BRE1_DROME Loading...

E3 ubiquitin-protein ligase Bre1

E3 ubiquitin-protein ligase that mediates monoubiquitination of 'Lys-117' of histone H2B. H2B 'Lys-117' ubiquitination gives a specific tag for epigenetic transcriptional activation and is also prerequisite for histone H3 'Lys-4' and 'Lys-79' methylation. It thereby plays a central role in histone code and gene regulation. Required for the expression of Notch target genes in development by affecting the levels of Su(H) in imaginal disk cells and stimulating the Su(H)-mediated transcription of Notch-specific genes.

AlphaFold DB , UniProt , Accession Q9VRP9, Species DROME (Drosophila melanogaster, Fruit fly), Gene Bre1, Length 1,044 aa.

						>BRE1_DROME|Q9VRP9|Bre1
MSKRSADDATGSSCLVAAAAAGQPPIKKVHFEPHLIGPVSTLEEMDIKVLEFQNKKLAQRIEQRMRTEAELRHRIEQLEKRQTQDDAVLNVVNRYWNQLNEDIRVLLQRFDAETADELENRNENEVTTSFLAQLSTWDKEELDEKLANRVQVSKRAVAKIVQVIDRLMQRNEKITHVLKGDSLASAGSGSGAGAGGEEEQQQASGDAETTTSSAGVHALEETLKQTHIEIMSENHKLQNLNTSLHEKFHTMSLKMKEYQDAHTAKETENAELKNQIDELQYDLEKIHCRNDKLENHLAEAIEKLKAYHQIYGDPNKSTNSAKTPTTTGSGGATTSVNSQLLEELQKELEEYRELANNRLQELDKLHATHRETLKEVEKLKMDIRQLPESVIVETTEYKCLQSQFSVLYNESMQIKTMLDETRNQLQTSKNQHLRQIEVMESEELIAQKKVRSEMIQMEDVLALIRKEYETLRIEFEQNMAANEQTAPINREMRHLITSLQNHNGQLKGEVQRYKRKYKDTSTDNLKLRQELADALATLEGNKLQAATGAAGEEIKQENSTGVKEENSNNVSASGQTNQTNSGNDTNVAIKEENHISAEDEADDEASGKDVKDGIKQEKLSSGDAAAAEKKDSPGPGNSTSSATNSVPVKNEKDSKDGVKGKDVKAVESETVRDLKAQLKKALNDQKEMKLLLDMYKGVSKDQRDKVQLMATEKKLRSEIEELRQQLKKLQESKREERKKLADEEALRKIKQLEEQKYELQKQMANHKPTDNSWGSGAPGTANYTRPFVGSHEEEALLNEMEVTGQAFEDMQEQNSRLIQQLREKDDANFKLMSERIKANQLHKLLREEKTVLEDQMATATTQIEAMHIVLRKLEEKERSLQATVASIEKELMLRQQAMEMHKRKAIESAQSAADLKLHLEKYHAQMKEAQQVVAEKTSSLEAEAYKTKRLQEELAQFKRKAERMKKMEMSGTTIDEVMIEEIREYKETLTCPSCKVKRKDAVLSKCFHVFCYDCLRTRYETRQRKCPKCNCAFGANDYHRLYLQ
					

Structure Viewer

Loading PAE data...

(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	36.3	Very low	34.5	Very low	245 Å²	245	146.5 Å²	146.5	100%	1.207	85%	0.846	S	S	*	*				0	105.7	0	-74.1	-172.5	148.2	0	0	108.8	K3	M1-K3 PolarHBondContact O-N 2.89Å
2	S	34.8	Very low	34.3	Very low	120 Å²	120	144.3 Å²	144.3	84%	0.839	85%	0.846	S	S	*	*			trans	-74.1	109.1	-179.8	-163.6	0	0	0	0	108.6	R4	S2-R4 PolarHBondContact O-N 2.79Å
3	K	33.2	Very low	33.9	Very low	202 Å²	202	141.2 Å²	141.2	88%	0.878	84%	0.837	S	S	*	*			trans	-52.2	106.9	170.3	-88.9	176.3	169	176.9	0	108.8	M1	M1-K3 PolarHBondContact O-N 2.89Å
4	R	34.3	Very low	33.7	Very low	240 Å²	240	138.1 Å²	138.1	91%	0.906	83%	0.825	S	S	*	*			trans	-90	114.3	159.5	-82	-174.2	175.2	-177.4	-0.9	106.7	S2 A6	S2-R4 PolarHBondContact O-N 2.79Å; R4-A6 PolarHBondContact O-N 3.45Å
5	S	33.3	Very low	33.6	Very low	106 Å²	106	140.3 Å²	140.3	74%	0.741	83%	0.829	S	S	*	*			trans	-51.7	121.2	179.9	-51.9	0	0	0	0	110.5	D7	S5-D7 PolarHBondContact O-N 2.59Å
6	A	37.3	Very low	33.6	Very low	90 Å²	90	140.7 Å²	140.7	74%	0.744	83%	0.833	S	S	*	*			trans	-70.7	113.7	161.4	0	0	0	0	0	106.5	R4 D8	R4-A6 PolarHBondContact O-N 3.45Å; A6-D8 PolarHBondContact O-N 3.39Å
7	D	34.8	Very low	33.6	Very low	159 Å²	159	137.7 Å²	137.7	85%	0.85	83%	0.828	S	S	*	*			trans	-67.4	113.9	169	-81.3	-36.9	0	0	0	108.3	S5 A9	S5-D7 PolarHBondContact O-N 2.59Å; D7-A9 PolarHBondContact O-N 2.75Å
8	D	34	Very low	33.6	Very low	145 Å²	145	135.3 Å²	135.3	78%	0.775	83%	0.825	S	S	*	*			trans	-58.2	98.1	169.8	-78.2	-45.1	0	0	0	110.3	A6 T10	A6-D8 PolarHBondContact O-N 3.39Å; D8-T10 PolarHBondContact O-N 3.03Å
9	A	35.8	Very low	33.6	Very low	101 Å²	101	133.7 Å²	133.7	84%	0.835	83%	0.827	S	S	*	*			trans	-93.6	77.8	157.8	0	0	0	0	0	108.4	D7 G11	D7-A9 PolarHBondContact O-N 2.75Å; A9-G11 VanDerWaalsContact C-N 3.34Å; A9-G11 PolarHBondContact O-N 2.7Å
10	T	32.6	Very low	33.8	Very low	134 Å²	134	131.8 Å²	131.8	82%	0.822	83%	0.825	S	S	*	*			trans	-64.3	91.6	164.7	39	0	0	0	0	109.2	D8	D8-T10 PolarHBondContact O-N 3.03Å
11	G	33.2	Very low	34.1	Very low	69 Å²	69	130.2 Å²	130.2	71%	0.711	83%	0.825	S	S	*	*			trans	-131.2	83.9	173.7	0	0	0	0	0	109.4	A9 S13	A9-G11 VanDerWaalsContact C-N 3.34Å; A9-G11 PolarHBondContact O-N 2.7Å; G11-S13 PolarHBondContact O-N 3.27Å
12	S	32.2	Very low	34	Very low	121 Å²	121	122 Å²	122	85%	0.846	80%	0.802	S	S	*	*			trans	-47.4	128	-179.3	-172.8	0	0	0	0	112.7
13	S	29.6	Very low	34.1	Very low	103 Å²	103	124.1 Å²	124.1	72%	0.72	80%	0.799	S	S	*	*			trans	-25.2	131.4	150	173.1	0	0	0	0	113.6	G11	G11-S13 PolarHBondContact O-N 3.27Å
14	C	30.6	Very low	34.3	Very low	99 Å²	99	119.5 Å²	119.5	67%	0.669	79%	0.79	S	S	*	*				140.1	78.9	121	-161.8	0	0	0	0	111.9
15	L	32.1	Very low	34.7	Very low	170 Å²	170	113.8 Å²	113.8	89%	0.89	78%	0.784	S	S	*	*			trans	-141.8	103.5	142	-83.7	-177.6	0	0	0	108.4	A17	L15-A17 PolarHBondContact O-N 2.93Å
16	V	33.6	Very low	35.2	Very low	147 Å²	147	115.3 Å²	115.3	89%	0.891	78%	0.782	S	S	*	*			trans	-58.4	97	166.6	178.7	0	0	0	0	107.6
17	A	33.1	Very low	35.6	Very low	90 Å²	90	120 Å²	120	74%	0.744	79%	0.786	S	S	*	*			trans	-120.1	108.1	163.9	0	0	0	0	0	106.9	L15 A19	L15-A17 PolarHBondContact O-N 2.93Å; A17-A19 PolarHBondContact O-N 3.24Å
18	A	33.8	Very low	36	Very low	94 Å²	94	121.6 Å²	121.6	78%	0.777	79%	0.785	S	S	*	*			trans	-41.8	133.6	-179.3	0	0	0	0	0	111.8	A20	A18-A20 VanDerWaalsContact C-N 3.3Å; A18-A20 PolarHBondContact O-N 2.78Å
19	A	34.6	Very low	37.1	Very low	105 Å²	105	118.1 Å²	118.1	87%	0.868	77%	0.769	S	S	*	*			trans	-54.8	87.1	176.8	0	0	0	0	0	111.4	A17 A21	A17-A19 PolarHBondContact O-N 3.24Å; A19-A21 PolarHBondContact O-N 3.06Å
20	A	37.1	Very low	37.7	Very low	95 Å²	95	122 Å²	122	79%	0.785	77%	0.769	S	S	*	*			trans	-70	104.4	151.7	0	0	0	0	0	105.6	A18 G22	A18-A20 VanDerWaalsContact C-N 3.3Å; A18-A20 PolarHBondContact O-N 2.78Å; A20-G22 VanDerWaalsContact C-N 3.32Å; A20-G22 PolarHBondContact O-N 3.45Å
21	A	40.2	Very low	38.8	Very low	100 Å²	100	119.6 Å²	119.6	83%	0.826	75%	0.748	S	S	*	*			trans	-48.8	95.5	173.8	0	0	0	0	0	109.9	A19 Q23	A19-A21 PolarHBondContact O-N 3.06Å; A21-Q23 PolarHBondContact O-N 2.99Å
22	G	35.2	Very low	39.7	Very low	71 Å²	71	124.8 Å²	124.8	73%	0.732	75%	0.754	S	S	*	*			trans	-69.9	95.3	175.8	0	0	0	0	0	108.4	A20	A20-G22 VanDerWaalsContact C-N 3.32Å; A20-G22 PolarHBondContact O-N 3.45Å
23	Q	35.8	Very low	41	Very low	166 Å²	166	124.5 Å²	124.5	78%	0.776	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-53.5	127.4	168.6	-144.9	170.9	17.5	0	0	107.9	A21	A21-Q23 PolarHBondContact O-N 2.99Å
24	P	38	Very low	42.6	Very low	104 Å²	104	124.8 Å²	124.8	68%	0.675	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-58.6	143.8	-175.2	22.8	-31.9	0	0	0	109.7	I26	P24-I26 PolarHBondContact O-N 3.41Å
25	P	42.7	Very low	44.3	Very low	121 Å²	121	127.8 Å²	127.8	79%	0.786	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-58	117.6	-169.2	23	-32.2	0	0	0	108.9	K27	P25-K27 VanDerWaalsContact C-N 3.29Å; P25-K27 PolarHBondContact O-N 3.47Å
26	I	43.5	Very low	45.9	Very low	138 Å²	138	123.8 Å²	123.8	71%	0.708	73%	0.726	S	S	*	*			trans	-56.6	98.9	174	-61.9	170.1	0	0	0	105.7	P24 K28	P24-I26 PolarHBondContact O-N 3.41Å; I26-K28 VanDerWaalsContact C-N 3.26Å; I26-K28 PolarHBondContact O-N 2.75Å
27	K	45.5	Very low	47.8	Very low	188 Å²	188	118.6 Å²	118.6	82%	0.817	70%	0.702	S	S	*	*			trans	-56.5	101	166	-75.6	-177.9	178.7	176.3	0	104.6	P25 V29	P25-K27 VanDerWaalsContact C-N 3.29Å; P25-K27 PolarHBondContact O-N 3.47Å; K27-V29 VanDerWaalsContact C-N 3.3Å; K27-V29 WeakPolarHBondContact O-CG2 3.35Å; K27-V29 PolarHBondContact O-N 3.34Å
28	K	43.8	Very low	49.8	Very low	193 Å²	193	120.1 Å²	120.1	84%	0.839	70%	0.704	S	S	*	*			trans	-57.7	99.4	178.2	-76.3	-178.6	177.8	177.5	0	106.4	I26 H30	I26-K28 VanDerWaalsContact C-N 3.26Å; I26-K28 PolarHBondContact O-N 2.75Å; K28-H30 PolarHBondContact O-N 2.88Å
29	V	56.2	Low	51.8	Low	72 Å²	72	118.3 Å²	118.3	44%	0.436	68%	0.683	S	S	.	*			trans	-66.8	103.7	179.3	-173.5	0	0	0	0	106.1	K27 F31	K27-V29 VanDerWaalsContact C-N 3.3Å; K27-V29 WeakPolarHBondContact O-CG2 3.35Å; K27-V29 PolarHBondContact O-N 3.34Å; V29-F31 HydrophobicContact CB-CD2 4.14Å; V29-F31 HydrophobicContact CB-CE2 3.52Å; V29-F31 HydrophobicContact CB-CZ 3.77Å; V29-F31 HydrophobicContact CG1-CD1 4.07Å; V29-F31 HydrophobicContact CG1-CD2 3.92Å; V29-F31 HydrophobicContact CG1-CE1 3.56Å; V29-F31 HydrophobicContact CG1-CE2 3.4Å; V29-F31 VanDerWaalsContact CG1-CE2 3.4Å; V29-F31 HydrophobicContact CG1-CG 4.24Å; V29-F31 HydrophobicContact CG1-CZ 3.2Å; V29-F31 WeakPolarHBondContact O-CD2 3.1Å; V29-F31 PolarHBondContact O-N 2.93Å
30	H	47.8	Very low	54	Low	181 Å²	181	118.3 Å²	118.3	84%	0.838	68%	0.677	S	S	*	*			trans	-75.6	104.8	176.6	-168	67.4	0	0	0	107.3	K28	K28-H30 PolarHBondContact O-N 2.88Å
31	F	56.6	Low	56.3	Low	85 Å²	85	117.5 Å²	117.5	37%	0.373	66%	0.662	S	S	.	*	P	Polyproline II helix	trans	-94.9	124.3	176	-64.7	-81.8	0	0	0	108.9	V29 K56	V29-F31 HydrophobicContact CB-CD2 4.14Å; V29-F31 HydrophobicContact CB-CE2 3.52Å; V29-F31 HydrophobicContact CB-CZ 3.77Å; V29-F31 HydrophobicContact CG1-CD1 4.07Å; V29-F31 HydrophobicContact CG1-CD2 3.92Å; V29-F31 HydrophobicContact CG1-CE1 3.56Å; V29-F31 HydrophobicContact CG1-CE2 3.4Å; V29-F31 VanDerWaalsContact CG1-CE2 3.4Å; V29-F31 HydrophobicContact CG1-CG 4.24Å; V29-F31 HydrophobicContact CG1-CZ 3.2Å; V29-F31 WeakPolarHBondContact O-CD2 3.1Å; V29-F31 PolarHBondContact O-N 2.93Å; F31-K56 VanDerWaalsContact CB-NZ 3.33Å
32	E	52.4	Low	58.4	Low	178 Å²	178	118.5 Å²	118.5	83%	0.832	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-60.9	129.6	174.5	-164	173.1	-172.8	0	0	110.2	H34	E32-H34 PolarHBondContact O-N 2.93Å
33	P	58.3	Low	60.7	Low	114 Å²	114	122 Å²	122	74%	0.74	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-61.6	130	179.6	-20.7	31.4	0	0	0	111.6
34	H	62.8	Low	63	Low	109 Å²	109	116.9 Å²	116.9	51%	0.505	63%	0.626	S	S	.	*	P	Polyproline II helix	trans	-91.5	116.4	175.3	-160.4	51.1	0	0	0	109.9	E32 I36 F52	E32-H34 PolarHBondContact O-N 2.93Å; H34-I36 PolarHBondContact O-N 2.92Å; H34-F52 HydrophobicContact CB-CD2 3.8Å; H34-F52 HydrophobicContact CB-CE2 3.61Å; H34-F52 AromaticContact CD2-CD2 3.95Å
35	L	66.3	Low	65.1	Low	163 Å²	163	116.1 Å²	116.1	85%	0.853	62%	0.615	S	S	*	*			trans	-73.3	106.9	176.4	-85.5	148.6	0	0	0	109.8	G37	L35-G37 PolarHBondContact O-N 3.42Å
36	I	65.8	Low	67.2	Low	86 Å²	86	114.5 Å²	114.5	44%	0.441	60%	0.599	S	S	.	*			trans	-71.1	111.6	168	-54.8	177.1	0	0	0	106.1	H34 V39 K48	H34-I36 PolarHBondContact O-N 2.92Å; I36-V39 HydrophobicContact CG2-CG2 3.98Å; I36-K48 HydrophobicContact CG2-CB 4.07Å; I36-K48 HydrophobicContact CG2-CD 3.69Å; I36-K48 HydrophobicContact CG2-CG 4.48Å
37	G	74.9	Confident	69.2	Low	37 Å²	37	112.1 Å²	112.1	38%	0.381	59%	0.587	S	S	.	*			trans	-59.5	171.9	175.8	0	0	0	0	0	112.3	L35 V39	L35-G37 PolarHBondContact O-N 3.42Å; G37-V39 WeakPolarHBondContact O-CG2 3.29Å; G37-V39 PolarHBondContact O-N 3.41Å
38	P	73.8	Confident	71	Confident	123 Å²	123	105.3 Å²	105.3	80%	0.799	56%	0.558	S	S	*	*			trans	-51.7	139.3	-176.8	21	-31.7	0	0	0	111.8	K48	P38-K48 PolarHBondContact O-NZ 2.79Å
39	V	77.3	Confident	73	Confident	56 Å²	56	98.6 Å²	98.6	34%	0.339	53%	0.533	S	S	.	.			trans	-118.3	126.6	-174.4	178.2	0	0	0	0	108	I36 G37 T41 E44 M45 K48	I36-V39 HydrophobicContact CG2-CG2 3.98Å; G37-V39 WeakPolarHBondContact O-CG2 3.29Å; G37-V39 PolarHBondContact O-N 3.41Å; V39-T41 WeakPolarHBondContact CG1-O 3.28Å; V39-E44 HydrophobicContact CG1-CB 4.32Å; V39-M45 HydrophobicContact CG1-CB 3.68Å; V39-M45 HydrophobicContact CG1-CG 4.26Å; V39-M45 HydrophobicContact CG1-SD 4.45Å; V39-K48 HydrophobicContact CG2-CD 4.27Å
40	S	80.4	Confident	74.5	Confident	104 Å²	104	99.9 Å²	99.9	73%	0.727	54%	0.537	S	S	*	.			trans	-102.7	-22.5	-173.3	-33.6	0	0	0	0	112.5	E44	S40-E44 WeakPolarHBondContact CB-OE2 3.4Å; S40-E44 PolarHBondContact N-OE2 2.94Å; S40-E44 PolarHBondContact OG-OE2 2.92Å; S40-E44 VanDerWaalsContact OG-OE2 3.13Å
41	T	85.2	Confident	76.1	Confident	78 Å²	78	97.1 Å²	97.1	48%	0.479	52%	0.524	S	S	.	.	S	Bend	trans	-142.9	157.3	-176.3	64.9	0	0	0	0	110.9	V39 E43 E44 M45	V39-T41 WeakPolarHBondContact CG1-O 3.28Å; T41-E43 VanDerWaalsContact C-N 3.29Å; T41-E43 PolarHBondContact O-N 3.35Å; T41-E44 PolarHBondContact O-N 2.9Å; T41-E44 VanDerWaalsContact OG1-CB 3.31Å; T41-E44 WeakPolarHBondContact OG1-CB 3.31Å; T41-E44 PolarHBondContact OG1-N 2.88Å; T41-M45 PolarHBondContact O-N 3.36Å; T41-M45 VanDerWaalsContact O-N 3.14Å
42	L	84	Confident	77.3	Confident	121 Å²	121	96.5 Å²	96.5	63%	0.634	52%	0.521	S	S	*	.	H	α-helix	trans	-60.3	-40.3	176.1	-175.8	64.9	0	0	0	111.6	E44 M45 D46	L42-E44 PolarHBondContact O-N 3.27Å; L42-M45 HydrophobicContact CD1-CE 3.95Å; L42-M45 WeakPolarHBondContact O-CA 3.36Å; L42-M45 VanDerWaalsContact O-CB 3.25Å; L42-M45 WeakPolarHBondContact O-CB 3.08Å; L42-M45 PolarHBondContact O-N 2.94Å; L42-M45 VanDerWaalsContact O-N 3.07Å; L42-D46 PolarHBondContact O-N 3.4Å
43	E	84.7	Confident	78.9	Confident	145 Å²	145	93.4 Å²	93.4	68%	0.678	51%	0.507	S	S	*	.	H	α-helix	trans	-62.6	-40.5	178	-167.6	172.5	-159.1	0	0	111.9	T41 M45 D46 I47	T41-E43 VanDerWaalsContact C-N 3.29Å; T41-E43 PolarHBondContact O-N 3.35Å; E43-M45 VanDerWaalsContact C-N 3.29Å; E43-M45 PolarHBondContact O-N 3.09Å; E43-D46 PolarHBondContact O-N 2.83Å; E43-I47 HydrophobicContact CG-CD1 4.38Å; E43-I47 WeakPolarHBondContact O-CG1 3.33Å; E43-I47 PolarHBondContact O-N 3.39Å
44	E	82.8	Confident	80	Confident	58 Å²	58	93.1 Å²	93.1	27%	0.271	50%	0.499	S	S	.	.	H	α-helix	trans	-65.3	-33	173.9	-163.4	-170.1	170.9	0	0	111.9	V39 S40 T41 L42 K48	V39-E44 HydrophobicContact CG1-CB 4.32Å; S40-E44 WeakPolarHBondContact CB-OE2 3.4Å; S40-E44 PolarHBondContact N-OE2 2.94Å; S40-E44 PolarHBondContact OG-OE2 2.92Å; S40-E44 VanDerWaalsContact OG-OE2 3.13Å; T41-E44 PolarHBondContact O-N 2.9Å; T41-E44 VanDerWaalsContact OG1-CB 3.31Å; T41-E44 WeakPolarHBondContact OG1-CB 3.31Å; T41-E44 PolarHBondContact OG1-N 2.88Å; L42-E44 PolarHBondContact O-N 3.27Å; E44-K48 WeakPolarHBondContact O-CG 3.49Å; E44-K48 PolarHBondContact O-N 3.41Å; E44-K48 WeakPolarHBondContact OE1-CE 3.34Å; E44-K48 IonicContact OE1-NZ 3.03Å; E44-K48 PolarHBondContact OE1-NZ 3.18Å
45	M	81.7	Confident	81.2	Confident	88 Å²	88	93.1 Å²	93.1	43%	0.433	50%	0.498	S	S	.	.	H	α-helix	trans	-65.9	-48.7	173.2	-160	148.8	62.1	0	0	111.2	V39 T41 L42 E43 I47 K48 V49	V39-M45 HydrophobicContact CG1-CB 3.68Å; V39-M45 HydrophobicContact CG1-CG 4.26Å; V39-M45 HydrophobicContact CG1-SD 4.45Å; T41-M45 PolarHBondContact O-N 3.36Å; T41-M45 VanDerWaalsContact O-N 3.14Å; L42-M45 HydrophobicContact CD1-CE 3.95Å; L42-M45 WeakPolarHBondContact O-CA 3.36Å; L42-M45 VanDerWaalsContact O-CB 3.25Å; L42-M45 WeakPolarHBondContact O-CB 3.08Å; L42-M45 PolarHBondContact O-N 2.94Å; L42-M45 VanDerWaalsContact O-N 3.07Å; E43-M45 VanDerWaalsContact C-N 3.29Å; E43-M45 PolarHBondContact O-N 3.09Å; M45-I47 VanDerWaalsContact C-N 3.35Å; M45-I47 PolarHBondContact O-N 3.23Å; M45-K48 PolarHBondContact O-N 3.07Å; M45-V49 HydrophobicContact CG-CG2 4.45Å; M45-V49 WeakPolarHBondContact O-CB 3.47Å; M45-V49 VanDerWaalsContact O-CG2 3.29Å; M45-V49 WeakPolarHBondContact O-CG2 3.19Å; M45-V49 PolarHBondContact O-N 2.9Å
46	D	86.6	Confident	82.1	Confident	87 Å²	87	87.5 Å²	87.5	47%	0.465	47%	0.467	S	S	.	.	H	α-helix	trans	-62.6	-41.8	-177.1	-72.4	-24	0	0	0	111.4	L42 E43 V49 L50	L42-D46 PolarHBondContact O-N 3.4Å; E43-D46 PolarHBondContact O-N 2.83Å; D46-V49 PolarHBondContact O-N 3.28Å; D46-L50 WeakPolarHBondContact O-CB 3.43Å; D46-L50 WeakPolarHBondContact O-CG 3.48Å; D46-L50 PolarHBondContact O-N 3.3Å
47	I	85.6	Confident	83.1	Confident	88 Å²	88	87.5 Å²	87.5	45%	0.451	47%	0.467	S	S	.	.	H	α-helix	trans	-61	-50.1	174.4	-67.1	167.6	0	0	0	110.7	E43 M45 V49 L50 E51	E43-I47 HydrophobicContact CG-CD1 4.38Å; E43-I47 WeakPolarHBondContact O-CG1 3.33Å; E43-I47 PolarHBondContact O-N 3.39Å; M45-I47 VanDerWaalsContact C-N 3.35Å; M45-I47 PolarHBondContact O-N 3.23Å; I47-V49 VanDerWaalsContact C-N 3.3Å; I47-V49 PolarHBondContact O-N 2.75Å; I47-L50 PolarHBondContact O-N 2.7Å; I47-E51 HydrophobicContact CG2-CG 4.38Å; I47-E51 WeakPolarHBondContact O-CG 3.36Å; I47-E51 PolarHBondContact O-N 3.11Å
48	K	83.6	Confident	83.8	Confident	46 Å²	46	88.3 Å²	88.3	20%	0.2	47%	0.47	C	S	.	.	H	α-helix	trans	-63.1	-35.6	179.9	-73.4	178.6	-171.7	164.5	0	112.3	I36 P38 V39 E44 M45 F52	I36-K48 HydrophobicContact CG2-CB 4.07Å; I36-K48 HydrophobicContact CG2-CD 3.69Å; I36-K48 HydrophobicContact CG2-CG 4.48Å; P38-K48 PolarHBondContact O-NZ 2.79Å; V39-K48 HydrophobicContact CG2-CD 4.27Å; E44-K48 WeakPolarHBondContact O-CG 3.49Å; E44-K48 PolarHBondContact O-N 3.41Å; E44-K48 WeakPolarHBondContact OE1-CE 3.34Å; E44-K48 IonicContact OE1-NZ 3.03Å; E44-K48 PolarHBondContact OE1-NZ 3.18Å; M45-K48 PolarHBondContact O-N 3.07Å; K48-F52 WeakPolarHBondContact O-CB 3.14Å; K48-F52 PolarHBondContact O-N 3.04Å
49	V	85.8	Confident	84.4	Confident	51 Å²	51	86.2 Å²	86.2	31%	0.309	45%	0.45	S	S	.	.	H	α-helix	trans	-67	-44.6	174.5	170.7	0	0	0	0	110.8	M45 D46 I47 F52 Q53	M45-V49 HydrophobicContact CG-CG2 4.45Å; M45-V49 WeakPolarHBondContact O-CB 3.47Å; M45-V49 VanDerWaalsContact O-CG2 3.29Å; M45-V49 WeakPolarHBondContact O-CG2 3.19Å; M45-V49 PolarHBondContact O-N 2.9Å; D46-V49 PolarHBondContact O-N 3.28Å; I47-V49 VanDerWaalsContact C-N 3.3Å; I47-V49 PolarHBondContact O-N 2.75Å; V49-F52 PolarHBondContact O-N 2.85Å; V49-Q53 HydrophobicContact CG1-CG 4.35Å; V49-Q53 WeakPolarHBondContact O-CB 3.49Å; V49-Q53 VanDerWaalsContact O-CG 3.29Å; V49-Q53 WeakPolarHBondContact O-CG 3.36Å; V49-Q53 PolarHBondContact O-N 2.91Å
50	L	87.6	Confident	84.8	Confident	100 Å²	100	90.4 Å²	90.4	52%	0.524	46%	0.459	S	S	.	.	H	α-helix	trans	-63.3	-42.6	176.3	-78	169.8	0	0	0	112.2	D46 I47 F52 Q53 N54	D46-L50 WeakPolarHBondContact O-CB 3.43Å; D46-L50 WeakPolarHBondContact O-CG 3.48Å; D46-L50 PolarHBondContact O-N 3.3Å; I47-L50 PolarHBondContact O-N 2.7Å; L50-F52 VanDerWaalsContact C-N 3.35Å; L50-F52 PolarHBondContact O-N 3.49Å; L50-Q53 PolarHBondContact O-N 3.36Å; L50-N54 WeakPolarHBondContact O-CB 3.04Å; L50-N54 PolarHBondContact O-N 3.46Å
51	E	81.6	Confident	85.3	Confident	122 Å²	122	89.8 Å²	89.8	57%	0.57	45%	0.447	S	S	*	.	H	α-helix	trans	-59.4	-45	174	-74.6	179.3	167.1	0	0	111.5	I47 N54 K55	I47-E51 HydrophobicContact CG2-CG 4.38Å; I47-E51 WeakPolarHBondContact O-CG 3.36Å; I47-E51 PolarHBondContact O-N 3.11Å; E51-N54 PolarHBondContact O-N 3.25Å; E51-K55 WeakPolarHBondContact O-CB 3.36Å; E51-K55 PolarHBondContact O-N 2.84Å
52	F	83	Confident	85.6	Confident	72 Å²	72	90.9 Å²	90.9	32%	0.316	45%	0.446	S	S	.	.	H	α-helix	trans	-64.7	-43.2	176.1	177.9	-102.7	0	0	0	112.4	H34 K48 V49 L50 K55 K56	H34-F52 HydrophobicContact CB-CD2 3.8Å; H34-F52 HydrophobicContact CB-CE2 3.61Å; H34-F52 AromaticContact CD2-CD2 3.95Å; K48-F52 WeakPolarHBondContact O-CB 3.14Å; K48-F52 PolarHBondContact O-N 3.04Å; V49-F52 PolarHBondContact O-N 2.85Å; L50-F52 VanDerWaalsContact C-N 3.35Å; L50-F52 PolarHBondContact O-N 3.49Å; F52-K55 PolarHBondContact O-N 3.45Å; F52-K56 HydrophobicContact CD1-CG 4.41Å; F52-K56 HydrophobicContact CE1-CG 3.91Å; F52-K56 HydrophobicContact CE2-CG 4.24Å; F52-K56 HydrophobicContact CZ-CD 4.37Å; F52-K56 HydrophobicContact CZ-CG 3.83Å; F52-K56 WeakPolarHBondContact O-CB 3.49Å; F52-K56 PolarHBondContact O-N 3.16Å
