33.1	0	0	0	110.2	W227 H262 K263	W227-P260 HydrophobicContact CD2-CG 4.32Å; W227-P260 HydrophobicContact CE3-CG 4.1Å; W227-P260 HydrophobicContact CH2-CG 3.78Å; W227-P260 HydrophobicContact CZ2-CG 3.99Å; W227-P260 VanDerWaalsContact CZ3-CD 3.48Å; W227-P260 HydrophobicContact CZ3-CG 3.85Å; P260-H262 WeakPolarHBondContact CB-CE1 3.47Å; P260-H262 PolarHBondContact O-N 2.73Å; P260-K263 PolarHBondContact O-N 3.37Å
261	I	86.4	Confident	79.4	Confident	34 Å²	34	71.4 Å²	71.4	17%	0.174	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-48.1	-40.6	-177.7	-71.7	-178.9	0	0	0	112.4	L198 M217 E226 K263 V264	L198-I261 HydrophobicContact CD1-CG2 4.33Å; M217-I261 HydrophobicContact CG-CD1 4.39Å; E226-I261 HydrophobicContact CB-CD1 3.55Å; E226-I261 HydrophobicContact CB-CG1 4.2Å; E226-I261 PolarHBondContact O-N 2.94Å; I261-K263 VanDerWaalsContact C-N 3.27Å; I261-K263 PolarHBondContact O-N 3.47Å; I261-V264 PolarHBondContact O-N 2.96Å; I261-V264 VanDerWaalsContact O-N 3.12Å
262	H	82.3	Confident	77.2	Confident	149 Å²	149	76.8 Å²	76.8	69%	0.69	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-69.2	-14.2	-178.9	65.8	-103.5	0	0	0	115.5	P260	P260-H262 WeakPolarHBondContact CB-CE1 3.47Å; P260-H262 PolarHBondContact O-N 2.73Å
263	K	83.6	Confident	74.6	Confident	68 Å²	68	77.1 Å²	77.1	30%	0.296	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-96.8	6.5	173	-73.3	-153.4	172.1	-165.8	0	113.3	T141 D142 P260 I261	T141-K263 PolarHBondContact OG1-NZ 3.49Å; D142-K263 IonicContact OD2-NZ 3.84Å; D142-K263 PolarHBondContact OD2-NZ 2.76Å; P260-K263 PolarHBondContact O-N 3.37Å; I261-K263 VanDerWaalsContact C-N 3.27Å; I261-K263 PolarHBondContact O-N 3.47Å
264	V	86.1	Confident	72.6	Confident	11 Å²	11	79 Å²	79	7%	0.067	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	129.1	-178.7	-176.5	0	0	0	0	110	L198 V204 V206 C228 A259 I261	L198-V264 HydrophobicContact CD1-CB 4.16Å; L198-V264 HydrophobicContact CD1-CG1 4.04Å; V204-V264 HydrophobicContact CB-CG1 3.58Å; V204-V264 HydrophobicContact CG1-CG1 3.68Å; V204-V264 HydrophobicContact CG2-CG1 3.83Å; V206-V264 HydrophobicContact CG2-CG2 4.31Å; C228-V264 HydrophobicContact CB-CG2 3.98Å; A259-V264 HydrophobicContact CB-CG2 3.82Å; I261-V264 PolarHBondContact O-N 2.96Å; I261-V264 VanDerWaalsContact O-N 3.12Å
265	I	86.5	Confident	69.9	Low	108 Å²	108	77.2 Å²	77.2	55%	0.554	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.3	129.6	-175.7	-57	175.6	0	0	0	109.1	V204 L205	V204-I265 CarbonylContact C-O 3.57Å; V204-I265 VanDerWaalsContact CA-O 3.24Å; V204-I265 WeakPolarHBondContact CA-O 3.49Å; V204-I265 WeakPolarHBondContact CB-O 3.28Å; L205-I265 PolarHBondContact N-O 2.88Å; L205-I265 PolarHBondContact O-N 3.48Å
266	R	85.4	Confident	67.1	Low	111 Å²	111	85.2 Å²	85.2	42%	0.419	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	130	178.4	-159.2	176.8	-173.3	165.6	3.8	111.3	D197 L198 D202	D197-R266 PolarHBondContact O-NH1 3.48Å; L198-R266 HydrophobicContact CD2-CB 3.7Å; L198-R266 HydrophobicContact CD2-CG 4.2Å; D202-R266 VanDerWaalsContact CG-CZ 3.45Å; D202-R266 VanDerWaalsContact CG-NE 3.26Å; D202-R266 IonicContact OD1-CZ 3.82Å; D202-R266 IonicContact OD1-NE 3.78Å; D202-R266 PolarHBondContact OD1-NE 3.36Å; D202-R266 IonicContact OD1-NH2 3.68Å; D202-R266 PolarHBondContact OD1-NH2 3.45Å; D202-R266 IonicContact OD2-CZ 2.65Å; D202-R266 IonicContact OD2-NE 2.64Å; D202-R266 PolarHBondContact OD2-NE 2.85Å; D202-R266 IonicContact OD2-NH1 2.79Å; D202-R266 IonicContact OD2-NH2 3.75Å; D202-R266 PolarHBondContact OD2-NH2 3.25Å
267	I	82.1	Confident	64.3	Low	54 Å²	54	90.3 Å²	90.3	28%	0.277	53%	0.528	S	S	.	.			trans	-91.1	120.8	171.3	-57.8	172.9	0	0	0	107.6	R203 L205 M211 F269	R203-I267 HydrophobicContact CB-CB 4.49Å; R203-I267 PolarHBondContact O-N 3.46Å; L205-I267 HydrophobicContact CB-CD1 4.02Å; L205-I267 HydrophobicContact CB-CG1 4.08Å; M211-I267 HydrophobicContact CE-CD1 3.92Å; M211-I267 HydrophobicContact CG-CD1 3.82Å; M211-I267 HydrophobicContact SD-CD1 4.14Å; I267-F269 PolarHBondContact O-N 2.99Å; I267-F269 VanDerWaalsContact O-N 3.15Å
268	G	49.7	Very low	61.5	Low	63 Å²	63	98.7 Å²	98.7	65%	0.649	56%	0.564	S	S	*	*			trans	-81.7	92.2	-164.2	0	0	0	0	0	115.7
269	F	41.7	Very low	58.6	Low	187 Å²	187	107.1 Å²	107.1	82%	0.82	60%	0.601	S	S	*	*			trans	-133.9	125.7	148.5	-72.6	-74.2	0	0	0	109.6	I267 S271	I267-F269 PolarHBondContact O-N 2.99Å; I267-F269 VanDerWaalsContact O-N 3.15Å; F269-S271 PolarHBondContact O-N 3.48Å
270	P	42.5	Very low	55.7	Low	120 Å²	120	113 Å²	113	78%	0.779	64%	0.641	S	S	*	*			trans	-71.5	112.6	177.4	28.3	-32.6	0	0	0	110.3
271	S	34.3	Very low	52.9	Low	119 Å²	119	121.4 Å²	121.4	83%	0.832	68%	0.675	S	S	*	*			trans	-62	140.7	-179.9	-170.3	0	0	0	0	112.2	F269	F269-S271 PolarHBondContact O-N 3.48Å
272	T	43	Very low	50.4	Low	123 Å²	123	131.4 Å²	131.4	76%	0.755	71%	0.71	S	S	*	*			trans	-88.4	128.7	-164.5	53.2	0	0	0	0	114
273	S	33.4	Very low	48	Very low	116 Å²	116	131.4 Å²	131.4	81%	0.811	72%	0.72	S	S	*	*			trans	-156	155.4	152.1	-88.7	0	0	0	0	111.5
274	P	45	Very low	45.5	Very low	134 Å²	134	133.1 Å²	133.1	87%	0.87	75%	0.747	S	S	*	*			trans	-97.8	136.9	-147.2	34.9	-35.2	0	0	0	116
275	A	31	Very low	43.1	Very low	103 Å²	103	141.3 Å²	141.3	85%	0.851	79%	0.787	S	S	*	*			trans	-119.1	141	165.3	0	0	0	0	0	111.1
276	K	33.3	Very low	40.6	Very low	214 Å²	214	139.7 Å²	139.7	93%	0.93	80%	0.797	S	S	*	*			trans	-93	126.2	-176.4	-64	168.6	179.1	168.3	0	111.9
277	A	33.2	Very low	38	Very low	107 Å²	107	141.1 Å²	141.1	88%	0.884	82%	0.818	S	S	*	*			trans	-163.6	155.5	144.5	0	0	0	0	0	113
278	K	35.1	Very low	35.8	Very low	194 Å²	194	144.6 Å²	144.6	84%	0.843	85%	0.847	S	S	*	*			trans	-93.8	141.7	-165.1	-74.7	167.6	177.2	169	0	115.1
279	K	34	Very low	35	Very low	199 Å²	199	147.4 Å²	147.4	87%	0.865	86%	0.856	S	S	*	*			trans	62.5	114.8	138.6	-67.4	-179.3	175.4	-168.9	0	121.1
280	S	30.1	Very low	34.9	Very low	130 Å²	130	145.9 Å²	145.9	91%	0.909	86%	0.856	S	S	*	*				-152.2	-172.4	118.8	-159.5	0	0	0	0	111.4
281	K	32.6	Very low	34.7	Very low	206 Å²	206	144.9 Å²	144.9	90%	0.896	86%	0.858	S	S	*	*			trans	-66	160.6	-167	-91.4	-179	173	-179.7	0	115.8
282	R	33.8	Very low	34.7	Very low	243 Å²	243	147 Å²	147	92%	0.917	86%	0.855	S	S	*	*			trans	-80	148.3	-178.7	-43.1	175.2	-165.5	158.9	2.4	112.8
283	V	31.2	Very low	34.2	Very low	149 Å²	149	146 Å²	146	90%	0.903	85%	0.852	S	S	*	*			trans	-129.3	148.9	131.3	-74.5	0	0	0	0	107.4
284	A	32.1	Very low	34.3	Very low	104 Å²	104	146.8 Å²	146.8	86%	0.86	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-94.4	148	-177	0	0	0	0	0	111.4
285	M	35.3	Very low	34	Very low	183 Å²	183	146 Å²	146	90%	0.901	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-78.7	135.1	-179.2	-66.5	-66.8	-173.2	0	0	111.5
286	G	33.4	Very low	34.4	Very low	74 Å²	74	146.4 Å²	146.4	76%	0.763	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-76.2	142.7	158.8	0	0	0	0	0	110.4
287	V	31.8	Very low	34.8	Very low	142 Å²	142	141.8 Å²	141.8	86%	0.861	84%	0.844	S	S	*	*			trans	-102.3	110.1	177.4	-82.4	0	0	0	0	110.8
288	S	35.1	Very low	35	Very low	126 Å²	126	141.9 Å²	141.9	88%	0.881	84%	0.838	S	S	*	*			trans	-97	108.9	172.4	-61.9	0	0	0	0	110.1	L290	S288-L290 PolarHBondContact O-N 2.92Å
289	S	33.4	Very low	35.6	Very low	122 Å²	122	141 Å²	141	85%	0.853	84%	0.84	S	S	*	*			trans	-95.2	89.9	179	57.1	0	0	0	0	111.9
290	L	39.7	Very low	36	Very low	155 Å²	155	136.6 Å²	136.6	81%	0.812	84%	0.835	S	S	*	*			trans	-140	94.3	164.1	-172	64.2	0	0	0	110.6	S288	S288-L290 PolarHBondContact O-N 2.92Å
291	A	37.9	Very low	36.4	Very low	99 Å²	99	135.9 Å²	135.9	82%	0.818	83%	0.83	S	S	*	*			trans	-137	140.5	167.9	0	0	0	0	0	108
292	H	33.9	Very low	36.6	Very low	165 Å²	165	132.5 Å²	132.5	76%	0.764	83%	0.826	S	S	*	*			trans	-86.1	155.7	-173.8	-71.4	-90.5	0	0	0	113
293	S	32.3	Very low	36.8	Very low	100 Å²	100	126.8 Å²	126.8	70%	0.699	82%	0.823	S	S	*	*	S	Bend	trans	71.5	121.9	170.7	-58.8	0	0	0	0	117.2	S295	S293-S295 PolarHBondContact O-N 3Å
294	P	35.8	Very low	37.1	Very low	133 Å²	133	124.4 Å²	124.4	86%	0.864	81%	0.813	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	75.8	-175.1	34.9	-36.2	0	0	0	112.5
295	S	38.6	Very low	37.3	Very low	119 Å²	119	126 Å²	126	83%	0.832	81%	0.812	S	S	*	*	T	Hydrogen-bonded Turn	trans	-148.6	-1.5	173.7	-65.3	0	0	0	0	116.6	S293	S293-S295 PolarHBondContact O-N 3Å
296	S	40.2	Very low	37.2	Very low	110 Å²	110	122.2 Å²	122.2	77%	0.769	81%	0.81	S	S	*	*			trans	-112.8	97.4	174.9	51.6	0	0	0	0	111.9
297	S	42.2	Very low	37.3	Very low	118 Å²	118	123.5 Å²	123.5	83%	0.825	81%	0.807	S	S	*	*			trans	-81.2	122.1	174.5	40.6	0	0	0	0	111.8
298	S	35.9	Very low	37.6	Very low	109 Å²	109	122.8 Å²	122.8	76%	0.762	81%	0.809	S	S	*	*			trans	-63.1	153.3	165.6	-67.9	0	0	0	0	111.1	S300	S298-S300 PolarHBondContact O-N 3.4Å
299	I	48.8	Very low	37.9	Very low	174 Å²	174	124.2 Å²	124.2	89%	0.892	81%	0.812	S	S	*	*	S	Bend	trans	-66.4	38	-163.7	59.3	169.8	0	0	0	117.5
300	S	41.6	Very low	38.2	Very low	107 Å²	107	122.4 Å²	122.4	75%	0.748	81%	0.813	S	S	*	*			trans	-118.9	26.6	-170.4	-57.1	0	0	0	0	115	S298	S298-S300 PolarHBondContact O-N 3.4Å
301	S	38.4	Very low	37.8	Very low	116 Å²	116	118.6 Å²	118.6	81%	0.811	81%	0.811	S	S	*	*			trans	-157.2	102.3	163.8	-90.2	0	0	0	0	110.6
302	V	36.7	Very low	37.9	Very low	135 Å²	135	125.4 Å²	125.4	82%	0.818	82%	0.815	S	S	*	*			trans	-93.3	119.8	164.4	-73.6	0	0	0	0	109.4	S304	V302-S304 VanDerWaalsContact C-N 3.29Å; V302-S304 PolarHBondContact O-N 2.97Å
303	S	37.4	Very low	38.1	Very low	122 Å²	122	123.5 Å²	123.5	85%	0.853	82%	0.818	S	S	*	*			trans	-74	83.9	172.3	-60.5	0	0	0	0	109.9	V305	S303-V305 PolarHBondContact O-N 2.75Å
304	S	37.9	Very low	38.5	Very low	99 Å²	99	124.3 Å²	124.3	69%	0.692	82%	0.823	S	S	*	*			trans	-56.3	130.2	175.7	-62.6	0	0	0	0	111.5	V302 A306	V302-S304 VanDerWaalsContact C-N 3.29Å; V302-S304 PolarHBondContact O-N 2.97Å; S304-A306 VanDerWaalsContact C-N 3.33Å; S304-A306 PolarHBondContact O-N 2.8Å
305	V	37.3	Very low	39	Very low	137 Å²	137	129.8 Å²	129.8	83%	0.83	83%	0.827	S	S	*	*			trans	-70	87.1	172.4	-78.2	0	0	0	0	110.7	S303 S307	S303-V305 PolarHBondContact O-N 2.75Å; V305-S307 VanDerWaalsContact C-N 3.29Å; V305-S307 PolarHBondContact O-N 3.12Å
306	A	32.8	Very low	39.1	Very low	104 Å²	104	129 Å²	129	86%	0.86	83%	0.828	S	S	*	*			trans	-74.2	76.8	177.7	0	0	0	0	0	111.5	S304	S304-A306 VanDerWaalsContact C-N 3.33Å; S304-A306 PolarHBondContact O-N 2.8Å
307	S	35.4	Very low	38.9	Very low	101 Å²	101	127.3 Å²	127.3	71%	0.706	83%	0.828	S	S	*	*			trans	-82.3	122.8	172	-56.4	0	0	0	0	110.9	V305 V309	V305-S307 VanDerWaalsContact C-N 3.29Å; V305-S307 PolarHBondContact O-N 3.12Å; S307-V309 PolarHBondContact O-N 3.39Å
308	S	38.6	Very low	38.7	Very low	128 Å²	128	129.3 Å²	129.3	90%	0.895	83%	0.828	S	S	*	*			trans	-74.1	112.7	178.9	38.7	0	0	0	0	111.9
309	V	40.9	Very low	38.7	Very low	155 Å²	155	132 Å²	132	94%	0.939	83%	0.833	S	S	*	*			trans	-90.2	116.6	177.4	-132.6	0	0	0	0	110.1	S307	S307-V309 PolarHBondContact O-N 3.39Å
310	G	39.3	Very low	38.1	Very low	85 Å²	85	129.7 Å²	129.7	88%	0.876	83%	0.827	S	S	*	*			trans	-171.4	47.1	-172	0	0	0	0	0	116.4
311	G	31.9	Very low	38.2	Very low	75 Å²	75	133.4 Å²	133.4	77%	0.773	83%	0.833	S	S	*	*			trans	-155.8	123.2	177.3	0	0	0	0	0	112.3
312	R	39.1	Very low	38	Very low	241 Å²	241	134.3 Å²	134.3	91%	0.909	83%	0.834	S	S	*	*			trans	-59.2	139.3	-172.4	-70.8	172.5	166.6	178.6	-5.7	113.2
313	P	39.2	Very low	37.9	Very low	126 Å²	126	133.1 Å²	133.1	82%	0.818	83%	0.831	S	S	*	*			trans	-77.8	137.9	171.8	32.3	-33.8	0	0	0	111.7
314	S	40.7	Very low	38.3	Very low	116 Å²	116	133.4 Å²	133.4	81%	0.811	83%	0.833	S	S	*	*			trans	-136.2	108.7	169.5	-80	0	0	0	0	111.2
315	R	47.1	Very low	38.7	Very low	248 Å²	248	139.4 Å²	139.4	94%	0.936	84%	0.841	S	S	*	*			trans	62.5	65.8	152.6	-160.9	-176.2	175.8	113.5	-4	117.7
316	A	39	Very low	38.6	Very low	103 Å²	103	142.4 Å²	142.4	85%	0.851	84%	0.839	S	S	*	*			trans	-104.7	101.4	146.7	0	0	0	0	0	108.4	L318	A316-L318 PolarHBondContact O-N 2.78Å
317	G	36.4	Very low	39.2	Very low	75 Å²	75	142.6 Å²	142.6	77%	0.773	84%	0.84	S	S	*	*			trans	-90.8	86.5	-168.6	0	0	0	0	0	113.9	L319	G317-L319 PolarHBondContact O-N 3.12Å
318	L	38.7	Very low	39.5	Very low	159 Å²	159	147.1 Å²	147.1	83%	0.832	84%	0.842	S	S	*	*			trans	-79.5	103.1	163.8	-176.9	68.6	0	0	0	109.2	A316	A316-L318 PolarHBondContact O-N 2.78Å
319	L	35.6	Very low	40.1	Very low	167 Å²	167	151.3 Å²	151.3	87%	0.874	84%	0.844	S	S	*	*			trans	-119.4	105.2	167.8	-75.3	179	0	0	0	110.2	G317	G317-L319 PolarHBondContact O-N 3.12Å
320	T	35.2	Very low	40.4	Very low	125 Å²	125	151.2 Å²	151.2	77%	0.767	84%	0.837	S	S	*	*			trans	-65.1	169.4	161.2	13.1	0	0	0	0	111.4
321	E	44.9	Very low	40.8	Very low	184 Å²	184	150.4 Å²	150.4	86%	0.86	82%	0.817	S	S	*	*			trans	-44.9	134.3	-174.9	-59.1	175.2	91.1	0	0	115.4
322	T	34.2	Very low	42	Very low	136 Å²	136	149.6 Å²	149.6	83%	0.834	81%	0.809	S	S	*	*				-167.9	162	127.8	10.7	0	0	0	0	113.1
323	S	35.3	Very low	43.1	Very low	109 Å²	109	142.6 Å²	142.6	76%	0.762	79%	0.793	S	S	*	*			trans	75.8	75.1	165.1	74.1	0	0	0	0	119	R325	S323-R325 PolarHBondContact O-N 2.89Å
324	S	44.6	Very low	44.5	Very low	128 Å²	128	139.7 Å²	139.7	90%	0.895	77%	0.773	S	S	*	*			trans	-62.1	79.6	152	-53.4	0	0	0	0	111.7
325	R	45.6	Very low	45.9	Very low	225 Å²	225	137 Å²	137	85%	0.849	76%	0.757	S	S	*	*			trans	-170.1	88.5	163.5	-119.9	-178.3	-78.1	-150.7	0.7	114	S323	S323-R325 PolarHBondContact O-N 2.89Å
326	Y	36.1	Very low	47.3	Very low	201 Å²	201	130.6 Å²	130.6	79%	0.788	74%	0.742	S	S	*	*			trans	-177.1	80.6	138.3	-103	-59.9	0	0	0	112.1	R328	Y326-R328 VanDerWaalsContact CE1-NH2 3.32Å; Y326-R328 PolarHBondContact O-N 3.32Å
327	A	44.5	Very low	49.1	Very low	108 Å²	108	132.6 Å²	132.6	89%	0.893	73%	0.733	S	S	*	*			trans	-78.1	108.7	164.6	0	0	0	0	0	109.5
328	R	43.6	Very low	51.2	Low	196 Å²	196	134.5 Å²	134.5	74%	0.74	72%	0.722	S	S	*	*			trans	-135.6	135.2	165.7	-121.4	-174.4	-69.4	-172.7	-0.3	109.3	Y326 I330	Y326-R328 VanDerWaalsContact CE1-NH2 3.32Å; Y326-R328 PolarHBondContact O-N 3.32Å; R328-I330 PolarHBondContact O-N 3.21Å
329	K	51.1	Low	53.2	Low	216 Å²	216	129 Å²	129	94%	0.939	70%	0.7	S	S	*	*			trans	-67.7	123.8	-173.2	-62.5	-177.2	179.2	-176.8	0	110.7
330	I	45.5	Very low	55.5	Low	153 Å²	153	126.5 Å²	126.5	79%	0.785	69%	0.687	S	S	*	*			trans	-119.2	147.4	161.8	-60.6	178.2	0	0	0	106.4	R328 G332	R328-I330 PolarHBondContact O-N 3.21Å; I330-G332 PolarHBondContact O-N 3.49Å
331	S	49.3	Very low	58.1	Low	67 Å²	67	128 Å²	128	47%	0.469	68%	0.682	S	S	.	*			trans	-64.2	124.9	-171.5	-167.7	0	0	0	0	112	T333 T334	S331-T333 PolarHBondContact O-N 2.88Å; S331-T333 VanDerWaalsContact O-N 3.11Å; S331-T333 PolarHBondContact OG-OG1 2.83Å; S331-T334 PolarHBondContact O-N 2.86Å; S331-T334 VanDerWaalsContact O-N 3.12Å
332	G	57.3	Low	59.9	Low	58 Å²	58	125.7 Å²	125.7	60%	0.598	67%	0.672	S	S	*	*	H	α-helix	trans	-62.4	-18	179	0	0	0	0	0	114.1	I330 L336	I330-G332 PolarHBondContact O-N 3.49Å; G332-L336 WeakPolarHBondContact O-CB 3.35Å; G332-L336 PolarHBondContact O-N 2.89Å
333	T	60.8	Low	62.5	Low	95 Å²	95	125.8 Å²	125.8	58%	0.583	66%	0.66	S	S	*	*	H	α-helix	trans	-62.7	-43.3	172.7	52.4	0	0	0	0	112.4	S331 Q337	S331-T333 PolarHBondContact O-N 2.88Å; S331-T333 VanDerWaalsContact O-N 3.11Å; S331-T333 PolarHBondContact OG-OG1 2.83Å; T333-Q337 WeakPolarHBondContact O-CB 3.48Å; T333-Q337 PolarHBondContact O-N 2.94Å
334	T	68.2	Low	65.1	Low	65 Å²	65	126.1 Å²	126.1	40%	0.399	65%	0.65	S	S	.	*	H	α-helix	trans	-73.2	-47.3	-173.2	-41.8	0	0	0	0	110.8	S331 L336 Q337 E338	S331-T334 PolarHBondContact O-N 2.86Å; S331-T334 VanDerWaalsContact O-N 3.12Å; T334-L336 VanDerWaalsContact C-N 3.3Å; T334-L336 PolarHBondContact O-N 3.38Å; T334-Q337 PolarHBondContact O-N 2.68Å; T334-E338 WeakPolarHBondContact O-CG 3.43Å; T334-E338 PolarHBondContact O-N 2.67Å
335	A	71.6	Confident	67.3	Low	58 Å²	58	125.8 Å²	125.8	48%	0.479	63%	0.634	S	S	.	*	H	α-helix	trans	-62.3	-34.5	178.9	0	0	0	0	0	112.8	A339	A335-A339 VanDerWaalsContact O-CB 3.28Å; A335-A339 WeakPolarHBondContact O-CB 3.49Å; A335-A339 PolarHBondContact O-N 3.4Å
336	L	75.7	Confident	69.4	Low	115 Å²	115	119.8 Å²	119.8	60%	0.602	62%	0.616	S	S	*	*	H	α-helix	trans	-68.1	-38.6	173.7	-179.3	61.9	0	0	0	112	G332 T334 L340	G332-L336 WeakPolarHBondContact O-CB 3.35Å; G332-L336 PolarHBondContact O-N 2.89Å; T334-L336 VanDerWaalsContact C-N 3.3Å; T334-L336 PolarHBondContact O-N 3.38Å; L336-L340 HydrophobicContact CG-CD1 4.48Å; L336-L340 WeakPolarHBondContact O-CB 3.42Å; L336-L340 PolarHBondContact O-N 2.9Å
337	Q	77.7	Confident	71.9	Confident	144 Å²	144	114.4 Å²	114.4	67%	0.673	60%	0.6	S	S	*	*	H	α-helix	trans	-73.7	-33.7	179.9	-164.1	167.4	8.6	0	0	112.1	T333 T334 K341	T333-Q337 WeakPolarHBondContact O-CB 3.48Å; T333-Q337 PolarHBondContact O-N 2.94Å; T334-Q337 PolarHBondContact O-N 2.68Å; Q337-K341 WeakPolarHBondContact O-CB 3.34Å; Q337-K341 PolarHBondContact O-N 3.45Å; Q337-K341 VanDerWaalsContact O-N 3.1Å
338	E	79.9	Confident	74.2	Confident	115 Å²	115	115.4 Å²	115.4	54%	0.537	59%	0.586	S	S	.	*	H	α-helix	trans	-66.6	-48.5	169.4	-71.6	170.9	153.8	0	0	111	T334 L340 K341 E342	T334-E338 WeakPolarHBondContact O-CG 3.43Å; T334-E338 PolarHBondContact O-N 2.67Å; E338-L340 VanDerWaalsContact C-N 3.32Å; E338-L340 PolarHBondContact O-N 3.24Å; E338-K341 CarbonylContact O-C 3.6Å; E338-K341 WeakPolarHBondContact O-CA 3.47Å; E338-K341 WeakPolarHBondContact O-CB 3.2Å; E338-K341 PolarHBondContact O-N 2.99Å; E338-E342 PolarHBondContact O-N 3.33Å
339	A	79.9	Confident	76.4	Confident	45 Å²	45	111.1 Å²	111.1	37%	0.372	57%	0.574	S	S	.	*	H	α-helix	trans	-61.1	-37.2	176.6	0	0	0	0	0	113.1	A335 K343	A335-A339 VanDerWaalsContact O-CB 3.28Å; A335-A339 WeakPolarHBondContact O-CB 3.49Å; A335-A339 PolarHBondContact O-N 3.4Å; A339-K343 WeakPolarHBondContact O-CB 3.36Å; A339-K343 WeakPolarHBondContact O-CG 3.43Å; A339-K343 PolarHBondContact O-N 3.41Å
340	L	85.3	Confident	78.4	Confident	114 Å²	114	105 Å²	105	60%	0.597	55%	0.551	S	S	*	*	H	α-helix	trans	-63.6	-40.9	171.7	-91.8	164.3	0	0	0	112	L336 E338 K343 Q344	L336-L340 HydrophobicContact CG-CD1 4.48Å; L336-L340 WeakPolarHBondContact O-CB 3.42Å; L336-L340 PolarHBondContact O-N 2.9Å; E338-L340 VanDerWaalsContact C-N 3.32Å; E338-L340 PolarHBondContact O-N 3.24Å; L340-K343 PolarHBondContact O-N 3Å; L340-Q344 WeakPolarHBondContact O-CB 3.39Å; L340-Q344 PolarHBondContact O-N 3.17Å
341	K	87.9	Confident	80.6	Confident	155 Å²	155	102.4 Å²	102.4	67%	0.674	54%	0.539	S	S	*	.	H	α-helix	trans	-67	-42.2	176.9	-170.1	-178	178.7	-173.9	0	112	Q337 E338 K343 Q344 Q345	Q337-K341 WeakPolarHBondContact O-CB 3.34Å; Q337-K341 PolarHBondContact O-N 3.45Å; Q337-K341 VanDerWaalsContact O-N 3.1Å; E338-K341 CarbonylContact O-C 3.6Å; E338-K341 WeakPolarHBondContact O-CA 3.47Å; E338-K341 WeakPolarHBondContact O-CB 3.2Å; E338-K341 PolarHBondContact O-N 2.99Å; K341-K343 VanDerWaalsContact C-N 3.35Å; K341-Q344 PolarHBondContact O-N 3.13Å; K341-Q345 WeakPolarHBondContact O-CB 3.26Å; K341-Q345 PolarHBondContact O-N 3.47Å
342	E	84.2	Confident	82.6	Confident	136 Å²	136	102.2 Å²	102.2	64%	0.636	54%	0.541	S	S	*	.	H	α-helix	trans	-61.1	-41.9	173.3	-71.8	-176.7	162.1	0	0	111.6	E338 Q345 H346	E338-E342 PolarHBondContact O-N 3.33Å; E342-Q345 PolarHBondContact O-N 3.16Å; E342-H346 WeakPolarHBondContact O-CB 3.46Å; E342-H346 PolarHBondContact O-N 2.91Å
343	K	89.3	Confident	84	Confident	138 Å²	138	103.6 Å²	103.6	60%	0.6	53%	0.532	S	S	*	.	H	α-helix	trans	-67.1	-38.2	175.3	-71.3	-63.3	179.2	-170.6	0	112.9	A339 L340 K341 H346 I347	A339-K343 WeakPolarHBondContact O-CB 3.36Å; A339-K343 WeakPolarHBondContact O-CG 3.43Å; A339-K343 PolarHBondContact O-N 3.41Å; L340-K343 PolarHBondContact O-N 3Å; K341-K343 VanDerWaalsContact C-N 3.35Å; K343-H346 PolarHBondContact O-N 3.15Å; K343-I347 VanDerWaalsContact O-CG1 3.31Å; K343-I347 WeakPolarHBondContact O-CG1 3.49Å; K343-I347 PolarHBondContact O-N 2.99Å
344	Q	89.6	Confident	85.4	Confident	116 Å²	116	104.8 Å²	104.8	54%	0.542	53%	0.526	S	S	.	.	H	α-helix	trans	-63	-44.4	173.5	-173.9	58.5	54.5	0	0	111.6	L340 K341 H346 I347 E348	L340-Q344 WeakPolarHBondContact O-CB 3.39Å; L340-Q344 PolarHBondContact O-N 3.17Å; K341-Q344 PolarHBondContact O-N 3.13Å; Q344-H346 VanDerWaalsContact C-N 3.34Å; Q344-H346 PolarHBondContact O-N 3.47Å; Q344-I347 PolarHBondContact O-N 3.04Å; Q344-E348 PolarHBondContact O-N 3.5Å
345	Q	90.3	Very high	86.6	Confident	121 Å²	121	104.8 Å²	104.8	57%	0.565	52%	0.523	S	S	*	.	H	α-helix	trans	-64.7	-36.6	176.6	-174.8	176.4	-9.5	0	0	112.1	K341 E342 E348 Q349	K341-Q345 WeakPolarHBondContact O-CB 3.26Å; K341-Q345 PolarHBondContact O-N 3.47Å; E342-Q345 PolarHBondContact O-N 3.16Å; Q345-E348 PolarHBondContact O-N 3.35Å; Q345-Q349 WeakPolarHBondContact O-CB 3.23Å; Q345-Q349 PolarHBondContact O-N 3.45Å
346	H	88.9	Confident	87.5	Confident	99 Å²	99	107 Å²	107	46%	0.458	53%	0.527	S	S	.	.	H	α-helix	trans	-68.6	-33.4	175	-170.3	-48.5	0	0	0	112.4	E342 K343 Q344 L350	E342-H346 WeakPolarHBondContact O-CB 3.46Å; E342-H346 PolarHBondContact O-N 2.91Å; K343-H346 PolarHBondContact O-N 3.15Å; Q344-H346 VanDerWaalsContact C-N 3.34Å; Q344-H346 PolarHBondContact O-N 3.47Å; H346-L350 WeakPolarHBondContact O-CG 3.33Å; H346-L350 PolarHBondContact O-N 3.43Å
347	I	89.9	Confident	88.1	Confident	88 Å²	88	107.2 Å²	107.2	45%	0.451	53%	0.525	S	S	.	.	H	α-helix	trans	-68.3	-43.3	172.7	-69.1	162.7	0	0	0	110.1	K343 Q344 L350 L351	K343-I347 VanDerWaalsContact O-CG1 3.31Å; K343-I347 WeakPolarHBondContact O-CG1 3.49Å; K343-I347 PolarHBondContact O-N 2.99Å; Q344-I347 PolarHBondContact O-N 3.04Å; I347-L350 PolarHBondContact O-N 3.31Å; I347-L351 HydrophobicContact CG2-CD1 4.14Å; I347-L351 WeakPolarHBondContact O-CG 3.42Å; I347-L351 PolarHBondContact O-N 3.5Å
348	E	91.5	Very high	88.9	Confident	130 Å²	130	107 Å²	107	61%	0.607	52%	0.517	S	S	*	.	H	α-helix	trans	-61.8	-41.3	175.7	-171.2	171.8	-164.8	0	0	112.1	Q344 Q345 L351 A352	Q344-E348 PolarHBondContact O-N 3.5Å; Q345-E348 PolarHBondContact O-N 3.35Å; E348-L351 PolarHBondContact O-N 2.83Å; E348-A352 PolarHBondContact O-N 3.1Å
349	Q	90.8	Very high	89.4	Confident	105 Å²	105	103.6 Å²	103.6	49%	0.491	51%	0.509	S	S	.	.	H	α-helix	trans	-62	-49.1	173.3	179.6	174.9	-15.4	0	0	112.2	Q345 L351 A352 E353	Q345-Q349 WeakPolarHBondContact O-CB 3.23Å; Q345-Q349 PolarHBondContact O-N 3.45Å; Q349-L351 VanDerWaalsContact C-N 3.26Å; Q349-L351 PolarHBondContact O-N 3.19Å; Q349-A352 PolarHBondContact O-N 3.11Å; Q349-A352 VanDerWaalsContact O-N 3.1Å; Q349-E353 HydrophobicContact CG-CG 4.31Å; Q349-E353 WeakPolarHBondContact CG-OE1 3.39Å; Q349-E353 PolarHBondContact NE2-OE1 2.89Å; Q349-E353 WeakPolarHBondContact O-CG 3.28Å; Q349-E353 PolarHBondContact O-N 3.27Å
350	L	91.9	Very high	89.8	Confident	88 Å²	88	106.7 Å²	106.7	46%	0.461	52%	0.516	S	S	.	.	H	α-helix	trans	-61.1	-34.4	178.3	-75	173.2	0	0	0	112.6	H346 I347 R354	H346-L350 WeakPolarHBondContact O-CG 3.33Å; H346-L350 PolarHBondContact O-N 3.43Å; I347-L350 PolarHBondContact O-N 3.31Å; L350-R354 WeakPolarHBondContact O-CB 3.46Å; L350-R354 PolarHBondContact O-N 2.87Å
351	L	91.6	Very high	90	Very high	99 Å²	99	105.6 Å²	105.6	52%	0.518	51%	0.514	S	S	.	.	H	α-helix	trans	-68.2	-41.1	174.4	-71.8	169.8	0	0	0	111.6	I347 E348 Q349 D355	I347-L351 HydrophobicContact CG2-CD1 4.14Å; I347-L351 WeakPolarHBondContact O-CG 3.42Å; I347-L351 PolarHBondContact O-N 3.5Å; E348-L351 PolarHBondContact O-N 2.83Å; Q349-L351 VanDerWaalsContact C-N 3.26Å; Q349-L351 PolarHBondContact O-N 3.19Å; L351-D355 VanDerWaalsContact O-CB 3.28Å; L351-D355 WeakPolarHBondContact O-CB 3.46Å; L351-D355 PolarHBondContact O-N 3.21Å
352	A	92.2	Very high	90.2	Very high	63 Å²	63	101 Å²	101	52%	0.521	51%	0.505	S	S	.	.	H	α-helix	trans	-67.4	-40.5	176	0	0	0	0	0	112.6	E348 Q349 D355 L356	E348-A352 PolarHBondContact O-N 3.1Å; Q349-A352 PolarHBondContact O-N 3.11Å; Q349-A352 VanDerWaalsContact O-N 3.1Å; A352-D355 PolarHBondContact O-N 3.49Å; A352-L356 PolarHBondContact O-N 3.38Å
353	E	87.2	Confident	90.5	Very high	86 Å²	86	101.7 Å²	101.7	40%	0.402	51%	0.506	S	S	.	.	H	α-helix	trans	-62.8	-51.1	175.4	-74.2	169.7	174.5	0	0	110.8	Q349 D355 L356 E357	Q349-E353 HydrophobicContact CG-CG 4.31Å; Q349-E353 WeakPolarHBondContact CG-OE1 3.39Å; Q349-E353 PolarHBondContact NE2-OE1 2.89Å; Q349-E353 WeakPolarHBondContact O-CG 3.28Å; Q349-E353 PolarHBondContact O-N 3.27Å; E353-D355 PolarHBondContact O-N 2.86Å; E353-L356 WeakPolarHBondContact O-CB 3.39Å; E353-L356 PolarHBondContact O-N 2.9Å; E353-L356 VanDerWaalsContact O-N 3.13Å; E353-E357 WeakPolarHBondContact O-CG 3.45Å; E353-E357 PolarHBondContact O-N 3.29Å
354	R	90.5	Very high	90.4	Very high	120 Å²	120	97.7 Å²	97.7	45%	0.453	50%	0.498	S	S	.	.	H	α-helix	trans	-61	-32.7	176.5	-163.7	-149.9	66.8	156.3	-5.9	112.5	L350 E357 R358	L350-R354 WeakPolarHBondContact O-CB 3.46Å; L350-R354 PolarHBondContact O-N 2.87Å; R354-E357 WeakPolarHBondContact O-CB 3.35Å; R354-E357 PolarHBondContact O-N 3.25Å; R354-R358 VanDerWaalsContact NH2-NE 3.2Å; R354-R358 WeakPolarHBondContact O-CG 3.15Å; R354-R358 PolarHBondContact O-N 2.95Å
355	D	91.8	Very high	90.3	Very high	65 Å²	65	95.8 Å²	95.8	35%	0.348	50%	0.495	S	S	.	.	H	α-helix	trans	-80.5	-23.8	179.4	-77.2	9.6	0	0	0	113	L351 A352 E353 R358 A359	L351-D355 VanDerWaalsContact O-CB 3.28Å; L351-D355 WeakPolarHBondContact O-CB 3.46Å; L351-D355 PolarHBondContact O-N 3.21Å; A352-D355 PolarHBondContact O-N 3.49Å; E353-D355 PolarHBondContact O-N 2.86Å; D355-R358 IonicContact OD1-CZ 3Å; D355-R358 VanDerWaalsContact OD1-CZ 3.24Å; D355-R358 IonicContact OD1-NE 2.69Å; D355-R358 PolarHBondContact OD1-NE 3.01Å; D355-R358 IonicContact OD1-NH2 3.71Å; D355-R358 PolarHBondContact OD1-NH2 2.73Å; D355-R358 IonicContact OD2-CZ 3.9Å; D355-R358 IonicContact OD2-NH2 3.23Å; D355-R358 PolarHBondContact OD2-NH2 3.01Å; D355-A359 PolarHBondContact O-N 3.36Å
356	L	90.9	Very high	90.4	Very high	106 Å²	106	93 Å²	93	56%	0.555	49%	0.489	S	S	*	.	H	α-helix	trans	-65.5	-49.2	162	-171.5	76.2	0	0	0	110.6	A352 E353 R358 A359 E360	A352-L356 PolarHBondContact O-N 3.38Å; E353-L356 WeakPolarHBondContact O-CB 3.39Å; E353-L356 PolarHBondContact O-N 2.9Å; E353-L356 VanDerWaalsContact O-N 3.13Å; L356-R358 VanDerWaalsContact C-N 3.31Å; L356-R358 PolarHBondContact O-N 2.85Å; L356-A359 CarbonylContact O-C 3.6Å; L356-A359 WeakPolarHBondContact O-CA 3.45Å; L356-A359 WeakPolarHBondContact O-CB 3.23Å; L356-A359 PolarHBondContact O-N 3.31Å; L356-E360 PolarHBondContact O-N 3.2Å
357	E	89.4	Confident	90.4	Very high	119 Å²	119	93.9 Å²	93.9	56%	0.556	49%	0.493	S	S	*	.	H	α-helix	trans	-55	-45	176.1	-68	174.7	157.3	0	0	111.4	E353 R354 A359 E360 V361	E353-E357 WeakPolarHBondContact O-CG 3.45Å; E353-E357 PolarHBondContact O-N 3.29Å; R354-E357 WeakPolarHBondContact O-CB 3.35Å; R354-E357 PolarHBondContact O-N 3.25Å; E357-A359 VanDerWaalsContact C-N 3.3Å; E357-A359 PolarHBondContact O-N 2.91Å; E357-E360 PolarHBondContact O-N 3.04Å; E357-V361 WeakPolarHBondContact O-CB 3.46Å; E357-V361 WeakPolarHBondContact O-CG2 3.36Å; E357-V361 PolarHBondContact O-N 3.4Å
358	R	93.2	Very high	90.2	Very high	138 Å²	138	94.2 Å²	94.2	52%	0.521	50%	0.495	S	S	.	.	H	α-helix	trans	-60.1	-37.7	175.2	-71.8	-166.7	-56.2	138.1	-8.4	112.5	R354 D355 L356 A362	R354-R358 VanDerWaalsContact NH2-NE 3.2Å; R354-R358 WeakPolarHBondContact O-CG 3.15Å; R354-R358 PolarHBondContact O-N 2.95Å; D355-R358 IonicContact OD1-CZ 3Å; D355-R358 VanDerWaalsContact OD1-CZ 3.24Å; D355-R358 IonicContact OD1-NE 2.69Å; D355-R358 PolarHBondContact OD1-NE 3.01Å; D355-R358 IonicContact OD1-NH2 3.71Å; D355-R358 PolarHBondContact OD1-NH2 2.73Å; D355-R358 IonicContact OD2-CZ 3.9Å; D355-R358 IonicContact OD2-NH2 3.23Å; D355-R358 PolarHBondContact OD2-NH2 3.01Å; L356-R358 VanDerWaalsContact C-N 3.31Å; L356-R358 PolarHBondContact O-N 2.85Å; R358-A362 WeakPolarHBondContact O-CB 3.45Å; R358-A362 PolarHBondContact O-N 2.91Å
359	A	91.8	Very high	90.1	Very high	44 Å²	44	91.4 Å²	91.4	36%	0.364	49%	0.488	S	S	.	.	H	α-helix	trans	-73.1	-33.1	177.3	0	0	0	0	0	112.7	D355 L356 E357 K363	D355-A359 PolarHBondContact O-N 3.36Å; L356-A359 CarbonylContact O-C 3.6Å; L356-A359 WeakPolarHBondContact O-CA 3.45Å; L356-A359 WeakPolarHBondContact O-CB 3.23Å; L356-A359 PolarHBondContact O-N 3.31Å; E357-A359 VanDerWaalsContact C-N 3.3Å; E357-A359 PolarHBondContact O-N 2.91Å; A359-K363 WeakPolarHBondContact O-CG 3.48Å; A359-K363 PolarHBondContact O-N 3.14Å; A359-K363 VanDerWaalsContact O-N 3.14Å
360	E	87.6	Confident	90	Very high	110 Å²	110	91 Å²	91	51%	0.514	49%	0.487	S	S	.	.	H	α-helix	trans	-73	-43.3	175.1	-69.8	-174.7	173.6	0	0	111.9	L356 E357 A362 K363 A364	L356-E360 PolarHBondContact O-N 3.2Å; E357-E360 PolarHBondContact O-N 3.04Å; E360-A362 VanDerWaalsContact C-N 3.34Å; E360-A362 PolarHBondContact O-N 3.3Å; E360-K363 PolarHBondContact O-N 3.31Å; E360-A364 PolarHBondContact O-N 3.06Å
361	V	89.4	Confident	89.8	Confident	92 Å²	92	89.9 Å²	89.9	56%	0.558	48%	0.483	S	S	*	.	H	α-helix	trans	-58.6	-45.5	171.4	171.1	0	0	0	0	110.6	E357 K363 A364 T365	E357-V361 WeakPolarHBondContact O-CB 3.46Å; E357-V361 WeakPolarHBondContact O-CG2 3.36Å; E357-V361 PolarHBondContact O-N 3.4Å; V361-K363 VanDerWaalsContact C-N 3.34Å; V361-K363 PolarHBondContact O-N 3.18Å; V361-A364 PolarHBondContact O-N 3.16Å; V361-T365 PolarHBondContact O-N 3.08Å; V361-T365 PolarHBondContact O-OG1 2.96Å; V361-T365 VanDerWaalsContact O-OG1 3.07Å
362	A	91.4	Very high	89.6	Confident	59 Å²	59	90.4 Å²	90.4	49%	0.488	48%	0.483	S	S	.	.	H	α-helix	trans	-60.6	-39.9	177.3	0	0	0	0	0	113.1	R358 E360 S366	R358-A362 WeakPolarHBondContact O-CB 3.45Å; R358-A362 PolarHBondContact O-N 2.91Å; E360-A362 VanDerWaalsContact C-N 3.34Å; E360-A362 PolarHBondContact O-N 3.3Å; A362-S366 PolarHBondContact O-N 3.01Å
363	K	91.6	Very high	89.6	Confident	149 Å²	149	94.9 Å²	94.9	65%	0.648	49%	0.491	S	S	*	.	H	α-helix	trans	-65	-44.1	173.5	-74.2	168.7	-178.1	172.4	0	111.9	A359 E360 V361 T365 S366 H367	A359-K363 WeakPolarHBondContact O-CG 3.48Å; A359-K363 PolarHBondContact O-N 3.14Å; A359-K363 VanDerWaalsContact O-N 3.14Å; E360-K363 PolarHBondContact O-N 3.31Å; V361-K363 VanDerWaalsContact C-N 3.34Å; V361-K363 PolarHBondContact O-N 3.18Å; K363-T365 VanDerWaalsContact C-N 3.35Å; K363-T365 PolarHBondContact O-N 3.47Å; K363-S366 PolarHBondContact O-N 2.88Å; K363-H367 PolarHBondContact O-N 2.97Å
364	A	86.6	Confident	89.7	Confident	54 Å²	54	97 Å²	97	45%	0.446	50%	0.501	S	S	.	.	H	α-helix	trans	-60.9	-43.5	177	0	0	0	0	0	111.5	E360 V361 H367 I368	E360-A364 PolarHBondContact O-N 3.06Å; V361-A364 PolarHBondContact O-N 3.16Å; A364-H367 PolarHBondContact O-N 3.49Å; A364-I368 VanDerWaalsContact O-CG1 3.28Å; A364-I368 WeakPolarHBondContact O-CG1 3.44Å; A364-I368 PolarHBondContact O-N 3.38Å
365	T	88.6	Confident	89.2	Confident	76 Å²	76	95 Å²	95	47%	0.466	50%	0.499	S	S	.	.	H	α-helix	trans	-62.4	-43.4	174.1	-54.5	0	0	0	0	112.1	V361 K363 H367 I368 C369	V361-T365 PolarHBondContact O-N 3.08Å; V361-T365 PolarHBondContact O-OG1 2.96Å; V361-T365 VanDerWaalsContact O-OG1 3.07Å; K363-T365 VanDerWaalsContact C-N 3.35Å; K363-T365 PolarHBondContact O-N 3.47Å; T365-H367 VanDerWaalsContact C-N 3.33Å; T365-H367 PolarHBondContact O-N 3.35Å; T365-I368 PolarHBondContact O-N 3.24Å; T365-C369 PolarHBondContact O-N 2.86Å; T365-C369 PolarHBondContact O-SG 2.87Å
366	S	91.2	Very high	89.1	Confident	63 Å²	63	95.9 Å²	95.9	44%	0.441	50%	0.503	S	S	.	.	H	α-helix	trans	-58	-46.3	175.6	-165.7	0	0	0	0	111.7	A362 K363 I368 C369 E370	A362-S366 PolarHBondContact O-N 3.01Å; K363-S366 PolarHBondContact O-N 2.88Å; S366-I368 PolarHBondContact O-N 2.96Å; S366-C369 WeakPolarHBondContact O-CB 3.06Å; S366-C369 PolarHBondContact O-N 2.82Å; S366-E370 WeakPolarHBondContact O-CG 3.42Å; S366-E370 PolarHBondContact O-N 3.17Å; S366-E370 PolarHBondContact OG-OE1 2.89Å
367	H	88.7	Confident	89.2	Confident	117 Å²	117	94.2 Å²	94.2	54%	0.542	50%	0.498	S	S	.	.	H	α-helix	trans	-68.4	-33.9	-179.2	-168.7	45.9	0	0	0	112.8	K363 A364 T365 E370 V371	K363-H367 PolarHBondContact O-N 2.97Å; A364-H367 PolarHBondContact O-N 3.49Å; T365-H367 VanDerWaalsContact C-N 3.33Å; T365-H367 PolarHBondContact O-N 3.35Å; H367-E370 IonicContact ND1-OE2 2.87Å; H367-E370 PolarHBondContact ND1-OE2 2.79Å; H367-E370 PolarHBondContact O-N 2.92Å; H367-V371 WeakPolarHBondContact O-CG2 3.35Å; H367-V371 PolarHBondContact O-N 2.85Å
368	I	86.1	Confident	89	Confident	95 Å²	95	93.8 Å²	93.8	49%	0.487	50%	0.498	S	S	.	.	H	α-helix	trans	-61.6	-48	170.4	-70.2	163.5	0	0	0	110.3	A364 T365 S366 E370 V371 E372	A364-I368 VanDerWaalsContact O-CG1 3.28Å; A364-I368 WeakPolarHBondContact O-CG1 3.44Å; A364-I368 PolarHBondContact O-N 3.38Å; T365-I368 PolarHBondContact O-N 3.24Å; S366-I368 PolarHBondContact O-N 2.96Å; I368-E370 VanDerWaalsContact C-N 3.3Å; I368-E370 PolarHBondContact O-N 2.67Å; I368-V371 PolarHBondContact O-N 2.89Å; I368-E372 HydrophobicContact CG2-CG 4.27Å; I368-E372 WeakPolarHBondContact O-CB 3.5Å; I368-E372 WeakPolarHBondContact O-CG 3.11Å; I368-E372 PolarHBondContact O-N 3.19Å
369	C	89.1	Confident	88.7	Confident	71 Å²	71	94.1 Å²	94.1	48%	0.48	50%	0.5	S	S	.	.	H	α-helix	trans	-61.1	-35.8	177.5	-67.1	0	0	0	0	113.1	T365 S366 K373	T365-C369 PolarHBondContact O-N 2.86Å; T365-C369 PolarHBondContact O-SG 2.87Å; S366-C369 WeakPolarHBondContact O-CB 3.06Å; S366-C369 PolarHBondContact O-N 2.82Å; C369-K373 VanDerWaalsContact O-CB 3.32Å; C369-K373 WeakPolarHBondContact O-CB 3.3Å; C369-K373 PolarHBondContact O-N 2.89Å; C369-K373 VanDerWaalsContact O-N 3.08Å
370	E	90.3	Very high	88.6	Confident	97 Å²	97	95 Å²	95	45%	0.453	51%	0.507	S	S	.	.	H	α-helix	trans	-64.9	-51.2	173.8	-72.7	156.2	-162.2	0	0	111.3	S366 H367 I368 E372 K373 E374	S366-E370 WeakPolarHBondContact O-CG 3.42Å; S366-E370 PolarHBondContact O-N 3.17Å; S366-E370 PolarHBondContact OG-OE1 2.89Å; H367-E370 IonicContact ND1-OE2 2.87Å; H367-E370 PolarHBondContact ND1-OE2 2.79Å; H367-E370 PolarHBondContact O-N 2.92Å; I368-E370 VanDerWaalsContact C-N 3.3Å; I368-E370 PolarHBondContact O-N 2.67Å; E370-E372 PolarHBondContact O-N 3.48Å; E370-K373 WeakPolarHBondContact O-CB 3.46Å; E370-K373 PolarHBondContact O-N 3.18Å; E370-K373 VanDerWaalsContact O-N 3.17Å; E370-E374 PolarHBondContact O-N 3.43Å
371	V	87.7	Confident	88.7	Confident	65 Å²	65	95.2 Å²	95.2	39%	0.394	51%	0.508	S	S	.	.	H	α-helix	trans	-62.8	-41.3	178.5	171	0	0	0	0	111.4	H367 I368 K373 E374 L375	H367-V371 WeakPolarHBondContact O-CG2 3.35Å; H367-V371 PolarHBondContact O-N 2.85Å; I368-V371 PolarHBondContact O-N 2.89Å; V371-K373 VanDerWaalsContact C-N 3.31Å; V371-K373 PolarHBondContact O-N 2.78Å; V371-E374 PolarHBondContact O-N 2.8Å; V371-L375 VanDerWaalsContact O-CB 3.27Å; V371-L375 WeakPolarHBondContact O-CB 3.36Å; V371-L375 PolarHBondContact O-N 3.28Å
372	E	86.8	Confident	88.5	Confident	110 Å²	110	96.6 Å²	96.6	51%	0.514	51%	0.508	S	S	.	.	H	α-helix	trans	-62.1	-38.4	174.9	-75.6	-177	161.6	0	0	112.2	I368 E370 N376	I368-E372 HydrophobicContact CG2-CG 4.27Å; I368-E372 WeakPolarHBondContact O-CB 3.5Å; I368-E372 WeakPolarHBondContact O-CG 3.11Å; I368-E372 PolarHBondContact O-N 3.19Å; E370-E372 PolarHBondContact O-N 3.48Å; E372-N376 WeakPolarHBondContact O-CB 3.05Å; E372-N376 PolarHBondContact O-N 3.31Å; E372-N376 PolarHBondContact O-ND2 2.83Å
373	K	91.3	Very high	88.4	Confident	157 Å²	157	98.1 Å²	98.1	68%	0.683	51%	0.511	S	S	*	.	H	α-helix	trans	-65.6	-45.6	175.5	-176.1	-176.3	177.8	-173.3	0	111.6	C369 E370 V371 N376 V377	C369-K373 VanDerWaalsContact O-CB 3.32Å; C369-K373 WeakPolarHBondContact O-CB 3.3Å; C369-K373 PolarHBondContact O-N 2.89Å; C369-K373 VanDerWaalsContact O-N 3.08Å; E370-K373 WeakPolarHBondContact O-CB 3.46Å; E370-K373 PolarHBondContact O-N 3.18Å; E370-K373 VanDerWaalsContact O-N 3.17Å; V371-K373 VanDerWaalsContact C-N 3.31Å; V371-K373 PolarHBondContact O-N 2.78Å; K373-N376 PolarHBondContact O-N 2.99Å; K373-V377 WeakPolarHBondContact O-CG2 3.45Å; K373-V377 PolarHBondContact O-N 2.91Å
374	E	89	Confident	88.4	Confident	130 Å²	130	96.2 Å²	96.2	61%	0.607	50%	0.504	S	S	*	.	H	α-helix	trans	-62.1	-46.2	175.2	-70.6	-175.3	168.4	0	0	111.6	E370 V371 N376 V377 L378	E370-E374 PolarHBondContact O-N 3.43Å; V371-E374 PolarHBondContact O-N 2.8Å; E374-N376 VanDerWaalsContact C-N 3.27Å; E374-N376 PolarHBondContact O-N 2.72Å; E374-V377 WeakPolarHBondContact O-CB 3.45Å; E374-V377 PolarHBondContact O-N 3.04Å; E374-L378 WeakPolarHBondContact O-CD1 3.45Å; E374-L378 PolarHBondContact O-N 3.09Å
375	L	81.7	Confident	88.6	Confident	79 Å²	79	100.2 Å²	100.2	41%	0.414	51%	0.509	S	S	.	.	H	α-helix	trans	-60.7	-37.6	178.2	-149.7	-179.8	0	0	0	111.2	V371 L378 R379	V371-L375 VanDerWaalsContact O-CB 3.27Å; V371-L375 WeakPolarHBondContact O-CB 3.36Å; V371-L375 PolarHBondContact O-N 3.28Å; L375-L378 PolarHBondContact O-N 2.85Å; L375-R379 HydrophobicContact CD2-CG 3.99Å; L375-R379 WeakPolarHBondContact O-CB 3.38Å; L375-R379 VanDerWaalsContact O-CG 3.29Å; L375-R379 WeakPolarHBondContact O-CG 3.4Å; L375-R379 PolarHBondContact O-N 3.43Å
376	N	89.6	Confident	88.6	Confident	83 Å²	83	99.7 Å²	99.7	44%	0.444	51%	0.506	S	S	.	.	H	α-helix	trans	-70	-33.7	174.2	-73	-30.9	0	0	0	113.3	E372 K373 E374 R379 A380	E372-N376 WeakPolarHBondContact O-CB 3.05Å; E372-N376 PolarHBondContact O-N 3.31Å; E372-N376 PolarHBondContact O-ND2 2.83Å; K373-N376 PolarHBondContact O-N 2.99Å; E374-N376 VanDerWaalsContact C-N 3.27Å; E374-N376 PolarHBondContact O-N 2.72Å; N376-R379 PolarHBondContact OD1-NH1 3.33Å; N376-A380 PolarHBondContact O-N 3.34Å
377	V	92	Very high	88.5	Confident	71 Å²	71	100.2 Å²	100.2	43%	0.43	51%	0.506	S	S	.	.	H	α-helix	trans	-66.1	-45	170.7	171.3	0	0	0	0	111.1	K373 E374 R379 A380 Q381	K373-V377 WeakPolarHBondContact O-CG2 3.45Å; K373-V377 PolarHBondContact O-N 2.91Å; E374-V377 WeakPolarHBondContact O-CB 3.45Å; E374-V377 PolarHBondContact O-N 3.04Å; V377-R379 VanDerWaalsContact C-N 3.34Å; V377-R379 PolarHBondContact O-N 3.29Å; V377-A380 PolarHBondContact O-N 2.89Å; V377-Q381 HydrophobicContact CG1-CG 4.48Å; V377-Q381 WeakPolarHBondContact O-CG 3.05Å; V377-Q381 PolarHBondContact O-N 3.36Å
378	L	85.1	Confident	88.7	Confident	110 Å²	110	99.4 Å²	99.4	58%	0.576	50%	0.502	S	S	*	.	H	α-helix	trans	-61.8	-40	176	-92.7	67.3	0	0	0	111.9	E374 L375 Q381 H382	E374-L378 WeakPolarHBondContact O-CD1 3.45Å; E374-L378 PolarHBondContact O-N 3.09Å; L375-L378 PolarHBondContact O-N 2.85Å; L378-Q381 PolarHBondContact O-N 3.09Å; L378-H382 WeakPolarHBondContact O-CB 3.35Å; L378-H382 PolarHBondContact O-N 2.89Å
379	R	86.9	Confident	88.4	Confident	145 Å²	145	98.3 Å²	98.3	55%	0.547	50%	0.498	S	S	.	.	H	α-helix	trans	-59.5	-47.4	172.2	-77.5	169.1	175.9	156.1	0.2	111.7	L375 N376 V377 H382 V383	L375-R379 HydrophobicContact CD2-CG 3.99Å; L375-R379 WeakPolarHBondContact O-CB 3.38Å; L375-R379 VanDerWaalsContact O-CG 3.29Å; L375-R379 WeakPolarHBondContact O-CG 3.4Å; L375-R379 PolarHBondContact O-N 3.43Å; N376-R379 PolarHBondContact OD1-NH1 3.33Å; V377-R379 VanDerWaalsContact C-N 3.34Å; V377-R379 PolarHBondContact O-N 3.29Å; R379-H382 PolarHBondContact O-N 2.71Å; R379-V383 WeakPolarHBondContact O-CG2 3.49Å; R379-V383 PolarHBondContact O-N 3.49Å
380	A	90.4	Very high	88.4	Confident	62 Å²	62	100 Å²	100	51%	0.512	50%	0.498	S	S	.	.	H	α-helix	trans	-62.2	-44.5	179.3	0	0	0	0	0	111.9	N376 V377 H382 V383 Q384	N376-A380 PolarHBondContact O-N 3.34Å; V377-A380 PolarHBondContact O-N 2.89Å; A380-H382 PolarHBondContact O-N 3.41Å; A380-V383 PolarHBondContact O-N 2.81Å; A380-Q384 WeakPolarHBondContact O-CB 3.36Å; A380-Q384 PolarHBondContact O-N 2.95Å
381	Q	90.3	Very high	88.4	Confident	115 Å²	115	99 Å²	99	54%	0.537	50%	0.502	S	S	.	.	H	α-helix	trans	-61.9	-41.2	175.1	-71.6	174	-9.8	0	0	112.3	V377 L378 Q384 Y385	V377-Q381 HydrophobicContact CG1-CG 4.48Å; V377-Q381 WeakPolarHBondContact O-CG 3.05Å; V377-Q381 PolarHBondContact O-N 3.36Å; L378-Q381 PolarHBondContact O-N 3.09Å; Q381-Q384 PolarHBondContact O-N 3.23Å; Q381-Y385 WeakPolarHBondContact O-CB 3.4Å; Q381-Y385 PolarHBondContact O-N 2.84Å
382	H	83.2	Confident	88.5	Confident	121 Å²	121	98.7 Å²	98.7	56%	0.56	50%	0.503	S	S	*	.	H	α-helix	trans	-66.8	-42.3	177.4	-173.8	67.5	0	0	0	112.3	L378 R379 A380 Y385 V386	L378-H382 WeakPolarHBondContact O-CB 3.35Å; L378-H382 PolarHBondContact O-N 2.89Å; R379-H382 PolarHBondContact O-N 2.71Å; A380-H382 PolarHBondContact O-N 3.41Å; H382-Y385 PolarHBondContact O-N 3.36Å; H382-V386 WeakPolarHBondContact O-CG2 3.41Å; H382-V386 PolarHBondContact O-N 3.23Å
383	V	90.4	Very high	88.6	Confident	91 Å²	91	98.1 Å²	98.1	55%	0.552	50%	0.503	S	S	*	.	H	α-helix	trans	-60.7	-46.1	174.1	170	0	0	0	0	110.8	R379 A380 Y385 V386 T387	R379-V383 WeakPolarHBondContact O-CG2 3.49Å; R379-V383 PolarHBondContact O-N 3.49Å; A380-V383 PolarHBondContact O-N 2.81Å; V383-Y385 PolarHBondContact O-N 2.86Å; V383-V386 PolarHBondContact O-N 3.05Å; V383-T387 PolarHBondContact O-N 3Å; V383-T387 PolarHBondContact O-OG1 3.3Å
384	Q	91.2	Very high	88.6	Confident	108 Å²	108	95.3 Å²	95.3	51%	0.505	49%	0.493	S	S	.	.	H	α-helix	trans	-57.5	-50.9	176.1	-179.1	177.1	-12.5	0	0	111.3	A380 Q381 V386 T387 E388	A380-Q384 WeakPolarHBondContact O-CB 3.36Å; A380-Q384 PolarHBondContact O-N 2.95Å; Q381-Q384 PolarHBondContact O-N 3.23Å; Q384-V386 VanDerWaalsContact C-N 3.3Å; Q384-V386 PolarHBondContact O-N 2.91Å; Q384-T387 WeakPolarHBondContact CA-OG1 3.45Å; Q384-T387 PolarHBondContact O-N 3.41Å; Q384-T387 VanDerWaalsContact O-N 3.08Å; Q384-T387 PolarHBondContact O-OG1 3.34Å; Q384-E388 HydrophobicContact CG-CG 4.37Å; Q384-E388 VanDerWaalsContact CG-OE1 3.3Å; Q384-E388 WeakPolarHBondContact CG-OE1 3.49Å; Q384-E388 PolarHBondContact NE2-OE1 2.9Å; Q384-E388 WeakPolarHBondContact O-CG 3.3Å; Q384-E388 PolarHBondContact O-N 2.95Å
385	Y	90.6	Very high	88.8	Confident	138 Å²	138	95.5 Å²	95.5	54%	0.541	49%	0.493	S	S	.	.	H	α-helix	trans	-57.8	-39.2	178	177.1	-108.2	0	0	0	113.1	Q381 H382 V383 N389	Q381-Y385 WeakPolarHBondContact O-CB 3.4Å; Q381-Y385 PolarHBondContact O-N 2.84Å; H382-Y385 PolarHBondContact O-N 3.36Å; V383-Y385 PolarHBondContact O-N 2.86Å; Y385-N389 WeakPolarHBondContact CE1-ND2 3.35Å; Y385-N389 WeakPolarHBondContact O-CB 3.43Å; Y385-N389 PolarHBondContact O-N 3.48Å; Y385-N389 PolarHBondContact O-ND2 3.47Å; Y385-N389 PolarHBondContact OH-ND2 2.99Å
386	V	88.7	Confident	89.2	Confident	66 Å²	66	96 Å²	96	40%	0.4	50%	0.499	S	S	.	.	H	α-helix	trans	-64.7	-45.3	174	170	0	0	0	0	111	H382 V383 Q384 E388 N389 E390	H382-V386 WeakPolarHBondContact O-CG2 3.41Å; H382-V386 PolarHBondContact O-N 3.23Å; V383-V386 PolarHBondContact O-N 3.05Å; Q384-V386 VanDerWaalsContact C-N 3.3Å; Q384-V386 PolarHBondContact O-N 2.91Å; V386-E388 PolarHBondContact O-N 2.96Å; V386-N389 PolarHBondContact O-N 3.35Å; V386-E390 WeakPolarHBondContact O-CB 3.36Å; V386-E390 PolarHBondContact O-N 3.16Å
387	T	90.5	Very high	89.2	Confident	73 Å²	73	97.2 Å²	97.2	45%	0.448	50%	0.503	S	S	.	.	H	α-helix	trans	-67.2	-35	178.6	55.3	0	0	0	0	113.6	V383 Q384 E390 S391	V383-T387 PolarHBondContact O-N 3Å; V383-T387 PolarHBondContact O-OG1 3.3Å; Q384-T387 WeakPolarHBondContact CA-OG1 3.45Å; Q384-T387 PolarHBondContact O-N 3.41Å; Q384-T387 VanDerWaalsContact O-N 3.08Å; Q384-T387 PolarHBondContact O-OG1 3.34Å; T387-E390 PolarHBondContact O-N 2.93Å; T387-S391 WeakPolarHBondContact O-CB 3.28Å; T387-S391 PolarHBondContact O-N 2.89Å
388	E	91.3	Very high	89.3	Confident	100 Å²	100	98.5 Å²	98.5	47%	0.467	51%	0.511	S	S	.	.	H	α-helix	trans	-68.6	-40.8	175.3	-72.7	175.1	-175.2	0	0	111.5	Q384 V386 S392	Q384-E388 HydrophobicContact CG-CG 4.37Å; Q384-E388 VanDerWaalsContact CG-OE1 3.3Å; Q384-E388 WeakPolarHBondContact CG-OE1 3.49Å; Q384-E388 PolarHBondContact NE2-OE1 2.9Å; Q384-E388 WeakPolarHBondContact O-CG 3.3Å; Q384-E388 PolarHBondContact O-N 2.95Å; V386-E388 PolarHBondContact O-N 2.96Å; E388-S392 WeakPolarHBondContact O-CB 3.25Å; E388-S392 PolarHBondContact O-N 3.23Å; E388-S392 PolarHBondContact O-OG 3.32Å
389	N	81.3	Confident	89.6	Confident	73 Å²	73	98.9 Å²	98.9	39%	0.39	51%	0.511	S	S	.	.	H	α-helix	trans	-64	-41.8	171.6	-82.3	-24	0	0	0	112.4	Y385 V386 S392 L393	Y385-N389 WeakPolarHBondContact CE1-ND2 3.35Å; Y385-N389 WeakPolarHBondContact O-CB 3.43Å; Y385-N389 PolarHBondContact O-N 3.48Å; Y385-N389 PolarHBondContact O-ND2 3.47Å; Y385-N389 PolarHBondContact OH-ND2 2.99Å; V386-N389 PolarHBondContact O-N 3.35Å; N389-S392 PolarHBondContact O-N 2.99Å; N389-L393 WeakPolarHBondContact O-CB 3.29Å; N389-L393 PolarHBondContact O-N 3.35Å
390	E	88.1	Confident	89.8	Confident	105 Å²	105	97.9 Å²	97.9	49%	0.491	52%	0.516	S	S	.	.	H	α-helix	trans	-66	-44.8	179	-171.3	177.1	179.2	0	0	111.4	V386 T387 S392 L393 Q394	V386-E390 WeakPolarHBondContact O-CB 3.36Å; V386-E390 PolarHBondContact O-N 3.16Å; T387-E390 PolarHBondContact O-N 2.93Å; E390-S392 VanDerWaalsContact C-N 3.33Å; E390-S392 PolarHBondContact O-N 3.41Å; E390-L393 WeakPolarHBondContact O-CB 3.38Å; E390-L393 PolarHBondContact O-N 3.18Å; E390-Q394 WeakPolarHBondContact O-CG 3.49Å; E390-Q394 PolarHBondContact O-N 2.9Å; E390-Q394 PolarHBondContact OE1-NE2 3.36Å