53	Q	85.3	Confident	85.8	Confident	113 Å²	113	89.3 Å²	89.3	53%	0.528	44%	0.436	S	S	.	.	H	α-helix	trans	-62.3	-44.4	176.3	-74.6	179.9	9	0	0	111.5	V49 L50 K56 L57	V49-Q53 HydrophobicContact CG1-CG 4.35Å; V49-Q53 WeakPolarHBondContact O-CB 3.49Å; V49-Q53 VanDerWaalsContact O-CG 3.29Å; V49-Q53 WeakPolarHBondContact O-CG 3.36Å; V49-Q53 PolarHBondContact O-N 2.91Å; L50-Q53 PolarHBondContact O-N 3.36Å; Q53-K56 PolarHBondContact O-N 3.46Å; Q53-L57 WeakPolarHBondContact O-CB 3.47Å; Q53-L57 PolarHBondContact O-N 3.36Å
54	N	82.5	Confident	86	Confident	108 Å²	108	91.6 Å²	91.6	58%	0.578	44%	0.438	S	S	*	.	H	α-helix	trans	-61.8	-43	174.6	-90.7	-29.4	0	0	0	111.8	L50 E51 L57 A58	L50-N54 WeakPolarHBondContact O-CB 3.04Å; L50-N54 PolarHBondContact O-N 3.46Å; E51-N54 PolarHBondContact O-N 3.25Å; N54-L57 PolarHBondContact O-N 3.14Å; N54-A58 WeakPolarHBondContact O-CB 3.22Å; N54-A58 PolarHBondContact O-N 3.4Å
55	K	86.7	Confident	86.4	Confident	110 Å²	110	94.4 Å²	94.4	48%	0.478	45%	0.453	S	S	.	.	H	α-helix	trans	-62.6	-43	175.7	-169.8	174.5	-176.8	176	0	112	E51 F52 L57 A58 Q59	E51-K55 WeakPolarHBondContact O-CB 3.36Å; E51-K55 PolarHBondContact O-N 2.84Å; F52-K55 PolarHBondContact O-N 3.45Å; K55-L57 VanDerWaalsContact C-N 3.34Å; K55-A58 PolarHBondContact O-N 3.44Å; K55-Q59 WeakPolarHBondContact O-CG 3.03Å; K55-Q59 PolarHBondContact O-N 3.28Å
56	K	84.9	Confident	86.9	Confident	45 Å²	45	97 Å²	97	20%	0.196	46%	0.458	C	S	.	.	H	α-helix	trans	-62.9	-39.2	173.5	-87.2	-82.1	-176.5	178.1	0	112.1	F31 F52 Q53 R60	F31-K56 VanDerWaalsContact CB-NZ 3.33Å; F52-K56 HydrophobicContact CD1-CG 4.41Å; F52-K56 HydrophobicContact CE1-CG 3.91Å; F52-K56 HydrophobicContact CE2-CG 4.24Å; F52-K56 HydrophobicContact CZ-CD 4.37Å; F52-K56 HydrophobicContact CZ-CG 3.83Å; F52-K56 WeakPolarHBondContact O-CB 3.49Å; F52-K56 PolarHBondContact O-N 3.16Å; Q53-K56 PolarHBondContact O-N 3.46Å; K56-R60 WeakPolarHBondContact O-CG 3.31Å; K56-R60 PolarHBondContact O-N 2.85Å; K56-R60 VanDerWaalsContact O-N 3.13Å
57	L	87.8	Confident	87	Confident	85 Å²	85	95.8 Å²	95.8	45%	0.445	45%	0.454	S	S	.	.	H	α-helix	trans	-66.2	-45.8	177.1	-168.7	71.6	0	0	0	110.8	Q53 N54 K55 Q59 R60 I61	Q53-L57 WeakPolarHBondContact O-CB 3.47Å; Q53-L57 PolarHBondContact O-N 3.36Å; N54-L57 PolarHBondContact O-N 3.14Å; K55-L57 VanDerWaalsContact C-N 3.34Å; L57-Q59 VanDerWaalsContact C-N 3.35Å; L57-Q59 PolarHBondContact O-N 3.35Å; L57-R60 PolarHBondContact O-N 3.44Å; L57-R60 VanDerWaalsContact O-N 3.12Å; L57-I61 HydrophobicContact CG-CD1 4.14Å; L57-I61 WeakPolarHBondContact O-CG1 3.48Å; L57-I61 PolarHBondContact O-N 3.05Å
58	A	88.2	Confident	87.2	Confident	55 Å²	55	96 Å²	96	46%	0.455	45%	0.453	S	S	.	.	H	α-helix	trans	-56.8	-46.1	175.5	0	0	0	0	0	111.8	N54 K55 R60 I61 E62	N54-A58 WeakPolarHBondContact O-CB 3.22Å; N54-A58 PolarHBondContact O-N 3.4Å; K55-A58 PolarHBondContact O-N 3.44Å; A58-R60 VanDerWaalsContact C-N 3.35Å; A58-R60 PolarHBondContact O-N 2.7Å; A58-I61 PolarHBondContact O-N 2.9Å; A58-E62 WeakPolarHBondContact O-CB 3.26Å; A58-E62 PolarHBondContact O-N 2.91Å
59	Q	86.9	Confident	87.6	Confident	79 Å²	79	96.6 Å²	96.6	37%	0.369	47%	0.466	S	S	.	.	H	α-helix	trans	-59.8	-40.7	175	-73.4	177.8	-10.6	0	0	113	K55 L57 Q63	K55-Q59 WeakPolarHBondContact O-CG 3.03Å; K55-Q59 PolarHBondContact O-N 3.28Å; L57-Q59 VanDerWaalsContact C-N 3.35Å; L57-Q59 PolarHBondContact O-N 3.35Å; Q59-Q63 WeakPolarHBondContact O-CB 3.44Å; Q59-Q63 PolarHBondContact O-N 3.2Å
60	R	86.9	Confident	87.8	Confident	144 Å²	144	100.6 Å²	100.6	54%	0.543	48%	0.482	S	S	.	.	H	α-helix	trans	-67.1	-38.9	176	-73.5	-174.2	-167.5	129.1	-3.2	112.1	K56 L57 A58 Q63 R64	K56-R60 WeakPolarHBondContact O-CG 3.31Å; K56-R60 PolarHBondContact O-N 2.85Å; K56-R60 VanDerWaalsContact O-N 3.13Å; L57-R60 PolarHBondContact O-N 3.44Å; L57-R60 VanDerWaalsContact O-N 3.12Å; A58-R60 VanDerWaalsContact C-N 3.35Å; A58-R60 PolarHBondContact O-N 2.7Å; R60-Q63 PolarHBondContact O-N 3.33Å; R60-R64 WeakPolarHBondContact O-CG 3.5Å; R60-R64 PolarHBondContact O-N 2.84Å
61	I	89.9	Confident	88	Confident	90 Å²	90	100.9 Å²	100.9	46%	0.462	48%	0.483	S	S	.	.	H	α-helix	trans	-63.9	-47.3	176.4	-69.8	168.5	0	0	0	109.6	L57 A58 Q63 R64 M65	L57-I61 HydrophobicContact CG-CD1 4.14Å; L57-I61 WeakPolarHBondContact O-CG1 3.48Å; L57-I61 PolarHBondContact O-N 3.05Å; A58-I61 PolarHBondContact O-N 2.9Å; I61-Q63 VanDerWaalsContact C-N 3.31Å; I61-Q63 PolarHBondContact O-N 2.96Å; I61-R64 PolarHBondContact O-N 3.38Å; I61-R64 VanDerWaalsContact O-N 3.1Å; I61-M65 HydrophobicContact CG2-CG 4.39Å; I61-M65 HydrophobicContact CG2-SD 4.12Å; I61-M65 WeakPolarHBondContact O-CG 3.4Å; I61-M65 PolarHBondContact O-N 3.14Å
62	E	90.6	Very high	88.5	Confident	101 Å²	101	102.8 Å²	102.8	47%	0.472	49%	0.485	S	S	.	.	H	α-helix	trans	-61.3	-39.9	178.9	-158.9	-161.8	134.5	0	0	112	A58 M65 R66	A58-E62 WeakPolarHBondContact O-CB 3.26Å; A58-E62 PolarHBondContact O-N 2.91Å; E62-M65 PolarHBondContact O-N 2.82Å; E62-R66 PolarHBondContact O-N 2.86Å; E62-R66 IonicContact OE1-CZ 3.68Å; E62-R66 IonicContact OE1-NE 3.03Å; E62-R66 IonicContact OE1-NH2 2.89Å; E62-R66 PolarHBondContact OE1-NH2 3.42Å
63	Q	88.7	Confident	88.8	Confident	88 Å²	88	104.3 Å²	104.3	41%	0.411	49%	0.493	S	S	.	.	H	α-helix	trans	-63.9	-43	173.4	-173	177.1	8.3	0	0	111.9	Q59 R60 I61 R66 T67	Q59-Q63 WeakPolarHBondContact O-CB 3.44Å; Q59-Q63 PolarHBondContact O-N 3.2Å; R60-Q63 PolarHBondContact O-N 3.33Å; I61-Q63 VanDerWaalsContact C-N 3.31Å; I61-Q63 PolarHBondContact O-N 2.96Å; Q63-R66 PolarHBondContact O-N 3.15Å; Q63-T67 PolarHBondContact O-N 3.46Å; Q63-T67 PolarHBondContact O-OG1 3.38Å
64	R	90.1	Very high	89.1	Confident	193 Å²	193	105.1 Å²	105.1	73%	0.728	49%	0.491	S	S	*	.	H	α-helix	trans	-61.9	-44.1	175.1	-75.3	-170.3	-164.3	-115.2	7.8	111.6	R60 I61 R66 T67 E68	R60-R64 WeakPolarHBondContact O-CG 3.5Å; R60-R64 PolarHBondContact O-N 2.84Å; I61-R64 PolarHBondContact O-N 3.38Å; I61-R64 VanDerWaalsContact O-N 3.1Å; R64-R66 VanDerWaalsContact C-N 3.32Å; R64-R66 PolarHBondContact O-N 3.31Å; R64-T67 PolarHBondContact O-N 3.45Å; R64-T67 VanDerWaalsContact O-N 3.16Å; R64-E68 WeakPolarHBondContact O-CB 3.41Å; R64-E68 PolarHBondContact O-N 3.05Å
65	M	91.4	Very high	89.5	Confident	118 Å²	118	104.3 Å²	104.3	58%	0.581	49%	0.486	S	S	*	.	H	α-helix	trans	-59.8	-41	176.5	-71.1	179	72.8	0	0	112	I61 E62 E68 A69	I61-M65 HydrophobicContact CG2-CG 4.39Å; I61-M65 HydrophobicContact CG2-SD 4.12Å; I61-M65 WeakPolarHBondContact O-CG 3.4Å; I61-M65 PolarHBondContact O-N 3.14Å; E62-M65 PolarHBondContact O-N 2.82Å; M65-E68 PolarHBondContact O-N 3.3Å; M65-A69 WeakPolarHBondContact O-CB 3.37Å; M65-A69 PolarHBondContact O-N 3.27Å
66	R	91	Very high	89.6	Confident	141 Å²	141	102.9 Å²	102.9	53%	0.532	48%	0.481	S	S	.	.	H	α-helix	trans	-62.1	-47	172.9	-82	-173.8	-108.7	149.3	-8.5	112.3	E62 Q63 R64 E68 A69 E70	E62-R66 PolarHBondContact O-N 2.86Å; E62-R66 IonicContact OE1-CZ 3.68Å; E62-R66 IonicContact OE1-NE 3.03Å; E62-R66 IonicContact OE1-NH2 2.89Å; E62-R66 PolarHBondContact OE1-NH2 3.42Å; Q63-R66 PolarHBondContact O-N 3.15Å; R64-R66 VanDerWaalsContact C-N 3.32Å; R64-R66 PolarHBondContact O-N 3.31Å; R66-E68 VanDerWaalsContact C-N 3.3Å; R66-E68 PolarHBondContact O-N 2.96Å; R66-A69 PolarHBondContact O-N 2.64Å; R66-E70 WeakPolarHBondContact O-CG 3.25Å; R66-E70 PolarHBondContact O-N 2.72Å
67	T	89.5	Confident	89.8	Confident	63 Å²	63	104.8 Å²	104.8	39%	0.387	49%	0.49	S	S	.	.	H	α-helix	trans	-62.8	-39.4	179	-33.5	0	0	0	0	111.2	Q63 R64 E70 L71	Q63-T67 PolarHBondContact O-N 3.46Å; Q63-T67 PolarHBondContact O-OG1 3.38Å; R64-T67 PolarHBondContact O-N 3.45Å; R64-T67 VanDerWaalsContact O-N 3.16Å; T67-E70 PolarHBondContact O-N 3.35Å; T67-L71 WeakPolarHBondContact O-CB 3.29Å; T67-L71 VanDerWaalsContact O-CG 3.31Å; T67-L71 WeakPolarHBondContact O-CG 3.43Å; T67-L71 PolarHBondContact O-N 2.97Å
68	E	89.3	Confident	89.9	Confident	92 Å²	92	104.8 Å²	104.8	43%	0.43	49%	0.49	S	S	.	.	H	α-helix	trans	-64.6	-43.9	175.3	-171.2	-171.6	157.4	0	0	111.5	R64 M65 R66 E70 L71 R72	R64-E68 WeakPolarHBondContact O-CB 3.41Å; R64-E68 PolarHBondContact O-N 3.05Å; M65-E68 PolarHBondContact O-N 3.3Å; R66-E68 VanDerWaalsContact C-N 3.3Å; R66-E68 PolarHBondContact O-N 2.96Å; E68-E70 PolarHBondContact O-N 2.8Å; E68-L71 PolarHBondContact O-N 3.24Å; E68-R72 WeakPolarHBondContact O-CB 3.49Å; E68-R72 VanDerWaalsContact O-CG 3.3Å; E68-R72 WeakPolarHBondContact O-CG 3.48Å; E68-R72 PolarHBondContact O-N 2.7Å; E68-R72 IonicContact OE1-CZ 3.24Å; E68-R72 VanDerWaalsContact OE1-CZ 3.26Å; E68-R72 IonicContact OE1-NE 3.93Å; E68-R72 PolarHBondContact OE1-NE 2.91Å; E68-R72 IonicContact OE1-NH2 2.78Å; E68-R72 PolarHBondContact OE1-NH2 3.48Å
69	A	91.7	Very high	89.8	Confident	58 Å²	58	107.2 Å²	107.2	48%	0.479	49%	0.492	S	S	.	.	H	α-helix	trans	-62.4	-41.4	176.1	0	0	0	0	0	112.1	M65 R66 R72 H73	M65-A69 WeakPolarHBondContact O-CB 3.37Å; M65-A69 PolarHBondContact O-N 3.27Å; R66-A69 PolarHBondContact O-N 2.64Å; A69-R72 PolarHBondContact O-N 2.84Å; A69-H73 WeakPolarHBondContact O-CB 3.46Å; A69-H73 PolarHBondContact O-N 3.29Å
70	E	91	Very high	89.8	Confident	135 Å²	135	109.1 Å²	109.1	63%	0.631	50%	0.499	S	S	*	.	H	α-helix	trans	-62.1	-43.8	174.3	-73.5	172.7	-171.3	0	0	111.9	R66 T67 E68 H73 R74	R66-E70 WeakPolarHBondContact O-CG 3.25Å; R66-E70 PolarHBondContact O-N 2.72Å; T67-E70 PolarHBondContact O-N 3.35Å; E68-E70 PolarHBondContact O-N 2.8Å; E70-H73 PolarHBondContact O-N 3.14Å; E70-R74 WeakPolarHBondContact O-CB 3.36Å; E70-R74 PolarHBondContact O-N 2.95Å
71	L	90.6	Very high	89.9	Confident	106 Å²	106	109.6 Å²	109.6	56%	0.555	50%	0.501	S	S	*	.	H	α-helix	trans	-66.6	-42.8	176.7	-72.7	172.1	0	0	0	112.1	T67 E68 H73 R74 I75	T67-L71 WeakPolarHBondContact O-CB 3.29Å; T67-L71 VanDerWaalsContact O-CG 3.31Å; T67-L71 WeakPolarHBondContact O-CG 3.43Å; T67-L71 PolarHBondContact O-N 2.97Å; E68-L71 PolarHBondContact O-N 3.24Å; L71-H73 VanDerWaalsContact C-N 3.34Å; L71-H73 PolarHBondContact O-N 2.96Å; L71-R74 WeakPolarHBondContact O-CB 3.35Å; L71-R74 PolarHBondContact O-N 3.26Å; L71-R74 VanDerWaalsContact O-N 3.13Å; L71-I75 VanDerWaalsContact O-CG1 3.31Å; L71-I75 WeakPolarHBondContact O-CG1 3.47Å; L71-I75 PolarHBondContact O-N 3.13Å
72	R	91.7	Very high	89.8	Confident	162 Å²	162	110.8 Å²	110.8	61%	0.611	51%	0.505	S	S	*	.	H	α-helix	trans	-58.2	-46.2	174.2	-76.4	175.2	-179.3	-114.6	4.7	111.1	E68 A69 R74 I75 E76	E68-R72 WeakPolarHBondContact O-CB 3.49Å; E68-R72 VanDerWaalsContact O-CG 3.3Å; E68-R72 WeakPolarHBondContact O-CG 3.48Å; E68-R72 PolarHBondContact O-N 2.7Å; E68-R72 IonicContact OE1-CZ 3.24Å; E68-R72 VanDerWaalsContact OE1-CZ 3.26Å; E68-R72 IonicContact OE1-NE 3.93Å; E68-R72 PolarHBondContact OE1-NE 2.91Å; E68-R72 IonicContact OE1-NH2 2.78Å; E68-R72 PolarHBondContact OE1-NH2 3.48Å; A69-R72 PolarHBondContact O-N 2.84Å; R72-R74 VanDerWaalsContact C-N 3.3Å; R72-R74 PolarHBondContact O-N 3.03Å; R72-I75 PolarHBondContact O-N 2.84Å; R72-E76 PolarHBondContact O-N 3.3Å
73	H	90.9	Very high	89.3	Confident	104 Å²	104	110.3 Å²	110.3	48%	0.481	51%	0.509	S	S	.	.	H	α-helix	trans	-64.5	-36.5	176.2	-172	55.4	0	0	0	112.2	A69 E70 L71 E76 Q77	A69-H73 WeakPolarHBondContact O-CB 3.46Å; A69-H73 PolarHBondContact O-N 3.29Å; E70-H73 PolarHBondContact O-N 3.14Å; L71-H73 VanDerWaalsContact C-N 3.34Å; L71-H73 PolarHBondContact O-N 2.96Å; H73-E76 IonicContact ND1-OE2 3.89Å; H73-E76 PolarHBondContact O-N 3.37Å; H73-Q77 PolarHBondContact CD2-NE2 3.07Å; H73-Q77 PolarHBondContact NE2-NE2 3.34Å; H73-Q77 WeakPolarHBondContact O-CG 3.19Å; H73-Q77 PolarHBondContact O-N 3.14Å; H73-Q77 VanDerWaalsContact O-N 3.08Å
74	R	91.6	Very high	89.2	Confident	131 Å²	131	112.3 Å²	112.3	49%	0.494	52%	0.519	S	S	.	.	H	α-helix	trans	-67.2	-39.2	176.2	-175.5	56.1	177.4	173.2	1.4	112.5	E70 L71 R72 Q77 L78	E70-R74 WeakPolarHBondContact O-CB 3.36Å; E70-R74 PolarHBondContact O-N 2.95Å; L71-R74 WeakPolarHBondContact O-CB 3.35Å; L71-R74 PolarHBondContact O-N 3.26Å; L71-R74 VanDerWaalsContact O-N 3.13Å; R72-R74 VanDerWaalsContact C-N 3.3Å; R72-R74 PolarHBondContact O-N 3.03Å; R74-Q77 PolarHBondContact O-N 2.85Å; R74-L78 HydrophobicContact CG-CD1 4.26Å; R74-L78 WeakPolarHBondContact O-CG 3.4Å; R74-L78 PolarHBondContact O-N 3.22Å
75	I	89.6	Confident	88.9	Confident	90 Å²	90	107.2 Å²	107.2	46%	0.462	51%	0.506	S	S	.	.	H	α-helix	trans	-61.7	-49.9	174.7	-70.7	164.5	0	0	0	109.7	L71 R72 Q77 L78 E79	L71-I75 VanDerWaalsContact O-CG1 3.31Å; L71-I75 WeakPolarHBondContact O-CG1 3.47Å; L71-I75 PolarHBondContact O-N 3.13Å; R72-I75 PolarHBondContact O-N 2.84Å; I75-Q77 VanDerWaalsContact C-N 3.27Å; I75-Q77 PolarHBondContact O-N 3.49Å; I75-L78 WeakPolarHBondContact O-CA 3.44Å; I75-L78 WeakPolarHBondContact O-CB 3.02Å; I75-L78 PolarHBondContact O-N 3.36Å; I75-E79 HydrophobicContact CG2-CG 4.25Å; I75-E79 VanDerWaalsContact CG2-OE1 3.28Å; I75-E79 WeakPolarHBondContact CG2-OE1 3.2Å; I75-E79 WeakPolarHBondContact O-CG 3.37Å; I75-E79 PolarHBondContact O-N 2.84Å
76	E	90.1	Very high	88.6	Confident	81 Å²	81	105 Å²	105	38%	0.379	50%	0.496	S	S	.	.	H	α-helix	trans	-57.5	-39.6	178.3	-168.8	-162.9	162.7	0	0	112.3	R72 H73 K80	R72-E76 PolarHBondContact O-N 3.3Å; H73-E76 IonicContact ND1-OE2 3.89Å; H73-E76 PolarHBondContact O-N 3.37Å; E76-K80 WeakPolarHBondContact O-CG 3.26Å; E76-K80 PolarHBondContact O-N 3.04Å; E76-K80 VanDerWaalsContact O-N 3.08Å; E76-K80 WeakPolarHBondContact OE1-CE 3.35Å; E76-K80 IonicContact OE1-NZ 3.78Å; E76-K80 PolarHBondContact OE1-NZ 3.17Å
77	Q	89.3	Confident	88.3	Confident	84 Å²	84	100.9 Å²	100.9	39%	0.393	49%	0.492	S	S	.	.	H	α-helix	trans	-65.8	-38.9	174.4	-73.8	179.7	5	0	0	112.8	H73 R74 I75 R81	H73-Q77 PolarHBondContact CD2-NE2 3.07Å; H73-Q77 PolarHBondContact NE2-NE2 3.34Å; H73-Q77 WeakPolarHBondContact O-CG 3.19Å; H73-Q77 PolarHBondContact O-N 3.14Å; H73-Q77 VanDerWaalsContact O-N 3.08Å; R74-Q77 PolarHBondContact O-N 2.85Å; I75-Q77 VanDerWaalsContact C-N 3.27Å; I75-Q77 PolarHBondContact O-N 3.49Å; Q77-R81 PolarHBondContact O-N 3.45Å; Q77-R81 VanDerWaalsContact O-N 3.14Å
78	L	88.8	Confident	88.3	Confident	85 Å²	85	102.2 Å²	102.2	45%	0.445	50%	0.5	S	S	.	.	H	α-helix	trans	-70.6	-39.5	179	-72.9	170.7	0	0	0	111.2	R74 I75 R81 Q82	R74-L78 HydrophobicContact CG-CD1 4.26Å; R74-L78 WeakPolarHBondContact O-CG 3.4Å; R74-L78 PolarHBondContact O-N 3.22Å; I75-L78 WeakPolarHBondContact O-CA 3.44Å; I75-L78 WeakPolarHBondContact O-CB 3.02Å; I75-L78 PolarHBondContact O-N 3.36Å; L78-R81 PolarHBondContact O-N 3.33Å; L78-R81 VanDerWaalsContact O-N 3.16Å; L78-Q82 WeakPolarHBondContact O-CB 2.76Å; L78-Q82 PolarHBondContact O-N 3.47Å
79	E	86.5	Confident	88.1	Confident	106 Å²	106	101 Å²	101	50%	0.495	50%	0.496	S	S	.	.	H	α-helix	trans	-63	-43.6	174.5	-70.6	168.6	169.9	0	0	111.7	I75 R81 Q82 T83	I75-E79 HydrophobicContact CG2-CG 4.25Å; I75-E79 VanDerWaalsContact CG2-OE1 3.28Å; I75-E79 WeakPolarHBondContact CG2-OE1 3.2Å; I75-E79 WeakPolarHBondContact O-CG 3.37Å; I75-E79 PolarHBondContact O-N 2.84Å; E79-R81 PolarHBondContact O-N 2.82Å; E79-Q82 PolarHBondContact O-N 3.26Å; E79-T83 WeakPolarHBondContact O-CG2 3.23Å; E79-T83 PolarHBondContact O-N 3.28Å; E79-T83 PolarHBondContact O-OG1 3.1Å
80	K	86.4	Confident	87.9	Confident	119 Å²	119	100.9 Å²	100.9	52%	0.517	49%	0.488	S	S	.	.	H	α-helix	trans	-62.1	-31.9	173.3	-77.7	177.4	-172	164.5	0	112.9	E76 T83 Q84	E76-K80 WeakPolarHBondContact O-CG 3.26Å; E76-K80 PolarHBondContact O-N 3.04Å; E76-K80 VanDerWaalsContact O-N 3.08Å; E76-K80 WeakPolarHBondContact OE1-CE 3.35Å; E76-K80 IonicContact OE1-NZ 3.78Å; E76-K80 PolarHBondContact OE1-NZ 3.17Å; K80-T83 WeakPolarHBondContact CA-OG1 3.32Å; K80-T83 PolarHBondContact O-OG1 3.4Å; K80-Q84 VanDerWaalsContact O-CG 3.32Å; K80-Q84 WeakPolarHBondContact O-CG 3.4Å; K80-Q84 PolarHBondContact O-N 2.87Å
81	R	89.8	Confident	87.7	Confident	154 Å²	154	97.7 Å²	97.7	58%	0.581	48%	0.477	S	S	*	.	H	α-helix	trans	-77.3	-41.7	176.3	-172.3	174.7	178.1	-175.4	1.2	111.4	Q77 L78 E79 T83 Q84 D85	Q77-R81 PolarHBondContact O-N 3.45Å; Q77-R81 VanDerWaalsContact O-N 3.14Å; L78-R81 PolarHBondContact O-N 3.33Å; L78-R81 VanDerWaalsContact O-N 3.16Å; E79-R81 PolarHBondContact O-N 2.82Å; R81-T83 PolarHBondContact O-N 2.86Å; R81-Q84 WeakPolarHBondContact O-CB 3.46Å; R81-Q84 PolarHBondContact O-N 3.18Å; R81-Q84 VanDerWaalsContact O-N 3.16Å; R81-D85 IonicContact NE-OD2 2.58Å; R81-D85 PolarHBondContact O-N 3.27Å
82	Q	86.6	Confident	87.5	Confident	116 Å²	116	96.5 Å²	96.5	54%	0.542	47%	0.474	S	S	.	.	H	α-helix	trans	-58.3	-47.5	176.4	-177.5	177.6	6.5	0	0	111.1	L78 E79 Q84 D85 D86	L78-Q82 WeakPolarHBondContact O-CB 2.76Å; L78-Q82 PolarHBondContact O-N 3.47Å; E79-Q82 PolarHBondContact O-N 3.26Å; Q82-Q84 VanDerWaalsContact C-N 3.28Å; Q82-Q84 PolarHBondContact O-N 3.02Å; Q82-D85 PolarHBondContact O-N 2.71Å; Q82-D85 VanDerWaalsContact O-N 3.13Å; Q82-D86 WeakPolarHBondContact O-CB 3.45Å; Q82-D86 VanDerWaalsContact O-CG 3.25Å; Q82-D86 PolarHBondContact O-N 2.74Å
83	T	82.1	Confident	87.3	Confident	91 Å²	91	89.5 Å²	89.5	56%	0.558	45%	0.448	S	S	*	.	H	α-helix	trans	-60	-35.7	175.9	46.9	0	0	0	0	113.4	E79 K80 R81 A87	E79-T83 WeakPolarHBondContact O-CG2 3.23Å; E79-T83 PolarHBondContact O-N 3.28Å; E79-T83 PolarHBondContact O-OG1 3.1Å; K80-T83 WeakPolarHBondContact CA-OG1 3.32Å; K80-T83 PolarHBondContact O-OG1 3.4Å; R81-T83 PolarHBondContact O-N 2.86Å; T83-A87 WeakPolarHBondContact O-CB 3.27Å; T83-A87 PolarHBondContact O-N 3.33Å; T83-A87 VanDerWaalsContact O-N 3.15Å
84	Q	84.7	Confident	87.1	Confident	130 Å²	130	85.6 Å²	85.6	61%	0.607	43%	0.43	S	S	*	.	H	α-helix	trans	-69.3	-44.3	173.2	-72.1	173.9	9.3	0	0	112.1	K80 R81 Q82 A87 V88	K80-Q84 VanDerWaalsContact O-CG 3.32Å; K80-Q84 WeakPolarHBondContact O-CG 3.4Å; K80-Q84 PolarHBondContact O-N 2.87Å; R81-Q84 WeakPolarHBondContact O-CB 3.46Å; R81-Q84 PolarHBondContact O-N 3.18Å; R81-Q84 VanDerWaalsContact O-N 3.16Å; Q82-Q84 VanDerWaalsContact C-N 3.28Å; Q82-Q84 PolarHBondContact O-N 3.02Å; Q84-A87 PolarHBondContact O-N 3.44Å; Q84-V88 WeakPolarHBondContact O-CG2 3.47Å; Q84-V88 PolarHBondContact O-N 3.35Å; Q84-V88 VanDerWaalsContact O-N 3.08Å
85	D	85.7	Confident	86.9	Confident	85 Å²	85	85.1 Å²	85.1	46%	0.455	43%	0.429	S	S	.	.	H	α-helix	trans	-65.5	-40.5	179.6	-70.4	-20.6	0	0	0	110.7	R81 Q82 V88 L89	R81-D85 IonicContact NE-OD2 2.58Å; R81-D85 PolarHBondContact O-N 3.27Å; Q82-D85 PolarHBondContact O-N 2.71Å; Q82-D85 VanDerWaalsContact O-N 3.13Å; D85-V88 PolarHBondContact O-N 3.17Å; D85-L89 WeakPolarHBondContact O-CB 3.38Å; D85-L89 PolarHBondContact O-N 3.28Å
86	D	84.8	Confident	86.9	Confident	73 Å²	73	84.9 Å²	84.9	39%	0.39	42%	0.422	S	S	.	.	H	α-helix	trans	-62.7	-41.7	174.5	-71	-23.5	0	0	0	111.8	Q82 V88 L89 N90	Q82-D86 WeakPolarHBondContact O-CB 3.45Å; Q82-D86 VanDerWaalsContact O-CG 3.25Å; Q82-D86 PolarHBondContact O-N 2.74Å; D86-V88 VanDerWaalsContact C-N 3.34Å; D86-V88 PolarHBondContact O-N 3.09Å; D86-L89 PolarHBondContact O-N 3.42Å; D86-N90 WeakPolarHBondContact O-CB 3.38Å; D86-N90 VanDerWaalsContact O-CG 3.24Å; D86-N90 PolarHBondContact O-N 2.8Å; D86-N90 PolarHBondContact O-ND2 3.14Å
87	A	85	Confident	86.7	Confident	53 Å²	53	81.9 Å²	81.9	44%	0.438	41%	0.408	S	S	.	.	H	α-helix	trans	-62.1	-42	175.2	0	0	0	0	0	111.9	T83 Q84 V91	T83-A87 WeakPolarHBondContact O-CB 3.27Å; T83-A87 PolarHBondContact O-N 3.33Å; T83-A87 VanDerWaalsContact O-N 3.15Å; Q84-A87 PolarHBondContact O-N 3.44Å; A87-V91 WeakPolarHBondContact O-CG2 3.32Å; A87-V91 PolarHBondContact O-N 3.06Å
88	V	87.9	Confident	86.5	Confident	92 Å²	92	78 Å²	78	56%	0.558	39%	0.39	S	S	*	.	H	α-helix	trans	-65.6	-42.9	175.3	173	0	0	0	0	110.8	Q84 D85 D86 N90 V91 V92	Q84-V88 WeakPolarHBondContact O-CG2 3.47Å; Q84-V88 PolarHBondContact O-N 3.35Å; Q84-V88 VanDerWaalsContact O-N 3.08Å; D85-V88 PolarHBondContact O-N 3.17Å; D86-V88 VanDerWaalsContact C-N 3.34Å; D86-V88 PolarHBondContact O-N 3.09Å; V88-N90 VanDerWaalsContact C-N 3.34Å; V88-N90 PolarHBondContact O-N 2.76Å; V88-V91 PolarHBondContact O-N 2.69Å; V88-V92 HydrophobicContact CG1-CG2 4.41Å; V88-V92 WeakPolarHBondContact O-CG2 3.39Å; V88-V92 PolarHBondContact O-N 2.81Å
89	L	86.3	Confident	86.3	Confident	66 Å²	66	77.9 Å²	77.9	35%	0.346	39%	0.39	S	S	.	.	H	α-helix	trans	-61.2	-42.2	178.6	-169.7	82.7	0	0	0	111.7	D85 D86 V91 V92 N93 L131 L134	D85-L89 WeakPolarHBondContact O-CB 3.38Å; D85-L89 PolarHBondContact O-N 3.28Å; D86-L89 PolarHBondContact O-N 3.42Å; L89-V91 PolarHBondContact O-N 3.47Å; L89-V92 PolarHBondContact O-N 2.92Å; L89-N93 VanDerWaalsContact O-CB 3.26Å; L89-N93 WeakPolarHBondContact O-CB 3.44Å; L89-N93 PolarHBondContact O-N 2.89Å; L89-L131 HydrophobicContact CD2-CD2 3.47Å; L89-L131 VanDerWaalsContact CD2-CD2 3.47Å; L89-L131 HydrophobicContact CG-CD2 3.77Å; L89-L134 HydrophobicContact CD1-CD2 4.32Å; L89-L134 HydrophobicContact CD2-CD2 3.43Å; L89-L134 VanDerWaalsContact CD2-CD2 3.43Å; L89-L134 HydrophobicContact CG-CD2 4.42Å
90	N	86.1	Confident	86.2	Confident	56 Å²	56	73.7 Å²	73.7	30%	0.299	37%	0.371	S	S	.	.	H	α-helix	trans	-59	-46.4	174.3	-73.4	-19.8	0	0	0	111.5	D86 V88 N93 R94 L131	D86-N90 WeakPolarHBondContact O-CB 3.38Å; D86-N90 VanDerWaalsContact O-CG 3.24Å; D86-N90 PolarHBondContact O-N 2.8Å; D86-N90 PolarHBondContact O-ND2 3.14Å; V88-N90 VanDerWaalsContact C-N 3.34Å; V88-N90 PolarHBondContact O-N 2.76Å; N90-N93 PolarHBondContact O-N 3.14Å; N90-R94 WeakPolarHBondContact O-CB 3.45Å; N90-R94 PolarHBondContact O-N 2.79Å; N90-L131 WeakPolarHBondContact OD1-CD1 3.47Å
91	V	87.9	Confident	86	Confident	68 Å²	68	70.4 Å²	70.4	41%	0.412	36%	0.357	S	S	.	.	H	α-helix	trans	-60.1	-49.9	176.7	172.5	0	0	0	0	110.9	A87 V88 L89 N93 R94 Y95	A87-V91 WeakPolarHBondContact O-CG2 3.32Å; A87-V91 PolarHBondContact O-N 3.06Å; V88-V91 PolarHBondContact O-N 2.69Å; L89-V91 PolarHBondContact O-N 3.47Å; V91-N93 VanDerWaalsContact C-N 3.34Å; V91-N93 PolarHBondContact O-N 2.8Å; V91-R94 PolarHBondContact O-N 3.44Å; V91-Y95 HydrophobicContact CG1-CD2 3.77Å; V91-Y95 HydrophobicContact CG1-CE2 3.81Å; V91-Y95 VanDerWaalsContact O-CD2 3.28Å; V91-Y95 WeakPolarHBondContact O-CD2 3.35Å; V91-Y95 PolarHBondContact O-N 2.78Å
92	V	87.1	Confident	85.7	Confident	80 Å²	80	65.5 Å²	65.5	49%	0.485	34%	0.342	S	S	.	.	H	α-helix	trans	-59.2	-46.9	178.6	173.1	0	0	0	0	110.7	V88 L89 R94 Y95 W96	V88-V92 HydrophobicContact CG1-CG2 4.41Å; V88-V92 WeakPolarHBondContact O-CG2 3.39Å; V88-V92 PolarHBondContact O-N 2.81Å; L89-V92 PolarHBondContact O-N 2.92Å; V92-R94 VanDerWaalsContact C-N 3.33Å; V92-R94 PolarHBondContact O-N 3.2Å; V92-Y95 PolarHBondContact O-N 2.83Å; V92-W96 VanDerWaalsContact O-CB 3.32Å; V92-W96 WeakPolarHBondContact O-CB 3.37Å; V92-W96 PolarHBondContact O-N 2.72Å
93	N	86.6	Confident	85.6	Confident	15 Å²	15	60.4 Å²	60.4	8%	0.08	32%	0.319	C	S	.	.	H	α-helix	trans	-60.3	-42.7	179	-176	63.6	0	0	0	112.1	L89 N90 V91 W96 N97 L131 R149	L89-N93 VanDerWaalsContact O-CB 3.26Å; L89-N93 WeakPolarHBondContact O-CB 3.44Å; L89-N93 PolarHBondContact O-N 2.89Å; N90-N93 PolarHBondContact O-N 3.14Å; V91-N93 VanDerWaalsContact C-N 3.34Å; V91-N93 PolarHBondContact O-N 2.8Å; N93-W96 PolarHBondContact O-N 3.21Å; N93-N97 PolarHBondContact ND2-ND2 3.47Å; N93-N97 WeakPolarHBondContact O-CB 3.33Å; N93-N97 VanDerWaalsContact O-CG 3.26Å; N93-N97 PolarHBondContact O-N 2.84Å; N93-L131 HydrophobicContact CB-CD1 3.81Å; N93-L131 HydrophobicContact CB-CD2 3.98Å; N93-L131 HydrophobicContact CB-CG 3.95Å; N93-L131 WeakPolarHBondContact ND2-CD1 3.33Å; N93-L131 WeakPolarHBondContact ND2-CG 3.49Å; N93-R149 PolarHBondContact OD1-NH1 3.31Å; N93-R149 PolarHBondContact OD1-NH2 3.38Å
94	R	86.9	Confident	85.5	Confident	23 Å²	23	57.1 Å²	57.1	9%	0.087	30%	0.296	C	S	.	.	H	α-helix	trans	-61.9	-49.1	178.2	-170.2	-174.2	74.5	-173.1	17.3	111.9	N90 V91 V92 N97 Q98 L253 K256 E257	N90-R94 WeakPolarHBondContact O-CB 3.45Å; N90-R94 PolarHBondContact O-N 2.79Å; V91-R94 PolarHBondContact O-N 3.44Å; V92-R94 VanDerWaalsContact C-N 3.33Å; V92-R94 PolarHBondContact O-N 3.2Å; R94-N97 PolarHBondContact O-N 2.87Å; R94-Q98 WeakPolarHBondContact O-CB 3.46Å; R94-Q98 PolarHBondContact O-N 2.74Å; R94-L253 HydrophobicContact CG-CD1 4.25Å; R94-K256 HydrophobicContact CG-CB 3.8Å; R94-K256 HydrophobicContact CG-CD 4.21Å; R94-E257 IonicContact CZ-OE1 3.65Å; R94-E257 VanDerWaalsContact NH1-CB 3.31Å; R94-E257 VanDerWaalsContact NH1-CD 3.27Å; R94-E257 IonicContact NH1-OE1 3.18Å; R94-E257 PolarHBondContact NH1-OE1 3.48Å; R94-E257 IonicContact NH2-OE1 3.66Å; R94-E257 PolarHBondContact NH2-OE1 2.83Å
95	Y	88.1	Confident	85.3	Confident	121 Å²	121	52.4 Å²	52.4	48%	0.475	28%	0.276	S	S	.	.	H	α-helix	trans	-66.7	-36.5	177.6	-82.1	-75.9	0	0	0	112.3	V91 V92 Q98 L99 L253	V91-Y95 HydrophobicContact CG1-CD2 3.77Å; V91-Y95 HydrophobicContact CG1-CE2 3.81Å; V91-Y95 VanDerWaalsContact O-CD2 3.28Å; V91-Y95 WeakPolarHBondContact O-CD2 3.35Å; V91-Y95 PolarHBondContact O-N 2.78Å; V92-Y95 PolarHBondContact O-N 2.83Å; Y95-Q98 PolarHBondContact O-N 3.22Å; Y95-L99 PolarHBondContact O-N 3.39Å; Y95-L253 HydrophobicContact CD1-CD1 4.34Å; Y95-L253 HydrophobicContact CE1-CD1 4.2Å; Y95-L253 HydrophobicContact CE1-CD2 4.02Å
96	W	88.7	Confident	85.1	Confident	85 Å²	85	51.9 Å²	51.9	32%	0.322	27%	0.273	S	S	.	.	H	α-helix	trans	-65	-43.5	175.1	-159	-67.1	0	0	0	111.8	V92 N93 Q98 L99 N100 V150 S153	V92-W96 VanDerWaalsContact O-CB 3.32Å; V92-W96 WeakPolarHBondContact O-CB 3.37Å; V92-W96 PolarHBondContact O-N 2.72Å; N93-W96 PolarHBondContact O-N 3.21Å; W96-Q98 VanDerWaalsContact C-N 3.28Å; W96-Q98 PolarHBondContact O-N 2.88Å; W96-L99 WeakPolarHBondContact O-CB 3.06Å; W96-L99 PolarHBondContact O-N 3.42Å; W96-N100 PolarHBondContact O-N 3.16Å; W96-V150 HydrophobicContact CH2-CG2 3.94Å; W96-V150 HydrophobicContact CZ2-CB 4.49Å; W96-V150 HydrophobicContact CZ2-CG2 3.82Å; W96-S153 PolarHBondContact NE1-OG 3.37Å
97	N	85	Confident	84.9	Confident	17 Å²	17	49.4 Å²	49.4	9%	0.091	26%	0.26	C	S	.	.	H	α-helix	trans	-66.6	-32.3	175.1	-73.8	-9.1	0	0	0	111.9	N93 R94 E101 T127 R149	N93-N97 PolarHBondContact ND2-ND2 3.47Å; N93-N97 WeakPolarHBondContact O-CB 3.33Å; N93-N97 VanDerWaalsContact O-CG 3.26Å; N93-N97 PolarHBondContact O-N 2.84Å; R94-N97 PolarHBondContact O-N 2.87Å; N97-E101 WeakPolarHBondContact O-CB 3.42Å; N97-E101 PolarHBondContact O-N 3.48Å; N97-E101 VanDerWaalsContact O-N 3.09Å; N97-T127 PolarHBondContact ND2-O 3.19Å; N97-T127 WeakPolarHBondContact OD1-CB 3.17Å; N97-T127 PolarHBondContact OD1-O 2.97Å; N97-R149 PolarHBondContact OD1-NH2 3.45Å
98	Q	84.9	Confident	84.6	Confident	2 Å²	2	52.6 Å²	52.6	1%	0.009	27%	0.266	C	S	.	.	H	α-helix	trans	-68.9	-43.7	173.7	-169.2	59.4	47.6	0	0	111.7	R94 Y95 W96 N100 E101 D102 H249 S252 L253	R94-Q98 WeakPolarHBondContact O-CB 3.46Å; R94-Q98 PolarHBondContact O-N 2.74Å; Y95-Q98 PolarHBondContact O-N 3.22Å; W96-Q98 VanDerWaalsContact C-N 3.28Å; W96-Q98 PolarHBondContact O-N 2.88Å; Q98-N100 VanDerWaalsContact C-N 3.3Å; Q98-N100 PolarHBondContact O-N 3.28Å; Q98-E101 PolarHBondContact O-N 2.98Å; Q98-D102 PolarHBondContact NE2-OD1 3.46Å; Q98-D102 PolarHBondContact O-N 3.09Å; Q98-H249 WeakPolarHBondContact CG-CE1 3.46Å; Q98-H249 PolarHBondContact NE2-ND1 3.3Å; Q98-S252 PolarHBondContact OE1-OG 3.47Å; Q98-S252 VanDerWaalsContact OE1-OG 3.05Å; Q98-L253 HydrophobicContact CB-CD1 4.09Å; Q98-L253 HydrophobicContact CG-CD1 4.08Å
99	L	86.5	Confident	84.1	Confident	83 Å²	83	52.4 Å²	52.4	44%	0.435	26%	0.255	S	S	.	.	H	α-helix	trans	-55.7	-46.4	173.8	174.9	67	0	0	0	111.4	Y95 W96 E101 D102 I103	Y95-L99 PolarHBondContact O-N 3.39Å; W96-L99 WeakPolarHBondContact O-CB 3.06Å; W96-L99 PolarHBondContact O-N 3.42Å; L99-E101 PolarHBondContact O-N 3.45Å; L99-D102 PolarHBondContact O-N 3.47Å; L99-I103 HydrophobicContact CD1-CD1 3.97Å; L99-I103 HydrophobicContact CD1-CG1 4.35Å; L99-I103 HydrophobicContact CG-CD1 3.86Å; L99-I103 WeakPolarHBondContact O-CB 3.37Å; L99-I103 WeakPolarHBondContact O-CD1 3.44Å; L99-I103 VanDerWaalsContact O-CG1 3.22Å; L99-I103 WeakPolarHBondContact O-CG1 3.33Å; L99-I103 PolarHBondContact O-N 2.88Å
100	N	84.1	Confident	83.6	Confident	18 Å²	18	53.9 Å²	53.9	10%	0.096	26%	0.259	C	S	.	.	H	α-helix	trans	-63.7	-41	178.9	-74.1	-8.9	0	0	0	112.3	W96 Q98 I103 R104 T127 S153	W96-N100 PolarHBondContact O-N 3.16Å; Q98-N100 VanDerWaalsContact C-N 3.3Å; Q98-N100 PolarHBondContact O-N 3.28Å; N100-I103 PolarHBondContact O-N 3.43Å; N100-R104 PolarHBondContact O-N 2.9Å; N100-T127 WeakPolarHBondContact ND2-CG2 3.37Å; N100-S153 PolarHBondContact ND2-OG 3.06Å; N100-S153 WeakPolarHBondContact OD1-CB 2.89Å; N100-S153 PolarHBondContact OD1-OG 3.46Å; N100-S153 VanDerWaalsContact OD1-OG 3.13Å
101	E	82.1	Confident	83.1	Confident	51 Å²	51	52.4 Å²	52.4	24%	0.238	25%	0.251	C	S	.	.	H	α-helix	trans	-64.8	-44.4	175.7	-172.6	60	-155.5	0	0	111.6	N97 Q98 L99 I103 R104 V105	N97-E101 WeakPolarHBondContact O-CB 3.42Å; N97-E101 PolarHBondContact O-N 3.48Å; N97-E101 VanDerWaalsContact O-N 3.09Å; Q98-E101 PolarHBondContact O-N 2.98Å; L99-E101 PolarHBondContact O-N 3.45Å; E101-I103 VanDerWaalsContact C-N 3.32Å; E101-I103 PolarHBondContact O-N 2.86Å; E101-R104 PolarHBondContact O-N 2.8Å; E101-R104 VanDerWaalsContact O-N 3.15Å; E101-R104 IonicContact OE2-NH1 3.69Å; E101-V105 WeakPolarHBondContact O-CG2 3.16Å; E101-V105 PolarHBondContact O-N 3.26Å
102	D	83.8	Confident	81.8	Confident	50 Å²	50	52.7 Å²	52.7	27%	0.267	26%	0.26	S	S	.	.	H	α-helix	trans	-61.8	-41.7	178.1	-63.3	-25.2	0	0	0	111.1	Q98 L99 R104 V105 L106 H249	Q98-D102 PolarHBondContact NE2-OD1 3.46Å; Q98-D102 PolarHBondContact O-N 3.09Å; L99-D102 PolarHBondContact O-N 3.47Å; D102-R104 VanDerWaalsContact C-N 3.34Å; D102-V105 PolarHBondContact O-N 2.78Å; D102-L106 WeakPolarHBondContact O-CB 3.42Å; D102-L106 VanDerWaalsContact O-CG 3.25Å; D102-L106 WeakPolarHBondContact O-CG 3.41Å; D102-L106 PolarHBondContact O-N 3.22Å; D102-H249 VanDerWaalsContact CG-ND1 3.34Å; D102-H249 IonicContact OD1-CE1 2.69Å; D102-H249 IonicContact OD1-CG 2.64Å; D102-H249 IonicContact OD1-ND1 2.77Å; D102-H249 PolarHBondContact OD1-ND1 3.45Å; D102-H249 IonicContact OD2-CE1 3.29Å; D102-H249 PolarHBondContact OD2-CE1 2.76Å; D102-H249 IonicContact OD2-ND1 3.66Å; D102-H249 PolarHBondContact OD2-ND1 3.14Å
103	I	83.9	Confident	80.6	Confident	9 Å²	9	58.2 Å²	58.2	5%	0.046	28%	0.281	C	S	.	.	H	α-helix	trans	-60.2	-45	174.5	-73.1	166.6	0	0	0	110.6	L99 N100 E101 L106 L107 A156 V157 I160	L99-I103 HydrophobicContact CD1-CD1 3.97Å; L99-I103 HydrophobicContact CD1-CG1 4.35Å; L99-I103 HydrophobicContact CG-CD1 3.86Å; L99-I103 WeakPolarHBondContact O-CB 3.37Å; L99-I103 WeakPolarHBondContact O-CD1 3.44Å; L99-I103 VanDerWaalsContact O-CG1 3.22Å; L99-I103 WeakPolarHBondContact O-CG1 3.33Å; L99-I103 PolarHBondContact O-N 2.88Å; N100-I103 PolarHBondContact O-N 3.43Å; E101-I103 VanDerWaalsContact C-N 3.32Å; E101-I103 PolarHBondContact O-N 2.86Å; I103-L106 PolarHBondContact O-N 3.14Å; I103-L107 HydrophobicContact CG2-CD1 4.16Å; I103-L107 WeakPolarHBondContact O-CG 3.44Å; I103-L107 PolarHBondContact O-N 3.41Å; I103-A156 HydrophobicContact CG2-CB 3.51Å; I103-V157 HydrophobicContact CD1-CG2 3.53Å; I103-V157 HydrophobicContact CG1-CG2 4.49Å; I103-I160 HydrophobicContact CB-CD1 3.9Å; I103-I160 HydrophobicContact CG1-CD1 3.93Å; I103-I160 HydrophobicContact CG2-CD1 3.6Å; I103-I160 HydrophobicContact CG2-CG1 4.22Å
104	R	80.6	Confident	79.4	Confident	23 Å²	23	61.5 Å²	61.5	9%	0.087	30%	0.301	C	S	.	.	H	α-helix	trans	-63.9	-46.8	178.5	-170.7	-170.4	-73.2	148.3	7.2	111.6	N100 E101 D102 L106 L107 Q108 N120 E123 N124	N100-R104 PolarHBondContact O-N 2.9Å; E101-R104 PolarHBondContact O-N 2.8Å; E101-R104 VanDerWaalsContact O-N 3.15Å; E101-R104 IonicContact OE2-NH1 3.69Å; D102-R104 VanDerWaalsContact C-N 3.34Å; R104-L106 PolarHBondContact O-N 3.41Å; R104-L107 PolarHBondContact O-N 2.99Å; R104-L107 VanDerWaalsContact O-N 3.13Å; R104-Q108 PolarHBondContact O-N 3.48Å; R104-N120 PolarHBondContact NH2-O 2.89Å; R104-E123 VanDerWaalsContact NH2-CB 3.31Å; R104-E123 IonicContact NH2-OE2 2.7Å; R104-N124 VanDerWaalsContact CZ-OD1 3.26Å; R104-N124 PolarHBondContact NH1-ND2 2.9Å; R104-N124 PolarHBondContact NH1-OD1 3.41Å; R104-N124 PolarHBondContact NH2-OD1 2.86Å
105	V	80.5	Confident	78	Confident	31 Å²	31	62.4 Å²	62.4	19%	0.188	31%	0.314	C	S	.	.	H	α-helix	trans	-59.5	-39.2	178.1	172.2	0	0	0	0	110.8	E101 D102 Q108 R109 H245	E101-V105 WeakPolarHBondContact O-CG2 3.16Å; E101-V105 PolarHBondContact O-N 3.26Å; D102-V105 PolarHBondContact O-N 2.78Å; V105-Q108 PolarHBondContact O-N 3.32Å; V105-R109 WeakPolarHBondContact O-CB 3.31Å; V105-R109 PolarHBondContact O-N 2.86Å; V105-H245 WeakPolarHBondContact CG1-CE1 3.5Å
106	L	81.5	Confident	76.5	Confident	74 Å²	74	61.3 Å²	61.3	39%	0.387	32%	0.316	S	S	.	.	H	α-helix	trans	-63.5	-45.5	173.9	-74.4	168.7	0	0	0	112.2	D102 I103 R104 R109 F110 I160	D102-L106 WeakPolarHBondContact O-CB 3.42Å; D102-L106 VanDerWaalsContact O-CG 3.25Å; D102-L106 WeakPolarHBondContact O-CG 3.41Å; D102-L106 PolarHBondContact O-N 3.22Å; I103-L106 PolarHBondContact O-N 3.14Å; R104-L106 PolarHBondContact O-N 3.41Å; L106-R109 PolarHBondContact O-N 3.02Å; L106-F110 HydrophobicContact CD2-CD2 4.2Å; L106-F110 HydrophobicContact CD2-CE2 3.76Å; L106-F110 VanDerWaalsContact O-CD2 3.28Å; L106-F110 WeakPolarHBondContact O-CD2 3.49Å; L106-F110 PolarHBondContact O-N 2.94Å; L106-I160 HydrophobicContact CB-CD1 3.83Å; L106-I160 HydrophobicContact CD1-CD1 3.99Å
107	L	80.7	Confident	75.1	Confident	20 Å²	20	65.1 Å²	65.1	11%	0.105	34%	0.337	C	S	.	.	H	α-helix	trans	-62.5	-42.6	176	-73.6	172.2	0	0	0	111.7	I103 R104 R109 F110 D111 K159 I160 V163	I103-L107 HydrophobicContact CG2-CD1 4.16Å; I103-L107 WeakPolarHBondContact O-CG 3.44Å; I103-L107 PolarHBondContact O-N 3.41Å; R104-L107 PolarHBondContact O-N 2.99Å; R104-L107 VanDerWaalsContact O-N 3.13Å; L107-R109 PolarHBondContact O-N 3.38Å; L107-F110 PolarHBondContact O-N 2.88Å; L107-D111 HydrophobicContact CD2-CB 4.48Å; L107-D111 CarbonylContact O-C 3.49Å; L107-D111 VanDerWaalsContact O-CA 3.29Å; L107-D111 WeakPolarHBondContact O-CA 3.46Å; L107-D111 VanDerWaalsContact O-CB 3.27Å; L107-D111 WeakPolarHBondContact O-CB 3.45Å; L107-D111 PolarHBondContact O-N 3.29Å; L107-K159 HydrophobicContact CD1-CB 4.25Å; L107-K159 HydrophobicContact CD1-CD 4.48Å; L107-K159 HydrophobicContact CD2-CB 3.79Å; L107-I160 HydrophobicContact CD1-CG1 4.37Å; L107-I160 HydrophobicContact CD2-CB 4.48Å; L107-I160 HydrophobicContact CD2-CG1 3.6Å; L107-I160 HydrophobicContact CG-CD1 4.38Å; L107-I160 HydrophobicContact CG-CG1 3.68Å; L107-V163 HydrophobicContact CD2-CG2 4.22Å
108	Q	78	Confident	73.6	Confident	121 Å²	121	70.5 Å²	70.5	57%	0.565	37%	0.365	S	S	*	.	H	α-helix	trans	-63.4	-31.3	177.1	-165.8	173.2	12.7	0	0	112.2	R104 V105	R104-Q108 PolarHBondContact O-N 3.48Å; V105-Q108 PolarHBondContact O-N 3.32Å
109	R	77.6	Confident	72.3	Confident	88 Å²	88	74.9 Å²	74.9	33%	0.332	39%	0.386	S	S	.	.	H	α-helix	trans	-78.2	-40	178.4	-173.4	175.7	-178	-164.2	-0.2	113.3	V105 L106 L107	V105-R109 WeakPolarHBondContact O-CB 3.31Å; V105-R109 PolarHBondContact O-N 2.86Å; L106-R109 PolarHBondContact O-N 3.02Å; L107-R109 PolarHBondContact O-N 3.38Å
110	F	75.9	Confident	70.9	Confident	97 Å²	97	72.8 Å²	72.8	43%	0.425	38%	0.375	S	S	.	.	H	α-helix	trans	-105.5	-14.5	-170.4	-68	-65	0	0	0	114.4	L106 L107 V163 L167	L106-F110 HydrophobicContact CD2-CD2 4.2Å; L106-F110 HydrophobicContact CD2-CE2 3.76Å; L106-F110 VanDerWaalsContact O-CD2 3.28Å; L106-F110 WeakPolarHBondContact O-CD2 3.49Å; L106-F110 PolarHBondContact O-N 2.94Å; L107-F110 PolarHBondContact O-N 2.88Å; F110-V163 HydrophobicContact CB-CG1 3.44Å; F110-V163 VanDerWaalsContact CB-CG1 3.44Å; F110-V163 WeakPolarHBondContact O-CG1 3.32Å; F110-L167 HydrophobicContact CB-CD1 3.94Å; F110-L167 HydrophobicContact CD1-CD1 3.48Å; F110-L167 VanDerWaalsContact CD1-CD1 3.48Å; F110-L167 HydrophobicContact CE1-CD1 4.24Å; F110-L167 HydrophobicContact CG-CD1 3.95Å
111	D	74.1	Confident	69.6	Low	25 Å²	25	81.5 Å²	81.5	13%	0.134	41%	0.407	C	S	.	.			trans	-132.4	33.4	-174.8	-154.2	42.9	0	0	0	112	L107 E113 T114 A115 V163 R166	L107-D111 HydrophobicContact CD2-CB 4.48Å; L107-D111 CarbonylContact O-C 3.49Å; L107-D111 VanDerWaalsContact O-CA 3.29Å; L107-D111 WeakPolarHBondContact O-CA 3.46Å; L107-D111 VanDerWaalsContact O-CB 3.27Å; L107-D111 WeakPolarHBondContact O-CB 3.45Å; L107-D111 PolarHBondContact O-N 3.29Å; D111-E113 PolarHBondContact O-N 3.4Å; D111-T114 PolarHBondContact O-N 3.31Å; D111-T114 VanDerWaalsContact O-N 3.11Å; D111-T114 PolarHBondContact OD1-OG1 3.5Å; D111-T114 PolarHBondContact OD2-OG1 2.87Å; D111-A115 PolarHBondContact O-N 3.46Å; D111-V163 HydrophobicContact CB-CG1 4.23Å; D111-V163 HydrophobicContact CB-CG2 3.59Å; D111-V163 VanDerWaalsContact CG-CG2 3.41Å; D111-V163 WeakPolarHBondContact OD1-CG2 3.47Å; D111-R166 IonicContact OD1-NH1 3.75Å
112	A	61.9	Low	68.2	Low	73 Å²	73	84.1 Å²	84.1	60%	0.603	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-24.4	-177.4	0	0	0	0	0	113.7
113	E	60.8	Low	67	Low	197 Å²	197	83.7 Å²	83.7	92%	0.921	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-23.8	-178.9	-64.8	178.8	-175.3	0	0	113.6	D111	D111-E113 PolarHBondContact O-N 3.4Å
114	T	61.5	Low	65.9	Low	83 Å²	83	86.4 Å²	86.4	51%	0.509	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.2	9.3	-179.9	41.6	0	0	0	0	113.8	D111 D116	D111-T114 PolarHBondContact O-N 3.31Å; D111-T114 VanDerWaalsContact O-N 3.11Å; D111-T114 PolarHBondContact OD1-OG1 3.5Å; D111-T114 PolarHBondContact OD2-OG1 2.87Å; T114-D116 PolarHBondContact O-N 3.36Å