391	S	91	Very high	89.9	Confident	76 Å²	76	97.8 Å²	97.8	53%	0.531	52%	0.515	S	S	.	.	H	α-helix	trans	-59.3	-43	173.2	-175.2	0	0	0	0	111.9	T387 L393 Q394 Q395	T387-S391 WeakPolarHBondContact O-CB 3.28Å; T387-S391 PolarHBondContact O-N 2.89Å; S391-L393 PolarHBondContact O-N 2.63Å; S391-Q394 PolarHBondContact O-N 3.1Å; S391-Q395 PolarHBondContact O-N 2.9Å
392	S	89.4	Confident	90.1	Very high	60 Å²	60	94.9 Å²	94.9	42%	0.42	51%	0.508	S	S	.	.	H	α-helix	trans	-62.9	-40.5	175.4	-58.2	0	0	0	0	112.1	E388 N389 E390 Q395 V396	E388-S392 WeakPolarHBondContact O-CB 3.25Å; E388-S392 PolarHBondContact O-N 3.23Å; E388-S392 PolarHBondContact O-OG 3.32Å; N389-S392 PolarHBondContact O-N 2.99Å; E390-S392 VanDerWaalsContact C-N 3.33Å; E390-S392 PolarHBondContact O-N 3.41Å; S392-Q395 PolarHBondContact O-N 3.41Å; S392-V396 WeakPolarHBondContact O-CG2 3.45Å; S392-V396 PolarHBondContact O-N 2.73Å
393	L	87.9	Confident	90.4	Very high	97 Å²	97	93 Å²	93	51%	0.508	50%	0.504	S	S	.	.	H	α-helix	trans	-65.6	-42.5	176	-179.6	62.4	0	0	0	111.5	N389 E390 S391 Q395 V396 Q397	N389-L393 WeakPolarHBondContact O-CB 3.29Å; N389-L393 PolarHBondContact O-N 3.35Å; E390-L393 WeakPolarHBondContact O-CB 3.38Å; E390-L393 PolarHBondContact O-N 3.18Å; S391-L393 PolarHBondContact O-N 2.63Å; L393-Q395 VanDerWaalsContact C-N 3.34Å; L393-V396 PolarHBondContact O-N 3.12Å; L393-Q397 HydrophobicContact CD1-CG 4.46Å; L393-Q397 WeakPolarHBondContact O-CB 3.44Å; L393-Q397 VanDerWaalsContact O-CG 3.26Å; L393-Q397 WeakPolarHBondContact O-CG 3.3Å; L393-Q397 PolarHBondContact O-N 3.12Å
394	Q	92.5	Very high	90.4	Very high	99 Å²	99	93.6 Å²	93.6	46%	0.463	50%	0.501	S	S	.	.	H	α-helix	trans	-63	-39	175	-70.2	175.9	16.5	0	0	111.8	E390 S391 Q397 T398	E390-Q394 WeakPolarHBondContact O-CG 3.49Å; E390-Q394 PolarHBondContact O-N 2.9Å; E390-Q394 PolarHBondContact OE1-NE2 3.36Å; S391-Q394 PolarHBondContact O-N 3.1Å; Q394-Q397 PolarHBondContact O-N 3.38Å; Q394-T398 WeakPolarHBondContact O-CB 3.35Å; Q394-T398 PolarHBondContact O-N 3.39Å; Q394-T398 PolarHBondContact O-OG1 2.93Å
395	Q	93.6	Very high	90.7	Very high	134 Å²	134	93.9 Å²	93.9	63%	0.626	50%	0.501	S	S	*	.	H	α-helix	trans	-63.1	-46	174.4	-168.8	-178.9	23.7	0	0	111.8	S391 S392 L393 T398 M399	S391-Q395 PolarHBondContact O-N 2.9Å; S392-Q395 PolarHBondContact O-N 3.41Å; L393-Q395 VanDerWaalsContact C-N 3.34Å; Q395-T398 PolarHBondContact O-N 3.19Å; Q395-M399 PolarHBondContact O-N 3.35Å
396	V	88.4	Confident	90.8	Very high	89 Å²	89	90.7 Å²	90.7	54%	0.539	49%	0.493	S	S	.	.	H	α-helix	trans	-65.2	-39.8	176.7	171.4	0	0	0	0	111.7	S392 L393 T398 M399 L400	S392-V396 WeakPolarHBondContact O-CG2 3.45Å; S392-V396 PolarHBondContact O-N 2.73Å; L393-V396 PolarHBondContact O-N 3.12Å; V396-T398 VanDerWaalsContact C-N 3.34Å; V396-T398 PolarHBondContact O-N 3.39Å; V396-M399 PolarHBondContact O-N 3.46Å; V396-L400 WeakPolarHBondContact O-CB 3.34Å; V396-L400 PolarHBondContact O-N 3.17Å
397	Q	90.1	Very high	91	Very high	109 Å²	109	94.1 Å²	94.1	51%	0.509	50%	0.503	S	S	.	.	H	α-helix	trans	-62.5	-40.1	174.1	-75	174.3	6.3	0	0	112	L393 Q394 L400 A401	L393-Q397 HydrophobicContact CD1-CG 4.46Å; L393-Q397 WeakPolarHBondContact O-CB 3.44Å; L393-Q397 VanDerWaalsContact O-CG 3.26Å; L393-Q397 WeakPolarHBondContact O-CG 3.3Å; L393-Q397 PolarHBondContact O-N 3.12Å; Q394-Q397 PolarHBondContact O-N 3.38Å; Q397-L400 PolarHBondContact O-N 3.35Å; Q397-A401 WeakPolarHBondContact O-CB 3.29Å; Q397-A401 PolarHBondContact O-N 2.9Å
398	T	93.8	Very high	91.2	Very high	98 Å²	98	95.1 Å²	95.1	60%	0.601	51%	0.505	S	S	*	.	H	α-helix	trans	-65.6	-45.2	177.5	-56.2	0	0	0	0	111.3	Q394 Q395 V396 A401 S402	Q394-T398 WeakPolarHBondContact O-CB 3.35Å; Q394-T398 PolarHBondContact O-N 3.39Å; Q394-T398 PolarHBondContact O-OG1 2.93Å; Q395-T398 PolarHBondContact O-N 3.19Å; V396-T398 VanDerWaalsContact C-N 3.34Å; V396-T398 PolarHBondContact O-N 3.39Å; T398-A401 PolarHBondContact O-N 2.95Å; T398-S402 PolarHBondContact O-N 3.43Å
399	M	92.6	Very high	91.4	Very high	118 Å²	118	94.3 Å²	94.3	58%	0.581	50%	0.501	S	S	*	.	H	α-helix	trans	-62.5	-41.6	175	-173.6	-170.9	-63.7	0	0	112.1	Q395 V396 A401 S402 T403	Q395-M399 PolarHBondContact O-N 3.35Å; V396-M399 PolarHBondContact O-N 3.46Å; M399-A401 VanDerWaalsContact C-N 3.3Å; M399-A401 PolarHBondContact O-N 2.94Å; M399-S402 PolarHBondContact O-N 3.12Å; M399-S402 PolarHBondContact O-OG 3.02Å; M399-T403 PolarHBondContact O-N 2.92Å; M399-T403 PolarHBondContact O-OG1 2.86Å
400	L	89.8	Confident	91.9	Very high	123 Å²	123	96 Å²	96	64%	0.644	51%	0.51	S	S	*	.	H	α-helix	trans	-63.5	-37.9	175.7	-176.9	64.2	0	0	0	111.6	V396 Q397 Q404	V396-L400 WeakPolarHBondContact O-CB 3.34Å; V396-L400 PolarHBondContact O-N 3.17Å; Q397-L400 PolarHBondContact O-N 3.35Å; L400-Q404 VanDerWaalsContact O-CB 3.23Å; L400-Q404 WeakPolarHBondContact O-CB 3.34Å; L400-Q404 PolarHBondContact O-N 3.05Å
401	A	93.9	Very high	92.1	Very high	61 Å²	61	93.5 Å²	93.5	50%	0.504	51%	0.507	S	S	.	.	H	α-helix	trans	-67.3	-41.2	176.7	0	0	0	0	0	112.5	Q397 T398 M399 K405	Q397-A401 WeakPolarHBondContact O-CB 3.29Å; Q397-A401 PolarHBondContact O-N 2.9Å; T398-A401 PolarHBondContact O-N 2.95Å; M399-A401 VanDerWaalsContact C-N 3.3Å; M399-A401 PolarHBondContact O-N 2.94Å; A401-K405 PolarHBondContact O-N 2.65Å; A401-K405 VanDerWaalsContact O-N 3.08Å
402	S	94	Very high	92.3	Very high	54 Å²	54	94.1 Å²	94.1	38%	0.378	50%	0.504	S	S	.	.	H	α-helix	trans	-65.4	-50.3	173.9	58.4	0	0	0	0	111.3	T398 M399 Q404 K405 D406	T398-S402 PolarHBondContact O-N 3.43Å; M399-S402 PolarHBondContact O-N 3.12Å; M399-S402 PolarHBondContact O-OG 3.02Å; S402-Q404 PolarHBondContact O-N 3.36Å; S402-K405 CarbonylContact O-C 3.57Å; S402-K405 WeakPolarHBondContact O-CA 3.36Å; S402-K405 WeakPolarHBondContact O-CB 3.2Å; S402-K405 PolarHBondContact O-N 2.85Å; S402-D406 PolarHBondContact O-N 3.32Å
403	T	89.7	Confident	92.5	Very high	80 Å²	80	96.5 Å²	96.5	49%	0.491	51%	0.508	S	S	.	.	H	α-helix	trans	-60.1	-32.5	178.2	-58.8	0	0	0	0	113	M399 K407	M399-T403 PolarHBondContact O-N 2.92Å; M399-T403 PolarHBondContact O-OG1 2.86Å; T403-K407 VanDerWaalsContact O-CB 3.25Å; T403-K407 WeakPolarHBondContact O-CB 3.44Å; T403-K407 PolarHBondContact O-N 2.79Å
404	Q	91.1	Very high	92.6	Very high	104 Å²	104	96.7 Å²	96.7	49%	0.486	51%	0.51	S	S	.	.	H	α-helix	trans	-72.6	-30.2	174.1	178.7	59.2	25.6	0	0	113	L400 S402 L408	L400-Q404 VanDerWaalsContact O-CB 3.23Å; L400-Q404 WeakPolarHBondContact O-CB 3.34Å; L400-Q404 PolarHBondContact O-N 3.05Å; S402-Q404 PolarHBondContact O-N 3.36Å; Q404-L408 PolarHBondContact O-N 3.4Å
405	K	96.3	Very high	92.6	Very high	114 Å²	114	96.5 Å²	96.5	50%	0.496	51%	0.509	S	S	.	.	H	α-helix	trans	-68.9	-48.9	169.3	174.6	-177.7	170.2	-64.1	0	110.7	A401 S402 K407 L408 E409	A401-K405 PolarHBondContact O-N 2.65Å; A401-K405 VanDerWaalsContact O-N 3.08Å; S402-K405 CarbonylContact O-C 3.57Å; S402-K405 WeakPolarHBondContact O-CA 3.36Å; S402-K405 WeakPolarHBondContact O-CB 3.2Å; S402-K405 PolarHBondContact O-N 2.85Å; K405-K407 VanDerWaalsContact C-N 3.29Å; K405-K407 PolarHBondContact O-N 3.47Å; K405-L408 WeakPolarHBondContact O-CA 3.2Å; K405-L408 WeakPolarHBondContact O-CB 3.35Å; K405-L408 PolarHBondContact O-N 3.03Å; K405-E409 WeakPolarHBondContact CE-OE1 3.34Å; K405-E409 WeakPolarHBondContact CG-OE1 3.25Å; K405-E409 IonicContact NZ-OE1 3.52Å; K405-E409 PolarHBondContact NZ-OE1 2.94Å; K405-E409 IonicContact NZ-OE2 2.97Å; K405-E409 PolarHBondContact NZ-OE2 2.96Å; K405-E409 PolarHBondContact O-N 2.91Å
406	D	93.4	Very high	92.7	Very high	72 Å²	72	95.2 Å²	95.2	39%	0.385	50%	0.503	S	S	.	.	H	α-helix	trans	-59.3	-41.9	179.4	-50.8	-28.8	0	0	0	111.1	S402 L408 E409 L410	S402-D406 PolarHBondContact O-N 3.32Å; D406-L408 VanDerWaalsContact C-N 3.3Å; D406-L408 PolarHBondContact O-N 3.39Å; D406-E409 PolarHBondContact O-N 3.49Å; D406-L410 WeakPolarHBondContact O-CB 3.46Å; D406-L410 VanDerWaalsContact O-CG 3.31Å; D406-L410 WeakPolarHBondContact O-CG 3.11Å; D406-L410 PolarHBondContact O-N 3.31Å
407	K	92	Very high	92.7	Very high	137 Å²	137	95.7 Å²	95.7	60%	0.596	50%	0.499	S	S	*	.	H	α-helix	trans	-58.9	-37.8	172.9	178.2	-179	174.2	-175.9	0	112.8	T403 K405 A411	T403-K407 VanDerWaalsContact O-CB 3.25Å; T403-K407 WeakPolarHBondContact O-CB 3.44Å; T403-K407 PolarHBondContact O-N 2.79Å; K405-K407 VanDerWaalsContact C-N 3.29Å; K405-K407 PolarHBondContact O-N 3.47Å; K407-A411 VanDerWaalsContact O-CB 3.31Å; K407-A411 WeakPolarHBondContact O-CB 3.29Å; K407-A411 PolarHBondContact O-N 3.49Å
408	L	94.9	Very high	92.9	Very high	95 Å²	95	96 Å²	96	50%	0.497	50%	0.498	S	S	.	.	H	α-helix	trans	-75.2	-37.2	179	-173.3	139.4	0	0	0	111.5	Q404 K405 D406 A411 N412	Q404-L408 PolarHBondContact O-N 3.4Å; K405-L408 WeakPolarHBondContact O-CA 3.2Å; K405-L408 WeakPolarHBondContact O-CB 3.35Å; K405-L408 PolarHBondContact O-N 3.03Å; D406-L408 VanDerWaalsContact C-N 3.3Å; D406-L408 PolarHBondContact O-N 3.39Å; L408-A411 PolarHBondContact O-N 3.19Å; L408-N412 PolarHBondContact O-N 3.36Å; L408-N412 PolarHBondContact O-ND2 2.89Å; L408-N412 PolarHBondContact O-OD1 3.35Å
409	E	95.3	Very high	93	Very high	82 Å²	82	98.3 Å²	98.3	38%	0.383	50%	0.496	S	S	.	.	H	α-helix	trans	-65	-43.8	173.2	-73.5	172.3	-164.7	0	0	111.7	K405 D406 A411 N412 Q413	K405-E409 WeakPolarHBondContact CE-OE1 3.34Å; K405-E409 WeakPolarHBondContact CG-OE1 3.25Å; K405-E409 IonicContact NZ-OE1 3.52Å; K405-E409 PolarHBondContact NZ-OE1 2.94Å; K405-E409 IonicContact NZ-OE2 2.97Å; K405-E409 PolarHBondContact NZ-OE2 2.96Å; K405-E409 PolarHBondContact O-N 2.91Å; D406-E409 PolarHBondContact O-N 3.49Å; E409-A411 VanDerWaalsContact C-N 3.35Å; E409-A411 PolarHBondContact O-N 3.35Å; E409-N412 PolarHBondContact O-N 2.89Å; E409-Q413 WeakPolarHBondContact O-CG 3.34Å; E409-Q413 PolarHBondContact O-N 3.39Å
410	L	93	Very high	93.1	Very high	109 Å²	109	96.5 Å²	96.5	57%	0.571	49%	0.485	S	S	*	.	H	α-helix	trans	-64.4	-35.8	173	-70.7	169.4	0	0	0	112.8	D406 L414	D406-L410 WeakPolarHBondContact O-CB 3.46Å; D406-L410 VanDerWaalsContact O-CG 3.31Å; D406-L410 WeakPolarHBondContact O-CG 3.11Å; D406-L410 PolarHBondContact O-N 3.31Å; L410-L414 WeakPolarHBondContact O-CB 3.28Å; L410-L414 PolarHBondContact O-N 2.99Å
411	A	91.4	Very high	93.2	Very high	52 Å²	52	95 Å²	95	43%	0.43	48%	0.481	S	S	.	.	H	α-helix	trans	-66.6	-41.4	174.8	0	0	0	0	0	112	K407 L408 E409 L414 E415	K407-A411 VanDerWaalsContact O-CB 3.31Å; K407-A411 WeakPolarHBondContact O-CB 3.29Å; K407-A411 PolarHBondContact O-N 3.49Å; L408-A411 PolarHBondContact O-N 3.19Å; E409-A411 VanDerWaalsContact C-N 3.35Å; E409-A411 PolarHBondContact O-N 3.35Å; A411-L414 PolarHBondContact O-N 3.43Å; A411-E415 PolarHBondContact O-N 3.01Å
412	N	94.9	Very high	93.1	Very high	89 Å²	89	98 Å²	98	48%	0.476	49%	0.485	S	S	.	.	H	α-helix	trans	-64.6	-43.7	175.6	-67.1	-14.8	0	0	0	111.5	L408 E409 L414 E415 E416	L408-N412 PolarHBondContact O-N 3.36Å; L408-N412 PolarHBondContact O-ND2 2.89Å; L408-N412 PolarHBondContact O-OD1 3.35Å; E409-N412 PolarHBondContact O-N 2.89Å; N412-L414 VanDerWaalsContact C-N 3.33Å; N412-L414 PolarHBondContact O-N 3.01Å; N412-E415 PolarHBondContact O-N 3.46Å; N412-E415 VanDerWaalsContact O-N 3.16Å; N412-E416 PolarHBondContact O-N 3.5Å
413	Q	93.8	Very high	93.1	Very high	110 Å²	110	99.8 Å²	99.8	51%	0.514	49%	0.49	S	S	.	.	H	α-helix	trans	-59.2	-43.4	174	-71.9	170.4	16.2	0	0	111.5	E409 E415 E416 E417	E409-Q413 WeakPolarHBondContact O-CG 3.34Å; E409-Q413 PolarHBondContact O-N 3.39Å; Q413-E415 VanDerWaalsContact C-N 3.3Å; Q413-E415 PolarHBondContact O-N 3.34Å; Q413-E416 PolarHBondContact O-N 3.44Å; Q413-E417 WeakPolarHBondContact O-CG 3.39Å; Q413-E417 PolarHBondContact O-N 3.47Å
414	L	90.3	Very high	93.2	Very high	102 Å²	102	100.5 Å²	100.5	53%	0.534	49%	0.49	S	S	.	.	H	α-helix	trans	-64.6	-32.1	176.3	-178.8	62.9	0	0	0	112.8	L410 A411 N412 K418	L410-L414 WeakPolarHBondContact O-CB 3.28Å; L410-L414 PolarHBondContact O-N 2.99Å; A411-L414 PolarHBondContact O-N 3.43Å; N412-L414 VanDerWaalsContact C-N 3.33Å; N412-L414 PolarHBondContact O-N 3.01Å; L414-K418 WeakPolarHBondContact O-CB 3.31Å; L414-K418 WeakPolarHBondContact O-CD 3.43Å; L414-K418 VanDerWaalsContact O-CG 3.23Å; L414-K418 WeakPolarHBondContact O-CG 3.37Å; L414-K418 PolarHBondContact O-N 3.29Å; L414-K418 VanDerWaalsContact O-N 3.14Å
415	E	92.6	Very high	93	Very high	95 Å²	95	100.8 Å²	100.8	44%	0.444	49%	0.492	S	S	.	.	H	α-helix	trans	-74.1	-37.6	173.2	-162.5	-179.1	157.3	0	0	112.1	A411 N412 Q413 K418 R419	A411-E415 PolarHBondContact O-N 3.01Å; N412-E415 PolarHBondContact O-N 3.46Å; N412-E415 VanDerWaalsContact O-N 3.16Å; Q413-E415 VanDerWaalsContact C-N 3.3Å; Q413-E415 PolarHBondContact O-N 3.34Å; E415-K418 WeakPolarHBondContact O-CB 3.33Å; E415-K418 PolarHBondContact O-N 3.2Å; E415-R419 WeakPolarHBondContact O-CG 3.48Å; E415-R419 PolarHBondContact O-N 3.12Å; E415-R419 IonicContact OE1-CZ 2.72Å; E415-R419 IonicContact OE1-NE 3.47Å; E415-R419 IonicContact OE1-NH2 2.93Å; E415-R419 PolarHBondContact OE1-NH2 3.43Å
416	E	94.8	Very high	92.9	Very high	106 Å²	106	101.5 Å²	101.5	50%	0.495	50%	0.495	S	S	.	.	H	α-helix	trans	-64.8	-44.7	175.4	-159	-168.8	123.1	0	0	111.8	N412 Q413 K418 R419 K420	N412-E416 PolarHBondContact O-N 3.5Å; Q413-E416 PolarHBondContact O-N 3.44Å; E416-K418 VanDerWaalsContact C-N 3.34Å; E416-K418 PolarHBondContact O-N 3.45Å; E416-R419 PolarHBondContact O-N 3.5Å; E416-K420 WeakPolarHBondContact O-CG 3.41Å; E416-K420 PolarHBondContact O-N 2.99Å; E416-K420 WeakPolarHBondContact OE1-CE 3.34Å; E416-K420 IonicContact OE1-NZ 3.15Å; E416-K420 PolarHBondContact OE1-NZ 3.12Å
417	E	90.1	Very high	92.8	Very high	99 Å²	99	103.7 Å²	103.7	46%	0.463	50%	0.498	S	S	.	.	H	α-helix	trans	-65.1	-34.6	174.4	-68.1	-53.3	125.5	0	0	112.5	Q413 K420 V421	Q413-E417 WeakPolarHBondContact O-CG 3.39Å; Q413-E417 PolarHBondContact O-N 3.47Å; E417-K420 PolarHBondContact O-N 2.87Å; E417-K420 WeakPolarHBondContact OE1-CD 3.41Å; E417-K420 IonicContact OE1-NZ 2.79Å; E417-K420 PolarHBondContact OE1-NZ 2.87Å; E417-V421 WeakPolarHBondContact O-CG2 3.48Å; E417-V421 PolarHBondContact O-N 3.37Å
418	K	93	Very high	92.7	Very high	115 Å²	115	101.4 Å²	101.4	50%	0.5	50%	0.495	S	S	.	.	H	α-helix	trans	-60.9	-46.7	170.8	-80.1	169.7	-179	178.1	0	111.9	L414 E415 E416 K420 V421 E422	L414-K418 WeakPolarHBondContact O-CB 3.31Å; L414-K418 WeakPolarHBondContact O-CD 3.43Å; L414-K418 VanDerWaalsContact O-CG 3.23Å; L414-K418 WeakPolarHBondContact O-CG 3.37Å; L414-K418 PolarHBondContact O-N 3.29Å; L414-K418 VanDerWaalsContact O-N 3.14Å; E415-K418 WeakPolarHBondContact O-CB 3.33Å; E415-K418 PolarHBondContact O-N 3.2Å; E416-K418 VanDerWaalsContact C-N 3.34Å; E416-K418 PolarHBondContact O-N 3.45Å; K418-K420 VanDerWaalsContact C-N 3.28Å; K418-K420 PolarHBondContact O-N 3.24Å; K418-V421 CarbonylContact O-C 3.41Å; K418-V421 PolarHBondContact O-N 3.46Å; K418-V421 VanDerWaalsContact O-N 3.1Å; K418-E422 WeakPolarHBondContact O-CG 3.27Å; K418-E422 PolarHBondContact O-N 3.3Å
419	R	95.8	Very high	92.3	Very high	148 Å²	148	101.4 Å²	101.4	56%	0.558	49%	0.493	S	S	*	.	H	α-helix	trans	-62.7	-34.7	177.2	-67.3	174.5	-168.1	172.8	3.3	112.1	E415 E416 E422 D423	E415-R419 WeakPolarHBondContact O-CG 3.48Å; E415-R419 PolarHBondContact O-N 3.12Å; E415-R419 IonicContact OE1-CZ 2.72Å; E415-R419 IonicContact OE1-NE 3.47Å; E415-R419 IonicContact OE1-NH2 2.93Å; E415-R419 PolarHBondContact OE1-NH2 3.43Å; E416-R419 PolarHBondContact O-N 3.5Å; R419-E422 PolarHBondContact O-N 2.86Å; R419-D423 WeakPolarHBondContact O-CB 3.43Å; R419-D423 PolarHBondContact O-N 3.19Å
420	K	95.5	Very high	92	Very high	80 Å²	80	102.7 Å²	102.7	35%	0.348	50%	0.498	S	S	.	.	H	α-helix	trans	-66.4	-39.9	172	-68.6	168.5	-167.1	164.2	0	112.2	E416 E417 K418 L424	E416-K420 WeakPolarHBondContact O-CG 3.41Å; E416-K420 PolarHBondContact O-N 2.99Å; E416-K420 WeakPolarHBondContact OE1-CE 3.34Å; E416-K420 IonicContact OE1-NZ 3.15Å; E416-K420 PolarHBondContact OE1-NZ 3.12Å; E417-K420 PolarHBondContact O-N 2.87Å; E417-K420 WeakPolarHBondContact OE1-CD 3.41Å; E417-K420 IonicContact OE1-NZ 2.79Å; E417-K420 PolarHBondContact OE1-NZ 2.87Å; K418-K420 VanDerWaalsContact C-N 3.28Å; K418-K420 PolarHBondContact O-N 3.24Å; K420-L424 WeakPolarHBondContact O-CB 3.25Å; K420-L424 VanDerWaalsContact O-CG 3.24Å; K420-L424 WeakPolarHBondContact O-CG 3.4Å; K420-L424 PolarHBondContact O-N 2.58Å
421	V	91.5	Very high	91.4	Very high	91 Å²	91	103 Å²	103	55%	0.552	50%	0.497	S	S	*	.	H	α-helix	trans	-66.4	-39.3	174.2	170	0	0	0	0	111.3	E417 K418 L424 Q425	E417-V421 WeakPolarHBondContact O-CG2 3.48Å; E417-V421 PolarHBondContact O-N 3.37Å; K418-V421 CarbonylContact O-C 3.41Å; K418-V421 PolarHBondContact O-N 3.46Å; K418-V421 VanDerWaalsContact O-N 3.1Å; V421-L424 PolarHBondContact O-N 3.02Å; V421-Q425 VanDerWaalsContact O-CB 3.29Å; V421-Q425 WeakPolarHBondContact O-CB 3.29Å; V421-Q425 PolarHBondContact O-N 3.08Å
422	E	92.3	Very high	90.8	Very high	124 Å²	124	103.8 Å²	103.8	58%	0.579	50%	0.499	S	S	*	.	H	α-helix	trans	-65	-43.5	175.5	-71.7	164.7	-176	0	0	111.9	K418 R419 Q425 F426	K418-E422 WeakPolarHBondContact O-CG 3.27Å; K418-E422 PolarHBondContact O-N 3.3Å; R419-E422 PolarHBondContact O-N 2.86Å; E422-Q425 PolarHBondContact O-N 3.42Å; E422-F426 PolarHBondContact O-N 3.5Å
423	D	93.9	Very high	90.1	Very high	91 Å²	91	104.8 Å²	104.8	49%	0.487	50%	0.504	S	S	.	.	H	α-helix	trans	-63.1	-46.7	173.6	-179.1	81	0	0	0	112.2	R419 Q425 F426 R427	R419-D423 WeakPolarHBondContact O-CB 3.43Å; R419-D423 PolarHBondContact O-N 3.19Å; D423-Q425 VanDerWaalsContact C-N 3.31Å; D423-Q425 PolarHBondContact O-N 3.02Å; D423-F426 PolarHBondContact O-N 3.14Å; D423-R427 WeakPolarHBondContact O-CB 3.49Å; D423-R427 WeakPolarHBondContact O-CG 3.42Å; D423-R427 PolarHBondContact O-N 2.92Å
424	L	91.5	Very high	89.3	Confident	96 Å²	96	103 Å²	103	50%	0.503	50%	0.5	S	S	.	.	H	α-helix	trans	-62.3	-38	175.5	-73.7	171.7	0	0	0	112	K420 V421 R427 V428	K420-L424 WeakPolarHBondContact O-CB 3.25Å; K420-L424 VanDerWaalsContact O-CG 3.24Å; K420-L424 WeakPolarHBondContact O-CG 3.4Å; K420-L424 PolarHBondContact O-N 2.58Å; V421-L424 PolarHBondContact O-N 3.02Å; L424-R427 PolarHBondContact O-N 3.34Å; L424-V428 WeakPolarHBondContact O-CB 3.33Å; L424-V428 VanDerWaalsContact O-CG2 3.28Å; L424-V428 WeakPolarHBondContact O-CG2 3.34Å; L424-V428 PolarHBondContact O-N 2.93Å
425	Q	87.4	Confident	88.7	Confident	110 Å²	110	102.8 Å²	102.8	51%	0.514	50%	0.495	S	S	.	.	H	α-helix	trans	-66.2	-46.3	175.4	-176.9	176.8	-24.6	0	0	111	V421 E422 D423 R427 V428 E429	V421-Q425 VanDerWaalsContact O-CB 3.29Å; V421-Q425 WeakPolarHBondContact O-CB 3.29Å; V421-Q425 PolarHBondContact O-N 3.08Å; E422-Q425 PolarHBondContact O-N 3.42Å; D423-Q425 VanDerWaalsContact C-N 3.31Å; D423-Q425 PolarHBondContact O-N 3.02Å; Q425-R427 VanDerWaalsContact C-N 3.31Å; Q425-R427 PolarHBondContact O-N 3.27Å; Q425-V428 PolarHBondContact O-N 3.01Å; Q425-V428 VanDerWaalsContact O-N 3.17Å; Q425-E429 WeakPolarHBondContact CG-OE1 3.39Å; Q425-E429 PolarHBondContact NE2-OE1 2.95Å; Q425-E429 WeakPolarHBondContact O-CG 3.42Å; Q425-E429 PolarHBondContact O-N 3.08Å
426	F	93.2	Very high	87.7	Confident	129 Å²	129	100.1 Å²	100.1	57%	0.566	49%	0.493	S	S	*	.	H	α-helix	trans	-57.2	-44.7	175.6	179.3	-94.2	0	0	0	111.7	E422 D423 E429 E430	E422-F426 PolarHBondContact O-N 3.5Å; D423-F426 PolarHBondContact O-N 3.14Å; F426-E429 PolarHBondContact O-N 2.87Å; F426-E430 PolarHBondContact O-N 2.72Å
427	R	91.4	Very high	86.7	Confident	118 Å²	118	100 Å²	100	45%	0.445	50%	0.496	S	S	.	.	H	α-helix	trans	-64.3	-38.6	175.9	-73.3	-177.5	57	-154.4	-13.5	113.3	D423 L424 Q425 E429 E430 E431	D423-R427 WeakPolarHBondContact O-CB 3.49Å; D423-R427 WeakPolarHBondContact O-CG 3.42Å; D423-R427 PolarHBondContact O-N 2.92Å; L424-R427 PolarHBondContact O-N 3.34Å; Q425-R427 VanDerWaalsContact C-N 3.31Å; Q425-R427 PolarHBondContact O-N 3.27Å; R427-E429 VanDerWaalsContact C-N 3.33Å; R427-E430 PolarHBondContact O-N 2.81Å; R427-E431 IonicContact NH2-OE1 3.68Å; R427-E431 WeakPolarHBondContact O-CB 3.33Å; R427-E431 WeakPolarHBondContact O-CG 3.37Å; R427-E431 PolarHBondContact O-N 2.85Å
428	V	89.3	Confident	85.4	Confident	88 Å²	88	100.7 Å²	100.7	53%	0.533	50%	0.502	S	S	.	.	H	α-helix	trans	-67.9	-34	174.4	167	0	0	0	0	111.3	L424 Q425 S432	L424-V428 WeakPolarHBondContact O-CB 3.33Å; L424-V428 VanDerWaalsContact O-CG2 3.28Å; L424-V428 WeakPolarHBondContact O-CG2 3.34Å; L424-V428 PolarHBondContact O-N 2.93Å; Q425-V428 PolarHBondContact O-N 3.01Å; Q425-V428 VanDerWaalsContact O-N 3.17Å; V428-S432 WeakPolarHBondContact O-CB 3.31Å; V428-S432 PolarHBondContact O-N 3.36Å; V428-S432 PolarHBondContact O-OG 3.38Å
429	E	87.6	Confident	84	Confident	96 Å²	96	99.5 Å²	99.5	45%	0.449	50%	0.498	S	S	.	.	H	α-helix	trans	-69	-41.8	173	-72.5	176.1	-160.3	0	0	111.4	Q425 F426 R427 S432 I433	Q425-E429 WeakPolarHBondContact CG-OE1 3.39Å; Q425-E429 PolarHBondContact NE2-OE1 2.95Å; Q425-E429 WeakPolarHBondContact O-CG 3.42Å; Q425-E429 PolarHBondContact O-N 3.08Å; F426-E429 PolarHBondContact O-N 2.87Å; R427-E429 VanDerWaalsContact C-N 3.33Å; E429-S432 PolarHBondContact O-N 3.3Å; E429-I433 VanDerWaalsContact O-CG1 3.28Å; E429-I433 WeakPolarHBondContact O-CG1 3.47Å; E429-I433 PolarHBondContact O-N 2.62Å
430	E	88.3	Confident	82.2	Confident	108 Å²	108	94.2 Å²	94.2	51%	0.505	49%	0.49	S	S	.	.	H	α-helix	trans	-63	-47	173.1	-175.5	176.9	-152.6	0	0	112.6	F426 R427 S432 I433 T434	F426-E430 PolarHBondContact O-N 2.72Å; R427-E430 PolarHBondContact O-N 2.81Å; E430-S432 PolarHBondContact O-N 2.99Å; E430-I433 PolarHBondContact O-N 3.2Å; E430-T434 WeakPolarHBondContact O-CG2 3.42Å; E430-T434 PolarHBondContact O-N 3.16Å; E430-T434 PolarHBondContact O-OG1 3.2Å
431	E	81.7	Confident	80.3	Confident	116 Å²	116	99.6 Å²	99.6	54%	0.542	51%	0.508	S	S	.	.	H	α-helix	trans	-62.8	-31.4	173.1	-75.7	-175.8	-155.9	0	0	111.7	R427 T434 K435	R427-E431 IonicContact NH2-OE1 3.68Å; R427-E431 WeakPolarHBondContact O-CB 3.33Å; R427-E431 WeakPolarHBondContact O-CG 3.37Å; R427-E431 PolarHBondContact O-N 2.85Å; E431-T434 WeakPolarHBondContact CA-OG1 3.47Å; E431-T434 PolarHBondContact O-OG1 2.94Å; E431-K435 WeakPolarHBondContact O-CB 3.49Å; E431-K435 PolarHBondContact O-N 2.93Å
432	S	79.1	Confident	78.2	Confident	69 Å²	69	103.6 Å²	103.6	48%	0.483	51%	0.513	S	S	.	.	H	α-helix	trans	-74.6	-38.5	175.8	-64.2	0	0	0	0	112.9	V428 E429 E430 G436	V428-S432 WeakPolarHBondContact O-CB 3.31Å; V428-S432 PolarHBondContact O-N 3.36Å; V428-S432 PolarHBondContact O-OG 3.38Å; E429-S432 PolarHBondContact O-N 3.3Å; E430-S432 PolarHBondContact O-N 2.99Å; S432-G436 PolarHBondContact O-N 2.86Å
433	I	78.6	Confident	75.9	Confident	110 Å²	110	102 Å²	102	56%	0.564	52%	0.515	S	S	*	.	H	α-helix	trans	-66.4	-51.6	175.3	-70	162	0	0	0	109.9	E429 E430 K435 G436 D437	E429-I433 VanDerWaalsContact O-CG1 3.28Å; E429-I433 WeakPolarHBondContact O-CG1 3.47Å; E429-I433 PolarHBondContact O-N 2.62Å; E430-I433 PolarHBondContact O-N 3.2Å; I433-K435 VanDerWaalsContact C-N 3.3Å; I433-K435 PolarHBondContact O-N 3.32Å; I433-G436 CarbonylContact O-C 3.58Å; I433-G436 WeakPolarHBondContact O-CA 3.38Å; I433-G436 PolarHBondContact O-N 2.94Å; I433-D437 PolarHBondContact O-N 2.63Å
434	T	77.4	Confident	73.6	Confident	71 Å²	71	105.8 Å²	105.8	44%	0.436	53%	0.53	S	S	.	.	H	α-helix	trans	-63.1	-35.7	179.3	52.2	0	0	0	0	112.4	E430 E431 D437 L438	E430-T434 WeakPolarHBondContact O-CG2 3.42Å; E430-T434 PolarHBondContact O-N 3.16Å; E430-T434 PolarHBondContact O-OG1 3.2Å; E431-T434 WeakPolarHBondContact CA-OG1 3.47Å; E431-T434 PolarHBondContact O-OG1 2.94Å; T434-D437 PolarHBondContact O-N 3.48Å; T434-L438 VanDerWaalsContact O-CG 3.29Å; T434-L438 WeakPolarHBondContact O-CG 3.5Å; T434-L438 PolarHBondContact O-N 3.33Å
435	K	77.1	Confident	71.5	Confident	99 Å²	99	107.3 Å²	107.3	43%	0.43	54%	0.543	S	S	.	.	H	α-helix	trans	-66.5	-38.4	169.1	-179.3	178.8	179.1	179.2	0	112.7	E431 I433 L438 E439	E431-K435 WeakPolarHBondContact O-CB 3.49Å; E431-K435 PolarHBondContact O-N 2.93Å; I433-K435 VanDerWaalsContact C-N 3.3Å; I433-K435 PolarHBondContact O-N 3.32Å; K435-L438 PolarHBondContact O-N 3.2Å; K435-E439 WeakPolarHBondContact CE-OE1 3.45Å; K435-E439 HydrophobicContact CG-CG 4.43Å; K435-E439 WeakPolarHBondContact O-CB 3.37Å; K435-E439 WeakPolarHBondContact O-CG 3.42Å; K435-E439 PolarHBondContact O-N 3.12Å
436	G	73.1	Confident	69	Low	39 Å²	39	105.1 Å²	105.1	40%	0.402	54%	0.543	S	S	.	.	H	α-helix	trans	-60.4	-43.5	172.9	0	0	0	0	0	112.2	S432 I433 E439 G440	S432-G436 PolarHBondContact O-N 2.86Å; I433-G436 CarbonylContact O-C 3.58Å; I433-G436 WeakPolarHBondContact O-CA 3.38Å; I433-G436 PolarHBondContact O-N 2.94Å; G436-E439 PolarHBondContact O-N 2.85Å; G436-G440 PolarHBondContact O-N 3.06Å
437	D	73.8	Confident	66.6	Low	103 Å²	103	108.3 Å²	108.3	55%	0.551	56%	0.56	S	S	*	*	H	α-helix	trans	-65.6	-36.1	173.9	-75.1	-26.9	0	0	0	112.4	I433 T434 R441	I433-D437 PolarHBondContact O-N 2.63Å; T434-D437 PolarHBondContact O-N 3.48Å; D437-R441 WeakPolarHBondContact O-CB 3.38Å; D437-R441 WeakPolarHBondContact O-CG 3.47Å; D437-R441 PolarHBondContact O-N 3.26Å
438	L	61.8	Low	64.2	Low	113 Å²	113	107.5 Å²	107.5	59%	0.592	57%	0.573	S	S	*	*	H	α-helix	trans	-71.7	-42.6	175	-72.9	170.3	0	0	0	112.3	T434 K435 G440 R441 R442	T434-L438 VanDerWaalsContact O-CG 3.29Å; T434-L438 WeakPolarHBondContact O-CG 3.5Å; T434-L438 PolarHBondContact O-N 3.33Å; K435-L438 PolarHBondContact O-N 3.2Å; L438-G440 VanDerWaalsContact C-N 3.3Å; L438-R441 PolarHBondContact O-N 3.45Å; L438-R442 VanDerWaalsContact O-CB 3.3Å; L438-R442 WeakPolarHBondContact O-CB 3.41Å; L438-R442 PolarHBondContact O-N 2.94Å
439	E	63.6	Low	61.8	Low	90 Å²	90	109.9 Å²	109.9	42%	0.421	58%	0.582	S	S	.	*	H	α-helix	trans	-68.3	-30.8	173.7	-70.1	-176.6	174	0	0	110.7	K435 G436 R442 S443 R454	K435-E439 WeakPolarHBondContact CE-OE1 3.45Å; K435-E439 HydrophobicContact CG-CG 4.43Å; K435-E439 WeakPolarHBondContact O-CB 3.37Å; K435-E439 WeakPolarHBondContact O-CG 3.42Å; K435-E439 PolarHBondContact O-N 3.12Å; G436-E439 PolarHBondContact O-N 2.85Å; E439-R442 CarbonylContact O-C 3.15Å; E439-R442 WeakPolarHBondContact O-CB 3.4Å; E439-R442 PolarHBondContact O-N 2.97Å; E439-S443 PolarHBondContact O-N 3.13Å; E439-R454 IonicContact OE1-NH1 2.61Å; E439-R454 IonicContact OE1-NH2 2.67Å
440	G	58.8	Low	59.6	Low	37 Å²	37	116 Å²	116	38%	0.381	60%	0.601	S	S	.	*	H	α-helix	trans	-75.2	-27.2	171.9	0	0	0	0	0	115.2	G436 L438 S443	G436-G440 PolarHBondContact O-N 3.06Å; L438-G440 VanDerWaalsContact C-N 3.3Å; G440-S443 PolarHBondContact O-OG 2.84Å
441	R	55	Low	57.4	Low	193 Å²	193	119.7 Å²	119.7	73%	0.728	62%	0.623	S	S	*	*	H	α-helix	trans	-74.3	-31.9	164.1	-76.9	174.7	176.6	179.2	1.3	111.5	D437 L438 H444	D437-R441 WeakPolarHBondContact O-CB 3.38Å; D437-R441 WeakPolarHBondContact O-CG 3.47Å; D437-R441 PolarHBondContact O-N 3.26Å; L438-R441 PolarHBondContact O-N 3.45Å; R441-H444 PolarHBondContact O-N 2.88Å
442	R	47.1	Very low	55.1	Low	176 Å²	176	119.2 Å²	119.2	66%	0.664	63%	0.632	S	S	*	*	H	α-helix	trans	-72.5	-27.8	177.9	-160	171.9	-170.6	155.3	2.4	112.9	L438 E439 H444 V445 A446	L438-R442 VanDerWaalsContact O-CB 3.3Å; L438-R442 WeakPolarHBondContact O-CB 3.41Å; L438-R442 PolarHBondContact O-N 2.94Å; E439-R442 CarbonylContact O-C 3.15Å; E439-R442 WeakPolarHBondContact O-CB 3.4Å; E439-R442 PolarHBondContact O-N 2.97Å; R442-H444 PolarHBondContact O-N 3.14Å; R442-V445 CarbonylContact O-C 3.56Å; R442-V445 PolarHBondContact O-N 2.97Å; R442-A446 HydrophobicContact CG-CB 4.16Å; R442-A446 PolarHBondContact O-N 3.19Å
443	S	44.3	Very low	53.5	Low	90 Å²	90	122.3 Å²	122.3	63%	0.629	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	-24	172.7	68.4	0	0	0	0	113.3	E439 G440	E439-S443 PolarHBondContact O-N 3.13Å; G440-S443 PolarHBondContact O-OG 2.84Å
444	H	44.9	Very low	51.9	Low	171 Å²	171	125.1 Å²	125.1	79%	0.792	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-12.6	170.1	-88	-77.6	0	0	0	114.1	R441 R442	R441-H444 PolarHBondContact O-N 2.88Å; R442-H444 PolarHBondContact O-N 3.14Å
445	V	48.6	Very low	50.3	Low	127 Å²	127	128 Å²	128	77%	0.77	66%	0.664	S	S	*	*	S	Bend	trans	-145.6	53.7	-179.1	-161.4	0	0	0	0	112.3	R442	R442-V445 CarbonylContact O-C 3.56Å; R442-V445 PolarHBondContact O-N 2.97Å
446	A	34.5	Very low	48.8	Very low	64 Å²	64	131.2 Å²	131.2	53%	0.529	68%	0.678	S	S	.	*			trans	-169.5	87.2	162.6	0	0	0	0	0	111.4	R442	R442-A446 HydrophobicContact CG-CB 4.16Å; R442-A446 PolarHBondContact O-N 3.19Å
447	E	43.1	Very low	47.4	Very low	197 Å²	197	134.2 Å²	134.2	92%	0.921	68%	0.682	S	S	*	*			trans	-78.2	134.1	164.7	-170.5	171.4	-157	0	0	110
448	S	41.1	Very low	46.3	Very low	101 Å²	101	133 Å²	133	71%	0.706	68%	0.678	S	S	*	*			trans	80.8	155.3	168.8	-149.7	0	0	0	0	120.1
449	L	39.3	Very low	45.8	Very low	138 Å²	138	130.9 Å²	130.9	72%	0.723	67%	0.67	S	S	*	*			trans	70.2	118.2	177.7	-75.4	97.5	0	0	0	121.7
450	R	40	Very low	45.5	Very low	225 Å²	225	130.7 Å²	130.7	85%	0.849	68%	0.675	S	S	*	*			trans	76.1	86.4	141.1	-67.5	177.8	171	174.8	-2.3	120.4
451	L	41.8	Very low	45.6	Very low	185 Å²	185	133.9 Å²	133.9	97%	0.969	68%	0.68	S	S	*	*			trans	-91	94.8	138.6	-82.7	80.7	0	0	0	110.1
452	S	35.1	Very low	45.7	Very low	105 Å²	105	130.4 Å²	130.4	73%	0.734	67%	0.672	S	S	*	*	S	Bend	trans	-175.9	81.5	152.8	-169.8	0	0	0	0	110.6
453	N	44.9	Very low	46.3	Very low	135 Å²	135	128.4 Å²	128.4	72%	0.722	67%	0.67	S	S	*	*			trans	160.5	71.7	160.8	-87.8	-21.4	0	0	0	110.4
454	R	45.6	Very low	47.5	Very low	169 Å²	169	126.4 Å²	126.4	64%	0.638	66%	0.656	S	S	*	*	S	Bend	trans	-133.8	8.7	171.5	-150.4	162.7	86.4	172.4	-2.5	115.1	E439	E439-R454 IonicContact OE1-NH1 2.61Å; E439-R454 IonicContact OE1-NH2 2.67Å
455	T	43.7	Very low	49	Very low	130 Å²	130	126.6 Å²	126.6	80%	0.798	65%	0.65	S	S	*	*	S	Bend	trans	-118.4	6.3	177.9	39.2	0	0	0	0	114.2
456	K	44.7	Very low	50.1	Low	167 Å²	167	125 Å²	125	73%	0.726	64%	0.636	S	S	*	*	S	Bend	trans	-118.6	0.6	171.9	-68.9	-171.9	176.9	-176.7	0	113.7	V460	K456-V460 VanDerWaalsContact O-CG2 3.28Å; K456-V460 WeakPolarHBondContact O-CG2 3.48Å
457	Q	44.3	Very low	52	Low	103 Å²	103	127.4 Å²	127.4	48%	0.481	64%	0.638	S	S	.	*	S	Bend	trans	-100.3	-42.5	-172.6	-176.8	159.6	-7.2	0	0	111.8	T459 V460 E461	Q457-T459 VanDerWaalsContact C-N 3.35Å; Q457-T459 PolarHBondContact O-N 3.09Å; Q457-V460 PolarHBondContact O-N 3.48Å; Q457-V460 VanDerWaalsContact O-N 3.12Å; Q457-E461 VanDerWaalsContact CG-CD 3.49Å; Q457-E461 HydrophobicContact CG-CG 4.26Å; Q457-E461 WeakPolarHBondContact CG-OE1 3.25Å; Q457-E461 PolarHBondContact NE2-OE1 3.28Å; Q457-E461 WeakPolarHBondContact O-CB 3.43Å; Q457-E461 WeakPolarHBondContact O-CG 3.41Å; Q457-E461 PolarHBondContact O-N 3.39Å
458	T	49.9	Very low	53.6	Low	76 Å²	76	123.4 Å²	123.4	47%	0.466	62%	0.619	S	S	.	*	H	α-helix	trans	-57.5	-44.8	177.1	53.9	0	0	0	0	112.4	V460 E461 E462	T458-V460 VanDerWaalsContact C-N 3.32Å; T458-V460 PolarHBondContact O-N 3.36Å; T458-E461 PolarHBondContact O-N 2.74Å; T458-E462 WeakPolarHBondContact O-CB 3.41Å; T458-E462 WeakPolarHBondContact O-CG 3.41Å; T458-E462 PolarHBondContact O-N 2.73Å
459	T	52.3	Low	55.3	Low	69 Å²	69	122.9 Å²	122.9	42%	0.423	61%	0.608	S	S	.	*	H	α-helix	trans	-67.6	-29.6	178.5	48.6	0	0	0	0	113.5	Q457 Q463	Q457-T459 VanDerWaalsContact C-N 3.35Å; Q457-T459 PolarHBondContact O-N 3.09Å; T459-Q463 VanDerWaalsContact O-CB 3.29Å; T459-Q463 WeakPolarHBondContact O-CB 3.2Å; T459-Q463 WeakPolarHBondContact O-CG 3.41Å; T459-Q463 PolarHBondContact O-N 3.22Å
460	V	55.8	Low	57	Low	86 Å²	86	122.1 Å²	122.1	52%	0.521	60%	0.601	S	S	.	*	H	α-helix	trans	-78.2	-36.9	175.8	173	0	0	0	0	110.7	K456 Q457 T458 S464	K456-V460 VanDerWaalsContact O-CG2 3.28Å; K456-V460 WeakPolarHBondContact O-CG2 3.48Å; Q457-V460 PolarHBondContact O-N 3.48Å; Q457-V460 VanDerWaalsContact O-N 3.12Å; T458-V460 VanDerWaalsContact C-N 3.32Å; T458-V460 PolarHBondContact O-N 3.36Å; V460-S464 VanDerWaalsContact O-CB 3.22Å; V460-S464 WeakPolarHBondContact O-CB 3.32Å; V460-S464 PolarHBondContact O-N 3.3Å
461	E	61.8	Low	59	Low	104 Å²	104	117.2 Å²	117.2	49%	0.486	59%	0.587	S	S	.	*	H	α-helix	trans	-69	-39.3	174.2	-72.3	166.3	171.9	0	0	111.3	Q457 T458 R465	Q457-E461 VanDerWaalsContact CG-CD 3.49Å; Q457-E461 HydrophobicContact CG-CG 4.26Å; Q457-E461 WeakPolarHBondContact CG-OE1 3.25Å; Q457-E461 PolarHBondContact NE2-OE1 3.28Å; Q457-E461 WeakPolarHBondContact O-CB 3.43Å; Q457-E461 WeakPolarHBondContact O-CG 3.41Å; Q457-E461 PolarHBondContact O-N 3.39Å; T458-E461 PolarHBondContact O-N 2.74Å; E461-R465 VanDerWaalsContact O-CB 3.27Å; E461-R465 WeakPolarHBondContact O-CB 3.43Å; E461-R465 PolarHBondContact O-N 2.76Å
462	E	57	Low	60.9	Low	120 Å²	120	112.5 Å²	112.5	56%	0.561	56%	0.56	S	S	*	*	H	α-helix	trans	-65.3	-46.3	171.1	-74.4	178	134.1	0	0	112.2	T458 S464 R465 I466	T458-E462 WeakPolarHBondContact O-CB 3.41Å; T458-E462 WeakPolarHBondContact O-CG 3.41Å; T458-E462 PolarHBondContact O-N 2.73Å; E462-S464 VanDerWaalsContact C-N 3.34Å; E462-S464 PolarHBondContact O-N 2.68Å; E462-R465 PolarHBondContact O-N 3.13Å; E462-I466 VanDerWaalsContact O-CG1 3.3Å; E462-I466 WeakPolarHBondContact O-CG1 3.28Å; E462-I466 PolarHBondContact O-N 3.28Å
463	Q	59.2	Low	63	Low	134 Å²	134	111.8 Å²	111.8	63%	0.626	55%	0.548	S	S	*	.	H	α-helix	trans	-62.9	-39.7	175.5	-78.3	176.9	-13.5	0	0	112.2	T459 I466 M467	T459-Q463 VanDerWaalsContact O-CB 3.29Å; T459-Q463 WeakPolarHBondContact O-CB 3.2Å; T459-Q463 WeakPolarHBondContact O-CG 3.41Å; T459-Q463 PolarHBondContact O-N 3.22Å; Q463-I466 PolarHBondContact O-N 3.36Å; Q463-M467 WeakPolarHBondContact O-CB 3.5Å; Q463-M467 PolarHBondContact O-N 2.92Å
464	S	70.6	Confident	64.8	Low	48 Å²	48	108 Å²	108	34%	0.336	54%	0.535	S	S	.	.	H	α-helix	trans	-66.6	-37.6	175.4	-171.5	0	0	0	0	111.9	V460 E462 M467 Q468	V460-S464 VanDerWaalsContact O-CB 3.22Å; V460-S464 WeakPolarHBondContact O-CB 3.32Å; V460-S464 PolarHBondContact O-N 3.3Å; E462-S464 VanDerWaalsContact C-N 3.34Å; E462-S464 PolarHBondContact O-N 2.68Å; S464-M467 PolarHBondContact O-N 3.14Å; S464-Q468 WeakPolarHBondContact O-CB 3.33Å; S464-Q468 VanDerWaalsContact O-CG 3.26Å; S464-Q468 WeakPolarHBondContact O-CG 3.49Å; S464-Q468 PolarHBondContact O-N 3.06Å
465	R	74.8	Confident	66.6	Low	176 Å²	176	105 Å²	105	66%	0.664	53%	0.531	S	S	*	.	H	α-helix	trans	-69	-38.8	175.2	-171.7	178.9	-176.7	-165.3	1	112.5	E461 E462 Q468 L469	E461-R465 VanDerWaalsContact O-CB 3.27Å; E461-R465 WeakPolarHBondContact O-CB 3.43Å; E461-R465 PolarHBondContact O-N 2.76Å; E462-R465 PolarHBondContact O-N 3.13Å; R465-Q468 PolarHBondContact O-N 3.28Å; R465-L469 HydrophobicContact CG-CD1 4.31Å; R465-L469 VanDerWaalsContact O-CG 3.3Å; R465-L469 WeakPolarHBondContact O-CG 3.21Å; R465-L469 PolarHBondContact O-N 3.22Å
466	I	73.4	Confident	68.1	Low	93 Å²	93	104.8 Å²	104.8	48%	0.477	52%	0.516	S	S	.	.	H	α-helix	trans	-62.4	-48.5	172.7	-70.2	164	0	0	0	109.5	E462 Q463 Q468 L469 E470	E462-I466 VanDerWaalsContact O-CG1 3.3Å; E462-I466 WeakPolarHBondContact O-CG1 3.28Å; E462-I466 PolarHBondContact O-N 3.28Å; Q463-I466 PolarHBondContact O-N 3.36Å; I466-Q468 VanDerWaalsContact C-N 3.33Å; I466-Q468 PolarHBondContact O-N 2.9Å; I466-L469 CarbonylContact O-C 3.58Å; I466-L469 PolarHBondContact O-N 3.13Å; I466-L469 VanDerWaalsContact O-N 3.09Å; I466-E470 HydrophobicContact CG2-CG 4.35Å; I466-E470 WeakPolarHBondContact O-CG 3.35Å; I466-E470 PolarHBondContact O-N 2.67Å
467	M	74.1	Confident	69.6	Low	114 Å²	114	104.7 Å²	104.7	56%	0.562	51%	0.511	S	S	*	.	H	α-helix	trans	-59.8	-40.2	178.1	-169.3	-179.2	75.5	0	0	112.4	Q463 S464 E470 E471	Q463-M467 WeakPolarHBondContact O-CB 3.5Å; Q463-M467 PolarHBondContact O-N 2.92Å; S464-M467 PolarHBondContact O-N 3.14Å; M467-E470 PolarHBondContact O-N 2.92Å; M467-E471 WeakPolarHBondContact O-CB 3.31Å; M467-E471 PolarHBondContact O-N 3.41Å
468	Q	76.6	Confident	71.2	Confident	113 Å²	113	102.5 Å²	102.5	53%	0.528	51%	0.51	S	S	.	.	H	α-helix	trans	-64.6	-38.8	173.9	-75.2	167.4	4.6	0	0	112.7	S464 R465 I466 E471 E472	S464-Q468 WeakPolarHBondContact O-CB 3.33Å; S464-Q468 VanDerWaalsContact O-CG 3.26Å; S464-Q468 WeakPolarHBondContact O-CG 3.49Å; S464-Q468 PolarHBondContact O-N 3.06Å; R465-Q468 PolarHBondContact O-N 3.28Å; I466-Q468 VanDerWaalsContact C-N 3.33Å; I466-Q468 PolarHBondContact O-N 2.9Å; Q468-E471 PolarHBondContact O-N 3.17Å; Q468-E472 PolarHBondContact O-N 2.92Å
469	L	76.4	Confident	72.7	Confident	90 Å²	90	103.6 Å²	103.6	47%	0.471	51%	0.51	S	S	.	.	H	α-helix	trans	-71.7	-33.4	175.7	-71.5	168.1	0	0	0	112.1	R465 I466 L473	R465-L469 HydrophobicContact CG-CD1 4.31Å; R465-L469 VanDerWaalsContact O-CG 3.3Å; R465-L469 WeakPolarHBondContact O-CG 3.21Å; R465-L469 PolarHBondContact O-N 3.22Å; I466-L469 CarbonylContact O-C 3.58Å; I466-L469 PolarHBondContact O-N 3.13Å; I466-L469 VanDerWaalsContact O-N 3.09Å; L469-L473 VanDerWaalsContact O-CB 3.26Å; L469-L473 WeakPolarHBondContact O-CB 3.43Å; L469-L473 WeakPolarHBondContact O-CG 3.24Å; L469-L473 PolarHBondContact O-N 3Å
470	E	74.7	Confident	73.8	Confident	123 Å²	123	104.6 Å²	104.6	58%	0.575	51%	0.512	S	S	*	.	H	α-helix	trans	-68.8	-39.1	172.2	-72.2	-177	148.9	0	0	111.8	I466 M467 L473 A474	I466-E470 HydrophobicContact CG2-CG 4.35Å; I466-E470 WeakPolarHBondContact O-CG 3.35Å; I466-E470 PolarHBondContact O-N 2.67Å; M467-E470 PolarHBondContact O-N 2.92Å; E470-L473 PolarHBondContact O-N 2.84Å; E470-A474 WeakPolarHBondContact O-CB 3.24Å; E470-A474 PolarHBondContact O-N 2.86Å
471	E	81.9	Confident	74.9	Confident	122 Å²	122	108 Å²	108	57%	0.57	52%	0.52	S	S	*	.	H	α-helix	trans	-66.7	-44.8	173.3	-175.1	169.1	-154.6	0	0	111.7	M467 Q468 A474 L475	M467-E471 WeakPolarHBondContact O-CB 3.31Å; M467-E471 PolarHBondContact O-N 3.41Å; Q468-E471 PolarHBondContact O-N 3.17Å; E471-A474 WeakPolarHBondContact O-CB 3.49Å; E471-A474 PolarHBondContact O-N 3.07Å; E471-L475 HydrophobicContact CG-CD1 4.37Å; E471-L475 WeakPolarHBondContact O-CG 3.36Å; E471-L475 PolarHBondContact O-N 3.21Å
472	E	82.1	Confident	75.5	Confident	86 Å²	86	107 Å²	107	40%	0.402	52%	0.517	S	S	.	.	H	α-helix	trans	-62.9	-45.1	173.6	-161.4	-169	160.1	0	0	110.7	Q468 A474 L475 R476	Q468-E472 PolarHBondContact O-N 2.92Å; E472-A474 VanDerWaalsContact C-N 3.27Å; E472-A474 PolarHBondContact O-N 3.3Å; E472-L475 CarbonylContact O-C 3.57Å; E472-L475 WeakPolarHBondContact O-CB 3.33Å; E472-L475 PolarHBondContact O-N 3.47Å; E472-L475 VanDerWaalsContact O-N 3.12Å; E472-R476 HydrophobicContact CG-CG 4.35Å; E472-R476 WeakPolarHBondContact O-CG 3.23Å; E472-R476 PolarHBondContact O-N 2.85Å; E472-R476 IonicContact OE1-CZ 3.72Å; E472-R476 VanDerWaalsContact OE1-CZ 3.26Å; E472-R476 IonicContact OE1-NE 3.26Å; E472-R476 PolarHBondContact OE1-NE 2.62Å; E472-R476 IonicContact OE1-NH2 3.74Å; E472-R476 PolarHBondContact OE1-NH2 3.08Å
473	L	79.4	Confident	76.3	Confident	90 Å²	90	105.7 Å²	105.7	47%	0.471	51%	0.514	S	S	.	.	H	α-helix	trans	-62	-33.1	175.4	-76.7	171	0	0	0	112.6	L469 E470 R477	L469-L473 VanDerWaalsContact O-CB 3.26Å; L469-L473 WeakPolarHBondContact O-CB 3.43Å; L469-L473 WeakPolarHBondContact O-CG 3.24Å; L469-L473 PolarHBondContact O-N 3Å; E470-L473 PolarHBondContact O-N 2.84Å; L473-R477 VanDerWaalsContact O-CB 3.29Å; L473-R477 WeakPolarHBondContact O-CB 3.47Å; L473-R477 VanDerWaalsContact O-CD 3.28Å; L473-R477 WeakPolarHBondContact O-CD 3.05Å; L473-R477 WeakPolarHBondContact O-CG 3.32Å; L473-R477 PolarHBondContact O-N 2.93Å
474	A	82.1	Confident	76.7	Confident	54 Å²	54	105 Å²	105	45%	0.446	51%	0.511	S	S	.	.	H	α-helix	trans	-67.3	-43.4	172.4	0	0	0	0	0	111.5	E470 E471 E472 R477 A478	E470-A474 WeakPolarHBondContact O-CB 3.24Å; E470-A474 PolarHBondContact O-N 2.86Å; E471-A474 WeakPolarHBondContact O-CB 3.49Å; E471-A474 PolarHBondContact O-N 3.07Å; E472-A474 VanDerWaalsContact C-N 3.27Å; E472-A474 PolarHBondContact O-N 3.3Å; A474-R477 PolarHBondContact O-N 3.35Å; A474-A478 WeakPolarHBondContact O-CB 3.16Å; A474-A478 PolarHBondContact O-N 2.95Å
475	L	83.4	Confident	76.6	Confident	108 Å²	108	103.9 Å²	103.9	57%	0.565	51%	0.506	S	S	*	.	H	α-helix	trans	-62.9	-47.7	174.7	-73.6	166.1	0	0	0	111.8	E471 E472 R477 A478 E479	E471-L475 HydrophobicContact CG-CD1 4.37Å; E471-L475 WeakPolarHBondContact O-CG 3.36Å; E471-L475 PolarHBondContact O-N 3.21Å; E472-L475 CarbonylContact O-C 3.57Å; E472-L475 WeakPolarHBondContact O-CB 3.33Å; E472-L475 PolarHBondContact O-N 3.47Å; E472-L475 VanDerWaalsContact O-N 3.12Å; L475-R477 VanDerWaalsContact C-N 3.32Å; L475-R477 PolarHBondContact O-N 3.49Å; L475-A478 CarbonylContact O-C 3.6Å; L475-A478 WeakPolarHBondContact O-CB 3.45Å; L475-A478 PolarHBondContact O-N 2.92Å; L475-A478 VanDerWaalsContact O-N 3.12Å; L475-E479 WeakPolarHBondContact O-CB 3.37Å; L475-E479 PolarHBondContact O-N 2.93Å
476	R	76.4	Confident	76.4	Confident	125 Å²	125	100 Å²	100	47%	0.472	50%	0.495	S	S	.	.	H	α-helix	trans	-61.1	-37.9	174.9	-60.4	-49.7	-173.8	142.3	8	112.1	E472 E479 I480	E472-R476 HydrophobicContact CG-CG 4.35Å; E472-R476 WeakPolarHBondContact O-CG 3.23Å; E472-R476 PolarHBondContact O-N 2.85Å; E472-R476 IonicContact OE1-CZ 3.72Å; E472-R476 VanDerWaalsContact OE1-CZ 3.26Å; E472-R476 IonicContact OE1-NE 3.26Å; E472-R476 PolarHBondContact OE1-NE 2.62Å; E472-R476 IonicContact OE1-NH2 3.74Å; E472-R476 PolarHBondContact OE1-NH2 3.08Å; R476-E479 WeakPolarHBondContact CD-OE2 3.46Å; R476-E479 IonicContact NH1-OE2 3.97Å; R476-E479 PolarHBondContact O-N 3.38Å; R476-I480 WeakPolarHBondContact O-CB 3.48Å; R476-I480 WeakPolarHBondContact O-CD1 3.33Å; R476-I480 WeakPolarHBondContact O-CG1 3.33Å; R476-I480 PolarHBondContact O-N 2.97Å
477	R	76.4	Confident	75.7	Confident	165 Å²	165	100.7 Å²	100.7	62%	0.623	50%	0.5	S	S	*	.	H	α-helix	trans	-66.9	-36.6	174.2	-75.5	165.5	-177.9	149.6	-1.2	112	L473 A474 L475 K481	L473-R477 VanDerWaalsContact O-CB 3.29Å; L473-R477 WeakPolarHBondContact O-CB 3.47Å; L473-R477 VanDerWaalsContact O-CD 3.28Å; L473-R477 WeakPolarHBondContact O-CD 3.05Å; L473-R477 WeakPolarHBondContact O-CG 3.32Å; L473-R477 PolarHBondContact O-N 2.93Å; A474-R477 PolarHBondContact O-N 3.35Å; L475-R477 VanDerWaalsContact C-N 3.32Å; L475-R477 PolarHBondContact O-N 3.49Å; R477-K481 VanDerWaalsContact O-CB 3.25Å; R477-K481 WeakPolarHBondContact O-CB 3.36Å; R477-K481 PolarHBondContact O-N 3.38Å
478	A	77.5	Confident	74.9	Confident	56 Å²	56	105 Å²	105	46%	0.463	51%	0.51	S	S	.	.	H	α-helix	trans	-69.4	-42.9	174.1	0	0	0	0	0	111.8	A474 L475 K481 D482	A474-A478 WeakPolarHBondContact O-CB 3.16Å; A474-A478 PolarHBondContact O-N 2.95Å; L475-A478 CarbonylContact O-C 3.6Å; L475-A478 WeakPolarHBondContact O-CB 3.45Å; L475-A478 PolarHBondContact O-N 2.92Å; L475-A478 VanDerWaalsContact O-N 3.12Å; A478-K481 PolarHBondContact O-N 3.31Å; A478-D482 PolarHBondContact O-N 2.87Å
479	E	81.3	Confident	73.9	Confident	100 Å²	100	107.9 Å²	107.9	47%	0.467	52%	0.516	S	S	.	.	H	α-helix	trans	-59.9	-49.8	174.3	179.9	176.8	-134.2	0	0	111.3	L475 R476 K481 D482 L483	L475-E479 WeakPolarHBondContact O-CB 3.37Å; L475-E479 PolarHBondContact O-N 2.93Å; R476-E479 WeakPolarHBondContact CD-OE2 3.46Å; R476-E479 IonicContact NH1-OE2 3.97Å; R476-E479 PolarHBondContact O-N 3.38Å; E479-K481 VanDerWaalsContact C-N 3.29Å; E479-K481 PolarHBondContact O-N 2.87Å; E479-D482 PolarHBondContact O-N 3.31Å; E479-L483 HydrophobicContact CG-CD1 4Å; E479-L483 WeakPolarHBondContact O-CB 3.41Å; E479-L483 VanDerWaalsContact O-CG 3.28Å; E479-L483 WeakPolarHBondContact O-CG 3.29Å; E479-L483 PolarHBondContact O-N 2.91Å
480	I	74.9	Confident	72.8	Confident	89 Å²	89	107.4 Å²	107.4	46%	0.456	52%	0.516	S	S	.	.	H	α-helix	trans	-59	-40.9	174.1	-71.2	164.5	0	0	0	111.1	R476 Q484	R476-I480 WeakPolarHBondContact O-CB 3.48Å; R476-I480 WeakPolarHBondContact O-CD1 3.33Å; R476-I480 WeakPolarHBondContact O-CG1 3.33Å; R476-I480 PolarHBondContact O-N 2.97Å; I480-Q484 HydrophobicContact CG2-CG 4.48Å; I480-Q484 WeakPolarHBondContact O-CB 3.47Å; I480-Q484 WeakPolarHBondContact O-CG 3.41Å; I480-Q484 PolarHBondContact O-N 2.92Å
481	K	78.3	Confident	71.5	Confident	159 Å²	159	107.1 Å²	107.1	69%	0.691	52%	0.519	S	S	*	.	H	α-helix	trans	-68.1	-37.6	178.6	-175.1	179.8	179.3	-176.6	0	112.4	R477 A478 E479 G485	R477-K481 VanDerWaalsContact O-CB 3.25Å; R477-K481 WeakPolarHBondContact O-CB 3.36Å; R477-K481 PolarHBondContact O-N 3.38Å; A478-K481 PolarHBondContact O-N 3.31Å; E479-K481 VanDerWaalsContact C-N 3.29Å; E479-K481 PolarHBondContact O-N 2.87Å; K481-G485 PolarHBondContact O-N 3.48Å
482	D	74.4	Confident	69.9	Low	81 Å²	81	105.5 Å²	105.5	43%	0.433	53%	0.526	S	S	.	.	H	α-helix	trans	-74.6	-40.1	175.8	-162.1	65.1	0	0	0	111.4	A478 E479 Q484 G485 Q486	A478-D482 PolarHBondContact O-N 2.87Å; E479-D482 PolarHBondContact O-N 3.31Å; D482-Q484 VanDerWaalsContact C-N 3.34Å; D482-Q484 PolarHBondContact O-N 3.34Å; D482-G485 CarbonylContact O-C 3.57Å; D482-G485 VanDerWaalsContact O-CA 3.29Å; D482-G485 WeakPolarHBondContact O-CA 3.41Å; D482-G485 PolarHBondContact O-N 3.39Å; D482-Q486 WeakPolarHBondContact O-CG 3.43Å; D482-Q486 PolarHBondContact O-N 3.01Å; D482-Q486 PolarHBondContact OD2-NE2 3.31Å