115	A	57	Low	64.8	Low	43 Å²	43	92 Å²	92	36%	0.355	46%	0.461	S	S	.	.			trans	-69	100.8	179.4	0	0	0	0	0	111.2	D111 E117	D111-A115 PolarHBondContact O-N 3.46Å; A115-E117 PolarHBondContact O-N 2.92Å
116	D	58.7	Low	63.7	Low	97 Å²	97	94.2 Å²	94.2	52%	0.519	47%	0.474	S	S	.	.			trans	-79.2	107.4	175.2	-147.2	-10	0	0	0	109.4	T114 L118 E119 N120	T114-D116 PolarHBondContact O-N 3.36Å; D116-L118 PolarHBondContact O-N 2.83Å; D116-L118 VanDerWaalsContact O-N 3.08Å; D116-E119 PolarHBondContact O-N 2.84Å; D116-E119 VanDerWaalsContact O-N 3.13Å; D116-N120 PolarHBondContact O-N 3.34Å
117	E	58.2	Low	62.5	Low	165 Å²	165	91.3 Å²	91.3	77%	0.771	46%	0.459	S	S	*	.	H	α-helix	trans	-57.4	-27.4	-173.8	-69.5	-164	156.1	0	0	113.3	A115 N120 R121	A115-E117 PolarHBondContact O-N 2.92Å; E117-N120 PolarHBondContact O-N 3.46Å; E117-R121 PolarHBondContact O-N 3.39Å
118	L	52.6	Low	61.7	Low	130 Å²	130	95 Å²	95	68%	0.681	48%	0.483	S	S	*	.	H	α-helix	trans	-68.2	-39	178.7	-95.3	139.2	0	0	0	113.2	D116 R121 N122	D116-L118 PolarHBondContact O-N 2.83Å; D116-L118 VanDerWaalsContact O-N 3.08Å; L118-R121 PolarHBondContact O-N 3.46Å; L118-N122 PolarHBondContact O-N 2.99Å
119	E	57.5	Low	61.2	Low	94 Å²	94	91.1 Å²	91.1	44%	0.439	47%	0.469	S	S	.	.	H	α-helix	trans	-69	-38.8	176.7	-70.8	-167.3	149.3	0	0	110.8	D116 R121 N122 E123 K159	D116-E119 PolarHBondContact O-N 2.84Å; D116-E119 VanDerWaalsContact O-N 3.13Å; E119-R121 VanDerWaalsContact C-N 3.28Å; E119-R121 PolarHBondContact O-N 2.85Å; E119-N122 PolarHBondContact O-N 3.23Å; E119-E123 PolarHBondContact O-N 3.25Å; E119-K159 IonicContact OE2-NZ 3.94Å; E119-K159 PolarHBondContact OE2-NZ 3.19Å
120	N	58.5	Low	61.1	Low	40 Å²	40	87.3 Å²	87.3	21%	0.214	46%	0.455	C	S	.	.	H	α-helix	trans	-59.8	-38.1	176.3	-76.2	-12	0	0	0	112.1	R104 D116 E117	R104-N120 PolarHBondContact NH2-O 2.89Å; D116-N120 PolarHBondContact O-N 3.34Å; E117-N120 PolarHBondContact O-N 3.46Å
121	R	56.2	Low	61.2	Low	201 Å²	201	84.6 Å²	84.6	76%	0.758	45%	0.445	S	S	*	.	H	α-helix	trans	-73.4	-40.1	-177.3	-159.6	174.6	160.3	172.4	-5.3	112.6	E117 L118 E119 E123 N124	E117-R121 PolarHBondContact O-N 3.39Å; L118-R121 PolarHBondContact O-N 3.46Å; E119-R121 VanDerWaalsContact C-N 3.28Å; E119-R121 PolarHBondContact O-N 2.85Å; R121-E123 VanDerWaalsContact C-N 3.34Å; R121-E123 PolarHBondContact O-N 3.47Å; R121-N124 WeakPolarHBondContact O-CB 3.5Å; R121-N124 PolarHBondContact O-N 2.77Å
122	N	53.5	Low	61.3	Low	105 Å²	105	86.7 Å²	86.7	56%	0.561	47%	0.465	S	S	*	.	H	α-helix	trans	-66.3	-34.8	179.5	-80.2	-8	0	0	0	112.9	L118 E119 N124 V126	L118-N122 PolarHBondContact O-N 2.99Å; E119-N122 PolarHBondContact O-N 3.23Å; N122-N124 VanDerWaalsContact C-N 3.25Å; N122-N124 PolarHBondContact O-N 3.18Å; N122-V126 WeakPolarHBondContact O-CG2 3.08Å; N122-V126 PolarHBondContact O-N 3.37Å
123	E	58.2	Low	62	Low	42 Å²	42	87 Å²	87	20%	0.196	45%	0.454	C	S	.	.	H	α-helix	trans	-64.7	-29.5	176	-74	-176.7	168	0	0	112.6	R104 E119 R121 T127 V152	R104-E123 VanDerWaalsContact NH2-CB 3.31Å; R104-E123 IonicContact NH2-OE2 2.7Å; E119-E123 PolarHBondContact O-N 3.25Å; R121-E123 VanDerWaalsContact C-N 3.34Å; R121-E123 PolarHBondContact O-N 3.47Å; E123-T127 WeakPolarHBondContact O-CB 3.5Å; E123-T127 WeakPolarHBondContact O-CG2 3.33Å; E123-T127 PolarHBondContact O-N 3.44Å; E123-T127 PolarHBondContact O-OG1 3.44Å; E123-V152 HydrophobicContact CG-CG1 3.79Å
124	N	60.2	Low	62.9	Low	66 Å²	66	79.4 Å²	79.4	35%	0.353	42%	0.419	S	S	.	.	H	α-helix	trans	-69.8	-44.6	178.8	-100.1	7.5	0	0	0	113.4	R104 R121 N122 T127 T128	R104-N124 VanDerWaalsContact CZ-OD1 3.26Å; R104-N124 PolarHBondContact NH1-ND2 2.9Å; R104-N124 PolarHBondContact NH1-OD1 3.41Å; R104-N124 PolarHBondContact NH2-OD1 2.86Å; R121-N124 WeakPolarHBondContact O-CB 3.5Å; R121-N124 PolarHBondContact O-N 2.77Å; N122-N124 VanDerWaalsContact C-N 3.25Å; N122-N124 PolarHBondContact O-N 3.18Å; N124-T127 PolarHBondContact O-N 3.05Å; N124-T127 PolarHBondContact O-OG1 3.47Å; N124-T128 WeakPolarHBondContact O-CB 3.33Å; N124-T128 WeakPolarHBondContact O-CG2 3.2Å; N124-T128 PolarHBondContact O-N 2.7Å; N124-T128 VanDerWaalsContact O-N 3.08Å; N124-T128 PolarHBondContact O-OG1 2.85Å
125	E	57.6	Low	63.6	Low	140 Å²	140	80.3 Å²	80.3	65%	0.654	43%	0.43	S	S	*	.	H	α-helix	trans	-70.4	-40.1	-173.7	-130.1	172.1	-160.8	0	0	111.6	T127 S129	E125-T127 VanDerWaalsContact C-N 3.35Å; E125-T127 PolarHBondContact O-N 2.86Å; E125-S129 PolarHBondContact O-OG 2.82Å; E125-S129 VanDerWaalsContact O-OG 3.09Å
126	V	57.7	Low	64.6	Low	78 Å²	78	83.2 Å²	83.2	47%	0.473	44%	0.443	S	S	.	.	H	α-helix	trans	-69.1	-32.8	178.8	178.7	0	0	0	0	111.8	N122	N122-V126 WeakPolarHBondContact O-CG2 3.08Å; N122-V126 PolarHBondContact O-N 3.37Å
127	T	56.7	Low	65.6	Low	12 Å²	12	80.5 Å²	80.5	7%	0.074	43%	0.425	C	S	.	.	H	α-helix	trans	-87.5	-36	-175.3	53	0	0	0	0	113.5	N97 N100 E123 N124 E125	N97-T127 PolarHBondContact ND2-O 3.19Å; N97-T127 WeakPolarHBondContact OD1-CB 3.17Å; N97-T127 PolarHBondContact OD1-O 2.97Å; N100-T127 WeakPolarHBondContact ND2-CG2 3.37Å; E123-T127 WeakPolarHBondContact O-CB 3.5Å; E123-T127 WeakPolarHBondContact O-CG2 3.33Å; E123-T127 PolarHBondContact O-N 3.44Å; E123-T127 PolarHBondContact O-OG1 3.44Å; N124-T127 PolarHBondContact O-N 3.05Å; N124-T127 PolarHBondContact O-OG1 3.47Å; E125-T127 VanDerWaalsContact C-N 3.35Å; E125-T127 PolarHBondContact O-N 2.86Å
128	T	64.1	Low	66.7	Low	99 Å²	99	78.3 Å²	78.3	61%	0.607	42%	0.419	S	S	*	.	H	α-helix	trans	-75	-33	-176.6	51.4	0	0	0	0	113.2	N124	N124-T128 WeakPolarHBondContact O-CB 3.33Å; N124-T128 WeakPolarHBondContact O-CG2 3.2Å; N124-T128 PolarHBondContact O-N 2.7Å; N124-T128 VanDerWaalsContact O-N 3.08Å; N124-T128 PolarHBondContact O-OG1 2.85Å
129	S	67.7	Low	68.1	Low	38 Å²	38	80.8 Å²	80.8	27%	0.266	42%	0.424	S	S	.	.	S	Bend	trans	-96	2.9	-178.3	72.7	0	0	0	0	115.3	E125 L131 A132 Q133	E125-S129 PolarHBondContact O-OG 2.82Å; E125-S129 VanDerWaalsContact O-OG 3.09Å; S129-L131 PolarHBondContact O-N 3.48Å; S129-A132 WeakPolarHBondContact O-CB 2.97Å; S129-A132 PolarHBondContact O-N 2.94Å; S129-A132 VanDerWaalsContact O-N 3.07Å; S129-Q133 PolarHBondContact O-N 3.02Å; S129-Q133 VanDerWaalsContact O-N 3.1Å; S129-Q133 PolarHBondContact OG-NE2 3.4Å
130	F	75	Confident	69.3	Low	9 Å²	9	85 Å²	85	4%	0.039	44%	0.444	C	S	.	.	H	α-helix	trans	-54.7	-44.7	-170.5	-177.1	-90.4	0	0	0	113.9	A132 Q133 L134 W137 L146 R149	F130-A132 VanDerWaalsContact C-N 3.34Å; F130-A132 PolarHBondContact O-N 3.28Å; F130-Q133 PolarHBondContact O-N 3.47Å; F130-L134 HydrophobicContact CD1-CD1 4.43Å; F130-L134 HydrophobicContact CE1-CD1 3.65Å; F130-L134 HydrophobicContact CZ-CD1 3.88Å; F130-L134 WeakPolarHBondContact O-CB 3.34Å; F130-L134 PolarHBondContact O-N 3.37Å; F130-W137 AromaticContact CD2-CH2 3.66Å; F130-W137 HydrophobicContact CD2-CH2 3.66Å; F130-W137 HydrophobicContact CD2-CZ3 4.05Å; F130-W137 HydrophobicContact CE1-CZ3 4.4Å; F130-W137 AromaticContact CE2-CH2 3.48Å; F130-W137 HydrophobicContact CE2-CH2 3.48Å; F130-W137 VanDerWaalsContact CE2-CH2 3.48Å; F130-W137 AromaticContact CE2-CZ3 3.46Å; F130-W137 HydrophobicContact CE2-CZ3 3.46Å; F130-W137 VanDerWaalsContact CE2-CZ3 3.46Å; F130-W137 HydrophobicContact CG-CH2 4.45Å; F130-W137 HydrophobicContact CZ-CH2 4.16Å; F130-W137 AromaticContact CZ-CZ3 3.67Å; F130-W137 HydrophobicContact CZ-CZ3 3.67Å; F130-L146 HydrophobicContact CZ-CD2 4.07Å; F130-L146 HydrophobicContact CZ-CG 4.25Å; F130-R149 HydrophobicContact CE2-CB 4.34Å
131	L	77	Confident	70.4	Confident	40 Å²	40	87.3 Å²	87.3	21%	0.209	45%	0.453	C	S	.	.	H	α-helix	trans	-65.9	-37	-179.6	-69.4	173.1	0	0	0	112.7	L89 N90 N93 S129 Q133 L134	L89-L131 HydrophobicContact CD2-CD2 3.47Å; L89-L131 VanDerWaalsContact CD2-CD2 3.47Å; L89-L131 HydrophobicContact CG-CD2 3.77Å; N90-L131 WeakPolarHBondContact OD1-CD1 3.47Å; N93-L131 HydrophobicContact CB-CD1 3.81Å; N93-L131 HydrophobicContact CB-CD2 3.98Å; N93-L131 HydrophobicContact CB-CG 3.95Å; N93-L131 WeakPolarHBondContact ND2-CD1 3.33Å; N93-L131 WeakPolarHBondContact ND2-CG 3.49Å; S129-L131 PolarHBondContact O-N 3.48Å; L131-Q133 VanDerWaalsContact C-N 3.33Å; L131-L134 WeakPolarHBondContact O-CB 3.46Å; L131-L134 PolarHBondContact O-N 2.78Å
132	A	75.8	Confident	71.7	Confident	68 Å²	68	80.2 Å²	80.2	56%	0.562	43%	0.43	S	S	*	.	H	α-helix	trans	-64.4	-42.4	175.8	0	0	0	0	0	110.6	S129 F130 S135	S129-A132 WeakPolarHBondContact O-CB 2.97Å; S129-A132 PolarHBondContact O-N 2.94Å; S129-A132 VanDerWaalsContact O-N 3.07Å; F130-A132 VanDerWaalsContact C-N 3.34Å; F130-A132 PolarHBondContact O-N 3.28Å; A132-S135 PolarHBondContact O-OG 3.44Å
133	Q	78	Confident	73.1	Confident	80 Å²	80	81.1 Å²	81.1	37%	0.374	44%	0.435	S	S	.	.	H	α-helix	trans	-69.4	-32.4	176.9	-63	-178.3	3.7	0	0	112.5	S129 F130 L131 S135 T136 W137	S129-Q133 PolarHBondContact O-N 3.02Å; S129-Q133 VanDerWaalsContact O-N 3.1Å; S129-Q133 PolarHBondContact OG-NE2 3.4Å; F130-Q133 PolarHBondContact O-N 3.47Å; L131-Q133 VanDerWaalsContact C-N 3.33Å; Q133-S135 PolarHBondContact O-N 2.98Å; Q133-T136 PolarHBondContact O-N 2.91Å; Q133-T136 PolarHBondContact O-OG1 3.22Å; Q133-W137 HydrophobicContact CB-CH2 4.14Å; Q133-W137 HydrophobicContact CB-CZ2 3.41Å; Q133-W137 VanDerWaalsContact CB-CZ2 3.41Å; Q133-W137 HydrophobicContact CG-CZ2 4.43Å; Q133-W137 PolarHBondContact O-N 2.99Å; Q133-W137 PolarHBondContact O-NE1 3.38Å
134	L	78.8	Confident	74.4	Confident	37 Å²	37	85.1 Å²	85.1	19%	0.194	45%	0.454	C	S	.	.	H	α-helix	trans	-56	-36.5	178.8	-156.6	75.6	0	0	0	112.5	L89 F130 L131 T136 W137 L142	L89-L134 HydrophobicContact CD1-CD2 4.32Å; L89-L134 HydrophobicContact CD2-CD2 3.43Å; L89-L134 VanDerWaalsContact CD2-CD2 3.43Å; L89-L134 HydrophobicContact CG-CD2 4.42Å; F130-L134 HydrophobicContact CD1-CD1 4.43Å; F130-L134 HydrophobicContact CE1-CD1 3.65Å; F130-L134 HydrophobicContact CZ-CD1 3.88Å; F130-L134 WeakPolarHBondContact O-CB 3.34Å; F130-L134 PolarHBondContact O-N 3.37Å; L131-L134 WeakPolarHBondContact O-CB 3.46Å; L131-L134 PolarHBondContact O-N 2.78Å; L134-T136 PolarHBondContact O-N 2.99Å; L134-W137 HydrophobicContact CD1-CE3 3.56Å; L134-W137 HydrophobicContact CD1-CZ3 3.58Å; L134-W137 PolarHBondContact O-N 3.41Å; L134-L142 HydrophobicContact CD1-CD1 3.25Å; L134-L142 HydrophobicContact CG-CD1 4.14Å
135	S	76.1	Confident	75.4	Confident	103 Å²	103	85.7 Å²	85.7	72%	0.72	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-17.1	177.9	72.5	0	0	0	0	113.9	A132 Q133	A132-S135 PolarHBondContact O-OG 3.44Å; Q133-S135 PolarHBondContact O-N 2.98Å
136	T	78.6	Confident	76.7	Confident	103 Å²	103	82.5 Å²	82.5	63%	0.632	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	-5.7	-177.8	64.9	0	0	0	0	113.8	Q133 L134	Q133-T136 PolarHBondContact O-N 2.91Å; Q133-T136 PolarHBondContact O-OG1 3.22Å; L134-T136 PolarHBondContact O-N 2.99Å
137	W	79.4	Confident	78.1	Confident	40 Å²	40	81.5 Å²	81.5	15%	0.152	44%	0.44	C	S	.	.			trans	-93.4	136.6	-174.3	-62.3	-18.8	0	0	0	112	F130 Q133 L134 L142 K145	F130-W137 AromaticContact CD2-CH2 3.66Å; F130-W137 HydrophobicContact CD2-CH2 3.66Å; F130-W137 HydrophobicContact CD2-CZ3 4.05Å; F130-W137 HydrophobicContact CE1-CZ3 4.4Å; F130-W137 AromaticContact CE2-CH2 3.48Å; F130-W137 HydrophobicContact CE2-CH2 3.48Å; F130-W137 VanDerWaalsContact CE2-CH2 3.48Å; F130-W137 AromaticContact CE2-CZ3 3.46Å; F130-W137 HydrophobicContact CE2-CZ3 3.46Å; F130-W137 VanDerWaalsContact CE2-CZ3 3.46Å; F130-W137 HydrophobicContact CG-CH2 4.45Å; F130-W137 HydrophobicContact CZ-CH2 4.16Å; F130-W137 AromaticContact CZ-CZ3 3.67Å; F130-W137 HydrophobicContact CZ-CZ3 3.67Å; Q133-W137 HydrophobicContact CB-CH2 4.14Å; Q133-W137 HydrophobicContact CB-CZ2 3.41Å; Q133-W137 VanDerWaalsContact CB-CZ2 3.41Å; Q133-W137 HydrophobicContact CG-CZ2 4.43Å; Q133-W137 PolarHBondContact O-N 2.99Å; Q133-W137 PolarHBondContact O-NE1 3.38Å; L134-W137 HydrophobicContact CD1-CE3 3.56Å; L134-W137 HydrophobicContact CD1-CZ3 3.58Å; L134-W137 PolarHBondContact O-N 3.41Å; W137-L142 HydrophobicContact CE3-CD1 4.14Å; W137-K145 HydrophobicContact CD2-CB 4.28Å; W137-K145 HydrophobicContact CD2-CD 4.45Å; W137-K145 HydrophobicContact CD2-CG 3.82Å; W137-K145 HydrophobicContact CE3-CB 3.64Å; W137-K145 HydrophobicContact CE3-CG 3.69Å; W137-K145 HydrophobicContact CH2-CB 3.63Å; W137-K145 HydrophobicContact CH2-CD 4.14Å; W137-K145 HydrophobicContact CH2-CG 3.91Å; W137-K145 HydrophobicContact CZ2-CB 4.21Å; W137-K145 HydrophobicContact CZ2-CD 3.86Å; W137-K145 HydrophobicContact CZ2-CG 3.96Å; W137-K145 HydrophobicContact CZ3-CB 3.31Å; W137-K145 HydrophobicContact CZ3-CD 4.5Å; W137-K145 HydrophobicContact CZ3-CG 3.78Å
138	D	82.5	Confident	79.4	Confident	120 Å²	120	84.9 Å²	84.9	64%	0.642	46%	0.458	S	S	*	.			trans	-71.8	153.9	169.2	-78.2	-37.3	0	0	0	110.7	E140 E141 L142	D138-E140 PolarHBondContact O-N 3.45Å; D138-E141 HydrophobicContact CB-CG 4.48Å; D138-E141 PolarHBondContact O-N 3.19Å; D138-L142 PolarHBondContact O-N 3.1Å
139	K	81.6	Confident	80.4	Confident	182 Å²	182	81 Å²	81	79%	0.791	43%	0.432	S	S	*	.	H	α-helix	trans	-54.5	-31.6	-179	-174.7	-178.8	175.9	-174.1	0	112.8	L142	K139-L142 WeakPolarHBondContact O-CB 3.46Å
140	E	82.5	Confident	81.4	Confident	183 Å²	183	82.3 Å²	82.3	86%	0.855	44%	0.438	S	S	*	.	H	α-helix	trans	-72.7	-29.8	179.7	-62.4	-179	178.6	0	0	112.6	D138	D138-E140 PolarHBondContact O-N 3.45Å
141	E	81.9	Confident	82	Confident	87 Å²	87	86 Å²	86	41%	0.407	46%	0.456	S	S	.	.	H	α-helix	trans	-83.6	-24.4	178.7	-57.3	-172.1	159.3	0	0	112.3	D138 D143 E144 K145	D138-E141 HydrophobicContact CB-CG 4.48Å; D138-E141 PolarHBondContact O-N 3.19Å; E141-D143 VanDerWaalsContact C-N 3.32Å; E141-D143 PolarHBondContact O-N 3.29Å; E141-E144 PolarHBondContact O-N 3.31Å; E141-E144 VanDerWaalsContact O-N 3.16Å; E141-K145 WeakPolarHBondContact O-CG 3.49Å; E141-K145 PolarHBondContact O-N 2.85Å
142	L	82.5	Confident	82.3	Confident	53 Å²	53	86 Å²	86	28%	0.277	46%	0.457	S	S	.	.	H	α-helix	trans	-55.9	-44.2	-172.9	-170.7	65.8	0	0	0	112.8	L134 W137 D138 K139 K145 L146	L134-L142 HydrophobicContact CD1-CD1 3.25Å; L134-L142 HydrophobicContact CG-CD1 4.14Å; W137-L142 HydrophobicContact CE3-CD1 4.14Å; D138-L142 PolarHBondContact O-N 3.1Å; K139-L142 WeakPolarHBondContact O-CB 3.46Å; L142-K145 PolarHBondContact O-N 3.47Å; L142-L146 HydrophobicContact CD1-CD1 4.26Å; L142-L146 HydrophobicContact CG-CD1 3.89Å; L142-L146 WeakPolarHBondContact O-CB 3.44Å; L142-L146 PolarHBondContact O-N 2.81Å
143	D	83	Confident	82.7	Confident	124 Å²	124	83.1 Å²	83.1	66%	0.663	43%	0.433	S	S	*	.	H	α-helix	trans	-64.6	-40.9	-179.2	-75.9	-22.5	0	0	0	111.6	E141 A147	E141-D143 VanDerWaalsContact C-N 3.32Å; E141-D143 PolarHBondContact O-N 3.29Å; D143-A147 VanDerWaalsContact O-CB 3.22Å; D143-A147 WeakPolarHBondContact O-CB 3.46Å; D143-A147 PolarHBondContact O-N 3.4Å
144	E	84.8	Confident	83.2	Confident	126 Å²	126	86 Å²	86	59%	0.589	44%	0.444	S	S	*	.	H	α-helix	trans	-66.3	-44.6	177.6	-168.9	-169.7	155.7	0	0	111.1	E141 A147 N148	E141-E144 PolarHBondContact O-N 3.31Å; E141-E144 VanDerWaalsContact O-N 3.16Å; E144-A147 PolarHBondContact O-N 2.89Å; E144-N148 WeakPolarHBondContact O-CB 3.49Å; E144-N148 VanDerWaalsContact O-CG 3.29Å; E144-N148 PolarHBondContact O-N 2.74Å; E144-N148 PolarHBondContact O-ND2 3.33Å
145	K	82	Confident	83.5	Confident	77 Å²	77	92 Å²	92	34%	0.335	46%	0.464	S	S	.	.	H	α-helix	trans	-66.2	-42	-180	-61.8	-70.7	-175.9	-175.2	0	112	W137 E141 L142 N148 R149	W137-K145 HydrophobicContact CD2-CB 4.28Å; W137-K145 HydrophobicContact CD2-CD 4.45Å; W137-K145 HydrophobicContact CD2-CG 3.82Å; W137-K145 HydrophobicContact CE3-CB 3.64Å; W137-K145 HydrophobicContact CE3-CG 3.69Å; W137-K145 HydrophobicContact CH2-CB 3.63Å; W137-K145 HydrophobicContact CH2-CD 4.14Å; W137-K145 HydrophobicContact CH2-CG 3.91Å; W137-K145 HydrophobicContact CZ2-CB 4.21Å; W137-K145 HydrophobicContact CZ2-CD 3.86Å; W137-K145 HydrophobicContact CZ2-CG 3.96Å; W137-K145 HydrophobicContact CZ3-CB 3.31Å; W137-K145 HydrophobicContact CZ3-CD 4.5Å; W137-K145 HydrophobicContact CZ3-CG 3.78Å; E141-K145 WeakPolarHBondContact O-CG 3.49Å; E141-K145 PolarHBondContact O-N 2.85Å; L142-K145 PolarHBondContact O-N 3.47Å; K145-N148 PolarHBondContact O-N 3.34Å; K145-R149 PolarHBondContact O-N 3.4Å
146	L	85.8	Confident	83.9	Confident	73 Å²	73	87.4 Å²	87.4	38%	0.382	43%	0.432	S	S	.	.	H	α-helix	trans	-62.3	-45.2	172.7	-85	158.4	0	0	0	111.2	F130 L142 N148 R149 V150	F130-L146 HydrophobicContact CZ-CD2 4.07Å; F130-L146 HydrophobicContact CZ-CG 4.25Å; L142-L146 HydrophobicContact CD1-CD1 4.26Å; L142-L146 HydrophobicContact CG-CD1 3.89Å; L142-L146 WeakPolarHBondContact O-CB 3.44Å; L142-L146 PolarHBondContact O-N 2.81Å; L146-N148 VanDerWaalsContact C-N 3.31Å; L146-N148 PolarHBondContact O-N 2.88Å; L146-R149 PolarHBondContact O-N 3.39Å; L146-V150 WeakPolarHBondContact O-CG2 3.19Å; L146-V150 PolarHBondContact O-N 2.92Å
147	A	86.2	Confident	84.3	Confident	57 Å²	57	85.6 Å²	85.6	47%	0.471	42%	0.421	S	S	.	.	H	α-helix	trans	-59.1	-42.9	176.7	0	0	0	0	0	111.6	D143 E144 V150 Q151	D143-A147 VanDerWaalsContact O-CB 3.22Å; D143-A147 WeakPolarHBondContact O-CB 3.46Å; D143-A147 PolarHBondContact O-N 3.4Å; E144-A147 PolarHBondContact O-N 2.89Å; A147-V150 PolarHBondContact O-N 2.92Å; A147-Q151 VanDerWaalsContact O-CB 3.26Å; A147-Q151 WeakPolarHBondContact O-CB 3.5Å; A147-Q151 PolarHBondContact O-N 2.92Å
148	N	84.6	Confident	84.7	Confident	83 Å²	83	85.9 Å²	85.9	44%	0.444	43%	0.432	S	S	.	.	H	α-helix	trans	-61.1	-45.5	176.1	-75.9	-33.7	0	0	0	112.1	E144 K145 L146 V150 Q151 V152	E144-N148 WeakPolarHBondContact O-CB 3.49Å; E144-N148 VanDerWaalsContact O-CG 3.29Å; E144-N148 PolarHBondContact O-N 2.74Å; E144-N148 PolarHBondContact O-ND2 3.33Å; K145-N148 PolarHBondContact O-N 3.34Å; L146-N148 VanDerWaalsContact C-N 3.31Å; L146-N148 PolarHBondContact O-N 2.88Å; N148-V150 PolarHBondContact O-N 3.49Å; N148-Q151 PolarHBondContact O-N 3.13Å; N148-V152 WeakPolarHBondContact O-CG2 3.42Å; N148-V152 PolarHBondContact O-N 2.91Å
149	R	85.1	Confident	84.9	Confident	17 Å²	17	83.9 Å²	83.9	6%	0.064	42%	0.418	C	S	.	.	H	α-helix	trans	-62.4	-43.2	177.1	-176.2	177.6	178.4	173.1	4.4	112.5	N93 N97 F130 K145 L146 Q151 S153	N93-R149 PolarHBondContact OD1-NH1 3.31Å; N93-R149 PolarHBondContact OD1-NH2 3.38Å; N97-R149 PolarHBondContact OD1-NH2 3.45Å; F130-R149 HydrophobicContact CE2-CB 4.34Å; K145-R149 PolarHBondContact O-N 3.4Å; L146-R149 PolarHBondContact O-N 3.39Å; R149-Q151 VanDerWaalsContact C-N 3.31Å; R149-S153 PolarHBondContact O-N 2.91Å; R149-S153 PolarHBondContact O-OG 3.01Å
150	V	88.5	Confident	85	Confident	67 Å²	67	76.5 Å²	76.5	41%	0.406	39%	0.387	S	S	.	.	H	α-helix	trans	-63.3	-41.1	175.2	173.1	0	0	0	0	110.4	W96 L146 A147 N148 V152 S153 K154	W96-V150 HydrophobicContact CH2-CG2 3.94Å; W96-V150 HydrophobicContact CZ2-CB 4.49Å; W96-V150 HydrophobicContact CZ2-CG2 3.82Å; L146-V150 WeakPolarHBondContact O-CG2 3.19Å; L146-V150 PolarHBondContact O-N 2.92Å; A147-V150 PolarHBondContact O-N 2.92Å; N148-V150 PolarHBondContact O-N 3.49Å; V150-V152 PolarHBondContact O-N 3.24Å; V150-S153 PolarHBondContact O-N 3.46Å; V150-K154 VanDerWaalsContact O-CB 3.31Å; V150-K154 WeakPolarHBondContact O-CB 3.4Å; V150-K154 PolarHBondContact O-N 3.33Å
151	Q	87.4	Confident	85.3	Confident	85 Å²	85	71.2 Å²	71.2	40%	0.397	37%	0.367	S	S	.	.	H	α-helix	trans	-65.2	-40	-178.9	-171.8	67.5	-4.8	0	0	112.4	A147 N148 R149 K154 R155	A147-Q151 VanDerWaalsContact O-CB 3.26Å; A147-Q151 WeakPolarHBondContact O-CB 3.5Å; A147-Q151 PolarHBondContact O-N 2.92Å; N148-Q151 PolarHBondContact O-N 3.13Å; R149-Q151 VanDerWaalsContact C-N 3.31Å; Q151-K154 PolarHBondContact O-N 3.26Å; Q151-R155 WeakPolarHBondContact O-CG 3.46Å; Q151-R155 PolarHBondContact O-N 3.49Å
152	V	83.8	Confident	85.5	Confident	41 Å²	41	72 Å²	72	25%	0.248	37%	0.37	C	S	.	.	H	α-helix	trans	-58.5	-52.7	172.8	171	0	0	0	0	110.1	E123 N148 V150 K154 R155 A156	E123-V152 HydrophobicContact CG-CG1 3.79Å; N148-V152 WeakPolarHBondContact O-CG2 3.42Å; N148-V152 PolarHBondContact O-N 2.91Å; V150-V152 PolarHBondContact O-N 3.24Å; V152-K154 VanDerWaalsContact C-N 3.28Å; V152-K154 PolarHBondContact O-N 2.92Å; V152-R155 PolarHBondContact O-N 3.11Å; V152-R155 VanDerWaalsContact O-N 3.14Å; V152-A156 PolarHBondContact O-N 3.37Å; V152-A156 VanDerWaalsContact O-N 3.08Å
153	S	84.2	Confident	85.6	Confident	7 Å²	7	69.8 Å²	69.8	5%	0.049	36%	0.359	C	S	.	.	H	α-helix	trans	-59.3	-41.2	179.9	-43.2	0	0	0	0	111.2	W96 N100 R149 V150 A156 V157	W96-S153 PolarHBondContact NE1-OG 3.37Å; N100-S153 PolarHBondContact ND2-OG 3.06Å; N100-S153 WeakPolarHBondContact OD1-CB 2.89Å; N100-S153 PolarHBondContact OD1-OG 3.46Å; N100-S153 VanDerWaalsContact OD1-OG 3.13Å; R149-S153 PolarHBondContact O-N 2.91Å; R149-S153 PolarHBondContact O-OG 3.01Å; V150-S153 PolarHBondContact O-N 3.46Å; S153-A156 PolarHBondContact O-N 2.97Å; S153-V157 WeakPolarHBondContact O-CG2 3.32Å; S153-V157 PolarHBondContact O-N 2.74Å
154	K	88.8	Confident	85.7	Confident	141 Å²	141	67.8 Å²	67.8	61%	0.613	35%	0.348	S	S	*	.	H	α-helix	trans	-64.4	-39.5	177.7	-171.6	178.4	-179.8	-179.3	0	112.8	V150 Q151 V152 A158	V150-K154 VanDerWaalsContact O-CB 3.31Å; V150-K154 WeakPolarHBondContact O-CB 3.4Å; V150-K154 PolarHBondContact O-N 3.33Å; Q151-K154 PolarHBondContact O-N 3.26Å; V152-K154 VanDerWaalsContact C-N 3.28Å; V152-K154 PolarHBondContact O-N 2.92Å; K154-A158 WeakPolarHBondContact O-CB 3.36Å; K154-A158 PolarHBondContact O-N 3.49Å
155	R	84.9	Confident	85.8	Confident	163 Å²	163	65.5 Å²	65.5	62%	0.615	34%	0.339	S	S	*	.	H	α-helix	trans	-64.1	-44.2	174.5	-73.1	-178.8	-156.3	167.7	6.6	111.1	Q151 V152 A158 K159	Q151-R155 WeakPolarHBondContact O-CG 3.46Å; Q151-R155 PolarHBondContact O-N 3.49Å; V152-R155 PolarHBondContact O-N 3.11Å; V152-R155 VanDerWaalsContact O-N 3.14Å; R155-A158 WeakPolarHBondContact O-CB 3.2Å; R155-A158 PolarHBondContact O-N 3.26Å; R155-K159 PolarHBondContact O-N 2.77Å
156	A	83.3	Confident	85.8	Confident	6 Å²	6	68 Å²	68	5%	0.05	35%	0.347	C	S	.	.	H	α-helix	trans	-63.9	-41.7	179	0	0	0	0	0	111.7	I103 V152 S153 A158 K159 I160	I103-A156 HydrophobicContact CG2-CB 3.51Å; V152-A156 PolarHBondContact O-N 3.37Å; V152-A156 VanDerWaalsContact O-N 3.08Å; S153-A156 PolarHBondContact O-N 2.97Å; A156-A158 PolarHBondContact O-N 2.92Å; A156-K159 WeakPolarHBondContact O-CB 3.2Å; A156-K159 PolarHBondContact O-N 3.45Å; A156-I160 PolarHBondContact O-N 3.37Å; A156-I160 VanDerWaalsContact O-N 3.13Å
157	V	87.8	Confident	85.6	Confident	66 Å²	66	66.5 Å²	66.5	40%	0.4	34%	0.339	S	S	.	.	H	α-helix	trans	-60	-43.8	171.4	173.4	0	0	0	0	111.7	I103 S153 K159 I160 V161	I103-V157 HydrophobicContact CD1-CG2 3.53Å; I103-V157 HydrophobicContact CG1-CG2 4.49Å; S153-V157 WeakPolarHBondContact O-CG2 3.32Å; S153-V157 PolarHBondContact O-N 2.74Å; V157-K159 VanDerWaalsContact C-N 3.28Å; V157-K159 PolarHBondContact O-N 3.21Å; V157-I160 PolarHBondContact O-N 3.4Å; V157-I160 VanDerWaalsContact O-N 3.15Å; V157-V161 WeakPolarHBondContact O-CG2 3.38Å; V157-V161 PolarHBondContact O-N 2.85Å
158	A	88	Confident	85.4	Confident	46 Å²	46	68.7 Å²	68.7	38%	0.38	34%	0.341	S	S	.	.	H	α-helix	trans	-61.4	-37	178.5	0	0	0	0	0	112.3	K154 R155 A156 V161 Q162	K154-A158 WeakPolarHBondContact O-CB 3.36Å; K154-A158 PolarHBondContact O-N 3.49Å; R155-A158 WeakPolarHBondContact O-CB 3.2Å; R155-A158 PolarHBondContact O-N 3.26Å; A156-A158 PolarHBondContact O-N 2.92Å; A158-V161 PolarHBondContact O-N 2.92Å; A158-Q162 WeakPolarHBondContact O-CG 3.19Å; A158-Q162 PolarHBondContact O-N 3.32Å; A158-Q162 VanDerWaalsContact O-N 3.12Å
159	K	85.2	Confident	85.3	Confident	77 Å²	77	69.9 Å²	69.9	34%	0.335	34%	0.344	S	S	.	.	H	α-helix	trans	-62.6	-45.3	172.7	-71.1	-173.9	-179.9	-176	0	111.6	L107 E119 R155 A156 V157 V161 Q162 V163	L107-K159 HydrophobicContact CD1-CB 4.25Å; L107-K159 HydrophobicContact CD1-CD 4.48Å; L107-K159 HydrophobicContact CD2-CB 3.79Å; E119-K159 IonicContact OE2-NZ 3.94Å; E119-K159 PolarHBondContact OE2-NZ 3.19Å; R155-K159 PolarHBondContact O-N 2.77Å; A156-K159 WeakPolarHBondContact O-CB 3.2Å; A156-K159 PolarHBondContact O-N 3.45Å; V157-K159 VanDerWaalsContact C-N 3.28Å; V157-K159 PolarHBondContact O-N 3.21Å; K159-V161 VanDerWaalsContact C-N 3.29Å; K159-V161 PolarHBondContact O-N 3.41Å; K159-Q162 WeakPolarHBondContact O-CB 3.36Å; K159-Q162 PolarHBondContact O-N 2.89Å; K159-Q162 VanDerWaalsContact O-N 3.14Å; K159-V163 VanDerWaalsContact O-CG2 3.26Å; K159-V163 WeakPolarHBondContact O-CG2 3.48Å; K159-V163 PolarHBondContact O-N 2.92Å
160	I	84.4	Confident	85	Confident	27 Å²	27	75.9 Å²	75.9	14%	0.138	37%	0.366	C	S	.	.	H	α-helix	trans	-57	-45	176.6	-73.8	-174	0	0	0	111.2	I103 L106 L107 A156 V157 Q162 V163 I164	I103-I160 HydrophobicContact CB-CD1 3.9Å; I103-I160 HydrophobicContact CG1-CD1 3.93Å; I103-I160 HydrophobicContact CG2-CD1 3.6Å; I103-I160 HydrophobicContact CG2-CG1 4.22Å; L106-I160 HydrophobicContact CB-CD1 3.83Å; L106-I160 HydrophobicContact CD1-CD1 3.99Å; L107-I160 HydrophobicContact CD1-CG1 4.37Å; L107-I160 HydrophobicContact CD2-CB 4.48Å; L107-I160 HydrophobicContact CD2-CG1 3.6Å; L107-I160 HydrophobicContact CG-CD1 4.38Å; L107-I160 HydrophobicContact CG-CG1 3.68Å; A156-I160 PolarHBondContact O-N 3.37Å; A156-I160 VanDerWaalsContact O-N 3.13Å; V157-I160 PolarHBondContact O-N 3.4Å; V157-I160 VanDerWaalsContact O-N 3.15Å; I160-Q162 VanDerWaalsContact C-N 3.33Å; I160-Q162 PolarHBondContact O-N 2.9Å; I160-V163 PolarHBondContact O-N 2.69Å; I160-I164 HydrophobicContact CG2-CD1 3.64Å; I160-I164 HydrophobicContact CG2-CG1 4.26Å; I160-I164 VanDerWaalsContact O-CG1 3.31Å; I160-I164 WeakPolarHBondContact O-CG1 3.38Å; I160-I164 PolarHBondContact O-N 3.33Å
161	V	88.5	Confident	84.3	Confident	73 Å²	73	76.5 Å²	76.5	44%	0.442	37%	0.368	S	S	.	.	H	α-helix	trans	-59.7	-44.9	178.4	175.6	0	0	0	0	110.8	V157 A158 K159 V163 I164 D165	V157-V161 WeakPolarHBondContact O-CG2 3.38Å; V157-V161 PolarHBondContact O-N 2.85Å; A158-V161 PolarHBondContact O-N 2.92Å; K159-V161 VanDerWaalsContact C-N 3.29Å; K159-V161 PolarHBondContact O-N 3.41Å; V161-V163 VanDerWaalsContact C-N 3.32Å; V161-V163 PolarHBondContact O-N 3.14Å; V161-I164 PolarHBondContact O-N 3.31Å; V161-D165 PolarHBondContact O-N 3.32Å
162	Q	87.3	Confident	83.8	Confident	102 Å²	102	78.1 Å²	78.1	48%	0.477	38%	0.375	S	S	.	.	H	α-helix	trans	-61.6	-39.4	176.7	-69.5	175.5	19.7	0	0	112.8	A158 K159 I160 D165 R166	A158-Q162 WeakPolarHBondContact O-CG 3.19Å; A158-Q162 PolarHBondContact O-N 3.32Å; A158-Q162 VanDerWaalsContact O-N 3.12Å; K159-Q162 WeakPolarHBondContact O-CB 3.36Å; K159-Q162 PolarHBondContact O-N 2.89Å; K159-Q162 VanDerWaalsContact O-N 3.14Å; I160-Q162 VanDerWaalsContact C-N 3.33Å; I160-Q162 PolarHBondContact O-N 2.9Å; Q162-D165 PolarHBondContact O-N 2.87Å; Q162-R166 WeakPolarHBondContact O-CG 3.47Å; Q162-R166 PolarHBondContact O-N 3.4Å
163	V	84.4	Confident	83.3	Confident	7 Å²	7	83 Å²	83	4%	0.042	39%	0.393	C	S	.	.	H	α-helix	trans	-67.3	-41.8	178.2	173.5	0	0	0	0	110.9	L107 F110 D111 K159 I160 V161 R166 L167	L107-V163 HydrophobicContact CD2-CG2 4.22Å; F110-V163 HydrophobicContact CB-CG1 3.44Å; F110-V163 VanDerWaalsContact CB-CG1 3.44Å; F110-V163 WeakPolarHBondContact O-CG1 3.32Å; D111-V163 HydrophobicContact CB-CG1 4.23Å; D111-V163 HydrophobicContact CB-CG2 3.59Å; D111-V163 VanDerWaalsContact CG-CG2 3.41Å; D111-V163 WeakPolarHBondContact OD1-CG2 3.47Å; K159-V163 VanDerWaalsContact O-CG2 3.26Å; K159-V163 WeakPolarHBondContact O-CG2 3.48Å; K159-V163 PolarHBondContact O-N 2.92Å; I160-V163 PolarHBondContact O-N 2.69Å; V161-V163 VanDerWaalsContact C-N 3.32Å; V161-V163 PolarHBondContact O-N 3.14Å; V163-R166 PolarHBondContact O-N 2.94Å; V163-L167 HydrophobicContact CG1-CD1 4.05Å; V163-L167 WeakPolarHBondContact O-CB 3.37Å; V163-L167 WeakPolarHBondContact O-CG 3.31Å; V163-L167 PolarHBondContact O-N 2.91Å
164	I	83.9	Confident	82.6	Confident	82 Å²	82	86.5 Å²	86.5	42%	0.421	41%	0.41	S	S	.	.	H	α-helix	trans	-60.6	-46.1	173.8	-69.3	169.8	0	0	0	110.3	I160 V161 R166 L167 M168	I160-I164 HydrophobicContact CG2-CD1 3.64Å; I160-I164 HydrophobicContact CG2-CG1 4.26Å; I160-I164 VanDerWaalsContact O-CG1 3.31Å; I160-I164 WeakPolarHBondContact O-CG1 3.38Å; I160-I164 PolarHBondContact O-N 3.33Å; V161-I164 PolarHBondContact O-N 3.31Å; I164-R166 PolarHBondContact O-N 2.94Å; I164-L167 PolarHBondContact O-N 2.89Å; I164-M168 HydrophobicContact CG2-CG 4.35Å; I164-M168 HydrophobicContact CG2-SD 4.07Å; I164-M168 WeakPolarHBondContact O-CB 3.47Å; I164-M168 WeakPolarHBondContact O-CG 3.41Å; I164-M168 PolarHBondContact O-N 3.36Å
165	D	86.7	Confident	81.7	Confident	78 Å²	78	82.9 Å²	82.9	42%	0.417	40%	0.4	S	S	.	.	H	α-helix	trans	-59.9	-44.5	177.6	-74.1	-22.5	0	0	0	111.7	V161 Q162 M168 Q169	V161-D165 PolarHBondContact O-N 3.32Å; Q162-D165 PolarHBondContact O-N 2.87Å; D165-M168 PolarHBondContact O-N 3.16Å; D165-Q169 VanDerWaalsContact O-CG 3.3Å; D165-Q169 WeakPolarHBondContact O-CG 3.38Å; D165-Q169 PolarHBondContact O-N 3.33Å
166	R	82.6	Confident	81	Confident	129 Å²	129	79.8 Å²	79.8	49%	0.487	39%	0.392	S	S	.	.	H	α-helix	trans	-61.9	-44.2	175.7	-71.6	175.7	-166.1	165.6	4.8	111.8	D111 Q162 V163 I164 Q169 R170	D111-R166 IonicContact OD1-NH1 3.75Å; Q162-R166 WeakPolarHBondContact O-CG 3.47Å; Q162-R166 PolarHBondContact O-N 3.4Å; V163-R166 PolarHBondContact O-N 2.94Å; I164-R166 PolarHBondContact O-N 2.94Å; R166-Q169 PolarHBondContact O-N 3.43Å; R166-R170 WeakPolarHBondContact O-CB 3.45Å; R166-R170 PolarHBondContact O-N 3.42Å
167	L	81.3	Confident	80.2	Confident	42 Å²	42	84.3 Å²	84.3	22%	0.22	42%	0.419	C	S	.	.	H	α-helix	trans	-64.7	-41	177.9	-79.2	168.6	0	0	0	111.9	F110 V163 I164 R170 N171	F110-L167 HydrophobicContact CB-CD1 3.94Å; F110-L167 HydrophobicContact CD1-CD1 3.48Å; F110-L167 VanDerWaalsContact CD1-CD1 3.48Å; F110-L167 HydrophobicContact CE1-CD1 4.24Å; F110-L167 HydrophobicContact CG-CD1 3.95Å; V163-L167 HydrophobicContact CG1-CD1 4.05Å; V163-L167 WeakPolarHBondContact O-CB 3.37Å; V163-L167 WeakPolarHBondContact O-CG 3.31Å; V163-L167 PolarHBondContact O-N 2.91Å; I164-L167 PolarHBondContact O-N 2.89Å; L167-R170 PolarHBondContact O-N 3.4Å; L167-N171 WeakPolarHBondContact O-CB 3.38Å; L167-N171 PolarHBondContact O-N 3.49Å; L167-N171 PolarHBondContact O-ND2 3.03Å
168	M	82.6	Confident	78.9	Confident	104 Å²	104	86.5 Å²	86.5	51%	0.512	43%	0.428	S	S	.	.	H	α-helix	trans	-61.3	-49.8	174.8	-77.7	-176.6	60.2	0	0	111.1	I164 D165 R170 N171 E172	I164-M168 HydrophobicContact CG2-CG 4.35Å; I164-M168 HydrophobicContact CG2-SD 4.07Å; I164-M168 WeakPolarHBondContact O-CB 3.47Å; I164-M168 WeakPolarHBondContact O-CG 3.41Å; I164-M168 PolarHBondContact O-N 3.36Å; D165-M168 PolarHBondContact O-N 3.16Å; M168-R170 VanDerWaalsContact C-N 3.32Å; M168-R170 PolarHBondContact O-N 2.91Å; M168-N171 PolarHBondContact O-N 2.96Å; M168-E172 PolarHBondContact O-N 3.33Å
169	Q	83	Confident	78	Confident	108 Å²	108	91.6 Å²	91.6	51%	0.505	44%	0.442	S	S	.	.	H	α-helix	trans	-60.3	-40.1	177.2	-71.2	173.3	25.6	0	0	112.5	D165 R166 E172 K173	D165-Q169 VanDerWaalsContact O-CG 3.3Å; D165-Q169 WeakPolarHBondContact O-CG 3.38Å; D165-Q169 PolarHBondContact O-N 3.33Å; R166-Q169 PolarHBondContact O-N 3.43Å; Q169-E172 PolarHBondContact O-N 2.92Å; Q169-K173 WeakPolarHBondContact O-CG 3.35Å; Q169-K173 PolarHBondContact O-N 2.91Å
170	R	77.5	Confident	76.4	Confident	142 Å²	142	90.8 Å²	90.8	54%	0.536	46%	0.455	S	S	.	.	H	α-helix	trans	-63.4	-45.7	175.6	-172.3	-173.5	70.5	146.8	1.8	111.2	R166 L167 M168 K173 I174	R166-R170 WeakPolarHBondContact O-CB 3.45Å; R166-R170 PolarHBondContact O-N 3.42Å; L167-R170 PolarHBondContact O-N 3.4Å; M168-R170 VanDerWaalsContact C-N 3.32Å; M168-R170 PolarHBondContact O-N 2.91Å; R170-K173 PolarHBondContact O-N 3.42Å; R170-I174 HydrophobicContact CG-CD1 4.07Å; R170-I174 WeakPolarHBondContact O-CG1 3.46Å; R170-I174 PolarHBondContact O-N 3.35Å
171	N	75.4	Confident	74.4	Confident	81 Å²	81	93.8 Å²	93.8	43%	0.433	47%	0.471	S	S	.	.	H	α-helix	trans	-65.6	-37.6	178.8	-72.3	-12.6	0	0	0	111.9	L167 M168 I174 T175	L167-N171 WeakPolarHBondContact O-CB 3.38Å; L167-N171 PolarHBondContact O-N 3.49Å; L167-N171 PolarHBondContact O-ND2 3.03Å; M168-N171 PolarHBondContact O-N 2.96Å; N171-I174 PolarHBondContact O-N 3.3Å; N171-T175 VanDerWaalsContact O-CB 3.32Å; N171-T175 WeakPolarHBondContact O-CB 3.46Å; N171-T175 PolarHBondContact O-N 2.96Å; N171-T175 PolarHBondContact O-OG1 2.86Å
172	E	76.4	Confident	72.3	Confident	119 Å²	119	95.6 Å²	95.6	56%	0.556	49%	0.487	S	S	*	.	H	α-helix	trans	-61.7	-45.8	173	-78.8	-179.9	167.8	0	0	112	M168 Q169 I174 T175 H176	M168-E172 PolarHBondContact O-N 3.33Å; Q169-E172 PolarHBondContact O-N 2.92Å; E172-I174 PolarHBondContact O-N 2.97Å; E172-T175 PolarHBondContact O-N 3.41Å; E172-H176 PolarHBondContact O-N 2.83Å
173	K	73.9	Confident	70	Confident	144 Å²	144	98.2 Å²	98.2	63%	0.626	50%	0.504	S	S	*	.	H	α-helix	trans	-59.8	-46.8	175.8	-72.8	174.7	-176.3	178.4	0	112	Q169 R170 T175 H176 V177	Q169-K173 WeakPolarHBondContact O-CG 3.35Å; Q169-K173 PolarHBondContact O-N 2.91Å; R170-K173 PolarHBondContact O-N 3.42Å; K173-T175 VanDerWaalsContact C-N 3.31Å; K173-T175 PolarHBondContact O-N 3.39Å; K173-H176 PolarHBondContact O-N 2.87Å; K173-V177 WeakPolarHBondContact O-CG2 3.29Å; K173-V177 PolarHBondContact O-N 3.31Å
174	I	68.8	Low	67.9	Low	80 Å²	80	102.4 Å²	102.4	41%	0.41	54%	0.539	S	S	.	.	H	α-helix	trans	-61.6	-42.6	176.7	-67.6	167.5	0	0	0	110.2	R170 N171 E172 H176 V177 L178	R170-I174 HydrophobicContact CG-CD1 4.07Å; R170-I174 WeakPolarHBondContact O-CG1 3.46Å; R170-I174 PolarHBondContact O-N 3.35Å; N171-I174 PolarHBondContact O-N 3.3Å; E172-I174 PolarHBondContact O-N 2.97Å; I174-H176 VanDerWaalsContact C-N 3.35Å; I174-H176 PolarHBondContact O-N 3.48Å; I174-V177 PolarHBondContact O-N 2.87Å; I174-L178 HydrophobicContact CG2-CD1 3.74Å; I174-L178 HydrophobicContact CG2-CG 4.22Å; I174-L178 WeakPolarHBondContact O-CB 3.37Å; I174-L178 VanDerWaalsContact O-CG 3.31Å; I174-L178 WeakPolarHBondContact O-CG 3.47Å; I174-L178 PolarHBondContact O-N 3.39Å
175	T	70.8	Confident	65.7	Low	64 Å²	64	104 Å²	104	39%	0.393	56%	0.557	S	S	.	*	H	α-helix	trans	-63	-40.4	178.5	-57.3	0	0	0	0	111.7	N171 E172 K173 L178 K179	N171-T175 VanDerWaalsContact O-CB 3.32Å; N171-T175 WeakPolarHBondContact O-CB 3.46Å; N171-T175 PolarHBondContact O-N 2.96Å; N171-T175 PolarHBondContact O-OG1 2.86Å; E172-T175 PolarHBondContact O-N 3.41Å; K173-T175 VanDerWaalsContact C-N 3.31Å; K173-T175 PolarHBondContact O-N 3.39Å; T175-L178 PolarHBondContact O-N 3.46Å; T175-K179 HydrophobicContact CG2-CD 4.24Å; T175-K179 WeakPolarHBondContact O-CB 3.43Å; T175-K179 WeakPolarHBondContact O-CG 3.39Å; T175-K179 PolarHBondContact O-N 3.29Å
176	H	68.6	Low	63.3	Low	98 Å²	98	105.5 Å²	105.5	45%	0.454	58%	0.581	S	S	.	*	H	α-helix	trans	-63.9	-45.4	174.7	-96.8	-63	0	0	0	112.2	E172 K173 I174 L178 K179 G180 D181	E172-H176 PolarHBondContact O-N 2.83Å; K173-H176 PolarHBondContact O-N 2.87Å; I174-H176 VanDerWaalsContact C-N 3.35Å; I174-H176 PolarHBondContact O-N 3.48Å; H176-L178 VanDerWaalsContact C-N 3.33Å; H176-L178 PolarHBondContact O-N 2.92Å; H176-K179 PolarHBondContact O-N 2.94Å; H176-G180 PolarHBondContact O-N 3.18Å; H176-D181 IonicContact CE1-OD2 3.6Å; H176-D181 IonicContact ND1-OD2 2.76Å; H176-D181 PolarHBondContact ND1-OD2 2.98Å; H176-D181 PolarHBondContact O-N 3.37Å
177	V	66.5	Low	60.9	Low	102 Å²	102	103 Å²	103	62%	0.618	60%	0.595	S	S	*	*	H	α-helix	trans	-61.4	-42.5	177	173.6	0	0	0	0	111	K173 I174 G180	K173-V177 WeakPolarHBondContact O-CG2 3.29Å; K173-V177 PolarHBondContact O-N 3.31Å; I174-V177 PolarHBondContact O-N 2.87Å; V177-G180 PolarHBondContact O-N 3.34Å
178	L	61.2	Low	58.6	Low	112 Å²	112	107.1 Å²	107.1	59%	0.586	63%	0.627	S	S	*	*	H	α-helix	trans	-70.7	-30.5	178.8	-72.5	174.2	0	0	0	113.6	I174 T175 H176 G180	I174-L178 HydrophobicContact CG2-CD1 3.74Å; I174-L178 HydrophobicContact CG2-CG 4.22Å; I174-L178 WeakPolarHBondContact O-CB 3.37Å; I174-L178 VanDerWaalsContact O-CG 3.31Å; I174-L178 WeakPolarHBondContact O-CG 3.47Å; I174-L178 PolarHBondContact O-N 3.39Å; T175-L178 PolarHBondContact O-N 3.46Å; H176-L178 VanDerWaalsContact C-N 3.33Å; H176-L178 PolarHBondContact O-N 2.92Å; L178-G180 PolarHBondContact O-N 2.98Å
179	K	68.1	Low	56.1	Low	153 Å²	153	105.4 Å²	105.4	67%	0.665	64%	0.636	S	S	*	*	H	α-helix	trans	-73.7	-9.2	174.2	-79	-179.5	178.3	179.2	0	113.2	T175 H176 D181	T175-K179 HydrophobicContact CG2-CD 4.24Å; T175-K179 WeakPolarHBondContact O-CB 3.43Å; T175-K179 WeakPolarHBondContact O-CG 3.39Å; T175-K179 PolarHBondContact O-N 3.29Å; H176-K179 PolarHBondContact O-N 2.94Å; K179-D181 PolarHBondContact O-N 3.02Å
180	G	52.2	Low	53.7	Low	59 Å²	59	106.2 Å²	106.2	61%	0.608	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	74.3	14.7	-176.5	0	0	0	0	0	113.5	H176 V177 L178 S182	H176-G180 PolarHBondContact O-N 3.18Å; V177-G180 PolarHBondContact O-N 3.34Å; L178-G180 PolarHBondContact O-N 2.98Å; G180-S182 VanDerWaalsContact C-N 3.27Å; G180-S182 PolarHBondContact O-N 3.36Å
181	D	43.2	Very low	51.5	Low	90 Å²	90	103.1 Å²	103.1	48%	0.481	67%	0.666	S	S	.	*			trans	-72.7	90	170.6	-78.4	-22.7	0	0	0	107.6	H176 K179 L183	H176-D181 IonicContact CE1-OD2 3.6Å; H176-D181 IonicContact ND1-OD2 2.76Å; H176-D181 PolarHBondContact ND1-OD2 2.98Å; H176-D181 PolarHBondContact O-N 3.37Å; K179-D181 PolarHBondContact O-N 3.02Å; D181-L183 PolarHBondContact O-N 2.93Å
182	S	43.4	Very low	49.3	Very low	111 Å²	111	104.9 Å²	104.9	78%	0.776	69%	0.691	S	S	*	*			trans	-51.3	124.8	172.6	-153.9	0	0	0	0	108.4	G180 A184	G180-S182 VanDerWaalsContact C-N 3.27Å; G180-S182 PolarHBondContact O-N 3.36Å; S182-A184 PolarHBondContact O-N 3.09Å