483	L	74.6	Confident	68.1	Low	94 Å²	94	105.5 Å²	105.5	49%	0.492	54%	0.536	S	S	.	.	H	α-helix	trans	-59.7	-40.5	171.4	-71.6	170.8	0	0	0	112.1	E479 G485 Q486 L487	E479-L483 HydrophobicContact CG-CD1 4Å; E479-L483 WeakPolarHBondContact O-CB 3.41Å; E479-L483 VanDerWaalsContact O-CG 3.28Å; E479-L483 WeakPolarHBondContact O-CG 3.29Å; E479-L483 PolarHBondContact O-N 2.91Å; L483-G485 VanDerWaalsContact C-N 3.3Å; L483-G485 PolarHBondContact O-N 3.43Å; L483-Q486 PolarHBondContact O-N 3.35Å; L483-L487 WeakPolarHBondContact O-CB 3.42Å; L483-L487 PolarHBondContact O-N 2.99Å
484	Q	66.8	Low	66.5	Low	120 Å²	120	105.1 Å²	105.1	56%	0.561	54%	0.541	S	S	*	.	H	α-helix	trans	-64.3	-34.7	170.2	-75.2	172.2	0.8	0	0	112.3	I480 D482 R488	I480-Q484 HydrophobicContact CG2-CG 4.48Å; I480-Q484 WeakPolarHBondContact O-CB 3.47Å; I480-Q484 WeakPolarHBondContact O-CG 3.41Å; I480-Q484 PolarHBondContact O-N 2.92Å; D482-Q484 VanDerWaalsContact C-N 3.34Å; D482-Q484 PolarHBondContact O-N 3.34Å; Q484-R488 PolarHBondContact O-N 3Å; Q484-R488 VanDerWaalsContact O-N 3.13Å
485	G	69	Low	64.4	Low	23 Å²	23	111.6 Å²	111.6	24%	0.237	56%	0.562	C	S	.	*	H	α-helix	trans	-69	-38	173.1	0	0	0	0	0	113.5	K481 D482 L483 R489	K481-G485 PolarHBondContact O-N 3.48Å; D482-G485 CarbonylContact O-C 3.57Å; D482-G485 VanDerWaalsContact O-CA 3.29Å; D482-G485 WeakPolarHBondContact O-CA 3.41Å; D482-G485 PolarHBondContact O-N 3.39Å; L483-G485 VanDerWaalsContact C-N 3.3Å; L483-G485 PolarHBondContact O-N 3.43Å; G485-R489 WeakPolarHBondContact O-CG 3.18Å; G485-R489 PolarHBondContact O-N 3.23Å
486	Q	71.7	Confident	62.3	Low	94 Å²	94	115.7 Å²	115.7	44%	0.439	58%	0.578	S	S	.	*	H	α-helix	trans	-70.1	-44.1	175.1	-69.6	178.5	31.9	0	0	110.6	D482 L483 R488 R489 V490	D482-Q486 WeakPolarHBondContact O-CG 3.43Å; D482-Q486 PolarHBondContact O-N 3.01Å; D482-Q486 PolarHBondContact OD2-NE2 3.31Å; L483-Q486 PolarHBondContact O-N 3.35Å; Q486-R488 PolarHBondContact O-N 2.89Å; Q486-R489 CarbonylContact O-C 3.58Å; Q486-R489 WeakPolarHBondContact O-CA 3.18Å; Q486-R489 WeakPolarHBondContact O-CB 3.42Å; Q486-R489 PolarHBondContact O-N 3.29Å; Q486-V490 WeakPolarHBondContact O-CG2 3.14Å; Q486-V490 PolarHBondContact O-N 2.69Å
487	L	57.9	Low	60.4	Low	109 Å²	109	119.1 Å²	119.1	57%	0.571	60%	0.599	S	S	*	*	H	α-helix	trans	-57.5	-47.6	175.3	-165.6	67.1	0	0	0	110.9	L483 R489 V490 D491	L483-L487 WeakPolarHBondContact O-CB 3.42Å; L483-L487 PolarHBondContact O-N 2.99Å; L487-R489 PolarHBondContact O-N 3.3Å; L487-V490 PolarHBondContact O-N 3.12Å; L487-D491 PolarHBondContact O-N 3.3Å
488	R	56.2	Low	58.6	Low	204 Å²	204	115.6 Å²	115.6	77%	0.77	61%	0.606	S	S	*	*	H	α-helix	trans	-59.3	-25	171.8	-82	-171.3	175	-163.5	0.1	114.7	Q484 Q486 A492	Q484-R488 PolarHBondContact O-N 3Å; Q484-R488 VanDerWaalsContact O-N 3.13Å; Q486-R488 PolarHBondContact O-N 2.89Å; R488-A492 WeakPolarHBondContact O-CB 3.49Å; R488-A492 PolarHBondContact O-N 3.39Å
489	R	57	Low	57.3	Low	173 Å²	173	119.2 Å²	119.2	65%	0.653	63%	0.625	S	S	*	*	H	α-helix	trans	-82.3	-34.3	174.2	-70.3	174.6	-159.6	-176.2	11.1	111.6	G485 Q486 L487 A492 S493	G485-R489 WeakPolarHBondContact O-CG 3.18Å; G485-R489 PolarHBondContact O-N 3.23Å; Q486-R489 CarbonylContact O-C 3.58Å; Q486-R489 WeakPolarHBondContact O-CA 3.18Å; Q486-R489 WeakPolarHBondContact O-CB 3.42Å; Q486-R489 PolarHBondContact O-N 3.29Å; L487-R489 PolarHBondContact O-N 3.3Å; R489-A492 CarbonylContact O-C 3.55Å; R489-A492 PolarHBondContact O-N 2.73Å; R489-S493 WeakPolarHBondContact O-CB 3.48Å; R489-S493 PolarHBondContact O-N 3.29Å; R489-S493 VanDerWaalsContact O-N 3.13Å; R489-S493 PolarHBondContact O-OG 2.89Å
490	V	53.8	Low	55.4	Low	80 Å²	80	117.9 Å²	117.9	49%	0.485	64%	0.638	S	S	.	*	H	α-helix	trans	-65.7	-45.4	173.8	173.5	0	0	0	0	110.1	Q486 L487 A492 S493 S494	Q486-V490 WeakPolarHBondContact O-CG2 3.14Å; Q486-V490 PolarHBondContact O-N 2.69Å; L487-V490 PolarHBondContact O-N 3.12Å; V490-A492 PolarHBondContact O-N 2.95Å; V490-S493 PolarHBondContact O-N 3.37Å; V490-S493 VanDerWaalsContact O-N 3.14Å; V490-S493 PolarHBondContact O-OG 3.41Å; V490-S494 WeakPolarHBondContact O-CB 3.33Å; V490-S494 PolarHBondContact O-N 3.28Å; V490-S494 PolarHBondContact O-OG 2.9Å
491	D	46.8	Very low	53.7	Low	117 Å²	117	120.4 Å²	120.4	63%	0.626	66%	0.657	S	S	*	*	H	α-helix	trans	-58.6	-34.8	172.8	-65.1	-29.6	0	0	0	112.2	L487	L487-D491 PolarHBondContact O-N 3.3Å
492	A	47.1	Very low	52.5	Low	88 Å²	88	120.9 Å²	120.9	73%	0.727	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	-5.7	179.1	0	0	0	0	0	115.3	R488 R489 V490	R488-A492 WeakPolarHBondContact O-CB 3.49Å; R488-A492 PolarHBondContact O-N 3.39Å; R489-A492 CarbonylContact O-C 3.55Å; R489-A492 PolarHBondContact O-N 2.73Å; V490-A492 PolarHBondContact O-N 2.95Å
493	S	45.2	Very low	51.5	Low	87 Å²	87	120 Å²	120	61%	0.608	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.8	-1.9	-177.8	46.9	0	0	0	0	114.2	R489 V490 Q495	R489-S493 WeakPolarHBondContact O-CB 3.48Å; R489-S493 PolarHBondContact O-N 3.29Å; R489-S493 VanDerWaalsContact O-N 3.13Å; R489-S493 PolarHBondContact O-OG 2.89Å; V490-S493 PolarHBondContact O-N 3.37Å; V490-S493 VanDerWaalsContact O-N 3.14Å; V490-S493 PolarHBondContact O-OG 3.41Å; S493-Q495 VanDerWaalsContact C-N 3.35Å; S493-Q495 PolarHBondContact O-N 3.29Å
494	S	45.3	Very low	50.8	Low	81 Å²	81	119.3 Å²	119.3	57%	0.566	67%	0.673	S	S	*	*			trans	-91.9	37.5	-175.4	-59.3	0	0	0	0	114.5	V490	V490-S494 WeakPolarHBondContact O-CB 3.33Å; V490-S494 PolarHBondContact O-N 3.28Å; V490-S494 PolarHBondContact O-OG 2.9Å
495	Q	38.5	Very low	50.6	Low	191 Å²	191	118.5 Å²	118.5	89%	0.893	68%	0.677	S	S	*	*			trans	-136	61.2	170.7	-75	-161.4	-6.8	0	0	113.2	S493	S493-Q495 VanDerWaalsContact C-N 3.35Å; S493-Q495 PolarHBondContact O-N 3.29Å
496	Q	40	Very low	50.3	Low	194 Å²	194	124.2 Å²	124.2	91%	0.907	70%	0.698	S	S	*	*			trans	-151.6	136.9	147.1	-118.2	168.5	3.7	0	0	110.9
497	E	35.6	Very low	49.8	Very low	196 Å²	196	122.9 Å²	122.9	92%	0.916	70%	0.697	S	S	*	*			trans	-80.3	170.5	178	-50.2	172.2	123.9	0	0	109.3
498	A	38.6	Very low	50.3	Low	92 Å²	92	121.6 Å²	121.6	76%	0.76	69%	0.693	S	S	*	*			cis	-150.2	-151.7	19.1	0	0	0	0	0	110.8
499	P	49.4	Very low	51.1	Low	132 Å²	132	116.8 Å²	116.8	86%	0.857	68%	0.682	S	S	*	*				-120.8	173.7	-129.3	38.6	-20	0	0	0	116.1
500	G	42.4	Very low	51.9	Low	72 Å²	72	113.3 Å²	113.3	74%	0.742	68%	0.676	S	S	*	*			trans	136.5	74.6	153	0	0	0	0	0	117.7
501	T	39.3	Very low	52.8	Low	142 Å²	142	118.4 Å²	118.4	87%	0.871	69%	0.686	S	S	*	*			trans	-154.9	133.4	145.8	-20	0	0	0	0	109.6	A503	T501-A503 PolarHBondContact O-N 2.95Å
502	D	53.6	Low	54.1	Low	169 Å²	169	118.2 Å²	118.2	90%	0.904	68%	0.682	S	S	*	*			trans	-70.8	114.9	-179.2	-66.8	-63.9	0	0	0	111.5
503	A	52.9	Low	55.6	Low	62 Å²	62	120 Å²	120	51%	0.512	68%	0.675	S	S	.	*			trans	-88.8	132.7	165.5	0	0	0	0	0	109	T501	T501-A503 PolarHBondContact O-N 2.95Å
504	P	60.2	Low	57	Low	80 Å²	80	122.4 Å²	122.4	52%	0.519	68%	0.68	S	S	.	*			trans	-63.8	146.5	-174.5	25	-33.1	0	0	0	111.4	E506 T507	P504-E506 PolarHBondContact O-N 3.27Å; P504-T507 HydrophobicContact CG-CG2 3.91Å; P504-T507 PolarHBondContact O-N 3.26Å; P504-T507 PolarHBondContact O-OG1 2.89Å
505	P	62	Low	58.6	Low	102 Å²	102	123.1 Å²	123.1	66%	0.662	68%	0.677	S	S	*	*	H	α-helix	trans	-59.1	-29.8	-167	21.5	-33.9	0	0	0	114	T507 V508 L509	P505-T507 VanDerWaalsContact C-N 3.32Å; P505-T507 PolarHBondContact O-N 2.97Å; P505-V508 WeakPolarHBondContact O-CB 3.41Å; P505-V508 PolarHBondContact O-N 3.49Å; P505-V508 VanDerWaalsContact O-N 3.16Å; P505-L509 WeakPolarHBondContact O-CG 3.44Å; P505-L509 PolarHBondContact O-N 3.07Å
506	E	62.4	Low	60.6	Low	143 Å²	143	116.2 Å²	116.2	67%	0.668	65%	0.648	S	S	*	*	H	α-helix	trans	-60.3	-37.7	173.9	-171.9	169.5	-150.4	0	0	112.7	P504 V508 L509 L510	P504-E506 PolarHBondContact O-N 3.27Å; E506-V508 VanDerWaalsContact C-N 3.33Å; E506-V508 PolarHBondContact O-N 2.92Å; E506-L509 PolarHBondContact O-N 2.85Å; E506-L510 HydrophobicContact CG-CD1 4.16Å; E506-L510 WeakPolarHBondContact O-CB 3.25Å; E506-L510 VanDerWaalsContact O-CG 3.32Å; E506-L510 WeakPolarHBondContact O-CG 3.47Å; E506-L510 PolarHBondContact O-N 3.37Å
507	T	62.4	Low	62.5	Low	67 Å²	67	111.3 Å²	111.3	41%	0.411	63%	0.631	S	S	.	*	H	α-helix	trans	-71.6	-28	175.8	62.8	0	0	0	0	112.8	P504 P505 R511	P504-T507 HydrophobicContact CG-CG2 3.91Å; P504-T507 PolarHBondContact O-N 3.26Å; P504-T507 PolarHBondContact O-OG1 2.89Å; P505-T507 VanDerWaalsContact C-N 3.32Å; P505-T507 PolarHBondContact O-N 2.97Å; T507-R511 WeakPolarHBondContact O-CB 3.46Å; T507-R511 PolarHBondContact O-N 2.82Å; T507-R511 VanDerWaalsContact O-N 3.11Å
508	V	67.7	Low	64.4	Low	82 Å²	82	104 Å²	104	50%	0.497	61%	0.608	S	S	.	*	H	α-helix	trans	-71	-47.8	173.8	-176.6	0	0	0	0	109.8	P505 E506 R511 E512	P505-V508 WeakPolarHBondContact O-CB 3.41Å; P505-V508 PolarHBondContact O-N 3.49Å; P505-V508 VanDerWaalsContact O-N 3.16Å; E506-V508 VanDerWaalsContact C-N 3.33Å; E506-V508 PolarHBondContact O-N 2.92Å; V508-R511 PolarHBondContact O-N 3.16Å; V508-E512 WeakPolarHBondContact O-CB 3.27Å; V508-E512 PolarHBondContact O-N 3.03Å
509	L	72.8	Confident	66.3	Low	103 Å²	103	106.6 Å²	106.6	54%	0.539	60%	0.598	S	S	.	*	H	α-helix	trans	-62.8	-44.3	177.7	-69.9	171.2	0	0	0	112.5	P505 E506 R511 E512 Q513	P505-L509 WeakPolarHBondContact O-CG 3.44Å; P505-L509 PolarHBondContact O-N 3.07Å; E506-L509 PolarHBondContact O-N 2.85Å; L509-R511 VanDerWaalsContact C-N 3.33Å; L509-R511 PolarHBondContact O-N 3.36Å; L509-E512 PolarHBondContact O-N 3.37Å; L509-Q513 WeakPolarHBondContact O-CG 3.31Å; L509-Q513 PolarHBondContact O-N 3.49Å
510	L	73.7	Confident	67.9	Low	99 Å²	99	105.4 Å²	105.4	52%	0.518	58%	0.581	S	S	.	*	H	α-helix	trans	-62.1	-40.4	175.2	-75.6	167.8	0	0	0	111.7	E506 Q513 L514	E506-L510 HydrophobicContact CG-CD1 4.16Å; E506-L510 WeakPolarHBondContact O-CB 3.25Å; E506-L510 VanDerWaalsContact O-CG 3.32Å; E506-L510 WeakPolarHBondContact O-CG 3.47Å; E506-L510 PolarHBondContact O-N 3.37Å; L510-Q513 PolarHBondContact O-N 2.71Å; L510-L514 WeakPolarHBondContact O-CB 3.26Å; L510-L514 PolarHBondContact O-N 2.87Å
511	R	73.2	Confident	69.7	Low	187 Å²	187	108.1 Å²	108.1	71%	0.706	57%	0.574	S	S	*	*	H	α-helix	trans	-66.6	-38	175.9	-173	176.9	-177	-172.5	0.4	112.2	T507 V508 L509 L514 L515	T507-R511 WeakPolarHBondContact O-CB 3.46Å; T507-R511 PolarHBondContact O-N 2.82Å; T507-R511 VanDerWaalsContact O-N 3.11Å; V508-R511 PolarHBondContact O-N 3.16Å; L509-R511 VanDerWaalsContact C-N 3.33Å; L509-R511 PolarHBondContact O-N 3.36Å; R511-L514 PolarHBondContact O-N 3.38Å; R511-L515 HydrophobicContact CG-CD1 4.31Å; R511-L515 WeakPolarHBondContact O-CB 3.24Å; R511-L515 VanDerWaalsContact O-CG 3.26Å; R511-L515 WeakPolarHBondContact O-CG 3.39Å; R511-L515 PolarHBondContact O-N 2.86Å
512	E	73.8	Confident	71.5	Confident	113 Å²	113	107.9 Å²	107.9	53%	0.528	56%	0.563	S	S	.	*	H	α-helix	trans	-68.3	-40.3	175.8	-177.5	167.3	-146.7	0	0	112.4	V508 L509 L515 T516	V508-E512 WeakPolarHBondContact O-CB 3.27Å; V508-E512 PolarHBondContact O-N 3.03Å; L509-E512 PolarHBondContact O-N 3.37Å; E512-L515 PolarHBondContact O-N 3.32Å; E512-T516 WeakPolarHBondContact O-CB 3.47Å; E512-T516 PolarHBondContact O-N 3.04Å; E512-T516 PolarHBondContact O-OG1 2.72Å
513	Q	77.8	Confident	73.2	Confident	125 Å²	125	106 Å²	106	58%	0.584	55%	0.547	S	S	*	.	H	α-helix	trans	-61.8	-47	171.7	-75.1	-179	-8.5	0	0	111.4	L509 L510 L515 T516 V517	L509-Q513 WeakPolarHBondContact O-CG 3.31Å; L509-Q513 PolarHBondContact O-N 3.49Å; L510-Q513 PolarHBondContact O-N 2.71Å; Q513-L515 VanDerWaalsContact C-N 3.32Å; Q513-L515 PolarHBondContact O-N 3.44Å; Q513-T516 WeakPolarHBondContact O-CA 3.47Å; Q513-T516 WeakPolarHBondContact O-CB 3.46Å; Q513-T516 PolarHBondContact O-N 3.05Å; Q513-V517 PolarHBondContact O-N 2.92Å
514	L	76.3	Confident	74.7	Confident	138 Å²	138	109.1 Å²	109.1	72%	0.723	55%	0.551	S	S	*	*	H	α-helix	trans	-64	-37.1	-179.7	-137.5	131.1	0	0	0	112.2	L510 R511 T516 G518	L510-L514 WeakPolarHBondContact O-CB 3.26Å; L510-L514 PolarHBondContact O-N 2.87Å; R511-L514 PolarHBondContact O-N 3.38Å; L514-T516 VanDerWaalsContact C-N 3.34Å; L514-G518 PolarHBondContact O-N 3.13Å
515	L	77.2	Confident	75.4	Confident	97 Å²	97	108.4 Å²	108.4	51%	0.508	55%	0.548	S	S	.	.	H	α-helix	trans	-68	-30.8	171.2	-73.8	169.3	0	0	0	112.8	R511 E512 Q513 R519	R511-L515 HydrophobicContact CG-CD1 4.31Å; R511-L515 WeakPolarHBondContact O-CB 3.24Å; R511-L515 VanDerWaalsContact O-CG 3.26Å; R511-L515 WeakPolarHBondContact O-CG 3.39Å; R511-L515 PolarHBondContact O-N 2.86Å; E512-L515 PolarHBondContact O-N 3.32Å; Q513-L515 VanDerWaalsContact C-N 3.32Å; Q513-L515 PolarHBondContact O-N 3.44Å; L515-R519 VanDerWaalsContact O-CG 3.3Å; L515-R519 WeakPolarHBondContact O-CG 3.18Å; L515-R519 PolarHBondContact O-N 3.23Å; L515-R519 VanDerWaalsContact O-N 3.09Å; L515-R519 PolarHBondContact O-NE 2.94Å
516	T	80.5	Confident	76.4	Confident	45 Å²	45	106.8 Å²	106.8	28%	0.276	54%	0.539	S	S	.	.	H	α-helix	trans	-73.1	-51.3	177.5	-56.8	0	0	0	0	111.1	E512 Q513 L514 G518 R519 E520	E512-T516 WeakPolarHBondContact O-CB 3.47Å; E512-T516 PolarHBondContact O-N 3.04Å; E512-T516 PolarHBondContact O-OG1 2.72Å; Q513-T516 WeakPolarHBondContact O-CA 3.47Å; Q513-T516 WeakPolarHBondContact O-CB 3.46Å; Q513-T516 PolarHBondContact O-N 3.05Å; L514-T516 VanDerWaalsContact C-N 3.34Å; T516-G518 PolarHBondContact O-N 2.92Å; T516-R519 WeakPolarHBondContact O-CB 3.42Å; T516-R519 PolarHBondContact O-N 3.4Å; T516-R519 PolarHBondContact OG1-NH2 3.11Å; T516-E520 WeakPolarHBondContact O-CG 3.46Å; T516-E520 PolarHBondContact O-N 2.82Å
517	V	79.9	Confident	77.6	Confident	92 Å²	92	103 Å²	103	56%	0.558	52%	0.521	S	S	*	.	H	α-helix	trans	-58.7	-38.1	174	177.4	0	0	0	0	111.1	Q513 E520 H521	Q513-V517 PolarHBondContact O-N 2.92Å; V517-E520 PolarHBondContact O-N 3.03Å; V517-H521 WeakPolarHBondContact O-CB 3.4Å; V517-H521 PolarHBondContact O-N 2.97Å
518	G	76.4	Confident	78.7	Confident	41 Å²	41	104.1 Å²	104.1	42%	0.423	52%	0.524	S	S	.	.	H	α-helix	trans	-62.2	-40.3	174	0	0	0	0	0	113.8	L514 T516 H522	L514-G518 PolarHBondContact O-N 3.13Å; T516-G518 PolarHBondContact O-N 2.92Å; G518-H522 VanDerWaalsContact O-CB 3.29Å; G518-H522 WeakPolarHBondContact O-CB 3.47Å; G518-H522 PolarHBondContact O-N 3.06Å; G518-H522 VanDerWaalsContact O-N 3.09Å
519	R	78.7	Confident	79.6	Confident	148 Å²	148	106.3 Å²	106.3	56%	0.558	53%	0.527	S	S	*	.	H	α-helix	trans	-68	-41.4	173.8	-75.4	178.7	-64.5	-120.4	4.5	112.1	L515 T516 H522 K523	L515-R519 VanDerWaalsContact O-CG 3.3Å; L515-R519 WeakPolarHBondContact O-CG 3.18Å; L515-R519 PolarHBondContact O-N 3.23Å; L515-R519 VanDerWaalsContact O-N 3.09Å; L515-R519 PolarHBondContact O-NE 2.94Å; T516-R519 WeakPolarHBondContact O-CB 3.42Å; T516-R519 PolarHBondContact O-N 3.4Å; T516-R519 PolarHBondContact OG1-NH2 3.11Å; R519-H522 PolarHBondContact O-N 2.72Å; R519-K523 WeakPolarHBondContact O-CB 3.42Å; R519-K523 PolarHBondContact O-N 3.17Å
520	E	82.9	Confident	80.5	Confident	107 Å²	107	107.4 Å²	107.4	50%	0.5	53%	0.529	S	S	.	.	H	α-helix	trans	-65.5	-51.5	179.8	-71.5	170	154.8	0	0	110.8	T516 V517 H522 K523 E524	T516-E520 WeakPolarHBondContact O-CG 3.46Å; T516-E520 PolarHBondContact O-N 2.82Å; V517-E520 PolarHBondContact O-N 3.03Å; E520-H522 VanDerWaalsContact C-N 3.28Å; E520-H522 PolarHBondContact O-N 3.03Å; E520-K523 WeakPolarHBondContact O-CB 3.21Å; E520-K523 PolarHBondContact O-N 2.95Å; E520-E524 WeakPolarHBondContact O-CG 3.49Å; E520-E524 PolarHBondContact O-N 3.06Å
521	H	79	Confident	81.1	Confident	128 Å²	128	108.5 Å²	108.5	59%	0.593	53%	0.53	S	S	*	.	H	α-helix	trans	-59.7	-36.4	174.7	-179.9	-91.2	0	0	0	112.6	V517 S525	V517-H521 WeakPolarHBondContact O-CB 3.4Å; V517-H521 PolarHBondContact O-N 2.97Å; H521-S525 WeakPolarHBondContact O-CB 3.47Å; H521-S525 PolarHBondContact O-N 3.14Å
522	H	78.6	Confident	81.5	Confident	138 Å²	138	107.3 Å²	107.3	64%	0.639	53%	0.526	S	S	*	.	H	α-helix	trans	-66.9	-40.7	174.1	-173	68.3	0	0	0	112.3	G518 R519 E520 S525 S526	G518-H522 VanDerWaalsContact O-CB 3.29Å; G518-H522 WeakPolarHBondContact O-CB 3.47Å; G518-H522 PolarHBondContact O-N 3.06Å; G518-H522 VanDerWaalsContact O-N 3.09Å; R519-H522 PolarHBondContact O-N 2.72Å; E520-H522 VanDerWaalsContact C-N 3.28Å; E520-H522 PolarHBondContact O-N 3.03Å; H522-S525 PolarHBondContact O-N 3.2Å; H522-S526 WeakPolarHBondContact O-CB 3.2Å; H522-S526 PolarHBondContact O-N 3.35Å
523	K	87.9	Confident	82.2	Confident	128 Å²	128	107.2 Å²	107.2	56%	0.557	53%	0.526	S	S	*	.	H	α-helix	trans	-64.2	-48	174.9	-178.2	178.1	-179.5	-78.9	0	111.4	R519 E520 S525 S526 E527	R519-K523 WeakPolarHBondContact O-CB 3.42Å; R519-K523 PolarHBondContact O-N 3.17Å; E520-K523 WeakPolarHBondContact O-CB 3.21Å; E520-K523 PolarHBondContact O-N 2.95Å; K523-S525 VanDerWaalsContact C-N 3.35Å; K523-S525 PolarHBondContact O-N 2.84Å; K523-S526 PolarHBondContact O-N 3Å; K523-E527 IonicContact NZ-OE1 3.01Å; K523-E527 PolarHBondContact NZ-OE1 3.49Å; K523-E527 WeakPolarHBondContact O-CG 3.42Å; K523-E527 PolarHBondContact O-N 3.06Å
524	E	84.9	Confident	82.8	Confident	128 Å²	128	105.6 Å²	105.6	60%	0.598	53%	0.525	S	S	*	.	H	α-helix	trans	-59.4	-44.6	175.9	-71.3	179.5	163.9	0	0	111.6	E520 S526 E527 L528	E520-E524 WeakPolarHBondContact O-CG 3.49Å; E520-E524 PolarHBondContact O-N 3.06Å; E524-S526 VanDerWaalsContact C-N 3.35Å; E524-S526 PolarHBondContact O-N 2.97Å; E524-E527 PolarHBondContact O-N 2.94Å; E524-L528 WeakPolarHBondContact O-CB 3.48Å; E524-L528 PolarHBondContact O-N 3.02Å
525	S	74.4	Confident	83.2	Confident	66 Å²	66	101.8 Å²	101.8	46%	0.462	51%	0.513	S	S	.	.	H	α-helix	trans	-62.5	-39.5	175.7	-173.8	0	0	0	0	112.4	H521 H522 K523 K529	H521-S525 WeakPolarHBondContact O-CB 3.47Å; H521-S525 PolarHBondContact O-N 3.14Å; H522-S525 PolarHBondContact O-N 3.2Å; K523-S525 VanDerWaalsContact C-N 3.35Å; K523-S525 PolarHBondContact O-N 2.84Å; S525-K529 WeakPolarHBondContact O-CB 3.46Å; S525-K529 PolarHBondContact O-N 2.72Å
526	S	83.9	Confident	83.5	Confident	67 Å²	67	102 Å²	102	47%	0.469	51%	0.514	S	S	.	.	H	α-helix	trans	-67.4	-48.1	175.5	-169.8	0	0	0	0	112.1	H522 K523 E524 L528 K529 E530	H522-S526 WeakPolarHBondContact O-CB 3.2Å; H522-S526 PolarHBondContact O-N 3.35Å; K523-S526 PolarHBondContact O-N 3Å; E524-S526 VanDerWaalsContact C-N 3.35Å; E524-S526 PolarHBondContact O-N 2.97Å; S526-L528 VanDerWaalsContact C-N 3.31Å; S526-L528 PolarHBondContact O-N 3.37Å; S526-K529 PolarHBondContact O-N 2.72Å; S526-E530 WeakPolarHBondContact O-CB 3.32Å; S526-E530 PolarHBondContact O-N 2.58Å
527	E	88.5	Confident	83.9	Confident	64 Å²	64	102.4 Å²	102.4	30%	0.299	52%	0.522	S	S	.	.	H	α-helix	trans	-61.7	-39.6	176.8	-76.2	-172.4	-147.4	0	0	111.8	K523 E524 E530 K531	K523-E527 IonicContact NZ-OE1 3.01Å; K523-E527 PolarHBondContact NZ-OE1 3.49Å; K523-E527 WeakPolarHBondContact O-CG 3.42Å; K523-E527 PolarHBondContact O-N 3.06Å; E524-E527 PolarHBondContact O-N 2.94Å; E527-E530 PolarHBondContact O-N 2.98Å; E527-K531 WeakPolarHBondContact O-CB 3.36Å; E527-K531 VanDerWaalsContact O-CD 3.23Å; E527-K531 WeakPolarHBondContact O-CD 3.39Å; E527-K531 WeakPolarHBondContact O-CG 3.42Å; E527-K531 PolarHBondContact O-N 2.96Å; E527-K531 IonicContact OE2-NZ 2.73Å; E527-K531 PolarHBondContact OE2-NZ 2.67Å
528	L	85.6	Confident	84.3	Confident	90 Å²	90	100.7 Å²	100.7	47%	0.471	52%	0.517	S	S	.	.	H	α-helix	trans	-67.6	-40.4	177.6	-175.6	62	0	0	0	111.1	E524 S526 K531 Y532	E524-L528 WeakPolarHBondContact O-CB 3.48Å; E524-L528 PolarHBondContact O-N 3.02Å; S526-L528 VanDerWaalsContact C-N 3.31Å; S526-L528 PolarHBondContact O-N 3.37Å; L528-K531 PolarHBondContact O-N 3.48Å; L528-Y532 HydrophobicContact CD1-CD2 4.08Å; L528-Y532 HydrophobicContact CD1-CE2 3.61Å; L528-Y532 HydrophobicContact CD2-CE2 4.17Å; L528-Y532 HydrophobicContact CG-CD2 3.93Å; L528-Y532 HydrophobicContact CG-CE2 3.63Å; L528-Y532 WeakPolarHBondContact O-CD2 3.39Å; L528-Y532 PolarHBondContact O-N 2.94Å
529	K	86.6	Confident	83.9	Confident	128 Å²	128	101.5 Å²	101.5	56%	0.557	52%	0.517	S	S	*	.	H	α-helix	trans	-59.8	-48.1	172	-178	-177.6	178.7	-77.8	0	111.3	S525 S526 K531 Y532 E533	S525-K529 WeakPolarHBondContact O-CB 3.46Å; S525-K529 PolarHBondContact O-N 2.72Å; S526-K529 PolarHBondContact O-N 2.72Å; K529-K531 VanDerWaalsContact C-N 3.34Å; K529-K531 PolarHBondContact O-N 3Å; K529-Y532 PolarHBondContact O-N 2.77Å; K529-E533 IonicContact NZ-OE1 3.08Å; K529-E533 IonicContact NZ-OE2 2.81Å; K529-E533 PolarHBondContact NZ-OE2 2.79Å; K529-E533 VanDerWaalsContact O-CB 3.31Å; K529-E533 WeakPolarHBondContact O-CB 3.35Å; K529-E533 PolarHBondContact O-N 2.82Å
530	E	90	Very high	84	Confident	127 Å²	127	100.2 Å²	100.2	59%	0.593	52%	0.517	S	S	*	.	H	α-helix	trans	-61.7	-40.7	179.1	-174.5	176.6	-169.3	0	0	112	S526 E527 E533 T534	S526-E530 WeakPolarHBondContact O-CB 3.32Å; S526-E530 PolarHBondContact O-N 2.58Å; E527-E530 PolarHBondContact O-N 2.98Å; E530-E533 PolarHBondContact O-N 3.33Å; E530-T534 VanDerWaalsContact O-CB 3.32Å; E530-T534 WeakPolarHBondContact O-CB 3.45Å; E530-T534 PolarHBondContact O-N 3.49Å; E530-T534 PolarHBondContact O-OG1 3.43Å
531	K	87.3	Confident	84.4	Confident	121 Å²	121	102.3 Å²	102.3	53%	0.526	53%	0.527	S	S	.	.	H	α-helix	trans	-61.6	-44.2	173.5	-70.7	158.3	-162.6	165.9	0	111.4	E527 L528 K529 A535	E527-K531 WeakPolarHBondContact O-CB 3.36Å; E527-K531 VanDerWaalsContact O-CD 3.23Å; E527-K531 WeakPolarHBondContact O-CD 3.39Å; E527-K531 WeakPolarHBondContact O-CG 3.42Å; E527-K531 PolarHBondContact O-N 2.96Å; E527-K531 IonicContact OE2-NZ 2.73Å; E527-K531 PolarHBondContact OE2-NZ 2.67Å; L528-K531 PolarHBondContact O-N 3.48Å; K529-K531 VanDerWaalsContact C-N 3.34Å; K529-K531 PolarHBondContact O-N 3Å; K531-A535 WeakPolarHBondContact O-CB 3.35Å; K531-A535 PolarHBondContact O-N 3.47Å
532	Y	82.1	Confident	84.7	Confident	162 Å²	162	101.8 Å²	101.8	64%	0.635	53%	0.525	S	S	*	.	H	α-helix	trans	-67.6	-40	175.1	-79.4	-57.3	0	0	0	113.4	L528 K529 A535 L536	L528-Y532 HydrophobicContact CD1-CD2 4.08Å; L528-Y532 HydrophobicContact CD1-CE2 3.61Å; L528-Y532 HydrophobicContact CD2-CE2 4.17Å; L528-Y532 HydrophobicContact CG-CD2 3.93Å; L528-Y532 HydrophobicContact CG-CE2 3.63Å; L528-Y532 WeakPolarHBondContact O-CD2 3.39Å; L528-Y532 PolarHBondContact O-N 2.94Å; K529-Y532 PolarHBondContact O-N 2.77Å; Y532-A535 PolarHBondContact O-N 2.95Å; Y532-L536 VanDerWaalsContact O-CB 3.27Å; Y532-L536 WeakPolarHBondContact O-CB 3.47Å; Y532-L536 PolarHBondContact O-N 3.28Å
533	E	88	Confident	85	Confident	112 Å²	112	98.1 Å²	98.1	52%	0.523	51%	0.512	S	S	.	.	H	α-helix	trans	-67.5	-39	179.9	-166.3	157.5	-172.3	0	0	110.9	K529 E530 A537	K529-E533 IonicContact NZ-OE1 3.08Å; K529-E533 IonicContact NZ-OE2 2.81Å; K529-E533 PolarHBondContact NZ-OE2 2.79Å; K529-E533 VanDerWaalsContact O-CB 3.31Å; K529-E533 WeakPolarHBondContact O-CB 3.35Å; K529-E533 PolarHBondContact O-N 2.82Å; E530-E533 PolarHBondContact O-N 3.33Å; E533-A537 WeakPolarHBondContact O-CB 3.42Å; E533-A537 PolarHBondContact O-N 2.93Å
534	T	89.8	Confident	85	Confident	91 Å²	91	97.5 Å²	97.5	56%	0.558	51%	0.511	S	S	*	.	H	α-helix	trans	-65.4	-45.5	171.9	-54.9	0	0	0	0	112.1	E530 L536 A537 A538	E530-T534 VanDerWaalsContact O-CB 3.32Å; E530-T534 WeakPolarHBondContact O-CB 3.45Å; E530-T534 PolarHBondContact O-N 3.49Å; E530-T534 PolarHBondContact O-OG1 3.43Å; T534-L536 VanDerWaalsContact C-N 3.34Å; T534-L536 PolarHBondContact O-N 3.43Å; T534-A537 PolarHBondContact O-N 2.92Å; T534-A538 PolarHBondContact O-N 3.28Å
535	A	84.2	Confident	85.2	Confident	57 Å²	57	94.1 Å²	94.1	47%	0.471	50%	0.502	S	S	.	.	H	α-helix	trans	-64.6	-37.8	177.6	0	0	0	0	0	112.4	K531 Y532 A538 S539	K531-A535 WeakPolarHBondContact O-CB 3.35Å; K531-A535 PolarHBondContact O-N 3.47Å; Y532-A535 PolarHBondContact O-N 2.95Å; A535-A538 PolarHBondContact O-N 3.46Å; A535-S539 WeakPolarHBondContact O-CB 3.32Å; A535-S539 PolarHBondContact O-N 3.42Å
536	L	83.8	Confident	85.6	Confident	102 Å²	102	95.5 Å²	95.5	53%	0.534	50%	0.503	S	S	.	.	H	α-helix	trans	-64.7	-44.1	174.4	-179.8	62.1	0	0	0	111.4	Y532 T534 S539 Q540	Y532-L536 VanDerWaalsContact O-CB 3.27Å; Y532-L536 WeakPolarHBondContact O-CB 3.47Å; Y532-L536 PolarHBondContact O-N 3.28Å; T534-L536 VanDerWaalsContact C-N 3.34Å; T534-L536 PolarHBondContact O-N 3.43Å; L536-S539 PolarHBondContact O-N 2.99Å; L536-Q540 HydrophobicContact CD1-CG 4.49Å; L536-Q540 WeakPolarHBondContact O-CB 3.4Å; L536-Q540 VanDerWaalsContact O-CG 3.28Å; L536-Q540 WeakPolarHBondContact O-CG 3.37Å; L536-Q540 PolarHBondContact O-N 3.38Å
537	A	89.8	Confident	85.7	Confident	53 Å²	53	99.1 Å²	99.1	44%	0.438	51%	0.507	S	S	.	.	H	α-helix	trans	-62.4	-43.6	175.9	0	0	0	0	0	112.2	E533 T534 Q540 Q541	E533-A537 WeakPolarHBondContact O-CB 3.42Å; E533-A537 PolarHBondContact O-N 2.93Å; T534-A537 PolarHBondContact O-N 2.92Å; A537-Q540 PolarHBondContact O-N 2.97Å; A537-Q541 PolarHBondContact O-N 3.44Å
538	A	88.1	Confident	85.8	Confident	56 Å²	56	100.1 Å²	100.1	46%	0.463	52%	0.517	S	S	.	.	H	α-helix	trans	-61.5	-45.2	175.6	0	0	0	0	0	112.1	T534 A535 Q540 Q541 E542	T534-A538 PolarHBondContact O-N 3.28Å; A535-A538 PolarHBondContact O-N 3.46Å; A538-Q540 PolarHBondContact O-N 2.82Å; A538-Q541 PolarHBondContact O-N 3.21Å; A538-E542 PolarHBondContact O-N 2.95Å
539	S	67.4	Low	86	Confident	59 Å²	59	99 Å²	99	41%	0.413	51%	0.514	S	S	.	.	H	α-helix	trans	-64.7	-37	176.5	-174.9	0	0	0	0	112.5	A535 L536 E542 V543	A535-S539 WeakPolarHBondContact O-CB 3.32Å; A535-S539 PolarHBondContact O-N 3.42Å; L536-S539 PolarHBondContact O-N 2.99Å; S539-E542 PolarHBondContact O-N 3.02Å; S539-V543 WeakPolarHBondContact O-CB 3.41Å; S539-V543 VanDerWaalsContact O-CG2 3.31Å; S539-V543 WeakPolarHBondContact O-CG2 3.47Å; S539-V543 PolarHBondContact O-N 2.96Å
540	Q	81.8	Confident	85.7	Confident	121 Å²	121	97.3 Å²	97.3	57%	0.565	51%	0.514	S	S	*	.	H	α-helix	trans	-64.1	-42.3	173	-74.4	175.2	14.1	0	0	112	L536 A537 A538 V543 E544	L536-Q540 HydrophobicContact CD1-CG 4.49Å; L536-Q540 WeakPolarHBondContact O-CB 3.4Å; L536-Q540 VanDerWaalsContact O-CG 3.28Å; L536-Q540 WeakPolarHBondContact O-CG 3.37Å; L536-Q540 PolarHBondContact O-N 3.38Å; A537-Q540 PolarHBondContact O-N 2.97Å; A538-Q540 PolarHBondContact O-N 2.82Å; Q540-V543 PolarHBondContact O-N 3.47Å; Q540-E544 WeakPolarHBondContact O-CB 3.39Å; Q540-E544 PolarHBondContact O-N 3.25Å
541	Q	90.5	Very high	85.7	Confident	150 Å²	150	98.2 Å²	98.2	70%	0.701	52%	0.516	S	S	*	.	H	α-helix	trans	-64.2	-40.3	175.6	-175	179.2	-2.2	0	0	112.1	A537 A538 E544 S545	A537-Q541 PolarHBondContact O-N 3.44Å; A538-Q541 PolarHBondContact O-N 3.21Å; Q541-E544 PolarHBondContact O-N 3.23Å; Q541-S545 PolarHBondContact O-N 3.38Å
542	E	86.2	Confident	85.9	Confident	118 Å²	118	98.9 Å²	98.9	55%	0.551	52%	0.519	S	S	*	.	H	α-helix	trans	-61.5	-49.4	173.7	-174.9	177.2	-163.8	0	0	111.2	A538 S539 E544 S545 L546	A538-E542 PolarHBondContact O-N 2.95Å; S539-E542 PolarHBondContact O-N 3.02Å; E542-E544 VanDerWaalsContact C-N 3.31Å; E542-E544 PolarHBondContact O-N 3.45Å; E542-S545 PolarHBondContact O-N 3.38Å; E542-S545 VanDerWaalsContact O-N 3.11Å; E542-S545 PolarHBondContact O-OG 2.86Å; E542-L546 HydrophobicContact CG-CD1 4.1Å; E542-L546 WeakPolarHBondContact O-CG 3.44Å; E542-L546 PolarHBondContact O-N 3.18Å
543	V	83.4	Confident	85.8	Confident	61 Å²	61	96 Å²	96	37%	0.37	51%	0.511	S	S	.	.	H	α-helix	trans	-59.5	-39	176	167.8	0	0	0	0	112	S539 Q540 R547	S539-V543 WeakPolarHBondContact O-CB 3.41Å; S539-V543 VanDerWaalsContact O-CG2 3.31Å; S539-V543 WeakPolarHBondContact O-CG2 3.47Å; S539-V543 PolarHBondContact O-N 2.96Å; Q540-V543 PolarHBondContact O-N 3.47Å; V543-R547 WeakPolarHBondContact O-CB 3.35Å; V543-R547 WeakPolarHBondContact O-CD 3.46Å; V543-R547 WeakPolarHBondContact O-CG 3.35Å; V543-R547 PolarHBondContact O-N 2.88Å
544	E	89.4	Confident	85.3	Confident	114 Å²	114	94 Å²	94	53%	0.533	51%	0.51	S	S	.	.	H	α-helix	trans	-63.1	-46.2	173.4	-163.5	89.2	-89	0	0	111.1	Q540 Q541 E542 L546 R547 T548	Q540-E544 WeakPolarHBondContact O-CB 3.39Å; Q540-E544 PolarHBondContact O-N 3.25Å; Q541-E544 PolarHBondContact O-N 3.23Å; E542-E544 VanDerWaalsContact C-N 3.31Å; E542-E544 PolarHBondContact O-N 3.45Å; E544-L546 PolarHBondContact O-N 2.87Å; E544-R547 WeakPolarHBondContact O-CB 3.05Å; E544-R547 PolarHBondContact O-N 3.14Å; E544-R547 IonicContact OE1-NH1 2.67Å; E544-T548 PolarHBondContact O-N 3.23Å
545	S	88.1	Confident	85.2	Confident	58 Å²	58	92.8 Å²	92.8	41%	0.406	51%	0.509	S	S	.	.	H	α-helix	trans	-60.9	-46.4	177.9	79.8	0	0	0	0	111.7	Q541 E542 R547 T548 V549	Q541-S545 PolarHBondContact O-N 3.38Å; E542-S545 PolarHBondContact O-N 3.38Å; E542-S545 VanDerWaalsContact O-N 3.11Å; E542-S545 PolarHBondContact O-OG 2.86Å; S545-R547 VanDerWaalsContact C-N 3.32Å; S545-R547 PolarHBondContact O-N 2.95Å; S545-T548 PolarHBondContact O-N 3.31Å; S545-T548 PolarHBondContact O-OG1 3.33Å; S545-V549 PolarHBondContact O-N 3.2Å; S545-V549 VanDerWaalsContact O-N 3.07Å
546	L	84.3	Confident	85.3	Confident	95 Å²	95	94.2 Å²	94.2	50%	0.497	51%	0.506	S	S	.	.	H	α-helix	trans	-61.9	-38.5	176.5	-69.3	171.7	0	0	0	111.6	E542 E544 T548 V549 V550	E542-L546 HydrophobicContact CG-CD1 4.1Å; E542-L546 WeakPolarHBondContact O-CG 3.44Å; E542-L546 PolarHBondContact O-N 3.18Å; E544-L546 PolarHBondContact O-N 2.87Å; L546-T548 VanDerWaalsContact C-N 3.3Å; L546-T548 PolarHBondContact O-N 3.04Å; L546-V549 PolarHBondContact O-N 3.27Å; L546-V550 WeakPolarHBondContact O-CB 3.31Å; L546-V550 WeakPolarHBondContact O-CG2 3.4Å; L546-V550 PolarHBondContact O-N 3.47Å
547	R	85.8	Confident	85.2	Confident	143 Å²	143	94.9 Å²	94.9	54%	0.54	51%	0.509	S	S	.	.	H	α-helix	trans	-61.2	-35.1	171.7	-74.9	164.5	176.1	179.8	2.3	112.6	V543 E544 S545 K551	V543-R547 WeakPolarHBondContact O-CB 3.35Å; V543-R547 WeakPolarHBondContact O-CD 3.46Å; V543-R547 WeakPolarHBondContact O-CG 3.35Å; V543-R547 PolarHBondContact O-N 2.88Å; E544-R547 WeakPolarHBondContact O-CB 3.05Å; E544-R547 PolarHBondContact O-N 3.14Å; E544-R547 IonicContact OE1-NH1 2.67Å; S545-R547 VanDerWaalsContact C-N 3.32Å; S545-R547 PolarHBondContact O-N 2.95Å; R547-K551 WeakPolarHBondContact O-CB 3.24Å; R547-K551 VanDerWaalsContact O-CG 3.23Å; R547-K551 WeakPolarHBondContact O-CG 3.06Å; R547-K551 PolarHBondContact O-N 2.82Å
548	T	90.1	Very high	85.1	Confident	84 Å²	84	94.2 Å²	94.2	52%	0.515	51%	0.507	S	S	.	.	H	α-helix	trans	-70.3	-40.5	174.5	69.4	0	0	0	0	112.3	E544 S545 L546 K551 K552	E544-T548 PolarHBondContact O-N 3.23Å; S545-T548 PolarHBondContact O-N 3.31Å; S545-T548 PolarHBondContact O-OG1 3.33Å; L546-T548 VanDerWaalsContact C-N 3.3Å; L546-T548 PolarHBondContact O-N 3.04Å; T548-K551 PolarHBondContact O-N 2.87Å; T548-K552 PolarHBondContact O-N 2.96Å
549	V	89.3	Confident	85.1	Confident	67 Å²	67	96.5 Å²	96.5	41%	0.406	51%	0.508	S	S	.	.	H	α-helix	trans	-63.1	-48.1	176.1	176.1	0	0	0	0	110.9	S545 L546 K551 K552 Q553	S545-V549 PolarHBondContact O-N 3.2Å; S545-V549 VanDerWaalsContact O-N 3.07Å; L546-V549 PolarHBondContact O-N 3.27Å; V549-K551 VanDerWaalsContact C-N 3.33Å; V549-K551 PolarHBondContact O-N 3.31Å; V549-K552 PolarHBondContact O-N 3.23Å; V549-K552 VanDerWaalsContact O-N 3.17Å; V549-Q553 HydrophobicContact CG1-CG 4.41Å; V549-Q553 WeakPolarHBondContact O-CG 3.47Å; V549-Q553 PolarHBondContact O-N 3.05Å
550	V	81.6	Confident	85.7	Confident	92 Å²	92	98.9 Å²	98.9	56%	0.558	51%	0.514	S	S	*	.	H	α-helix	trans	-60.9	-40.7	176.7	170.8	0	0	0	0	111.4	L546 S554	L546-V550 WeakPolarHBondContact O-CB 3.31Å; L546-V550 WeakPolarHBondContact O-CG2 3.4Å; L546-V550 PolarHBondContact O-N 3.47Å; V550-S554 VanDerWaalsContact O-CB 3.31Å; V550-S554 WeakPolarHBondContact O-CB 3.49Å; V550-S554 PolarHBondContact O-N 3.38Å; V550-S554 PolarHBondContact O-OG 3.02Å
551	K	88.3	Confident	85.7	Confident	146 Å²	146	99.5 Å²	99.5	64%	0.635	52%	0.515	S	S	*	.	H	α-helix	trans	-59.8	-48.5	173	-78.8	171.9	-179	176.2	0	111.5	R547 T548 V549 S554 A555	R547-K551 WeakPolarHBondContact O-CB 3.24Å; R547-K551 VanDerWaalsContact O-CG 3.23Å; R547-K551 WeakPolarHBondContact O-CG 3.06Å; R547-K551 PolarHBondContact O-N 2.82Å; T548-K551 PolarHBondContact O-N 2.87Å; V549-K551 VanDerWaalsContact C-N 3.33Å; V549-K551 PolarHBondContact O-N 3.31Å; K551-S554 PolarHBondContact O-N 2.7Å; K551-S554 PolarHBondContact O-OG 2.95Å; K551-A555 PolarHBondContact O-N 3.18Å; K551-A555 VanDerWaalsContact O-N 3.12Å
552	K	91.2	Very high	85.5	Confident	135 Å²	135	98.9 Å²	98.9	59%	0.587	51%	0.512	S	S	*	.	H	α-helix	trans	-59.2	-51	178.7	-173	177.9	-174.5	-87	0	111.6	T548 V549 S554 A555 E556	T548-K552 PolarHBondContact O-N 2.96Å; V549-K552 PolarHBondContact O-N 3.23Å; V549-K552 VanDerWaalsContact O-N 3.17Å; K552-S554 VanDerWaalsContact C-N 3.31Å; K552-S554 PolarHBondContact O-N 3.12Å; K552-A555 WeakPolarHBondContact O-CB 3.18Å; K552-A555 PolarHBondContact O-N 3.04Å; K552-A555 VanDerWaalsContact O-N 3.12Å; K552-E556 WeakPolarHBondContact CE-OE1 3.14Å; K552-E556 WeakPolarHBondContact CG-OE1 3.23Å; K552-E556 IonicContact NZ-OE1 2.72Å; K552-E556 PolarHBondContact NZ-OE1 3.41Å; K552-E556 WeakPolarHBondContact O-CG 3.23Å; K552-E556 PolarHBondContact O-N 2.86Å
553	Q	81.8	Confident	85.5	Confident	101 Å²	101	98.5 Å²	98.5	47%	0.472	51%	0.509	S	S	.	.	H	α-helix	trans	-60.2	-39.1	177.1	-71.4	175	-21.2	0	0	112	V549 A555 E556 I557	V549-Q553 HydrophobicContact CG1-CG 4.41Å; V549-Q553 WeakPolarHBondContact O-CG 3.47Å; V549-Q553 PolarHBondContact O-N 3.05Å; Q553-A555 VanDerWaalsContact C-N 3.3Å; Q553-A555 PolarHBondContact O-N 2.85Å; Q553-E556 PolarHBondContact O-N 3.15Å; Q553-I557 WeakPolarHBondContact O-CB 3.41Å; Q553-I557 WeakPolarHBondContact O-CD1 3.36Å; Q553-I557 WeakPolarHBondContact O-CG1 3.31Å; Q553-I557 PolarHBondContact O-N 3.07Å
554	S	77.1	Confident	85.5	Confident	72 Å²	72	99.9 Å²	99.9	50%	0.503	52%	0.517	S	S	.	.	H	α-helix	trans	-64.5	-32.5	176.8	75.7	0	0	0	0	113.3	V550 K551 K552 G558	V550-S554 VanDerWaalsContact O-CB 3.31Å; V550-S554 WeakPolarHBondContact O-CB 3.49Å; V550-S554 PolarHBondContact O-N 3.38Å; V550-S554 PolarHBondContact O-OG 3.02Å; K551-S554 PolarHBondContact O-N 2.7Å; K551-S554 PolarHBondContact O-OG 2.95Å; K552-S554 VanDerWaalsContact C-N 3.31Å; K552-S554 PolarHBondContact O-N 3.12Å; S554-G558 PolarHBondContact O-N 3.32Å; S554-G558 VanDerWaalsContact O-N 3.08Å
555	A	86.9	Confident	85.2	Confident	65 Å²	65	100.2 Å²	100.2	54%	0.537	52%	0.519	S	S	.	.	H	α-helix	trans	-72.9	-44.1	174.4	0	0	0	0	0	111.8	K551 K552 Q553 I557 G558 E559	K551-A555 PolarHBondContact O-N 3.18Å; K551-A555 VanDerWaalsContact O-N 3.12Å; K552-A555 WeakPolarHBondContact O-CB 3.18Å; K552-A555 PolarHBondContact O-N 3.04Å; K552-A555 VanDerWaalsContact O-N 3.12Å; Q553-A555 VanDerWaalsContact C-N 3.3Å; Q553-A555 PolarHBondContact O-N 2.85Å; A555-I557 PolarHBondContact O-N 2.87Å; A555-G558 WeakPolarHBondContact O-CA 3.41Å; A555-G558 PolarHBondContact O-N 3.2Å; A555-G558 VanDerWaalsContact O-N 3.08Å; A555-E559 PolarHBondContact O-N 2.89Å
556	E	86.6	Confident	85.1	Confident	86 Å²	86	101.7 Å²	101.7	40%	0.402	52%	0.519	S	S	.	.	H	α-helix	trans	-60.5	-42.3	175.3	-69.5	168.6	-179.1	0	0	111.6	K552 Q553 G558 E559 M560	K552-E556 WeakPolarHBondContact CE-OE1 3.14Å; K552-E556 WeakPolarHBondContact CG-OE1 3.23Å; K552-E556 IonicContact NZ-OE1 2.72Å; K552-E556 PolarHBondContact NZ-OE1 3.41Å; K552-E556 WeakPolarHBondContact O-CG 3.23Å; K552-E556 PolarHBondContact O-N 2.86Å; Q553-E556 PolarHBondContact O-N 3.15Å; E556-G558 VanDerWaalsContact C-N 3.32Å; E556-G558 PolarHBondContact O-N 3.15Å; E556-E559 PolarHBondContact O-N 3.22Å; E556-M560 WeakPolarHBondContact O-CB 3.27Å; E556-M560 WeakPolarHBondContact O-CG 3.29Å; E556-M560 PolarHBondContact O-N 2.85Å
557	I	82.6	Confident	84.9	Confident	117 Å²	117	99.2 Å²	99.2	60%	0.6	51%	0.512	S	S	*	.	H	α-helix	trans	-62.4	-39.4	172.6	-70.1	164.8	0	0	0	111.1	Q553 A555 K561	Q553-I557 WeakPolarHBondContact O-CB 3.41Å; Q553-I557 WeakPolarHBondContact O-CD1 3.36Å; Q553-I557 WeakPolarHBondContact O-CG1 3.31Å; Q553-I557 PolarHBondContact O-N 3.07Å; A555-I557 PolarHBondContact O-N 2.87Å; I557-K561 VanDerWaalsContact O-CB 3.23Å; I557-K561 WeakPolarHBondContact O-CB 3.17Å; I557-K561 PolarHBondContact O-N 2.83Å
558	G	87.9	Confident	84.7	Confident	38 Å²	38	96.3 Å²	96.3	39%	0.392	51%	0.51	S	S	.	.	H	α-helix	trans	-61.6	-48.3	174.7	0	0	0	0	0	112.8	S554 A555 E556 K561 Q562	S554-G558 PolarHBondContact O-N 3.32Å; S554-G558 VanDerWaalsContact O-N 3.08Å; A555-G558 WeakPolarHBondContact O-CA 3.41Å; A555-G558 PolarHBondContact O-N 3.2Å; A555-G558 VanDerWaalsContact O-N 3.08Å; E556-G558 VanDerWaalsContact C-N 3.32Å; E556-G558 PolarHBondContact O-N 3.15Å; G558-K561 PolarHBondContact O-N 3.03Å; G558-Q562 PolarHBondContact O-N 3.03Å
559	E	87.1	Confident	84.6	Confident	104 Å²	104	97.2 Å²	97.2	49%	0.486	51%	0.507	S	S	.	.	H	α-helix	trans	-64.1	-44.5	178.1	-166.4	-167.8	151.3	0	0	111.7	A555 E556 K561 Q562 K563	A555-E559 PolarHBondContact O-N 2.89Å; E556-E559 PolarHBondContact O-N 3.22Å; E559-K561 VanDerWaalsContact C-N 3.35Å; E559-K561 PolarHBondContact O-N 2.97Å; E559-Q562 PolarHBondContact O-N 3.41Å; E559-K563 WeakPolarHBondContact O-CG 3.5Å; E559-K563 PolarHBondContact O-N 3.36Å; E559-K563 WeakPolarHBondContact OE1-CE 3.49Å; E559-K563 IonicContact OE1-NZ 3.89Å; E559-K563 PolarHBondContact OE1-NZ 2.76Å
560	M	80.7	Confident	84.5	Confident	110 Å²	110	98.7 Å²	98.7	54%	0.542	51%	0.509	S	S	.	.	H	α-helix	trans	-63.6	-39.7	176.3	-72.9	-60.8	-66.4	0	0	112	E556 Q562 K563 V564	E556-M560 WeakPolarHBondContact O-CB 3.27Å; E556-M560 WeakPolarHBondContact O-CG 3.29Å; E556-M560 PolarHBondContact O-N 2.85Å; M560-Q562 VanDerWaalsContact C-N 3.35Å; M560-Q562 PolarHBondContact O-N 2.83Å; M560-K563 PolarHBondContact O-N 3.38Å; M560-K563 HydrophobicContact SD-CD 4.14Å; M560-V564 WeakPolarHBondContact O-CG2 3.23Å; M560-V564 PolarHBondContact O-N 2.9Å
561	K	82	Confident	84.3	Confident	134 Å²	134	99 Å²	99	58%	0.583	51%	0.508	S	S	*	.	H	α-helix	trans	-62.3	-41.2	173.4	-176.1	178.8	-179.5	-179.2	0	111.8	I557 G558 E559 V564 Q565	I557-K561 VanDerWaalsContact O-CB 3.23Å; I557-K561 WeakPolarHBondContact O-CB 3.17Å; I557-K561 PolarHBondContact O-N 2.83Å; G558-K561 PolarHBondContact O-N 3.03Å; E559-K561 VanDerWaalsContact C-N 3.35Å; E559-K561 PolarHBondContact O-N 2.97Å; K561-V564 PolarHBondContact O-N 3.39Å; K561-Q565 WeakPolarHBondContact O-CG 3.31Å; K561-Q565 PolarHBondContact O-N 2.79Å
562	Q	86.4	Confident	84.1	Confident	137 Å²	137	97.7 Å²	97.7	64%	0.64	51%	0.506	S	S	*	.	H	α-helix	trans	-64.5	-41.8	175.9	-173.3	176.2	-5.5	0	0	111.8	G558 E559 M560 Q565 Q566	G558-Q562 PolarHBondContact O-N 3.03Å; E559-Q562 PolarHBondContact O-N 3.41Å; M560-Q562 VanDerWaalsContact C-N 3.35Å; M560-Q562 PolarHBondContact O-N 2.83Å; Q562-Q565 PolarHBondContact O-N 2.95Å; Q562-Q566 WeakPolarHBondContact O-CB 3.43Å; Q562-Q566 PolarHBondContact O-N 2.83Å
563	K	85.8	Confident	83.9	Confident	110 Å²	110	96.4 Å²	96.4	48%	0.478	50%	0.502	S	S	.	.	H	α-helix	trans	-61.1	-44	174.3	-71.7	170.8	-176.2	168.3	0	112.3	E559 M560 Q566 A567	E559-K563 WeakPolarHBondContact O-CG 3.5Å; E559-K563 PolarHBondContact O-N 3.36Å; E559-K563 WeakPolarHBondContact OE1-CE 3.49Å; E559-K563 IonicContact OE1-NZ 3.89Å; E559-K563 PolarHBondContact OE1-NZ 2.76Å; M560-K563 PolarHBondContact O-N 3.38Å; M560-K563 HydrophobicContact SD-CD 4.14Å; K563-Q566 PolarHBondContact O-N 3.34Å; K563-A567 WeakPolarHBondContact O-CB 3.44Å; K563-A567 PolarHBondContact O-N 3.41Å
564	V	82.1	Confident	84.1	Confident	90 Å²	90	96.3 Å²	96.3	55%	0.545	50%	0.502	S	S	.	.	H	α-helix	trans	-63.6	-41.4	175.7	171	0	0	0	0	111.4	M560 K561 T568	M560-V564 WeakPolarHBondContact O-CG2 3.23Å; M560-V564 PolarHBondContact O-N 2.9Å; K561-V564 PolarHBondContact O-N 3.39Å; V564-T568 WeakPolarHBondContact O-CB 3.27Å; V564-T568 PolarHBondContact O-N 3Å; V564-T568 PolarHBondContact O-OG1 2.77Å
565	Q	83.1	Confident	84.1	Confident	121 Å²	121	99.2 Å²	99.2	57%	0.565	51%	0.51	S	S	*	.	H	α-helix	trans	-64	-41.7	175.5	-75.1	179.7	-38.9	0	0	112.3	K561 Q562 T568 K569	K561-Q565 WeakPolarHBondContact O-CG 3.31Å; K561-Q565 PolarHBondContact O-N 2.79Å; Q562-Q565 PolarHBondContact O-N 2.95Å; Q565-T568 PolarHBondContact O-N 2.87Å; Q565-K569 PolarHBondContact O-N 2.66Å
566	Q	86.5	Confident	84.1	Confident	89 Å²	89	100.3 Å²	100.3	42%	0.416	51%	0.506	S	S	.	.	H	α-helix	trans	-64.4	-48.2	176.7	-178.4	60.4	22.9	0	0	111.7	Q562 K563 T568 K569 E570	Q562-Q566 WeakPolarHBondContact O-CB 3.43Å; Q562-Q566 PolarHBondContact O-N 2.83Å; K563-Q566 PolarHBondContact O-N 3.34Å; Q566-T568 VanDerWaalsContact C-N 3.29Å; Q566-T568 PolarHBondContact O-N 2.98Å; Q566-K569 WeakPolarHBondContact O-CB 3.39Å; Q566-K569 PolarHBondContact O-N 3Å; Q566-K569 VanDerWaalsContact O-N 3.12Å; Q566-E570 WeakPolarHBondContact CG-OE1 3.47Å; Q566-E570 PolarHBondContact NE2-OE1 3.17Å; Q566-E570 WeakPolarHBondContact O-CG 3.41Å; Q566-E570 PolarHBondContact O-N 3.38Å
567	A	79.4	Confident	84.1	Confident	43 Å²	43	98.6 Å²	98.6	36%	0.355	50%	0.504	S	S	.	.	H	α-helix	trans	-62.7	-34.6	176.1	0	0	0	0	0	112.6	K563 N571	K563-A567 WeakPolarHBondContact O-CB 3.44Å; K563-A567 PolarHBondContact O-N 3.41Å; A567-N571 WeakPolarHBondContact O-CB 3.44Å; A567-N571 VanDerWaalsContact O-CG 3.27Å; A567-N571 PolarHBondContact O-N 2.94Å; A567-N571 PolarHBondContact O-ND2 3.42Å
568	T	81.5	Confident	83.9	Confident	81 Å²	81	101.2 Å²	101.2	50%	0.497	51%	0.507	S	S	.	.	H	α-helix	trans	-65.4	-41.2	174	-56.3	0	0	0	0	111.3	V564 Q565 Q566 M572	V564-T568 WeakPolarHBondContact O-CB 3.27Å; V564-T568 PolarHBondContact O-N 3Å; V564-T568 PolarHBondContact O-OG1 2.77Å; Q565-T568 PolarHBondContact O-N 2.87Å; Q566-T568 VanDerWaalsContact C-N 3.29Å; Q566-T568 PolarHBondContact O-N 2.98Å; T568-M572 PolarHBondContact O-N 3.48Å; T568-M572 VanDerWaalsContact O-N 3.09Å
569	K	89.6	Confident	83.9	Confident	103 Å²	103	105.3 Å²	105.3	45%	0.448	51%	0.514	S	S	.	.	H	α-helix	trans	-64.4	-48.4	175.3	179.6	-174	163.8	-173.8	0	111.4	Q565 Q566 N571 M572 E573	Q565-K569 PolarHBondContact O-N 2.66Å; Q566-K569 WeakPolarHBondContact O-CB 3.39Å; Q566-K569 PolarHBondContact O-N 3Å; Q566-K569 VanDerWaalsContact O-N 3.12Å; K569-N571 VanDerWaalsContact C-N 3.33Å; K569-N571 PolarHBondContact O-N 3.45Å; K569-M572 PolarHBondContact O-N 2.99Å; K569-E573 WeakPolarHBondContact CE-OE1 3.2Å; K569-E573 HydrophobicContact CG-CG 4.5Å; K569-E573 IonicContact NZ-OE1 2.61Å; K569-E573 PolarHBondContact NZ-OE1 3.23Å; K569-E573 PolarHBondContact O-N 3.44Å
570	E	87.3	Confident	84	Confident	98 Å²	98	104.2 Å²	104.2	46%	0.458	51%	0.514	S	S	.	.	H	α-helix	trans	-61.1	-39.7	178.9	-72.2	168.5	-176	0	0	112.1	Q566 M572 E573 M574	Q566-E570 WeakPolarHBondContact CG-OE1 3.47Å; Q566-E570 PolarHBondContact NE2-OE1 3.17Å; Q566-E570 WeakPolarHBondContact O-CG 3.41Å; Q566-E570 PolarHBondContact O-N 3.38Å; E570-M572 VanDerWaalsContact C-N 3.33Å; E570-M572 PolarHBondContact O-N 3.29Å; E570-E573 PolarHBondContact O-N 3.49Å; E570-M574 WeakPolarHBondContact O-CB 3.18Å; E570-M574 PolarHBondContact O-N 2.94Å
571	N	76.4	Confident	84.2	Confident	98 Å²	98	104.8 Å²	104.8	52%	0.524	51%	0.514	S	S	.	.	H	α-helix	trans	-63.6	-36.7	172.3	-76.6	-23.6	0	0	0	112.4	A567 K569 M574 M575	A567-N571 WeakPolarHBondContact O-CB 3.44Å; A567-N571 VanDerWaalsContact O-CG 3.27Å; A567-N571 PolarHBondContact O-N 2.94Å; A567-N571 PolarHBondContact O-ND2 3.42Å; K569-N571 VanDerWaalsContact C-N 3.33Å; K569-N571 PolarHBondContact O-N 3.45Å; N571-M574 WeakPolarHBondContact O-CB 3.49Å; N571-M574 PolarHBondContact O-N 2.95Å; N571-M575 VanDerWaalsContact O-CG 3.31Å; N571-M575 WeakPolarHBondContact O-CG 3.37Å; N571-M575 PolarHBondContact O-N 3.05Å
572	M	83.8	Confident	84.4	Confident	120 Å²	120	104.9 Å²	104.9	59%	0.591	51%	0.514	S	S	*	.	H	α-helix	trans	-72.4	-41.4	177.3	-168.3	147	58.2	0	0	112	T568 K569 E570 M574 M575 D576	T568-M572 PolarHBondContact O-N 3.48Å; T568-M572 VanDerWaalsContact O-N 3.09Å; K569-M572 PolarHBondContact O-N 2.99Å; E570-M572 VanDerWaalsContact C-N 3.33Å; E570-M572 PolarHBondContact O-N 3.29Å; M572-M574 VanDerWaalsContact C-N 3.28Å; M572-M574 PolarHBondContact O-N 2.9Å; M572-M575 PolarHBondContact O-N 3.29Å; M572-M575 VanDerWaalsContact O-N 3.15Å; M572-D576 PolarHBondContact O-N 2.61Å
573	E	87.8	Confident	84.3	Confident	107 Å²	107	102.1 Å²	102.1	50%	0.5	50%	0.504	S	S	.	.	H	α-helix	trans	-62.7	-34.6	171.9	-70.3	177.4	165	0	0	111.8	K569 E570 S577	K569-E573 WeakPolarHBondContact CE-OE1 3.2Å; K569-E573 HydrophobicContact CG-CG 4.5Å; K569-E573 IonicContact NZ-OE1 2.61Å; K569-E573 PolarHBondContact NZ-OE1 3.23Å; K569-E573 PolarHBondContact O-N 3.44Å; E570-E573 PolarHBondContact O-N 3.49Å; E573-S577 WeakPolarHBondContact O-CB 3.39Å; E573-S577 PolarHBondContact O-N 2.86Å