183	L	38.6	Very low	47.2	Very low	158 Å²	158	102.8 Å²	102.8	83%	0.827	70%	0.702	S	S	*	*			trans	-56.7	79.7	-178.3	-78.7	153.4	0	0	0	110.8	D181 S185	D181-L183 PolarHBondContact O-N 2.93Å; L183-S185 PolarHBondContact O-N 2.93Å
184	A	40.8	Very low	45	Very low	94 Å²	94	101.3 Å²	101.3	78%	0.777	72%	0.717	S	S	*	*			trans	-80.2	104.5	172.9	0	0	0	0	0	108.3	S182	S182-A184 PolarHBondContact O-N 3.09Å
185	S	38.8	Very low	43	Very low	115 Å²	115	101.5 Å²	101.5	80%	0.804	74%	0.738	S	S	*	*			trans	62.7	86.4	143.1	169.6	0	0	0	0	116.6	L183	L183-S185 PolarHBondContact O-N 2.93Å
186	A	35.7	Very low	40.9	Very low	111 Å²	111	101.7 Å²	101.7	92%	0.917	75%	0.753	S	S	*	*			trans	-142.9	96.3	148.4	0	0	0	0	0	108.9
187	G	33.2	Very low	39	Very low	76 Å²	76	106.2 Å²	106.2	78%	0.784	77%	0.774	S	S	*	*			trans	173.9	59.5	-179	0	0	0	0	0	114
188	S	31.8	Very low	37.1	Very low	128 Å²	128	110.7 Å²	110.7	90%	0.895	79%	0.789	S	S	*	*			trans	-43.5	134.9	163.1	52.8	0	0	0	0	113.4
189	G	31.1	Very low	35.6	Very low	68 Å²	68	114.1 Å²	114.1	70%	0.701	80%	0.801	S	S	*	*			trans	-177.7	69.2	171.3	0	0	0	0	0	114.4
190	S	31.6	Very low	33.7	Very low	126 Å²	126	115.7 Å²	115.7	88%	0.881	81%	0.811	S	S	*	*			trans	26.9	107.2	149.8	60.8	0	0	0	0	119.5
191	G	31.9	Very low	32.6	Very low	77 Å²	77	121 Å²	121	79%	0.794	82%	0.82	S	S	*	*			trans	-160.1	93.5	161.2	0	0	0	0	0	110	G193	G191-G193 PolarHBondContact O-N 3.17Å
192	A	29.5	Very low	31.8	Very low	117 Å²	117	125.4 Å²	125.4	97%	0.967	84%	0.838	S	S	*	*			trans	-64.5	121.1	175	0	0	0	0	0	110.1
193	G	30.6	Very low	31.2	Very low	75 Å²	75	124.8 Å²	124.8	77%	0.773	84%	0.84	S	S	*	*			trans	-156.3	88.2	173.7	0	0	0	0	0	108.6	G191	G191-G193 PolarHBondContact O-N 3.17Å
194	A	28.7	Very low	30.8	Very low	114 Å²	114	123.2 Å²	123.2	94%	0.942	84%	0.841	S	S	*	*			trans	-74.4	142.2	173.7	0	0	0	0	0	110.5
195	G	26	Very low	30.5	Very low	83 Å²	83	122 Å²	122	86%	0.856	84%	0.838	S	S	*	*			trans	128.1	124.2	156.7	0	0	0	0	0	114.5
196	G	27	Very low	30.1	Very low	68 Å²	68	124.2 Å²	124.2	70%	0.701	84%	0.841	S	S	*	*			trans	117.8	77.6	149.7	0	0	0	0	0	116.5
197	E	29.4	Very low	30.1	Very low	194 Å²	194	124 Å²	124	91%	0.907	84%	0.839	S	S	*	*				67.8	106.6	124.8	-66.8	167.8	-176.5	0	0	119.6
198	E	26.7	Very low	30.2	Very low	196 Å²	196	129 Å²	129	92%	0.916	84%	0.842	S	S	*	*			trans	-34.1	129.1	144.2	-61.8	168.8	149.1	0	0	113.1
199	E	30.4	Very low	30.4	Very low	183 Å²	183	127.8 Å²	127.8	86%	0.855	83%	0.83	S	S	*	*			trans	-155.2	112.3	137.9	-120.1	172.8	-177.5	0	0	111.2
200	Q	26.8	Very low	31.1	Very low	187 Å²	187	130.2 Å²	130.2	87%	0.874	83%	0.831	S	S	*	*			trans	-73	127.4	161.9	-80.7	164.2	-31.6	0	0	109.4
201	Q	29.3	Very low	31.7	Very low	169 Å²	169	130.2 Å²	130.2	79%	0.79	83%	0.826	S	S	*	*			trans	-166	101.7	144.7	-106.4	147.5	33.1	0	0	109
202	Q	26	Very low	32.5	Very low	184 Å²	184	129.6 Å²	129.6	86%	0.86	81%	0.809	S	S	*	*				67.2	100.8	90.2	-107.8	170.8	-14.9	0	0	115.1
203	A	30.8	Very low	33.5	Very low	98 Å²	98	127.3 Å²	127.3	81%	0.81	79%	0.786	S	S	*	*				54.9	100.6	125.2	0	0	0	0	0	119
204	S	31.6	Very low	34.6	Very low	124 Å²	124	126.8 Å²	126.8	87%	0.867	77%	0.774	S	S	*	*				-143.2	124.4	128.6	52.4	0	0	0	0	105.5
205	G	32.9	Very low	35.8	Very low	69 Å²	69	123.5 Å²	123.5	71%	0.711	75%	0.752	S	S	*	*			cis	112.2	40.6	20.7	0	0	0	0	0	111
206	D	30.6	Very low	37.3	Very low	162 Å²	162	124 Å²	124	87%	0.866	74%	0.738	S	S	*	*			trans	-129.9	102.4	165.9	-79.9	-38.9	0	0	0	109.8	E208	D206-E208 PolarHBondContact O-N 3.42Å
207	A	37	Very low	39	Very low	106 Å²	106	125.8 Å²	125.8	88%	0.876	73%	0.728	S	S	*	*			trans	-81.6	92.1	173.8	0	0	0	0	0	108.8
208	E	34.3	Very low	40.8	Very low	181 Å²	181	119.2 Å²	119.2	85%	0.846	71%	0.707	S	S	*	*			trans	-150.1	48.6	167.3	-124.4	177.2	-162.4	0	0	111.5	D206	D206-E208 PolarHBondContact O-N 3.42Å
209	T	37.1	Very low	42.7	Very low	103 Å²	103	115.4 Å²	115.4	63%	0.632	69%	0.692	S	S	*	*			trans	-135	52.9	176.3	-39.7	0	0	0	0	110.6	S212	T209-S212 WeakPolarHBondContact CG2-OG 3.46Å
210	T	44.1	Very low	44.7	Very low	119 Å²	119	110.9 Å²	110.9	73%	0.73	67%	0.671	S	S	*	*	S	Bend	trans	-108.1	-0.4	174.6	41	0	0	0	0	114.1
211	T	46	Very low	47	Very low	126 Å²	126	107.4 Å²	107.4	77%	0.773	66%	0.655	S	S	*	*	S	Bend	trans	-101.8	-22.6	175.2	43.6	0	0	0	0	114
212	S	48.1	Very low	49	Very low	63 Å²	63	103.3 Å²	103.3	44%	0.441	64%	0.641	S	S	.	*	H	α-helix	trans	-79.6	-22.8	173.1	41.8	0	0	0	0	113.2	T209 A214 G215 V216	T209-S212 WeakPolarHBondContact CG2-OG 3.46Å; S212-A214 PolarHBondContact O-N 3.26Å; S212-G215 PolarHBondContact O-N 3.29Å; S212-V216 WeakPolarHBondContact O-CG2 3.36Å; S212-V216 PolarHBondContact O-N 2.89Å; S212-V216 VanDerWaalsContact O-N 3.08Å
213	S	50	Low	51.1	Low	70 Å²	70	100 Å²	100	49%	0.49	63%	0.629	S	S	.	*	H	α-helix	trans	-68.1	-34	175.6	76.2	0	0	0	0	112.5	G215 V216 H217	S213-G215 PolarHBondContact O-N 3.19Å; S213-V216 PolarHBondContact O-N 3.47Å; S213-H217 VanDerWaalsContact O-CB 3.26Å; S213-H217 WeakPolarHBondContact O-CB 3.41Å; S213-H217 PolarHBondContact O-N 2.87Å
214	A	53	Low	53.3	Low	63 Å²	63	100.3 Å²	100.3	52%	0.521	61%	0.612	S	S	.	*	H	α-helix	trans	-65.6	-37.9	176.8	0	0	0	0	0	112.2	S212 A218	S212-A214 PolarHBondContact O-N 3.26Å; A214-A218 VanDerWaalsContact O-CB 3.31Å; A214-A218 WeakPolarHBondContact O-CB 3.49Å; A214-A218 PolarHBondContact O-N 3.17Å
215	G	53.5	Low	55.3	Low	46 Å²	46	99.1 Å²	99.1	47%	0.474	59%	0.593	S	S	.	*	H	α-helix	trans	-70	-41.4	175.1	0	0	0	0	0	112.8	S212 S213 A218 L219	S212-G215 PolarHBondContact O-N 3.29Å; S213-G215 PolarHBondContact O-N 3.19Å; G215-A218 PolarHBondContact O-N 2.95Å; G215-L219 WeakPolarHBondContact O-CB 3.31Å; G215-L219 PolarHBondContact O-N 3.11Å
216	V	58.3	Low	57.2	Low	92 Å²	92	98.7 Å²	98.7	56%	0.558	58%	0.577	S	S	*	*	H	α-helix	trans	-64.2	-42.2	174.1	174.8	0	0	0	0	110.7	S212 S213 L219 E220	S212-V216 WeakPolarHBondContact O-CG2 3.36Å; S212-V216 PolarHBondContact O-N 2.89Å; S212-V216 VanDerWaalsContact O-N 3.08Å; S213-V216 PolarHBondContact O-N 3.47Å; V216-L219 PolarHBondContact O-N 2.91Å; V216-E220 VanDerWaalsContact O-CB 3.3Å; V216-E220 WeakPolarHBondContact O-CB 3.44Å; V216-E220 PolarHBondContact O-N 3.2Å
217	H	63.6	Low	59.3	Low	107 Å²	107	94.9 Å²	94.9	50%	0.495	55%	0.553	S	S	.	*	H	α-helix	trans	-67.9	-39.4	178.5	-150.4	-65.4	0	0	0	112	S213 E220 E221	S213-H217 VanDerWaalsContact O-CB 3.26Å; S213-H217 WeakPolarHBondContact O-CB 3.41Å; S213-H217 PolarHBondContact O-N 2.87Å; H217-E220 PolarHBondContact O-N 3.32Å; H217-E221 IonicContact CE1-OE2 3.3Å; H217-E221 IonicContact ND1-OE2 3.48Å; H217-E221 PolarHBondContact ND1-OE2 2.89Å; H217-E221 WeakPolarHBondContact O-CB 3.33Å; H217-E221 PolarHBondContact O-N 3.43Å
218	A	66	Low	61.3	Low	55 Å²	55	94.6 Å²	94.6	46%	0.455	54%	0.536	S	S	.	.	H	α-helix	trans	-66.1	-39.1	174.6	0	0	0	0	0	112.3	A214 G215 E221 T222	A214-A218 VanDerWaalsContact O-CB 3.31Å; A214-A218 WeakPolarHBondContact O-CB 3.49Å; A214-A218 PolarHBondContact O-N 3.17Å; G215-A218 PolarHBondContact O-N 2.95Å; A218-E221 PolarHBondContact O-N 2.83Å; A218-T222 WeakPolarHBondContact O-CB 3.5Å; A218-T222 PolarHBondContact O-N 3.22Å; A218-T222 PolarHBondContact O-OG1 3.43Å
219	L	66.7	Low	63.4	Low	116 Å²	116	91 Å²	91	61%	0.607	52%	0.519	S	S	*	.	H	α-helix	trans	-64.1	-44	172.7	-174.5	68.9	0	0	0	110.6	G215 V216 T222 L223	G215-L219 WeakPolarHBondContact O-CB 3.31Å; G215-L219 PolarHBondContact O-N 3.11Å; V216-L219 PolarHBondContact O-N 2.91Å; L219-T222 PolarHBondContact O-N 3.25Å; L219-L223 WeakPolarHBondContact O-CB 3.33Å; L219-L223 PolarHBondContact O-N 2.92Å
220	E	73.8	Confident	65.5	Low	88 Å²	88	91.4 Å²	91.4	41%	0.411	52%	0.516	S	S	.	.	H	α-helix	trans	-63.5	-39.6	177.3	-162.3	-173.8	151.4	0	0	112	V216 H217 L223 K224	V216-E220 VanDerWaalsContact O-CB 3.3Å; V216-E220 WeakPolarHBondContact O-CB 3.44Å; V216-E220 PolarHBondContact O-N 3.2Å; H217-E220 PolarHBondContact O-N 3.32Å; E220-L223 PolarHBondContact O-N 3.11Å; E220-K224 WeakPolarHBondContact O-CB 3.48Å; E220-K224 VanDerWaalsContact O-CG 3.31Å; E220-K224 WeakPolarHBondContact O-CG 3.42Å; E220-K224 PolarHBondContact O-N 2.63Å; E220-K224 WeakPolarHBondContact OE1-CE 3.47Å; E220-K224 IonicContact OE1-NZ 3.01Å; E220-K224 PolarHBondContact OE1-NZ 3.23Å
221	E	74.2	Confident	67.1	Low	114 Å²	114	91 Å²	91	53%	0.533	51%	0.507	S	S	.	.	H	α-helix	trans	-61.8	-45.5	173.5	-152.9	94.5	-160.8	0	0	111	H217 A218 L223 K224 Q225	H217-E221 IonicContact CE1-OE2 3.3Å; H217-E221 IonicContact ND1-OE2 3.48Å; H217-E221 PolarHBondContact ND1-OE2 2.89Å; H217-E221 WeakPolarHBondContact O-CB 3.33Å; H217-E221 PolarHBondContact O-N 3.43Å; A218-E221 PolarHBondContact O-N 2.83Å; E221-L223 VanDerWaalsContact C-N 3.34Å; E221-L223 PolarHBondContact O-N 3.4Å; E221-K224 PolarHBondContact O-N 3.23Å; E221-Q225 WeakPolarHBondContact O-CB 3.41Å; E221-Q225 PolarHBondContact O-N 3.41Å
222	T	70.5	Confident	68.7	Low	84 Å²	84	87.5 Å²	87.5	52%	0.515	49%	0.488	S	S	.	.	H	α-helix	trans	-65.5	-39	178.2	-51.9	0	0	0	0	111.1	A218 L219 Q225 T226	A218-T222 WeakPolarHBondContact O-CB 3.5Å; A218-T222 PolarHBondContact O-N 3.22Å; A218-T222 PolarHBondContact O-OG1 3.43Å; L219-T222 PolarHBondContact O-N 3.25Å; T222-Q225 PolarHBondContact O-N 2.93Å; T222-T226 WeakPolarHBondContact O-CB 3.38Å; T222-T226 WeakPolarHBondContact O-CG2 3.43Å; T222-T226 PolarHBondContact O-N 3.4Å; T222-T226 PolarHBondContact O-OG1 3.47Å
223	L	69.9	Low	70.2	Confident	114 Å²	114	89 Å²	89	60%	0.597	49%	0.488	S	S	*	.	H	α-helix	trans	-68	-37.9	176.9	-135.8	134	0	0	0	111.2	L219 E220 E221 T226 H227	L219-L223 WeakPolarHBondContact O-CB 3.33Å; L219-L223 PolarHBondContact O-N 2.92Å; E220-L223 PolarHBondContact O-N 3.11Å; E221-L223 VanDerWaalsContact C-N 3.34Å; E221-L223 PolarHBondContact O-N 3.4Å; L223-T226 WeakPolarHBondContact CA-OG1 3.41Å; L223-T226 PolarHBondContact O-OG1 2.82Å; L223-T226 VanDerWaalsContact O-OG1 3.06Å; L223-H227 WeakPolarHBondContact O-CB 3.22Å; L223-H227 PolarHBondContact O-N 3.31Å
224	K	77.2	Confident	71.5	Confident	105 Å²	105	89.4 Å²	89.4	46%	0.457	49%	0.485	S	S	.	.	H	α-helix	trans	-64.8	-44.2	172.3	-76.8	171.2	-174.6	162	0	111.5	E220 E221 H227 I228	E220-K224 WeakPolarHBondContact O-CB 3.48Å; E220-K224 VanDerWaalsContact O-CG 3.31Å; E220-K224 WeakPolarHBondContact O-CG 3.42Å; E220-K224 PolarHBondContact O-N 2.63Å; E220-K224 WeakPolarHBondContact OE1-CE 3.47Å; E220-K224 IonicContact OE1-NZ 3.01Å; E220-K224 PolarHBondContact OE1-NZ 3.23Å; E221-K224 PolarHBondContact O-N 3.23Å; K224-H227 PolarHBondContact O-N 3.49Å; K224-I228 VanDerWaalsContact O-CG1 3.28Å; K224-I228 WeakPolarHBondContact O-CG1 3.37Å; K224-I228 PolarHBondContact O-N 3.31Å
225	Q	74.4	Confident	72.9	Confident	98 Å²	98	91.4 Å²	91.4	46%	0.458	48%	0.483	S	S	.	.	H	α-helix	trans	-65.3	-47.7	179.8	-175.6	58.2	32	0	0	112.1	E221 T222 H227 I228 E229	E221-Q225 WeakPolarHBondContact O-CB 3.41Å; E221-Q225 PolarHBondContact O-N 3.41Å; T222-Q225 PolarHBondContact O-N 2.93Å; Q225-H227 VanDerWaalsContact C-N 3.31Å; Q225-H227 PolarHBondContact O-N 3.46Å; Q225-I228 WeakPolarHBondContact O-CB 3.48Å; Q225-I228 PolarHBondContact O-N 3.33Å; Q225-I228 VanDerWaalsContact O-N 3.16Å; Q225-E229 PolarHBondContact NE2-OE1 2.95Å; Q225-E229 PolarHBondContact O-N 2.92Å
226	T	72.4	Confident	74.4	Confident	61 Å²	61	94.7 Å²	94.7	37%	0.374	48%	0.484	S	S	.	.	H	α-helix	trans	-63	-37.9	175.8	51.2	0	0	0	0	111.8	T222 L223 E229 I230	T222-T226 WeakPolarHBondContact O-CB 3.38Å; T222-T226 WeakPolarHBondContact O-CG2 3.43Å; T222-T226 PolarHBondContact O-N 3.4Å; T222-T226 PolarHBondContact O-OG1 3.47Å; L223-T226 WeakPolarHBondContact CA-OG1 3.41Å; L223-T226 PolarHBondContact O-OG1 2.82Å; L223-T226 VanDerWaalsContact O-OG1 3.06Å; T226-E229 PolarHBondContact O-N 2.84Å; T226-I230 WeakPolarHBondContact O-CB 3.43Å; T226-I230 VanDerWaalsContact O-CG1 3.26Å; T226-I230 WeakPolarHBondContact O-CG1 3.44Å; T226-I230 PolarHBondContact O-N 3.26Å
227	H	74.6	Confident	75.7	Confident	82 Å²	82	95.2 Å²	95.2	38%	0.38	48%	0.483	S	S	.	.	H	α-helix	trans	-62.2	-42.6	172.5	179.9	-91.8	0	0	0	112.2	L223 K224 Q225 E229 I230 M231	L223-H227 WeakPolarHBondContact O-CB 3.22Å; L223-H227 PolarHBondContact O-N 3.31Å; K224-H227 PolarHBondContact O-N 3.49Å; Q225-H227 VanDerWaalsContact C-N 3.31Å; Q225-H227 PolarHBondContact O-N 3.46Å; H227-E229 VanDerWaalsContact C-N 3.35Å; H227-E229 PolarHBondContact O-N 3.41Å; H227-I230 PolarHBondContact O-N 2.94Å; H227-M231 VanDerWaalsContact O-CB 3.29Å; H227-M231 WeakPolarHBondContact O-CB 3.3Å; H227-M231 WeakPolarHBondContact O-CG 3.41Å; H227-M231 PolarHBondContact O-N 2.87Å
228	I	80.1	Confident	76.5	Confident	99 Å²	99	94.5 Å²	94.5	51%	0.508	48%	0.48	S	S	.	.	H	α-helix	trans	-61.4	-43.4	175.1	-69.9	163.3	0	0	0	111	K224 Q225 M231 S232	K224-I228 VanDerWaalsContact O-CG1 3.28Å; K224-I228 WeakPolarHBondContact O-CG1 3.37Å; K224-I228 PolarHBondContact O-N 3.31Å; Q225-I228 WeakPolarHBondContact O-CB 3.48Å; Q225-I228 PolarHBondContact O-N 3.33Å; Q225-I228 VanDerWaalsContact O-N 3.16Å; I228-M231 PolarHBondContact O-N 3.21Å; I228-S232 WeakPolarHBondContact O-CB 3.43Å; I228-S232 PolarHBondContact O-N 2.9Å
229	E	78.7	Confident	77.5	Confident	107 Å²	107	96 Å²	96	50%	0.5	48%	0.481	S	S	.	.	H	α-helix	trans	-64.5	-46.4	178.4	-73.7	170.2	-163	0	0	112	Q225 T226 H227 M231 S232 E233	Q225-E229 PolarHBondContact NE2-OE1 2.95Å; Q225-E229 PolarHBondContact O-N 2.92Å; T226-E229 PolarHBondContact O-N 2.84Å; H227-E229 VanDerWaalsContact C-N 3.35Å; H227-E229 PolarHBondContact O-N 3.41Å; E229-M231 VanDerWaalsContact C-N 3.32Å; E229-M231 PolarHBondContact O-N 2.87Å; E229-S232 WeakPolarHBondContact O-CB 3.4Å; E229-S232 PolarHBondContact O-N 3.3Å; E229-E233 WeakPolarHBondContact O-CB 3.38Å; E229-E233 PolarHBondContact O-N 3.44Å
230	I	79.3	Confident	78.6	Confident	111 Å²	111	95.2 Å²	95.2	57%	0.569	48%	0.477	S	S	*	.	H	α-helix	trans	-60.5	-42.6	174.8	-70.1	168.6	0	0	0	110.5	T226 H227 E233 N234	T226-I230 WeakPolarHBondContact O-CB 3.43Å; T226-I230 VanDerWaalsContact O-CG1 3.26Å; T226-I230 WeakPolarHBondContact O-CG1 3.44Å; T226-I230 PolarHBondContact O-N 3.26Å; H227-I230 PolarHBondContact O-N 2.94Å; I230-E233 PolarHBondContact O-N 2.9Å; I230-N234 VanDerWaalsContact O-CB 3.24Å; I230-N234 WeakPolarHBondContact O-CB 3.46Å; I230-N234 PolarHBondContact O-N 3.02Å
231	M	79	Confident	79	Confident	110 Å²	110	94 Å²	94	54%	0.542	47%	0.473	S	S	.	.	H	α-helix	trans	-64.4	-41.1	176.6	-74.5	-67.1	-68.1	0	0	112.1	H227 I228 E229 H235	H227-M231 VanDerWaalsContact O-CB 3.29Å; H227-M231 WeakPolarHBondContact O-CB 3.3Å; H227-M231 WeakPolarHBondContact O-CG 3.41Å; H227-M231 PolarHBondContact O-N 2.87Å; I228-M231 PolarHBondContact O-N 3.21Å; E229-M231 VanDerWaalsContact C-N 3.32Å; E229-M231 PolarHBondContact O-N 2.87Å; M231-H235 WeakPolarHBondContact O-CB 3.41Å; M231-H235 PolarHBondContact O-N 2.97Å
232	S	78.7	Confident	79.5	Confident	53 Å²	53	92.1 Å²	92.1	37%	0.371	47%	0.47	S	S	.	.	H	α-helix	trans	-60.7	-47.6	173.6	145.2	0	0	0	0	111.3	I228 E229 H235 K236	I228-S232 WeakPolarHBondContact O-CB 3.43Å; I228-S232 PolarHBondContact O-N 2.9Å; E229-S232 WeakPolarHBondContact O-CB 3.4Å; E229-S232 PolarHBondContact O-N 3.3Å; S232-H235 WeakPolarHBondContact O-CB 3.37Å; S232-H235 PolarHBondContact O-N 3.47Å; S232-K236 WeakPolarHBondContact O-CG 3.37Å; S232-K236 PolarHBondContact O-N 2.81Å
233	E	80.1	Confident	80.5	Confident	94 Å²	94	90.2 Å²	90.2	44%	0.439	46%	0.46	S	S	.	.	H	α-helix	trans	-68.4	-40	-178.7	-159	64.1	-167.2	0	0	111.4	E229 I230 H235 K236 L237	E229-E233 WeakPolarHBondContact O-CB 3.38Å; E229-E233 PolarHBondContact O-N 3.44Å; I230-E233 PolarHBondContact O-N 2.9Å; E233-H235 VanDerWaalsContact C-N 3.29Å; E233-H235 PolarHBondContact O-N 3.1Å; E233-K236 PolarHBondContact O-N 3.29Å; E233-K236 IonicContact OE2-NZ 3.74Å; E233-K236 PolarHBondContact OE2-NZ 3Å; E233-L237 WeakPolarHBondContact O-CB 3.49Å; E233-L237 WeakPolarHBondContact O-CG 3.32Å; E233-L237 PolarHBondContact O-N 3.47Å
234	N	78.1	Confident	81.2	Confident	78 Å²	78	89.4 Å²	89.4	42%	0.417	46%	0.455	S	S	.	.	H	α-helix	trans	-60.1	-41.3	172.3	-157.5	-56.4	0	0	0	110.9	I230 L237 Q238	I230-N234 VanDerWaalsContact O-CB 3.24Å; I230-N234 WeakPolarHBondContact O-CB 3.46Å; I230-N234 PolarHBondContact O-N 3.02Å; N234-L237 PolarHBondContact O-N 3.19Å; N234-Q238 WeakPolarHBondContact O-CB 3.4Å; N234-Q238 VanDerWaalsContact O-CG 3.26Å; N234-Q238 WeakPolarHBondContact O-CG 3.38Å; N234-Q238 PolarHBondContact O-N 3.13Å; N234-Q238 PolarHBondContact OD1-NE2 2.85Å
235	H	82.1	Confident	81.4	Confident	106 Å²	106	87.4 Å²	87.4	49%	0.491	45%	0.448	S	S	.	.	H	α-helix	trans	-63.4	-43.4	175.2	-170.5	62.6	0	0	0	112.3	M231 S232 E233 Q238 N239	M231-H235 WeakPolarHBondContact O-CB 3.41Å; M231-H235 PolarHBondContact O-N 2.97Å; S232-H235 WeakPolarHBondContact O-CB 3.37Å; S232-H235 PolarHBondContact O-N 3.47Å; E233-H235 VanDerWaalsContact C-N 3.29Å; E233-H235 PolarHBondContact O-N 3.1Å; H235-Q238 PolarHBondContact O-N 2.98Å; H235-N239 PolarHBondContact CD2-ND2 3.04Å; H235-N239 PolarHBondContact NE2-ND2 3.19Å; H235-N239 VanDerWaalsContact NE2-ND2 3.16Å; H235-N239 VanDerWaalsContact O-CG 3.24Å; H235-N239 PolarHBondContact O-N 3.42Å; H235-N239 PolarHBondContact O-ND2 2.92Å
236	K	84.8	Confident	82	Confident	114 Å²	114	89.2 Å²	89.2	50%	0.496	46%	0.456	S	S	.	.	H	α-helix	trans	-61.7	-45	174.3	-68.4	178.5	-154.7	154.8	0	112	S232 E233 Q238 N239 L240	S232-K236 WeakPolarHBondContact O-CG 3.37Å; S232-K236 PolarHBondContact O-N 2.81Å; E233-K236 PolarHBondContact O-N 3.29Å; E233-K236 IonicContact OE2-NZ 3.74Å; E233-K236 PolarHBondContact OE2-NZ 3Å; K236-Q238 VanDerWaalsContact C-N 3.34Å; K236-N239 PolarHBondContact O-N 2.84Å; K236-L240 WeakPolarHBondContact O-CB 3.45Å; K236-L240 PolarHBondContact O-N 3.32Å
237	L	85.3	Confident	82.7	Confident	103 Å²	103	92.2 Å²	92.2	54%	0.539	46%	0.464	S	S	.	.	H	α-helix	trans	-63.3	-40.7	177.3	-73.1	172.6	0	0	0	111.4	E233 N234 L240 N241	E233-L237 WeakPolarHBondContact O-CB 3.49Å; E233-L237 WeakPolarHBondContact O-CG 3.32Å; E233-L237 PolarHBondContact O-N 3.47Å; N234-L237 PolarHBondContact O-N 3.19Å; L237-L240 PolarHBondContact O-N 3.31Å; L237-N241 WeakPolarHBondContact O-CB 3.47Å; L237-N241 PolarHBondContact O-N 3.29Å
238	Q	81.5	Confident	83.1	Confident	92 Å²	92	93.8 Å²	93.8	43%	0.43	47%	0.47	S	S	.	.	H	α-helix	trans	-62	-43.4	173.8	-76.5	179	11.7	0	0	111.9	N234 H235 K236 T242	N234-Q238 WeakPolarHBondContact O-CB 3.4Å; N234-Q238 VanDerWaalsContact O-CG 3.26Å; N234-Q238 WeakPolarHBondContact O-CG 3.38Å; N234-Q238 PolarHBondContact O-N 3.13Å; N234-Q238 PolarHBondContact OD1-NE2 2.85Å; H235-Q238 PolarHBondContact O-N 2.98Å; K236-Q238 VanDerWaalsContact C-N 3.34Å; Q238-T242 WeakPolarHBondContact O-CB 3.47Å; Q238-T242 PolarHBondContact O-N 3.46Å; Q238-T242 PolarHBondContact O-OG1 3.45Å