574	M	86.1	Confident	84.4	Confident	99 Å²	99	102.7 Å²	102.7	49%	0.488	51%	0.51	S	S	.	.	H	α-helix	trans	-64	-48.8	170.1	-167.6	-167.3	-48.5	0	0	111.3	E570 N571 M572 D576 S577 W578	E570-M574 WeakPolarHBondContact O-CB 3.18Å; E570-M574 PolarHBondContact O-N 2.94Å; N571-M574 WeakPolarHBondContact O-CB 3.49Å; N571-M574 PolarHBondContact O-N 2.95Å; M572-M574 VanDerWaalsContact C-N 3.28Å; M572-M574 PolarHBondContact O-N 2.9Å; M574-D576 PolarHBondContact O-N 3.17Å; M574-S577 WeakPolarHBondContact O-CB 3.34Å; M574-S577 PolarHBondContact O-N 3.25Å; M574-S577 VanDerWaalsContact O-N 3.16Å; M574-W578 PolarHBondContact O-N 2.94Å
575	M	77.5	Confident	84.6	Confident	134 Å²	134	103 Å²	103	66%	0.66	51%	0.508	S	S	*	.	H	α-helix	trans	-60.7	-41.5	178.3	-74.9	-66.3	-68.6	0	0	112.2	N571 M572 W578 K579	N571-M575 VanDerWaalsContact O-CG 3.31Å; N571-M575 WeakPolarHBondContact O-CG 3.37Å; N571-M575 PolarHBondContact O-N 3.05Å; M572-M575 PolarHBondContact O-N 3.29Å; M572-M575 VanDerWaalsContact O-N 3.15Å; M575-W578 PolarHBondContact O-N 3.43Å; M575-K579 VanDerWaalsContact O-CB 3.29Å; M575-K579 WeakPolarHBondContact O-CB 3.44Å; M575-K579 PolarHBondContact O-N 3.41Å
576	D	85.4	Confident	84.8	Confident	87 Å²	87	100.7 Å²	100.7	47%	0.465	50%	0.502	S	S	.	.	H	α-helix	trans	-67.6	-34.7	174.8	-79.4	-33.6	0	0	0	112.3	M572 M574 T580	M572-D576 PolarHBondContact O-N 2.61Å; M574-D576 PolarHBondContact O-N 3.17Å; D576-T580 WeakPolarHBondContact O-CB 3.21Å; D576-T580 PolarHBondContact O-N 2.86Å; D576-T580 PolarHBondContact O-OG1 2.85Å
577	S	86.6	Confident	84.8	Confident	51 Å²	51	100.1 Å²	100.1	36%	0.357	50%	0.504	S	S	.	.	H	α-helix	trans	-63.8	-41.7	171	-175.4	0	0	0	0	112.2	E573 M574 K581	E573-S577 WeakPolarHBondContact O-CB 3.39Å; E573-S577 PolarHBondContact O-N 2.86Å; M574-S577 WeakPolarHBondContact O-CB 3.34Å; M574-S577 PolarHBondContact O-N 3.25Å; M574-S577 VanDerWaalsContact O-N 3.16Å; S577-K581 WeakPolarHBondContact O-CD 3.42Å; S577-K581 VanDerWaalsContact O-CG 3.29Å; S577-K581 WeakPolarHBondContact O-CG 3.48Å; S577-K581 PolarHBondContact O-N 3.14Å; S577-K581 VanDerWaalsContact O-N 3.08Å; S577-K581 PolarHBondContact OG-NZ 2.99Å
578	W	79.4	Confident	85.1	Confident	172 Å²	172	101.7 Å²	101.7	65%	0.652	51%	0.507	S	S	*	.	H	α-helix	trans	-69.6	-41.6	177.4	-78.9	53.3	0	0	0	111.8	M574 M575 K581 F582	M574-W578 PolarHBondContact O-N 2.94Å; M575-W578 PolarHBondContact O-N 3.43Å; W578-K581 PolarHBondContact O-N 2.82Å; W578-F582 PolarHBondContact O-N 3.03Å
579	K	88.1	Confident	85.3	Confident	123 Å²	123	103.5 Å²	103.5	54%	0.535	51%	0.51	S	S	.	.	H	α-helix	trans	-59.4	-47.4	172.5	-177.8	-178.7	173.7	-171.2	0	111.4	M575 K581 F582 D583	M575-K579 VanDerWaalsContact O-CB 3.29Å; M575-K579 WeakPolarHBondContact O-CB 3.44Å; M575-K579 PolarHBondContact O-N 3.41Å; K579-K581 VanDerWaalsContact C-N 3.3Å; K579-K581 PolarHBondContact O-N 2.88Å; K579-F582 CarbonylContact O-C 3.39Å; K579-F582 WeakPolarHBondContact O-CA 3.48Å; K579-F582 WeakPolarHBondContact O-CB 3.41Å; K579-F582 PolarHBondContact O-N 2.86Å; K579-D583 PolarHBondContact O-N 3.13Å
580	T	88.3	Confident	85.3	Confident	81 Å²	81	103.2 Å²	103.2	50%	0.497	51%	0.51	S	S	.	.	H	α-helix	trans	-58.4	-41.6	176	-55.8	0	0	0	0	111.6	D576 D583 M584	D576-T580 WeakPolarHBondContact O-CB 3.21Å; D576-T580 PolarHBondContact O-N 2.86Å; D576-T580 PolarHBondContact O-OG1 2.85Å; T580-D583 PolarHBondContact O-N 3.3Å; T580-M584 HydrophobicContact CG2-SD 4.41Å; T580-M584 WeakPolarHBondContact O-CB 3.35Å; T580-M584 VanDerWaalsContact O-CG 3.24Å; T580-M584 WeakPolarHBondContact O-CG 3.32Å; T580-M584 PolarHBondContact O-N 2.91Å
581	K	85.6	Confident	85.1	Confident	123 Å²	123	104.1 Å²	104.1	54%	0.535	51%	0.509	S	S	.	.	H	α-helix	trans	-65.1	-37.1	174.7	-71.4	161.3	-175.7	158.2	0	112.6	S577 W578 K579 L585	S577-K581 WeakPolarHBondContact O-CD 3.42Å; S577-K581 VanDerWaalsContact O-CG 3.29Å; S577-K581 WeakPolarHBondContact O-CG 3.48Å; S577-K581 PolarHBondContact O-N 3.14Å; S577-K581 VanDerWaalsContact O-N 3.08Å; S577-K581 PolarHBondContact OG-NZ 2.99Å; W578-K581 PolarHBondContact O-N 2.82Å; K579-K581 VanDerWaalsContact C-N 3.3Å; K579-K581 PolarHBondContact O-N 2.88Å; K581-L585 WeakPolarHBondContact O-CB 3.26Å; K581-L585 PolarHBondContact O-N 2.72Å
582	F	85.3	Confident	85.3	Confident	135 Å²	135	102.6 Å²	102.6	59%	0.592	51%	0.506	S	S	*	.	H	α-helix	trans	-67.9	-47.4	175.7	-171.3	-92.9	0	0	0	111.4	W578 K579 M584 L585 V586	W578-F582 PolarHBondContact O-N 3.03Å; K579-F582 CarbonylContact O-C 3.39Å; K579-F582 WeakPolarHBondContact O-CA 3.48Å; K579-F582 WeakPolarHBondContact O-CB 3.41Å; K579-F582 PolarHBondContact O-N 2.86Å; F582-M584 VanDerWaalsContact C-N 3.29Å; F582-M584 PolarHBondContact O-N 3.42Å; F582-L585 PolarHBondContact O-N 2.77Å; F582-V586 HydrophobicContact CD1-CG2 3.94Å; F582-V586 HydrophobicContact CE1-CG2 3.64Å; F582-V586 HydrophobicContact CZ-CG2 4.13Å; F582-V586 WeakPolarHBondContact O-CG2 3.35Å; F582-V586 PolarHBondContact O-N 2.95Å
583	D	85.1	Confident	85.1	Confident	79 Å²	79	101.9 Å²	101.9	42%	0.422	50%	0.504	S	S	.	.	H	α-helix	trans	-62.8	-35.8	176.5	-65.3	-24.3	0	0	0	111.4	K579 T580 T587	K579-D583 PolarHBondContact O-N 3.13Å; T580-D583 PolarHBondContact O-N 3.3Å; D583-T587 WeakPolarHBondContact O-CB 3.46Å; D583-T587 WeakPolarHBondContact O-CG2 3.42Å; D583-T587 PolarHBondContact O-N 3.18Å; D583-T587 PolarHBondContact O-OG1 2.98Å
584	M	86.9	Confident	84.7	Confident	122 Å²	122	102 Å²	102	60%	0.601	51%	0.505	S	S	*	.	H	α-helix	trans	-62.5	-46.5	168.7	-77	178.8	69	0	0	112.2	T580 F582 V586 T587 D588	T580-M584 HydrophobicContact CG2-SD 4.41Å; T580-M584 WeakPolarHBondContact O-CB 3.35Å; T580-M584 VanDerWaalsContact O-CG 3.24Å; T580-M584 WeakPolarHBondContact O-CG 3.32Å; T580-M584 PolarHBondContact O-N 2.91Å; F582-M584 VanDerWaalsContact C-N 3.29Å; F582-M584 PolarHBondContact O-N 3.42Å; M584-V586 VanDerWaalsContact C-N 3.35Å; M584-V586 PolarHBondContact O-N 3.41Å; M584-T587 WeakPolarHBondContact CA-OG1 3.43Å; M584-T587 PolarHBondContact O-N 3.21Å; M584-T587 PolarHBondContact O-OG1 2.93Å; M584-T587 VanDerWaalsContact O-OG1 3.07Å; M584-D588 VanDerWaalsContact O-CB 3.3Å; M584-D588 WeakPolarHBondContact O-CB 3.46Å; M584-D588 PolarHBondContact O-N 3.35Å
585	L	86.8	Confident	84.4	Confident	97 Å²	97	103.1 Å²	103.1	51%	0.508	51%	0.509	S	S	.	.	H	α-helix	trans	-65.9	-36.2	179.3	-176.7	63.9	0	0	0	112.6	K581 F582 H589	K581-L585 WeakPolarHBondContact O-CB 3.26Å; K581-L585 PolarHBondContact O-N 2.72Å; F582-L585 PolarHBondContact O-N 2.77Å; L585-H589 PolarHBondContact O-N 2.91Å; L585-H589 PolarHBondContact O-ND1 2.81Å; L585-H589 VanDerWaalsContact O-ND1 3.08Å
586	V	87.2	Confident	84.3	Confident	72 Å²	72	102.3 Å²	102.3	44%	0.436	51%	0.507	S	S	.	.	H	α-helix	trans	-68.2	-44.6	174.6	170	0	0	0	0	110.9	F582 M584 D588 H589 Q590	F582-V586 HydrophobicContact CD1-CG2 3.94Å; F582-V586 HydrophobicContact CE1-CG2 3.64Å; F582-V586 HydrophobicContact CZ-CG2 4.13Å; F582-V586 WeakPolarHBondContact O-CG2 3.35Å; F582-V586 PolarHBondContact O-N 2.95Å; M584-V586 VanDerWaalsContact C-N 3.35Å; M584-V586 PolarHBondContact O-N 3.41Å; V586-D588 VanDerWaalsContact C-N 3.31Å; V586-D588 PolarHBondContact O-N 3.32Å; V586-H589 PolarHBondContact O-N 3.25Å; V586-Q590 WeakPolarHBondContact O-CB 3.05Å; V586-Q590 PolarHBondContact O-N 3.31Å
587	T	87.7	Confident	83.9	Confident	77 Å²	77	104.9 Å²	104.9	47%	0.472	51%	0.513	S	S	.	.	H	α-helix	trans	-69.7	-27.7	176.6	50.3	0	0	0	0	113	D583 M584 R591	D583-T587 WeakPolarHBondContact O-CB 3.46Å; D583-T587 WeakPolarHBondContact O-CG2 3.42Å; D583-T587 PolarHBondContact O-N 3.18Å; D583-T587 PolarHBondContact O-OG1 2.98Å; M584-T587 WeakPolarHBondContact CA-OG1 3.43Å; M584-T587 PolarHBondContact O-N 3.21Å; M584-T587 PolarHBondContact O-OG1 2.93Å; M584-T587 VanDerWaalsContact O-OG1 3.07Å; T587-R591 WeakPolarHBondContact O-CB 3.27Å; T587-R591 PolarHBondContact O-N 2.91Å
588	D	85.4	Confident	83.3	Confident	77 Å²	77	104.6 Å²	104.6	41%	0.412	51%	0.514	S	S	.	.	H	α-helix	trans	-72.1	-40.7	172.5	-154.3	60.1	0	0	0	112.2	M584 V586 R591 S592	M584-D588 VanDerWaalsContact O-CB 3.3Å; M584-D588 WeakPolarHBondContact O-CB 3.46Å; M584-D588 PolarHBondContact O-N 3.35Å; V586-D588 VanDerWaalsContact C-N 3.31Å; V586-D588 PolarHBondContact O-N 3.32Å; D588-R591 PolarHBondContact O-N 3.4Å; D588-R591 IonicContact OD1-CZ 3.07Å; D588-R591 IonicContact OD1-NH1 3.59Å; D588-R591 PolarHBondContact OD1-NH1 2.93Å; D588-S592 WeakPolarHBondContact O-CB 3.42Å; D588-S592 PolarHBondContact O-N 3.48Å; D588-S592 PolarHBondContact O-OG 3.39Å
589	H	85.8	Confident	83	Confident	119 Å²	119	99.4 Å²	99.4	55%	0.551	50%	0.504	S	S	*	.	H	α-helix	trans	-62.8	-44.4	168.9	-88.1	75.8	0	0	0	112.1	L585 V586 R591 S592 L593	L585-H589 PolarHBondContact O-N 2.91Å; L585-H589 PolarHBondContact O-ND1 2.81Å; L585-H589 VanDerWaalsContact O-ND1 3.08Å; V586-H589 PolarHBondContact O-N 3.25Å; H589-R591 VanDerWaalsContact C-N 3.35Å; H589-R591 PolarHBondContact O-N 2.96Å; H589-S592 WeakPolarHBondContact O-CB 3.33Å; H589-S592 PolarHBondContact O-N 3.47Å; H589-L593 WeakPolarHBondContact O-CG 3.39Å; H589-L593 PolarHBondContact O-N 3.41Å
590	Q	88.2	Confident	81.8	Confident	96 Å²	96	97.4 Å²	97.4	45%	0.449	50%	0.499	S	S	.	.	H	α-helix	trans	-62	-42.9	177.5	-177.1	61.3	25.8	0	0	111.3	V586 L593 E594	V586-Q590 WeakPolarHBondContact O-CB 3.05Å; V586-Q590 PolarHBondContact O-N 3.31Å; Q590-L593 PolarHBondContact O-N 3.48Å; Q590-E594 PolarHBondContact NE2-OE1 2.87Å; Q590-E594 WeakPolarHBondContact O-CG 3.12Å; Q590-E594 PolarHBondContact O-N 3.44Å
591	R	84.9	Confident	80.7	Confident	117 Å²	117	97.9 Å²	97.9	44%	0.442	50%	0.498	S	S	.	.	H	α-helix	trans	-61.9	-44.1	173.5	-167.1	-174.4	-47.3	104.9	15.1	111.4	T587 D588 H589 L593 E594 E595	T587-R591 WeakPolarHBondContact O-CB 3.27Å; T587-R591 PolarHBondContact O-N 2.91Å; D588-R591 PolarHBondContact O-N 3.4Å; D588-R591 IonicContact OD1-CZ 3.07Å; D588-R591 IonicContact OD1-NH1 3.59Å; D588-R591 PolarHBondContact OD1-NH1 2.93Å; H589-R591 VanDerWaalsContact C-N 3.35Å; H589-R591 PolarHBondContact O-N 2.96Å; R591-L593 VanDerWaalsContact C-N 3.31Å; R591-L593 PolarHBondContact O-N 2.93Å; R591-E594 CarbonylContact O-C 3.57Å; R591-E594 PolarHBondContact O-N 2.88Å; R591-E594 VanDerWaalsContact O-N 3.14Å; R591-E595 WeakPolarHBondContact CD-OE1 3.45Å; R591-E595 HydrophobicContact CG-CG 4.42Å; R591-E595 WeakPolarHBondContact CG-OE1 3.39Å; R591-E595 WeakPolarHBondContact O-CB 3.38Å; R591-E595 WeakPolarHBondContact O-CG 3.38Å; R591-E595 PolarHBondContact O-N 3.34Å
592	S	80.4	Confident	79.5	Confident	67 Å²	67	102 Å²	102	47%	0.469	51%	0.511	S	S	.	.	H	α-helix	trans	-60	-40.4	176.9	-59	0	0	0	0	112	D588 H589 L596	D588-S592 WeakPolarHBondContact O-CB 3.42Å; D588-S592 PolarHBondContact O-N 3.48Å; D588-S592 PolarHBondContact O-OG 3.39Å; H589-S592 WeakPolarHBondContact O-CB 3.33Å; H589-S592 PolarHBondContact O-N 3.47Å; S592-L596 VanDerWaalsContact O-CB 3.31Å; S592-L596 WeakPolarHBondContact O-CB 3.5Å; S592-L596 PolarHBondContact O-N 2.94Å
593	L	78.4	Confident	77.8	Confident	104 Å²	104	98.1 Å²	98.1	55%	0.545	50%	0.5	S	S	.	.	H	α-helix	trans	-67.6	-37.8	174.1	-71.6	169.7	0	0	0	112.5	H589 Q590 R591 K597	H589-L593 WeakPolarHBondContact O-CG 3.39Å; H589-L593 PolarHBondContact O-N 3.41Å; Q590-L593 PolarHBondContact O-N 3.48Å; R591-L593 VanDerWaalsContact C-N 3.31Å; R591-L593 PolarHBondContact O-N 2.93Å; L593-K597 VanDerWaalsContact O-CB 3.24Å; L593-K597 WeakPolarHBondContact O-CB 3.36Å; L593-K597 PolarHBondContact O-N 3.38Å
594	E	80.7	Confident	76.1	Confident	111 Å²	111	100.6 Å²	100.6	52%	0.519	51%	0.509	S	S	.	.	H	α-helix	trans	-72.4	-35.7	176.6	-75.6	177.9	-161.2	0	0	112.8	Q590 R591 K597 A598	Q590-E594 PolarHBondContact NE2-OE1 2.87Å; Q590-E594 WeakPolarHBondContact O-CG 3.12Å; Q590-E594 PolarHBondContact O-N 3.44Å; R591-E594 CarbonylContact O-C 3.57Å; R591-E594 PolarHBondContact O-N 2.88Å; R591-E594 VanDerWaalsContact O-N 3.14Å; E594-K597 PolarHBondContact O-N 3.34Å; E594-A598 VanDerWaalsContact O-CB 3.26Å; E594-A598 WeakPolarHBondContact O-CB 3.48Å; E594-A598 PolarHBondContact O-N 3.31Å
595	E	78.9	Confident	74.2	Confident	122 Å²	122	100.2 Å²	100.2	57%	0.57	52%	0.519	S	S	*	.	H	α-helix	trans	-67.4	-40.4	171.2	-74.5	-179.7	-158.2	0	0	111.6	R591 A598 S599	R591-E595 WeakPolarHBondContact CD-OE1 3.45Å; R591-E595 HydrophobicContact CG-CG 4.42Å; R591-E595 WeakPolarHBondContact CG-OE1 3.39Å; R591-E595 WeakPolarHBondContact O-CB 3.38Å; R591-E595 WeakPolarHBondContact O-CG 3.38Å; R591-E595 PolarHBondContact O-N 3.34Å; E595-A598 PolarHBondContact O-N 3.02Å; E595-S599 PolarHBondContact O-N 3.4Å
596	L	74.4	Confident	72.3	Confident	117 Å²	117	98.5 Å²	98.5	61%	0.613	52%	0.518	S	S	*	.	H	α-helix	trans	-62.9	-41.4	172.1	-163.7	77.5	0	0	0	111.5	S592 S599 L600	S592-L596 VanDerWaalsContact O-CB 3.31Å; S592-L596 WeakPolarHBondContact O-CB 3.5Å; S592-L596 PolarHBondContact O-N 2.94Å; L596-S599 PolarHBondContact O-N 2.87Å; L596-S599 PolarHBondContact O-OG 3.43Å; L596-L600 WeakPolarHBondContact O-CB 3.45Å; L596-L600 PolarHBondContact O-N 3.5Å
597	K	78	Confident	70.6	Confident	140 Å²	140	100.7 Å²	100.7	61%	0.609	53%	0.534	S	S	*	.	H	α-helix	trans	-67.8	-35.8	175.1	-173.4	177.9	-179.8	-178.3	0	112.2	L593 E594 N601	L593-K597 VanDerWaalsContact O-CB 3.24Å; L593-K597 WeakPolarHBondContact O-CB 3.36Å; L593-K597 PolarHBondContact O-N 3.38Å; E594-K597 PolarHBondContact O-N 3.34Å; K597-N601 PolarHBondContact O-N 3.09Å
598	A	74.5	Confident	68.8	Low	45 Å²	45	106.6 Å²	106.6	37%	0.372	56%	0.556	S	S	.	*	H	α-helix	trans	-70.4	-35.5	174.6	0	0	0	0	0	112	E594 E595 N601 R602	E594-A598 VanDerWaalsContact O-CB 3.26Å; E594-A598 WeakPolarHBondContact O-CB 3.48Å; E594-A598 PolarHBondContact O-N 3.31Å; E595-A598 PolarHBondContact O-N 3.02Å; A598-N601 PolarHBondContact O-N 3.26Å; A598-R602 WeakPolarHBondContact O-CG 3.16Å; A598-R602 PolarHBondContact O-N 3.13Å
599	S	71.9	Confident	67.3	Low	64 Å²	64	105.6 Å²	105.6	45%	0.448	56%	0.564	S	S	.	*	H	α-helix	trans	-67.8	-41.7	173.1	77.7	0	0	0	0	111.2	E595 L596 N601 R602 S603	E595-S599 PolarHBondContact O-N 3.4Å; L596-S599 PolarHBondContact O-N 2.87Å; L596-S599 PolarHBondContact O-OG 3.43Å; S599-N601 VanDerWaalsContact C-N 3.34Å; S599-N601 PolarHBondContact O-N 3.43Å; S599-R602 WeakPolarHBondContact O-CB 3.21Å; S599-R602 PolarHBondContact O-N 3.49Å; S599-R602 VanDerWaalsContact O-N 3.08Å; S599-S603 PolarHBondContact O-N 2.82Å; S599-S603 PolarHBondContact O-OG 2.86Å
600	L	62.6	Low	65.6	Low	81 Å²	81	103.4 Å²	103.4	42%	0.424	55%	0.554	S	S	.	*	H	α-helix	trans	-59.5	-41.3	173.7	-171.8	65.8	0	0	0	112.3	L596 S603 L617	L596-L600 WeakPolarHBondContact O-CB 3.45Å; L596-L600 PolarHBondContact O-N 3.5Å; L600-S603 VanDerWaalsContact C-OG 3.31Å; L600-S603 WeakPolarHBondContact CA-OG 3.32Å; L600-S603 PolarHBondContact O-N 2.63Å; L600-S603 PolarHBondContact O-OG 3.41Å; L600-L617 HydrophobicContact CD1-CD1 3.91Å; L600-L617 HydrophobicContact CD2-CD1 4.04Å
601	N	66.8	Low	63.9	Low	90 Å²	90	107 Å²	107	48%	0.481	57%	0.571	S	S	.	*	H	α-helix	trans	-68.1	-35.8	173.4	-73.8	-4.9	0	0	0	112.4	K597 A598 S599 S603 Q604	K597-N601 PolarHBondContact O-N 3.09Å; A598-N601 PolarHBondContact O-N 3.26Å; S599-N601 VanDerWaalsContact C-N 3.34Å; S599-N601 PolarHBondContact O-N 3.43Å; N601-S603 VanDerWaalsContact C-N 3.29Å; N601-S603 PolarHBondContact O-N 3.12Å; N601-Q604 WeakPolarHBondContact O-CB 3.48Å; N601-Q604 PolarHBondContact O-N 2.85Å
602	R	60.7	Low	62.3	Low	210 Å²	210	108.7 Å²	108.7	79%	0.792	58%	0.584	S	S	*	*	H	α-helix	trans	-64.4	-32.4	173.3	-75.5	176.9	-175.4	-175	4.1	112.3	A598 S599 Q604 S605	A598-R602 WeakPolarHBondContact O-CG 3.16Å; A598-R602 PolarHBondContact O-N 3.13Å; S599-R602 WeakPolarHBondContact O-CB 3.21Å; S599-R602 PolarHBondContact O-N 3.49Å; S599-R602 VanDerWaalsContact O-N 3.08Å; R602-Q604 PolarHBondContact O-N 2.74Å; R602-S605 PolarHBondContact O-OG 3.04Å
603	S	48.3	Very low	61.1	Low	53 Å²	53	110 Å²	110	37%	0.371	59%	0.586	S	S	.	*	G	3₁₀ helix	trans	-69.5	-13.3	174.1	37.2	0	0	0	0	114.7	S599 L600 N601 S605 Q610	S599-S603 PolarHBondContact O-N 2.82Å; S599-S603 PolarHBondContact O-OG 2.86Å; L600-S603 VanDerWaalsContact C-OG 3.31Å; L600-S603 WeakPolarHBondContact CA-OG 3.32Å; L600-S603 PolarHBondContact O-N 2.63Å; L600-S603 PolarHBondContact O-OG 3.41Å; N601-S603 VanDerWaalsContact C-N 3.29Å; N601-S603 PolarHBondContact O-N 3.12Å; S603-S605 PolarHBondContact O-N 3.09Å; S603-Q610 PolarHBondContact O-NE2 3.05Å
604	Q	49.3	Very low	60	Low	131 Å²	131	106.8 Å²	106.8	61%	0.612	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-70.9	-5	178	-67.9	-174.7	-16.3	0	0	114.2	N601 R602 A606	N601-Q604 WeakPolarHBondContact O-CB 3.48Å; N601-Q604 PolarHBondContact O-N 2.85Å; R602-Q604 PolarHBondContact O-N 2.74Å; Q604-A606 VanDerWaalsContact C-N 3.26Å; Q604-A606 PolarHBondContact O-N 3.43Å
605	S	48.3	Very low	59.2	Low	115 Å²	115	106.6 Å²	106.6	80%	0.804	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-84.8	13.9	175.8	74	0	0	0	0	114.7	R602 S603	R602-S605 PolarHBondContact O-OG 3.04Å; S603-S605 PolarHBondContact O-N 3.09Å
606	A	46.9	Very low	58.5	Low	60 Å²	60	106.9 Å²	106.9	50%	0.496	58%	0.575	S	S	.	*	S	Bend	trans	-125.5	118.1	176.2	0	0	0	0	0	110.4	Q604	Q604-A606 VanDerWaalsContact C-N 3.26Å; Q604-A606 PolarHBondContact O-N 3.43Å
607	P	51.2	Low	58.1	Low	119 Å²	119	105.4 Å²	105.4	77%	0.773	57%	0.567	S	S	*	*			trans	-78.2	156.9	-177.2	31.7	-35.1	0	0	0	113.1
608	Q	49.8	Very low	57.7	Low	200 Å²	200	105.3 Å²	105.3	94%	0.935	56%	0.563	S	S	*	*	S	Bend	trans	66.8	90.7	174.2	-66.5	175.1	-58.3	0	0	116.2
609	G	54.3	Low	57.7	Low	56 Å²	56	106.9 Å²	106.9	58%	0.577	57%	0.568	S	S	*	*			trans	168.6	-34.8	164.7	0	0	0	0	0	114.8	E611	G609-E611 VanDerWaalsContact C-N 3.3Å; G609-E611 PolarHBondContact O-N 2.97Å
610	Q	49.5	Very low	57.8	Low	74 Å²	74	107.4 Å²	107.4	35%	0.346	57%	0.568	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72	-0.7	-155.9	-67.1	178.7	-20.2	0	0	118.1	S603 A614	S603-Q610 PolarHBondContact O-NE2 3.05Å; Q610-A614 VanDerWaalsContact O-CB 3.26Å; Q610-A614 WeakPolarHBondContact O-CB 3.45Å; Q610-A614 PolarHBondContact O-N 3.36Å; Q610-A614 VanDerWaalsContact O-N 3.07Å
611	E	51.6	Low	58.3	Low	171 Å²	171	109.3 Å²	109.3	80%	0.799	58%	0.579	S	S	*	*	H	α-helix	trans	-77	-26.4	-175.5	-164.6	157.1	-143.6	0	0	113	G609	G609-E611 VanDerWaalsContact C-N 3.3Å; G609-E611 PolarHBondContact O-N 2.97Å
612	Q	52.8	Low	58.7	Low	153 Å²	153	111 Å²	111	72%	0.715	58%	0.583	S	S	*	*	H	α-helix	trans	-75.4	-50.7	170.2	-64.3	-166.9	-87.8	0	0	111.4	A614 Q615 E616	Q612-A614 VanDerWaalsContact C-N 3.29Å; Q612-A614 PolarHBondContact O-N 2.87Å; Q612-Q615 CarbonylContact O-C 3.59Å; Q612-Q615 WeakPolarHBondContact O-CA 3.35Å; Q612-Q615 WeakPolarHBondContact O-CB 3.41Å; Q612-Q615 PolarHBondContact O-N 2.74Å; Q612-E616 PolarHBondContact O-N 2.97Å
613	D	54.5	Low	59.4	Low	94 Å²	94	104.1 Å²	104.1	50%	0.503	57%	0.568	S	S	.	*	H	α-helix	trans	-56.8	-41.8	-179.6	-54	-8.7	0	0	0	112.1	Q615 E616 L617	D613-Q615 VanDerWaalsContact C-N 3.26Å; D613-Q615 PolarHBondContact O-N 3.11Å; D613-E616 PolarHBondContact O-N 2.93Å; D613-L617 WeakPolarHBondContact O-CB 3.4Å; D613-L617 WeakPolarHBondContact O-CG 3.5Å; D613-L617 PolarHBondContact O-N 3.27Å
614	A	55.2	Low	60.7	Low	36 Å²	36	107 Å²	107	30%	0.298	58%	0.578	S	S	.	*	H	α-helix	trans	-67.4	-25.5	176.3	0	0	0	0	0	113.1	Q610 Q612 R618	Q610-A614 VanDerWaalsContact O-CB 3.26Å; Q610-A614 WeakPolarHBondContact O-CB 3.45Å; Q610-A614 PolarHBondContact O-N 3.36Å; Q610-A614 VanDerWaalsContact O-N 3.07Å; Q612-A614 VanDerWaalsContact C-N 3.29Å; Q612-A614 PolarHBondContact O-N 2.87Å; A614-R618 WeakPolarHBondContact O-CG 3.47Å; A614-R618 PolarHBondContact O-N 3.4Å; A614-R618 PolarHBondContact O-NE 3.38Å; A614-R618 PolarHBondContact O-NH1 2.89Å; A614-R618 PolarHBondContact O-NH2 2.9Å
615	Q	63.1	Low	62.2	Low	107 Å²	107	107.9 Å²	107.9	50%	0.5	58%	0.58	S	S	.	*	H	α-helix	trans	-80.1	-40.8	174.7	-165.3	71.1	-8.8	0	0	111.2	Q612 D613 R618 T619	Q612-Q615 CarbonylContact O-C 3.59Å; Q612-Q615 WeakPolarHBondContact O-CA 3.35Å; Q612-Q615 WeakPolarHBondContact O-CB 3.41Å; Q612-Q615 PolarHBondContact O-N 2.74Å; D613-Q615 VanDerWaalsContact C-N 3.26Å; D613-Q615 PolarHBondContact O-N 3.11Å; Q615-R618 WeakPolarHBondContact O-CB 3.49Å; Q615-R618 PolarHBondContact O-N 2.89Å; Q615-R618 VanDerWaalsContact OE1-CZ 3.29Å; Q615-T619 PolarHBondContact O-N 3.46Å; Q615-T619 PolarHBondContact O-OG1 2.94Å
616	E	65.8	Low	63.6	Low	129 Å²	129	108.3 Å²	108.3	60%	0.603	57%	0.571	S	S	*	*	H	α-helix	trans	-65	-39.2	173.1	-66	-164.1	164.3	0	0	112.1	Q612 D613 R618 T619 T620	Q612-E616 PolarHBondContact O-N 2.97Å; D613-E616 PolarHBondContact O-N 2.93Å; E616-R618 VanDerWaalsContact C-N 3.27Å; E616-R618 PolarHBondContact O-N 3.38Å; E616-T619 WeakPolarHBondContact CA-OG1 3.47Å; E616-T619 PolarHBondContact O-N 3.31Å; E616-T619 PolarHBondContact O-OG1 3.19Å; E616-T620 WeakPolarHBondContact O-CB 3.28Å; E616-T620 WeakPolarHBondContact O-CG2 3.31Å; E616-T620 PolarHBondContact O-N 2.87Å; E616-T620 PolarHBondContact O-OG1 3.37Å
617	L	65	Low	64.7	Low	86 Å²	86	111.4 Å²	111.4	45%	0.45	58%	0.575	S	S	.	*	H	α-helix	trans	-64.7	-29.2	173.1	-76.6	168.4	0	0	0	112.9	L600 D613 T620 L621	L600-L617 HydrophobicContact CD1-CD1 3.91Å; L600-L617 HydrophobicContact CD2-CD1 4.04Å; D613-L617 WeakPolarHBondContact O-CB 3.4Å; D613-L617 WeakPolarHBondContact O-CG 3.5Å; D613-L617 PolarHBondContact O-N 3.27Å; L617-T620 WeakPolarHBondContact CA-OG1 3.46Å; L617-T620 PolarHBondContact O-OG1 2.97Å; L617-L621 WeakPolarHBondContact O-CB 3.34Å; L617-L621 PolarHBondContact O-N 2.88Å
618	R	69.2	Low	65.9	Low	137 Å²	137	112 Å²	112	52%	0.517	57%	0.567	S	S	.	*	H	α-helix	trans	-71.9	-46.1	171.1	-79.2	-177.5	-72.2	-92.7	4.9	111.7	A614 Q615 E616 T620 L621 E622	A614-R618 WeakPolarHBondContact O-CG 3.47Å; A614-R618 PolarHBondContact O-N 3.4Å; A614-R618 PolarHBondContact O-NE 3.38Å; A614-R618 PolarHBondContact O-NH1 2.89Å; A614-R618 PolarHBondContact O-NH2 2.9Å; Q615-R618 WeakPolarHBondContact O-CB 3.49Å; Q615-R618 PolarHBondContact O-N 2.89Å; Q615-R618 VanDerWaalsContact OE1-CZ 3.29Å; E616-R618 VanDerWaalsContact C-N 3.27Å; E616-R618 PolarHBondContact O-N 3.38Å; R618-T620 PolarHBondContact O-N 3.44Å; R618-L621 PolarHBondContact O-N 3Å; R618-E622 WeakPolarHBondContact O-CB 3.26Å; R618-E622 PolarHBondContact O-N 2.69Å
619	T	75.4	Confident	67.2	Low	78 Å²	78	107.6 Å²	107.6	48%	0.479	55%	0.546	S	S	.	.	H	α-helix	trans	-67.8	-34.6	-179.7	56.9	0	0	0	0	112.8	Q615 E616 S623	Q615-T619 PolarHBondContact O-N 3.46Å; Q615-T619 PolarHBondContact O-OG1 2.94Å; E616-T619 WeakPolarHBondContact CA-OG1 3.47Å; E616-T619 PolarHBondContact O-N 3.31Å; E616-T619 PolarHBondContact O-OG1 3.19Å; T619-S623 WeakPolarHBondContact O-CB 3.39Å; T619-S623 PolarHBondContact O-N 2.68Å; T619-S623 PolarHBondContact O-OG 3.39Å
620	T	73.3	Confident	68.5	Low	75 Å²	75	110.8 Å²	110.8	46%	0.46	55%	0.55	S	S	.	.	H	α-helix	trans	-70	-39.8	175	49.2	0	0	0	0	112.7	E616 L617 R618 S623 L624	E616-T620 WeakPolarHBondContact O-CB 3.28Å; E616-T620 WeakPolarHBondContact O-CG2 3.31Å; E616-T620 PolarHBondContact O-N 2.87Å; E616-T620 PolarHBondContact O-OG1 3.37Å; L617-T620 WeakPolarHBondContact CA-OG1 3.46Å; L617-T620 PolarHBondContact O-OG1 2.97Å; R618-T620 PolarHBondContact O-N 3.44Å; T620-S623 WeakPolarHBondContact CA-OG 3.35Å; T620-S623 PolarHBondContact O-N 2.92Å; T620-S623 PolarHBondContact O-OG 2.97Å; T620-L624 WeakPolarHBondContact O-CB 3.3Å; T620-L624 PolarHBondContact O-N 3.46Å
621	L	72.8	Confident	69.9	Low	122 Å²	122	111.5 Å²	111.5	64%	0.639	55%	0.553	S	S	*	*	H	α-helix	trans	-65.9	-40.5	174.8	-161.2	164.6	0	0	0	110.9	L617 R618 L624 K625	L617-L621 WeakPolarHBondContact O-CB 3.34Å; L617-L621 PolarHBondContact O-N 2.88Å; R618-L621 PolarHBondContact O-N 3Å; L621-L624 PolarHBondContact O-N 2.92Å; L621-K625 WeakPolarHBondContact O-CB 3.38Å; L621-K625 PolarHBondContact O-N 3.37Å
622	E	75.4	Confident	70.8	Confident	125 Å²	125	106.3 Å²	106.3	58%	0.584	53%	0.533	S	S	*	.	H	α-helix	trans	-68.5	-36.5	175.6	-168.5	152.8	-123	0	0	112.7	R618 K625 M626	R618-E622 WeakPolarHBondContact O-CB 3.26Å; R618-E622 PolarHBondContact O-N 2.69Å; E622-K625 PolarHBondContact O-N 2.95Å; E622-M626 WeakPolarHBondContact O-CG 3.5Å; E622-M626 PolarHBondContact O-N 3.26Å
623	S	75	Confident	72.1	Confident	66 Å²	66	103.2 Å²	103.2	46%	0.462	52%	0.518	S	S	.	.	H	α-helix	trans	-66.3	-40.8	171.3	65.6	0	0	0	0	112.3	T619 T620 K625 M626 E627	T619-S623 WeakPolarHBondContact O-CB 3.39Å; T619-S623 PolarHBondContact O-N 2.68Å; T619-S623 PolarHBondContact O-OG 3.39Å; T620-S623 WeakPolarHBondContact CA-OG 3.35Å; T620-S623 PolarHBondContact O-N 2.92Å; T620-S623 PolarHBondContact O-OG 2.97Å; S623-K625 VanDerWaalsContact C-N 3.29Å; S623-K625 PolarHBondContact O-N 3.28Å; S623-M626 PolarHBondContact O-N 3.4Å; S623-E627 WeakPolarHBondContact O-CB 3.35Å; S623-E627 PolarHBondContact O-N 2.99Å
624	L	75.8	Confident	73.1	Confident	114 Å²	114	103 Å²	103	60%	0.597	52%	0.518	S	S	*	.	H	α-helix	trans	-64.3	-35.2	177.4	-147	79	0	0	0	111.7	T620 L621 E627 H628	T620-L624 WeakPolarHBondContact O-CB 3.3Å; T620-L624 PolarHBondContact O-N 3.46Å; L621-L624 PolarHBondContact O-N 2.92Å; L624-E627 PolarHBondContact O-N 3.35Å; L624-H628 WeakPolarHBondContact O-CB 3.4Å; L624-H628 PolarHBondContact O-N 2.61Å
625	K	80.6	Confident	74.1	Confident	149 Å²	149	105.8 Å²	105.8	65%	0.648	53%	0.527	S	S	*	.	H	α-helix	trans	-67.4	-41.3	173.6	-174.6	-177	176.3	-171.7	0	112	L621 E622 S623 Q629	L621-K625 WeakPolarHBondContact O-CB 3.38Å; L621-K625 PolarHBondContact O-N 3.37Å; E622-K625 PolarHBondContact O-N 2.95Å; S623-K625 VanDerWaalsContact C-N 3.29Å; S623-K625 PolarHBondContact O-N 3.28Å; K625-Q629 WeakPolarHBondContact O-CB 3.28Å; K625-Q629 PolarHBondContact O-N 2.67Å
626	M	77.8	Confident	74.6	Confident	123 Å²	123	105.2 Å²	105.2	61%	0.606	52%	0.523	S	S	*	.	H	α-helix	trans	-66.6	-40.1	173.8	-74	-65.4	-158	0	0	111.9	E622 S623 Q629 L630	E622-M626 WeakPolarHBondContact O-CG 3.5Å; E622-M626 PolarHBondContact O-N 3.26Å; S623-M626 PolarHBondContact O-N 3.4Å; M626-Q629 PolarHBondContact O-N 2.99Å; M626-L630 WeakPolarHBondContact O-CB 3.22Å; M626-L630 VanDerWaalsContact O-CG 3.3Å; M626-L630 WeakPolarHBondContact O-CG 3.45Å; M626-L630 PolarHBondContact O-N 2.75Å
627	E	71.4	Confident	75.1	Confident	125 Å²	125	101.1 Å²	101.1	58%	0.584	51%	0.511	S	S	*	.	H	α-helix	trans	-61.3	-47.5	175.4	-176.4	170.2	-148.4	0	0	111.4	S623 L624 Q629 L630 E631	S623-E627 WeakPolarHBondContact O-CB 3.35Å; S623-E627 PolarHBondContact O-N 2.99Å; L624-E627 PolarHBondContact O-N 3.35Å; E627-Q629 PolarHBondContact O-N 2.97Å; E627-L630 PolarHBondContact O-N 3.33Å; E627-E631 PolarHBondContact O-N 3.02Å
628	H	75.3	Confident	75.7	Confident	132 Å²	132	103 Å²	103	61%	0.611	52%	0.515	S	S	*	.	H	α-helix	trans	-60.9	-41.9	173.5	-177.7	70.8	0	0	0	112.6	L624 L630 E631 V632	L624-H628 WeakPolarHBondContact O-CB 3.4Å; L624-H628 PolarHBondContact O-N 2.61Å; H628-L630 PolarHBondContact O-N 3.46Å; H628-E631 PolarHBondContact O-N 2.91Å; H628-V632 WeakPolarHBondContact O-CG2 3.19Å; H628-V632 PolarHBondContact O-N 3.49Å
629	Q	77.8	Confident	75.8	Confident	107 Å²	107	102.5 Å²	102.5	50%	0.5	52%	0.519	S	S	.	.	H	α-helix	trans	-66.8	-36	178.2	-177.3	58.6	87.8	0	0	112.5	K625 M626 E627 E633	K625-Q629 WeakPolarHBondContact O-CB 3.28Å; K625-Q629 PolarHBondContact O-N 2.67Å; M626-Q629 PolarHBondContact O-N 2.99Å; E627-Q629 PolarHBondContact O-N 2.97Å; Q629-E633 PolarHBondContact O-N 3.27Å
630	L	82.4	Confident	75.8	Confident	124 Å²	124	105.2 Å²	105.2	65%	0.649	52%	0.524	S	S	*	.	H	α-helix	trans	-66.6	-43.9	172.4	-75.9	167.5	0	0	0	111	M626 E627 H628 V632 E633 N634	M626-L630 WeakPolarHBondContact O-CB 3.22Å; M626-L630 VanDerWaalsContact O-CG 3.3Å; M626-L630 WeakPolarHBondContact O-CG 3.45Å; M626-L630 PolarHBondContact O-N 2.75Å; E627-L630 PolarHBondContact O-N 3.33Å; H628-L630 PolarHBondContact O-N 3.46Å; L630-V632 VanDerWaalsContact C-N 3.34Å; L630-V632 PolarHBondContact O-N 2.97Å; L630-E633 PolarHBondContact O-N 2.81Å; L630-N634 VanDerWaalsContact O-CB 3.25Å; L630-N634 WeakPolarHBondContact O-CB 3.48Å; L630-N634 PolarHBondContact O-N 3.45Å
631	E	78.9	Confident	76.2	Confident	88 Å²	88	106.6 Å²	106.6	41%	0.411	53%	0.527	S	S	.	.	H	α-helix	trans	-66.2	-35.1	179.6	-174.3	56.6	-166.2	0	0	112.4	E627 H628 N634 L635	E627-E631 PolarHBondContact O-N 3.02Å; H628-E631 PolarHBondContact O-N 2.91Å; E631-N634 WeakPolarHBondContact O-CB 3.5Å; E631-N634 PolarHBondContact O-N 3.18Å; E631-N634 PolarHBondContact OE2-ND2 2.99Å; E631-L635 HydrophobicContact CG-CD1 4.31Å; E631-L635 WeakPolarHBondContact O-CB 3.41Å; E631-L635 VanDerWaalsContact O-CG 3.3Å; E631-L635 WeakPolarHBondContact O-CG 3.31Å; E631-L635 PolarHBondContact O-N 2.94Å
632	V	70.2	Confident	76.3	Confident	62 Å²	62	105.6 Å²	105.6	38%	0.376	52%	0.519	S	S	.	.	H	α-helix	trans	-63.1	-43.7	172.2	169.4	0	0	0	0	112	H628 L630 K636	H628-V632 WeakPolarHBondContact O-CG2 3.19Å; H628-V632 PolarHBondContact O-N 3.49Å; L630-V632 VanDerWaalsContact C-N 3.34Å; L630-V632 PolarHBondContact O-N 2.97Å; V632-K636 VanDerWaalsContact O-CB 3.24Å; V632-K636 WeakPolarHBondContact O-CB 3.42Å; V632-K636 PolarHBondContact O-N 2.73Å; V632-K636 VanDerWaalsContact O-N 3.12Å
633	E	78.7	Confident	76.1	Confident	88 Å²	88	101.5 Å²	101.5	41%	0.411	51%	0.507	S	S	.	.	H	α-helix	trans	-71.9	-28.7	174.3	-71.2	-60.2	133.5	0	0	112.6	Q629 L630 K636 A637	Q629-E633 PolarHBondContact O-N 3.27Å; L630-E633 PolarHBondContact O-N 2.81Å; E633-K636 PolarHBondContact O-N 3.06Å; E633-K636 IonicContact OE1-NZ 3.71Å; E633-K636 PolarHBondContact OE1-NZ 3.48Å; E633-K636 WeakPolarHBondContact OE2-CD 3.5Å; E633-K636 WeakPolarHBondContact OE2-CE 3.28Å; E633-K636 IonicContact OE2-NZ 3.24Å; E633-K636 PolarHBondContact OE2-NZ 3.07Å; E633-A637 VanDerWaalsContact O-CB 3.29Å; E633-A637 WeakPolarHBondContact O-CB 3.46Å; E633-A637 PolarHBondContact O-N 2.69Å
634	N	75.7	Confident	76.2	Confident	91 Å²	91	101 Å²	101	49%	0.487	51%	0.507	S	S	.	.	H	α-helix	trans	-66.5	-47.8	174.7	-170.2	24.2	0	0	0	111.2	L630 E631 K636 A637 K638	L630-N634 VanDerWaalsContact O-CB 3.25Å; L630-N634 WeakPolarHBondContact O-CB 3.48Å; L630-N634 PolarHBondContact O-N 3.45Å; E631-N634 WeakPolarHBondContact O-CB 3.5Å; E631-N634 PolarHBondContact O-N 3.18Å; E631-N634 PolarHBondContact OE2-ND2 2.99Å; N634-K636 VanDerWaalsContact C-N 3.31Å; N634-K636 PolarHBondContact O-N 3.22Å; N634-A637 PolarHBondContact O-N 2.95Å; N634-K638 WeakPolarHBondContact O-CB 3.45Å; N634-K638 PolarHBondContact O-N 3.35Å
635	L	76.4	Confident	76.6	Confident	93 Å²	93	99.3 Å²	99.3	49%	0.487	50%	0.497	S	S	.	.	H	α-helix	trans	-60.4	-40.1	173	-71.3	168.6	0	0	0	111.9	E631 K638 H639	E631-L635 HydrophobicContact CG-CD1 4.31Å; E631-L635 WeakPolarHBondContact O-CB 3.41Å; E631-L635 VanDerWaalsContact O-CG 3.3Å; E631-L635 WeakPolarHBondContact O-CG 3.31Å; E631-L635 PolarHBondContact O-N 2.94Å; L635-K638 PolarHBondContact O-N 3Å; L635-H639 WeakPolarHBondContact O-CB 3.39Å; L635-H639 PolarHBondContact O-N 2.77Å
636	K	73.5	Confident	76.2	Confident	95 Å²	95	97.3 Å²	97.3	41%	0.413	49%	0.494	S	S	.	.	H	α-helix	trans	-69.8	-33	176.4	-178.7	177	166.1	-147.8	0	112.8	V632 E633 N634 K640	V632-K636 VanDerWaalsContact O-CB 3.24Å; V632-K636 WeakPolarHBondContact O-CB 3.42Å; V632-K636 PolarHBondContact O-N 2.73Å; V632-K636 VanDerWaalsContact O-N 3.12Å; E633-K636 PolarHBondContact O-N 3.06Å; E633-K636 IonicContact OE1-NZ 3.71Å; E633-K636 PolarHBondContact OE1-NZ 3.48Å; E633-K636 WeakPolarHBondContact OE2-CD 3.5Å; E633-K636 WeakPolarHBondContact OE2-CE 3.28Å; E633-K636 IonicContact OE2-NZ 3.24Å; E633-K636 PolarHBondContact OE2-NZ 3.07Å; N634-K636 VanDerWaalsContact C-N 3.31Å; N634-K636 PolarHBondContact O-N 3.22Å; K636-K640 WeakPolarHBondContact O-CG 3.49Å; K636-K640 PolarHBondContact O-N 3.42Å
637	A	77.5	Confident	76.4	Confident	43 Å²	43	95.4 Å²	95.4	36%	0.355	49%	0.485	S	S	.	.	H	α-helix	trans	-70.9	-45	170.7	0	0	0	0	0	111.1	E633 N634 H639 K640 I641	E633-A637 VanDerWaalsContact O-CB 3.29Å; E633-A637 WeakPolarHBondContact O-CB 3.46Å; E633-A637 PolarHBondContact O-N 2.69Å; N634-A637 PolarHBondContact O-N 2.95Å; A637-H639 PolarHBondContact O-N 3.3Å; A637-K640 WeakPolarHBondContact O-CB 3.34Å; A637-K640 PolarHBondContact O-N 2.9Å; A637-K640 VanDerWaalsContact O-N 3.16Å; A637-I641 WeakPolarHBondContact O-CG1 3.42Å; A637-I641 PolarHBondContact O-N 3.41Å
638	K	76.3	Confident	77	Confident	125 Å²	125	95.3 Å²	95.3	54%	0.543	48%	0.483	S	S	.	.	H	α-helix	trans	-54.8	-48.7	173.9	-178	-176.5	175.3	-173.8	0	111.3	N634 L635 K640 I641 E642	N634-K638 WeakPolarHBondContact O-CB 3.45Å; N634-K638 PolarHBondContact O-N 3.35Å; L635-K638 PolarHBondContact O-N 3Å; K638-K640 VanDerWaalsContact C-N 3.33Å; K638-K640 PolarHBondContact O-N 3.06Å; K638-I641 PolarHBondContact O-N 2.9Å; K638-I641 VanDerWaalsContact O-N 3.13Å; K638-E642 WeakPolarHBondContact O-CB 3.18Å; K638-E642 PolarHBondContact O-N 3.38Å
639	H	71.3	Confident	77.2	Confident	127 Å²	127	93.8 Å²	93.8	59%	0.588	48%	0.476	S	S	*	.	H	α-helix	trans	-63	-36.3	178.3	-172.2	63	0	0	0	113	L635 A637 A643	L635-H639 WeakPolarHBondContact O-CB 3.39Å; L635-H639 PolarHBondContact O-N 2.77Å; A637-H639 PolarHBondContact O-N 3.3Å; H639-A643 WeakPolarHBondContact O-CB 3.44Å; H639-A643 PolarHBondContact O-N 3.17Å
640	K	76.4	Confident	77	Confident	136 Å²	136	95.2 Å²	95.2	59%	0.591	48%	0.477	S	S	*	.	H	α-helix	trans	-66	-39.7	172.1	-74.3	173.3	177.9	-179.3	0	112.6	K636 A637 K638 A644	K636-K640 WeakPolarHBondContact O-CG 3.49Å; K636-K640 PolarHBondContact O-N 3.42Å; A637-K640 WeakPolarHBondContact O-CB 3.34Å; A637-K640 PolarHBondContact O-N 2.9Å; A637-K640 VanDerWaalsContact O-N 3.16Å; K638-K640 VanDerWaalsContact C-N 3.33Å; K638-K640 PolarHBondContact O-N 3.06Å; K640-A644 WeakPolarHBondContact O-CB 3.36Å; K640-A644 PolarHBondContact O-N 3.5Å
641	I	80.8	Confident	77	Confident	104 Å²	104	93.5 Å²	93.5	53%	0.533	47%	0.465	S	S	.	.	H	α-helix	trans	-66.7	-43.8	176.7	-68.8	163	0	0	0	110	A637 K638 A644 I645	A637-I641 WeakPolarHBondContact O-CG1 3.42Å; A637-I641 PolarHBondContact O-N 3.41Å; K638-I641 PolarHBondContact O-N 2.9Å; K638-I641 VanDerWaalsContact O-N 3.13Å; I641-A644 CarbonylContact O-C 3.54Å; I641-A644 PolarHBondContact O-N 2.89Å; I641-I645 HydrophobicContact CG2-CD1 3.83Å; I641-I645 HydrophobicContact CG2-CG1 4.43Å; I641-I645 VanDerWaalsContact O-CG1 3.29Å; I641-I645 WeakPolarHBondContact O-CG1 3.44Å; I641-I645 PolarHBondContact O-N 2.97Å
642	E	75.4	Confident	77.1	Confident	100 Å²	100	91.9 Å²	91.9	47%	0.467	46%	0.459	S	S	.	.	H	α-helix	trans	-62	-44.8	177	-169.7	165.3	-130.4	0	0	111.8	K638 A644 I645 L646	K638-E642 WeakPolarHBondContact O-CB 3.18Å; K638-E642 PolarHBondContact O-N 3.38Å; E642-A644 VanDerWaalsContact C-N 3.35Å; E642-A644 PolarHBondContact O-N 3.08Å; E642-I645 PolarHBondContact O-N 3.38Å; E642-L646 WeakPolarHBondContact O-CG 3.49Å; E642-L646 PolarHBondContact O-N 3.26Å
643	A	70.4	Confident	77.4	Confident	40 Å²	40	93.9 Å²	93.9	33%	0.331	47%	0.467	S	S	.	.	H	α-helix	trans	-62.1	-38.9	171.8	0	0	0	0	0	112.9	H639 L646 I647	H639-A643 WeakPolarHBondContact O-CB 3.44Å; H639-A643 PolarHBondContact O-N 3.17Å; A643-L646 PolarHBondContact O-N 2.96Å; A643-I647 WeakPolarHBondContact O-CB 3.36Å; A643-I647 WeakPolarHBondContact O-CD1 3.39Å; A643-I647 VanDerWaalsContact O-CG1 3.28Å; A643-I647 WeakPolarHBondContact O-CG1 3.34Å; A643-I647 PolarHBondContact O-N 3.05Å
644	A	78.3	Confident	77.3	Confident	55 Å²	55	93.2 Å²	93.2	46%	0.455	47%	0.472	S	S	.	.	H	α-helix	trans	-69.4	-34.4	175.8	0	0	0	0	0	112.7	K640 I641 E642 K648	K640-A644 WeakPolarHBondContact O-CB 3.36Å; K640-A644 PolarHBondContact O-N 3.5Å; I641-A644 CarbonylContact O-C 3.54Å; I641-A644 PolarHBondContact O-N 2.89Å; E642-A644 VanDerWaalsContact C-N 3.35Å; E642-A644 PolarHBondContact O-N 3.08Å; A644-K648 WeakPolarHBondContact O-CB 3.33Å; A644-K648 PolarHBondContact O-N 2.72Å
645	I	83.8	Confident	77.5	Confident	78 Å²	78	93 Å²	93	40%	0.4	47%	0.47	S	S	.	.	H	α-helix	trans	-63.7	-50.4	172.2	-72.2	164.9	0	0	0	109.6	I641 E642 I647 K648 E649	I641-I645 HydrophobicContact CG2-CD1 3.83Å; I641-I645 HydrophobicContact CG2-CG1 4.43Å; I641-I645 VanDerWaalsContact O-CG1 3.29Å; I641-I645 WeakPolarHBondContact O-CG1 3.44Å; I641-I645 PolarHBondContact O-N 2.97Å; E642-I645 PolarHBondContact O-N 3.38Å; I645-I647 VanDerWaalsContact C-N 3.3Å; I645-I647 PolarHBondContact O-N 3.32Å; I645-K648 CarbonylContact O-C 3.08Å; I645-K648 PolarHBondContact O-N 3.43Å; I645-E649 HydrophobicContact CG2-CG 4.1Å; I645-E649 WeakPolarHBondContact O-CB 3.38Å; I645-E649 WeakPolarHBondContact O-CG 3.46Å; I645-E649 PolarHBondContact O-N 3.37Å
646	L	72.2	Confident	77.6	Confident	108 Å²	108	96.2 Å²	96.2	57%	0.565	48%	0.476	S	S	*	.	H	α-helix	trans	-61	-37.1	178.5	-69	168.9	0	0	0	112.9	E642 A643 R650	E642-L646 WeakPolarHBondContact O-CG 3.49Å; E642-L646 PolarHBondContact O-N 3.26Å; A643-L646 PolarHBondContact O-N 2.96Å; L646-R650 WeakPolarHBondContact O-CB 3.13Å; L646-R650 PolarHBondContact O-N 3.27Å; L646-R650 VanDerWaalsContact O-N 3.09Å
647	I	82.6	Confident	77.4	Confident	82 Å²	82	97.8 Å²	97.8	42%	0.421	49%	0.488	S	S	.	.	H	α-helix	trans	-61.9	-46.5	172.1	-77	167	0	0	0	110.9	A643 I645 R650 E651	A643-I647 WeakPolarHBondContact O-CB 3.36Å; A643-I647 WeakPolarHBondContact O-CD1 3.39Å; A643-I647 VanDerWaalsContact O-CG1 3.28Å; A643-I647 WeakPolarHBondContact O-CG1 3.34Å; A643-I647 PolarHBondContact O-N 3.05Å; I645-I647 VanDerWaalsContact C-N 3.3Å; I645-I647 PolarHBondContact O-N 3.32Å; I647-R650 WeakPolarHBondContact O-CB 3.39Å; I647-E651 WeakPolarHBondContact CG2-OE1 3.38Å; I647-E651 WeakPolarHBondContact O-CG 3.42Å; I647-E651 PolarHBondContact O-N 3.34Å; I647-E651 VanDerWaalsContact O-N 3.12Å
648	K	84.1	Confident	77.2	Confident	124 Å²	124	99.8 Å²	99.8	54%	0.539	49%	0.49	S	S	.	.	H	α-helix	trans	-69.2	-40.5	179	-168.8	-169.9	172.2	-161	0	112.2	A644 I645 R650 E651 D652	A644-K648 WeakPolarHBondContact O-CB 3.33Å; A644-K648 PolarHBondContact O-N 2.72Å; I645-K648 CarbonylContact O-C 3.08Å; I645-K648 PolarHBondContact O-N 3.43Å; K648-R650 VanDerWaalsContact C-N 3.31Å; K648-R650 PolarHBondContact O-N 3.11Å; K648-E651 CarbonylContact O-C 3.45Å; K648-E651 WeakPolarHBondContact O-CA 3.49Å; K648-E651 PolarHBondContact O-N 3.15Å; K648-D652 VanDerWaalsContact CE-OD2 3.31Å; K648-D652 WeakPolarHBondContact CE-OD2 3.4Å; K648-D652 IonicContact NZ-OD2 3.35Å; K648-D652 WeakPolarHBondContact O-CB 3.48Å; K648-D652 PolarHBondContact O-N 3.49Å
649	E	79.3	Confident	77.2	Confident	100 Å²	100	98.9 Å²	98.9	47%	0.467	49%	0.488	S	S	.	.	H	α-helix	trans	-62.8	-39.1	177.6	-74.8	177.5	162.8	0	0	111.3	I645 E651 L653	I645-E649 HydrophobicContact CG2-CG 4.1Å; I645-E649 WeakPolarHBondContact O-CB 3.38Å; I645-E649 WeakPolarHBondContact O-CG 3.46Å; I645-E649 PolarHBondContact O-N 3.37Å; E649-E651 VanDerWaalsContact C-N 3.34Å; E649-L653 VanDerWaalsContact O-CB 3.28Å; E649-L653 WeakPolarHBondContact O-CB 3.29Å; E649-L653 WeakPolarHBondContact O-CG 3.37Å; E649-L653 PolarHBondContact O-N 3.25Å
650	R	73.5	Confident	77.2	Confident	137 Å²	137	95.3 Å²	95.3	52%	0.517	48%	0.481	S	S	.	.	H	α-helix	trans	-59.9	-43.1	169.3	177.1	-158.8	67.8	-164	1.7	111.9	L646 I647 K648 L653 C654	L646-R650 WeakPolarHBondContact O-CB 3.13Å; L646-R650 PolarHBondContact O-N 3.27Å; L646-R650 VanDerWaalsContact O-N 3.09Å; I647-R650 WeakPolarHBondContact O-CB 3.39Å; K648-R650 VanDerWaalsContact C-N 3.31Å; K648-R650 PolarHBondContact O-N 3.11Å; R650-L653 PolarHBondContact O-N 2.94Å; R650-C654 PolarHBondContact O-N 2.93Å; R650-C654 PolarHBondContact O-SG 3.44Å; R650-C654 VanDerWaalsContact O-SG 3.35Å
651	E	81.7	Confident	76.8	Confident	88 Å²	88	93.5 Å²	93.5	41%	0.411	47%	0.47	S	S	.	.	H	α-helix	trans	-69.9	-42.5	178.9	-76.7	159.6	-157.9	0	0	112.2	I647 K648 E649 L653 C654 N655	I647-E651 WeakPolarHBondContact CG2-OE1 3.38Å; I647-E651 WeakPolarHBondContact O-CG 3.42Å; I647-E651 PolarHBondContact O-N 3.34Å; I647-E651 VanDerWaalsContact O-N 3.12Å; K648-E651 CarbonylContact O-C 3.45Å; K648-E651 WeakPolarHBondContact O-CA 3.49Å; K648-E651 PolarHBondContact O-N 3.15Å; E649-E651 VanDerWaalsContact C-N 3.34Å; E651-L653 VanDerWaalsContact C-N 3.29Å; E651-L653 PolarHBondContact O-N 3.3Å; E651-C654 WeakPolarHBondContact O-CB 3.41Å; E651-C654 PolarHBondContact O-N 3.05Å; E651-N655 WeakPolarHBondContact O-CB 3.36Å; E651-N655 PolarHBondContact O-N 3.5Å; E651-N655 PolarHBondContact O-ND2 2.95Å
652	D	81.1	Confident	76.4	Confident	54 Å²	54	91.9 Å²	91.9	29%	0.289	46%	0.462	S	S	.	.	H	α-helix	trans	-64.1	-32	172.9	-73.6	-18	0	0	0	111.4	K648 R656	K648-D652 VanDerWaalsContact CE-OD2 3.31Å; K648-D652 WeakPolarHBondContact CE-OD2 3.4Å; K648-D652 IonicContact NZ-OD2 3.35Å; K648-D652 WeakPolarHBondContact O-CB 3.48Å; K648-D652 PolarHBondContact O-N 3.49Å; D652-R656 WeakPolarHBondContact O-CB 3.37Å; D652-R656 WeakPolarHBondContact O-CG 3.47Å; D652-R656 PolarHBondContact O-N 3Å
653	L	77	Confident	76.2	Confident	104 Å²	104	92.9 Å²	92.9	55%	0.545	47%	0.467	S	S	.	.	H	α-helix	trans	-71.2	-41.4	171.1	-77.2	168.3	0	0	0	112.6	E649 R650 E651 N655 R656 L657	E649-L653 VanDerWaalsContact O-CB 3.28Å; E649-L653 WeakPolarHBondContact O-CB 3.29Å; E649-L653 WeakPolarHBondContact O-CG 3.37Å; E649-L653 PolarHBondContact O-N 3.25Å; R650-L653 PolarHBondContact O-N 2.94Å; E651-L653 VanDerWaalsContact C-N 3.29Å; E651-L653 PolarHBondContact O-N 3.3Å; L653-N655 VanDerWaalsContact C-N 3.34Å; L653-R656 PolarHBondContact O-N 3.4Å; L653-L657 WeakPolarHBondContact O-CB 3.4Å; L653-L657 WeakPolarHBondContact O-CG 3.4Å; L653-L657 PolarHBondContact O-N 3.03Å
654	C	75.9	Confident	75.8	Confident	74 Å²	74	95.3 Å²	95.3	50%	0.5	47%	0.474	S	S	.	.	H	α-helix	trans	-61.8	-42.5	171.4	-73.5	0	0	0	0	111.5	R650 E651 L657 Q658	R650-C654 PolarHBondContact O-N 2.93Å; R650-C654 PolarHBondContact O-SG 3.44Å; R650-C654 VanDerWaalsContact O-SG 3.35Å; E651-C654 WeakPolarHBondContact O-CB 3.41Å; E651-C654 PolarHBondContact O-N 3.05Å; C654-L657 PolarHBondContact O-N 2.95Å; C654-Q658 PolarHBondContact O-N 3.03Å
655	N	79.9	Confident	74.9	Confident	86 Å²	86	95.7 Å²	95.7	46%	0.46	47%	0.468	S	S	.	.	H	α-helix	trans	-62.9	-45.8	176.2	-67.1	-25.6	0	0	0	110.9	E651 L653 L657 Q658 E659	E651-N655 WeakPolarHBondContact O-CB 3.36Å; E651-N655 PolarHBondContact O-N 3.5Å; E651-N655 PolarHBondContact O-ND2 2.95Å; L653-N655 VanDerWaalsContact C-N 3.34Å; N655-L657 VanDerWaalsContact C-N 3.33Å; N655-L657 PolarHBondContact O-N 3.12Å; N655-Q658 CarbonylContact O-C 3.6Å; N655-Q658 PolarHBondContact O-N 3.29Å; N655-Q658 VanDerWaalsContact O-N 3.13Å; N655-E659 WeakPolarHBondContact O-CB 3.23Å; N655-E659 WeakPolarHBondContact O-CG 3.4Å; N655-E659 PolarHBondContact O-N 3.13Å
656	R	79.2	Confident	73.7	Confident	161 Å²	161	98 Å²	98	61%	0.608	48%	0.478	S	S	*	.	H	α-helix	trans	-64.7	-32.9	175	-73.6	173.1	-163.4	-179.5	9.3	113.6	D652 L653 Q658 A660	D652-R656 WeakPolarHBondContact O-CB 3.37Å; D652-R656 WeakPolarHBondContact O-CG 3.47Å; D652-R656 PolarHBondContact O-N 3Å; L653-R656 PolarHBondContact O-N 3.4Å; R656-Q658 VanDerWaalsContact C-N 3.35Å; R656-A660 WeakPolarHBondContact O-CB 3.47Å; R656-A660 PolarHBondContact O-N 2.92Å
657	L	68.7	Low	72.8	Confident	128 Å²	128	94.3 Å²	94.3	67%	0.67	47%	0.465	S	S	*	.	H	α-helix	trans	-68.5	-35.5	172.4	-79.8	168.1	0	0	0	111.8	L653 C654 N655 R661	L653-L657 WeakPolarHBondContact O-CB 3.4Å; L653-L657 WeakPolarHBondContact O-CG 3.4Å; L653-L657 PolarHBondContact O-N 3.03Å; C654-L657 PolarHBondContact O-N 2.95Å; N655-L657 VanDerWaalsContact C-N 3.33Å; N655-L657 PolarHBondContact O-N 3.12Å; L657-R661 WeakPolarHBondContact O-CB 3.44Å; L657-R661 PolarHBondContact O-N 3.39Å
658	Q	74.2	Confident	71.2	Confident	84 Å²	84	95.5 Å²	95.5	39%	0.393	46%	0.464	S	S	.	.	H	α-helix	trans	-71.7	-46.6	173.7	-175.6	55.7	42.8	0	0	111.3	C654 N655 R656 A660 R661 D662	C654-Q658 PolarHBondContact O-N 3.03Å; N655-Q658 CarbonylContact O-C 3.6Å; N655-Q658 PolarHBondContact O-N 3.29Å; N655-Q658 VanDerWaalsContact O-N 3.13Å; R656-Q658 VanDerWaalsContact C-N 3.35Å; Q658-A660 VanDerWaalsContact C-N 3.29Å; Q658-A660 PolarHBondContact O-N 2.83Å; Q658-R661 CarbonylContact O-C 3.41Å; Q658-R661 WeakPolarHBondContact O-CA 3.31Å; Q658-R661 WeakPolarHBondContact O-CB 3.39Å; Q658-R661 PolarHBondContact O-N 3.16Å; Q658-D662 PolarHBondContact NE2-OD1 2.91Å; Q658-D662 PolarHBondContact NE2-OD2 3.42Å; Q658-D662 VanDerWaalsContact O-CG 3.29Å; Q658-D662 PolarHBondContact O-N 3.28Å
659	E	75.9	Confident	69.6	Low	107 Å²	107	93.1 Å²	93.1	50%	0.5	46%	0.463	S	S	.	.	H	α-helix	trans	-57	-40.6	172.3	-71.8	170.9	175.3	0	0	111.8	N655 D662 Q663	N655-E659 WeakPolarHBondContact O-CB 3.23Å; N655-E659 WeakPolarHBondContact O-CG 3.4Å; N655-E659 PolarHBondContact O-N 3.13Å; E659-D662 PolarHBondContact O-N 3.43Å; E659-Q663 VanDerWaalsContact O-CB 3.32Å; E659-Q663 WeakPolarHBondContact O-CB 3.18Å; E659-Q663 WeakPolarHBondContact O-CG 3.3Å; E659-Q663 PolarHBondContact O-N 2.8Å
660	A	70.7	Confident	68.1	Low	52 Å²	52	94.2 Å²	94.2	43%	0.43	47%	0.472	S	S	.	.	H	α-helix	trans	-69.5	-32.3	174.8	0	0	0	0	0	112.8	R656 Q658 L664	R656-A660 WeakPolarHBondContact O-CB 3.47Å; R656-A660 PolarHBondContact O-N 2.92Å; Q658-A660 VanDerWaalsContact C-N 3.29Å; Q658-A660 PolarHBondContact O-N 2.83Å; A660-L664 VanDerWaalsContact O-CB 3.26Å; A660-L664 WeakPolarHBondContact O-CB 3.34Å; A660-L664 PolarHBondContact O-N 2.89Å
661	R	67.4	Low	66.7	Low	98 Å²	98	91.9 Å²	91.9	37%	0.37	47%	0.468	S	S	.	.	H	α-helix	trans	-68.4	-39.6	172	-173.7	-176.6	-170.7	-178.9	3.6	111.3	L657 Q658 L664 N665 E691	L657-R661 WeakPolarHBondContact O-CB 3.44Å; L657-R661 PolarHBondContact O-N 3.39Å; Q658-R661 CarbonylContact O-C 3.41Å; Q658-R661 WeakPolarHBondContact O-CA 3.31Å; Q658-R661 WeakPolarHBondContact O-CB 3.39Å; Q658-R661 PolarHBondContact O-N 3.16Å; R661-L664 WeakPolarHBondContact O-CB 3.37Å; R661-L664 PolarHBondContact O-N 3.45Å; R661-N665 PolarHBondContact O-N 3.03Å; R661-N665 PolarHBondContact O-ND2 3.12Å; R661-E691 IonicContact CZ-OE1 2.69Å; R661-E691 IonicContact NE-OE1 2.69Å; R661-E691 IonicContact NH2-OE1 3.22Å; R661-E691 PolarHBondContact NH2-OE1 3.28Å
662	D	72.8	Confident	65	Low	69 Å²	69	95.3 Å²	95.3	37%	0.369	48%	0.484	S	S	.	.	H	α-helix	trans	-74.7	-39.8	-179.4	-64.4	-29	0	0	0	111	Q658 E659 L664 N665 E666	Q658-D662 PolarHBondContact NE2-OD1 2.91Å; Q658-D662 PolarHBondContact NE2-OD2 3.42Å; Q658-D662 VanDerWaalsContact O-CG 3.29Å; Q658-D662 PolarHBondContact O-N 3.28Å; E659-D662 PolarHBondContact O-N 3.43Å; D662-L664 VanDerWaalsContact C-N 3.3Å; D662-L664 PolarHBondContact O-N 3.36Å; D662-N665 CarbonylContact O-C 3.58Å; D662-N665 WeakPolarHBondContact O-CA 3.46Å; D662-N665 WeakPolarHBondContact O-CB 3.45Å; D662-N665 PolarHBondContact O-N 2.88Å; D662-E666 PolarHBondContact O-N 3.24Å
663	Q	72.6	Confident	63.7	Low	122 Å²	122	96.8 Å²	96.8	57%	0.57	50%	0.504	S	S	*	.	H	α-helix	trans	-63.1	-32.9	168.2	-72.4	166.8	37.3	0	0	112.7	E659 N665 G667	E659-Q663 VanDerWaalsContact O-CB 3.32Å; E659-Q663 WeakPolarHBondContact O-CB 3.18Å; E659-Q663 WeakPolarHBondContact O-CG 3.3Å; E659-Q663 PolarHBondContact O-N 2.8Å; Q663-N665 VanDerWaalsContact C-N 3.3Å; Q663-G667 PolarHBondContact O-N 2.94Å
664	L	61.5	Low	62.6	Low	90 Å²	90	99.7 Å²	99.7	47%	0.471	52%	0.515	S	S	.	.	H	α-helix	trans	-68.6	-30.1	171.9	-168.1	75.7	0	0	0	111.7	A660 R661 D662 R668 L687	A660-L664 VanDerWaalsContact O-CB 3.26Å; A660-L664 WeakPolarHBondContact O-CB 3.34Å; A660-L664 PolarHBondContact O-N 2.89Å; R661-L664 WeakPolarHBondContact O-CB 3.37Å; R661-L664 PolarHBondContact O-N 3.45Å; D662-L664 VanDerWaalsContact C-N 3.3Å; D662-L664 PolarHBondContact O-N 3.36Å; L664-R668 WeakPolarHBondContact O-CB 3.32Å; L664-R668 PolarHBondContact O-N 3.22Å; L664-L687 HydrophobicContact CD2-CD1 4.23Å; L664-L687 HydrophobicContact CD2-CD2 4.35Å
665	N	59.5	Low	61	Low	63 Å²	63	100.6 Å²	100.6	34%	0.337	52%	0.522	S	S	.	.	H	α-helix	trans	-76.7	-41.9	173.7	-74.1	-38.9	0	0	0	112.2	R661 D662 Q663 R668 S669	R661-N665 PolarHBondContact O-N 3.03Å; R661-N665 PolarHBondContact O-ND2 3.12Å; D662-N665 CarbonylContact O-C 3.58Å; D662-N665 WeakPolarHBondContact O-CA 3.46Å; D662-N665 WeakPolarHBondContact O-CB 3.45Å; D662-N665 PolarHBondContact O-N 2.88Å; Q663-N665 VanDerWaalsContact C-N 3.3Å; N665-R668 WeakPolarHBondContact O-CB 3.33Å; N665-R668 PolarHBondContact O-N 2.85Å; N665-R668 VanDerWaalsContact O-N 3.13Å; N665-S669 PolarHBondContact O-N 2.79Å
666	E	58.4	Low	60	Low	128 Å²	128	100 Å²	100	60%	0.598	52%	0.522	S	S	*	.	H	α-helix	trans	-65.3	-44.7	174.3	-69.6	-179.7	145.5	0	0	111.1	D662 R668 S669 D670	D662-E666 PolarHBondContact O-N 3.24Å; E666-R668 PolarHBondContact O-N 2.8Å; E666-R668 VanDerWaalsContact O-N 3.15Å; E666-S669 PolarHBondContact O-N 2.6Å; E666-S669 PolarHBondContact O-OG 2.76Å; E666-D670 PolarHBondContact O-N 2.67Å; E666-D670 VanDerWaalsContact O-N 3.15Å
667	G	53.2	Low	59	Low	29 Å²	29	101.7 Å²	101.7	30%	0.299	53%	0.534	S	S	.	.	H	α-helix	trans	-62.5	-18.4	171.8	0	0	0	0	0	113.7	Q663 M671	Q663-G667 PolarHBondContact O-N 2.94Å; G667-M671 WeakPolarHBondContact O-CB 3.48Å; G667-M671 WeakPolarHBondContact O-CG 3.29Å; G667-M671 PolarHBondContact O-N 3.12Å
668	R	48.1	Very low	58.4	Low	107 Å²	107	99.1 Å²	99.1	40%	0.404	53%	0.531	S	S	.	.	H	α-helix	trans	-76.1	-30.6	173.5	-160.1	-179.9	-172.4	-166.9	0.2	112.5	L664 N665 E666 L680 S684	L664-R668 WeakPolarHBondContact O-CB 3.32Å; L664-R668 PolarHBondContact O-N 3.22Å; N665-R668 WeakPolarHBondContact O-CB 3.33Å; N665-R668 PolarHBondContact O-N 2.85Å; N665-R668 VanDerWaalsContact O-N 3.13Å; E666-R668 PolarHBondContact O-N 2.8Å; E666-R668 VanDerWaalsContact O-N 3.15Å; R668-L680 HydrophobicContact CG-CD1 4.3Å; R668-S684 PolarHBondContact NE-OG 3.48Å; R668-S684 PolarHBondContact NH2-OG 3Å
669	S	51.1	Low	57.7	Low	75 Å²	75	97.3 Å²	97.3	52%	0.524	53%	0.53	S	S	.	.	H	α-helix	trans	-74	-44.1	169.1	22.4	0	0	0	0	111.8	N665 E666 E672	N665-S669 PolarHBondContact O-N 2.79Å; E666-S669 PolarHBondContact O-N 2.6Å; E666-S669 PolarHBondContact O-OG 2.76Å; S669-E672 PolarHBondContact O-N 3.27Å
670	D	47.3	Very low	57	Low	123 Å²	123	93.9 Å²	93.9	66%	0.658	52%	0.515	S	S	*	.	H	α-helix	trans	-71.3	-36.4	-175.5	-71.5	-3.5	0	0	0	112.6	E666 E672 A673	E666-D670 PolarHBondContact O-N 2.67Å; E666-D670 VanDerWaalsContact O-N 3.15Å; D670-E672 VanDerWaalsContact C-N 3.25Å; D670-E672 PolarHBondContact O-N 2.72Å; D670-A673 WeakPolarHBondContact O-CB 3.5Å; D670-A673 PolarHBondContact O-N 2.94Å; D670-A673 VanDerWaalsContact O-N 3.12Å
671	M	44.6	Very low	56.9	Low	87 Å²	87	94.9 Å²	94.9	43%	0.429	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-3.6	178.4	-71.5	-75.8	-69.7	0	0	114.6	G667 S675 L680	G667-M671 WeakPolarHBondContact O-CB 3.48Å; G667-M671 WeakPolarHBondContact O-CG 3.29Å; G667-M671 PolarHBondContact O-N 3.12Å; M671-S675 WeakPolarHBondContact CE-O 3.44Å; M671-L680 HydrophobicContact CB-CD1 3.89Å
672	E	46.6	Very low	57	Low	160 Å²	160	95 Å²	95	75%	0.748	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-16.2	164.7	-75.3	-160.1	137.7	0	0	112.4	S669 D670 L680	S669-E672 PolarHBondContact O-N 3.27Å; D670-E672 VanDerWaalsContact C-N 3.25Å; D670-E672 PolarHBondContact O-N 2.72Å; E672-L680 HydrophobicContact CG-CD2 3.9Å
673	A	53.3	Low	56.7	Low	86 Å²	86	93.9 Å²	93.9	71%	0.711	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-41	179.7	0	0	0	0	0	114.3	D670	D670-A673 WeakPolarHBondContact O-CB 3.5Å; D670-A673 PolarHBondContact O-N 2.94Å; D670-A673 VanDerWaalsContact O-N 3.12Å
674	Q	53.4	Low	56.6	Low	164 Å²	164	89 Å²	89	77%	0.766	50%	0.504	S	S	*	.	S	Bend	trans	-146.6	96.5	-171.4	-67.8	-172.1	-2.8	0	0	115
675	S	42.9	Very low	57.5	Low	94 Å²	94	89.2 Å²	89.2	66%	0.657	50%	0.502	S	S	*	.	S	Bend	trans	65.3	125.8	155.9	-152.9	0	0	0	0	118	M671	M671-S675 WeakPolarHBondContact CE-O 3.44Å
676	T	58	Low	58.3	Low	74 Å²	74	91.7 Å²	91.7	45%	0.454	51%	0.51	S	S	.	.			cis	-126.7	151.1	-0.7	60.7	0	0	0	0	110.2	A678 A679 L680	T676-A678 PolarHBondContact O-N 3.38Å; T676-A678 VanDerWaalsContact O-N 3.14Å; T676-A679 PolarHBondContact O-N 3.34Å; T676-A679 PolarHBondContact OG1-N 3.03Å; T676-L680 PolarHBondContact O-N 3.39Å
677	K	58.1	Low	59.1	Low	196 Å²	196	86.7 Å²	86.7	85%	0.852	49%	0.487	S	S	*	.	H	α-helix	trans	-59	-28.1	179.8	-169.4	171.5	-177.7	174.6	0	113.6	S681	K677-S681 WeakPolarHBondContact O-CB 3.46Å; K677-S681 PolarHBondContact O-N 3.48Å
678	A	56.3	Low	60.5	Low	73 Å²	73	91.3 Å²	91.3	60%	0.603	50%	0.501	S	S	*	.	H	α-helix	trans	-69.6	-52.3	176.9	0	0	0	0	0	112	T676 L680 S681 E682	T676-A678 PolarHBondContact O-N 3.38Å; T676-A678 VanDerWaalsContact O-N 3.14Å; A678-L680 PolarHBondContact O-N 2.95Å; A678-S681 PolarHBondContact O-N 3.44Å; A678-E682 WeakPolarHBondContact O-CB 3.24Å; A678-E682 PolarHBondContact O-N 2.95Å
679	A	60.2	Low	62.1	Low	46 Å²	46	92.9 Å²	92.9	38%	0.38	51%	0.507	S	S	.	.	H	α-helix	trans	-63.3	-42.6	-177.6	0	0	0	0	0	112.4	T676 S681 E682 A683	T676-A679 PolarHBondContact O-N 3.34Å; T676-A679 PolarHBondContact OG1-N 3.03Å; A679-S681 VanDerWaalsContact C-N 3.33Å; A679-S681 PolarHBondContact O-N 3.47Å; A679-E682 PolarHBondContact O-N 3.12Å; A679-A683 VanDerWaalsContact O-CB 3.29Å; A679-A683 WeakPolarHBondContact O-CB 3.3Å; A679-A683 PolarHBondContact O-N 2.9Å
680	L	61	Low	62.7	Low	36 Å²	36	91.6 Å²	91.6	19%	0.188	50%	0.501	C	S	.	.	H	α-helix	trans	-65.9	-36.1	176.9	-169.4	69.7	0	0	0	112.3	R668 M671 E672 T676 A678 S684	R668-L680 HydrophobicContact CG-CD1 4.3Å; M671-L680 HydrophobicContact CB-CD1 3.89Å; E672-L680 HydrophobicContact CG-CD2 3.9Å; T676-L680 PolarHBondContact O-N 3.39Å; A678-L680 PolarHBondContact O-N 2.95Å; L680-S684 VanDerWaalsContact O-CB 3.26Å; L680-S684 WeakPolarHBondContact O-CB 3.34Å; L680-S684 PolarHBondContact O-N 2.92Å; L680-S684 PolarHBondContact O-OG 3.28Å
681	S	68.8	Low	64	Low	73 Å²	73	89.2 Å²	89.2	51%	0.51	49%	0.486	S	S	.	.	H	α-helix	trans	-67.9	-45.7	174.8	-176.7	0	0	0	0	111.3	K677 A678 A679 S684 Q685	K677-S681 WeakPolarHBondContact O-CB 3.46Å; K677-S681 PolarHBondContact O-N 3.48Å; A678-S681 PolarHBondContact O-N 3.44Å; A679-S681 VanDerWaalsContact C-N 3.33Å; A679-S681 PolarHBondContact O-N 3.47Å; S681-S684 PolarHBondContact O-N 3.08Å; S681-Q685 VanDerWaalsContact O-CB 3.27Å; S681-Q685 WeakPolarHBondContact O-CB 3.42Å; S681-Q685 PolarHBondContact O-N 3.39Å
682	E	69.8	Low	65.8	Low	99 Å²	99	88 Å²	88	46%	0.463	49%	0.49	S	S	.	.	H	α-helix	trans	-65.1	-42.4	178.2	-162	-167.5	161.8	0	0	111.7	A678 A679 Q685 K686	A678-E682 WeakPolarHBondContact O-CB 3.24Å; A678-E682 PolarHBondContact O-N 2.95Å; A679-E682 PolarHBondContact O-N 3.12Å; E682-Q685 PolarHBondContact O-N 2.89Å; E682-K686 HydrophobicContact CG-CD 4.44Å; E682-K686 WeakPolarHBondContact O-CB 3.49Å; E682-K686 VanDerWaalsContact O-CG 3.31Å; E682-K686 WeakPolarHBondContact O-CG 3.37Å; E682-K686 PolarHBondContact O-N 3.08Å; E682-K686 WeakPolarHBondContact OE1-CE 3.4Å; E682-K686 IonicContact OE1-NZ 3.46Å; E682-K686 PolarHBondContact OE1-NZ 2.92Å
683	A	66.3	Low	67.3	Low	46 Å²	46	88.8 Å²	88.8	38%	0.38	49%	0.486	S	S	.	.	H	α-helix	trans	-62.2	-47.1	174.1	0	0	0	0	0	111.8	A679 Q685 K686 L687	A679-A683 VanDerWaalsContact O-CB 3.29Å; A679-A683 WeakPolarHBondContact O-CB 3.3Å; A679-A683 PolarHBondContact O-N 2.9Å; A683-Q685 VanDerWaalsContact C-N 3.3Å; A683-Q685 PolarHBondContact O-N 3.01Å; A683-K686 PolarHBondContact O-N 3.46Å; A683-L687 WeakPolarHBondContact O-CB 3.5Å; A683-L687 PolarHBondContact O-N 2.93Å
684	S	69.8	Low	68.2	Low	21 Å²	21	89.9 Å²	89.9	15%	0.147	48%	0.479	C	S	.	.	H	α-helix	trans	-60.2	-39.2	174.8	-66.6	0	0	0	0	112.2	R668 L680 S681 L687 Q688	R668-S684 PolarHBondContact NE-OG 3.48Å; R668-S684 PolarHBondContact NH2-OG 3Å; L680-S684 VanDerWaalsContact O-CB 3.26Å; L680-S684 WeakPolarHBondContact O-CB 3.34Å; L680-S684 PolarHBondContact O-N 2.92Å; L680-S684 PolarHBondContact O-OG 3.28Å; S681-S684 PolarHBondContact O-N 3.08Å; S684-L687 PolarHBondContact O-N 3.38Å; S684-Q688 WeakPolarHBondContact O-CG 3.44Å; S684-Q688 PolarHBondContact O-N 3.27Å
685	Q	81.4	Confident	69.5	Low	94 Å²	94	84.6 Å²	84.6	44%	0.439	46%	0.463	S	S	.	.	H	α-helix	trans	-75.8	-26.2	178.9	-154.4	-164.3	45.8	0	0	112.2	S681 E682 A683 R689	S681-Q685 VanDerWaalsContact O-CB 3.27Å; S681-Q685 WeakPolarHBondContact O-CB 3.42Å; S681-Q685 PolarHBondContact O-N 3.39Å; E682-Q685 PolarHBondContact O-N 2.89Å; A683-Q685 VanDerWaalsContact C-N 3.3Å; A683-Q685 PolarHBondContact O-N 3.01Å; Q685-R689 VanDerWaalsContact C-NH1 3.34Å; Q685-R689 VanDerWaalsContact CD-NH1 3.32Å; Q685-R689 VanDerWaalsContact CD-NH2 3.29Å; Q685-R689 VanDerWaalsContact CG-NH1 3.29Å; Q685-R689 VanDerWaalsContact O-CG 3.23Å; Q685-R689 WeakPolarHBondContact O-CG 3.46Å; Q685-R689 PolarHBondContact O-N 3.2Å; Q685-R689 PolarHBondContact O-NH1 3.04Å; Q685-R689 VanDerWaalsContact OE1-CZ 3.23Å
686	K	76.3	Confident	71.5	Confident	115 Å²	115	85.9 Å²	85.9	50%	0.5	46%	0.459	S	S	.	.	H	α-helix	trans	-71.9	-42.5	168.9	-76.7	170	-177.9	169	0	110.8	E682 A683 R689 A690	E682-K686 HydrophobicContact CG-CD 4.44Å; E682-K686 WeakPolarHBondContact O-CB 3.49Å; E682-K686 VanDerWaalsContact O-CG 3.31Å; E682-K686 WeakPolarHBondContact O-CG 3.37Å; E682-K686 PolarHBondContact O-N 3.08Å; E682-K686 WeakPolarHBondContact OE1-CE 3.4Å; E682-K686 IonicContact OE1-NZ 3.46Å; E682-K686 PolarHBondContact OE1-NZ 2.92Å; A683-K686 PolarHBondContact O-N 3.46Å; K686-R689 PolarHBondContact O-N 3.01Å; K686-A690 PolarHBondContact O-N 3.34Å
687	L	74.9	Confident	71.8	Confident	22 Å²	22	87.9 Å²	87.9	12%	0.115	47%	0.465	C	S	.	.	H	α-helix	trans	-60.9	-50	174.3	-178.4	60.8	0	0	0	111.4	L664 A683 S684 R689 A690 E691	L664-L687 HydrophobicContact CD2-CD1 4.23Å; L664-L687 HydrophobicContact CD2-CD2 4.35Å; A683-L687 WeakPolarHBondContact O-CB 3.5Å; A683-L687 PolarHBondContact O-N 2.93Å; S684-L687 PolarHBondContact O-N 3.38Å; L687-R689 VanDerWaalsContact C-N 3.31Å; L687-R689 PolarHBondContact O-N 3.16Å; L687-A690 WeakPolarHBondContact O-CA 3.22Å; L687-A690 WeakPolarHBondContact O-CB 3.4Å; L687-A690 PolarHBondContact O-N 3.43Å; L687-E691 HydrophobicContact CD1-CG 4.15Å; L687-E691 HydrophobicContact CG-CG 4.46Å; L687-E691 WeakPolarHBondContact O-CG 3.37Å; L687-E691 PolarHBondContact O-N 2.91Å
688	Q	82.5	Confident	72.9	Confident	127 Å²	127	85 Å²	85	59%	0.593	45%	0.454	S	S	*	.	H	α-helix	trans	-59.5	-37.4	176.2	-77.6	-173.8	-44.5	0	0	113.2	S684 A692	S684-Q688 WeakPolarHBondContact O-CG 3.44Å; S684-Q688 PolarHBondContact O-N 3.27Å; Q688-A692 VanDerWaalsContact O-CB 3.24Å; Q688-A692 WeakPolarHBondContact O-CB 3.48Å; Q688-A692 PolarHBondContact O-N 2.77Å
689	R	81.3	Confident	74.3	Confident	139 Å²	139	85.5 Å²	85.5	53%	0.525	45%	0.45	S	S	.	.	H	α-helix	trans	-65.1	-39.7	172.6	-75.5	175.8	-171.5	103.9	-10.3	112.1	Q685 K686 L687 R693	Q685-R689 VanDerWaalsContact C-NH1 3.34Å; Q685-R689 VanDerWaalsContact CD-NH1 3.32Å; Q685-R689 VanDerWaalsContact CD-NH2 3.29Å; Q685-R689 VanDerWaalsContact CG-NH1 3.29Å; Q685-R689 VanDerWaalsContact O-CG 3.23Å; Q685-R689 WeakPolarHBondContact O-CG 3.46Å; Q685-R689 PolarHBondContact O-N 3.2Å; Q685-R689 PolarHBondContact O-NH1 3.04Å; Q685-R689 VanDerWaalsContact OE1-CZ 3.23Å; K686-R689 PolarHBondContact O-N 3.01Å; L687-R689 VanDerWaalsContact C-N 3.31Å; L687-R689 PolarHBondContact O-N 3.16Å; R689-R693 VanDerWaalsContact O-CB 3.27Å; R689-R693 WeakPolarHBondContact O-CB 3.48Å; R689-R693 PolarHBondContact O-N 3.01Å
690	A	63.2	Low	75.2	Confident	49 Å²	49	87.6 Å²	87.6	41%	0.405	45%	0.454	S	S	.	.	H	α-helix	trans	-67.6	-42.3	177.3	0	0	0	0	0	111.8	K686 L687 R693 L694	K686-A690 PolarHBondContact O-N 3.34Å; L687-A690 WeakPolarHBondContact O-CA 3.22Å; L687-A690 WeakPolarHBondContact O-CB 3.4Å; L687-A690 PolarHBondContact O-N 3.43Å; A690-R693 PolarHBondContact O-N 2.96Å; A690-L694 WeakPolarHBondContact O-CG 3.45Å; A690-L694 PolarHBondContact O-N 3.12Å
691	E	76.4	Confident	76.1	Confident	72 Å²	72	93.5 Å²	93.5	34%	0.336	47%	0.474	S	S	.	.	H	α-helix	trans	-69.2	-40	177.6	-67.7	-175.7	139.8	0	0	112.1	R661 L687 R693 L694 A695	R661-E691 IonicContact CZ-OE1 2.69Å; R661-E691 IonicContact NE-OE1 2.69Å; R661-E691 IonicContact NH2-OE1 3.22Å; R661-E691 PolarHBondContact NH2-OE1 3.28Å; L687-E691 HydrophobicContact CD1-CG 4.15Å; L687-E691 HydrophobicContact CG-CG 4.46Å; L687-E691 WeakPolarHBondContact O-CG 3.37Å; L687-E691 PolarHBondContact O-N 2.91Å; E691-R693 VanDerWaalsContact C-N 3.34Å; E691-R693 PolarHBondContact O-N 3.07Å; E691-L694 PolarHBondContact O-N 3.06Å; E691-A695 PolarHBondContact O-N 3.02Å
692	A	81.9	Confident	76.8	Confident	62 Å²	62	94.4 Å²	94.4	51%	0.512	48%	0.476	S	S	.	.	H	α-helix	trans	-60.5	-42.7	171	0	0	0	0	0	111.8	Q688 A695 E696	Q688-A692 VanDerWaalsContact O-CB 3.24Å; Q688-A692 WeakPolarHBondContact O-CB 3.48Å; Q688-A692 PolarHBondContact O-N 2.77Å; A692-A695 PolarHBondContact O-N 2.78Å; A692-E696 WeakPolarHBondContact O-CB 3.32Å; A692-E696 PolarHBondContact O-N 3.12Å
693	R	78.3	Confident	77.3	Confident	176 Å²	176	95.2 Å²	95.2	66%	0.664	48%	0.48	S	S	*	.	H	α-helix	trans	-68.4	-32.5	176.7	-170.4	176.7	-177.3	-176.4	1.2	112.8	R689 A690 E691 M697	R689-R693 VanDerWaalsContact O-CB 3.27Å; R689-R693 WeakPolarHBondContact O-CB 3.48Å; R689-R693 PolarHBondContact O-N 3.01Å; A690-R693 PolarHBondContact O-N 2.96Å; E691-R693 VanDerWaalsContact C-N 3.34Å; E691-R693 PolarHBondContact O-N 3.07Å; R693-M697 WeakPolarHBondContact O-CB 3.41Å; R693-M697 WeakPolarHBondContact O-CG 3.23Å; R693-M697 PolarHBondContact O-N 3.12Å
694	L	70.9	Confident	77.7	Confident	110 Å²	110	100 Å²	100	58%	0.576	49%	0.488	S	S	*	.	H	α-helix	trans	-67.8	-44.1	172.2	-77	169.6	0	0	0	111.2	A690 E691 E696 M697 E698	A690-L694 WeakPolarHBondContact O-CG 3.45Å; A690-L694 PolarHBondContact O-N 3.12Å; E691-L694 PolarHBondContact O-N 3.06Å; L694-E696 VanDerWaalsContact C-N 3.35Å; L694-E696 PolarHBondContact O-N 2.79Å; L694-M697 PolarHBondContact O-N 3.41Å; L694-E698 WeakPolarHBondContact O-CB 3.37Å; L694-E698 PolarHBondContact O-N 3.44Å
695	A	82.1	Confident	77.8	Confident	52 Å²	52	101.6 Å²	101.6	43%	0.43	50%	0.495	S	S	.	.	H	α-helix	trans	-62.5	-40.6	174.5	0	0	0	0	0	112.1	E691 A692 E698 V699	E691-A695 PolarHBondContact O-N 3.02Å; A692-A695 PolarHBondContact O-N 2.78Å; A695-E698 PolarHBondContact O-N 3.07Å; A695-V699 WeakPolarHBondContact O-CG2 3.46Å; A695-V699 PolarHBondContact O-N 2.86Å
696	E	84.4	Confident	78	Confident	121 Å²	121	102.9 Å²	102.9	57%	0.565	50%	0.499	S	S	*	.	H	α-helix	trans	-61.2	-45.9	173.2	-176.1	177	-144.9	0	0	111.7	A692 L694 E698 V699 L700	A692-E696 WeakPolarHBondContact O-CB 3.32Å; A692-E696 PolarHBondContact O-N 3.12Å; L694-E696 VanDerWaalsContact C-N 3.35Å; L694-E696 PolarHBondContact O-N 2.79Å; E696-E698 VanDerWaalsContact C-N 3.31Å; E696-E698 PolarHBondContact O-N 3.19Å; E696-V699 PolarHBondContact O-N 2.83Å; E696-L700 HydrophobicContact CG-CD1 4.23Å; E696-L700 WeakPolarHBondContact O-CB 3.26Å; E696-L700 VanDerWaalsContact O-CG 3.27Å; E696-L700 WeakPolarHBondContact O-CG 3.48Å; E696-L700 PolarHBondContact O-N 2.82Å
697	M	64	Low	78	Confident	117 Å²	117	100.5 Å²	100.5	58%	0.576	50%	0.495	S	S	*	.	H	α-helix	trans	-63.8	-32.7	174.8	-74.5	-67.2	-59.6	0	0	113.1	R693 L694 R701	R693-M697 WeakPolarHBondContact O-CB 3.41Å; R693-M697 WeakPolarHBondContact O-CG 3.23Å; R693-M697 PolarHBondContact O-N 3.12Å; L694-M697 PolarHBondContact O-N 3.41Å; M697-R701 WeakPolarHBondContact O-CB 3.44Å; M697-R701 PolarHBondContact O-N 2.79Å
698	E	81.6	Confident	77.9	Confident	134 Å²	134	102.2 Å²	102.2	63%	0.626	51%	0.506	S	S	*	.	H	α-helix	trans	-75.8	-38.6	176.7	-171.1	156	-138.2	0	0	112	L694 A695 E696 R701 V702	L694-E698 WeakPolarHBondContact O-CB 3.37Å; L694-E698 PolarHBondContact O-N 3.44Å; A695-E698 PolarHBondContact O-N 3.07Å; E696-E698 VanDerWaalsContact C-N 3.31Å; E696-E698 PolarHBondContact O-N 3.19Å; E698-R701 WeakPolarHBondContact O-CB 3.4Å; E698-R701 PolarHBondContact O-N 3.27Å; E698-V702 WeakPolarHBondContact O-CG2 3.24Å; E698-V702 PolarHBondContact O-N 3.27Å
699	V	86.4	Confident	77.7	Confident	85 Å²	85	98.9 Å²	98.9	52%	0.515	49%	0.494	S	S	.	.	H	α-helix	trans	-60.4	-50	169.2	169.5	0	0	0	0	110.6	A695 E696 R701 V702 E703	A695-V699 WeakPolarHBondContact O-CG2 3.46Å; A695-V699 PolarHBondContact O-N 2.86Å; E696-V699 PolarHBondContact O-N 2.83Å; V699-R701 PolarHBondContact O-N 3.24Å; V699-V702 PolarHBondContact O-N 2.8Å; V699-E703 HydrophobicContact CG1-CG 4.44Å; V699-E703 PolarHBondContact O-N 3.49Å
700	L	78.1	Confident	77.6	Confident	90 Å²	90	96.3 Å²	96.3	47%	0.471	49%	0.488	S	S	.	.	H	α-helix	trans	-59.3	-34.2	176.4	-73.1	169.6	0	0	0	112.2	E696 R704	E696-L700 HydrophobicContact CG-CD1 4.23Å; E696-L700 WeakPolarHBondContact O-CB 3.26Å; E696-L700 VanDerWaalsContact O-CG 3.27Å; E696-L700 WeakPolarHBondContact O-CG 3.48Å; E696-L700 PolarHBondContact O-N 2.82Å; L700-R704 WeakPolarHBondContact O-CB 3.41Å; L700-R704 PolarHBondContact O-N 2.86Å
701	R	79	Confident	78.1	Confident	159 Å²	159	98.2 Å²	98.2	60%	0.6	49%	0.491	S	S	*	.	H	α-helix	trans	-67	-45.3	172.8	-179.6	178.9	177.5	167	-0.4	111.8	M697 E698 V699 R704 D705	M697-R701 WeakPolarHBondContact O-CB 3.44Å; M697-R701 PolarHBondContact O-N 2.79Å; E698-R701 WeakPolarHBondContact O-CB 3.4Å; E698-R701 PolarHBondContact O-N 3.27Å; V699-R701 PolarHBondContact O-N 3.24Å; R701-R704 PolarHBondContact O-N 3.49Å; R701-D705 IonicContact NE-OD2 2.83Å; R701-D705 WeakPolarHBondContact O-CB 3.5Å; R701-D705 PolarHBondContact O-N 2.95Å
702	V	83.4	Confident	78.1	Confident	93 Å²	93	102 Å²	102	56%	0.564	50%	0.502	S	S	*	.	H	α-helix	trans	-64.8	-41.5	177.9	170.7	0	0	0	0	111.3	E698 V699 D705 K706	E698-V702 WeakPolarHBondContact O-CG2 3.24Å; E698-V702 PolarHBondContact O-N 3.27Å; V699-V702 PolarHBondContact O-N 2.8Å; V702-D705 PolarHBondContact O-N 2.7Å; V702-K706 VanDerWaalsContact O-CB 3.29Å; V702-K706 WeakPolarHBondContact O-CB 3.45Å; V702-K706 PolarHBondContact O-N 3.21Å
703	E	80.8	Confident	78	Confident	115 Å²	115	103.6 Å²	103.6	54%	0.537	50%	0.502	S	S	.	.	H	α-helix	trans	-63	-45.7	173.3	-71.2	-170	145.1	0	0	111.9	V699 D705 K706 T707	V699-E703 HydrophobicContact CG1-CG 4.44Å; V699-E703 PolarHBondContact O-N 3.49Å; E703-D705 PolarHBondContact O-N 3.27Å; E703-K706 PolarHBondContact O-N 3.2Å; E703-T707 WeakPolarHBondContact O-CG2 3.47Å; E703-T707 PolarHBondContact O-N 3.03Å; E703-T707 PolarHBondContact O-OG1 3.3Å
704	R	74.8	Confident	77.9	Confident	147 Å²	147	103.1 Å²	103.1	56%	0.555	50%	0.501	S	S	*	.	H	α-helix	trans	-57.8	-50.2	174.1	-172.1	-156	76.3	138.3	1.7	110.8	L700 R701 K706 T707 T708	L700-R704 WeakPolarHBondContact O-CB 3.41Å; L700-R704 PolarHBondContact O-N 2.86Å; R701-R704 PolarHBondContact O-N 3.49Å; R704-K706 VanDerWaalsContact C-N 3.32Å; R704-K706 PolarHBondContact O-N 3.48Å; R704-T707 PolarHBondContact O-N 3.47Å; R704-T707 VanDerWaalsContact O-N 3.16Å; R704-T707 PolarHBondContact O-OG1 2.97Å; R704-T708 WeakPolarHBondContact O-CG2 3.36Å; R704-T708 PolarHBondContact O-N 2.92Å
705	D	72.9	Confident	78	Confident	54 Å²	54	102.7 Å²	102.7	29%	0.289	50%	0.498	S	S	.	.	H	α-helix	trans	-63.1	-41	-177.3	-67.9	-3.4	0	0	0	110.4	R701 V702 E703 T708 T709	R701-D705 IonicContact NE-OD2 2.83Å; R701-D705 WeakPolarHBondContact O-CB 3.5Å; R701-D705 PolarHBondContact O-N 2.95Å; V702-D705 PolarHBondContact O-N 2.7Å; E703-D705 PolarHBondContact O-N 3.27Å; D705-T708 PolarHBondContact O-N 3.35Å; D705-T708 PolarHBondContact O-OG1 2.97Å; D705-T709 PolarHBondContact O-N 3.4Å; D705-T709 PolarHBondContact O-OG1 2.9Å
706	K	85.3	Confident	77.9	Confident	122 Å²	122	104.8 Å²	104.8	53%	0.53	50%	0.499	S	S	.	.	H	α-helix	trans	-58.5	-47	170.8	-178.4	176.9	-178.1	-82.4	0	113	V702 E703 R704 T708 T709 E710	V702-K706 VanDerWaalsContact O-CB 3.29Å; V702-K706 WeakPolarHBondContact O-CB 3.45Å; V702-K706 PolarHBondContact O-N 3.21Å; E703-K706 PolarHBondContact O-N 3.2Å; R704-K706 VanDerWaalsContact C-N 3.32Å; R704-K706 PolarHBondContact O-N 3.48Å; K706-T708 VanDerWaalsContact C-N 3.28Å; K706-T708 PolarHBondContact O-N 2.91Å; K706-T709 WeakPolarHBondContact CA-OG1 3.37Å; K706-T709 PolarHBondContact O-N 2.61Å; K706-T709 PolarHBondContact O-OG1 3.31Å; K706-E710 WeakPolarHBondContact CE-OE1 3.42Å; K706-E710 IonicContact NZ-OE1 3.3Å; K706-E710 PolarHBondContact NZ-OE1 3.34Å; K706-E710 WeakPolarHBondContact O-CG 3.45Å; K706-E710 PolarHBondContact O-N 2.94Å
707	T	76.8	Confident	77.6	Confident	65 Å²	65	103.8 Å²	103.8	40%	0.399	50%	0.497	S	S	.	.	H	α-helix	trans	-65.2	-31.4	176.2	60	0	0	0	0	112.2	E703 R704 E710 L711	E703-T707 WeakPolarHBondContact O-CG2 3.47Å; E703-T707 PolarHBondContact O-N 3.03Å; E703-T707 PolarHBondContact O-OG1 3.3Å; R704-T707 PolarHBondContact O-N 3.47Å; R704-T707 VanDerWaalsContact O-N 3.16Å; R704-T707 PolarHBondContact O-OG1 2.97Å; T707-E710 PolarHBondContact O-N 2.95Å; T707-L711 WeakPolarHBondContact O-CB 3.47Å; T707-L711 WeakPolarHBondContact O-CG 3.33Å; T707-L711 PolarHBondContact O-N 3.22Å
708	T	72.3	Confident	78	Confident	58 Å²	58	100 Å²	100	36%	0.356	48%	0.482	S	S	.	.	H	α-helix	trans	-69.8	-31.4	173.2	67.2	0	0	0	0	113.4	R704 D705 K706 R712	R704-T708 WeakPolarHBondContact O-CG2 3.36Å; R704-T708 PolarHBondContact O-N 2.92Å; D705-T708 PolarHBondContact O-N 3.35Å; D705-T708 PolarHBondContact O-OG1 2.97Å; K706-T708 VanDerWaalsContact C-N 3.28Å; K706-T708 PolarHBondContact O-N 2.91Å; T708-R712 WeakPolarHBondContact O-CB 3.44Å; T708-R712 PolarHBondContact O-N 3.38Å; T708-R712 VanDerWaalsContact O-N 3.11Å
709	T	77.6	Confident	77.8	Confident	56 Å²	56	98.9 Å²	98.9	34%	0.344	48%	0.477	S	S	.	.	H	α-helix	trans	-69.6	-47.9	169.4	41.2	0	0	0	0	111.5	D705 K706 L711 R712 D713	D705-T709 PolarHBondContact O-N 3.4Å; D705-T709 PolarHBondContact O-OG1 2.9Å; K706-T709 WeakPolarHBondContact CA-OG1 3.37Å; K706-T709 PolarHBondContact O-N 2.61Å; K706-T709 PolarHBondContact O-OG1 3.31Å; T709-L711 PolarHBondContact O-N 3.32Å; T709-L711 VanDerWaalsContact O-N 3.17Å; T709-R712 WeakPolarHBondContact O-CA 3.48Å; T709-R712 WeakPolarHBondContact O-CB 3.24Å; T709-R712 PolarHBondContact O-N 3.49Å; T709-D713 PolarHBondContact O-N 2.94Å
710	E	79.8	Confident	77.6	Confident	86 Å²	86	99.9 Å²	99.9	40%	0.402	47%	0.474	S	S	.	.	H	α-helix	trans	-59.5	-31.4	177.4	-69.7	172.2	-174.5	0	0	113.2	K706 T707 R714	K706-E710 WeakPolarHBondContact CE-OE1 3.42Å; K706-E710 IonicContact NZ-OE1 3.3Å; K706-E710 PolarHBondContact NZ-OE1 3.34Å; K706-E710 WeakPolarHBondContact O-CG 3.45Å; K706-E710 PolarHBondContact O-N 2.94Å; T707-E710 PolarHBondContact O-N 2.95Å; E710-R714 WeakPolarHBondContact O-CB 3.25Å; E710-R714 WeakPolarHBondContact O-CG 3.39Å; E710-R714 PolarHBondContact O-N 2.94Å
711	L	73.4	Confident	77.7	Confident	89 Å²	89	99.6 Å²	99.6	47%	0.466	47%	0.469	S	S	.	.	H	α-helix	trans	-74.1	-36.4	172.5	-74.8	169.5	0	0	0	113	T707 T709 L715	T707-L711 WeakPolarHBondContact O-CB 3.47Å; T707-L711 WeakPolarHBondContact O-CG 3.33Å; T707-L711 PolarHBondContact O-N 3.22Å; T709-L711 PolarHBondContact O-N 3.32Å; T709-L711 VanDerWaalsContact O-N 3.17Å; L711-L715 PolarHBondContact O-N 2.68Å
712	R	76	Confident	77.5	Confident	150 Å²	150	95.4 Å²	95.4	57%	0.566	46%	0.457	S	S	*	.	H	α-helix	trans	-67.6	-47.1	177.2	-172.1	-173.9	-57.7	142.2	7.7	111.3	T708 T709 R714 L715 E716	T708-R712 WeakPolarHBondContact O-CB 3.44Å; T708-R712 PolarHBondContact O-N 3.38Å; T708-R712 VanDerWaalsContact O-N 3.11Å; T709-R712 WeakPolarHBondContact O-CA 3.48Å; T709-R712 WeakPolarHBondContact O-CB 3.24Å; T709-R712 PolarHBondContact O-N 3.49Å; R712-R714 VanDerWaalsContact C-N 3.26Å; R712-R714 PolarHBondContact O-N 2.97Å; R712-L715 WeakPolarHBondContact O-CA 3.29Å; R712-L715 WeakPolarHBondContact O-CB 3.43Å; R712-L715 PolarHBondContact O-N 3.1Å; R712-E716 PolarHBondContact O-N 2.72Å
713	D	80.3	Confident	77.3	Confident	97 Å²	97	94.8 Å²	94.8	52%	0.519	45%	0.454	S	S	.	.	H	α-helix	trans	-63.5	-36.5	-179.9	-54.5	-13.1	0	0	0	110.7	T709 L717	T709-D713 PolarHBondContact O-N 2.94Å; D713-L717 WeakPolarHBondContact O-CB 3.45Å; D713-L717 PolarHBondContact O-N 3.35Å
714	R	75.5	Confident	77.3	Confident	166 Å²	166	93.8 Å²	93.8	63%	0.626	45%	0.452	S	S	*	.	H	α-helix	trans	-66.6	-33.5	170.6	-90.9	170.9	47.1	-154	-13.8	113.9	E710 R712 S718	E710-R714 WeakPolarHBondContact O-CB 3.25Å; E710-R714 WeakPolarHBondContact O-CG 3.39Å; E710-R714 PolarHBondContact O-N 2.94Å; R712-R714 VanDerWaalsContact C-N 3.26Å; R712-R714 PolarHBondContact O-N 2.97Å; R714-S718 WeakPolarHBondContact O-CB 3.47Å; R714-S718 PolarHBondContact O-N 3.44Å; R714-S718 VanDerWaalsContact O-N 3.12Å
715	L	73.3	Confident	77.5	Confident	100 Å²	100	88.4 Å²	88.4	52%	0.524	43%	0.432	S	S	.	.	H	α-helix	trans	-70.1	-49.6	176.6	-179.1	62	0	0	0	110	L711 R712 L717 S718 E719	L711-L715 PolarHBondContact O-N 2.68Å; R712-L715 WeakPolarHBondContact O-CA 3.29Å; R712-L715 WeakPolarHBondContact O-CB 3.43Å; R712-L715 PolarHBondContact O-N 3.1Å; L715-L717 VanDerWaalsContact C-N 3.3Å; L715-L717 PolarHBondContact O-N 3.37Å; L715-S718 CarbonylContact O-C 3.53Å; L715-S718 WeakPolarHBondContact O-CA 3.36Å; L715-S718 WeakPolarHBondContact O-CB 3.35Å; L715-S718 PolarHBondContact O-N 2.89Å; L715-E719 HydrophobicContact CD1-CG 4.45Å; L715-E719 HydrophobicContact CG-CG 4.49Å; L715-E719 WeakPolarHBondContact O-CG 3.46Å; L715-E719 PolarHBondContact O-N 3.42Å
716	E	80.1	Confident	77.9	Confident	97 Å²	97	91.4 Å²	91.4	45%	0.453	44%	0.444	S	S	.	.	H	α-helix	trans	-58.4	-40.9	177.2	-167.6	-167.5	132.6	0	0	111.8	R712 S718 E719 K720	R712-E716 PolarHBondContact O-N 2.72Å; E716-S718 VanDerWaalsContact C-N 3.29Å; E716-S718 PolarHBondContact O-N 2.94Å; E716-E719 PolarHBondContact O-N 2.95Å; E716-K720 WeakPolarHBondContact O-CG 3.47Å; E716-K720 PolarHBondContact O-N 3.4Å; E716-K720 WeakPolarHBondContact OE1-CE 3.39Å; E716-K720 IonicContact OE1-NZ 3.81Å; E716-K720 PolarHBondContact OE1-NZ 3.41Å
717	L	78.4	Confident	78	Confident	100 Å²	100	88.4 Å²	88.4	52%	0.524	44%	0.443	S	S	.	.	H	α-helix	trans	-65.5	-30	173.4	-177.4	61.8	0	0	0	112.9	D713 L715 K721	D713-L717 WeakPolarHBondContact O-CB 3.45Å; D713-L717 PolarHBondContact O-N 3.35Å; L715-L717 VanDerWaalsContact C-N 3.3Å; L715-L717 PolarHBondContact O-N 3.37Å; L717-K721 WeakPolarHBondContact O-CG 3.47Å; L717-K721 PolarHBondContact O-N 3.27Å
718	S	72.4	Confident	78.4	Confident	38 Å²	38	87.2 Å²	87.2	27%	0.266	43%	0.434	S	S	.	.	H	α-helix	trans	-77.3	-37.9	175.4	-163.6	0	0	0	0	111.9	R714 L715 E716 K721 M722	R714-S718 WeakPolarHBondContact O-CB 3.47Å; R714-S718 PolarHBondContact O-N 3.44Å; R714-S718 VanDerWaalsContact O-N 3.12Å; L715-S718 CarbonylContact O-C 3.53Å; L715-S718 WeakPolarHBondContact O-CA 3.36Å; L715-S718 WeakPolarHBondContact O-CB 3.35Å; L715-S718 PolarHBondContact O-N 2.89Å; E716-S718 VanDerWaalsContact C-N 3.29Å; E716-S718 PolarHBondContact O-N 2.94Å; S718-K721 PolarHBondContact O-N 3.15Å; S718-M722 WeakPolarHBondContact O-CG 3.5Å; S718-M722 PolarHBondContact O-N 3.04Å
719	E	77.3	Confident	78.8	Confident	109 Å²	109	88.8 Å²	88.8	51%	0.509	44%	0.437	S	S	.	.	H	α-helix	trans	-63.6	-45.2	175.8	-71.3	171.5	163.9	0	0	110.9	L715 E716 K721 M722 T723	L715-E719 HydrophobicContact CD1-CG 4.45Å; L715-E719 HydrophobicContact CG-CG 4.49Å; L715-E719 WeakPolarHBondContact O-CG 3.46Å; L715-E719 PolarHBondContact O-N 3.42Å; E716-E719 PolarHBondContact O-N 2.95Å; E719-K721 VanDerWaalsContact C-N 3.34Å; E719-K721 PolarHBondContact O-N 2.93Å; E719-M722 WeakPolarHBondContact O-CB 3.45Å; E719-M722 PolarHBondContact O-N 3.1Å; E719-T723 PolarHBondContact O-N 2.74Å; E719-T723 PolarHBondContact O-OG1 3.02Å
720	K	82.6	Confident	79.4	Confident	107 Å²	107	92.2 Å²	92.2	47%	0.465	45%	0.447	S	S	.	.	H	α-helix	trans	-56.8	-45	173.3	-74.5	167.5	174.2	172.3	0	112.3	E716 M722 T723 D724	E716-K720 WeakPolarHBondContact O-CG 3.47Å; E716-K720 PolarHBondContact O-N 3.4Å; E716-K720 WeakPolarHBondContact OE1-CE 3.39Å; E716-K720 IonicContact OE1-NZ 3.81Å; E716-K720 PolarHBondContact OE1-NZ 3.41Å; K720-M722 VanDerWaalsContact C-N 3.3Å; K720-M722 PolarHBondContact O-N 3.01Å; K720-T723 WeakPolarHBondContact CA-OG1 3.42Å; K720-T723 PolarHBondContact O-N 3.31Å; K720-T723 PolarHBondContact O-OG1 3.05Å; K720-D724 PolarHBondContact O-N 3.09Å
721	K	79.6	Confident	79.6	Confident	84 Å²	84	89.9 Å²	89.9	37%	0.365	44%	0.443	S	S	.	.	H	α-helix	trans	-63.5	-32.1	175	-74	178	178	-166.5	0	113.5	L717 S718 E719 Y725	L717-K721 WeakPolarHBondContact O-CG 3.47Å; L717-K721 PolarHBondContact O-N 3.27Å; S718-K721 PolarHBondContact O-N 3.15Å; E719-K721 VanDerWaalsContact C-N 3.34Å; E719-K721 PolarHBondContact O-N 2.93Å; K721-Y725 WeakPolarHBondContact O-CB 3.34Å; K721-Y725 PolarHBondContact O-N 3.33Å
722	M	74.6	Confident	80.2	Confident	70 Å²	70	87.2 Å²	87.2	35%	0.345	43%	0.428	S	S	.	.	H	α-helix	trans	-69.6	-40.1	173.8	-71.6	-64	-64.7	0	0	111.7	S718 E719 K720 Y725 Q726 I813	S718-M722 WeakPolarHBondContact O-CG 3.5Å; S718-M722 PolarHBondContact O-N 3.04Å; E719-M722 WeakPolarHBondContact O-CB 3.45Å; E719-M722 PolarHBondContact O-N 3.1Å; K720-M722 VanDerWaalsContact C-N 3.3Å; K720-M722 PolarHBondContact O-N 3.01Å; M722-Y725 PolarHBondContact O-N 2.89Å; M722-Q726 WeakPolarHBondContact O-CG 3.24Å; M722-Q726 PolarHBondContact O-N 3.35Å; M722-I813 HydrophobicContact CE-CG2 4.39Å; M722-I813 HydrophobicContact SD-CB 4.39Å; M722-I813 HydrophobicContact SD-CD1 3.64Å; M722-I813 HydrophobicContact SD-CG1 3.7Å; M722-I813 HydrophobicContact SD-CG2 3.75Å
723	T	79.3	Confident	80.7	Confident	81 Å²	81	82.6 Å²	82.6	50%	0.497	42%	0.422	S	S	.	.	H	α-helix	trans	-67.9	-39.1	174.8	50.6	0	0	0	0	112.3	E719 K720 Q726 A727	E719-T723 PolarHBondContact O-N 2.74Å; E719-T723 PolarHBondContact O-OG1 3.02Å; K720-T723 WeakPolarHBondContact CA-OG1 3.42Å; K720-T723 PolarHBondContact O-N 3.31Å; K720-T723 PolarHBondContact O-OG1 3.05Å; T723-Q726 PolarHBondContact O-N 3.34Å; T723-A727 WeakPolarHBondContact O-CB 3.34Å; T723-A727 PolarHBondContact O-N 2.76Å
724	D	80.8	Confident	81.1	Confident	93 Å²	93	82.8 Å²	82.8	50%	0.497	42%	0.419	S	S	.	.	H	α-helix	trans	-63.6	-42.1	176	-63.3	-22.3	0	0	0	111.3	K720 A727 L728	K720-D724 PolarHBondContact O-N 3.09Å; D724-A727 PolarHBondContact O-N 2.89Å; D724-L728 WeakPolarHBondContact O-CB 3.48Å; D724-L728 WeakPolarHBondContact O-CG 3.26Å; D724-L728 PolarHBondContact O-N 3.15Å
725	Y	78.6	Confident	81.5	Confident	34 Å²	34	75.4 Å²	75.4	13%	0.133	39%	0.394	C	S	.	.	H	α-helix	trans	-60.8	-45	174.2	173.3	-102.7	0	0	0	112.4	K721 M722 A727 L728 Q729 V806 L809 K810 I813	K721-Y725 WeakPolarHBondContact O-CB 3.34Å; K721-Y725 PolarHBondContact O-N 3.33Å; M722-Y725 PolarHBondContact O-N 2.89Å; Y725-A727 PolarHBondContact O-N 3.49Å; Y725-L728 PolarHBondContact O-N 2.93Å; Y725-Q729 WeakPolarHBondContact O-CB 3.44Å; Y725-Q729 PolarHBondContact O-N 2.88Å; Y725-V806 HydrophobicContact CE2-CG1 3.75Å; Y725-V806 WeakPolarHBondContact CE2-O 3.47Å; Y725-L809 HydrophobicContact CD2-CB 3.62Å; Y725-L809 HydrophobicContact CD2-CD1 4.28Å; Y725-L809 HydrophobicContact CE2-CB 4.33Å; Y725-L809 HydrophobicContact CG-CB 4.46Å; Y725-K810 HydrophobicContact CE2-CB 3.9Å; Y725-I813 HydrophobicContact CD1-CD1 3.75Å; Y725-I813 HydrophobicContact CD2-CD1 3.92Å; Y725-I813 HydrophobicContact CE1-CD1 4.25Å; Y725-I813 HydrophobicContact CE2-CD1 4.37Å; Y725-I813 HydrophobicContact CG-CD1 3.57Å
726	Q	83.2	Confident	82.1	Confident	117 Å²	117	74.6 Å²	74.6	55%	0.547	39%	0.387	S	S	.	.	H	α-helix	trans	-63.8	-39.4	176.7	-73.1	173.6	-3.5	0	0	112.1	M722 T723 Q729 K730	M722-Q726 WeakPolarHBondContact O-CG 3.24Å; M722-Q726 PolarHBondContact O-N 3.35Å; T723-Q726 PolarHBondContact O-N 3.34Å; Q726-Q729 PolarHBondContact O-N 3.12Å; Q726-K730 WeakPolarHBondContact O-CB 3.19Å; Q726-K730 PolarHBondContact O-N 2.6Å
727	A	86.6	Confident	82.6	Confident	60 Å²	60	74.8 Å²	74.8	50%	0.496	39%	0.388	S	S	.	.	H	α-helix	trans	-64.8	-44.8	175.7	0	0	0	0	0	112.1	T723 D724 Y725 K730 A731	T723-A727 WeakPolarHBondContact O-CB 3.34Å; T723-A727 PolarHBondContact O-N 2.76Å; D724-A727 PolarHBondContact O-N 2.89Å; Y725-A727 PolarHBondContact O-N 3.49Å; A727-K730 PolarHBondContact O-N 2.88Å; A727-A731 PolarHBondContact O-N 2.99Å
728	L	84.5	Confident	83.1	Confident	40 Å²	40	73.7 Å²	73.7	21%	0.209	38%	0.38	C	S	.	.	H	α-helix	trans	-63.3	-42.4	175.4	-76.9	165.4	0	0	0	112.3	D724 Y725 K730 A731 Q732 L802 V806 L809	D724-L728 WeakPolarHBondContact O-CB 3.48Å; D724-L728 WeakPolarHBondContact O-CG 3.26Å; D724-L728 PolarHBondContact O-N 3.15Å; Y725-L728 PolarHBondContact O-N 2.93Å; L728-K730 VanDerWaalsContact C-N 3.33Å; L728-K730 PolarHBondContact O-N 3.29Å; L728-A731 PolarHBondContact O-N 3.33Å; L728-Q732 WeakPolarHBondContact O-CB 3.27Å; L728-Q732 PolarHBondContact O-N 3.01Å; L728-L802 HydrophobicContact CD2-CD2 3.68Å; L728-V806 HydrophobicContact CB-CG2 3.96Å; L728-L809 HydrophobicContact CD1-CD1 3.52Å
729	Q	82.1	Confident	83.8	Confident	91 Å²	91	72.8 Å²	72.8	43%	0.425	37%	0.372	S	S	.	.	H	α-helix	trans	-63.1	-38.6	176.7	-170.5	179.2	13.9	0	0	111.8	Y725 Q726 A733	Y725-Q729 WeakPolarHBondContact O-CB 3.44Å; Y725-Q729 PolarHBondContact O-N 2.88Å; Q726-Q729 PolarHBondContact O-N 3.12Å; Q729-A733 PolarHBondContact O-N 2.92Å; Q729-A733 VanDerWaalsContact O-N 3.14Å
730	K	89.9	Confident	84.4	Confident	128 Å²	128	73.4 Å²	73.4	56%	0.557	38%	0.375	S	S	*	.	H	α-helix	trans	-65.7	-47.2	174.5	-175	173.2	179.3	-71.9	0	111.7	Q726 A727 L728 Q732 A733 E734	Q726-K730 WeakPolarHBondContact O-CB 3.19Å; Q726-K730 PolarHBondContact O-N 2.6Å; A727-K730 PolarHBondContact O-N 2.88Å; L728-K730 VanDerWaalsContact C-N 3.33Å; L728-K730 PolarHBondContact O-N 3.29Å; K730-Q732 VanDerWaalsContact C-N 3.33Å; K730-Q732 PolarHBondContact O-N 2.82Å; K730-A733 PolarHBondContact O-N 2.69Å; K730-E734 WeakPolarHBondContact CE-OE1 3.38Å; K730-E734 IonicContact NZ-OE1 3.76Å; K730-E734 PolarHBondContact NZ-OE1 2.8Å; K730-E734 IonicContact NZ-OE2 3.16Å; K730-E734 WeakPolarHBondContact O-CG 3.36Å; K730-E734 PolarHBondContact O-N 3.16Å
731	A	84.4	Confident	84.8	Confident	37 Å²	37	72.9 Å²	72.9	31%	0.306	37%	0.373	S	S	.	.	H	α-helix	trans	-62.9	-37.3	177.7	0	0	0	0	0	112.7	A727 L728 S735	A727-A731 PolarHBondContact O-N 2.99Å; L728-A731 PolarHBondContact O-N 3.33Å; A731-S735 WeakPolarHBondContact O-CB 3.48Å; A731-S735 PolarHBondContact O-N 2.94Å
732	Q	84.6	Confident	85.2	Confident	32 Å²	32	69.6 Å²	69.6	15%	0.15	36%	0.359	C	S	.	.	H	α-helix	trans	-60	-46.9	172.9	-173.5	-165.4	11.6	0	0	111.2	L728 K730 S735 Q736 L802 S803	L728-Q732 WeakPolarHBondContact O-CB 3.27Å; L728-Q732 PolarHBondContact O-N 3.01Å; K730-Q732 VanDerWaalsContact C-N 3.33Å; K730-Q732 PolarHBondContact O-N 2.82Å; Q732-S735 PolarHBondContact O-N 3.33Å; Q732-Q736 VanDerWaalsContact O-CG 3.31Å; Q732-Q736 WeakPolarHBondContact O-CG 3.28Å; Q732-Q736 PolarHBondContact O-N 2.9Å; Q732-L802 HydrophobicContact CB-CB 4.34Å; Q732-L802 HydrophobicContact CG-CB 4.47Å; Q732-S803 PolarHBondContact NE2-OG 3.33Å
733	A	85.9	Confident	85.8	Confident	54 Å²	54	70.9 Å²	70.9	45%	0.446	36%	0.364	S	S	.	.	H	α-helix	trans	-66.8	-43.6	179.3	0	0	0	0	0	112.5	Q729 K730 S735 Q736 E737	Q729-A733 PolarHBondContact O-N 2.92Å; Q729-A733 VanDerWaalsContact O-N 3.14Å; K730-A733 PolarHBondContact O-N 2.69Å; A733-S735 VanDerWaalsContact C-N 3.34Å; A733-S735 PolarHBondContact O-N 2.96Å; A733-Q736 PolarHBondContact O-N 2.89Å; A733-E737 PolarHBondContact O-N 2.99Å
734	E	89.9	Confident	86.4	Confident	100 Å²	100	71.2 Å²	71.2	47%	0.467	36%	0.36	S	S	.	.	H	α-helix	trans	-60.2	-42.6	176.3	-72.7	173.1	162.4	0	0	111.6	K730 E737 E738	K730-E734 WeakPolarHBondContact CE-OE1 3.38Å; K730-E734 IonicContact NZ-OE1 3.76Å; K730-E734 PolarHBondContact NZ-OE1 2.8Å; K730-E734 IonicContact NZ-OE2 3.16Å; K730-E734 WeakPolarHBondContact O-CG 3.36Å; K730-E734 PolarHBondContact O-N 3.16Å; E734-E737 PolarHBondContact O-N 3.44Å; E734-E738 PolarHBondContact O-N 3.02Å
735	S	84.2	Confident	86.8	Confident	12 Å²	12	72.7 Å²	72.7	8%	0.084	36%	0.362	C	S	.	.	H	α-helix	trans	-74.4	-23.7	177.4	-169.5	0	0	0	0	113.6	A731 Q732 A733 I739 V799	A731-S735 WeakPolarHBondContact O-CB 3.48Å; A731-S735 PolarHBondContact O-N 2.94Å; Q732-S735 PolarHBondContact O-N 3.33Å; A733-S735 VanDerWaalsContact C-N 3.34Å; A733-S735 PolarHBondContact O-N 2.96Å; S735-I739 WeakPolarHBondContact O-CG1 3.49Å; S735-I739 PolarHBondContact O-N 2.89Å; S735-I739 VanDerWaalsContact O-N 3.12Å; S735-V799 VanDerWaalsContact OG-CG2 3.28Å; S735-V799 WeakPolarHBondContact OG-CG2 3.44Å
736	Q	84.3	Confident	87.3	Confident	83 Å²	83	72.9 Å²	72.9	39%	0.388	37%	0.365	S	S	.	.	H	α-helix	trans	-71.7	-40.1	169.4	-77.9	173.1	-5.3	0	0	111.6	Q732 A733 E738 I739 Q740 V799	Q732-Q736 VanDerWaalsContact O-CG 3.31Å; Q732-Q736 WeakPolarHBondContact O-CG 3.28Å; Q732-Q736 PolarHBondContact O-N 2.9Å; A733-Q736 PolarHBondContact O-N 2.89Å; Q736-E738 VanDerWaalsContact C-N 3.28Å; Q736-E738 PolarHBondContact O-N 2.98Å; Q736-I739 WeakPolarHBondContact O-CB 3.3Å; Q736-I739 PolarHBondContact O-N 3.29Å; Q736-Q740 PolarHBondContact O-N 3.2Å; Q736-Q740 VanDerWaalsContact O-N 3.12Å; Q736-V799 HydrophobicContact CG-CG1 3.75Å; Q736-V799 HydrophobicContact CG-CG2 4.19Å
737	E	90.6	Very high	87.6	Confident	100 Å²	100	73.7 Å²	73.7	47%	0.467	36%	0.363	S	S	.	.	H	α-helix	trans	-64	-35.2	173.2	-154.8	-154.1	161.6	0	0	111.3	A733 E734 Q740 K741	A733-E737 PolarHBondContact O-N 2.99Å; E734-E737 PolarHBondContact O-N 3.44Å; E737-Q740 PolarHBondContact O-N 3.15Å; E737-K741 VanDerWaalsContact CD-CE 3.48Å; E737-K741 WeakPolarHBondContact O-CD 3.3Å; E737-K741 VanDerWaalsContact O-CG 3.25Å; E737-K741 WeakPolarHBondContact O-CG 3.21Å; E737-K741 PolarHBondContact O-N 3.31Å; E737-K741 VanDerWaalsContact O-N 3.08Å; E737-K741 WeakPolarHBondContact OE1-CE 3.33Å; E737-K741 IonicContact OE1-NZ 3.32Å; E737-K741 PolarHBondContact OE1-NZ 3.5Å; E737-K741 IonicContact OE2-NZ 3.46Å; E737-K741 PolarHBondContact OE2-NZ 2.93Å
738	E	89.1	Confident	87.8	Confident	77 Å²	77	73.5 Å²	73.5	36%	0.36	36%	0.356	S	S	.	.	H	α-helix	trans	-71	-33	175.4	-150.9	-176.9	164.2	0	0	113.1	E734 Q736 K741 L742 R795	E734-E738 PolarHBondContact O-N 3.02Å; Q736-E738 VanDerWaalsContact C-N 3.28Å; Q736-E738 PolarHBondContact O-N 2.98Å; E738-K741 PolarHBondContact O-N 3.03Å; E738-L742 WeakPolarHBondContact O-CG 3.35Å; E738-L742 PolarHBondContact O-N 3.3Å; E738-L742 VanDerWaalsContact O-N 3.08Å; E738-R795 IonicContact OE1-CZ 3.07Å; E738-R795 IonicContact OE1-NH1 3.07Å; E738-R795 PolarHBondContact OE1-NH1 2.95Å; E738-R795 IonicContact OE1-NH2 2.68Å; E738-R795 IonicContact OE2-CZ 2.87Å; E738-R795 IonicContact OE2-NE 2.67Å; E738-R795 IonicContact OE2-NH1 3.03Å; E738-R795 PolarHBondContact OE2-NH1 2.95Å; E738-R795 IonicContact OE2-NH2 3.49Å; E738-R795 PolarHBondContact OE2-NH2 3.38Å
739	I	87.6	Confident	87.9	Confident	19 Å²	19	72.2 Å²	72.2	10%	0.097	35%	0.35	C	S	.	.	H	α-helix	trans	-59.9	-52	169	-75.2	171.5	0	0	0	110.2	S735 Q736 K741 L742 E743 L792 R795 E796 V799	S735-I739 WeakPolarHBondContact O-CG1 3.49Å; S735-I739 PolarHBondContact O-N 2.89Å; S735-I739 VanDerWaalsContact O-N 3.12Å; Q736-I739 WeakPolarHBondContact O-CB 3.3Å; Q736-I739 PolarHBondContact O-N 3.29Å; I739-K741 VanDerWaalsContact C-N 3.26Å; I739-K741 PolarHBondContact O-N 2.69Å; I739-L742 CarbonylContact O-C 3.6Å; I739-L742 WeakPolarHBondContact O-CA 3.38Å; I739-L742 WeakPolarHBondContact O-CB 3.36Å; I739-L742 PolarHBondContact O-N 2.97Å; I739-E743 HydrophobicContact CG2-CG 4.23Å; I739-E743 WeakPolarHBondContact O-CG 3.38Å; I739-E743 PolarHBondContact O-N 3.44Å; I739-L792 HydrophobicContact CB-CD1 4.45Å; I739-L792 HydrophobicContact CG2-CD1 3.91Å; I739-R795 HydrophobicContact CD1-CB 4.35Å; I739-R795 HydrophobicContact CG1-CB 3.81Å; I739-E796 HydrophobicContact CD1-CG 4.05Å; I739-V799 HydrophobicContact CD1-CB 4.02Å; I739-V799 HydrophobicContact CD1-CG2 3.6Å
740	Q	89.6	Confident	88	Confident	122 Å²	122	69.9 Å²	69.9	57%	0.57	35%	0.346	S	S	*	.	H	α-helix	trans	-58.3	-37.6	179	-68.4	175.4	2.7	0	0	112.5	Q736 E737 L742 E743 E744	Q736-Q740 PolarHBondContact O-N 3.2Å; Q736-Q740 VanDerWaalsContact O-N 3.12Å; E737-Q740 PolarHBondContact O-N 3.15Å; Q740-L742 VanDerWaalsContact C-N 3.29Å; Q740-L742 PolarHBondContact O-N 2.89Å; Q740-E743 WeakPolarHBondContact CA-OE2 3.3Å; Q740-E743 PolarHBondContact O-N 3.3Å; Q740-E744 WeakPolarHBondContact O-CB 3.39Å; Q740-E744 PolarHBondContact O-N 3.29Å
741	K	91.6	Very high	87.9	Confident	97 Å²	97	67.6 Å²	67.6	42%	0.422	34%	0.34	S	S	.	.	H	α-helix	trans	-68.2	-23.8	174	-70.8	163.7	-173.8	166.3	0	113.4	E737 E738 I739 K745	E737-K741 VanDerWaalsContact CD-CE 3.48Å; E737-K741 WeakPolarHBondContact O-CD 3.3Å; E737-K741 VanDerWaalsContact O-CG 3.25Å; E737-K741 WeakPolarHBondContact O-CG 3.21Å; E737-K741 PolarHBondContact O-N 3.31Å; E737-K741 VanDerWaalsContact O-N 3.08Å; E737-K741 WeakPolarHBondContact OE1-CE 3.33Å; E737-K741 IonicContact OE1-NZ 3.32Å; E737-K741 PolarHBondContact OE1-NZ 3.5Å; E737-K741 IonicContact OE2-NZ 3.46Å; E737-K741 PolarHBondContact OE2-NZ 2.93Å; E738-K741 PolarHBondContact O-N 3.03Å; I739-K741 VanDerWaalsContact C-N 3.26Å; I739-K741 PolarHBondContact O-N 2.69Å; K741-K745 VanDerWaalsContact O-CD 3.28Å; K741-K745 WeakPolarHBondContact O-CD 3.12Å; K741-K745 WeakPolarHBondContact O-CG 3.35Å; K741-K745 PolarHBondContact O-N 2.86Å
742	L	88.7	Confident	88	Confident	15 Å²	15	70.4 Å²	70.4	8%	0.079	35%	0.346	C	S	.	.	H	α-helix	trans	-84.8	-42.1	173.8	-72.8	167.7	0	0	0	111.3	E738 I739 Q740 E744 K745 L746 K791 L792 R795	E738-L742 WeakPolarHBondContact O-CG 3.35Å; E738-L742 PolarHBondContact O-N 3.3Å; E738-L742 VanDerWaalsContact O-N 3.08Å; I739-L742 CarbonylContact O-C 3.6Å; I739-L742 WeakPolarHBondContact O-CA 3.38Å; I739-L742 WeakPolarHBondContact O-CB 3.36Å; I739-L742 PolarHBondContact O-N 2.97Å; Q740-L742 VanDerWaalsContact C-N 3.29Å; Q740-L742 PolarHBondContact O-N 2.89Å; L742-E744 VanDerWaalsContact C-N 3.35Å; L742-E744 PolarHBondContact O-N 2.94Å; L742-K745 PolarHBondContact O-N 3.2Å; L742-L746 WeakPolarHBondContact O-CB 3.37Å; L742-L746 PolarHBondContact O-N 3.06Å; L742-K791 HydrophobicContact CD1-CB 4.44Å; L742-K791 HydrophobicContact CD2-CB 4.46Å; L742-L792 HydrophobicContact CB-CD1 3.79Å; L742-R795 HydrophobicContact CD1-CG 4.3Å