239	N	86.8	Confident	83.3	Confident	86 Å²	86	92 Å²	92	46%	0.46	46%	0.459	S	S	.	.	H	α-helix	trans	-65.3	-45.4	177.5	-70.1	-21.2	0	0	0	111.8	H235 K236 T242 S243	H235-N239 PolarHBondContact CD2-ND2 3.04Å; H235-N239 PolarHBondContact NE2-ND2 3.19Å; H235-N239 VanDerWaalsContact NE2-ND2 3.16Å; H235-N239 VanDerWaalsContact O-CG 3.24Å; H235-N239 PolarHBondContact O-N 3.42Å; H235-N239 PolarHBondContact O-ND2 2.92Å; K236-N239 PolarHBondContact O-N 2.84Å; N239-T242 PolarHBondContact O-N 3.42Å; N239-S243 WeakPolarHBondContact O-CB 3.43Å; N239-S243 PolarHBondContact O-N 2.9Å
240	L	88.9	Confident	83.7	Confident	101 Å²	101	89.9 Å²	89.9	53%	0.529	45%	0.454	S	S	.	.	H	α-helix	trans	-61.9	-46.7	177.1	179.2	62.7	0	0	0	111.3	K236 L237 T242 S243 L244	K236-L240 WeakPolarHBondContact O-CB 3.45Å; K236-L240 PolarHBondContact O-N 3.32Å; L237-L240 PolarHBondContact O-N 3.31Å; L240-T242 VanDerWaalsContact C-N 3.34Å; L240-T242 PolarHBondContact O-N 2.88Å; L240-S243 PolarHBondContact O-N 3.41Å; L240-L244 HydrophobicContact CD1-CD1 4.45Å; L240-L244 HydrophobicContact CD1-CG 4.46Å; L240-L244 HydrophobicContact CG-CD1 4.22Å; L240-L244 WeakPolarHBondContact O-CG 3.31Å; L240-L244 PolarHBondContact O-N 3.43Å
241	N	82.9	Confident	84	Confident	62 Å²	62	91.1 Å²	91.1	33%	0.332	46%	0.459	S	S	.	.	H	α-helix	trans	-61.5	-43.7	178.4	-169.1	-20.8	0	0	0	111	L237 S243 L244 H245	L237-N241 WeakPolarHBondContact O-CB 3.47Å; L237-N241 PolarHBondContact O-N 3.29Å; N241-S243 PolarHBondContact O-N 3.28Å; N241-L244 PolarHBondContact O-N 2.9Å; N241-H245 PolarHBondContact O-CD2 2.95Å; N241-H245 VanDerWaalsContact O-CD2 3.3Å; N241-H245 PolarHBondContact O-N 2.89Å; N241-H245 PolarHBondContact OD1-CD2 3.34Å; N241-H245 PolarHBondContact OD1-NE2 2.89Å
242	T	85.3	Confident	84.3	Confident	75 Å²	75	87 Å²	87	46%	0.46	44%	0.441	S	S	.	.	H	α-helix	trans	-61.7	-42	175.2	-53.6	0	0	0	0	111.9	Q238 N239 L240 H245 E246	Q238-T242 WeakPolarHBondContact O-CB 3.47Å; Q238-T242 PolarHBondContact O-N 3.46Å; Q238-T242 PolarHBondContact O-OG1 3.45Å; N239-T242 PolarHBondContact O-N 3.42Å; L240-T242 VanDerWaalsContact C-N 3.34Å; L240-T242 PolarHBondContact O-N 2.88Å; T242-H245 PolarHBondContact O-N 3.27Å; T242-E246 PolarHBondContact O-N 3.47Å
243	S	89.9	Confident	84.6	Confident	44 Å²	44	85.6 Å²	85.6	31%	0.308	43%	0.429	S	S	.	.	H	α-helix	trans	-64.6	-39.3	175.3	-176.8	0	0	0	0	112.8	N239 L240 N241 E246 K247	N239-S243 WeakPolarHBondContact O-CB 3.43Å; N239-S243 PolarHBondContact O-N 2.9Å; L240-S243 PolarHBondContact O-N 3.41Å; N241-S243 PolarHBondContact O-N 3.28Å; S243-E246 PolarHBondContact O-N 3.41Å; S243-K247 WeakPolarHBondContact O-CG 3.37Å; S243-K247 PolarHBondContact O-N 2.92Å; S243-K247 VanDerWaalsContact O-N 3.12Å
244	L	85.8	Confident	85	Confident	96 Å²	96	86.5 Å²	86.5	50%	0.503	43%	0.431	S	S	.	.	H	α-helix	trans	-66.8	-40.2	175.8	-73.5	172.8	0	0	0	111.5	L240 N241 K247 F248	L240-L244 HydrophobicContact CD1-CD1 4.45Å; L240-L244 HydrophobicContact CD1-CG 4.46Å; L240-L244 HydrophobicContact CG-CD1 4.22Å; L240-L244 WeakPolarHBondContact O-CG 3.31Å; L240-L244 PolarHBondContact O-N 3.43Å; N241-L244 PolarHBondContact O-N 2.9Å; L244-K247 PolarHBondContact O-N 2.91Å; L244-F248 WeakPolarHBondContact O-CB 3.4Å; L244-F248 PolarHBondContact O-N 2.93Å
245	H	81.2	Confident	85.4	Confident	64 Å²	64	89.4 Å²	89.4	30%	0.296	44%	0.444	S	S	.	.	H	α-helix	trans	-64.1	-41.5	174.5	-81.4	-57	0	0	0	112.8	V105 N241 T242 K247 F248 H249	V105-H245 WeakPolarHBondContact CG1-CE1 3.5Å; N241-H245 PolarHBondContact O-CD2 2.95Å; N241-H245 VanDerWaalsContact O-CD2 3.3Å; N241-H245 PolarHBondContact O-N 2.89Å; N241-H245 PolarHBondContact OD1-CD2 3.34Å; N241-H245 PolarHBondContact OD1-NE2 2.89Å; T242-H245 PolarHBondContact O-N 3.27Å; H245-K247 VanDerWaalsContact C-N 3.33Å; H245-K247 PolarHBondContact O-N 3.27Å; H245-F248 PolarHBondContact O-N 3.18Å; H245-H249 VanDerWaalsContact O-CB 3.29Å; H245-H249 WeakPolarHBondContact O-CB 3.25Å; H245-H249 PolarHBondContact O-N 3.01Å
246	E	85.8	Confident	85.5	Confident	136 Å²	136	87.2 Å²	87.2	64%	0.636	43%	0.433	S	S	*	.	H	α-helix	trans	-60.8	-42.5	175.2	-174.3	-175.3	-178.9	0	0	111.8	T242 S243 T250	T242-E246 PolarHBondContact O-N 3.47Å; S243-E246 PolarHBondContact O-N 3.41Å; E246-T250 WeakPolarHBondContact O-CB 3.3Å; E246-T250 PolarHBondContact O-N 2.91Å; E246-T250 PolarHBondContact O-OG1 3.37Å
247	K	87.4	Confident	85.5	Confident	124 Å²	124	85.4 Å²	85.4	54%	0.539	43%	0.427	S	S	.	.	H	α-helix	trans	-64.7	-44.9	174.9	-71.7	173.3	-174.8	173.2	0	111.6	S243 L244 H245 T250 M251	S243-K247 WeakPolarHBondContact O-CG 3.37Å; S243-K247 PolarHBondContact O-N 2.92Å; S243-K247 VanDerWaalsContact O-N 3.12Å; L244-K247 PolarHBondContact O-N 2.91Å; H245-K247 VanDerWaalsContact C-N 3.33Å; H245-K247 PolarHBondContact O-N 3.27Å; K247-T250 PolarHBondContact O-N 3.47Å; K247-M251 WeakPolarHBondContact O-CB 3.45Å; K247-M251 WeakPolarHBondContact O-CG 3.47Å; K247-M251 PolarHBondContact O-N 2.87Å
248	F	83.9	Confident	85.4	Confident	115 Å²	115	89 Å²	89	50%	0.504	43%	0.434	S	S	.	.	H	α-helix	trans	-61.3	-45.8	177.1	179.6	-97.5	0	0	0	111.4	L244 H245 T250 M251 S252	L244-F248 WeakPolarHBondContact O-CB 3.4Å; L244-F248 PolarHBondContact O-N 2.93Å; H245-F248 PolarHBondContact O-N 3.18Å; F248-T250 PolarHBondContact O-N 2.88Å; F248-M251 PolarHBondContact O-N 3.44Å; F248-S252 VanDerWaalsContact O-CB 3.24Å; F248-S252 WeakPolarHBondContact O-CB 3.47Å; F248-S252 PolarHBondContact O-N 2.81Å
249	H	83.9	Confident	85.5	Confident	60 Å²	60	89.8 Å²	89.8	28%	0.278	44%	0.438	S	S	.	.	H	α-helix	trans	-56.7	-48.9	175.1	177.7	91.4	0	0	0	111.1	Q98 D102 H245 M251 S252 L253	Q98-H249 WeakPolarHBondContact CG-CE1 3.46Å; Q98-H249 PolarHBondContact NE2-ND1 3.3Å; D102-H249 VanDerWaalsContact CG-ND1 3.34Å; D102-H249 IonicContact OD1-CE1 2.69Å; D102-H249 IonicContact OD1-CG 2.64Å; D102-H249 IonicContact OD1-ND1 2.77Å; D102-H249 PolarHBondContact OD1-ND1 3.45Å; D102-H249 IonicContact OD2-CE1 3.29Å; D102-H249 PolarHBondContact OD2-CE1 2.76Å; D102-H249 IonicContact OD2-ND1 3.66Å; D102-H249 PolarHBondContact OD2-ND1 3.14Å; H245-H249 VanDerWaalsContact O-CB 3.29Å; H245-H249 WeakPolarHBondContact O-CB 3.25Å; H245-H249 PolarHBondContact O-N 3.01Å; H249-M251 PolarHBondContact O-N 3.24Å; H249-S252 PolarHBondContact O-N 3.4Å; H249-L253 WeakPolarHBondContact O-CB 3.3Å; H249-L253 PolarHBondContact O-N 3.49Å
250	T	87.1	Confident	85.4	Confident	64 Å²	64	87.9 Å²	87.9	39%	0.393	43%	0.428	S	S	.	.	H	α-helix	trans	-62.8	-42.4	178.4	-56.4	0	0	0	0	112.2	E246 K247 F248 K254	E246-T250 WeakPolarHBondContact O-CB 3.3Å; E246-T250 PolarHBondContact O-N 2.91Å; E246-T250 PolarHBondContact O-OG1 3.37Å; K247-T250 PolarHBondContact O-N 3.47Å; F248-T250 PolarHBondContact O-N 2.88Å; T250-K254 WeakPolarHBondContact O-CB 3.46Å; T250-K254 WeakPolarHBondContact O-CG 3.42Å; T250-K254 PolarHBondContact O-N 2.99Å; T250-K254 VanDerWaalsContact O-N 3.08Å
251	M	85.2	Confident	85	Confident	137 Å²	137	85.6 Å²	85.6	68%	0.675	42%	0.423	S	S	*	.	H	α-helix	trans	-68.7	-41.9	177.8	-76.2	-174.1	64.9	0	0	112.4	K247 F248 H249 K254 M255	K247-M251 WeakPolarHBondContact O-CB 3.45Å; K247-M251 WeakPolarHBondContact O-CG 3.47Å; K247-M251 PolarHBondContact O-N 2.87Å; F248-M251 PolarHBondContact O-N 3.44Å; H249-M251 PolarHBondContact O-N 3.24Å; M251-K254 PolarHBondContact O-N 3.14Å; M251-M255 WeakPolarHBondContact O-CB 3.47Å; M251-M255 PolarHBondContact O-N 3.09Å
252	S	85.1	Confident	84.9	Confident	23 Å²	23	87.4 Å²	87.4	16%	0.161	43%	0.429	C	S	.	.	H	α-helix	trans	-60.5	-45.6	175.9	171.4	0	0	0	0	111.1	Q98 F248 H249 M255 K256	Q98-S252 PolarHBondContact OE1-OG 3.47Å; Q98-S252 VanDerWaalsContact OE1-OG 3.05Å; F248-S252 VanDerWaalsContact O-CB 3.24Å; F248-S252 WeakPolarHBondContact O-CB 3.47Å; F248-S252 PolarHBondContact O-N 2.81Å; H249-S252 PolarHBondContact O-N 3.4Å; S252-M255 PolarHBondContact O-N 3.33Å; S252-K256 PolarHBondContact O-N 2.89Å
253	L	85.6	Confident	84.8	Confident	23 Å²	23	86.9 Å²	86.9	12%	0.12	43%	0.426	C	S	.	.	H	α-helix	trans	-61.2	-49	176.9	-162.7	78.7	0	0	0	110.7	R94 Y95 Q98 H249 M255 K256 E257	R94-L253 HydrophobicContact CG-CD1 4.25Å; Y95-L253 HydrophobicContact CD1-CD1 4.34Å; Y95-L253 HydrophobicContact CE1-CD1 4.2Å; Y95-L253 HydrophobicContact CE1-CD2 4.02Å; Q98-L253 HydrophobicContact CB-CD1 4.09Å; Q98-L253 HydrophobicContact CG-CD1 4.08Å; H249-L253 WeakPolarHBondContact O-CB 3.3Å; H249-L253 PolarHBondContact O-N 3.49Å; L253-M255 VanDerWaalsContact C-N 3.33Å; L253-M255 PolarHBondContact O-N 2.96Å; L253-K256 PolarHBondContact O-N 3.23Å; L253-E257 WeakPolarHBondContact O-CG 3.21Å; L253-E257 PolarHBondContact O-N 3.39Å
254	K	88.4	Confident	84.3	Confident	113 Å²	113	87.1 Å²	87.1	49%	0.491	43%	0.431	S	S	.	.	H	α-helix	trans	-56.2	-44.4	175.7	-78.9	-178.4	179.2	-179.1	0	112.5	T250 M251 K256 E257 Y258	T250-K254 WeakPolarHBondContact O-CB 3.46Å; T250-K254 WeakPolarHBondContact O-CG 3.42Å; T250-K254 PolarHBondContact O-N 2.99Å; T250-K254 VanDerWaalsContact O-N 3.08Å; M251-K254 PolarHBondContact O-N 3.14Å; K254-K256 VanDerWaalsContact C-N 3.35Å; K254-E257 PolarHBondContact O-N 2.88Å; K254-Y258 WeakPolarHBondContact O-CD2 3.39Å; K254-Y258 PolarHBondContact O-N 3.24Å
255	M	87	Confident	84.2	Confident	139 Å²	139	88.7 Å²	88.7	69%	0.685	43%	0.434	S	S	*	.	H	α-helix	trans	-63.8	-40.6	179.1	-172.8	158.5	178.1	0	0	111.7	M251 S252 L253 Y258 Q259	M251-M255 WeakPolarHBondContact O-CB 3.47Å; M251-M255 PolarHBondContact O-N 3.09Å; S252-M255 PolarHBondContact O-N 3.33Å; L253-M255 VanDerWaalsContact C-N 3.33Å; L253-M255 PolarHBondContact O-N 2.96Å; M255-Y258 PolarHBondContact O-N 3.26Å; M255-Q259 WeakPolarHBondContact O-CB 3.49Å; M255-Q259 PolarHBondContact O-N 2.84Å
256	K	84.7	Confident	84.3	Confident	60 Å²	60	90.6 Å²	90.6	26%	0.261	44%	0.443	S	S	.	.	H	α-helix	trans	-64.4	-40.3	172.8	-71.6	175.9	-179.3	167.8	0	112.2	R94 S252 L253 K254 Y258 Q259 D260	R94-K256 HydrophobicContact CG-CB 3.8Å; R94-K256 HydrophobicContact CG-CD 4.21Å; S252-K256 PolarHBondContact O-N 2.89Å; L253-K256 PolarHBondContact O-N 3.23Å; K254-K256 VanDerWaalsContact C-N 3.35Å; K256-Y258 VanDerWaalsContact C-N 3.33Å; K256-Y258 PolarHBondContact O-N 3.44Å; K256-Q259 WeakPolarHBondContact O-CB 3.28Å; K256-Q259 PolarHBondContact O-N 2.91Å; K256-D260 PolarHBondContact O-N 3.46Å
257	E	83.5	Confident	84.2	Confident	77 Å²	77	87.7 Å²	87.7	36%	0.36	43%	0.434	S	S	.	.	H	α-helix	trans	-62.8	-40	175.6	-19.5	-173.2	100.5	0	0	112	R94 L253 K254 Q259 D260 A261	R94-E257 IonicContact CZ-OE1 3.65Å; R94-E257 VanDerWaalsContact NH1-CB 3.31Å; R94-E257 VanDerWaalsContact NH1-CD 3.27Å; R94-E257 IonicContact NH1-OE1 3.18Å; R94-E257 PolarHBondContact NH1-OE1 3.48Å; R94-E257 IonicContact NH2-OE1 3.66Å; R94-E257 PolarHBondContact NH2-OE1 2.83Å; L253-E257 WeakPolarHBondContact O-CG 3.21Å; L253-E257 PolarHBondContact O-N 3.39Å; K254-E257 PolarHBondContact O-N 2.88Å; E257-Q259 VanDerWaalsContact C-N 3.33Å; E257-D260 PolarHBondContact O-N 3.33Å; E257-A261 WeakPolarHBondContact O-CB 3.37Å; E257-A261 PolarHBondContact O-N 2.98Å
258	Y	84.1	Confident	83.9	Confident	179 Å²	179	85.8 Å²	85.8	70%	0.702	43%	0.427	S	S	*	.	H	α-helix	trans	-66.2	-36.4	174.9	-73.3	-58.9	0	0	0	112.2	K254 M255 K256 A261 H262	K254-Y258 WeakPolarHBondContact O-CD2 3.39Å; K254-Y258 PolarHBondContact O-N 3.24Å; M255-Y258 PolarHBondContact O-N 3.26Å; K256-Y258 VanDerWaalsContact C-N 3.33Å; K256-Y258 PolarHBondContact O-N 3.44Å; Y258-A261 PolarHBondContact O-N 2.96Å; Y258-H262 WeakPolarHBondContact O-CB 3.36Å; Y258-H262 PolarHBondContact O-N 3.49Å
259	Q	84.2	Confident	83.7	Confident	107 Å²	107	84.5 Å²	84.5	50%	0.5	43%	0.426	S	S	.	.	H	α-helix	trans	-66.1	-43.4	175	-170.3	64	33.8	0	0	111.8	M255 K256 E257 A261 H262 T263	M255-Q259 WeakPolarHBondContact O-CB 3.49Å; M255-Q259 PolarHBondContact O-N 2.84Å; K256-Q259 WeakPolarHBondContact O-CB 3.28Å; K256-Q259 PolarHBondContact O-N 2.91Å; E257-Q259 VanDerWaalsContact C-N 3.33Å; Q259-A261 VanDerWaalsContact C-N 3.34Å; Q259-H262 PolarHBondContact O-N 3.19Å; Q259-T263 PolarHBondContact O-N 3.31Å; Q259-T263 PolarHBondContact O-OG1 3.01Å
260	D	82.7	Confident	83.9	Confident	47 Å²	47	84 Å²	84	25%	0.251	43%	0.432	S	S	.	.	H	α-helix	trans	-61.5	-44.9	175.3	-63.9	-22.5	0	0	0	110.2	K256 E257 H262 T263 A264	K256-D260 PolarHBondContact O-N 3.46Å; E257-D260 PolarHBondContact O-N 3.33Å; D260-H262 PolarHBondContact O-N 3.04Å; D260-T263 PolarHBondContact O-N 3.42Å; D260-A264 WeakPolarHBondContact O-CB 3.46Å; D260-A264 PolarHBondContact O-N 3.44Å
261	A	81.7	Confident	83.7	Confident	53 Å²	53	86.4 Å²	86.4	44%	0.438	44%	0.438	S	S	.	.	H	α-helix	trans	-64.1	-38.6	177.1	0	0	0	0	0	112.6	E257 Y258 Q259 K265	E257-A261 WeakPolarHBondContact O-CB 3.37Å; E257-A261 PolarHBondContact O-N 2.98Å; Y258-A261 PolarHBondContact O-N 2.96Å; Q259-A261 VanDerWaalsContact C-N 3.34Å; A261-K265 VanDerWaalsContact O-CG 3.26Å; A261-K265 WeakPolarHBondContact O-CG 3.46Å; A261-K265 PolarHBondContact O-N 2.86Å
262	H	80.5	Confident	83.5	Confident	99 Å²	99	83.8 Å²	83.8	46%	0.458	43%	0.427	S	S	.	.	H	α-helix	trans	-61.8	-49.4	174.1	-178.4	-85.3	0	0	0	111	Y258 Q259 D260 A264 K265 E266	Y258-H262 WeakPolarHBondContact O-CB 3.36Å; Y258-H262 PolarHBondContact O-N 3.49Å; Q259-H262 PolarHBondContact O-N 3.19Å; D260-H262 PolarHBondContact O-N 3.04Å; H262-A264 VanDerWaalsContact C-N 3.33Å; H262-A264 PolarHBondContact O-N 3.39Å; H262-K265 CarbonylContact O-C 3.6Å; H262-K265 WeakPolarHBondContact O-CA 3.47Å; H262-K265 WeakPolarHBondContact O-CB 3.41Å; H262-K265 PolarHBondContact O-N 3.37Å; H262-E266 IonicContact CE1-OE1 3.66Å; H262-E266 PolarHBondContact CE1-OE1 2.9Å; H262-E266 IonicContact CE1-OE2 3.62Å; H262-E266 PolarHBondContact CE1-OE2 3.2Å; H262-E266 VanDerWaalsContact ND1-CD 3.32Å; H262-E266 IonicContact ND1-OE1 3.4Å; H262-E266 IonicContact ND1-OE2 3.36Å; H262-E266 PolarHBondContact ND1-OE2 3.26Å; H262-E266 VanDerWaalsContact ND1-OE2 3.09Å; H262-E266 PolarHBondContact O-N 2.88Å
263	T	83	Confident	83.6	Confident	64 Å²	64	88.7 Å²	88.7	39%	0.393	45%	0.445	S	S	.	.	H	α-helix	trans	-61.6	-42.2	180	-47.3	0	0	0	0	110.9	Q259 D260 K265 E266 T267	Q259-T263 PolarHBondContact O-N 3.31Å; Q259-T263 PolarHBondContact O-OG1 3.01Å; D260-T263 PolarHBondContact O-N 3.42Å; T263-K265 VanDerWaalsContact C-N 3.3Å; T263-K265 PolarHBondContact O-N 3.35Å; T263-E266 WeakPolarHBondContact O-CB 3.21Å; T263-E266 PolarHBondContact O-N 3.39Å; T263-T267 PolarHBondContact O-N 3.18Å; T263-T267 PolarHBondContact O-OG1 3.46Å
264	A	79.1	Confident	83.7	Confident	49 Å²	49	92.1 Å²	92.1	41%	0.405	46%	0.464	S	S	.	.	H	α-helix	trans	-62.8	-34.3	174.4	0	0	0	0	0	112.9	D260 H262 T267 E268	D260-A264 WeakPolarHBondContact O-CB 3.46Å; D260-A264 PolarHBondContact O-N 3.44Å; H262-A264 VanDerWaalsContact C-N 3.33Å; H262-A264 PolarHBondContact O-N 3.39Å; A264-T267 WeakPolarHBondContact CA-OG1 3.48Å; A264-T267 PolarHBondContact O-OG1 2.9Å; A264-E268 WeakPolarHBondContact O-CB 3.46Å; A264-E268 PolarHBondContact O-N 2.95Å
265	K	84	Confident	83.7	Confident	129 Å²	129	91.7 Å²	91.7	56%	0.561	46%	0.464	S	S	*	.	H	α-helix	trans	-73.8	-31.1	174.3	-71.1	-70.3	165.3	-159.7	0	112.6	A261 H262 T263 E268 N269	A261-K265 VanDerWaalsContact O-CG 3.26Å; A261-K265 WeakPolarHBondContact O-CG 3.46Å; A261-K265 PolarHBondContact O-N 2.86Å; H262-K265 CarbonylContact O-C 3.6Å; H262-K265 WeakPolarHBondContact O-CA 3.47Å; H262-K265 WeakPolarHBondContact O-CB 3.41Å; H262-K265 PolarHBondContact O-N 3.37Å; T263-K265 VanDerWaalsContact C-N 3.3Å; T263-K265 PolarHBondContact O-N 3.35Å; K265-E268 WeakPolarHBondContact CD-OE2 3.48Å; K265-E268 IonicContact NZ-OE1 2.82Å; K265-E268 IonicContact NZ-OE2 2.64Å; K265-E268 PolarHBondContact NZ-OE2 3.07Å; K265-N269 VanDerWaalsContact O-CB 3.28Å; K265-N269 WeakPolarHBondContact O-CB 3.32Å; K265-N269 PolarHBondContact O-N 3.03Å
266	E	83.7	Confident	83.4	Confident	105 Å²	105	89.4 Å²	89.4	49%	0.491	45%	0.453	S	S	.	.	H	α-helix	trans	-67.5	-42.4	172.3	-72.6	177.8	130.2	0	0	111.9	H262 T263 N269 A270	H262-E266 IonicContact CE1-OE1 3.66Å; H262-E266 PolarHBondContact CE1-OE1 2.9Å; H262-E266 IonicContact CE1-OE2 3.62Å; H262-E266 PolarHBondContact CE1-OE2 3.2Å; H262-E266 VanDerWaalsContact ND1-CD 3.32Å; H262-E266 IonicContact ND1-OE1 3.4Å; H262-E266 IonicContact ND1-OE2 3.36Å; H262-E266 PolarHBondContact ND1-OE2 3.26Å; H262-E266 VanDerWaalsContact ND1-OE2 3.09Å; H262-E266 PolarHBondContact O-N 2.88Å; T263-E266 WeakPolarHBondContact O-CB 3.21Å; T263-E266 PolarHBondContact O-N 3.39Å; E266-N269 PolarHBondContact O-N 3.24Å; E266-A270 PolarHBondContact O-N 3.39Å
267	T	82.5	Confident	83.6	Confident	74 Å²	74	91 Å²	91	45%	0.454	46%	0.464	S	S	.	.	H	α-helix	trans	-65.1	-44.7	175.3	55.1	0	0	0	0	111.5	T263 A264 N269 A270 E271	T263-T267 PolarHBondContact O-N 3.18Å; T263-T267 PolarHBondContact O-OG1 3.46Å; A264-T267 WeakPolarHBondContact CA-OG1 3.48Å; A264-T267 PolarHBondContact O-OG1 2.9Å; T267-N269 VanDerWaalsContact C-N 3.27Å; T267-N269 PolarHBondContact O-N 3.11Å; T267-A270 WeakPolarHBondContact O-CB 3.49Å; T267-A270 PolarHBondContact O-N 3.2Å; T267-A270 VanDerWaalsContact O-N 3.13Å; T267-E271 WeakPolarHBondContact O-CG 3.28Å; T267-E271 PolarHBondContact O-N 2.91Å
268	E	83.2	Confident	83.7	Confident	84 Å²	84	93.5 Å²	93.5	39%	0.393	48%	0.476	S	S	.	.	H	α-helix	trans	-59.2	-38.9	174.8	-174.7	-177.6	176.2	0	0	111.6	A264 K265 E271 L272	A264-E268 WeakPolarHBondContact O-CB 3.46Å; A264-E268 PolarHBondContact O-N 2.95Å; K265-E268 WeakPolarHBondContact CD-OE2 3.48Å; K265-E268 IonicContact NZ-OE1 2.82Å; K265-E268 IonicContact NZ-OE2 2.64Å; K265-E268 PolarHBondContact NZ-OE2 3.07Å; E268-E271 PolarHBondContact O-N 3.39Å; E268-L272 HydrophobicContact CG-CD1 4.32Å; E268-L272 WeakPolarHBondContact O-CB 3.45Å; E268-L272 VanDerWaalsContact O-CG 3.29Å; E268-L272 WeakPolarHBondContact O-CG 3.34Å; E268-L272 PolarHBondContact O-N 3.32Å
269	N	78.7	Confident	83.7	Confident	89 Å²	89	90.6 Å²	90.6	48%	0.476	47%	0.472	S	S	.	.	H	α-helix	trans	-68.1	-38.1	176.8	-162.4	-25.7	0	0	0	111.9	K265 E266 T267 K273	K265-N269 VanDerWaalsContact O-CB 3.28Å; K265-N269 WeakPolarHBondContact O-CB 3.32Å; K265-N269 PolarHBondContact O-N 3.03Å; E266-N269 PolarHBondContact O-N 3.24Å; T267-N269 VanDerWaalsContact C-N 3.27Å; T267-N269 PolarHBondContact O-N 3.11Å; N269-K273 WeakPolarHBondContact O-CG 3.26Å; N269-K273 PolarHBondContact O-N 3.06Å; N269-K273 WeakPolarHBondContact OD1-CE 3.31Å
270	A	87.1	Confident	83.7	Confident	48 Å²	48	90.7 Å²	90.7	40%	0.397	47%	0.473	S	S	.	.	H	α-helix	trans	-65.4	-41.5	173.6	0	0	0	0	0	112	E266 T267 K273 N274	E266-A270 PolarHBondContact O-N 3.39Å; T267-A270 WeakPolarHBondContact O-CB 3.49Å; T267-A270 PolarHBondContact O-N 3.2Å; T267-A270 VanDerWaalsContact O-N 3.13Å; A270-K273 PolarHBondContact O-N 2.91Å; A270-N274 PolarHBondContact O-N 3.48Å
271	E	83.5	Confident	84.1	Confident	115 Å²	115	95.7 Å²	95.7	54%	0.537	49%	0.489	S	S	.	.	H	α-helix	trans	-62.8	-45	175	-71.8	170.3	-171.9	0	0	112	T267 E268 K273 N274 Q275	T267-E271 WeakPolarHBondContact O-CG 3.28Å; T267-E271 PolarHBondContact O-N 2.91Å; E268-E271 PolarHBondContact O-N 3.39Å; E271-K273 VanDerWaalsContact C-N 3.31Å; E271-K273 PolarHBondContact O-N 3.45Å; E271-N274 PolarHBondContact O-N 3.01Å; E271-Q275 WeakPolarHBondContact O-CG 3.45Å; E271-Q275 PolarHBondContact O-N 2.92Å