743	E	87.2	Confident	88	Confident	96 Å²	96	69.6 Å²	69.6	45%	0.449	34%	0.343	S	S	.	.	H	α-helix	trans	-56.5	-46.4	172.5	-66.9	177	129	0	0	111.5	I739 Q740 L746 R747 L792	I739-E743 HydrophobicContact CG2-CG 4.23Å; I739-E743 WeakPolarHBondContact O-CG 3.38Å; I739-E743 PolarHBondContact O-N 3.44Å; Q740-E743 WeakPolarHBondContact CA-OE2 3.3Å; Q740-E743 PolarHBondContact O-N 3.3Å; E743-L746 WeakPolarHBondContact O-CB 3.44Å; E743-L746 PolarHBondContact O-N 3Å; E743-R747 WeakPolarHBondContact O-CB 3.49Å; E743-R747 PolarHBondContact O-N 3.06Å; E743-L792 HydrophobicContact CG-CD1 3.87Å
744	E	90.6	Very high	87.9	Confident	89 Å²	89	73.3 Å²	73.3	42%	0.416	35%	0.351	S	S	.	.	H	α-helix	trans	-66.4	-39	178.5	177.4	59.3	-172.6	0	0	112.2	Q740 L742 R747 V748	Q740-E744 WeakPolarHBondContact O-CB 3.39Å; Q740-E744 PolarHBondContact O-N 3.29Å; L742-E744 VanDerWaalsContact C-N 3.35Å; L742-E744 PolarHBondContact O-N 2.94Å; E744-R747 PolarHBondContact O-N 3.36Å; E744-R747 IonicContact OE1-CZ 2.67Å; E744-R747 IonicContact OE1-NE 3.93Å; E744-R747 IonicContact OE1-NH2 3.21Å; E744-R747 PolarHBondContact OE1-NH2 3.49Å; E744-R747 IonicContact OE2-CZ 3.22Å; E744-R747 VanDerWaalsContact OE2-CZ 3.24Å; E744-R747 IonicContact OE2-NE 2.89Å; E744-R747 PolarHBondContact OE2-NE 3.46Å; E744-R747 IonicContact OE2-NH2 2.69Å; E744-R747 PolarHBondContact OE2-NH2 3.03Å; E744-V748 WeakPolarHBondContact O-CB 3.3Å; E744-V748 VanDerWaalsContact O-CG2 3.32Å; E744-V748 WeakPolarHBondContact O-CG2 3.41Å; E744-V748 PolarHBondContact O-N 2.83Å
745	K	90	Very high	87.6	Confident	124 Å²	124	71 Å²	71	54%	0.539	35%	0.349	S	S	.	.	H	α-helix	trans	-63.4	-42.8	173.5	-77.3	170.7	-173.3	172.8	0	111.6	K741 L742 V748 T749	K741-K745 VanDerWaalsContact O-CD 3.28Å; K741-K745 WeakPolarHBondContact O-CD 3.12Å; K741-K745 WeakPolarHBondContact O-CG 3.35Å; K741-K745 PolarHBondContact O-N 2.86Å; L742-K745 PolarHBondContact O-N 3.2Å; K745-V748 PolarHBondContact O-N 2.69Å; K745-T749 WeakPolarHBondContact O-CG2 3.35Å; K745-T749 PolarHBondContact O-N 2.86Å; K745-T749 PolarHBondContact O-OG1 3.12Å
746	L	89	Confident	87.5	Confident	37 Å²	37	72 Å²	72	19%	0.194	36%	0.355	C	S	.	.	H	α-helix	trans	-62	-43.1	176.5	-174	68.6	0	0	0	111	L742 E743 T749 A750 I785 M789 L792	L742-L746 WeakPolarHBondContact O-CB 3.37Å; L742-L746 PolarHBondContact O-N 3.06Å; E743-L746 WeakPolarHBondContact O-CB 3.44Å; E743-L746 PolarHBondContact O-N 3Å; L746-T749 PolarHBondContact O-OG1 3.44Å; L746-A750 WeakPolarHBondContact O-CB 3.45Å; L746-A750 PolarHBondContact O-N 3.03Å; L746-I785 HydrophobicContact CD1-CB 4.36Å; L746-I785 HydrophobicContact CD1-CG1 4.4Å; L746-I785 HydrophobicContact CD1-CG2 3.88Å; L746-M789 HydrophobicContact CD1-CG 3.59Å; L746-M789 HydrophobicContact CD1-SD 4.35Å; L746-M789 HydrophobicContact CD2-CG 3.88Å; L746-M789 HydrophobicContact CG-CG 4.42Å; L746-L792 HydrophobicContact CD2-CD2 4.45Å
747	R	89.8	Confident	87	Confident	135 Å²	135	71.9 Å²	71.9	51%	0.509	35%	0.354	S	S	.	.	H	α-helix	trans	-62.1	-44.5	175.2	-167.8	-177.5	72.1	90	4.3	111.9	E743 E744 N751	E743-R747 WeakPolarHBondContact O-CB 3.49Å; E743-R747 PolarHBondContact O-N 3.06Å; E744-R747 PolarHBondContact O-N 3.36Å; E744-R747 IonicContact OE1-CZ 2.67Å; E744-R747 IonicContact OE1-NE 3.93Å; E744-R747 IonicContact OE1-NH2 3.21Å; E744-R747 PolarHBondContact OE1-NH2 3.49Å; E744-R747 IonicContact OE2-CZ 3.22Å; E744-R747 VanDerWaalsContact OE2-CZ 3.24Å; E744-R747 IonicContact OE2-NE 2.89Å; E744-R747 PolarHBondContact OE2-NE 3.46Å; E744-R747 IonicContact OE2-NH2 2.69Å; E744-R747 PolarHBondContact OE2-NH2 3.03Å; R747-N751 WeakPolarHBondContact O-CB 3.4Å; R747-N751 PolarHBondContact O-N 2.96Å; R747-N751 PolarHBondContact O-ND2 3.32Å
748	V	90.7	Very high	86.3	Confident	55 Å²	55	70.1 Å²	70.1	33%	0.333	36%	0.357	S	S	.	.	H	α-helix	trans	-66.4	-45.6	178.5	169.6	0	0	0	0	111.8	E744 K745 N751 Q752	E744-V748 WeakPolarHBondContact O-CB 3.3Å; E744-V748 VanDerWaalsContact O-CG2 3.32Å; E744-V748 WeakPolarHBondContact O-CG2 3.41Å; E744-V748 PolarHBondContact O-N 2.83Å; K745-V748 PolarHBondContact O-N 2.69Å; V748-N751 PolarHBondContact O-N 2.89Å; V748-Q752 WeakPolarHBondContact O-CG 3.46Å; V748-Q752 PolarHBondContact O-N 2.87Å
749	T	85.5	Confident	85.2	Confident	14 Å²	14	71 Å²	71	9%	0.086	36%	0.364	C	S	.	.	H	α-helix	trans	-70.3	-34.4	178.7	53.6	0	0	0	0	112.5	K745 L746 Q752 L753 I785	K745-T749 WeakPolarHBondContact O-CG2 3.35Å; K745-T749 PolarHBondContact O-N 2.86Å; K745-T749 PolarHBondContact O-OG1 3.12Å; L746-T749 PolarHBondContact O-OG1 3.44Å; T749-Q752 PolarHBondContact O-N 2.89Å; T749-L753 WeakPolarHBondContact O-CB 3.35Å; T749-L753 PolarHBondContact O-N 3.49Å; T749-I785 WeakPolarHBondContact OG1-CG1 3.5Å
750	A	85.7	Confident	83.8	Confident	42 Å²	42	75.9 Å²	75.9	35%	0.347	39%	0.386	S	S	.	.	H	α-helix	trans	-62.8	-44.3	171.5	0	0	0	0	0	112	L746 Q752 L753 Q754 I785	L746-A750 WeakPolarHBondContact O-CB 3.45Å; L746-A750 PolarHBondContact O-N 3.03Å; A750-Q752 PolarHBondContact O-N 2.95Å; A750-L753 PolarHBondContact O-N 3.04Å; A750-Q754 WeakPolarHBondContact O-CB 3.49Å; A750-Q754 PolarHBondContact O-N 3.42Å; A750-I785 HydrophobicContact CB-CD1 4.48Å
751	N	87.5	Confident	82.2	Confident	79 Å²	79	79 Å²	79	42%	0.422	40%	0.398	S	S	.	.	H	α-helix	trans	-63.1	-40.1	175.5	-72	-22.3	0	0	0	112.2	R747 V748 Q754 A755	R747-N751 WeakPolarHBondContact O-CB 3.4Å; R747-N751 PolarHBondContact O-N 2.96Å; R747-N751 PolarHBondContact O-ND2 3.32Å; V748-N751 PolarHBondContact O-N 2.89Å; N751-Q754 PolarHBondContact O-N 2.9Å; N751-A755 PolarHBondContact O-N 2.9Å
752	Q	86.6	Confident	80.4	Confident	96 Å²	96	81.7 Å²	81.7	45%	0.449	41%	0.41	S	S	.	.	H	α-helix	trans	-62.4	-46.5	173.7	-72.7	168.4	-4.1	0	0	111.5	V748 T749 A750 Q754 A755 V756 L781	V748-Q752 WeakPolarHBondContact O-CG 3.46Å; V748-Q752 PolarHBondContact O-N 2.87Å; T749-Q752 PolarHBondContact O-N 2.89Å; A750-Q752 PolarHBondContact O-N 2.95Å; Q752-Q754 VanDerWaalsContact C-N 3.27Å; Q752-Q754 PolarHBondContact O-N 3.23Å; Q752-A755 PolarHBondContact O-N 3.41Å; Q752-V756 WeakPolarHBondContact O-CG2 3.27Å; Q752-V756 PolarHBondContact O-N 3.38Å; Q752-L781 HydrophobicContact CB-CD2 4.4Å
753	L	85	Confident	78.4	Confident	16 Å²	16	86.3 Å²	86.3	8%	0.084	44%	0.441	C	S	.	.	H	α-helix	trans	-62.9	-32.6	176.1	177.3	60.2	0	0	0	112.3	T749 A750 Q757 K778 L781 K782 I785	T749-L753 WeakPolarHBondContact O-CB 3.35Å; T749-L753 PolarHBondContact O-N 3.49Å; A750-L753 PolarHBondContact O-N 3.04Å; L753-Q757 VanDerWaalsContact CG-NE2 3.31Å; L753-Q757 WeakPolarHBondContact O-CB 3.09Å; L753-Q757 VanDerWaalsContact O-CG 3.23Å; L753-Q757 WeakPolarHBondContact O-CG 3.42Å; L753-Q757 PolarHBondContact O-N 2.92Å; L753-Q757 VanDerWaalsContact O-N 3.16Å; L753-Q757 PolarHBondContact O-NE2 2.98Å; L753-K778 HydrophobicContact CD1-CG 3.96Å; L753-L781 HydrophobicContact CB-CB 4.29Å; L753-L781 HydrophobicContact CB-CD1 4.36Å; L753-L781 HydrophobicContact CD1-CB 4.14Å; L753-L781 HydrophobicContact CD1-CD1 4.48Å; L753-K782 HydrophobicContact CD1-CG 4.37Å; L753-K782 HydrophobicContact CD2-CG 3.7Å; L753-I785 HydrophobicContact CB-CD1 4.15Å; L753-I785 HydrophobicContact CD2-CD1 3.52Å; L753-I785 HydrophobicContact CG-CD1 4.46Å
754	Q	83.4	Confident	76.3	Confident	131 Å²	131	90.1 Å²	90.1	61%	0.612	46%	0.458	S	S	*	.	H	α-helix	trans	-71.5	-39.1	174	-172.9	175.4	-0.5	0	0	112.1	A750 N751 Q752 Q757 A758	A750-Q754 WeakPolarHBondContact O-CB 3.49Å; A750-Q754 PolarHBondContact O-N 3.42Å; N751-Q754 PolarHBondContact O-N 2.9Å; Q752-Q754 VanDerWaalsContact C-N 3.27Å; Q752-Q754 PolarHBondContact O-N 3.23Å; Q754-Q757 PolarHBondContact O-N 2.93Å; Q754-A758 PolarHBondContact O-N 3.38Å
755	A	83.1	Confident	74	Confident	51 Å²	51	92.6 Å²	92.6	42%	0.421	48%	0.475	S	S	.	.	H	α-helix	trans	-62	-49.7	174.7	0	0	0	0	0	111.6	N751 Q752 Q757 A758 D759	N751-A755 PolarHBondContact O-N 2.9Å; Q752-A755 PolarHBondContact O-N 3.41Å; A755-Q757 PolarHBondContact O-N 3.15Å; A755-A758 WeakPolarHBondContact O-CB 3.4Å; A755-A758 PolarHBondContact O-N 3.3Å; A755-D759 PolarHBondContact O-N 2.98Å; A755-D759 VanDerWaalsContact O-N 3.08Å
756	V	81	Confident	72	Confident	34 Å²	34	91 Å²	91	21%	0.206	48%	0.484	C	S	.	.	H	α-helix	trans	-60.4	-27.6	175.5	175.5	0	0	0	0	112.3	Q752 I774 K778 L781	Q752-V756 WeakPolarHBondContact O-CG2 3.27Å; Q752-V756 PolarHBondContact O-N 3.38Å; V756-I774 HydrophobicContact CG1-CG2 4.02Å; V756-K778 HydrophobicContact CG1-CB 4.44Å; V756-L781 HydrophobicContact CG2-CD1 4.3Å
757	Q	75.6	Confident	70.1	Confident	80 Å²	80	94.6 Å²	94.6	37%	0.374	50%	0.503	S	S	.	.	H	α-helix	trans	-79.6	-26.2	172	-75.8	175.2	45.5	0	0	114.1	L753 Q754 A755	L753-Q757 VanDerWaalsContact CG-NE2 3.31Å; L753-Q757 WeakPolarHBondContact O-CB 3.09Å; L753-Q757 VanDerWaalsContact O-CG 3.23Å; L753-Q757 WeakPolarHBondContact O-CG 3.42Å; L753-Q757 PolarHBondContact O-N 2.92Å; L753-Q757 VanDerWaalsContact O-N 3.16Å; L753-Q757 PolarHBondContact O-NE2 2.98Å; Q754-Q757 PolarHBondContact O-N 2.93Å; A755-Q757 PolarHBondContact O-N 3.15Å
758	A	74.6	Confident	68.4	Low	64 Å²	64	97 Å²	97	53%	0.529	52%	0.523	S	S	.	.	H	α-helix	trans	-79	-37.3	179.1	0	0	0	0	0	112.4	Q754 A755 H760 F761	Q754-A758 PolarHBondContact O-N 3.38Å; A755-A758 WeakPolarHBondContact O-CB 3.4Å; A755-A758 PolarHBondContact O-N 3.3Å; A758-H760 PolarHBondContact O-N 3.47Å; A758-F761 PolarHBondContact O-N 3.42Å; A758-F761 VanDerWaalsContact O-N 3.14Å
759	D	66.1	Low	66.6	Low	94 Å²	94	100.5 Å²	100.5	50%	0.503	54%	0.538	S	S	.	.	H	α-helix	trans	-64.8	-26.5	177	-79.9	-54.5	0	0	0	113	A755 F761 K762	A755-D759 PolarHBondContact O-N 2.98Å; A755-D759 VanDerWaalsContact O-N 3.08Å; D759-F761 PolarHBondContact O-N 3.48Å; D759-K762 PolarHBondContact O-N 2.87Å; D759-K762 WeakPolarHBondContact OD1-CE 3.43Å; D759-K762 IonicContact OD1-NZ 2.69Å; D759-K762 PolarHBondContact OD1-NZ 2.88Å
760	H	59	Low	65.2	Low	123 Å²	123	105.3 Å²	105.3	57%	0.569	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	-6.5	173.3	-162.3	-50.8	0	0	0	114.1	A758	A758-H760 PolarHBondContact O-N 3.47Å
761	F	54.4	Low	63.9	Low	187 Å²	187	108.6 Å²	108.6	82%	0.82	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	5.9	178.1	-92.4	-86.9	0	0	0	114.9	A758 D759	A758-F761 PolarHBondContact O-N 3.42Å; A758-F761 VanDerWaalsContact O-N 3.14Å; D759-F761 PolarHBondContact O-N 3.48Å
762	K	53.9	Low	62.8	Low	153 Å²	153	109.9 Å²	109.9	67%	0.665	58%	0.579	S	S	*	*			trans	-88.4	122.9	173.5	-67.9	167.2	-179.3	163.2	0	110.7	D759	D759-K762 PolarHBondContact O-N 2.87Å; D759-K762 WeakPolarHBondContact OD1-CE 3.43Å; D759-K762 IonicContact OD1-NZ 2.69Å; D759-K762 PolarHBondContact OD1-NZ 2.88Å
763	P	48.3	Very low	61.8	Low	113 Å²	113	112 Å²	112	73%	0.734	59%	0.588	S	S	*	*			trans	-90.3	129.5	-178.2	32.7	-32.3	0	0	0	113.5
764	H	42.5	Very low	60.9	Low	176 Å²	176	114.6 Å²	114.6	82%	0.815	60%	0.602	S	S	*	*			trans	68.1	147	173.5	-71.4	50.2	0	0	0	115.3
765	D	41.8	Very low	60.4	Low	141 Å²	141	111.4 Å²	111.4	75%	0.754	59%	0.594	S	S	*	*			cis	-130.5	147.5	14.3	-96.7	-49.7	0	0	0	114.9
766	A	49.3	Very low	60.2	Low	89 Å²	89	112.7 Å²	112.7	74%	0.736	59%	0.594	S	S	*	*			trans	37.7	88.2	148.9	0	0	0	0	0	122.2
767	N	48.1	Very low	60.2	Low	113 Å²	113	116.5 Å²	116.5	60%	0.604	61%	0.609	S	S	*	*			trans	-165.4	113.9	137.6	-112.8	-14.3	0	0	0	113.5	I769	N767-I769 PolarHBondContact O-N 3.05Å
768	M	53.9	Low	60.5	Low	185 Å²	185	115.5 Å²	115.5	91%	0.911	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	24	-176.1	-75.5	-168.7	69.2	0	0	115.7
769	I	53.8	Low	60.9	Low	130 Å²	130	119 Å²	119	67%	0.667	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.5	-36.7	-177.5	-60.8	-179.8	0	0	0	111.5	N767	N767-I769 PolarHBondContact O-N 3.05Å
770	E	55.7	Low	61.9	Low	115 Å²	115	121.6 Å²	121.6	54%	0.537	61%	0.614	S	S	.	*	H	α-helix	trans	-75.6	-30	-173.8	-65.9	171	-159	0	0	113	N772 E773 I774	E770-N772 PolarHBondContact O-N 3.34Å; E770-N772 VanDerWaalsContact O-N 3.11Å; E770-E773 PolarHBondContact O-N 3.17Å; E770-E773 VanDerWaalsContact O-N 3.16Å; E770-I774 WeakPolarHBondContact O-CG1 3.49Å; E770-I774 PolarHBondContact O-N 3.15Å; E770-I774 VanDerWaalsContact O-N 3.09Å
771	D	58.8	Low	63.2	Low	111 Å²	111	117 Å²	117	59%	0.594	59%	0.593	S	S	*	*	H	α-helix	trans	-52.1	-36	177.2	-83.8	-31	0	0	0	113.2	S775	D771-S775 VanDerWaalsContact O-CB 3.22Å; D771-S775 WeakPolarHBondContact O-CB 3.3Å; D771-S775 PolarHBondContact O-N 2.94Å
772	N	62.7	Low	64.6	Low	106 Å²	106	113.7 Å²	113.7	57%	0.567	58%	0.578	S	S	*	*	H	α-helix	trans	-77.1	-36.3	-176.1	-163	79	0	0	0	112.2	E770 S775 D776	E770-N772 PolarHBondContact O-N 3.34Å; E770-N772 VanDerWaalsContact O-N 3.11Å; N772-S775 WeakPolarHBondContact O-CB 3.44Å; N772-S775 PolarHBondContact O-N 3.41Å; N772-D776 PolarHBondContact O-N 2.82Å
773	E	65.8	Low	66.2	Low	139 Å²	139	112 Å²	112	65%	0.65	57%	0.573	S	S	*	*	H	α-helix	trans	-67.6	-44.8	174.4	-61.8	-167	148.3	0	0	110.6	E770 S775 D776 E777	E770-E773 PolarHBondContact O-N 3.17Å; E770-E773 VanDerWaalsContact O-N 3.16Å; E773-S775 VanDerWaalsContact C-N 3.27Å; E773-S775 PolarHBondContact O-N 2.87Å; E773-D776 PolarHBondContact O-N 3.28Å; E773-E777 WeakPolarHBondContact O-CG 3.39Å; E773-E777 PolarHBondContact O-N 3.08Å
774	I	67	Low	68.1	Low	71 Å²	71	110.1 Å²	110.1	36%	0.364	56%	0.557	S	S	.	*	H	α-helix	trans	-61	-36.8	175.2	-63.1	167.1	0	0	0	111.1	V756 E770 K778	V756-I774 HydrophobicContact CG1-CG2 4.02Å; E770-I774 WeakPolarHBondContact O-CG1 3.49Å; E770-I774 PolarHBondContact O-N 3.15Å; E770-I774 VanDerWaalsContact O-N 3.09Å; I774-K778 WeakPolarHBondContact O-CB 3.4Å; I774-K778 PolarHBondContact O-N 3.01Å
775	S	73.5	Confident	70.2	Confident	65 Å²	65	103 Å²	103	46%	0.455	53%	0.525	S	S	.	.	H	α-helix	trans	-64.7	-45.5	174.8	-173.6	0	0	0	0	112.6	D771 N772 E773 K778 K779	D771-S775 VanDerWaalsContact O-CB 3.22Å; D771-S775 WeakPolarHBondContact O-CB 3.3Å; D771-S775 PolarHBondContact O-N 2.94Å; N772-S775 WeakPolarHBondContact O-CB 3.44Å; N772-S775 PolarHBondContact O-N 3.41Å; E773-S775 VanDerWaalsContact C-N 3.27Å; E773-S775 PolarHBondContact O-N 2.87Å; S775-K778 PolarHBondContact O-N 3.47Å; S775-K779 WeakPolarHBondContact O-CB 3.38Å; S775-K779 PolarHBondContact O-N 2.69Å
776	D	78.6	Confident	72.3	Confident	78 Å²	78	103.1 Å²	103.1	42%	0.417	52%	0.52	S	S	.	.	H	α-helix	trans	-71.2	-34	177.5	-87	-37.8	0	0	0	112.4	N772 E773 K779 K780	N772-D776 PolarHBondContact O-N 2.82Å; E773-D776 PolarHBondContact O-N 3.28Å; D776-K779 PolarHBondContact O-N 2.83Å; D776-K779 IonicContact OD1-NZ 3.55Å; D776-K780 VanDerWaalsContact O-CB 3.22Å; D776-K780 WeakPolarHBondContact O-CB 3.46Å; D776-K780 PolarHBondContact O-N 3.1Å
777	E	81.4	Confident	74.2	Confident	114 Å²	114	102.4 Å²	102.4	53%	0.533	50%	0.502	S	S	.	.	H	α-helix	trans	-62.6	-46.3	169.7	-72.1	-153.8	140.8	0	0	112.1	E773 K779 K780 L781	E773-E777 WeakPolarHBondContact O-CG 3.39Å; E773-E777 PolarHBondContact O-N 3.08Å; E777-K779 VanDerWaalsContact C-N 3.27Å; E777-K779 PolarHBondContact O-N 3.22Å; E777-K780 PolarHBondContact O-N 3.28Å; E777-L781 WeakPolarHBondContact O-CB 3.37Å; E777-L781 WeakPolarHBondContact O-CG 3.45Å; E777-L781 PolarHBondContact O-N 3.32Å
778	K	82	Confident	75.9	Confident	58 Å²	58	97.6 Å²	97.6	25%	0.252	48%	0.477	S	S	.	.	H	α-helix	trans	-59.2	-37.2	175.7	-179.5	178.2	-177.5	173.4	0	112.1	L753 V756 I774 S775 K782	L753-K778 HydrophobicContact CD1-CG 3.96Å; V756-K778 HydrophobicContact CG1-CB 4.44Å; I774-K778 WeakPolarHBondContact O-CB 3.4Å; I774-K778 PolarHBondContact O-N 3.01Å; S775-K778 PolarHBondContact O-N 3.47Å; K778-K782 WeakPolarHBondContact O-CG 3.46Å; K778-K782 PolarHBondContact O-N 2.69Å
779	K	82.9	Confident	77.4	Confident	138 Å²	138	93 Å²	93	60%	0.6	45%	0.454	S	S	*	.	H	α-helix	trans	-70.2	-43.6	174.7	-178	-179.1	171.1	-168	0	112.1	S775 D776 E777 K782 Q783	S775-K779 WeakPolarHBondContact O-CB 3.38Å; S775-K779 PolarHBondContact O-N 2.69Å; D776-K779 PolarHBondContact O-N 2.83Å; D776-K779 IonicContact OD1-NZ 3.55Å; E777-K779 VanDerWaalsContact C-N 3.27Å; E777-K779 PolarHBondContact O-N 3.22Å; K779-K782 PolarHBondContact O-N 3.31Å; K779-Q783 PolarHBondContact O-N 2.73Å
780	K	86.1	Confident	79.1	Confident	149 Å²	149	93.8 Å²	93.8	65%	0.648	46%	0.455	S	S	*	.	H	α-helix	trans	-64.3	-40	176.3	-175	-179.5	-179.6	-175.7	0	112.4	D776 E777 Q783 N784	D776-K780 VanDerWaalsContact O-CB 3.22Å; D776-K780 WeakPolarHBondContact O-CB 3.46Å; D776-K780 PolarHBondContact O-N 3.1Å; E777-K780 PolarHBondContact O-N 3.28Å; K780-Q783 PolarHBondContact O-N 2.81Å; K780-N784 WeakPolarHBondContact O-CB 3.34Å; K780-N784 PolarHBondContact O-N 2.98Å
781	L	86	Confident	80.7	Confident	25 Å²	25	92.9 Å²	92.9	13%	0.131	45%	0.449	C	S	.	.	H	α-helix	trans	-63.4	-43.8	172.6	-77.6	170.1	0	0	0	111.8	Q752 L753 V756 E777 N784 I785	Q752-L781 HydrophobicContact CB-CD2 4.4Å; L753-L781 HydrophobicContact CB-CB 4.29Å; L753-L781 HydrophobicContact CB-CD1 4.36Å; L753-L781 HydrophobicContact CD1-CB 4.14Å; L753-L781 HydrophobicContact CD1-CD1 4.48Å; V756-L781 HydrophobicContact CG2-CD1 4.3Å; E777-L781 WeakPolarHBondContact O-CB 3.37Å; E777-L781 WeakPolarHBondContact O-CG 3.45Å; E777-L781 PolarHBondContact O-N 3.32Å; L781-N784 PolarHBondContact O-N 3.4Å; L781-I785 WeakPolarHBondContact O-CG1 3.37Å; L781-I785 PolarHBondContact O-N 2.9Å
782	K	84.1	Confident	82.1	Confident	118 Å²	118	88.4 Å²	88.4	51%	0.513	43%	0.425	S	S	.	.	H	α-helix	trans	-60.3	-45	173.7	-78.9	-172.5	174.1	-164	0	112.7	L753 K778 K779 N784 I785 E786	L753-K782 HydrophobicContact CD1-CG 4.37Å; L753-K782 HydrophobicContact CD2-CG 3.7Å; K778-K782 WeakPolarHBondContact O-CG 3.46Å; K778-K782 PolarHBondContact O-N 2.69Å; K779-K782 PolarHBondContact O-N 3.31Å; K782-N784 VanDerWaalsContact C-N 3.33Å; K782-N784 PolarHBondContact O-N 2.91Å; K782-I785 WeakPolarHBondContact O-CB 3.41Å; K782-I785 PolarHBondContact O-N 3.32Å; K782-E786 PolarHBondContact O-N 3.08Å
783	Q	87.6	Confident	83.2	Confident	118 Å²	118	87.9 Å²	87.9	55%	0.551	42%	0.421	S	S	*	.	H	α-helix	trans	-60.5	-42.6	176.1	-177	-177.3	-29.1	0	0	111.7	K779 K780 I785 E786 E787	K779-Q783 PolarHBondContact O-N 2.73Å; K780-Q783 PolarHBondContact O-N 2.81Å; Q783-I785 VanDerWaalsContact C-N 3.31Å; Q783-I785 PolarHBondContact O-N 2.81Å; Q783-E786 PolarHBondContact O-N 3.43Å; Q783-E787 HydrophobicContact CG-CG 4.43Å; Q783-E787 PolarHBondContact NE2-OE1 3.35Å; Q783-E787 VanDerWaalsContact O-CB 3.3Å; Q783-E787 WeakPolarHBondContact O-CB 3.3Å; Q783-E787 WeakPolarHBondContact O-CG 3.44Å; Q783-E787 PolarHBondContact O-N 3.43Å
784	N	87.7	Confident	84.3	Confident	74 Å²	74	87.6 Å²	87.6	40%	0.396	42%	0.417	S	S	.	.	H	α-helix	trans	-64.2	-35.5	178	-166	2.2	0	0	0	112.2	K780 L781 K782 T788	K780-N784 WeakPolarHBondContact O-CB 3.34Å; K780-N784 PolarHBondContact O-N 2.98Å; L781-N784 PolarHBondContact O-N 3.4Å; K782-N784 VanDerWaalsContact C-N 3.33Å; K782-N784 PolarHBondContact O-N 2.91Å; N784-T788 WeakPolarHBondContact O-CB 3.31Å; N784-T788 WeakPolarHBondContact O-CG2 3.49Å; N784-T788 PolarHBondContact O-N 2.83Å; N784-T788 PolarHBondContact O-OG1 3.37Å
785	I	87.4	Confident	85.1	Confident	27 Å²	27	87.4 Å²	87.4	14%	0.138	41%	0.412	C	S	.	.	H	α-helix	trans	-64.2	-50.5	172.2	-74.7	166.3	0	0	0	110.9	L746 T749 A750 L753 L781 K782 Q783 E787 T788 M789	L746-I785 HydrophobicContact CD1-CB 4.36Å; L746-I785 HydrophobicContact CD1-CG1 4.4Å; L746-I785 HydrophobicContact CD1-CG2 3.88Å; T749-I785 WeakPolarHBondContact OG1-CG1 3.5Å; A750-I785 HydrophobicContact CB-CD1 4.48Å; L753-I785 HydrophobicContact CB-CD1 4.15Å; L753-I785 HydrophobicContact CD2-CD1 3.52Å; L753-I785 HydrophobicContact CG-CD1 4.46Å; L781-I785 WeakPolarHBondContact O-CG1 3.37Å; L781-I785 PolarHBondContact O-N 2.9Å; K782-I785 WeakPolarHBondContact O-CB 3.41Å; K782-I785 PolarHBondContact O-N 3.32Å; Q783-I785 VanDerWaalsContact C-N 3.31Å; Q783-I785 PolarHBondContact O-N 2.81Å; I785-E787 PolarHBondContact O-N 3.4Å; I785-T788 WeakPolarHBondContact CA-OG1 3.29Å; I785-T788 PolarHBondContact O-N 2.88Å; I785-T788 VanDerWaalsContact O-N 3.16Å; I785-T788 PolarHBondContact O-OG1 2.98Å; I785-T788 VanDerWaalsContact O-OG1 3.06Å; I785-M789 HydrophobicContact CG2-SD 4.18Å; I785-M789 WeakPolarHBondContact O-CG 3.44Å; I785-M789 PolarHBondContact O-N 3.26Å
786	E	85.9	Confident	85.6	Confident	142 Å²	142	88 Å²	88	66%	0.664	41%	0.407	S	S	*	.	H	α-helix	trans	-57	-49	176.8	-157.9	79.7	-128.4	0	0	111.2	K782 Q783 T788 M789 E790	K782-E786 PolarHBondContact O-N 3.08Å; Q783-E786 PolarHBondContact O-N 3.43Å; E786-T788 VanDerWaalsContact C-N 3.3Å; E786-T788 PolarHBondContact O-N 3.17Å; E786-M789 PolarHBondContact O-N 3.46Å; E786-E790 PolarHBondContact O-N 3.34Å
787	E	88.4	Confident	86.1	Confident	74 Å²	74	90.6 Å²	90.6	35%	0.346	42%	0.415	S	S	.	.	H	α-helix	trans	-64.1	-27.8	178	-85.6	-166.2	-132.8	0	0	114.1	Q783 I785 K791	Q783-E787 HydrophobicContact CG-CG 4.43Å; Q783-E787 PolarHBondContact NE2-OE1 3.35Å; Q783-E787 VanDerWaalsContact O-CB 3.3Å; Q783-E787 WeakPolarHBondContact O-CB 3.3Å; Q783-E787 WeakPolarHBondContact O-CG 3.44Å; Q783-E787 PolarHBondContact O-N 3.43Å; I785-E787 PolarHBondContact O-N 3.4Å; E787-K791 WeakPolarHBondContact O-CD 3.37Å; E787-K791 WeakPolarHBondContact O-CE 3.39Å; E787-K791 WeakPolarHBondContact O-CG 3.35Å; E787-K791 PolarHBondContact O-NZ 3.08Å; E787-K791 IonicContact OE2-NZ 2.66Å; E787-K791 PolarHBondContact OE2-NZ 2.73Å
788	T	85.1	Confident	86.4	Confident	13 Å²	13	88.3 Å²	88.3	8%	0.08	40%	0.404	C	S	.	.	H	α-helix	trans	-85.4	-32.8	175.9	44.7	0	0	0	0	111.8	N784 I785 E786 K791 L792	N784-T788 WeakPolarHBondContact O-CB 3.31Å; N784-T788 WeakPolarHBondContact O-CG2 3.49Å; N784-T788 PolarHBondContact O-N 2.83Å; N784-T788 PolarHBondContact O-OG1 3.37Å; I785-T788 WeakPolarHBondContact CA-OG1 3.29Å; I785-T788 PolarHBondContact O-N 2.88Å; I785-T788 VanDerWaalsContact O-N 3.16Å; I785-T788 PolarHBondContact O-OG1 2.98Å; I785-T788 VanDerWaalsContact O-OG1 3.06Å; E786-T788 VanDerWaalsContact C-N 3.3Å; E786-T788 PolarHBondContact O-N 3.17Å; T788-K791 PolarHBondContact O-N 2.98Å; T788-L792 WeakPolarHBondContact O-CB 3.04Å; T788-L792 PolarHBondContact O-N 3.46Å
789	M	85.4	Confident	86.6	Confident	88 Å²	88	86.2 Å²	86.2	43%	0.433	40%	0.396	S	S	.	.	H	α-helix	trans	-64	-41.2	170.2	-71	-176.7	68.1	0	0	112.3	L746 I785 E786 K791 L792 M793	L746-M789 HydrophobicContact CD1-CG 3.59Å; L746-M789 HydrophobicContact CD1-SD 4.35Å; L746-M789 HydrophobicContact CD2-CG 3.88Å; L746-M789 HydrophobicContact CG-CG 4.42Å; I785-M789 HydrophobicContact CG2-SD 4.18Å; I785-M789 WeakPolarHBondContact O-CG 3.44Å; I785-M789 PolarHBondContact O-N 3.26Å; E786-M789 PolarHBondContact O-N 3.46Å; M789-K791 PolarHBondContact O-N 2.97Å; M789-L792 WeakPolarHBondContact O-CB 3.47Å; M789-L792 PolarHBondContact O-N 3.07Å; M789-M793 WeakPolarHBondContact O-CB 3.4Å; M789-M793 VanDerWaalsContact O-CG 3.24Å; M789-M793 WeakPolarHBondContact O-CG 3.46Å; M789-M793 PolarHBondContact O-N 3.12Å
790	E	89	Confident	86.8	Confident	147 Å²	147	87.2 Å²	87.2	69%	0.687	40%	0.401	S	S	*	.	H	α-helix	trans	-64	-41.6	176	-170.2	-179.8	-154.6	0	0	111.8	E786 M793 K794	E786-E790 PolarHBondContact O-N 3.34Å; E790-M793 PolarHBondContact O-N 3.37Å; E790-K794 WeakPolarHBondContact O-CB 3.46Å; E790-K794 PolarHBondContact O-N 3.35Å
791	K	88.6	Confident	86.9	Confident	95 Å²	95	83.6 Å²	83.6	41%	0.413	39%	0.392	S	S	.	.	H	α-helix	trans	-65.3	-37.7	176.7	-68.8	162.4	-159.7	151	0	111.7	L742 E787 T788 M789 R795	L742-K791 HydrophobicContact CD1-CB 4.44Å; L742-K791 HydrophobicContact CD2-CB 4.46Å; E787-K791 WeakPolarHBondContact O-CD 3.37Å; E787-K791 WeakPolarHBondContact O-CE 3.39Å; E787-K791 WeakPolarHBondContact O-CG 3.35Å; E787-K791 PolarHBondContact O-NZ 3.08Å; E787-K791 IonicContact OE2-NZ 2.66Å; E787-K791 PolarHBondContact OE2-NZ 2.73Å; T788-K791 PolarHBondContact O-N 2.98Å; M789-K791 PolarHBondContact O-N 2.97Å; K791-R795 WeakPolarHBondContact O-CG 3.15Å; K791-R795 PolarHBondContact O-N 2.94Å
792	L	88.3	Confident	86.7	Confident	17 Å²	17	84 Å²	84	9%	0.089	39%	0.394	C	S	.	.	H	α-helix	trans	-63.2	-56.4	172.6	-174.8	75.9	0	0	0	111.2	I739 L742 E743 L746 T788 M789 K794 R795 E796	I739-L792 HydrophobicContact CB-CD1 4.45Å; I739-L792 HydrophobicContact CG2-CD1 3.91Å; L742-L792 HydrophobicContact CB-CD1 3.79Å; E743-L792 HydrophobicContact CG-CD1 3.87Å; L746-L792 HydrophobicContact CD2-CD2 4.45Å; T788-L792 WeakPolarHBondContact O-CB 3.04Å; T788-L792 PolarHBondContact O-N 3.46Å; M789-L792 WeakPolarHBondContact O-CB 3.47Å; M789-L792 PolarHBondContact O-N 3.07Å; L792-K794 PolarHBondContact O-N 3.01Å; L792-K794 VanDerWaalsContact O-N 3.1Å; L792-R795 WeakPolarHBondContact O-CA 3.32Å; L792-R795 PolarHBondContact O-N 3.49Å; L792-E796 HydrophobicContact CG-CG 4.44Å; L792-E796 WeakPolarHBondContact O-CG 3.4Å; L792-E796 PolarHBondContact O-N 3.39Å
793	M	86.1	Confident	86.7	Confident	96 Å²	96	80.2 Å²	80.2	47%	0.473	38%	0.382	S	S	.	.	H	α-helix	trans	-58.3	-25.7	-179.7	-74.5	-75.9	-68.5	0	0	113.7	M789 E790 K797	M789-M793 WeakPolarHBondContact O-CB 3.4Å; M789-M793 VanDerWaalsContact O-CG 3.24Å; M789-M793 WeakPolarHBondContact O-CG 3.46Å; M789-M793 PolarHBondContact O-N 3.12Å; E790-M793 PolarHBondContact O-N 3.37Å; M793-K797 VanDerWaalsContact O-CD 3.29Å; M793-K797 WeakPolarHBondContact O-CD 2.94Å; M793-K797 WeakPolarHBondContact O-CE 2.78Å; M793-K797 WeakPolarHBondContact O-CG 3.42Å
794	K	88.9	Confident	86.6	Confident	132 Å²	132	78.2 Å²	78.2	57%	0.574	38%	0.381	S	S	*	.	H	α-helix	trans	-74.6	-45.7	171	-170.9	-178.4	178.8	-167.5	0	111.5	E790 L792 K797 E798	E790-K794 WeakPolarHBondContact O-CB 3.46Å; E790-K794 PolarHBondContact O-N 3.35Å; L792-K794 PolarHBondContact O-N 3.01Å; L792-K794 VanDerWaalsContact O-N 3.1Å; K794-K797 WeakPolarHBondContact O-CB 3.35Å; K794-K797 PolarHBondContact O-N 3.43Å; K794-E798 WeakPolarHBondContact CE-OE1 3.41Å; K794-E798 IonicContact NZ-OE1 2.69Å; K794-E798 PolarHBondContact O-N 3.22Å; K794-E798 VanDerWaalsContact O-N 3.11Å
795	R	84.5	Confident	86.6	Confident	67 Å²	67	79.3 Å²	79.3	25%	0.253	38%	0.384	S	S	.	.	H	α-helix	trans	-68.5	-36	-179.1	-74.2	-75.8	160.1	79	-45	113.5	E738 I739 L742 K791 L792 K797 E798 V799	E738-R795 IonicContact OE1-CZ 3.07Å; E738-R795 IonicContact OE1-NH1 3.07Å; E738-R795 PolarHBondContact OE1-NH1 2.95Å; E738-R795 IonicContact OE1-NH2 2.68Å; E738-R795 IonicContact OE2-CZ 2.87Å; E738-R795 IonicContact OE2-NE 2.67Å; E738-R795 IonicContact OE2-NH1 3.03Å; E738-R795 PolarHBondContact OE2-NH1 2.95Å; E738-R795 IonicContact OE2-NH2 3.49Å; E738-R795 PolarHBondContact OE2-NH2 3.38Å; I739-R795 HydrophobicContact CD1-CB 4.35Å; I739-R795 HydrophobicContact CG1-CB 3.81Å; L742-R795 HydrophobicContact CD1-CG 4.3Å; K791-R795 WeakPolarHBondContact O-CG 3.15Å; K791-R795 PolarHBondContact O-N 2.94Å; L792-R795 WeakPolarHBondContact O-CA 3.32Å; L792-R795 PolarHBondContact O-N 3.49Å; R795-K797 VanDerWaalsContact C-N 3.27Å; R795-K797 PolarHBondContact O-N 3.1Å; R795-E798 VanDerWaalsContact CD-OE2 3.25Å; R795-E798 WeakPolarHBondContact CD-OE2 3.28Å; R795-E798 IonicContact NE-OE2 3.76Å; R795-E798 PolarHBondContact NE-OE2 3.09Å; R795-E798 PolarHBondContact O-N 2.87Å; R795-V799 PolarHBondContact O-N 2.95Å
796	E	84.5	Confident	86.3	Confident	77 Å²	77	78.3 Å²	78.3	36%	0.36	38%	0.379	S	S	.	.	H	α-helix	trans	-58.3	-40.2	172.3	-69.5	172	153.9	0	0	111.9	I739 L792 V799 F800	I739-E796 HydrophobicContact CD1-CG 4.05Å; L792-E796 HydrophobicContact CG-CG 4.44Å; L792-E796 WeakPolarHBondContact O-CG 3.4Å; L792-E796 PolarHBondContact O-N 3.39Å; E796-V799 PolarHBondContact O-N 2.85Å; E796-F800 WeakPolarHBondContact O-CB 3.31Å; E796-F800 PolarHBondContact O-N 2.91Å
797	K	89.3	Confident	86.3	Confident	133 Å²	133	76 Å²	76	58%	0.578	37%	0.368	S	S	*	.	H	α-helix	trans	-69.4	-38.9	175.4	-66.5	167.2	-172.3	167.1	0	112.1	M793 K794 R795 F800 T801	M793-K797 VanDerWaalsContact O-CD 3.29Å; M793-K797 WeakPolarHBondContact O-CD 2.94Å; M793-K797 WeakPolarHBondContact O-CE 2.78Å; M793-K797 WeakPolarHBondContact O-CG 3.42Å; K794-K797 WeakPolarHBondContact O-CB 3.35Å; K794-K797 PolarHBondContact O-N 3.43Å; R795-K797 VanDerWaalsContact C-N 3.27Å; R795-K797 PolarHBondContact O-N 3.1Å; K797-F800 PolarHBondContact O-N 3.16Å; K797-T801 WeakPolarHBondContact O-CG2 3.48Å; K797-T801 PolarHBondContact O-N 2.86Å; K797-T801 VanDerWaalsContact O-N 3.1Å; K797-T801 PolarHBondContact O-OG1 3.06Å
798	E	86.5	Confident	86.2	Confident	67 Å²	67	74.7 Å²	74.7	31%	0.313	37%	0.37	S	S	.	.	H	α-helix	trans	-62	-48.1	173.5	-70.1	169.4	-173.7	0	0	110.4	K794 R795 F800 T801 L802	K794-E798 WeakPolarHBondContact CE-OE1 3.41Å; K794-E798 IonicContact NZ-OE1 2.69Å; K794-E798 PolarHBondContact O-N 3.22Å; K794-E798 VanDerWaalsContact O-N 3.11Å; R795-E798 VanDerWaalsContact CD-OE2 3.25Å; R795-E798 WeakPolarHBondContact CD-OE2 3.28Å; R795-E798 IonicContact NE-OE2 3.76Å; R795-E798 PolarHBondContact NE-OE2 3.09Å; R795-E798 PolarHBondContact O-N 2.87Å; E798-F800 PolarHBondContact O-N 3.09Å; E798-T801 PolarHBondContact O-N 3.08Å; E798-T801 PolarHBondContact O-OG1 2.82Å; E798-L802 WeakPolarHBondContact O-CG 3.31Å; E798-L802 PolarHBondContact O-N 3.49Å
799	V	86.3	Confident	86	Confident	14 Å²	14	75.8 Å²	75.8	9%	0.085	38%	0.375	C	S	.	.	H	α-helix	trans	-63.2	-39.3	175.1	170.5	0	0	0	0	112.5	S735 Q736 I739 R795 E796 L802 S803	S735-V799 VanDerWaalsContact OG-CG2 3.28Å; S735-V799 WeakPolarHBondContact OG-CG2 3.44Å; Q736-V799 HydrophobicContact CG-CG1 3.75Å; Q736-V799 HydrophobicContact CG-CG2 4.19Å; I739-V799 HydrophobicContact CD1-CB 4.02Å; I739-V799 HydrophobicContact CD1-CG2 3.6Å; R795-V799 PolarHBondContact O-N 2.95Å; E796-V799 PolarHBondContact O-N 2.85Å; V799-L802 PolarHBondContact O-N 3.04Å; V799-S803 VanDerWaalsContact O-CB 3.25Å; V799-S803 WeakPolarHBondContact O-CB 3.5Å; V799-S803 PolarHBondContact O-N 2.92Å; V799-S803 PolarHBondContact O-OG 3.26Å
800	F	87.6	Confident	85.9	Confident	159 Å²	159	76.2 Å²	76.2	70%	0.697	38%	0.375	S	S	*	.	H	α-helix	trans	-61.4	-44.7	177.4	-177.8	-95.2	0	0	0	111.8	E796 K797 E798 S803 S804	E796-F800 WeakPolarHBondContact O-CB 3.31Å; E796-F800 PolarHBondContact O-N 2.91Å; K797-F800 PolarHBondContact O-N 3.16Å; E798-F800 PolarHBondContact O-N 3.09Å; F800-S803 PolarHBondContact O-N 3.44Å; F800-S804 PolarHBondContact O-N 2.98Å; F800-S804 VanDerWaalsContact O-N 3.13Å
801	T	86.8	Confident	85.7	Confident	73 Å²	73	73.5 Å²	73.5	45%	0.448	37%	0.368	S	S	.	.	H	α-helix	trans	-68.6	-42.3	178.4	57.1	0	0	0	0	112.2	K797 E798 S803 S804 Q805	K797-T801 WeakPolarHBondContact O-CG2 3.48Å; K797-T801 PolarHBondContact O-N 2.86Å; K797-T801 VanDerWaalsContact O-N 3.1Å; K797-T801 PolarHBondContact O-OG1 3.06Å; E798-T801 PolarHBondContact O-N 3.08Å; E798-T801 PolarHBondContact O-OG1 2.82Å; T801-S803 PolarHBondContact O-N 2.71Å; T801-S804 PolarHBondContact O-N 2.86Å; T801-Q805 WeakPolarHBondContact O-CG 3.44Å; T801-Q805 PolarHBondContact O-N 2.75Å; T801-Q805 VanDerWaalsContact O-N 3.17Å
802	L	83.4	Confident	85.4	Confident	34 Å²	34	73.5 Å²	73.5	18%	0.178	37%	0.37	C	S	.	.	H	α-helix	trans	-60.8	-44	173.8	-70.7	171.2	0	0	0	112.1	L728 Q732 E798 V799 S804 Q805 V806	L728-L802 HydrophobicContact CD2-CD2 3.68Å; Q732-L802 HydrophobicContact CB-CB 4.34Å; Q732-L802 HydrophobicContact CG-CB 4.47Å; E798-L802 WeakPolarHBondContact O-CG 3.31Å; E798-L802 PolarHBondContact O-N 3.49Å; V799-L802 PolarHBondContact O-N 3.04Å; L802-S804 VanDerWaalsContact C-N 3.31Å; L802-S804 PolarHBondContact O-N 3.06Å; L802-Q805 PolarHBondContact O-N 3.42Å; L802-Q805 VanDerWaalsContact O-N 3.15Å; L802-V806 WeakPolarHBondContact O-CG2 3.48Å; L802-V806 PolarHBondContact O-N 3.25Å
803	S	83.1	Confident	85	Confident	37 Å²	37	73.8 Å²	73.8	26%	0.259	37%	0.371	S	S	.	.	H	α-helix	trans	-61.1	-39.8	179.1	-57.2	0	0	0	0	112.2	Q732 V799 F800 T801 E807	Q732-S803 PolarHBondContact NE2-OG 3.33Å; V799-S803 VanDerWaalsContact O-CB 3.25Å; V799-S803 WeakPolarHBondContact O-CB 3.5Å; V799-S803 PolarHBondContact O-N 2.92Å; V799-S803 PolarHBondContact O-OG 3.26Å; F800-S803 PolarHBondContact O-N 3.44Å; T801-S803 PolarHBondContact O-N 2.71Å; S803-E807 PolarHBondContact O-N 2.86Å; S803-E807 VanDerWaalsContact O-N 3.12Å
804	S	86.7	Confident	84.6	Confident	77 Å²	77	70.8 Å²	70.8	54%	0.538	36%	0.364	S	S	.	.	H	α-helix	trans	-65.4	-38.3	175.5	-177	0	0	0	0	112.5	F800 T801 L802 A808	F800-S804 PolarHBondContact O-N 2.98Å; F800-S804 VanDerWaalsContact O-N 3.13Å; T801-S804 PolarHBondContact O-N 2.86Å; L802-S804 VanDerWaalsContact C-N 3.31Å; L802-S804 PolarHBondContact O-N 3.06Å; S804-A808 WeakPolarHBondContact O-CB 3.39Å; S804-A808 PolarHBondContact O-N 3.02Å
805	Q	86.4	Confident	84.3	Confident	96 Å²	96	67 Å²	67	45%	0.449	36%	0.358	S	S	.	.	H	α-helix	trans	-69.8	-41.9	176.7	-68.2	173.8	13.4	0	0	112.3	T801 L802 A808 L809	T801-Q805 WeakPolarHBondContact O-CG 3.44Å; T801-Q805 PolarHBondContact O-N 2.75Å; T801-Q805 VanDerWaalsContact O-N 3.17Å; L802-Q805 PolarHBondContact O-N 3.42Å; L802-Q805 VanDerWaalsContact O-N 3.15Å; Q805-A808 PolarHBondContact O-N 3.49Å; Q805-L809 PolarHBondContact O-N 3.02Å
806	V	81.8	Confident	83.9	Confident	7 Å²	7	67.3 Å²	67.3	4%	0.042	36%	0.364	C	S	.	.	H	α-helix	trans	-60.2	-48.5	176.8	168.3	0	0	0	0	110.8	Y725 L728 L802 A808 L809 K810	Y725-V806 HydrophobicContact CE2-CG1 3.75Å; Y725-V806 WeakPolarHBondContact CE2-O 3.47Å; L728-V806 HydrophobicContact CB-CG2 3.96Å; L802-V806 WeakPolarHBondContact O-CG2 3.48Å; L802-V806 PolarHBondContact O-N 3.25Å; V806-A808 VanDerWaalsContact C-N 3.33Å; V806-A808 PolarHBondContact O-N 3.27Å; V806-L809 PolarHBondContact O-N 3.37Å; V806-K810 VanDerWaalsContact O-CB 3.27Å; V806-K810 WeakPolarHBondContact O-CB 3.47Å; V806-K810 PolarHBondContact O-N 3.24Å
807	E	86.1	Confident	83.6	Confident	93 Å²	93	67.8 Å²	67.8	44%	0.435	37%	0.366	S	S	.	.	H	α-helix	trans	-68	-32.4	-179.7	-158.7	64.2	-152.5	0	0	112.5	S803 K810 T811	S803-E807 PolarHBondContact O-N 2.86Å; S803-E807 VanDerWaalsContact O-N 3.12Å; E807-K810 WeakPolarHBondContact OE1-CE 3.43Å; E807-K810 IonicContact OE1-NZ 3.75Å; E807-K810 PolarHBondContact OE1-NZ 2.89Å; E807-K810 WeakPolarHBondContact OE2-CD 3.4Å; E807-K810 IonicContact OE2-NZ 2.73Å; E807-K810 PolarHBondContact OE2-NZ 3.21Å; E807-T811 WeakPolarHBondContact O-CG2 3.29Å; E807-T811 PolarHBondContact O-N 3.49Å; E807-T811 VanDerWaalsContact O-N 3.12Å; E807-T811 PolarHBondContact O-OG1 3.07Å
808	A	85.7	Confident	83.1	Confident	47 Å²	47	64.9 Å²	64.9	39%	0.388	36%	0.363	S	S	.	.	H	α-helix	trans	-69.6	-30.4	173.9	0	0	0	0	0	113.8	S804 Q805 V806 T811 Q812	S804-A808 WeakPolarHBondContact O-CB 3.39Å; S804-A808 PolarHBondContact O-N 3.02Å; Q805-A808 PolarHBondContact O-N 3.49Å; V806-A808 VanDerWaalsContact C-N 3.33Å; V806-A808 PolarHBondContact O-N 3.27Å; A808-T811 PolarHBondContact O-OG1 3Å; A808-Q812 WeakPolarHBondContact O-CG 3.42Å; A808-Q812 PolarHBondContact O-NE2 3.3Å; A808-Q812 VanDerWaalsContact O-NE2 3.1Å
809	L	81.3	Confident	82.7	Confident	36 Å²	36	68.7 Å²	68.7	19%	0.188	38%	0.378	C	S	.	.	H	α-helix	trans	-78.8	-44.1	172.7	-76.3	172.1	0	0	0	111.6	Y725 L728 Q805 V806 T811 Q812 I813	Y725-L809 HydrophobicContact CD2-CB 3.62Å; Y725-L809 HydrophobicContact CD2-CD1 4.28Å; Y725-L809 HydrophobicContact CE2-CB 4.33Å; Y725-L809 HydrophobicContact CG-CB 4.46Å; L728-L809 HydrophobicContact CD1-CD1 3.52Å; Q805-L809 PolarHBondContact O-N 3.02Å; V806-L809 PolarHBondContact O-N 3.37Å; L809-T811 VanDerWaalsContact C-N 3.3Å; L809-T811 PolarHBondContact O-N 3.3Å; L809-Q812 WeakPolarHBondContact O-CA 3.43Å; L809-Q812 WeakPolarHBondContact O-CB 3.33Å; L809-Q812 PolarHBondContact O-N 3.21Å; L809-I813 WeakPolarHBondContact O-CG1 3.49Å; L809-I813 PolarHBondContact O-N 2.97Å
810	K	83.1	Confident	82.3	Confident	97 Å²	97	71.9 Å²	71.9	42%	0.422	40%	0.398	S	S	.	.	H	α-helix	trans	-54.6	-42.2	176.6	178.4	-179.9	165.5	-148.7	0	112.8	Y725 V806 E807 I813 G814	Y725-K810 HydrophobicContact CE2-CB 3.9Å; V806-K810 VanDerWaalsContact O-CB 3.27Å; V806-K810 WeakPolarHBondContact O-CB 3.47Å; V806-K810 PolarHBondContact O-N 3.24Å; E807-K810 WeakPolarHBondContact OE1-CE 3.43Å; E807-K810 IonicContact OE1-NZ 3.75Å; E807-K810 PolarHBondContact OE1-NZ 2.89Å; E807-K810 WeakPolarHBondContact OE2-CD 3.4Å; E807-K810 IonicContact OE2-NZ 2.73Å; E807-K810 PolarHBondContact OE2-NZ 3.21Å; K810-I813 PolarHBondContact O-N 3.47Å; K810-G814 PolarHBondContact O-N 3.33Å
811	T	85.3	Confident	81.8	Confident	90 Å²	90	70.1 Å²	70.1	55%	0.552	39%	0.386	S	S	*	.	H	α-helix	trans	-67.4	-36	174.9	45.3	0	0	0	0	113	E807 A808 L809 A815	E807-T811 WeakPolarHBondContact O-CG2 3.29Å; E807-T811 PolarHBondContact O-N 3.49Å; E807-T811 VanDerWaalsContact O-N 3.12Å; E807-T811 PolarHBondContact O-OG1 3.07Å; A808-T811 PolarHBondContact O-OG1 3Å; L809-T811 VanDerWaalsContact C-N 3.3Å; L809-T811 PolarHBondContact O-N 3.3Å; T811-A815 PolarHBondContact O-N 3.43Å
812	Q	81.5	Confident	81.4	Confident	95 Å²	95	69.4 Å²	69.4	44%	0.444	38%	0.384	S	S	.	.	H	α-helix	trans	-67.2	-40.9	171.8	-71.1	174.8	55.3	0	0	112.3	A808 L809 A815 L816	A808-Q812 WeakPolarHBondContact O-CG 3.42Å; A808-Q812 PolarHBondContact O-NE2 3.3Å; A808-Q812 VanDerWaalsContact O-NE2 3.1Å; L809-Q812 WeakPolarHBondContact O-CA 3.43Å; L809-Q812 WeakPolarHBondContact O-CB 3.33Å; L809-Q812 PolarHBondContact O-N 3.21Å; Q812-A815 PolarHBondContact O-N 3Å; Q812-L816 WeakPolarHBondContact O-CG 3.37Å; Q812-L816 PolarHBondContact O-N 3.4Å
813	I	79.2	Confident	81	Confident	23 Å²	23	69.3 Å²	69.3	12%	0.118	39%	0.392	C	S	.	.	H	α-helix	trans	-61.3	-50.1	178.2	-68.2	162.1	0	0	0	110.3	M722 Y725 L809 K810 A815 L816 E817	M722-I813 HydrophobicContact CE-CG2 4.39Å; M722-I813 HydrophobicContact SD-CB 4.39Å; M722-I813 HydrophobicContact SD-CD1 3.64Å; M722-I813 HydrophobicContact SD-CG1 3.7Å; M722-I813 HydrophobicContact SD-CG2 3.75Å; Y725-I813 HydrophobicContact CD1-CD1 3.75Å; Y725-I813 HydrophobicContact CD2-CD1 3.92Å; Y725-I813 HydrophobicContact CE1-CD1 4.25Å; Y725-I813 HydrophobicContact CE2-CD1 4.37Å; Y725-I813 HydrophobicContact CG-CD1 3.57Å; L809-I813 WeakPolarHBondContact O-CG1 3.49Å; L809-I813 PolarHBondContact O-N 2.97Å; K810-I813 PolarHBondContact O-N 3.47Å; I813-A815 VanDerWaalsContact C-N 3.25Å; I813-A815 PolarHBondContact O-N 3.36Å; I813-L816 WeakPolarHBondContact O-CA 3.37Å; I813-L816 WeakPolarHBondContact O-CB 3.33Å; I813-L816 PolarHBondContact O-N 2.96Å; I813-E817 HydrophobicContact CG2-CG 4.4Å; I813-E817 PolarHBondContact O-N 3.47Å
814	G	79.2	Confident	80.7	Confident	32 Å²	32	73.1 Å²	73.1	33%	0.33	41%	0.406	S	S	.	.	H	α-helix	trans	-58.9	-34.1	177.2	0	0	0	0	0	113.8	K810 S818	K810-G814 PolarHBondContact O-N 3.33Å; G814-S818 WeakPolarHBondContact O-CB 3.41Å; G814-S818 PolarHBondContact O-N 3.32Å; G814-S818 VanDerWaalsContact O-N 3.12Å
815	A	82.4	Confident	80.6	Confident	53 Å²	53	77.3 Å²	77.3	44%	0.438	41%	0.414	S	S	.	.	H	α-helix	trans	-71	-34.6	173.9	0	0	0	0	0	113	T811 Q812 I813 K819	T811-A815 PolarHBondContact O-N 3.43Å; Q812-A815 PolarHBondContact O-N 3Å; I813-A815 VanDerWaalsContact C-N 3.25Å; I813-A815 PolarHBondContact O-N 3.36Å; A815-K819 WeakPolarHBondContact O-CG 3.5Å; A815-K819 PolarHBondContact O-N 3.35Å
816	L	76.4	Confident	80.5	Confident	73 Å²	73	79.9 Å²	79.9	38%	0.382	42%	0.424	S	S	.	.	H	α-helix	trans	-70.6	-46.6	174	-72	167	0	0	0	111.4	Q812 I813 S818 K819 V820	Q812-L816 WeakPolarHBondContact O-CG 3.37Å; Q812-L816 PolarHBondContact O-N 3.4Å; I813-L816 WeakPolarHBondContact O-CA 3.37Å; I813-L816 WeakPolarHBondContact O-CB 3.33Å; I813-L816 PolarHBondContact O-N 2.96Å; L816-S818 VanDerWaalsContact C-N 3.28Å; L816-S818 PolarHBondContact O-N 3.23Å; L816-K819 WeakPolarHBondContact O-CA 3.48Å; L816-K819 WeakPolarHBondContact O-CB 3.38Å; L816-K819 PolarHBondContact O-N 3.11Å; L816-V820 WeakPolarHBondContact O-CG2 3.35Å; L816-V820 PolarHBondContact O-N 3.13Å
817	E	77.1	Confident	80.2	Confident	87 Å²	87	85.6 Å²	85.6	41%	0.407	45%	0.453	S	S	.	.	H	α-helix	trans	-56.3	-42.2	174.7	-68.2	180	-168.2	0	0	112.2	I813 K819 V820 R821	I813-E817 HydrophobicContact CG2-CG 4.4Å; I813-E817 PolarHBondContact O-N 3.47Å; E817-K819 VanDerWaalsContact C-N 3.28Å; E817-K819 PolarHBondContact O-N 3.27Å; E817-V820 PolarHBondContact O-N 2.89Å; E817-R821 WeakPolarHBondContact O-CB 3.47Å; E817-R821 WeakPolarHBondContact O-CG 3.49Å; E817-R821 PolarHBondContact O-N 3.32Å; E817-R821 IonicContact OE2-CZ 2.63Å; E817-R821 VanDerWaalsContact OE2-CZ 3.23Å; E817-R821 IonicContact OE2-NH1 3.72Å; E817-R821 PolarHBondContact OE2-NH1 3.47Å; E817-R821 IonicContact OE2-NH2 2.58Å; E817-R821 PolarHBondContact OE2-NH2 2.87Å
818	S	78.9	Confident	80	Confident	72 Å²	72	85.9 Å²	85.9	50%	0.503	46%	0.455	S	S	.	.	H	α-helix	trans	-60.5	-39.8	177.1	-168.1	0	0	0	0	111.5	G814 L816 S822	G814-S818 WeakPolarHBondContact O-CB 3.41Å; G814-S818 PolarHBondContact O-N 3.32Å; G814-S818 VanDerWaalsContact O-N 3.12Å; L816-S818 VanDerWaalsContact C-N 3.28Å; L816-S818 PolarHBondContact O-N 3.23Å; S818-S822 PolarHBondContact O-N 3.29Å; S818-S822 VanDerWaalsContact O-N 3.07Å
819	K	79.1	Confident	79.8	Confident	147 Å²	147	86.2 Å²	86.2	64%	0.639	46%	0.458	S	S	*	.	H	α-helix	trans	-66.7	-42.6	173.2	-71.7	175.5	179.8	178.8	0	112	A815 L816 E817 S822 G823	A815-K819 WeakPolarHBondContact O-CG 3.5Å; A815-K819 PolarHBondContact O-N 3.35Å; L816-K819 WeakPolarHBondContact O-CA 3.48Å; L816-K819 WeakPolarHBondContact O-CB 3.38Å; L816-K819 PolarHBondContact O-N 3.11Å; E817-K819 VanDerWaalsContact C-N 3.28Å; E817-K819 PolarHBondContact O-N 3.27Å; K819-S822 PolarHBondContact O-N 2.78Å; K819-S822 PolarHBondContact O-OG 3.43Å; K819-G823 PolarHBondContact O-N 3.45Å
820	V	76.4	Confident	79.7	Confident	82 Å²	82	89.3 Å²	89.3	50%	0.497	48%	0.478	S	S	.	.	H	α-helix	trans	-58.9	-51.9	175.3	173.5	0	0	0	0	110.6	L816 E817 S822 G823 E824	L816-V820 WeakPolarHBondContact O-CG2 3.35Å; L816-V820 PolarHBondContact O-N 3.13Å; E817-V820 PolarHBondContact O-N 2.89Å; V820-S822 PolarHBondContact O-N 3.31Å; V820-S822 VanDerWaalsContact O-N 3.14Å; V820-G823 CarbonylContact O-C 3.51Å; V820-G823 WeakPolarHBondContact O-CA 3.34Å; V820-G823 PolarHBondContact O-N 2.66Å; V820-E824 HydrophobicContact CG1-CG 4.28Å; V820-E824 WeakPolarHBondContact O-CG 3.46Å; V820-E824 PolarHBondContact O-N 2.99Å
821	R	78.8	Confident	79.7	Confident	121 Å²	121	86.2 Å²	86.2	46%	0.457	47%	0.471	S	S	.	.	H	α-helix	trans	-58.2	-28.2	175.8	-70.6	-176.4	-74.9	-107.5	1.2	113.7	E817 E824 K825	E817-R821 WeakPolarHBondContact O-CB 3.47Å; E817-R821 WeakPolarHBondContact O-CG 3.49Å; E817-R821 PolarHBondContact O-N 3.32Å; E817-R821 IonicContact OE2-CZ 2.63Å; E817-R821 VanDerWaalsContact OE2-CZ 3.23Å; E817-R821 IonicContact OE2-NH1 3.72Å; E817-R821 PolarHBondContact OE2-NH1 3.47Å; E817-R821 IonicContact OE2-NH2 2.58Å; E817-R821 PolarHBondContact OE2-NH2 2.87Å; R821-E824 WeakPolarHBondContact CA-OE2 3.4Å; R821-K825 WeakPolarHBondContact O-CG 3.37Å
822	S	78.5	Confident	79.7	Confident	58 Å²	58	87.8 Å²	87.8	41%	0.406	47%	0.469	S	S	.	.	H	α-helix	trans	-78.2	-29.9	172.1	84.6	0	0	0	0	113.3	S818 K819 V820 K826	S818-S822 PolarHBondContact O-N 3.29Å; S818-S822 VanDerWaalsContact O-N 3.07Å; K819-S822 PolarHBondContact O-N 2.78Å; K819-S822 PolarHBondContact O-OG 3.43Å; V820-S822 PolarHBondContact O-N 3.31Å; V820-S822 VanDerWaalsContact O-N 3.14Å; S822-K826 WeakPolarHBondContact O-CG 3.32Å; S822-K826 PolarHBondContact O-N 2.79Å
823	G	75	Confident	79.8	Confident	33 Å²	33	87.9 Å²	87.9	34%	0.34	47%	0.47	S	S	.	.	H	α-helix	trans	-74.4	-44.3	175.9	0	0	0	0	0	112.4	K819 V820 K825 K826 L827	K819-G823 PolarHBondContact O-N 3.45Å; V820-G823 CarbonylContact O-C 3.51Å; V820-G823 WeakPolarHBondContact O-CA 3.34Å; V820-G823 PolarHBondContact O-N 2.66Å; G823-K825 VanDerWaalsContact C-N 3.34Å; G823-K825 PolarHBondContact O-N 3.09Å; G823-K826 WeakPolarHBondContact O-CB 3.32Å; G823-K826 PolarHBondContact O-N 3.23Å; G823-L827 WeakPolarHBondContact O-CB 3.28Å; G823-L827 PolarHBondContact O-N 3.22Å
824	E	76.8	Confident	79.8	Confident	117 Å²	117	92.4 Å²	92.4	55%	0.547	49%	0.489	S	S	.	.	H	α-helix	trans	-54.8	-48	174.2	-68.8	168.3	156	0	0	111.2	V820 R821 K826 L827 E828	V820-E824 HydrophobicContact CG1-CG 4.28Å; V820-E824 WeakPolarHBondContact O-CG 3.46Å; V820-E824 PolarHBondContact O-N 2.99Å; R821-E824 WeakPolarHBondContact CA-OE2 3.4Å; E824-K826 VanDerWaalsContact C-N 3.28Å; E824-K826 PolarHBondContact O-N 2.98Å; E824-L827 PolarHBondContact O-N 3.41Å; E824-E828 VanDerWaalsContact O-CB 3.3Å; E824-E828 WeakPolarHBondContact O-CB 3.37Å; E824-E828 PolarHBondContact O-N 2.94Å
825	K	84.2	Confident	80.1	Confident	165 Å²	165	97 Å²	97	72%	0.717	50%	0.503	S	S	*	.	H	α-helix	trans	-60.7	-32.6	176	-72.8	178.7	-179.8	-176	0	113.7	R821 G823 A829	R821-K825 WeakPolarHBondContact O-CG 3.37Å; G823-K825 VanDerWaalsContact C-N 3.34Å; G823-K825 PolarHBondContact O-N 3.09Å; K825-A829 PolarHBondContact O-N 3.01Å
826	K	82.9	Confident	80.4	Confident	149 Å²	149	99.7 Å²	99.7	65%	0.648	50%	0.502	S	S	*	.	H	α-helix	trans	-75.2	-41	174.7	-71.8	173	179.4	-176.4	0	111.6	S822 G823 E824 A829 V830	S822-K826 WeakPolarHBondContact O-CG 3.32Å; S822-K826 PolarHBondContact O-N 2.79Å; G823-K826 WeakPolarHBondContact O-CB 3.32Å; G823-K826 PolarHBondContact O-N 3.23Å; E824-K826 VanDerWaalsContact C-N 3.28Å; E824-K826 PolarHBondContact O-N 2.98Å; K826-A829 PolarHBondContact O-N 2.89Å; K826-V830 WeakPolarHBondContact O-CG2 3.24Å; K826-V830 PolarHBondContact O-N 3.38Å
827	L	76.5	Confident	80.7	Confident	127 Å²	127	99.8 Å²	99.8	67%	0.665	51%	0.506	S	S	*	.	H	α-helix	trans	-67	-38.8	179.2	-166.1	144.5	0	0	0	111.3	G823 E824 V830 A831	G823-L827 WeakPolarHBondContact O-CB 3.28Å; G823-L827 PolarHBondContact O-N 3.22Å; E824-L827 PolarHBondContact O-N 3.41Å; L827-V830 PolarHBondContact O-N 3.37Å; L827-A831 WeakPolarHBondContact O-CB 3.3Å; L827-A831 PolarHBondContact O-N 2.92Å
828	E	82.2	Confident	80.9	Confident	99 Å²	99	100.3 Å²	100.3	46%	0.463	51%	0.508	S	S	.	.	H	α-helix	trans	-62.1	-39.3	170.9	176.1	63.2	-172.6	0	0	112.6	E824 A831 K832	E824-E828 VanDerWaalsContact O-CB 3.3Å; E824-E828 WeakPolarHBondContact O-CB 3.37Å; E824-E828 PolarHBondContact O-N 2.94Å; E828-A831 PolarHBondContact O-N 3.47Å; E828-K832 PolarHBondContact O-N 3.08Å; E828-K832 VanDerWaalsContact O-N 3.13Å; E828-K832 WeakPolarHBondContact OE1-CE 3.44Å; E828-K832 IonicContact OE1-NZ 2.72Å; E828-K832 PolarHBondContact OE1-NZ 2.91Å
829	A	80.8	Confident	81.2	Confident	54 Å²	54	99.5 Å²	99.5	45%	0.446	51%	0.506	S	S	.	.	H	α-helix	trans	-67.6	-42.8	174.3	0	0	0	0	0	111.9	K825 K826 A831 K832 E833	K825-A829 PolarHBondContact O-N 3.01Å; K826-A829 PolarHBondContact O-N 2.89Å; A829-A831 VanDerWaalsContact C-N 3.34Å; A829-K832 PolarHBondContact O-N 2.89Å; A829-E833 PolarHBondContact O-N 3.07Å; A829-E833 VanDerWaalsContact O-N 3.09Å
830	V	80.6	Confident	81.6	Confident	102 Å²	102	97.1 Å²	97.1	62%	0.618	50%	0.497	S	S	*	.	H	α-helix	trans	-65.1	-37	174.9	171.1	0	0	0	0	111.6	K826 L827 K832 E833 K834	K826-V830 WeakPolarHBondContact O-CG2 3.24Å; K826-V830 PolarHBondContact O-N 3.38Å; L827-V830 PolarHBondContact O-N 3.37Å; V830-K832 VanDerWaalsContact C-N 3.35Å; V830-K832 PolarHBondContact O-N 3.47Å; V830-E833 PolarHBondContact O-N 2.79Å; V830-K834 WeakPolarHBondContact O-CB 3.46Å; V830-K834 PolarHBondContact O-N 3.46Å
831	A	81.4	Confident	81.8	Confident	32 Å²	32	98.6 Å²	98.6	26%	0.264	50%	0.501	S	S	.	.	H	α-helix	trans	-63.8	-39	175.2	0	0	0	0	0	112.2	L827 E828 A829 K834 M835	L827-A831 WeakPolarHBondContact O-CB 3.3Å; L827-A831 PolarHBondContact O-N 2.92Å; E828-A831 PolarHBondContact O-N 3.47Å; A829-A831 VanDerWaalsContact C-N 3.34Å; A831-K834 WeakPolarHBondContact O-CB 3.37Å; A831-K834 PolarHBondContact O-N 3.48Å; A831-M835 WeakPolarHBondContact O-CG 3.36Å; A831-M835 PolarHBondContact O-N 2.92Å
832	K	86.8	Confident	82.1	Confident	122 Å²	122	99.5 Å²	99.5	53%	0.53	51%	0.511	S	S	.	.	H	α-helix	trans	-66.8	-43.6	175.2	-79.5	163.1	170.9	153.5	0	112.9	E828 A829 V830 K834 M835 R836	E828-K832 PolarHBondContact O-N 3.08Å; E828-K832 VanDerWaalsContact O-N 3.13Å; E828-K832 WeakPolarHBondContact OE1-CE 3.44Å; E828-K832 IonicContact OE1-NZ 2.72Å; E828-K832 PolarHBondContact OE1-NZ 2.91Å; A829-K832 PolarHBondContact O-N 2.89Å; V830-K832 VanDerWaalsContact C-N 3.35Å; V830-K832 PolarHBondContact O-N 3.47Å; K832-K834 VanDerWaalsContact C-N 3.34Å; K832-M835 PolarHBondContact O-N 3.39Å; K832-R836 PolarHBondContact O-N 3.32Å
833	E	83.1	Confident	82.5	Confident	97 Å²	97	99 Å²	99	45%	0.453	51%	0.51	S	S	.	.	H	α-helix	trans	-65.6	-36.9	173.4	-75.6	-59.2	122.3	0	0	112.2	A829 V830 R836 V837	A829-E833 PolarHBondContact O-N 3.07Å; A829-E833 VanDerWaalsContact O-N 3.09Å; V830-E833 PolarHBondContact O-N 2.79Å; E833-R836 PolarHBondContact O-N 2.89Å; E833-R836 IonicContact OE1-NE 2.73Å; E833-R836 PolarHBondContact OE1-NE 2.9Å; E833-R836 IonicContact OE2-CZ 3.38Å; E833-R836 VanDerWaalsContact OE2-CZ 3.23Å; E833-R836 IonicContact OE2-NE 3.7Å; E833-R836 PolarHBondContact OE2-NE 2.88Å; E833-R836 IonicContact OE2-NH2 2.69Å; E833-R836 PolarHBondContact OE2-NH2 3.37Å; E833-V837 WeakPolarHBondContact O-CG2 3.24Å; E833-V837 PolarHBondContact O-N 3.49Å
834	K	79.4	Confident	82.7	Confident	118 Å²	118	103.1 Å²	103.1	51%	0.513	52%	0.522	S	S	.	.	H	α-helix	trans	-58.5	-49.8	171.9	-179.5	-177.8	175.6	-72.2	0	111.4	V830 A831 K832 R836 V837 E838	V830-K834 WeakPolarHBondContact O-CB 3.46Å; V830-K834 PolarHBondContact O-N 3.46Å; A831-K834 WeakPolarHBondContact O-CB 3.37Å; A831-K834 PolarHBondContact O-N 3.48Å; K832-K834 VanDerWaalsContact C-N 3.34Å; K834-R836 VanDerWaalsContact C-N 3.31Å; K834-R836 PolarHBondContact O-N 3.39Å; K834-V837 PolarHBondContact O-N 3.29Å; K834-E838 WeakPolarHBondContact CE-OE1 3.43Å; K834-E838 IonicContact NZ-OE1 2.63Å; K834-E838 PolarHBondContact NZ-OE1 2.86Å; K834-E838 IonicContact NZ-OE2 3.28Å; K834-E838 PolarHBondContact NZ-OE2 3.07Å; K834-E838 WeakPolarHBondContact O-CB 3.35Å; K834-E838 WeakPolarHBondContact O-CG 3.36Å; K834-E838 PolarHBondContact O-N 2.89Å
835	M	85.9	Confident	83	Confident	128 Å²	128	101.4 Å²	101.4	63%	0.631	52%	0.519	S	S	*	.	H	α-helix	trans	-60.2	-39.3	176.5	-70.7	-178.3	-168.9	0	0	112.3	A831 K832 E838 A839	A831-M835 WeakPolarHBondContact O-CG 3.36Å; A831-M835 PolarHBondContact O-N 2.92Å; K832-M835 PolarHBondContact O-N 3.39Å; M835-E838 PolarHBondContact O-N 3.28Å; M835-A839 WeakPolarHBondContact O-CB 3.38Å; M835-A839 PolarHBondContact O-N 3.14Å
836	R	88.8	Confident	83	Confident	111 Å²	111	100.1 Å²	100.1	42%	0.419	51%	0.514	S	S	.	.	H	α-helix	trans	-61.2	-48.5	176.2	-174.4	179.2	69.6	78.3	1	111.4	K832 E833 K834 A839 E840	K832-R836 PolarHBondContact O-N 3.32Å; E833-R836 PolarHBondContact O-N 2.89Å; E833-R836 IonicContact OE1-NE 2.73Å; E833-R836 PolarHBondContact OE1-NE 2.9Å; E833-R836 IonicContact OE2-CZ 3.38Å; E833-R836 VanDerWaalsContact OE2-CZ 3.23Å; E833-R836 IonicContact OE2-NE 3.7Å; E833-R836 PolarHBondContact OE2-NE 2.88Å; E833-R836 IonicContact OE2-NH2 2.69Å; E833-R836 PolarHBondContact OE2-NH2 3.37Å; K834-R836 VanDerWaalsContact C-N 3.31Å; K834-R836 PolarHBondContact O-N 3.39Å; R836-A839 PolarHBondContact O-N 3.21Å; R836-E840 VanDerWaalsContact CG-OE1 3.3Å; R836-E840 WeakPolarHBondContact CG-OE1 3.34Å; R836-E840 IonicContact CZ-OE1 2.62Å; R836-E840 IonicContact NH1-OE1 3.86Å; R836-E840 PolarHBondContact NH1-OE1 3.38Å; R836-E840 IonicContact NH1-OE2 2.66Å; R836-E840 PolarHBondContact NH1-OE2 3.19Å; R836-E840 WeakPolarHBondContact O-CB 3.37Å; R836-E840 WeakPolarHBondContact O-CG 3.46Å; R836-E840 PolarHBondContact O-N 2.76Å
837	V	81.5	Confident	83.1	Confident	75 Å²	75	99.4 Å²	99.4	46%	0.455	51%	0.511	S	S	.	.	H	α-helix	trans	-66.2	-37.5	179.3	172.7	0	0	0	0	111.8	E833 K834 E840 L841	E833-V837 WeakPolarHBondContact O-CG2 3.24Å; E833-V837 PolarHBondContact O-N 3.49Å; K834-V837 PolarHBondContact O-N 3.29Å; V837-E840 PolarHBondContact O-N 3.3Å; V837-L841 WeakPolarHBondContact O-CB 3.45Å; V837-L841 PolarHBondContact O-N 2.91Å
838	E	81.6	Confident	83.3	Confident	98 Å²	98	97.4 Å²	97.4	46%	0.458	51%	0.507	S	S	.	.	H	α-helix	trans	-65.1	-42.9	175.2	-74.4	174.6	142.2	0	0	111.8	K834 M835 L841 E842	K834-E838 WeakPolarHBondContact CE-OE1 3.43Å; K834-E838 IonicContact NZ-OE1 2.63Å; K834-E838 PolarHBondContact NZ-OE1 2.86Å; K834-E838 IonicContact NZ-OE2 3.28Å; K834-E838 PolarHBondContact NZ-OE2 3.07Å; K834-E838 WeakPolarHBondContact O-CB 3.35Å; K834-E838 WeakPolarHBondContact O-CG 3.36Å; K834-E838 PolarHBondContact O-N 2.89Å; M835-E838 PolarHBondContact O-N 3.28Å; E838-L841 PolarHBondContact O-N 2.88Å; E838-E842 PolarHBondContact O-N 3.39Å
839	A	85.6	Confident	83.4	Confident	55 Å²	55	99.4 Å²	99.4	46%	0.455	52%	0.516	S	S	.	.	H	α-helix	trans	-67.7	-36.7	175.4	0	0	0	0	0	113.1	M835 R836 L841 E842 A843	M835-A839 WeakPolarHBondContact O-CB 3.38Å; M835-A839 PolarHBondContact O-N 3.14Å; R836-A839 PolarHBondContact O-N 3.21Å; A839-L841 VanDerWaalsContact C-N 3.32Å; A839-E842 PolarHBondContact O-N 3.04Å; A839-A843 WeakPolarHBondContact O-CB 3.26Å; A839-A843 PolarHBondContact O-N 3.46Å
840	E	87.1	Confident	83.6	Confident	96 Å²	96	100.7 Å²	100.7	45%	0.449	52%	0.516	S	S	.	.	H	α-helix	trans	-64.9	-36.9	173.1	-77.8	169.1	-165.3	0	0	111.6	R836 V837 M844	R836-E840 VanDerWaalsContact CG-OE1 3.3Å; R836-E840 WeakPolarHBondContact CG-OE1 3.34Å; R836-E840 IonicContact CZ-OE1 2.62Å; R836-E840 IonicContact NH1-OE1 3.86Å; R836-E840 PolarHBondContact NH1-OE1 3.38Å; R836-E840 IonicContact NH1-OE2 2.66Å; R836-E840 PolarHBondContact NH1-OE2 3.19Å; R836-E840 WeakPolarHBondContact O-CB 3.37Å; R836-E840 WeakPolarHBondContact O-CG 3.46Å; R836-E840 PolarHBondContact O-N 2.76Å; V837-E840 PolarHBondContact O-N 3.3Å; E840-M844 WeakPolarHBondContact O-CG 3.4Å; E840-M844 PolarHBondContact O-N 3.49Å; E840-M844 VanDerWaalsContact O-N 3.11Å
841	L	80.1	Confident	83.8	Confident	114 Å²	114	98.5 Å²	98.5	60%	0.597	51%	0.508	S	S	*	.	H	α-helix	trans	-71.1	-40.9	176.7	-165.8	149.2	0	0	0	111.9	V837 E838 A839 M844 T845	V837-L841 WeakPolarHBondContact O-CB 3.45Å; V837-L841 PolarHBondContact O-N 2.91Å; E838-L841 PolarHBondContact O-N 2.88Å; A839-L841 VanDerWaalsContact C-N 3.32Å; L841-M844 PolarHBondContact O-N 3.14Å; L841-M844 VanDerWaalsContact O-N 3.15Å; L841-T845 HydrophobicContact CD2-CG2 4.17Å; L841-T845 PolarHBondContact O-N 2.78Å
842	E	85.4	Confident	83.9	Confident	140 Å²	140	100.2 Å²	100.2	65%	0.654	52%	0.518	S	S	*	.	H	α-helix	trans	-64	-39.3	173.1	-172.7	176.7	-165.2	0	0	112.2	E838 A839 M844 T845 K846	E838-E842 PolarHBondContact O-N 3.39Å; A839-E842 PolarHBondContact O-N 3.04Å; E842-M844 PolarHBondContact O-N 3.24Å; E842-T845 PolarHBondContact O-N 2.93Å; E842-T845 PolarHBondContact O-OG1 3.4Å; E842-K846 WeakPolarHBondContact O-CB 3.47Å; E842-K846 PolarHBondContact O-N 3.26Å
843	A	86.1	Confident	84	Confident	47 Å²	47	96.5 Å²	96.5	39%	0.388	51%	0.514	S	S	.	.	H	α-helix	trans	-63.2	-31.3	172.9	0	0	0	0	0	112.4	A839 K847	A839-A843 WeakPolarHBondContact O-CB 3.26Å; A839-A843 PolarHBondContact O-N 3.46Å; A843-K847 WeakPolarHBondContact O-CD 3.44Å; A843-K847 VanDerWaalsContact O-CG 3.26Å; A843-K847 WeakPolarHBondContact O-CG 3.45Å; A843-K847 PolarHBondContact O-N 2.99Å
844	M	80.8	Confident	84.2	Confident	119 Å²	119	98.1 Å²	98.1	59%	0.586	52%	0.522	S	S	*	.	H	α-helix	trans	-77.7	-39.9	175.8	-74.5	-62.9	-67	0	0	113.1	E840 L841 E842 K846 K847 S848	E840-M844 WeakPolarHBondContact O-CG 3.4Å; E840-M844 PolarHBondContact O-N 3.49Å; E840-M844 VanDerWaalsContact O-N 3.11Å; L841-M844 PolarHBondContact O-N 3.14Å; L841-M844 VanDerWaalsContact O-N 3.15Å; E842-M844 PolarHBondContact O-N 3.24Å; M844-K846 VanDerWaalsContact C-N 3.33Å; M844-K846 PolarHBondContact O-N 3.18Å; M844-K847 PolarHBondContact O-N 2.86Å; M844-K847 HydrophobicContact SD-CD 4.18Å; M844-S848 PolarHBondContact O-N 2.91Å
845	T	81.6	Confident	84.4	Confident	81 Å²	81	97.9 Å²	97.9	50%	0.497	53%	0.526	S	S	.	.	H	α-helix	trans	-64.7	-39.1	174.9	56	0	0	0	0	111.3	L841 E842 S848 H849	L841-T845 HydrophobicContact CD2-CG2 4.17Å; L841-T845 PolarHBondContact O-N 2.78Å; E842-T845 PolarHBondContact O-N 2.93Å; E842-T845 PolarHBondContact O-OG1 3.4Å; T845-S848 WeakPolarHBondContact O-CB 3.31Å; T845-S848 PolarHBondContact O-N 3.43Å; T845-H849 PolarHBondContact O-N 3.46Å
846	K	84.3	Confident	84.5	Confident	139 Å²	139	96.3 Å²	96.3	60%	0.604	52%	0.523	S	S	*	.	H	α-helix	trans	-61	-49.3	174.6	-171.8	170.4	-177.8	174.5	0	112.5	E842 M844 S848 H849 D850	E842-K846 WeakPolarHBondContact O-CB 3.47Å; E842-K846 PolarHBondContact O-N 3.26Å; M844-K846 VanDerWaalsContact C-N 3.33Å; M844-K846 PolarHBondContact O-N 3.18Å; K846-S848 VanDerWaalsContact C-N 3.25Å; K846-S848 PolarHBondContact O-N 3.45Å; K846-H849 WeakPolarHBondContact O-CB 3.31Å; K846-H849 PolarHBondContact O-N 2.91Å; K846-D850 PolarHBondContact O-N 2.89Å
847	K	86.1	Confident	84.2	Confident	134 Å²	134	94.8 Å²	94.8	58%	0.583	53%	0.529	S	S	*	.	H	α-helix	trans	-56.6	-38.6	174.5	-73	168.3	-175.5	175.6	0	112.7	A843 M844 A851	A843-K847 WeakPolarHBondContact O-CD 3.44Å; A843-K847 VanDerWaalsContact O-CG 3.26Å; A843-K847 WeakPolarHBondContact O-CG 3.45Å; A843-K847 PolarHBondContact O-N 2.99Å; M844-K847 PolarHBondContact O-N 2.86Å; M844-K847 HydrophobicContact SD-CD 4.18Å; K847-A851 WeakPolarHBondContact O-CB 3.38Å; K847-A851 PolarHBondContact O-N 3.39Å
848	S	81.1	Confident	84.4	Confident	84 Å²	84	96.4 Å²	96.4	59%	0.587	54%	0.535	S	S	*	.	H	α-helix	trans	-67.4	-37.5	176.3	-168.2	0	0	0	0	112.4	M844 T845 K846 S852	M844-S848 PolarHBondContact O-N 2.91Å; T845-S848 WeakPolarHBondContact O-CB 3.31Å; T845-S848 PolarHBondContact O-N 3.43Å; K846-S848 VanDerWaalsContact C-N 3.25Å; K846-S848 PolarHBondContact O-N 3.45Å; S848-S852 WeakPolarHBondContact O-CB 3.47Å; S848-S852 PolarHBondContact O-N 3.28Å
849	H	84.2	Confident	84.4	Confident	142 Å²	142	95 Å²	95	66%	0.657	54%	0.535	S	S	*	.	H	α-helix	trans	-65.9	-46.4	173.6	-172	84.2	0	0	0	111.8	T845 K846 A851 S852 G853	T845-H849 PolarHBondContact O-N 3.46Å; K846-H849 WeakPolarHBondContact O-CB 3.31Å; K846-H849 PolarHBondContact O-N 2.91Å; H849-A851 VanDerWaalsContact C-N 3.34Å; H849-A851 PolarHBondContact O-N 3.29Å; H849-S852 WeakPolarHBondContact O-CB 3.34Å; H849-S852 PolarHBondContact O-N 3.46Å; H849-S852 VanDerWaalsContact O-N 3.16Å; H849-G853 PolarHBondContact O-N 3.16Å
850	D	85.3	Confident	84.4	Confident	81 Å²	81	97.7 Å²	97.7	43%	0.433	54%	0.539	S	S	.	.	H	α-helix	trans	-60.7	-42.2	177.8	-63.4	-28.8	0	0	0	111.4	K846 G853 Q854	K846-D850 PolarHBondContact O-N 2.89Å; D850-G853 PolarHBondContact O-N 3.45Å; D850-Q854 WeakPolarHBondContact O-CG 3.45Å; D850-Q854 PolarHBondContact O-N 2.94Å
851	A	84.3	Confident	84.3	Confident	55 Å²	55	98 Å²	98	46%	0.455	54%	0.54	S	S	.	.	H	α-helix	trans	-63.9	-38.9	174.6	0	0	0	0	0	112.9	K847 H849 Q854 L855	K847-A851 WeakPolarHBondContact O-CB 3.38Å; K847-A851 PolarHBondContact O-N 3.39Å; H849-A851 VanDerWaalsContact C-N 3.34Å; H849-A851 PolarHBondContact O-N 3.29Å; A851-Q854 PolarHBondContact O-N 3.31Å; A851-L855 PolarHBondContact O-N 2.94Å
852	S	83.4	Confident	84.6	Confident	68 Å²	68	98.3 Å²	98.3	48%	0.476	54%	0.541	S	S	.	.	H	α-helix	trans	-63.7	-41	173.2	-170.2	0	0	0	0	111.7	S848 H849 Q854 L855 V856	S848-S852 WeakPolarHBondContact O-CB 3.47Å; S848-S852 PolarHBondContact O-N 3.28Å; H849-S852 WeakPolarHBondContact O-CB 3.34Å; H849-S852 PolarHBondContact O-N 3.46Å; H849-S852 VanDerWaalsContact O-N 3.16Å; S852-Q854 PolarHBondContact O-N 3.16Å; S852-L855 WeakPolarHBondContact O-CB 3.44Å; S852-L855 PolarHBondContact O-N 2.65Å; S852-V856 WeakPolarHBondContact O-CG2 3.46Å; S852-V856 PolarHBondContact O-N 3.1Å
853	G	88	Confident	84.7	Confident	44 Å²	44	95.5 Å²	95.5	45%	0.454	53%	0.531	S	S	.	.	H	α-helix	trans	-60.4	-41.3	173.4	0	0	0	0	0	113.2	H849 D850 V856 S857	H849-G853 PolarHBondContact O-N 3.16Å; D850-G853 PolarHBondContact O-N 3.45Å; G853-V856 PolarHBondContact O-N 3.4Å; G853-S857 PolarHBondContact O-N 3.34Å
854	Q	87.4	Confident	84.7	Confident	132 Å²	132	98.4 Å²	98.4	62%	0.617	53%	0.534	S	S	*	.	H	α-helix	trans	-62.8	-43.1	173.2	-68.9	176.7	16	0	0	111.8	D850 A851 S852 V856 S857 I858	D850-Q854 WeakPolarHBondContact O-CG 3.45Å; D850-Q854 PolarHBondContact O-N 2.94Å; A851-Q854 PolarHBondContact O-N 3.31Å; S852-Q854 PolarHBondContact O-N 3.16Å; Q854-V856 VanDerWaalsContact C-N 3.33Å; Q854-V856 PolarHBondContact O-N 3.02Å; Q854-S857 WeakPolarHBondContact O-CB 3.41Å; Q854-S857 PolarHBondContact O-N 3.47Å; Q854-S857 VanDerWaalsContact O-N 3.15Å; Q854-I858 WeakPolarHBondContact O-CG1 3.39Å; Q854-I858 PolarHBondContact O-N 3.29Å
855	L	83.4	Confident	84.9	Confident	113 Å²	113	98.8 Å²	98.8	59%	0.592	53%	0.533	S	S	*	.	H	α-helix	trans	-60.7	-40.6	177.3	-164.5	77.4	0	0	0	112.2	A851 S852 S859	A851-L855 PolarHBondContact O-N 2.94Å; S852-L855 WeakPolarHBondContact O-CB 3.44Å; S852-L855 PolarHBondContact O-N 2.65Å; L855-S859 WeakPolarHBondContact O-CB 3.45Å; L855-S859 PolarHBondContact O-N 2.9Å; L855-S859 PolarHBondContact O-OG 2.87Å
856	V	89.1	Confident	84.9	Confident	94 Å²	94	101 Å²	101	57%	0.57	54%	0.537	S	S	*	.	H	α-helix	trans	-64.9	-41.2	174.3	172.5	0	0	0	0	111.4	S852 G853 Q854 S859 Q860	S852-V856 WeakPolarHBondContact O-CG2 3.46Å; S852-V856 PolarHBondContact O-N 3.1Å; G853-V856 PolarHBondContact O-N 3.4Å; Q854-V856 VanDerWaalsContact C-N 3.33Å; Q854-V856 PolarHBondContact O-N 3.02Å; V856-S859 PolarHBondContact O-N 2.79Å; V856-Q860 PolarHBondContact O-N 3.38Å
857	S	82.9	Confident	85.1	Confident	79 Å²	79	101.9 Å²	101.9	55%	0.552	54%	0.537	S	S	*	.	H	α-helix	trans	-61.4	-49.4	176.5	-167.6	0	0	0	0	111.9	G853 Q854 S859 Q860 E861	G853-S857 PolarHBondContact O-N 3.34Å; Q854-S857 WeakPolarHBondContact O-CB 3.41Å; Q854-S857 PolarHBondContact O-N 3.47Å; Q854-S857 VanDerWaalsContact O-N 3.15Å; S857-S859 VanDerWaalsContact C-N 3.32Å; S857-S859 PolarHBondContact O-N 2.95Å; S857-Q860 PolarHBondContact O-N 3.49Å; S857-Q860 VanDerWaalsContact O-N 3.15Å; S857-E861 PolarHBondContact O-N 2.98Å
858	I	85.4	Confident	85	Confident	110 Å²	110	98.3 Å²	98.3	56%	0.564	53%	0.529	S	S	*	.	H	α-helix	trans	-59.3	-43.5	176.4	-67.2	164.2	0	0	0	110.6	Q854 Q860 E861 L862	Q854-I858 WeakPolarHBondContact O-CG1 3.39Å; Q854-I858 PolarHBondContact O-N 3.29Å; I858-Q860 VanDerWaalsContact C-N 3.33Å; I858-Q860 PolarHBondContact O-N 3.04Å; I858-E861 PolarHBondContact O-N 2.64Å; I858-L862 WeakPolarHBondContact O-CB 3.35Å; I858-L862 PolarHBondContact O-N 2.78Å
859	S	80.4	Confident	85.2	Confident	67 Å²	67	98.4 Å²	98.4	47%	0.469	52%	0.522	S	S	.	.	H	α-helix	trans	-62.5	-39.5	177.1	-58.2	0	0	0	0	112.1	L855 V856 S857 L863	L855-S859 WeakPolarHBondContact O-CB 3.45Å; L855-S859 PolarHBondContact O-N 2.9Å; L855-S859 PolarHBondContact O-OG 2.87Å; V856-S859 PolarHBondContact O-N 2.79Å; S857-S859 VanDerWaalsContact C-N 3.32Å; S857-S859 PolarHBondContact O-N 2.95Å; S859-L863 WeakPolarHBondContact O-CB 3.31Å; S859-L863 PolarHBondContact O-N 3.39Å; S859-L863 VanDerWaalsContact O-N 3.1Å
860	Q	86.7	Confident	85.3	Confident	113 Å²	113	95.8 Å²	95.8	53%	0.528	51%	0.514	S	S	.	.	H	α-helix	trans	-71	-35	176.6	-161.6	-165	85.5	0	0	112.2	V856 S857 I858 K864	V856-Q860 PolarHBondContact O-N 3.38Å; S857-Q860 PolarHBondContact O-N 3.49Å; S857-Q860 VanDerWaalsContact O-N 3.15Å; I858-Q860 VanDerWaalsContact C-N 3.33Å; I858-Q860 PolarHBondContact O-N 3.04Å; Q860-K864 WeakPolarHBondContact O-CG 3.43Å; Q860-K864 PolarHBondContact O-N 3.01Å; Q860-K864 VanDerWaalsContact O-N 3.17Å; Q860-K864 VanDerWaalsContact OE1-CE 3.3Å
861	E	85.2	Confident	85.4	Confident	101 Å²	101	97.5 Å²	97.5	47%	0.472	52%	0.519	S	S	.	.	H	α-helix	trans	-68.2	-44.8	173.1	-175.6	166.7	-174.4	0	0	111.7	S857 I858 L863 K864 K865	S857-E861 PolarHBondContact O-N 2.98Å; I858-E861 PolarHBondContact O-N 2.64Å; E861-L863 VanDerWaalsContact C-N 3.26Å; E861-L863 PolarHBondContact O-N 2.79Å; E861-K864 WeakPolarHBondContact O-CA 3.45Å; E861-K864 WeakPolarHBondContact O-CB 3.26Å; E861-K864 PolarHBondContact O-N 2.85Å; E861-K865 HydrophobicContact CG-CG 4.3Å; E861-K865 WeakPolarHBondContact O-CG 3.33Å; E861-K865 PolarHBondContact O-N 2.7Å; E861-K865 WeakPolarHBondContact OE1-CE 3.32Å; E861-K865 IonicContact OE1-NZ 4Å; E861-K865 PolarHBondContact OE1-NZ 2.95Å; E861-K865 VanDerWaalsContact OE1-NZ 3.08Å
862	L	85.6	Confident	85.4	Confident	121 Å²	121	100.4 Å²	100.4	63%	0.634	53%	0.526	S	S	*	.	H	α-helix	trans	-53.8	-45.3	174.7	-177.3	63.8	0	0	0	111.2	I858 K864 K865 E866	I858-L862 WeakPolarHBondContact O-CB 3.35Å; I858-L862 PolarHBondContact O-N 2.78Å; L862-K864 VanDerWaalsContact C-N 3.31Å; L862-K864 PolarHBondContact O-N 3.3Å; L862-K865 PolarHBondContact O-N 3Å; L862-E866 PolarHBondContact O-N 3.33Å
863	L	87.7	Confident	85.5	Confident	81 Å²	81	104.4 Å²	104.4	42%	0.424	53%	0.531	S	S	.	.	H	α-helix	trans	-65.1	-29.9	177.1	-155.2	82.1	0	0	0	113.3	S859 E861 R867	S859-L863 WeakPolarHBondContact O-CB 3.31Å; S859-L863 PolarHBondContact O-N 3.39Å; S859-L863 VanDerWaalsContact O-N 3.1Å; E861-L863 VanDerWaalsContact C-N 3.26Å; E861-L863 PolarHBondContact O-N 2.79Å; L863-R867 VanDerWaalsContact O-CG 3.3Å; L863-R867 WeakPolarHBondContact O-CG 3.33Å; L863-R867 PolarHBondContact O-N 3.44Å
864	K	86.4	Confident	85.4	Confident	108 Å²	108	105.4 Å²	105.4	47%	0.47	53%	0.528	S	S	.	.	H	α-helix	trans	-70.5	-47.2	171.8	-69.6	164.5	-168.8	161.7	0	110.6	Q860 E861 L862 E866 R867 S868	Q860-K864 WeakPolarHBondContact O-CG 3.43Å; Q860-K864 PolarHBondContact O-N 3.01Å; Q860-K864 VanDerWaalsContact O-N 3.17Å; Q860-K864 VanDerWaalsContact OE1-CE 3.3Å; E861-K864 WeakPolarHBondContact O-CA 3.45Å; E861-K864 WeakPolarHBondContact O-CB 3.26Å; E861-K864 PolarHBondContact O-N 2.85Å; L862-K864 VanDerWaalsContact C-N 3.31Å; L862-K864 PolarHBondContact O-N 3.3Å; K864-E866 VanDerWaalsContact C-N 3.31Å; K864-E866 PolarHBondContact O-N 3.23Å; K864-R867 PolarHBondContact O-N 3.42Å; K864-S868 PolarHBondContact O-N 3.34Å; K864-S868 VanDerWaalsContact O-N 3.1Å; K864-S868 PolarHBondContact O-OG 2.79Å
865	K	83.8	Confident	85.1	Confident	128 Å²	128	104.1 Å²	104.1	56%	0.557	53%	0.525	S	S	*	.	H	α-helix	trans	-60.9	-40.2	178.3	-57.5	-73.8	179.4	176	0	111.3	E861 L862 R867 S868 L869	E861-K865 HydrophobicContact CG-CG 4.3Å; E861-K865 WeakPolarHBondContact O-CG 3.33Å; E861-K865 PolarHBondContact O-N 2.7Å; E861-K865 WeakPolarHBondContact OE1-CE 3.32Å; E861-K865 IonicContact OE1-NZ 4Å; E861-K865 PolarHBondContact OE1-NZ 2.95Å; E861-K865 VanDerWaalsContact OE1-NZ 3.08Å; L862-K865 PolarHBondContact O-N 3Å; K865-R867 PolarHBondContact O-N 3.21Å; K865-S868 PolarHBondContact O-N 3.37Å; K865-L869 VanDerWaalsContact O-CB 3.3Å; K865-L869 WeakPolarHBondContact O-CB 3.27Å; K865-L869 PolarHBondContact O-N 2.98Å
866	E	82.6	Confident	84.9	Confident	126 Å²	126	103.6 Å²	103.6	59%	0.589	52%	0.522	S	S	*	.	H	α-helix	trans	-61.2	-42.5	176.2	-173.6	179	-158.9	0	0	112.3	L862 K864 L869 N870	L862-E866 PolarHBondContact O-N 3.33Å; K864-E866 VanDerWaalsContact C-N 3.31Å; K864-E866 PolarHBondContact O-N 3.23Å; E866-L869 PolarHBondContact O-N 2.9Å; E866-N870 WeakPolarHBondContact O-CB 3.47Å; E866-N870 PolarHBondContact O-N 3.24Å
867	R	87.4	Confident	84.4	Confident	158 Å²	158	104.7 Å²	104.7	60%	0.596	52%	0.524	S	S	*	.	H	α-helix	trans	-61.2	-50.6	174.9	-69.9	169	-169.3	-168.1	1.6	111.5	L863 K864 K865 L869 N870 E871	L863-R867 VanDerWaalsContact O-CG 3.3Å; L863-R867 WeakPolarHBondContact O-CG 3.33Å; L863-R867 PolarHBondContact O-N 3.44Å; K864-R867 PolarHBondContact O-N 3.42Å; K865-R867 PolarHBondContact O-N 3.21Å; R867-L869 VanDerWaalsContact C-N 3.31Å; R867-L869 PolarHBondContact O-N 3.08Å; R867-N870 CarbonylContact O-C 3.59Å; R867-N870 WeakPolarHBondContact O-CA 3.45Å; R867-N870 WeakPolarHBondContact O-CB 3.4Å; R867-N870 PolarHBondContact O-N 3.01Å; R867-E871 WeakPolarHBondContact O-CG 3.38Å; R867-E871 PolarHBondContact O-N 3.03Å
868	S	84.6	Confident	84.1	Confident	60 Å²	60	105.4 Å²	105.4	42%	0.42	52%	0.519	S	S	.	.	H	α-helix	trans	-63.4	-35.2	178.9	-58.6	0	0	0	0	112.9	K864 K865 N870 E871 L872	K864-S868 PolarHBondContact O-N 3.34Å; K864-S868 VanDerWaalsContact O-N 3.1Å; K864-S868 PolarHBondContact O-OG 2.79Å; K865-S868 PolarHBondContact O-N 3.37Å; S868-N870 VanDerWaalsContact C-N 3.33Å; S868-E871 WeakPolarHBondContact CA-OE2 3.48Å; S868-E871 PolarHBondContact O-N 2.94Å; S868-L872 WeakPolarHBondContact O-CB 3.43Å; S868-L872 VanDerWaalsContact O-CG 3.31Å; S868-L872 WeakPolarHBondContact O-CG 3.44Å; S868-L872 PolarHBondContact O-N 3.32Å
869	L	84.8	Confident	83.6	Confident	85 Å²	85	103.8 Å²	103.8	45%	0.445	52%	0.517	S	S	.	.	H	α-helix	trans	-65.6	-38.5	172.9	-162.5	163	0	0	0	110.8	K865 E866 R867 L872 R873	K865-L869 VanDerWaalsContact O-CB 3.3Å; K865-L869 WeakPolarHBondContact O-CB 3.27Å; K865-L869 PolarHBondContact O-N 2.98Å; E866-L869 PolarHBondContact O-N 2.9Å; R867-L869 VanDerWaalsContact C-N 3.31Å; R867-L869 PolarHBondContact O-N 3.08Å; L869-L872 PolarHBondContact O-N 2.86Å; L869-R873 HydrophobicContact CD2-CG 4.27Å; L869-R873 VanDerWaalsContact CD2-NE 3.34Å; L869-R873 WeakPolarHBondContact O-CG 3.48Å; L869-R873 PolarHBondContact O-N 3.18Å
870	N	86.2	Confident	83.2	Confident	88 Å²	88	106.4 Å²	106.4	47%	0.471	52%	0.522	S	S	.	.	H	α-helix	trans	-70.6	-35.5	175	-165.3	79.2	0	0	0	113.2	E866 R867 S868 R873 V874	E866-N870 WeakPolarHBondContact O-CB 3.47Å; E866-N870 PolarHBondContact O-N 3.24Å; R867-N870 CarbonylContact O-C 3.59Å; R867-N870 WeakPolarHBondContact O-CA 3.45Å; R867-N870 WeakPolarHBondContact O-CB 3.4Å; R867-N870 PolarHBondContact O-N 3.01Å; S868-N870 VanDerWaalsContact C-N 3.33Å; N870-R873 WeakPolarHBondContact O-CB 3.39Å; N870-R873 PolarHBondContact O-N 2.87Å; N870-V874 WeakPolarHBondContact O-CG2 3.12Å; N870-V874 PolarHBondContact O-N 3.23Å; N870-V874 VanDerWaalsContact O-N 3.09Å
871	E	88.1	Confident	82.5	Confident	116 Å²	116	109.7 Å²	109.7	54%	0.542	53%	0.529	S	S	.	.	H	α-helix	trans	-62.2	-46.8	170.9	-71.6	161.6	179.4	0	0	111.1	R867 S868 R873 V874 L875	R867-E871 WeakPolarHBondContact O-CG 3.38Å; R867-E871 PolarHBondContact O-N 3.03Å; S868-E871 WeakPolarHBondContact CA-OE2 3.48Å; S868-E871 PolarHBondContact O-N 2.94Å; E871-R873 VanDerWaalsContact C-N 3.31Å; E871-R873 PolarHBondContact O-N 2.94Å; E871-V874 PolarHBondContact O-N 3.09Å; E871-V874 VanDerWaalsContact O-N 3.09Å; E871-L875 WeakPolarHBondContact O-CG 3.49Å; E871-L875 PolarHBondContact O-N 3.36Å
872	L	84.4	Confident	81.7	Confident	117 Å²	117	111.2 Å²	111.2	61%	0.613	54%	0.536	S	S	*	.	H	α-helix	trans	-60.1	-37.5	174.3	-73	168	0	0	0	112.6	S868 L869 L876	S868-L872 WeakPolarHBondContact O-CB 3.43Å; S868-L872 VanDerWaalsContact O-CG 3.31Å; S868-L872 WeakPolarHBondContact O-CG 3.44Å; S868-L872 PolarHBondContact O-N 3.32Å; L869-L872 PolarHBondContact O-N 2.86Å; L872-L876 VanDerWaalsContact O-CB 3.28Å; L872-L876 WeakPolarHBondContact O-CB 3.36Å; L872-L876 PolarHBondContact O-N 2.87Å
873	R	85.8	Confident	81.2	Confident	151 Å²	151	109.1 Å²	109.1	57%	0.57	53%	0.532	S	S	*	.	H	α-helix	trans	-62.7	-40.2	172.7	-76.5	171.7	174.9	158.6	0.2	112.4	L869 N870 E871 L877	L869-R873 HydrophobicContact CD2-CG 4.27Å; L869-R873 VanDerWaalsContact CD2-NE 3.34Å; L869-R873 WeakPolarHBondContact O-CG 3.48Å; L869-R873 PolarHBondContact O-N 3.18Å; N870-R873 WeakPolarHBondContact O-CB 3.39Å; N870-R873 PolarHBondContact O-N 2.87Å; E871-R873 VanDerWaalsContact C-N 3.31Å; E871-R873 PolarHBondContact O-N 2.94Å; R873-L877 VanDerWaalsContact O-CG 3.31Å; R873-L877 WeakPolarHBondContact O-CG 3.29Å; R873-L877 PolarHBondContact O-N 2.86Å
874	V	85.8	Confident	80.5	Confident	65 Å²	65	112.6 Å²	112.6	39%	0.394	54%	0.539	S	S	.	.	H	α-helix	trans	-66.1	-49.5	176.4	172.2	0	0	0	0	110.5	N870 E871 L876 L877 E878	N870-V874 WeakPolarHBondContact O-CG2 3.12Å; N870-V874 PolarHBondContact O-N 3.23Å; N870-V874 VanDerWaalsContact O-N 3.09Å; E871-V874 PolarHBondContact O-N 3.09Å; E871-V874 VanDerWaalsContact O-N 3.09Å; V874-L876 VanDerWaalsContact C-N 3.28Å; V874-L876 PolarHBondContact O-N 3.44Å; V874-L877 PolarHBondContact O-N 3.11Å; V874-L877 VanDerWaalsContact O-N 3.12Å; V874-E878 HydrophobicContact CG1-CG 4.41Å; V874-E878 WeakPolarHBondContact O-CG 3.21Å; V874-E878 PolarHBondContact O-N 3.38Å
875	L	81.4	Confident	79.9	Confident	105 Å²	105	111.2 Å²	111.2	55%	0.55	54%	0.537	S	S	.	.	H	α-helix	trans	-58.9	-38.8	177.8	-68.8	171.5	0	0	0	112.4	E871 E878 S879	E871-L875 WeakPolarHBondContact O-CG 3.49Å; E871-L875 PolarHBondContact O-N 3.36Å; L875-E878 PolarHBondContact O-N 2.95Å; L875-S879 VanDerWaalsContact O-CB 3.32Å; L875-S879 WeakPolarHBondContact O-CB 3.4Å; L875-S879 PolarHBondContact O-N 2.97Å
876	L	78.6	Confident	79.3	Confident	103 Å²	103	109.8 Å²	109.8	54%	0.539	54%	0.539	S	S	.	.	H	α-helix	trans	-67.2	-40.8	176.2	-172.9	144.3	0	0	0	111.9	L872 V874 S879 H880	L872-L876 VanDerWaalsContact O-CB 3.28Å; L872-L876 WeakPolarHBondContact O-CB 3.36Å; L872-L876 PolarHBondContact O-N 2.87Å; V874-L876 VanDerWaalsContact C-N 3.28Å; V874-L876 PolarHBondContact O-N 3.44Å; L876-S879 PolarHBondContact O-N 3.4Å; L876-H880 PolarHBondContact O-N 2.95Å; L876-H880 VanDerWaalsContact O-N 3.13Å; L876-H880 PolarHBondContact O-ND1 3.17Å
877	L	79.3	Confident	78.7	Confident	116 Å²	116	109.4 Å²	109.4	61%	0.607	54%	0.537	S	S	*	.	H	α-helix	trans	-65.9	-38.7	174.2	-74.4	167.8	0	0	0	112.3	R873 V874 R881	R873-L877 VanDerWaalsContact O-CG 3.31Å; R873-L877 WeakPolarHBondContact O-CG 3.29Å; R873-L877 PolarHBondContact O-N 2.86Å; V874-L877 PolarHBondContact O-N 3.11Å; V874-L877 VanDerWaalsContact O-N 3.12Å; L877-R881 WeakPolarHBondContact O-CG 3.4Å; L877-R881 PolarHBondContact O-N 2.92Å
878	E	76	Confident	78.1	Confident	95 Å²	95	105.9 Å²	105.9	44%	0.444	53%	0.526	S	S	.	.	H	α-helix	trans	-68.2	-41.2	175.7	-72.1	-179.3	164.5	0	0	111.6	V874 L875 H880 R881 H882	V874-E878 HydrophobicContact CG1-CG 4.41Å; V874-E878 WeakPolarHBondContact O-CG 3.21Å; V874-E878 PolarHBondContact O-N 3.38Å; L875-E878 PolarHBondContact O-N 2.95Å; E878-H880 PolarHBondContact O-N 3.12Å; E878-R881 PolarHBondContact O-N 2.89Å; E878-R881 VanDerWaalsContact O-N 3.11Å; E878-H882 PolarHBondContact O-N 3.25Å; E878-H882 PolarHBondContact O-ND1 3.34Å
879	S	74.2	Confident	77.5	Confident	75 Å²	75	106.7 Å²	106.7	52%	0.524	53%	0.525	S	S	.	.	H	α-helix	trans	-57.3	-46	174.1	-179.8	0	0	0	0	112.1	L875 L876 R881 H882 S883	L875-S879 VanDerWaalsContact O-CB 3.32Å; L875-S879 WeakPolarHBondContact O-CB 3.4Å; L875-S879 PolarHBondContact O-N 2.97Å; L876-S879 PolarHBondContact O-N 3.4Å; S879-R881 VanDerWaalsContact C-N 3.27Å; S879-R881 PolarHBondContact O-N 2.96Å; S879-H882 PolarHBondContact O-N 2.94Å; S879-S883 VanDerWaalsContact O-CB 3.32Å; S879-S883 WeakPolarHBondContact O-CB 3.35Å; S879-S883 PolarHBondContact O-N 3.4Å
880	H	71.6	Confident	77.1	Confident	122 Å²	122	108.2 Å²	108.2	57%	0.565	53%	0.533	S	S	*	.	H	α-helix	trans	-61.9	-31.7	175.8	-77.6	76.4	0	0	0	113.2	L876 E878 R884	L876-H880 PolarHBondContact O-N 2.95Å; L876-H880 VanDerWaalsContact O-N 3.13Å; L876-H880 PolarHBondContact O-ND1 3.17Å; E878-H880 PolarHBondContact O-N 3.12Å; H880-R884 WeakPolarHBondContact O-CB 3.45Å; H880-R884 PolarHBondContact O-N 3.18Å
881	R	72.6	Confident	76.4	Confident	183 Å²	183	106.9 Å²	106.9	69%	0.691	53%	0.531	S	S	*	.	H	α-helix	trans	-72.4	-48.9	175.5	-69.2	178.8	69.3	152.4	2.1	111.7	L877 E878 S879 S883 R884 D885	L877-R881 WeakPolarHBondContact O-CG 3.4Å; L877-R881 PolarHBondContact O-N 2.92Å; E878-R881 PolarHBondContact O-N 2.89Å; E878-R881 VanDerWaalsContact O-N 3.11Å; S879-R881 VanDerWaalsContact C-N 3.27Å; S879-R881 PolarHBondContact O-N 2.96Å; R881-S883 VanDerWaalsContact C-N 3.35Å; R881-S883 PolarHBondContact O-N 3.44Å; R881-R884 PolarHBondContact O-N 2.8Å; R881-D885 PolarHBondContact O-N 3.48Å; R881-D885 VanDerWaalsContact O-N 3.09Å
882	H	69.1	Low	75.9	Confident	133 Å²	133	107.7 Å²	107.7	62%	0.616	53%	0.529	S	S	*	.	H	α-helix	trans	-60.6	-44.1	177.7	-69.6	92.5	0	0	0	111.6	E878 S879 R884 D885 V886	E878-H882 PolarHBondContact O-N 3.25Å; E878-H882 PolarHBondContact O-ND1 3.34Å; S879-H882 PolarHBondContact O-N 2.94Å; H882-R884 PolarHBondContact O-N 3.17Å; H882-D885 PolarHBondContact O-N 2.99Å; H882-V886 WeakPolarHBondContact O-CG2 3.36Å; H882-V886 PolarHBondContact O-N 3.08Å
883	S	74.9	Confident	75.6	Confident	77 Å²	77	107 Å²	107	54%	0.538	52%	0.523	S	S	.	.	H	α-helix	trans	-55.2	-51.4	175	-179.3	0	0	0	0	112.1	S879 R881 D885 V886 E887	S879-S883 VanDerWaalsContact O-CB 3.32Å; S879-S883 WeakPolarHBondContact O-CB 3.35Å; S879-S883 PolarHBondContact O-N 3.4Å; R881-S883 VanDerWaalsContact C-N 3.35Å; R881-S883 PolarHBondContact O-N 3.44Å; S883-D885 VanDerWaalsContact C-N 3.3Å; S883-D885 PolarHBondContact O-N 3.37Å; S883-V886 PolarHBondContact O-N 3.33Å; S883-E887 WeakPolarHBondContact O-CB 3.34Å; S883-E887 PolarHBondContact O-N 2.74Å
884	R	72.6	Confident	75.1	Confident	154 Å²	154	103.1 Å²	103.1	58%	0.581	52%	0.516	S	S	*	.	H	α-helix	trans	-68.8	-24	-178.3	-160.1	179.4	72.2	146.8	-0.1	114	H880 R881 H882 K888	H880-R884 WeakPolarHBondContact O-CB 3.45Å; H880-R884 PolarHBondContact O-N 3.18Å; R881-R884 PolarHBondContact O-N 2.8Å; H882-R884 PolarHBondContact O-N 3.17Å; R884-K888 WeakPolarHBondContact O-CD 3.28Å; R884-K888 WeakPolarHBondContact O-CE 3.44Å; R884-K888 VanDerWaalsContact O-CG 3.31Å; R884-K888 WeakPolarHBondContact O-CG 3.46Å; R884-K888 PolarHBondContact O-N 3.01Å
885	D	73.3	Confident	74.8	Confident	78 Å²	78	105.4 Å²	105.4	42%	0.417	52%	0.522	S	S	.	.	H	α-helix	trans	-85.1	-33.3	175.5	-70	-28.7	0	0	0	111.8	R881 H882 S883 K888 D889	R881-D885 PolarHBondContact O-N 3.48Å; R881-D885 VanDerWaalsContact O-N 3.09Å; H882-D885 PolarHBondContact O-N 2.99Å; S883-D885 VanDerWaalsContact C-N 3.3Å; S883-D885 PolarHBondContact O-N 3.37Å; D885-K888 PolarHBondContact O-N 3.24Å; D885-K888 IonicContact OD1-NZ 3.23Å; D885-K888 PolarHBondContact OD1-NZ 2.94Å; D885-D889 PolarHBondContact O-N 2.97Å; D885-D889 VanDerWaalsContact O-N 3.1Å
886	V	71.2	Confident	74.8	Confident	99 Å²	99	103.7 Å²	103.7	60%	0.6	51%	0.51	S	S	*	.	H	α-helix	trans	-63.5	-41.5	167.5	169.5	0	0	0	0	111.7	H882 S883 K888 D889 L890	H882-V886 WeakPolarHBondContact O-CG2 3.36Å; H882-V886 PolarHBondContact O-N 3.08Å; S883-V886 PolarHBondContact O-N 3.33Å; V886-K888 VanDerWaalsContact C-N 3.32Å; V886-K888 PolarHBondContact O-N 3.36Å; V886-D889 PolarHBondContact O-N 3.37Å; V886-L890 WeakPolarHBondContact O-CB 3.36Å; V886-L890 PolarHBondContact O-N 3.31Å
887	E	70.2	Confident	74.8	Confident	118 Å²	118	101.1 Å²	101.1	55%	0.551	50%	0.503	S	S	*	.	H	α-helix	trans	-58	-42.3	175.6	-178.4	-179.5	-140.6	0	0	112	S883 L890 S891	S883-E887 WeakPolarHBondContact O-CB 3.34Å; S883-E887 PolarHBondContact O-N 2.74Å; E887-L890 PolarHBondContact O-N 2.87Å; E887-S891 WeakPolarHBondContact O-CB 3.46Å; E887-S891 PolarHBondContact O-N 2.83Å; E887-S891 PolarHBondContact O-OG 2.85Å
888	K	75	Confident	74.8	Confident	84 Å²	84	99.5 Å²	99.5	37%	0.365	49%	0.493	S	S	.	.	H	α-helix	trans	-66.7	-39.8	174.8	-67.9	165.5	-162.5	163.1	0	112.6	R884 D885 V886 S891 R892	R884-K888 WeakPolarHBondContact O-CD 3.28Å; R884-K888 WeakPolarHBondContact O-CE 3.44Å; R884-K888 VanDerWaalsContact O-CG 3.31Å; R884-K888 WeakPolarHBondContact O-CG 3.46Å; R884-K888 PolarHBondContact O-N 3.01Å; D885-K888 PolarHBondContact O-N 3.24Å; D885-K888 IonicContact OD1-NZ 3.23Å; D885-K888 PolarHBondContact OD1-NZ 2.94Å; V886-K888 VanDerWaalsContact C-N 3.32Å; V886-K888 PolarHBondContact O-N 3.36Å; K888-S891 PolarHBondContact O-N 3.03Å; K888-R892 WeakPolarHBondContact O-CB 3.46Å; K888-R892 VanDerWaalsContact O-CG 3.31Å; K888-R892 WeakPolarHBondContact O-CG 3.35Å; K888-R892 PolarHBondContact O-N 3.13Å
889	D	73.3	Confident	75.1	Confident	77 Å²	77	99.9 Å²	99.9	41%	0.412	49%	0.49	S	S	.	.	H	α-helix	trans	-66.6	-39.6	176.1	-89.5	-28.9	0	0	0	111.9	D885 V886 R892 E893	D885-D889 PolarHBondContact O-N 2.97Å; D885-D889 VanDerWaalsContact O-N 3.1Å; V886-D889 PolarHBondContact O-N 3.37Å; D889-R892 PolarHBondContact O-N 3.01Å; D889-R892 IonicContact OD1-CZ 2.82Å; D889-R892 VanDerWaalsContact OD1-CZ 3.28Å; D889-R892 IonicContact OD1-NE 2.72Å; D889-R892 PolarHBondContact OD1-NE 3.44Å; D889-R892 VanDerWaalsContact OD1-NE 3.16Å; D889-R892 IonicContact OD1-NH2 3.79Å; D889-R892 PolarHBondContact OD1-NH2 2.87Å; D889-R892 IonicContact OD2-NH2 2.63Å; D889-E893 PolarHBondContact O-N 3.33Å
890	L	74.6	Confident	75.5	Confident	117 Å²	117	101.4 Å²	101.4	61%	0.613	49%	0.487	S	S	*	.	H	α-helix	trans	-61.4	-47.1	172.4	-174.6	61.3	0	0	0	111.1	V886 E887 R892 E893 V894	V886-L890 WeakPolarHBondContact O-CB 3.36Å; V886-L890 PolarHBondContact O-N 3.31Å; E887-L890 PolarHBondContact O-N 2.87Å; L890-R892 VanDerWaalsContact C-N 3.3Å; L890-R892 PolarHBondContact O-N 3.17Å; L890-E893 PolarHBondContact O-N 2.99Å; L890-V894 HydrophobicContact CD1-CG2 4.47Å; L890-V894 HydrophobicContact CG-CG2 4.5Å; L890-V894 WeakPolarHBondContact O-CB 3.35Å; L890-V894 VanDerWaalsContact O-CG2 3.27Å; L890-V894 WeakPolarHBondContact O-CG2 3.44Å; L890-V894 PolarHBondContact O-N 3.03Å
891	S	73	Confident	76.1	Confident	60 Å²	60	100.5 Å²	100.5	42%	0.42	49%	0.49	S	S	.	.	H	α-helix	trans	-60	-38.7	177.1	-57.4	0	0	0	0	112.4	E887 K888 H895	E887-S891 WeakPolarHBondContact O-CB 3.46Å; E887-S891 PolarHBondContact O-N 2.83Å; E887-S891 PolarHBondContact O-OG 2.85Å; K888-S891 PolarHBondContact O-N 3.03Å; S891-H895 PolarHBondContact O-N 3.44Å; S891-H895 VanDerWaalsContact O-N 3.08Å
892	R	77.4	Confident	76.7	Confident	132 Å²	132	96.6 Å²	96.6	50%	0.498	48%	0.478	S	S	.	.	H	α-helix	trans	-65.3	-45.3	175.3	-77.6	-169.5	-73.1	-147	-0.1	112.4	K888 D889 L890 K896	K888-R892 WeakPolarHBondContact O-CB 3.46Å; K888-R892 VanDerWaalsContact O-CG 3.31Å; K888-R892 WeakPolarHBondContact O-CG 3.35Å; K888-R892 PolarHBondContact O-N 3.13Å; D889-R892 PolarHBondContact O-N 3.01Å; D889-R892 IonicContact OD1-CZ 2.82Å; D889-R892 VanDerWaalsContact OD1-CZ 3.28Å; D889-R892 IonicContact OD1-NE 2.72Å; D889-R892 PolarHBondContact OD1-NE 3.44Å; D889-R892 VanDerWaalsContact OD1-NE 3.16Å; D889-R892 IonicContact OD1-NH2 3.79Å; D889-R892 PolarHBondContact OD1-NH2 2.87Å; D889-R892 IonicContact OD2-NH2 2.63Å; L890-R892 VanDerWaalsContact C-N 3.3Å; L890-R892 PolarHBondContact O-N 3.17Å; R892-K896 WeakPolarHBondContact O-CB 3.44Å; R892-K896 PolarHBondContact O-N 3.26Å
893	E	77.4	Confident	77.5	Confident	103 Å²	103	92.7 Å²	92.7	48%	0.481	46%	0.46	S	S	.	.	H	α-helix	trans	-74.6	-29.8	179.6	-160	61.6	-137	0	0	112.1	D889 L890 K896 A897 K900	D889-E893 PolarHBondContact O-N 3.33Å; L890-E893 PolarHBondContact O-N 2.99Å; E893-K896 CarbonylContact O-C 3.6Å; E893-K896 PolarHBondContact O-N 2.9Å; E893-A897 WeakPolarHBondContact O-CB 3.49Å; E893-A897 PolarHBondContact O-N 3.03Å; E893-K900 IonicContact OE1-NZ 3.54Å
894	V	76.8	Confident	78.1	Confident	70 Å²	70	93.4 Å²	93.4	42%	0.424	46%	0.455	S	S	.	.	H	α-helix	trans	-59.9	-54.1	169.5	167.6	0	0	0	0	110.7	L890 K896 A897 E898	L890-V894 HydrophobicContact CD1-CG2 4.47Å; L890-V894 HydrophobicContact CG-CG2 4.5Å; L890-V894 WeakPolarHBondContact O-CB 3.35Å; L890-V894 VanDerWaalsContact O-CG2 3.27Å; L890-V894 WeakPolarHBondContact O-CG2 3.44Å; L890-V894 PolarHBondContact O-N 3.03Å; V894-K896 PolarHBondContact O-N 3Å; V894-A897 WeakPolarHBondContact O-CA 3.48Å; V894-A897 WeakPolarHBondContact O-CB 3.5Å; V894-A897 PolarHBondContact O-N 2.86Å; V894-E898 WeakPolarHBondContact O-CG 3.33Å; V894-E898 PolarHBondContact O-N 3.28Å
895	H	79.4	Confident	79	Confident	113 Å²	113	92.7 Å²	92.7	52%	0.523	46%	0.456	S	S	.	.	H	α-helix	trans	-59.8	-34.4	175.3	-78.4	-38.2	0	0	0	112.6	S891 A897 E898 W899	S891-H895 PolarHBondContact O-N 3.44Å; S891-H895 VanDerWaalsContact O-N 3.08Å; H895-A897 VanDerWaalsContact C-N 3.34Å; H895-E898 IonicContact CE1-OE2 2.7Å; H895-E898 IonicContact CG-OE2 2.79Å; H895-E898 IonicContact ND1-OE2 2.84Å; H895-E898 PolarHBondContact ND1-OE2 2.91Å; H895-E898 PolarHBondContact O-N 3.33Å; H895-W899 WeakPolarHBondContact O-CB 3.46Å; H895-W899 VanDerWaalsContact O-CD1 3.3Å; H895-W899 PolarHBondContact O-N 3.02Å
896	K	80.9	Confident	79.7	Confident	68 Å²	68	90.9 Å²	90.9	30%	0.296	45%	0.446	S	S	.	.	H	α-helix	trans	-67	-33.5	175	-166.2	161.4	-173	149.3	0	112.3	R892 E893 V894 K900 D969	R892-K896 WeakPolarHBondContact O-CB 3.44Å; R892-K896 PolarHBondContact O-N 3.26Å; E893-K896 CarbonylContact O-C 3.6Å; E893-K896 PolarHBondContact O-N 2.9Å; V894-K896 PolarHBondContact O-N 3Å; K896-K900 WeakPolarHBondContact O-CD 3.42Å; K896-K900 WeakPolarHBondContact O-CG 3.49Å; K896-K900 PolarHBondContact O-N 2.95Å; K896-D969 IonicContact NZ-OD1 3.19Å; K896-D969 PolarHBondContact NZ-OD1 2.95Å; K896-D969 IonicContact NZ-OD2 2.61Å; K896-D969 PolarHBondContact NZ-OD2 3.27Å
897	A	78.2	Confident	80.6	Confident	49 Å²	49	90 Å²	90	41%	0.405	44%	0.435	S	S	.	.	H	α-helix	trans	-71.4	-45.7	172.2	0	0	0	0	0	112	E893 V894 H895 W899 K900 V901	E893-A897 WeakPolarHBondContact O-CB 3.49Å; E893-A897 PolarHBondContact O-N 3.03Å; V894-A897 WeakPolarHBondContact O-CA 3.48Å; V894-A897 WeakPolarHBondContact O-CB 3.5Å; V894-A897 PolarHBondContact O-N 2.86Å; H895-A897 VanDerWaalsContact C-N 3.34Å; A897-W899 VanDerWaalsContact C-N 3.28Å; A897-W899 PolarHBondContact O-N 3.38Å; A897-K900 PolarHBondContact O-N 3.21Å; A897-V901 WeakPolarHBondContact O-CG2 3.3Å; A897-V901 PolarHBondContact O-N 3.26Å
898	E	79.3	Confident	81.6	Confident	82 Å²	82	87.7 Å²	87.7	38%	0.383	43%	0.427	S	S	.	.	H	α-helix	trans	-55.7	-42.6	174.5	-68.1	-179.7	145.8	0	0	112.3	V894 H895 V901 K902	V894-E898 WeakPolarHBondContact O-CG 3.33Å; V894-E898 PolarHBondContact O-N 3.28Å; H895-E898 IonicContact CE1-OE2 2.7Å; H895-E898 IonicContact CG-OE2 2.79Å; H895-E898 IonicContact ND1-OE2 2.84Å; H895-E898 PolarHBondContact ND1-OE2 2.91Å; H895-E898 PolarHBondContact O-N 3.33Å; E898-V901 PolarHBondContact O-N 3.23Å; E898-K902 WeakPolarHBondContact O-CG 3.38Å; E898-K902 PolarHBondContact O-N 3.41Å
899	W	82	Confident	82.3	Confident	104 Å²	104	86.6 Å²	86.6	39%	0.394	43%	0.425	S	S	.	.	H	α-helix	trans	-66.1	-40.4	177.4	-90.3	109.9	0	0	0	112.8	H895 A897 V901 K902 E903 A961	H895-W899 WeakPolarHBondContact O-CB 3.46Å; H895-W899 VanDerWaalsContact O-CD1 3.3Å; H895-W899 PolarHBondContact O-N 3.02Å; A897-W899 VanDerWaalsContact C-N 3.28Å; A897-W899 PolarHBondContact O-N 3.38Å; W899-V901 VanDerWaalsContact C-N 3.31Å; W899-V901 PolarHBondContact O-N 3.42Å; W899-K902 HydrophobicContact CD2-CD 4.38Å; W899-K902 HydrophobicContact CE3-CB 4.41Å; W899-K902 HydrophobicContact CE3-CD 4.2Å; W899-K902 PolarHBondContact O-N 2.92Å; W899-E903 WeakPolarHBondContact O-CB 3.37Å; W899-E903 PolarHBondContact O-N 3.03Å; W899-A961 HydrophobicContact CZ3-CB 4.17Å
900	K	82.7	Confident	83.2	Confident	106 Å²	106	83.4 Å²	83.4	46%	0.461	41%	0.408	S	S	.	.	H	α-helix	trans	-61.5	-38	172.3	-71.4	164.8	-177.2	165.1	0	112	E893 K896 A897 E903 Q904	E893-K900 IonicContact OE1-NZ 3.54Å; K896-K900 WeakPolarHBondContact O-CD 3.42Å; K896-K900 WeakPolarHBondContact O-CG 3.49Å; K896-K900 PolarHBondContact O-N 2.95Å; A897-K900 PolarHBondContact O-N 3.21Å; K900-E903 PolarHBondContact O-N 3.49Å; K900-Q904 WeakPolarHBondContact O-CB 3.29Å; K900-Q904 PolarHBondContact O-N 3.29Å
901	V	84.6	Confident	84	Confident	103 Å²	103	83.4 Å²	83.4	62%	0.624	40%	0.403	S	S	*	.	H	α-helix	trans	-66.9	-40.4	175.5	173.1	0	0	0	0	111.4	A897 E898 W899 K905	A897-V901 WeakPolarHBondContact O-CG2 3.3Å; A897-V901 PolarHBondContact O-N 3.26Å; E898-V901 PolarHBondContact O-N 3.23Å; W899-V901 VanDerWaalsContact C-N 3.31Å; W899-V901 PolarHBondContact O-N 3.42Å; V901-K905 WeakPolarHBondContact O-CB 3.32Å; V901-K905 PolarHBondContact O-N 2.96Å
902	K	85.3	Confident	84.9	Confident	102 Å²	102	83.1 Å²	83.1	44%	0.443	40%	0.399	S	S	.	.	H	α-helix	trans	-63.3	-42.1	173.1	-70.1	163.7	-174.9	164.7	0	111.8	E898 W899 K905 L906	E898-K902 WeakPolarHBondContact O-CG 3.38Å; E898-K902 PolarHBondContact O-N 3.41Å; W899-K902 HydrophobicContact CD2-CD 4.38Å; W899-K902 HydrophobicContact CE3-CB 4.41Å; W899-K902 HydrophobicContact CE3-CD 4.2Å; W899-K902 PolarHBondContact O-N 2.92Å; K902-K905 PolarHBondContact O-N 3.24Å; K902-L906 WeakPolarHBondContact O-CG 3.4Å; K902-L906 PolarHBondContact O-N 2.79Å; K902-L906 VanDerWaalsContact O-N 3.11Å
903	E	85.4	Confident	85.5	Confident	50 Å²	50	77.3 Å²	77.3	23%	0.234	38%	0.378	C	S	.	.	H	α-helix	trans	-62.7	-51.4	176.6	-166.5	-165.3	142.8	0	0	111.6	W899 K900 K905 L906 Q907 L958 L962	W899-E903 WeakPolarHBondContact O-CB 3.37Å; W899-E903 PolarHBondContact O-N 3.03Å; K900-E903 PolarHBondContact O-N 3.49Å; E903-K905 VanDerWaalsContact C-N 3.32Å; E903-K905 PolarHBondContact O-N 2.87Å; E903-L906 PolarHBondContact O-N 2.7Å; E903-L906 VanDerWaalsContact O-N 3.13Å; E903-Q907 WeakPolarHBondContact O-CG 3.31Å; E903-Q907 PolarHBondContact O-N 2.92Å; E903-Q907 PolarHBondContact OE1-NE2 3.46Å; E903-L958 HydrophobicContact CG-CD1 3.67Å; E903-L962 HydrophobicContact CG-CD2 4.3Å
904	Q	88	Confident	86.2	Confident	92 Å²	92	79.2 Å²	79.2	43%	0.43	38%	0.381	S	S	.	.	H	α-helix	trans	-57.1	-44.8	177	-178.5	59.3	54.3	0	0	111.3	K900 L906 Q907 D908	K900-Q904 WeakPolarHBondContact O-CB 3.29Å; K900-Q904 PolarHBondContact O-N 3.29Å; Q904-L906 VanDerWaalsContact C-N 3.33Å; Q904-L906 PolarHBondContact O-N 3.4Å; Q904-Q907 WeakPolarHBondContact O-CB 3.44Å; Q904-Q907 PolarHBondContact O-N 3.03Å; Q904-Q907 VanDerWaalsContact O-N 3.1Å; Q904-D908 VanDerWaalsContact NE2-CG 3.29Å; Q904-D908 PolarHBondContact NE2-OD1 3.1Å; Q904-D908 PolarHBondContact NE2-OD2 2.99Å; Q904-D908 PolarHBondContact O-N 3.31Å
905	K	90.1	Very high	86.8	Confident	140 Å²	140	80.7 Å²	80.7	61%	0.609	38%	0.383	S	S	*	.	H	α-helix	trans	-59.1	-41.9	176.6	-175.7	177.7	179	179.9	0	112.4	V901 K902 E903 D908 D909	V901-K905 WeakPolarHBondContact O-CB 3.32Å; V901-K905 PolarHBondContact O-N 2.96Å; K902-K905 PolarHBondContact O-N 3.24Å; E903-K905 VanDerWaalsContact C-N 3.32Å; E903-K905 PolarHBondContact O-N 2.87Å; K905-D908 PolarHBondContact O-N 3.33Å; K905-D909 WeakPolarHBondContact O-CB 3.43Å; K905-D909 PolarHBondContact O-N 2.84Å
906	L	89.8	Confident	87.3	Confident	39 Å²	39	80.4 Å²	80.4	20%	0.204	38%	0.38	C	S	.	.	H	α-helix	trans	-64.9	-39.2	175.3	-72.4	171.6	0	0	0	111.7	K902 E903 Q904 D909 I910 L958	K902-L906 WeakPolarHBondContact O-CG 3.4Å; K902-L906 PolarHBondContact O-N 2.79Å; K902-L906 VanDerWaalsContact O-N 3.11Å; E903-L906 PolarHBondContact O-N 2.7Å; E903-L906 VanDerWaalsContact O-N 3.13Å; Q904-L906 VanDerWaalsContact C-N 3.33Å; Q904-L906 PolarHBondContact O-N 3.4Å; L906-D909 PolarHBondContact O-N 3.41Å; L906-I910 WeakPolarHBondContact O-CB 3.46Å; L906-I910 VanDerWaalsContact O-CD1 3.32Å; L906-I910 WeakPolarHBondContact O-CD1 3.35Å; L906-I910 WeakPolarHBondContact O-CG1 3.41Å; L906-I910 PolarHBondContact O-N 3.11Å; L906-L958 HydrophobicContact CB-CB 4.3Å; L906-L958 HydrophobicContact CB-CD1 4.17Å; L906-L958 HydrophobicContact CD1-CB 4.32Å; L906-L958 HydrophobicContact CD1-CD1 4.36Å
907	Q	89.1	Confident	87.5	Confident	80 Å²	80	78.7 Å²	78.7	37%	0.374	37%	0.374	S	S	.	.	H	α-helix	trans	-63.3	-40.8	174.5	-64.8	-179.8	28.4	0	0	112	E903 Q904 I910 K911 L958	E903-Q907 WeakPolarHBondContact O-CG 3.31Å; E903-Q907 PolarHBondContact O-N 2.92Å; E903-Q907 PolarHBondContact OE1-NE2 3.46Å; Q904-Q907 WeakPolarHBondContact O-CB 3.44Å; Q904-Q907 PolarHBondContact O-N 3.03Å; Q904-Q907 VanDerWaalsContact O-N 3.1Å; Q907-I910 PolarHBondContact O-N 3.35Å; Q907-K911 WeakPolarHBondContact O-CB 3.43Å; Q907-K911 PolarHBondContact O-N 2.87Å; Q907-L958 HydrophobicContact CG-CD1 4.49Å; Q907-L958 HydrophobicContact CG-CD2 3.82Å
908	D	91.3	Very high	87.9	Confident	71 Å²	71	82.2 Å²	82.2	38%	0.38	39%	0.385	S	S	.	.	H	α-helix	trans	-71.6	-36.8	177.6	-69.1	-39.5	0	0	0	112.8	Q904 K905 K911 T912	Q904-D908 VanDerWaalsContact NE2-CG 3.29Å; Q904-D908 PolarHBondContact NE2-OD1 3.1Å; Q904-D908 PolarHBondContact NE2-OD2 2.99Å; Q904-D908 PolarHBondContact O-N 3.31Å; K905-D908 PolarHBondContact O-N 3.33Å; D908-K911 PolarHBondContact O-N 3.03Å; D908-T912 VanDerWaalsContact O-CB 3.31Å; D908-T912 WeakPolarHBondContact O-CB 3.37Å; D908-T912 PolarHBondContact O-N 3.36Å; D908-T912 PolarHBondContact O-OG1 2.85Å
909	D	90.4	Very high	88.1	Confident	60 Å²	60	82.9 Å²	82.9	32%	0.321	39%	0.391	S	S	.	.	H	α-helix	trans	-63.2	-45.1	170.8	-88.3	-37.4	0	0	0	110.9	K905 L906 K911 T912 L913	K905-D909 WeakPolarHBondContact O-CB 3.43Å; K905-D909 PolarHBondContact O-N 2.84Å; L906-D909 PolarHBondContact O-N 3.41Å; D909-K911 PolarHBondContact O-N 3.38Å; D909-T912 PolarHBondContact O-N 3.13Å; D909-L913 WeakPolarHBondContact O-CB 3.48Å; D909-L913 VanDerWaalsContact O-CG 3.27Å; D909-L913 WeakPolarHBondContact O-CG 3.46Å; D909-L913 PolarHBondContact O-N 3.38Å
910	I	91.6	Very high	88	Confident	11 Å²	11	79.5 Å²	79.5	6%	0.056	38%	0.38	C	S	.	.	H	α-helix	trans	-59.1	-46.6	174.8	-75.4	163.2	0	0	0	110.8	L906 Q907 L913 R914 L951 E955 L958	L906-I910 WeakPolarHBondContact O-CB 3.46Å; L906-I910 VanDerWaalsContact O-CD1 3.32Å; L906-I910 WeakPolarHBondContact O-CD1 3.35Å; L906-I910 WeakPolarHBondContact O-CG1 3.41Å; L906-I910 PolarHBondContact O-N 3.11Å; Q907-I910 PolarHBondContact O-N 3.35Å; I910-L913 PolarHBondContact O-N 3.49Å; I910-R914 WeakPolarHBondContact O-CB 3.34Å; I910-R914 VanDerWaalsContact O-CG 3.27Å; I910-R914 WeakPolarHBondContact O-CG 3.43Å; I910-R914 PolarHBondContact O-N 3.25Å; I910-L951 HydrophobicContact CB-CD1 4.3Å; I910-L951 HydrophobicContact CG1-CD1 4.34Å; I910-L951 HydrophobicContact CG2-CD1 3.99Å; I910-E955 HydrophobicContact CD1-CB 4.49Å; I910-E955 HydrophobicContact CD1-CG 3.84Å; I910-E955 HydrophobicContact CG1-CG 3.91Å; I910-E955 HydrophobicContact CG2-CG 4.15Å; I910-L958 HydrophobicContact CD1-CB 4.07Å; I910-L958 HydrophobicContact CD1-CD2 3.59Å; I910-L958 HydrophobicContact CD1-CG 4.49Å
911	K	91.9	Very high	87.7	Confident	117 Å²	117	76.2 Å²	76.2	51%	0.509	38%	0.377	S	S	.	.	H	α-helix	trans	-59.5	-48.7	175.7	-176.9	-172.6	171.7	-165	0	111.2	Q907 D908 D909 L913 R914 E915	Q907-K911 WeakPolarHBondContact O-CB 3.43Å; Q907-K911 PolarHBondContact O-N 2.87Å; D908-K911 PolarHBondContact O-N 3.03Å; D909-K911 PolarHBondContact O-N 3.38Å; K911-L913 VanDerWaalsContact C-N 3.33Å; K911-L913 PolarHBondContact O-N 2.99Å; K911-R914 PolarHBondContact O-N 3.05Å; K911-E915 WeakPolarHBondContact CE-OE1 3.36Å; K911-E915 WeakPolarHBondContact O-CG 3.41Å; K911-E915 PolarHBondContact O-N 3.48Å
912	T	91.4	Very high	87.2	Confident	54 Å²	54	80.2 Å²	80.2	33%	0.331	38%	0.381	S	S	.	.	H	α-helix	trans	-61.5	-38.8	179.3	-58.7	0	0	0	0	112.3	D908 D909 K916	D908-T912 VanDerWaalsContact O-CB 3.31Å; D908-T912 WeakPolarHBondContact O-CB 3.37Å; D908-T912 PolarHBondContact O-N 3.36Å; D908-T912 PolarHBondContact O-OG1 2.85Å; D909-T912 PolarHBondContact O-N 3.13Å; T912-K916 HydrophobicContact CG2-CD 4.21Å; T912-K916 WeakPolarHBondContact O-CB 3.36Å; T912-K916 VanDerWaalsContact O-CG 3.3Å; T912-K916 WeakPolarHBondContact O-CG 3.46Å; T912-K916 PolarHBondContact O-N 3.41Å
913	L	91	Very high	86.4	Confident	10 Å²	10	79.4 Å²	79.4	5%	0.052	38%	0.379	C	S	.	.	H	α-helix	trans	-69.6	-39.9	176.4	-73.2	167.4	0	0	0	111.9	D909 I910 K911 K916 L917 L947 R950 L951 T954	D909-L913 WeakPolarHBondContact O-CB 3.48Å; D909-L913 VanDerWaalsContact O-CG 3.27Å; D909-L913 WeakPolarHBondContact O-CG 3.46Å; D909-L913 PolarHBondContact O-N 3.38Å; I910-L913 PolarHBondContact O-N 3.49Å; K911-L913 VanDerWaalsContact C-N 3.33Å; K911-L913 PolarHBondContact O-N 2.99Å; L913-K916 PolarHBondContact O-N 2.96Å; L913-L917 WeakPolarHBondContact O-CB 3.33Å; L913-L917 WeakPolarHBondContact O-CG 3.42Å; L913-L917 PolarHBondContact O-N 2.89Å; L913-L947 HydrophobicContact CD2-CD2 3.89Å; L913-R950 HydrophobicContact CD1-CG 4.01Å; L913-R950 HydrophobicContact CD2-CG 4.22Å; L913-L951 HydrophobicContact CB-CB 4.32Å; L913-L951 HydrophobicContact CB-CD1 3.95Å; L913-T954 HydrophobicContact CD1-CG2 4.2Å
914	R	90.6	Very high	85.4	Confident	143 Å²	143	82.3 Å²	82.3	54%	0.54	39%	0.388	S	S	.	.	H	α-helix	trans	-64.1	-42	173.5	-71.4	168.2	175.9	-163.8	-1	111.9	I910 K911 L917 L918 L951 E955	I910-R914 WeakPolarHBondContact O-CB 3.34Å; I910-R914 VanDerWaalsContact O-CG 3.27Å; I910-R914 WeakPolarHBondContact O-CG 3.43Å; I910-R914 PolarHBondContact O-N 3.25Å; K911-R914 PolarHBondContact O-N 3.05Å; R914-L917 PolarHBondContact O-N 3.1Å; R914-L918 WeakPolarHBondContact O-CB 3.45Å; R914-L918 PolarHBondContact O-N 2.96Å; R914-L951 HydrophobicContact CG-CD1 3.92Å; R914-L951 HydrophobicContact CG-CD2 3.75Å; R914-E955 IonicContact CZ-OE1 2.67Å; R914-E955 VanDerWaalsContact CZ-OE1 3.24Å; R914-E955 IonicContact NE-OE1 2.6Å; R914-E955 PolarHBondContact NE-OE1 3.41Å; R914-E955 IonicContact NH2-OE1 3.46Å; R914-E955 PolarHBondContact NH2-OE1 3.22Å
915	E	90.3	Very high	84.1	Confident	100 Å²	100	81.8 Å²	81.8	47%	0.467	39%	0.394	S	S	.	.	H	α-helix	trans	-64	-43.3	175.4	-74.6	174.9	-173.5	0	0	112.1	K911 L917 L918 L919	K911-E915 WeakPolarHBondContact CE-OE1 3.36Å; K911-E915 WeakPolarHBondContact O-CG 3.41Å; K911-E915 PolarHBondContact O-N 3.48Å; E915-L917 PolarHBondContact O-N 2.73Å; E915-L918 PolarHBondContact O-N 3.16Å; E915-L919 WeakPolarHBondContact O-CG 3.42Å; E915-L919 PolarHBondContact O-N 3.04Å
916	K	88.4	Confident	82.7	Confident	108 Å²	108	77 Å²	77	47%	0.47	38%	0.378	S	S	.	.	H	α-helix	trans	-62	-42.3	174.6	-75.1	169.9	-179.2	174.2	0	112.8	T912 L913 L918 L919 L920	T912-K916 HydrophobicContact CG2-CD 4.21Å; T912-K916 WeakPolarHBondContact O-CB 3.36Å; T912-K916 VanDerWaalsContact O-CG 3.3Å; T912-K916 WeakPolarHBondContact O-CG 3.46Å; T912-K916 PolarHBondContact O-N 3.41Å; L913-K916 PolarHBondContact O-N 2.96Å; K916-L918 VanDerWaalsContact C-N 3.31Å; K916-L918 PolarHBondContact O-N 3.49Å; K916-L919 PolarHBondContact O-N 3.31Å; K916-L920 WeakPolarHBondContact O-CG 3.49Å; K916-L920 PolarHBondContact O-N 2.89Å
917	L	86.6	Confident	81	Confident	32 Å²	32	79.4 Å²	79.4	17%	0.168	40%	0.396	C	S	.	.	H	α-helix	trans	-64	-35.3	174.3	-77.5	167	0	0	0	112.4	L913 R914 E915 G921 V944 L947 R948 L951	L913-L917 WeakPolarHBondContact O-CB 3.33Å; L913-L917 WeakPolarHBondContact O-CG 3.42Å; L913-L917 PolarHBondContact O-N 2.89Å; R914-L917 PolarHBondContact O-N 3.1Å; E915-L917 PolarHBondContact O-N 2.73Å; L917-G921 PolarHBondContact O-N 3.39Å; L917-V944 HydrophobicContact CD2-CG1 4.14Å; L917-L947 HydrophobicContact CD2-CB 3.72Å; L917-L947 HydrophobicContact CG-CB 4.08Å; L917-R948 HydrophobicContact CD1-CG 4.16Å; L917-R948 HydrophobicContact CD2-CG 3.99Å; L917-L951 HydrophobicContact CD1-CB 4.45Å; L917-L951 HydrophobicContact CD1-CD2 3.83Å
918	L	86.1	Confident	79.5	Confident	122 Å²	122	80.5 Å²	80.5	64%	0.639	41%	0.405	S	S	*	.	H	α-helix	trans	-70.3	-40.3	176	-171.7	150.5	0	0	0	111.9	R914 E915 K916 G921 R922	R914-L918 WeakPolarHBondContact O-CB 3.45Å; R914-L918 PolarHBondContact O-N 2.96Å; E915-L918 PolarHBondContact O-N 3.16Å; K916-L918 VanDerWaalsContact C-N 3.31Å; K916-L918 PolarHBondContact O-N 3.49Å; L918-G921 PolarHBondContact O-N 2.75Å; L918-R922 PolarHBondContact O-N 3.09Å
919	L	83.9	Confident	77.8	Confident	97 Å²	97	80.8 Å²	80.8	51%	0.508	40%	0.403	S	S	.	.	H	α-helix	trans	-63	-50	174.8	-72.4	169.4	0	0	0	111.8	E915 K916 G921 R922 E923	E915-L919 WeakPolarHBondContact O-CG 3.42Å; E915-L919 PolarHBondContact O-N 3.04Å; K916-L919 PolarHBondContact O-N 3.31Å; L919-G921 VanDerWaalsContact C-N 3.27Å; L919-G921 PolarHBondContact O-N 3.28Å; L919-R922 CarbonylContact O-C 3.54Å; L919-R922 WeakPolarHBondContact O-CA 3.47Å; L919-R922 VanDerWaalsContact O-CB 3.26Å; L919-R922 WeakPolarHBondContact O-CB 3.41Å; L919-R922 PolarHBondContact O-N 2.97Å; L919-E923 PolarHBondContact O-N 3.43Å
920	L	79.8	Confident	76.3	Confident	32 Å²	32	86.7 Å²	86.7	17%	0.168	42%	0.421	C	S	.	.	H	α-helix	trans	-60.3	-36.2	175	-71.7	167.4	0	0	0	112.1	K916 R922 E923 R924 V944 L947	K916-L920 WeakPolarHBondContact O-CG 3.49Å; K916-L920 PolarHBondContact O-N 2.89Å; L920-R922 VanDerWaalsContact C-N 3.29Å; L920-R922 PolarHBondContact O-N 3.01Å; L920-E923 PolarHBondContact O-N 3.04Å; L920-R924 VanDerWaalsContact O-CB 3.29Å; L920-R924 WeakPolarHBondContact O-CB 3.38Å; L920-R924 PolarHBondContact O-N 3.01Å; L920-V944 HydrophobicContact CB-CG2 4.27Å; L920-V944 HydrophobicContact CD1-CG2 4.34Å; L920-L947 HydrophobicContact CD1-CD1 3.36Å
921	G	75.3	Confident	74.5	Confident	38 Å²	38	95.6 Å²	95.6	39%	0.392	45%	0.454	S	S	.	.	H	α-helix	trans	-63.7	-32.3	171.8	0	0	0	0	0	113.5	L917 L918 L919 S925	L917-G921 PolarHBondContact O-N 3.39Å; L918-G921 PolarHBondContact O-N 2.75Å; L919-G921 VanDerWaalsContact C-N 3.27Å; L919-G921 PolarHBondContact O-N 3.28Å; G921-S925 PolarHBondContact O-N 3.48Å; G921-S925 PolarHBondContact O-OG 2.99Å
922	R	75.2	Confident	72.7	Confident	187 Å²	187	99.8 Å²	99.8	71%	0.706	47%	0.468	S	S	*	.	H	α-helix	trans	-74.9	-40.3	175.7	-151.9	176.8	-154.7	-127.3	3.3	112	L918 L919 L920 S925 S926	L918-R922 PolarHBondContact O-N 3.09Å; L919-R922 CarbonylContact O-C 3.54Å; L919-R922 WeakPolarHBondContact O-CA 3.47Å; L919-R922 VanDerWaalsContact O-CB 3.26Å; L919-R922 WeakPolarHBondContact O-CB 3.41Å; L919-R922 PolarHBondContact O-N 2.97Å; L920-R922 VanDerWaalsContact C-N 3.29Å; L920-R922 PolarHBondContact O-N 3.01Å; R922-S925 WeakPolarHBondContact CA-OG 3.25Å; R922-S925 PolarHBondContact O-N 2.61Å; R922-S925 PolarHBondContact O-OG 2.87Å; R922-S925 VanDerWaalsContact O-OG 3.12Å; R922-S926 PolarHBondContact O-N 2.59Å; R922-S926 VanDerWaalsContact O-N 3.07Å
923	E	67.4	Low	71	Confident	85 Å²	85	99.3 Å²	99.3	40%	0.397	47%	0.467	S	S	.	.	H	α-helix	trans	-64.9	-42.3	174	-69.8	167.6	176.8	0	0	111	L919 L920 S925 S926	L919-E923 PolarHBondContact O-N 3.43Å; L920-E923 PolarHBondContact O-N 3.04Å; E923-S925 PolarHBondContact O-N 3.19Å; E923-S926 PolarHBondContact O-N 3.44Å
924	R	65.3	Low	69.3	Low	111 Å²	111	108 Å²	108	42%	0.419	51%	0.509	S	S	.	.	H	α-helix	trans	-62.6	-24.7	174.4	-170.1	176	-171.1	176.5	6.3	114.1	L920 R930 D941	L920-R924 VanDerWaalsContact O-CB 3.29Å; L920-R924 WeakPolarHBondContact O-CB 3.38Å; L920-R924 PolarHBondContact O-N 3.01Å; R924-R930 PolarHBondContact O-NE 3.04Å; R924-R930 VanDerWaalsContact O-NE 3.14Å; R924-R930 PolarHBondContact O-NH2 3.35Å; R924-D941 IonicContact CZ-OD1 3.18Å; R924-D941 IonicContact CZ-OD2 2.69Å; R924-D941 IonicContact NH1-OD1 3.11Å; R924-D941 PolarHBondContact NH1-OD1 3.46Å; R924-D941 IonicContact NH1-OD2 2.62Å; R924-D941 VanDerWaalsContact NH2-CG 3.33Å; R924-D941 IonicContact NH2-OD1 3.02Å; R924-D941 PolarHBondContact NH2-OD1 2.94Å; R924-D941 IonicContact NH2-OD2 3.67Å; R924-D941 PolarHBondContact NH2-OD2 3.29Å
925	S	60.3	Low	67.8	Low	80 Å²	80	106.6 Å²	106.6	56%	0.559	51%	0.512	S	S	*	.	H	α-helix	trans	-99.2	-7.5	179.4	47.8	0	0	0	0	114.2	G921 R922 E923 P927	G921-S925 PolarHBondContact O-N 3.48Å; G921-S925 PolarHBondContact O-OG 2.99Å; R922-S925 WeakPolarHBondContact CA-OG 3.25Å; R922-S925 PolarHBondContact O-N 2.61Å; R922-S925 PolarHBondContact O-OG 2.87Å; R922-S925 VanDerWaalsContact O-OG 3.12Å; E923-S925 PolarHBondContact O-N 3.19Å; S925-P927 WeakPolarHBondContact O-CD 3.42Å
926	S	60.1	Low	66.4	Low	40 Å²	40	106.4 Å²	106.4	28%	0.28	51%	0.514	S	S	.	.			trans	-70.7	124.8	174.2	178.9	0	0	0	0	111.9	R922 E923 D928	R922-S926 PolarHBondContact O-N 2.59Å; R922-S926 VanDerWaalsContact O-N 3.07Å; E923-S926 PolarHBondContact O-N 3.44Å; S926-D928 VanDerWaalsContact C-N 3.32Å; S926-D928 PolarHBondContact O-N 3.49Å
927	P	56.1	Low	65.2	Low	90 Å²	90	106 Å²	106	58%	0.584	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-33.8	178	-24	35.2	0	0	0	114	S925	S925-P927 WeakPolarHBondContact O-CD 3.42Å
928	D	56.9	Low	64.2	Low	103 Å²	103	107.9 Å²	107.9	55%	0.551	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-34.9	-175.8	-60.6	-50.9	0	0	0	112.2	S926 R930 R931 Y932	S926-D928 VanDerWaalsContact C-N 3.32Å; S926-D928 PolarHBondContact O-N 3.49Å; D928-R930 PolarHBondContact O-N 2.93Å; D928-R931 PolarHBondContact O-N 2.69Å; D928-Y932 PolarHBondContact O-N 2.99Å
929	H	56.3	Low	63.4	Low	76 Å²	76	104.2 Å²	104.2	35%	0.352	53%	0.526	S	S	.	.	H	α-helix	trans	-62	-34	177.5	-162.8	88.1	0	0	0	111.4	R931 Y932 S933	H929-R931 PolarHBondContact O-N 3.23Å; H929-Y932 PolarHBondContact O-N 3.37Å; H929-S933 WeakPolarHBondContact O-CB 3.41Å; H929-S933 PolarHBondContact O-N 3.48Å
930	R	57	Low	62.8	Low	184 Å²	184	101.5 Å²	101.5	69%	0.694	51%	0.512	S	S	*	.	H	α-helix	trans	-69	-10.6	173.3	-65.6	-171.8	-176.2	-162.6	2.8	115	R924 D928	R924-R930 PolarHBondContact O-NE 3.04Å; R924-R930 VanDerWaalsContact O-NE 3.14Å; R924-R930 PolarHBondContact O-NH2 3.35Å; D928-R930 PolarHBondContact O-N 2.93Å
931	R	54.7	Low	62.5	Low	198 Å²	198	102.4 Å²	102.4	75%	0.747	52%	0.517	S	S	*	.	H	α-helix	trans	-101	-19.1	178.9	-62	-176.4	-172.7	-161.1	3.5	113.8	D928 H929	D928-R931 PolarHBondContact O-N 2.69Å; H929-R931 PolarHBondContact O-N 3.23Å
932	Y	54.3	Low	62.7	Low	205 Å²	205	104 Å²	104	80%	0.804	52%	0.522	S	S	*	.	H	α-helix	trans	-121.1	-12.6	-174.6	-78.6	-81.5	0	0	0	114.7	D928 H929 M934	D928-Y932 PolarHBondContact O-N 2.99Å; H929-Y932 PolarHBondContact O-N 3.37Å; Y932-M934 PolarHBondContact O-N 3.25Å
933	S	55.9	Low	63	Low	44 Å²	44	97.8 Å²	97.8	31%	0.308	50%	0.501	S	S	.	.			trans	-78.7	115.4	178.8	-165	0	0	0	0	111.5	H929 L935	H929-S933 WeakPolarHBondContact O-CB 3.41Å; H929-S933 PolarHBondContact O-N 3.48Å; S933-L935 PolarHBondContact O-N 3.11Å
934	M	55.5	Low	63.8	Low	192 Å²	192	94.3 Å²	94.3	95%	0.946	49%	0.486	S	S	*	.			trans	-80.1	12.1	173.8	-70.5	-71.7	-68.9	0	0	113.1	Y932	Y932-M934 PolarHBondContact O-N 3.25Å
935	L	58.3	Low	64.7	Low	115 Å²	115	93.2 Å²	93.2	60%	0.602	49%	0.488	S	S	*	.	S	Bend	trans	-90.3	135	-179.1	-69	165.5	0	0	0	110.8	S933 P937	S933-L935 PolarHBondContact O-N 3.11Å; L935-P937 WeakPolarHBondContact O-CD 3.45Å
936	D	60.8	Low	66	Low	95 Å²	95	97.2 Å²	97.2	51%	0.508	49%	0.491	S	S	.	.			trans	-59.6	126.3	172.4	178	1.4	0	0	0	110.5	S938 A939 L940	D936-S938 PolarHBondContact O-N 3.47Å; D936-S938 VanDerWaalsContact O-N 3.1Å; D936-S938 WeakPolarHBondContact OD1-CB 3.39Å; D936-S938 PolarHBondContact OD1-N 2.87Å; D936-S938 PolarHBondContact OD1-OG 3.33Å; D936-S938 WeakPolarHBondContact OD2-CB 3.27Å; D936-S938 PolarHBondContact OD2-OG 3.42Å; D936-A939 WeakPolarHBondContact O-CB 3.31Å; D936-A939 PolarHBondContact O-N 2.94Å; D936-L940 PolarHBondContact O-N 2.88Å
937	P	63.5	Low	67.4	Low	100 Å²	100	96.2 Å²	96.2	65%	0.649	48%	0.482	S	S	*	.	H	α-helix	trans	-49.6	-31.1	171.4	-29.3	36.3	0	0	0	114.5	L935 A939 L940 D941	L935-P937 WeakPolarHBondContact O-CD 3.45Å; P937-A939 VanDerWaalsContact C-N 3.33Å; P937-A939 PolarHBondContact O-N 2.88Å; P937-L940 PolarHBondContact O-N 3.41Å; P937-D941 PolarHBondContact O-N 2.99Å; P937-D941 VanDerWaalsContact O-N 3.11Å
938	S	66.1	Low	68.9	Low	72 Å²	72	98.8 Å²	98.8	50%	0.503	48%	0.48	S	S	.	.	H	α-helix	trans	-63.1	-38.4	177.1	90.2	0	0	0	0	112.3	D936 D941 S942	D936-S938 PolarHBondContact O-N 3.47Å; D936-S938 VanDerWaalsContact O-N 3.1Å; D936-S938 WeakPolarHBondContact OD1-CB 3.39Å; D936-S938 PolarHBondContact OD1-N 2.87Å; D936-S938 PolarHBondContact OD1-OG 3.33Å; D936-S938 WeakPolarHBondContact OD2-CB 3.27Å; D936-S938 PolarHBondContact OD2-OG 3.42Å; S938-D941 PolarHBondContact O-N 3.24Å; S938-S942 WeakPolarHBondContact O-CB 3.41Å; S938-S942 PolarHBondContact O-N 2.93Å
939	A	68.6	Low	70.5	Confident	45 Å²	45	98.9 Å²	98.9	37%	0.372	48%	0.477	S	S	.	.	H	α-helix	trans	-67.7	-41.1	178.6	0	0	0	0	0	111.1	D936 P937 S942 E943	D936-A939 WeakPolarHBondContact O-CB 3.31Å; D936-A939 PolarHBondContact O-N 2.94Å; P937-A939 VanDerWaalsContact C-N 3.33Å; P937-A939 PolarHBondContact O-N 2.88Å; A939-S942 WeakPolarHBondContact O-CB 3.48Å; A939-S942 PolarHBondContact O-N 3.39Å; A939-S942 PolarHBondContact O-OG 2.73Å; A939-E943 PolarHBondContact O-N 2.88Å
940	L	72.1	Confident	72.1	Confident	40 Å²	40	102.7 Å²	102.7	21%	0.209	49%	0.489	C	S	.	.	H	α-helix	trans	-66.3	-40.4	178.8	-137.8	105.4	0	0	0	111.9	D936 P937 E943 V944	D936-L940 PolarHBondContact O-N 2.88Å; P937-L940 PolarHBondContact O-N 3.41Å; L940-E943 PolarHBondContact O-N 3.44Å; L940-V944 WeakPolarHBondContact O-CG2 3.33Å; L940-V944 PolarHBondContact O-N 3.39Å
941	D	72.8	Confident	73.8	Confident	50 Å²	50	94.9 Å²	94.9	27%	0.267	46%	0.461	S	S	.	.	H	α-helix	trans	-69.5	-31.4	173.6	-92.1	-32	0	0	0	112.7	R924 P937 S938 E943 N945	R924-D941 IonicContact CZ-OD1 3.18Å; R924-D941 IonicContact CZ-OD2 2.69Å; R924-D941 IonicContact NH1-OD1 3.11Å; R924-D941 PolarHBondContact NH1-OD1 3.46Å; R924-D941 IonicContact NH1-OD2 2.62Å; R924-D941 VanDerWaalsContact NH2-CG 3.33Å; R924-D941 IonicContact NH2-OD1 3.02Å; R924-D941 PolarHBondContact NH2-OD1 2.94Å; R924-D941 IonicContact NH2-OD2 3.67Å; R924-D941 PolarHBondContact NH2-OD2 3.29Å; P937-D941 PolarHBondContact O-N 2.99Å; P937-D941 VanDerWaalsContact O-N 3.11Å; S938-D941 PolarHBondContact O-N 3.24Å; D941-E943 VanDerWaalsContact C-N 3.35Å; D941-N945 WeakPolarHBondContact O-CB 3.32Å; D941-N945 VanDerWaalsContact O-CG 3.27Å; D941-N945 PolarHBondContact O-N 2.87Å; D941-N945 PolarHBondContact O-ND2 2.9Å; D941-N945 VanDerWaalsContact O-ND2 3.11Å
942	S	79.2	Confident	75.5	Confident	72 Å²	72	89 Å²	89	50%	0.503	44%	0.444	S	S	.	.	H	α-helix	trans	-62.8	-40.9	171.3	85.1	0	0	0	0	111.9	S938 A939 N945 R946	S938-S942 WeakPolarHBondContact O-CB 3.41Å; S938-S942 PolarHBondContact O-N 2.93Å; A939-S942 WeakPolarHBondContact O-CB 3.48Å; A939-S942 PolarHBondContact O-N 3.39Å; A939-S942 PolarHBondContact O-OG 2.73Å; S942-N945 PolarHBondContact O-N 3.49Å; S942-R946 WeakPolarHBondContact O-CB 3.17Å; S942-R946 PolarHBondContact O-N 3.48Å
943	E	82.3	Confident	77.3	Confident	57 Å²	57	83.6 Å²	83.6	27%	0.266	43%	0.428	S	S	.	.	H	α-helix	trans	-71.7	-40.9	179	-176.8	59.1	-167.3	0	0	112.2	A939 L940 D941 N945 R946 L947	A939-E943 PolarHBondContact O-N 2.88Å; L940-E943 PolarHBondContact O-N 3.44Å; D941-E943 VanDerWaalsContact C-N 3.35Å; E943-N945 VanDerWaalsContact C-N 3.3Å; E943-N945 PolarHBondContact O-N 2.89Å; E943-R946 PolarHBondContact O-N 3.37Å; E943-R946 IonicContact OE1-CZ 2.92Å; E943-R946 IonicContact OE1-NE 2.73Å; E943-R946 IonicContact OE1-NH2 2.61Å; E943-R946 PolarHBondContact OE1-NH2 2.9Å; E943-R946 IonicContact OE2-CZ 2.68Å; E943-R946 IonicContact OE2-NE 2.67Å; E943-R946 PolarHBondContact OE2-NE 2.97Å; E943-R946 IonicContact OE2-NH2 3.39Å; E943-R946 PolarHBondContact OE2-NH2 3.4Å; E943-L947 HydrophobicContact CG-CD1 4.13Å; E943-L947 WeakPolarHBondContact O-CB 3.37Å; E943-L947 WeakPolarHBondContact O-CG 3.37Å; E943-L947 PolarHBondContact O-N 2.87Å
944	V	83.8	Confident	78.9	Confident	12 Å²	12	82.5 Å²	82.5	7%	0.073	42%	0.42	C	S	.	.	H	α-helix	trans	-60.6	-41	173.4	168.4	0	0	0	0	110.9	L917 L920 L940 R948	L917-V944 HydrophobicContact CD2-CG1 4.14Å; L920-V944 HydrophobicContact CB-CG2 4.27Å; L920-V944 HydrophobicContact CD1-CG2 4.34Å; L940-V944 WeakPolarHBondContact O-CG2 3.33Å; L940-V944 PolarHBondContact O-N 3.39Å; V944-R948 WeakPolarHBondContact O-CB 3.27Å; V944-R948 VanDerWaalsContact O-CG 3.25Å; V944-R948 WeakPolarHBondContact O-CG 3.48Å; V944-R948 PolarHBondContact O-N 2.88Å
945	N	83.4	Confident	80.6	Confident	87 Å²	87	75.4 Å²	75.4	47%	0.465	39%	0.385	S	S	.	.	H	α-helix	trans	-69.4	-38.8	175.5	-71.6	-31.1	0	0	0	112.3	D941 S942 E943 L947 R948 Q949	D941-N945 WeakPolarHBondContact O-CB 3.32Å; D941-N945 VanDerWaalsContact O-CG 3.27Å; D941-N945 PolarHBondContact O-N 2.87Å; D941-N945 PolarHBondContact O-ND2 2.9Å; D941-N945 VanDerWaalsContact O-ND2 3.11Å; S942-N945 PolarHBondContact O-N 3.49Å; E943-N945 VanDerWaalsContact C-N 3.3Å; E943-N945 PolarHBondContact O-N 2.89Å; N945-L947 PolarHBondContact O-N 2.92Å; N945-R948 PolarHBondContact O-N 3.01Å; N945-Q949 PolarHBondContact O-N 3.31Å
946	R	88.1	Confident	82.1	Confident	165 Å²	165	72.7 Å²	72.7	62%	0.623	37%	0.371	S	S	*	.	H	α-helix	trans	-60.1	-43.5	173.4	-169.6	174.9	74.1	142.7	2.5	112	S942 E943 R950	S942-R946 WeakPolarHBondContact O-CB 3.17Å; S942-R946 PolarHBondContact O-N 3.48Å; E943-R946 PolarHBondContact O-N 3.37Å; E943-R946 IonicContact OE1-CZ 2.92Å; E943-R946 IonicContact OE1-NE 2.73Å; E943-R946 IonicContact OE1-NH2 2.61Å; E943-R946 PolarHBondContact OE1-NH2 2.9Å; E943-R946 IonicContact OE2-CZ 2.68Å; E943-R946 IonicContact OE2-NE 2.67Å; E943-R946 PolarHBondContact OE2-NE 2.97Å; E943-R946 IonicContact OE2-NH2 3.39Å; E943-R946 PolarHBondContact OE2-NH2 3.4Å; R946-R950 WeakPolarHBondContact O-CB 3.34Å; R946-R950 PolarHBondContact O-N 3.39Å
947	L	89.1	Confident	83.5	Confident	19 Å²	19	70.2 Å²	70.2	10%	0.099	36%	0.364	C	S	.	.	H	α-helix	trans	-70.6	-36.6	177.3	-72.7	169.9	0	0	0	112.7	L913 L917 L920 E943 N945 R950 L951	L913-L947 HydrophobicContact CD2-CD2 3.89Å; L917-L947 HydrophobicContact CD2-CB 3.72Å; L917-L947 HydrophobicContact CG-CB 4.08Å; L920-L947 HydrophobicContact CD1-CD1 3.36Å; E943-L947 HydrophobicContact CG-CD1 4.13Å; E943-L947 WeakPolarHBondContact O-CB 3.37Å; E943-L947 WeakPolarHBondContact O-CG 3.37Å; E943-L947 PolarHBondContact O-N 2.87Å; N945-L947 PolarHBondContact O-N 2.92Å; L947-R950 PolarHBondContact O-N 3.1Å; L947-L951 WeakPolarHBondContact O-CB 3.45Å; L947-L951 PolarHBondContact O-N 2.92Å
948	R	87.8	Confident	84.8	Confident	144 Å²	144	66.5 Å²	66.5	54%	0.543	34%	0.338	S	S	.	.	H	α-helix	trans	-62.3	-45.8	171.8	-78.2	169.4	171.7	-175.1	-5.1	112.2	L917 V944 N945 R950 L951 L952	L917-R948 HydrophobicContact CD1-CG 4.16Å; L917-R948 HydrophobicContact CD2-CG 3.99Å; V944-R948 WeakPolarHBondContact O-CB 3.27Å; V944-R948 VanDerWaalsContact O-CG 3.25Å; V944-R948 WeakPolarHBondContact O-CG 3.48Å; V944-R948 PolarHBondContact O-N 2.88Å; N945-R948 PolarHBondContact O-N 3.01Å; R948-R950 VanDerWaalsContact C-N 3.34Å; R948-L951 PolarHBondContact O-N 2.67Å; R948-L952 PolarHBondContact O-N 3.32Å
949	Q	90.2	Very high	85.9	Confident	104 Å²	104	69.2 Å²	69.2	49%	0.486	34%	0.337	S	S	.	.	H	α-helix	trans	-64.4	-41	176.6	-169.4	63.2	54.8	0	0	111.2	N945 L951 L952 N953	N945-Q949 PolarHBondContact O-N 3.31Å; Q949-L951 PolarHBondContact O-N 3.34Å; Q949-L952 PolarHBondContact O-N 2.85Å; Q949-N953 PolarHBondContact NE2-OD1 2.69Å; Q949-N953 WeakPolarHBondContact O-CB 3.45Å; Q949-N953 PolarHBondContact O-N 3.1Å; Q949-N953 PolarHBondContact O-OD1 3.02Å
950	R	91.3	Very high	86.8	Confident	156 Å²	156	72.2 Å²	72.2	59%	0.589	35%	0.347	S	S	*	.	H	α-helix	trans	-61.9	-42.2	175	-173.5	173	176.7	155.5	1.3	112.1	L913 R946 L947 R948 N953 T954	L913-R950 HydrophobicContact CD1-CG 4.01Å; L913-R950 HydrophobicContact CD2-CG 4.22Å; R946-R950 WeakPolarHBondContact O-CB 3.34Å; R946-R950 PolarHBondContact O-N 3.39Å; L947-R950 PolarHBondContact O-N 3.1Å; R948-R950 VanDerWaalsContact C-N 3.34Å; R950-N953 PolarHBondContact O-N 3.11Å; R950-T954 PolarHBondContact O-N 2.62Å; R950-T954 PolarHBondContact O-OG1 3.38Å
951	L	91.6	Very high	87.4	Confident	21 Å²	21	71.3 Å²	71.3	11%	0.11	35%	0.345	C	S	.	.	H	α-helix	trans	-60.3	-51.1	175.4	177	62.9	0	0	0	111.3	I910 L913 R914 L917 L947 R948 Q949 N953 T954 E955	I910-L951 HydrophobicContact CB-CD1 4.3Å; I910-L951 HydrophobicContact CG1-CD1 4.34Å; I910-L951 HydrophobicContact CG2-CD1 3.99Å; L913-L951 HydrophobicContact CB-CB 4.32Å; L913-L951 HydrophobicContact CB-CD1 3.95Å; R914-L951 HydrophobicContact CG-CD1 3.92Å; R914-L951 HydrophobicContact CG-CD2 3.75Å; L917-L951 HydrophobicContact CD1-CB 4.45Å; L917-L951 HydrophobicContact CD1-CD2 3.83Å; L947-L951 WeakPolarHBondContact O-CB 3.45Å; L947-L951 PolarHBondContact O-N 2.92Å; R948-L951 PolarHBondContact O-N 2.67Å; Q949-L951 PolarHBondContact O-N 3.34Å; L951-N953 VanDerWaalsContact C-N 3.34Å; L951-N953 PolarHBondContact O-N 3.37Å; L951-T954 WeakPolarHBondContact CA-OG1 3.47Å; L951-T954 PolarHBondContact O-N 3.18Å; L951-T954 VanDerWaalsContact O-N 3.09Å; L951-T954 PolarHBondContact O-OG1 3.47Å; L951-E955 HydrophobicContact CD1-CG 4.09Å; L951-E955 WeakPolarHBondContact CD1-OE1 3.4Å; L951-E955 HydrophobicContact CG-CG 4.41Å; L951-E955 WeakPolarHBondContact O-CG 3.49Å; L951-E955 PolarHBondContact O-N 3.45Å
952	L	91.7	Very high	88.1	Confident	75 Å²	75	71.8 Å²	71.8	39%	0.393	35%	0.348	S	S	.	.	H	α-helix	trans	-56.4	-48.5	177.9	-178.7	61.5	0	0	0	111.3	R948 Q949 T954 E955 D956	R948-L952 PolarHBondContact O-N 3.32Å; Q949-L952 PolarHBondContact O-N 2.85Å; L952-T954 VanDerWaalsContact C-N 3.28Å; L952-T954 PolarHBondContact O-N 3.5Å; L952-E955 PolarHBondContact O-N 3.01Å; L952-E955 VanDerWaalsContact O-N 3.1Å; L952-D956 PolarHBondContact O-N 2.98Å
953	N	91.8	Very high	88.4	Confident	90 Å²	90	74.1 Å²	74.1	48%	0.481	35%	0.351	S	S	.	.	H	α-helix	trans	-58.8	-36.8	177.1	-66.8	10.7	0	0	0	112.5	Q949 R950 L951 A957	Q949-N953 PolarHBondContact NE2-OD1 2.69Å; Q949-N953 WeakPolarHBondContact O-CB 3.45Å; Q949-N953 PolarHBondContact O-N 3.1Å; Q949-N953 PolarHBondContact O-OD1 3.02Å; R950-N953 PolarHBondContact O-N 3.11Å; L951-N953 VanDerWaalsContact C-N 3.34Å; L951-N953 PolarHBondContact O-N 3.37Å; N953-A957 WeakPolarHBondContact O-CB 3.48Å; N953-A957 PolarHBondContact O-N 3.45Å
954	T	89.9	Confident	88.4	Confident	22 Å²	22	75.9 Å²	75.9	14%	0.135	36%	0.359	C	S	.	.	H	α-helix	trans	-73.7	-35	174.7	49	0	0	0	0	113.4	L913 R950 L951 L952 A957 L958	L913-T954 HydrophobicContact CD1-CG2 4.2Å; R950-T954 PolarHBondContact O-N 2.62Å; R950-T954 PolarHBondContact O-OG1 3.38Å; L951-T954 WeakPolarHBondContact CA-OG1 3.47Å; L951-T954 PolarHBondContact O-N 3.18Å; L951-T954 VanDerWaalsContact O-N 3.09Å; L951-T954 PolarHBondContact O-OG1 3.47Å; L952-T954 VanDerWaalsContact C-N 3.28Å; L952-T954 PolarHBondContact O-N 3.5Å; T954-A957 PolarHBondContact O-N 3.41Å; T954-L958 WeakPolarHBondContact O-CB 3.3Å; T954-L958 PolarHBondContact O-N 3Å
955	E	89.9	Confident	88.3	Confident	42 Å²	42	77.5 Å²	77.5	20%	0.196	37%	0.367	C	S	.	.	H	α-helix	trans	-70.9	-30.7	175.8	-70.3	179.4	172.5	0	0	112.1	I910 R914 L951 L952 R959	I910-E955 HydrophobicContact CD1-CB 4.49Å; I910-E955 HydrophobicContact CD1-CG 3.84Å; I910-E955 HydrophobicContact CG1-CG 3.91Å; I910-E955 HydrophobicContact CG2-CG 4.15Å; R914-E955 IonicContact CZ-OE1 2.67Å; R914-E955 VanDerWaalsContact CZ-OE1 3.24Å; R914-E955 IonicContact NE-OE1 2.6Å; R914-E955 PolarHBondContact NE-OE1 3.41Å; R914-E955 IonicContact NH2-OE1 3.46Å; R914-E955 PolarHBondContact NH2-OE1 3.22Å; L951-E955 HydrophobicContact CD1-CG 4.09Å; L951-E955 WeakPolarHBondContact CD1-OE1 3.4Å; L951-E955 HydrophobicContact CG-CG 4.41Å; L951-E955 WeakPolarHBondContact O-CG 3.49Å; L951-E955 PolarHBondContact O-N 3.45Å; L952-E955 PolarHBondContact O-N 3.01Å; L952-E955 VanDerWaalsContact O-N 3.1Å; E955-R959 WeakPolarHBondContact O-CG 3.4Å; E955-R959 PolarHBondContact O-N 2.89Å; E955-R959 PolarHBondContact O-NE 2.98Å
956	D	91	Very high	88.3	Confident	58 Å²	58	78.6 Å²	78.6	31%	0.31	37%	0.369	S	S	.	.	H	α-helix	trans	-73.2	-43.2	170.2	-68.7	-22.3	0	0	0	111.6	L952 L958 R959 N960	L952-D956 PolarHBondContact O-N 2.98Å; D956-L958 VanDerWaalsContact C-N 3.33Å; D956-L958 PolarHBondContact O-N 3.19Å; D956-R959 PolarHBondContact O-N 2.94Å; D956-R959 IonicContact OD1-CZ 3.98Å; D956-R959 IonicContact OD1-NE 3.24Å; D956-R959 IonicContact OD1-NH1 3.59Å; D956-R959 IonicContact OD1-NH2 2.79Å; D956-R959 PolarHBondContact OD1-NH2 3.03Å; D956-N960 WeakPolarHBondContact O-CB 3.48Å; D956-N960 VanDerWaalsContact O-CG 3.23Å; D956-N960 PolarHBondContact O-N 3.35Å; D956-N960 PolarHBondContact O-ND2 3.02Å
957	A	89.5	Confident	88.1	Confident	44 Å²	44	76.1 Å²	76.1	36%	0.364	37%	0.365	S	S	.	.	H	α-helix	trans	-59.5	-42.2	175.3	0	0	0	0	0	112.3	N953 T954 A961	N953-A957 WeakPolarHBondContact O-CB 3.48Å; N953-A957 PolarHBondContact O-N 3.45Å; T954-A957 PolarHBondContact O-N 3.41Å; A957-A961 WeakPolarHBondContact O-CB 3.43Å; A957-A961 PolarHBondContact O-N 2.95Å
958	L	90.8	Very high	87.6	Confident	22 Å²	22	78 Å²	78	12%	0.115	38%	0.377	C	S	.	.	H	α-helix	trans	-65	-42.9	175	178.5	59.7	0	0	0	112	E903 L906 Q907 I910 T954 D956 A961 L962	E903-L958 HydrophobicContact CG-CD1 3.67Å; L906-L958 HydrophobicContact CB-CB 4.3Å; L906-L958 HydrophobicContact CB-CD1 4.17Å; L906-L958 HydrophobicContact CD1-CB 4.32Å; L906-L958 HydrophobicContact CD1-CD1 4.36Å; Q907-L958 HydrophobicContact CG-CD1 4.49Å; Q907-L958 HydrophobicContact CG-CD2 3.82Å; I910-L958 HydrophobicContact CD1-CB 4.07Å; I910-L958 HydrophobicContact CD1-CD2 3.59Å; I910-L958 HydrophobicContact CD1-CG 4.49Å; T954-L958 WeakPolarHBondContact O-CB 3.3Å; T954-L958 PolarHBondContact O-N 3Å; D956-L958 VanDerWaalsContact C-N 3.33Å; D956-L958 PolarHBondContact O-N 3.19Å; L958-A961 PolarHBondContact O-N 3.38Å; L958-L962 HydrophobicContact CD1-CD1 4.08Å; L958-L962 HydrophobicContact CD1-CG 4.19Å; L958-L962 HydrophobicContact CG-CD1 4.03Å; L958-L962 WeakPolarHBondContact O-CB 3.45Å; L958-L962 WeakPolarHBondContact O-CG 3.4Å; L958-L962 PolarHBondContact O-N 2.92Å
959	R	88.8	Confident	87.2	Confident	128 Å²	128	73.9 Å²	73.9	48%	0.483	37%	0.366	S	S	.	.	H	α-helix	trans	-61.6	-47.2	176.5	-81.4	179.4	-79.3	-176.5	-7.5	112.1	E955 D956 A961 L962 E963	E955-R959 WeakPolarHBondContact O-CG 3.4Å; E955-R959 PolarHBondContact O-N 2.89Å; E955-R959 PolarHBondContact O-NE 2.98Å; D956-R959 PolarHBondContact O-N 2.94Å; D956-R959 IonicContact OD1-CZ 3.98Å; D956-R959 IonicContact OD1-NE 3.24Å; D956-R959 IonicContact OD1-NH1 3.59Å; D956-R959 IonicContact OD1-NH2 2.79Å; D956-R959 PolarHBondContact OD1-NH2 3.03Å; R959-A961 VanDerWaalsContact C-N 3.33Å; R959-A961 PolarHBondContact O-N 3.31Å; R959-L962 PolarHBondContact O-N 2.94Å; R959-E963 PolarHBondContact O-N 2.85Å
960	N	88.3	Confident	86.9	Confident	109 Å²	109	74.9 Å²	74.9	58%	0.583	37%	0.368	S	S	*	.	H	α-helix	trans	-61.9	-40.3	177.8	-67.1	-20.7	0	0	0	111.9	D956 H964	D956-N960 WeakPolarHBondContact O-CB 3.48Å; D956-N960 VanDerWaalsContact O-CG 3.23Å; D956-N960 PolarHBondContact O-N 3.35Å; D956-N960 PolarHBondContact O-ND2 3.02Å; N960-H964 WeakPolarHBondContact O-CB 3.28Å; N960-H964 PolarHBondContact O-N 3.1Å
961	A	84.8	Confident	86.2	Confident	20 Å²	20	72.7 Å²	72.7	17%	0.165	37%	0.368	C	S	.	.	H	α-helix	trans	-64.3	-41.8	174.9	0	0	0	0	0	112.4	W899 A957 L958 R959 H964 N965	W899-A961 HydrophobicContact CZ3-CB 4.17Å; A957-A961 WeakPolarHBondContact O-CB 3.43Å; A957-A961 PolarHBondContact O-N 2.95Å; L958-A961 PolarHBondContact O-N 3.38Å; R959-A961 VanDerWaalsContact C-N 3.33Å; R959-A961 PolarHBondContact O-N 3.31Å; A961-H964 PolarHBondContact O-N 2.93Å; A961-N965 VanDerWaalsContact O-CB 3.29Å; A961-N965 WeakPolarHBondContact O-CB 3.42Å; A961-N965 PolarHBondContact O-N 3.02Å
962	L	86	Confident	85.4	Confident	61 Å²	61	74 Å²	74	32%	0.319	38%	0.376	S	S	.	.	H	α-helix	trans	-66.7	-42	177.4	-75.9	169.8	0	0	0	112.6	E903 L958 R959 N965 Q966	E903-L962 HydrophobicContact CG-CD2 4.3Å; L958-L962 HydrophobicContact CD1-CD1 4.08Å; L958-L962 HydrophobicContact CD1-CG 4.19Å; L958-L962 HydrophobicContact CG-CD1 4.03Å; L958-L962 WeakPolarHBondContact O-CB 3.45Å; L958-L962 WeakPolarHBondContact O-CG 3.4Å; L958-L962 PolarHBondContact O-N 2.92Å; R959-L962 PolarHBondContact O-N 2.94Å; L962-N965 PolarHBondContact O-N 3.45Å; L962-Q966 WeakPolarHBondContact O-CG 3.44Å; L962-Q966 PolarHBondContact O-N 3.32Å
963	E	86.3	Confident	84.7	Confident	121 Å²	121	74.9 Å²	74.9	57%	0.565	38%	0.378	S	S	*	.	H	α-helix	trans	-64.2	-44	174.8	-73.7	-164	174.4	0	0	111.9	R959 Q966 Q967	R959-E963 PolarHBondContact O-N 2.85Å; E963-Q966 PolarHBondContact O-N 3.36Å; E963-Q967 VanDerWaalsContact O-CG 3.3Å; E963-Q967 WeakPolarHBondContact O-CG 3.48Å; E963-Q967 PolarHBondContact O-N 2.91Å
964	H	82.6	Confident	83.9	Confident	94 Å²	94	73 Å²	73	44%	0.435	38%	0.375	S	S	.	.	H	α-helix	trans	-61.7	-44.5	176.2	-175.2	66.2	0	0	0	111.8	N960 A961 Q966 Q967 V968	N960-H964 WeakPolarHBondContact O-CB 3.28Å; N960-H964 PolarHBondContact O-N 3.1Å; A961-H964 PolarHBondContact O-N 2.93Å; H964-Q966 PolarHBondContact O-N 3Å; H964-Q967 WeakPolarHBondContact O-CB 3.21Å; H964-Q967 PolarHBondContact O-N 2.99Å; H964-Q967 VanDerWaalsContact O-N 3.09Å; H964-V968 WeakPolarHBondContact O-CG2 3.26Å; H964-V968 PolarHBondContact O-N 3.32Å
965	N	81.6	Confident	82.8	Confident	45 Å²	45	78.1 Å²	78.1	24%	0.241	40%	0.399	C	S	.	.	H	α-helix	trans	-61	-42.8	176.2	-165.4	-1.7	0	0	0	111.3	A961 L962 Q967 V968 D969	A961-N965 VanDerWaalsContact O-CB 3.29Å; A961-N965 WeakPolarHBondContact O-CB 3.42Å; A961-N965 PolarHBondContact O-N 3.02Å; L962-N965 PolarHBondContact O-N 3.45Å; N965-Q967 VanDerWaalsContact C-N 3.32Å; N965-Q967 PolarHBondContact O-N 3.2Å; N965-V968 PolarHBondContact O-N 2.86Å; N965-D969 PolarHBondContact O-N 3.49Å
966	Q	83.8	Confident	81.9	Confident	111 Å²	111	84.8 Å²	84.8	52%	0.519	42%	0.423	S	S	.	.	H	α-helix	trans	-62.8	-33.8	172.9	-74.6	-174.8	34.7	0	0	113.7	L962 E963 H964 K970	L962-Q966 WeakPolarHBondContact O-CG 3.44Å; L962-Q966 PolarHBondContact O-N 3.32Å; E963-Q966 PolarHBondContact O-N 3.36Å; H964-Q966 PolarHBondContact O-N 3Å; Q966-K970 WeakPolarHBondContact O-CB 3.29Å; Q966-K970 WeakPolarHBondContact O-CD 3.48Å; Q966-K970 WeakPolarHBondContact O-CG 3.06Å; Q966-K970 PolarHBondContact O-N 3.06Å; Q966-K970 VanDerWaalsContact O-N 3.12Å
967	Q	83	Confident	80.5	Confident	112 Å²	112	90.4 Å²	90.4	52%	0.523	44%	0.439	S	S	.	.	H	α-helix	trans	-68.3	-42	174.4	-69	166.3	20.6	0	0	111	E963 H964 N965 K970 L971	E963-Q967 VanDerWaalsContact O-CG 3.3Å; E963-Q967 WeakPolarHBondContact O-CG 3.48Å; E963-Q967 PolarHBondContact O-N 2.91Å; H964-Q967 WeakPolarHBondContact O-CB 3.21Å; H964-Q967 PolarHBondContact O-N 2.99Å; H964-Q967 VanDerWaalsContact O-N 3.09Å; N965-Q967 VanDerWaalsContact C-N 3.32Å; N965-Q967 PolarHBondContact O-N 3.2Å; Q967-K970 PolarHBondContact O-N 3.2Å; Q967-L971 PolarHBondContact O-N 3.06Å
968	V	79.5	Confident	78.5	Confident	59 Å²	59	95.3 Å²	95.3	36%	0.358	46%	0.455	S	S	.	.	H	α-helix	trans	-65.4	-47.8	176.3	174	0	0	0	0	111.7	H964 N965 K970 L971 V972	H964-V968 WeakPolarHBondContact O-CG2 3.26Å; H964-V968 PolarHBondContact O-N 3.32Å; N965-V968 PolarHBondContact O-N 2.86Å; V968-K970 VanDerWaalsContact C-N 3.28Å; V968-K970 PolarHBondContact O-N 3.32Å; V968-L971 WeakPolarHBondContact O-CB 3.41Å; V968-L971 PolarHBondContact O-N 2.84Å; V968-L971 VanDerWaalsContact O-N 3.11Å; V968-V972 HydrophobicContact CG1-CG2 4.37Å; V968-V972 WeakPolarHBondContact O-CG2 3.42Å; V968-V972 PolarHBondContact O-N 3.41Å
969	D	79.9	Confident	76.6	Confident	58 Å²	58	99.3 Å²	99.3	31%	0.31	48%	0.482	S	S	.	.	H	α-helix	trans	-63.7	-33	177.3	-106.3	-3.7	0	0	0	111.4	K896 N965 Q973	K896-D969 IonicContact NZ-OD1 3.19Å; K896-D969 PolarHBondContact NZ-OD1 2.95Å; K896-D969 IonicContact NZ-OD2 2.61Å; K896-D969 PolarHBondContact NZ-OD2 3.27Å; N965-D969 PolarHBondContact O-N 3.49Å; D969-Q973 WeakPolarHBondContact O-CB 3.44Å; D969-Q973 VanDerWaalsContact O-CG 3.29Å; D969-Q973 WeakPolarHBondContact O-CG 3.39Å; D969-Q973 PolarHBondContact O-N 3.07Å
970	K	82.2	Confident	74.4	Confident	125 Å²	125	99.8 Å²	99.8	54%	0.543	49%	0.494	S	S	.	.	H	α-helix	trans	-65.2	-43	171.1	-75.1	163.1	-166.1	161.9	0	112	Q966 Q967 V968 Q973 A974	Q966-K970 WeakPolarHBondContact O-CB 3.29Å; Q966-K970 WeakPolarHBondContact O-CD 3.48Å; Q966-K970 WeakPolarHBondContact O-CG 3.06Å; Q966-K970 PolarHBondContact O-N 3.06Å; Q966-K970 VanDerWaalsContact O-N 3.12Å; Q967-K970 PolarHBondContact O-N 3.2Å; V968-K970 VanDerWaalsContact C-N 3.28Å; V968-K970 PolarHBondContact O-N 3.32Å; K970-Q973 PolarHBondContact O-N 3.25Å; K970-A974 PolarHBondContact O-N 3.12Å
971	L	77.2	Confident	72.1	Confident	110 Å²	110	104 Å²	104	58%	0.576	51%	0.507	S	S	*	.	H	α-helix	trans	-64.2	-44.8	176.3	-177.5	63.1	0	0	0	111.7	Q967 V968 Q973 A974 M975	Q967-L971 PolarHBondContact O-N 3.06Å; V968-L971 WeakPolarHBondContact O-CB 3.41Å; V968-L971 PolarHBondContact O-N 2.84Å; V968-L971 VanDerWaalsContact O-N 3.11Å; L971-Q973 VanDerWaalsContact C-N 3.34Å; L971-Q973 PolarHBondContact O-N 3.29Å; L971-A974 WeakPolarHBondContact O-CB 3.44Å; L971-A974 PolarHBondContact O-N 3.42Å; L971-A974 VanDerWaalsContact O-N 3.16Å; L971-M975 WeakPolarHBondContact O-CG 3.42Å; L971-M975 PolarHBondContact O-N 3.25Å
972	V	74.6	Confident	69.6	Low	47 Å²	47	108.3 Å²	108.3	29%	0.285	54%	0.536	S	S	.	.	H	α-helix	trans	-63	-39.3	175.9	172.6	0	0	0	0	111.4	V968 M975 R976	V968-V972 HydrophobicContact CG1-CG2 4.37Å; V968-V972 WeakPolarHBondContact O-CG2 3.42Å; V968-V972 PolarHBondContact O-N 3.41Å; V972-M975 PolarHBondContact O-N 3.14Å; V972-R976 WeakPolarHBondContact O-CG 3.48Å; V972-R976 PolarHBondContact O-N 3.28Å
973	Q	76.7	Confident	67.1	Low	94 Å²	94	113.6 Å²	113.6	44%	0.439	56%	0.559	S	S	.	*	H	α-helix	trans	-66.8	-36	173	-76	-177.8	42.5	0	0	112.9	D969 K970 L971 R976 R977	D969-Q973 WeakPolarHBondContact O-CB 3.44Å; D969-Q973 VanDerWaalsContact O-CG 3.29Å; D969-Q973 WeakPolarHBondContact O-CG 3.39Å; D969-Q973 PolarHBondContact O-N 3.07Å; K970-Q973 PolarHBondContact O-N 3.25Å; L971-Q973 VanDerWaalsContact C-N 3.34Å; L971-Q973 PolarHBondContact O-N 3.29Å; Q973-R976 PolarHBondContact O-N 2.74Å; Q973-R977 WeakPolarHBondContact O-CG 3.39Å; Q973-R977 PolarHBondContact O-N 3.43Å
974	A	74.8	Confident	64.6	Low	50 Å²	50	114 Å²	114	41%	0.413	57%	0.57	S	S	.	*	H	α-helix	trans	-64.5	-46.9	174.4	0	0	0	0	0	111.4	K970 L971 R976 R977 H978	K970-A974 PolarHBondContact O-N 3.12Å; L971-A974 WeakPolarHBondContact O-CB 3.44Å; L971-A974 PolarHBondContact O-N 3.42Å; L971-A974 VanDerWaalsContact O-N 3.16Å; A974-R976 VanDerWaalsContact C-N 3.28Å; A974-R976 PolarHBondContact O-N 2.79Å; A974-R977 PolarHBondContact O-N 3.27Å; A974-H978 PolarHBondContact O-N 3.11Å
975	M	68.5	Low	62.2	Low	130 Å²	130	116.6 Å²	116.6	64%	0.64	59%	0.586	S	S	*	*	H	α-helix	trans	-59.2	-36.8	174.7	-67.8	178.5	75.1	0	0	112.5	L971 V972 R977	L971-M975 WeakPolarHBondContact O-CG 3.42Å; L971-M975 PolarHBondContact O-N 3.25Å; V972-M975 PolarHBondContact O-N 3.14Å; M975-R977 VanDerWaalsContact C-N 3.32Å; M975-R977 PolarHBondContact O-N 2.86Å
976	R	69.6	Low	59.7	Low	183 Å²	183	118 Å²	118	69%	0.691	61%	0.611	S	S	*	*	H	α-helix	trans	-73.3	-16.8	175.6	-74.1	-177.4	178.8	-140.3	-1.9	114.3	V972 Q973 A974	V972-R976 WeakPolarHBondContact O-CG 3.48Å; V972-R976 PolarHBondContact O-N 3.28Å; Q973-R976 PolarHBondContact O-N 2.74Å; A974-R976 VanDerWaalsContact C-N 3.28Å; A974-R976 PolarHBondContact O-N 2.79Å
977	R	62.5	Low	57.2	Low	175 Å²	175	117.5 Å²	117.5	66%	0.66	63%	0.626	S	S	*	*	H	α-helix	trans	-94.6	-16.5	179.4	-74.1	176.9	-172.8	158.4	10.7	114	Q973 A974 M975	Q973-R977 WeakPolarHBondContact O-CG 3.39Å; Q973-R977 PolarHBondContact O-N 3.43Å; A974-R977 PolarHBondContact O-N 3.27Å; M975-R977 VanDerWaalsContact C-N 3.32Å; M975-R977 PolarHBondContact O-N 2.86Å
978	H	47	Very low	54.6	Low	147 Å²	147	119.9 Å²	119.9	68%	0.681	64%	0.642	S	S	*	*			trans	-133.3	84.5	176.9	-66.6	-53.9	0	0	0	111.2	A974 D980	A974-H978 PolarHBondContact O-N 3.11Å; H978-D980 VanDerWaalsContact C-N 3.32Å
979	P	50.7	Low	52.2	Low	106 Å²	106	122.6 Å²	122.6	69%	0.688	66%	0.664	S	S	*	*			trans	-65.4	-37.9	169.3	27.1	-33.2	0	0	0	111.4	K981	P979-K981 PolarHBondContact O-N 3.12Å
980	D	43.3	Very low	50	Low	139 Å²	139	124 Å²	124	74%	0.743	68%	0.683	S	S	*	*	S	Bend	trans	-88.5	83.1	-180	-69.2	-50.5	0	0	0	112.6	H978	H978-D980 VanDerWaalsContact C-N 3.32Å
981	K	39.3	Very low	47.7	Very low	197 Å²	197	126.1 Å²	126.1	86%	0.857	70%	0.701	S	S	*	*			trans	178.9	67.6	143.1	-97.1	154.2	-172.7	174.8	0	112.3	P979 Q983	P979-K981 PolarHBondContact O-N 3.12Å; K981-Q983 PolarHBondContact O-N 3.31Å
982	S	33.6	Very low	45.4	Very low	111 Å²	111	124.2 Å²	124.2	78%	0.776	71%	0.708	S	S	*	*			trans	-70.9	97.6	163.3	-69.7	0	0	0	0	109.9	V984	S982-V984 PolarHBondContact O-N 3.37Å
983	Q	33.5	Very low	43.6	Very low	171 Å²	171	129.9 Å²	129.9	80%	0.799	74%	0.735	S	S	*	*			trans	-75.4	85.6	-178	-172.9	176.9	12	0	0	111.2	K981 L985	K981-Q983 PolarHBondContact O-N 3.31Å; Q983-L985 PolarHBondContact O-N 3.34Å; Q983-L985 VanDerWaalsContact O-N 3.08Å
984	V	31.9	Very low	41.3	Very low	131 Å²	131	134.1 Å²	134.1	79%	0.794	75%	0.754	S	S	*	*			trans	-79.4	88.8	175.7	-175	0	0	0	0	110.2	S982	S982-V984 PolarHBondContact O-N 3.37Å
985	L	32.4	Very low	39.3	Very low	148 Å²	148	140 Å²	140	78%	0.775	77%	0.773	S	S	*	*			trans	-89.8	122.4	154.6	-73.5	169.8	0	0	0	107.6	Q983	Q983-L985 PolarHBondContact O-N 3.34Å; Q983-L985 VanDerWaalsContact O-N 3.08Å
986	G	30.3	Very low	37.3	Very low	73 Å²	73	142.6 Å²	142.6	75%	0.753	78%	0.783	S	S	*	*			trans	-91	172.7	-167.8	0	0	0	0	0	115.4
987	A	30.1	Very low	35.6	Very low	102 Å²	102	142.7 Å²	142.7	84%	0.843	79%	0.791	S	S	*	*			trans	-136.1	152	165.2	0	0	0	0	0	109.4
988	N	29.3	Very low	34	Very low	161 Å²	161	140 Å²	140	86%	0.861	80%	0.8	S	S	*	*			trans	-101.1	139.2	-166.4	-56.2	-48.6	0	0	0	113.3
989	S	29.4	Very low	33.2	Very low	116 Å²	116	140.5 Å²	140.5	81%	0.811	81%	0.807	S	S	*	*			trans	168.5	130.9	138.7	-75.1	0	0	0	0	107.9
990	A	33.3	Very low	32.3	Very low	87 Å²	87	140.4 Å²	140.4	72%	0.719	81%	0.809	S	S	*	*			cis	86.8	116.9	41.2	0	0	0	0	0	113.8
991	N	33	Very low	31.8	Very low	170 Å²	170	140.1 Å²	140.1	91%	0.909	81%	0.813	S	S	*	*			trans	64	132.2	165.3	-61.2	-8.8	0	0	0	120.6
992	G	29.6	Very low	31.4	Very low	70 Å²	70	139.4 Å²	139.4	72%	0.722	81%	0.812	S	S	*	*				108.5	89	115.4	0	0	0	0	0	119
993	I	37.3	Very low	31.4	Very low	166 Å²	166	142.5 Å²	142.5	85%	0.851	81%	0.814	S	S	*	*			trans	12.2	115.9	136.3	-53.5	167.1	0	0	0	117
994	H	28.3	Very low	31.5	Very low	184 Å²	184	142.4 Å²	142.4	85%	0.852	81%	0.814	S	S	*	*				-160.5	149.1	122	-123.8	-47.1	0	0	0	112.5
995	H	31.5	Very low	31.6	Very low	174 Å²	174	144.6 Å²	144.6	81%	0.806	82%	0.816	S	S	*	*			trans	-67.9	149.7	154.2	-70.5	-83.1	0	0	0	110.2
996	Q	26.9	Very low	31.7	Very low	184 Å²	184	149.7 Å²	149.7	86%	0.86	84%	0.835	S	S	*	*				-156.7	156.3	110.5	-140.8	162.7	-4.9	0	0	112.4
997	E	34.5	Very low	31.8	Very low	184 Å²	184	153.5 Å²	153.5	86%	0.86	84%	0.839	S	S	*	*			trans	-75.5	159	165	-60	139.1	131.4	0	0	110.2
998	S	29.3	Very low	31.9	Very low	120 Å²	120	156.2 Å²	156.2	84%	0.839	84%	0.839	S	S	*	*			trans	-150.9	114.6	161.2	62.8	0	0	0	0	110.1
999	D	29.9	Very low	32	Very low	157 Å²	157	155.9 Å²	155.9	84%	0.84	84%	0.838	S	S	*	*			trans	-65.9	164.3	176.2	-100.2	-51.2	0	0	0	113.3
1000	S	32.4	Very low	32.1	Very low	104 Å²	104	158.3 Å²	158.3	73%	0.727	84%	0.839	S	S	*	*			trans	-75.6	130.8	166.3	53.2	0	0	0	0	112.1
1001	T	33	Very low	32.1	Very low	133 Å²	133	162.8 Å²	162.8	82%	0.816	85%	0.847	S	S	*	*			trans	-168.6	165.7	150.6	5.7	0	0	0	0	111.8
1002	Q	29.1	Very low	32	Very low	182 Å²	182	162.3 Å²	162.3	85%	0.85	84%	0.843	S	S	*	*			trans	68.6	114.4	179.9	-50.6	-161.5	-83.4	0	0	114.7
1003	E	33.9	Very low	32.2	Very low	175 Å²	175	168.9 Å²	168.9	82%	0.818	85%	0.851	S	S	*	*			cis	80.5	127.9	24	-151.4	170.5	-123.3	0	0	114.6
1004	E	36.3	Very low	31.8	Very low	170 Å²	170	169.1 Å²	169.1	79%	0.794	85%	0.851	S	S	*	*			trans	18.6	118.3	172.1	-59.5	-169.2	145.6	0	0	121.1
1005	Q	33.5	Very low	32.1	Very low	177 Å²	177	167.8 Å²	167.8	83%	0.827	85%	0.851	S	S	*	*				-171.3	139.8	103.1	-101.2	163.9	46.8	0	0	114.1
1006	H	34.7	Very low	32.1	Very low	254 Å²	254	167.3 Å²	167.3	100%	1.176	86%	0.855	S	S	*	*			trans	68.8	0	169.6	-76.4	-64.2	0	0	0	120.3

Retrieved 1,006 of 1,006 residues in 1419.8 ms (Link to these results)

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