272	L	82.1	Confident	84.4	Confident	83 Å²	83	96.8 Å²	96.8	44%	0.435	49%	0.488	S	S	.	.	H	α-helix	trans	-63.6	-36.4	176.3	-73.7	171.6	0	0	0	112.2	E268 Q275 I276	E268-L272 HydrophobicContact CG-CD1 4.32Å; E268-L272 WeakPolarHBondContact O-CB 3.45Å; E268-L272 VanDerWaalsContact O-CG 3.29Å; E268-L272 WeakPolarHBondContact O-CG 3.34Å; E268-L272 PolarHBondContact O-N 3.32Å; L272-Q275 PolarHBondContact O-N 2.98Å; L272-I276 VanDerWaalsContact O-CG1 3.26Å; L272-I276 WeakPolarHBondContact O-CG1 3.06Å; L272-I276 PolarHBondContact O-N 3.49Å
273	K	86.3	Confident	84.5	Confident	125 Å²	125	96.6 Å²	96.6	54%	0.543	49%	0.49	S	S	.	.	H	α-helix	trans	-62.8	-47.4	172.5	-76.8	173.8	-177.3	177.3	0	111.4	N269 A270 E271 Q275 I276 D277	N269-K273 WeakPolarHBondContact O-CG 3.26Å; N269-K273 PolarHBondContact O-N 3.06Å; N269-K273 WeakPolarHBondContact OD1-CE 3.31Å; A270-K273 PolarHBondContact O-N 2.91Å; E271-K273 VanDerWaalsContact C-N 3.31Å; E271-K273 PolarHBondContact O-N 3.45Å; K273-Q275 VanDerWaalsContact C-N 3.3Å; K273-Q275 PolarHBondContact O-N 2.88Å; K273-I276 WeakPolarHBondContact O-CB 3.43Å; K273-I276 PolarHBondContact O-N 3.49Å; K273-I276 VanDerWaalsContact O-N 3.11Å; K273-D277 PolarHBondContact O-N 2.78Å
274	N	87.8	Confident	84.8	Confident	96 Å²	96	99.9 Å²	99.9	51%	0.513	50%	0.5	S	S	.	.	H	α-helix	trans	-59.7	-41	176.3	-68.2	-16.7	0	0	0	111.6	A270 E271 D277 E278	A270-N274 PolarHBondContact O-N 3.48Å; E271-N274 PolarHBondContact O-N 3.01Å; N274-D277 PolarHBondContact O-N 3.23Å; N274-E278 WeakPolarHBondContact O-CG 3.42Å; N274-E278 PolarHBondContact O-N 3.37Å
275	Q	87.8	Confident	85.4	Confident	104 Å²	104	103.6 Å²	103.6	49%	0.486	51%	0.508	S	S	.	.	H	α-helix	trans	-64.4	-38.3	175	-73.3	177.4	15.5	0	0	112.7	E271 L272 K273 E278 L279	E271-Q275 WeakPolarHBondContact O-CG 3.45Å; E271-Q275 PolarHBondContact O-N 2.92Å; L272-Q275 PolarHBondContact O-N 2.98Å; K273-Q275 VanDerWaalsContact C-N 3.3Å; K273-Q275 PolarHBondContact O-N 2.88Å; Q275-E278 PolarHBondContact O-N 3.06Å; Q275-L279 WeakPolarHBondContact O-CB 3.29Å; Q275-L279 VanDerWaalsContact O-CG 3.25Å; Q275-L279 WeakPolarHBondContact O-CG 3.31Å; Q275-L279 PolarHBondContact O-N 2.93Å
276	I	81.2	Confident	85.6	Confident	91 Å²	91	102.5 Å²	102.5	47%	0.467	51%	0.506	S	S	.	.	H	α-helix	trans	-63.4	-44.3	174.4	-72.5	165.5	0	0	0	110.1	L272 K273 L279 Q280	L272-I276 VanDerWaalsContact O-CG1 3.26Å; L272-I276 WeakPolarHBondContact O-CG1 3.06Å; L272-I276 PolarHBondContact O-N 3.49Å; K273-I276 WeakPolarHBondContact O-CB 3.43Å; K273-I276 PolarHBondContact O-N 3.49Å; K273-I276 VanDerWaalsContact O-N 3.11Å; I276-L279 PolarHBondContact O-N 3.4Å; I276-Q280 HydrophobicContact CG2-CG 4.34Å; I276-Q280 WeakPolarHBondContact O-CB 3.09Å; I276-Q280 VanDerWaalsContact O-CG 3.26Å; I276-Q280 WeakPolarHBondContact O-CG 3.44Å; I276-Q280 PolarHBondContact O-N 2.83Å
277	D	88.2	Confident	85.7	Confident	92 Å²	92	102.5 Å²	102.5	49%	0.492	51%	0.506	S	S	.	.	H	α-helix	trans	-64	-41.4	178.7	-65.8	-15.9	0	0	0	111.3	K273 N274 Q280 Y281	K273-D277 PolarHBondContact O-N 2.78Å; N274-D277 PolarHBondContact O-N 3.23Å; D277-Q280 PolarHBondContact O-N 3.26Å; D277-Y281 WeakPolarHBondContact O-CB 3.43Å; D277-Y281 PolarHBondContact O-N 3.03Å
278	E	87.4	Confident	86	Confident	131 Å²	131	101.8 Å²	101.8	61%	0.612	50%	0.504	S	S	*	.	H	α-helix	trans	-62.1	-45.5	173.2	-75.6	-179.1	-175.8	0	0	112.3	N274 Q275 Y281 D282	N274-E278 WeakPolarHBondContact O-CG 3.42Å; N274-E278 PolarHBondContact O-N 3.37Å; Q275-E278 PolarHBondContact O-N 3.06Å; E278-Y281 WeakPolarHBondContact O-CB 3.41Å; E278-Y281 PolarHBondContact O-N 3.03Å; E278-D282 PolarHBondContact O-N 3.43Å
279	L	82.8	Confident	86.3	Confident	118 Å²	118	106 Å²	106	62%	0.618	52%	0.516	S	S	*	.	H	α-helix	trans	-66.3	-37.7	177.9	-74.1	172.5	0	0	0	111.9	Q275 I276 D282 L283	Q275-L279 WeakPolarHBondContact O-CB 3.29Å; Q275-L279 VanDerWaalsContact O-CG 3.25Å; Q275-L279 WeakPolarHBondContact O-CG 3.31Å; Q275-L279 PolarHBondContact O-N 2.93Å; I276-L279 PolarHBondContact O-N 3.4Å; L279-D282 PolarHBondContact O-N 3.49Å; L279-L283 WeakPolarHBondContact O-CB 3.5Å; L279-L283 PolarHBondContact O-N 3.28Å
280	Q	85	Confident	86.5	Confident	108 Å²	108	105.5 Å²	105.5	51%	0.505	51%	0.513	S	S	.	.	H	α-helix	trans	-63	-44.6	173.5	-76.9	176.9	6	0	0	111	I276 D277 D282 L283 E284	I276-Q280 HydrophobicContact CG2-CG 4.34Å; I276-Q280 WeakPolarHBondContact O-CB 3.09Å; I276-Q280 VanDerWaalsContact O-CG 3.26Å; I276-Q280 WeakPolarHBondContact O-CG 3.44Å; I276-Q280 PolarHBondContact O-N 2.83Å; D277-Q280 PolarHBondContact O-N 3.26Å; Q280-D282 PolarHBondContact O-N 2.98Å; Q280-L283 PolarHBondContact O-N 2.87Å; Q280-E284 WeakPolarHBondContact O-CG 3.21Å; Q280-E284 PolarHBondContact O-N 2.97Å
281	Y	91.5	Very high	86.5	Confident	152 Å²	152	107.1 Å²	107.1	60%	0.596	52%	0.515	S	S	*	.	H	α-helix	trans	-60.7	-43.7	175.4	176.7	-99	0	0	0	112.4	D277 E278 L283 E284 K285	D277-Y281 WeakPolarHBondContact O-CB 3.43Å; D277-Y281 PolarHBondContact O-N 3.03Å; E278-Y281 WeakPolarHBondContact O-CB 3.41Å; E278-Y281 PolarHBondContact O-N 3.03Å; Y281-L283 VanDerWaalsContact C-N 3.35Å; Y281-E284 PolarHBondContact O-N 2.87Å; Y281-K285 VanDerWaalsContact O-CB 3.3Å; Y281-K285 WeakPolarHBondContact O-CB 3.5Å; Y281-K285 PolarHBondContact O-N 2.94Å
282	D	88.1	Confident	86.8	Confident	77 Å²	77	107.5 Å²	107.5	41%	0.412	52%	0.515	S	S	.	.	H	α-helix	trans	-66.7	-36.3	176.2	-87.8	-18.6	0	0	0	112.4	E278 L279 Q280 K285 I286	E278-D282 PolarHBondContact O-N 3.43Å; L279-D282 PolarHBondContact O-N 3.49Å; Q280-D282 PolarHBondContact O-N 2.98Å; D282-K285 PolarHBondContact O-N 3.47Å; D282-I286 VanDerWaalsContact O-CG1 3.28Å; D282-I286 WeakPolarHBondContact O-CG1 3.4Å; D282-I286 PolarHBondContact O-N 3.31Å
283	L	81.5	Confident	86.9	Confident	95 Å²	95	108.1 Å²	108.1	50%	0.497	52%	0.518	S	S	.	.	H	α-helix	trans	-65.3	-47	175.8	-160.2	170.8	0	0	0	110.5	L279 Q280 Y281 K285 I286 H287	L279-L283 WeakPolarHBondContact O-CB 3.5Å; L279-L283 PolarHBondContact O-N 3.28Å; Q280-L283 PolarHBondContact O-N 2.87Å; Y281-L283 VanDerWaalsContact C-N 3.35Å; L283-K285 VanDerWaalsContact C-N 3.33Å; L283-K285 PolarHBondContact O-N 3.44Å; L283-I286 PolarHBondContact O-N 2.97Å; L283-H287 WeakPolarHBondContact CD2-CD2 3.42Å; L283-H287 WeakPolarHBondContact CD2-NE2 3.37Å; L283-H287 PolarHBondContact O-CD2 3.32Å; L283-H287 PolarHBondContact O-N 2.84Å
284	E	90.3	Very high	86.9	Confident	133 Å²	133	108 Å²	108	62%	0.621	52%	0.519	S	S	*	.	H	α-helix	trans	-59.6	-41.9	173.3	-77.5	-179.9	173.9	0	0	112.2	Q280 Y281 I286 H287 C288	Q280-E284 WeakPolarHBondContact O-CG 3.21Å; Q280-E284 PolarHBondContact O-N 2.97Å; Y281-E284 PolarHBondContact O-N 2.87Å; E284-I286 VanDerWaalsContact C-N 3.34Å; E284-I286 PolarHBondContact O-N 3.26Å; E284-H287 PolarHBondContact O-N 3.32Å; E284-C288 WeakPolarHBondContact O-CB 3.4Å; E284-C288 PolarHBondContact O-N 2.88Å
285	K	91.7	Very high	86.9	Confident	127 Å²	127	108.1 Å²	108.1	55%	0.552	52%	0.52	S	S	*	.	H	α-helix	trans	-62.4	-39.7	175.6	179.8	-177.8	174.8	-172.4	0	112.1	Y281 D282 L283 R289	Y281-K285 VanDerWaalsContact O-CB 3.3Å; Y281-K285 WeakPolarHBondContact O-CB 3.5Å; Y281-K285 PolarHBondContact O-N 2.94Å; D282-K285 PolarHBondContact O-N 3.47Å; L283-K285 VanDerWaalsContact C-N 3.33Å; L283-K285 PolarHBondContact O-N 3.44Å; K285-R289 PolarHBondContact O-N 3.33Å; K285-R289 VanDerWaalsContact O-N 3.12Å
286	I	86.3	Confident	86.8	Confident	105 Å²	105	108.5 Å²	108.5	54%	0.538	52%	0.522	S	S	.	.	H	α-helix	trans	-69	-41.9	174.9	-69.9	167.9	0	0	0	110.8	D282 L283 E284 R289 N290	D282-I286 VanDerWaalsContact O-CG1 3.28Å; D282-I286 WeakPolarHBondContact O-CG1 3.4Å; D282-I286 PolarHBondContact O-N 3.31Å; L283-I286 PolarHBondContact O-N 2.97Å; E284-I286 VanDerWaalsContact C-N 3.34Å; E284-I286 PolarHBondContact O-N 3.26Å; I286-R289 WeakPolarHBondContact O-CB 3.3Å; I286-R289 PolarHBondContact O-N 2.89Å; I286-R289 VanDerWaalsContact O-N 3.17Å; I286-N290 PolarHBondContact O-N 3.23Å
287	H	86.6	Confident	87	Confident	105 Å²	105	109.4 Å²	109.4	49%	0.486	53%	0.527	S	S	.	.	H	α-helix	trans	-57.6	-50.5	173.3	-86.5	-58.4	0	0	0	111.6	L283 E284 R289 N290 D291	L283-H287 WeakPolarHBondContact CD2-CD2 3.42Å; L283-H287 WeakPolarHBondContact CD2-NE2 3.37Å; L283-H287 PolarHBondContact O-CD2 3.32Å; L283-H287 PolarHBondContact O-N 2.84Å; E284-H287 PolarHBondContact O-N 3.32Å; H287-R289 PolarHBondContact O-N 3.48Å; H287-R289 VanDerWaalsContact O-N 3.16Å; H287-N290 CarbonylContact O-C 3.59Å; H287-N290 WeakPolarHBondContact O-CA 3.39Å; H287-N290 WeakPolarHBondContact O-CB 3.39Å; H287-N290 PolarHBondContact O-N 3.45Å; H287-D291 VanDerWaalsContact O-CG 3.25Å; H287-D291 PolarHBondContact O-N 3.32Å
288	C	88	Confident	86.9	Confident	59 Å²	59	107.5 Å²	107.5	40%	0.399	52%	0.524	S	S	.	.	H	α-helix	trans	-59.8	-31.9	177.9	-168.8	0	0	0	0	112.5	E284 K292	E284-C288 WeakPolarHBondContact O-CB 3.4Å; E284-C288 PolarHBondContact O-N 2.88Å; C288-K292 VanDerWaalsContact O-CG 3.3Å; C288-K292 WeakPolarHBondContact O-CG 3.39Å; C288-K292 PolarHBondContact O-N 2.8Å
289	R	89.8	Confident	86.8	Confident	174 Å²	174	106 Å²	106	66%	0.657	52%	0.517	S	S	*	.	H	α-helix	trans	-71	-42.4	172.8	-177.9	179.2	177.1	170	-0.6	112	K285 I286 H287 K292 L293	K285-R289 PolarHBondContact O-N 3.33Å; K285-R289 VanDerWaalsContact O-N 3.12Å; I286-R289 WeakPolarHBondContact O-CB 3.3Å; I286-R289 PolarHBondContact O-N 2.89Å; I286-R289 VanDerWaalsContact O-N 3.17Å; H287-R289 PolarHBondContact O-N 3.48Å; H287-R289 VanDerWaalsContact O-N 3.16Å; R289-K292 PolarHBondContact O-N 3.06Å; R289-L293 HydrophobicContact CG-CD1 4.3Å; R289-L293 WeakPolarHBondContact O-CG 3.18Å; R289-L293 PolarHBondContact O-N 2.85Å
290	N	82.6	Confident	86.9	Confident	78 Å²	78	102.4 Å²	102.4	42%	0.417	51%	0.505	S	S	.	.	H	α-helix	trans	-61.7	-45.8	174.6	-91.7	-0.6	0	0	0	111	I286 H287 K292 L293 E294	I286-N290 PolarHBondContact O-N 3.23Å; H287-N290 CarbonylContact O-C 3.59Å; H287-N290 WeakPolarHBondContact O-CA 3.39Å; H287-N290 WeakPolarHBondContact O-CB 3.39Å; H287-N290 PolarHBondContact O-N 3.45Å; N290-K292 VanDerWaalsContact C-N 3.26Å; N290-K292 PolarHBondContact O-N 3.42Å; N290-L293 CarbonylContact O-C 3.57Å; N290-L293 WeakPolarHBondContact O-CA 3.46Å; N290-L293 PolarHBondContact O-N 2.85Å; N290-E294 WeakPolarHBondContact O-CG 3.45Å; N290-E294 PolarHBondContact O-N 2.92Å
291	D	88.9	Confident	86.8	Confident	81 Å²	81	101 Å²	101	43%	0.433	50%	0.5	S	S	.	.	H	α-helix	trans	-57	-41.3	177.2	-61.6	-16.9	0	0	0	111.4	H287 E294 N295	H287-D291 VanDerWaalsContact O-CG 3.25Å; H287-D291 PolarHBondContact O-N 3.32Å; D291-E294 PolarHBondContact O-N 3.35Å; D291-N295 WeakPolarHBondContact O-CB 3.46Å; D291-N295 PolarHBondContact O-N 3.34Å; D291-N295 PolarHBondContact O-ND2 3.12Å
292	K	89.4	Confident	86.4	Confident	124 Å²	124	100.7 Å²	100.7	54%	0.539	50%	0.504	S	S	.	.	H	α-helix	trans	-64.4	-42.2	174.4	-73	171.4	-173.7	175.2	0	112.3	C288 R289 N290 N295 H296	C288-K292 VanDerWaalsContact O-CG 3.3Å; C288-K292 WeakPolarHBondContact O-CG 3.39Å; C288-K292 PolarHBondContact O-N 2.8Å; R289-K292 PolarHBondContact O-N 3.06Å; N290-K292 VanDerWaalsContact C-N 3.26Å; N290-K292 PolarHBondContact O-N 3.42Å; K292-N295 PolarHBondContact O-N 3.47Å; K292-H296 WeakPolarHBondContact O-CB 3.44Å; K292-H296 PolarHBondContact O-CD2 2.89Å; K292-H296 PolarHBondContact O-N 2.98Å
293	L	84.6	Confident	86.2	Confident	95 Å²	95	103.9 Å²	103.9	50%	0.497	51%	0.514	S	S	.	.	H	α-helix	trans	-68.5	-37.9	178.2	-70.9	172	0	0	0	112	R289 N290 H296 L297	R289-L293 HydrophobicContact CG-CD1 4.3Å; R289-L293 WeakPolarHBondContact O-CG 3.18Å; R289-L293 PolarHBondContact O-N 2.85Å; N290-L293 CarbonylContact O-C 3.57Å; N290-L293 WeakPolarHBondContact O-CA 3.46Å; N290-L293 PolarHBondContact O-N 2.85Å; L293-H296 PolarHBondContact O-N 2.89Å; L293-L297 WeakPolarHBondContact O-CB 3.37Å; L293-L297 PolarHBondContact O-N 2.97Å
294	E	86.1	Confident	85.9	Confident	122 Å²	122	104.6 Å²	104.6	57%	0.57	52%	0.518	S	S	*	.	H	α-helix	trans	-64.9	-43.9	174	-73.4	-178.5	-176.4	0	0	111.2	N290 D291 L297 A298	N290-E294 WeakPolarHBondContact O-CG 3.45Å; N290-E294 PolarHBondContact O-N 2.92Å; D291-E294 PolarHBondContact O-N 3.35Å; E294-L297 PolarHBondContact O-N 3.38Å; E294-A298 WeakPolarHBondContact O-CB 3.38Å; E294-A298 PolarHBondContact O-N 2.93Å
295	N	86.5	Confident	85.5	Confident	100 Å²	100	104 Å²	104	54%	0.535	51%	0.513	S	S	.	.	H	α-helix	trans	-61	-45.1	173.1	-74.1	-35.4	0	0	0	111.7	D291 K292 L297 A298 E299	D291-N295 WeakPolarHBondContact O-CB 3.46Å; D291-N295 PolarHBondContact O-N 3.34Å; D291-N295 PolarHBondContact O-ND2 3.12Å; K292-N295 PolarHBondContact O-N 3.47Å; N295-L297 VanDerWaalsContact C-N 3.32Å; N295-L297 PolarHBondContact O-N 3.28Å; N295-A298 PolarHBondContact O-N 3.47Å; N295-E299 WeakPolarHBondContact O-CG 3.49Å; N295-E299 PolarHBondContact O-N 3.29Å
296	H	87.3	Confident	84.8	Confident	112 Å²	112	100 Å²	100	52%	0.519	50%	0.504	S	S	.	.	H	α-helix	trans	-63.4	-37.3	175.2	-75.4	-45.8	0	0	0	112.8	K292 L293 E299 A300	K292-H296 WeakPolarHBondContact O-CB 3.44Å; K292-H296 PolarHBondContact O-CD2 2.89Å; K292-H296 PolarHBondContact O-N 2.98Å; L293-H296 PolarHBondContact O-N 2.89Å; H296-E299 IonicContact ND1-OE2 2.98Å; H296-A300 VanDerWaalsContact O-CB 3.32Å; H296-A300 WeakPolarHBondContact O-CB 3.4Å; H296-A300 PolarHBondContact O-N 3.16Å
297	L	83.8	Confident	84.1	Confident	109 Å²	109	102 Å²	102	57%	0.571	51%	0.506	S	S	*	.	H	α-helix	trans	-66.1	-43.3	175	-177.4	63.9	0	0	0	110.7	L293 E294 N295 A300 I301	L293-L297 WeakPolarHBondContact O-CB 3.37Å; L293-L297 PolarHBondContact O-N 2.97Å; E294-L297 PolarHBondContact O-N 3.38Å; N295-L297 VanDerWaalsContact C-N 3.32Å; N295-L297 PolarHBondContact O-N 3.28Å; L297-A300 PolarHBondContact O-N 3.04Å; L297-I301 HydrophobicContact CD1-CD1 4.36Å; L297-I301 HydrophobicContact CG-CD1 4Å; L297-I301 WeakPolarHBondContact O-CB 3.5Å; L297-I301 VanDerWaalsContact O-CG1 3.22Å; L297-I301 WeakPolarHBondContact O-CG1 3.37Å; L297-I301 PolarHBondContact O-N 3.2Å
298	A	85.8	Confident	83.3	Confident	53 Å²	53	103.7 Å²	103.7	44%	0.438	51%	0.513	S	S	.	.	H	α-helix	trans	-60.9	-45.9	175.3	0	0	0	0	0	111.6	E294 N295 A300 I301 E302	E294-A298 WeakPolarHBondContact O-CB 3.38Å; E294-A298 PolarHBondContact O-N 2.93Å; N295-A298 PolarHBondContact O-N 3.47Å; A298-A300 PolarHBondContact O-N 3.5Å; A298-I301 PolarHBondContact O-N 3.21Å; A298-E302 PolarHBondContact O-N 2.95Å
299	E	87.1	Confident	82.6	Confident	98 Å²	98	109 Å²	109	46%	0.458	53%	0.533	S	S	.	.	H	α-helix	trans	-61.3	-40.6	174.1	-74.3	178.1	-170.8	0	0	112.6	N295 H296 E302 K303	N295-E299 WeakPolarHBondContact O-CG 3.49Å; N295-E299 PolarHBondContact O-N 3.29Å; H296-E299 IonicContact ND1-OE2 2.98Å; E299-E302 PolarHBondContact O-N 3.23Å; E299-K303 WeakPolarHBondContact O-CB 3.48Å; E299-K303 WeakPolarHBondContact O-CG 3.33Å; E299-K303 PolarHBondContact O-N 3.04Å
300	A	83.6	Confident	81.5	Confident	44 Å²	44	106.6 Å²	106.6	36%	0.364	53%	0.531	S	S	.	.	H	α-helix	trans	-66.2	-39.6	177.1	0	0	0	0	0	111.5	H296 L297 A298 K303 L304	H296-A300 VanDerWaalsContact O-CB 3.32Å; H296-A300 WeakPolarHBondContact O-CB 3.4Å; H296-A300 PolarHBondContact O-N 3.16Å; L297-A300 PolarHBondContact O-N 3.04Å; A298-A300 PolarHBondContact O-N 3.5Å; A300-K303 PolarHBondContact O-N 3.26Å; A300-L304 WeakPolarHBondContact O-CB 3.45Å; A300-L304 WeakPolarHBondContact O-CG 3.47Å; A300-L304 PolarHBondContact O-N 2.97Å
301	I	83.2	Confident	80.5	Confident	77 Å²	77	109.9 Å²	109.9	40%	0.395	54%	0.539	S	S	.	.	H	α-helix	trans	-64.1	-44.7	174	-69.7	165.3	0	0	0	110.5	L297 A298 L304 K305	L297-I301 HydrophobicContact CD1-CD1 4.36Å; L297-I301 HydrophobicContact CG-CD1 4Å; L297-I301 WeakPolarHBondContact O-CB 3.5Å; L297-I301 VanDerWaalsContact O-CG1 3.22Å; L297-I301 WeakPolarHBondContact O-CG1 3.37Å; L297-I301 PolarHBondContact O-N 3.2Å; A298-I301 PolarHBondContact O-N 3.21Å; I301-L304 PolarHBondContact O-N 3.38Å; I301-K305 HydrophobicContact CG2-CD 4.27Å; I301-K305 WeakPolarHBondContact O-CB 3.46Å; I301-K305 WeakPolarHBondContact O-CG 3.22Å; I301-K305 PolarHBondContact O-N 2.94Å
302	E	84.2	Confident	78.5	Confident	147 Å²	147	108.2 Å²	108.2	69%	0.687	54%	0.54	S	S	*	.	H	α-helix	trans	-61.1	-44.8	174.8	-85.8	-135	140.8	0	0	112.2	A298 E299 L304 K305 A306	A298-E302 PolarHBondContact O-N 2.95Å; E299-E302 PolarHBondContact O-N 3.23Å; E302-L304 VanDerWaalsContact C-N 3.32Å; E302-L304 PolarHBondContact O-N 3.4Å; E302-K305 PolarHBondContact O-N 3.36Å; E302-A306 WeakPolarHBondContact O-CB 3.32Å; E302-A306 PolarHBondContact O-N 3.48Å
303	K	83.2	Confident	76.1	Confident	143 Å²	143	108.8 Å²	108.8	62%	0.622	55%	0.549	S	S	*	.	H	α-helix	trans	-61	-40.7	175.5	-75.8	171	-177.1	164.5	0	111.7	E299 A300 A306 Y307	E299-K303 WeakPolarHBondContact O-CB 3.48Å; E299-K303 WeakPolarHBondContact O-CG 3.33Å; E299-K303 PolarHBondContact O-N 3.04Å; A300-K303 PolarHBondContact O-N 3.26Å; K303-A306 PolarHBondContact O-N 2.88Å; K303-Y307 VanDerWaalsContact O-CB 3.3Å; K303-Y307 WeakPolarHBondContact O-CB 3.37Å; K303-Y307 PolarHBondContact O-N 3.16Å
304	L	76	Confident	74.1	Confident	111 Å²	111	109.7 Å²	109.7	58%	0.581	56%	0.561	S	S	*	*	H	α-helix	trans	-65	-41.3	175	-85.1	162.6	0	0	0	112.2	A300 I301 E302 Y307 H308	A300-L304 WeakPolarHBondContact O-CB 3.45Å; A300-L304 WeakPolarHBondContact O-CG 3.47Å; A300-L304 PolarHBondContact O-N 2.97Å; I301-L304 PolarHBondContact O-N 3.38Å; E302-L304 VanDerWaalsContact C-N 3.32Å; E302-L304 PolarHBondContact O-N 3.4Å; L304-Y307 PolarHBondContact O-N 3.29Å; L304-H308 WeakPolarHBondContact O-CB 3.4Å; L304-H308 PolarHBondContact O-N 2.87Å
305	K	80.1	Confident	71.9	Confident	121 Å²	121	110 Å²	110	53%	0.526	57%	0.567	S	S	.	*	H	α-helix	trans	-62.9	-47	174.5	-75.8	179.1	178.2	-175.9	0	111	I301 E302 Y307 H308 Q309	I301-K305 HydrophobicContact CG2-CD 4.27Å; I301-K305 WeakPolarHBondContact O-CB 3.46Å; I301-K305 WeakPolarHBondContact O-CG 3.22Å; I301-K305 PolarHBondContact O-N 2.94Å; E302-K305 PolarHBondContact O-N 3.36Å; K305-Y307 PolarHBondContact O-N 3.43Å; K305-H308 PolarHBondContact O-N 3Å; K305-Q309 PolarHBondContact O-N 3.12Å
306	A	77.1	Confident	69.2	Low	43 Å²	43	114.6 Å²	114.6	36%	0.355	58%	0.582	S	S	.	*	H	α-helix	trans	-62.1	-41.7	175.8	0	0	0	0	0	111.7	E302 K303 Q309 I310	E302-A306 WeakPolarHBondContact O-CB 3.32Å; E302-A306 PolarHBondContact O-N 3.48Å; K303-A306 PolarHBondContact O-N 2.88Å; A306-Q309 PolarHBondContact O-N 2.96Å; A306-I310 WeakPolarHBondContact O-CD1 3.45Å; A306-I310 WeakPolarHBondContact O-CG1 3.34Å; A306-I310 PolarHBondContact O-N 3.5Å
307	Y	71.4	Confident	66.6	Low	147 Å²	147	113.1 Å²	113.1	58%	0.576	58%	0.584	S	S	*	*	H	α-helix	trans	-65.9	-40.7	176.6	-154.1	-87.9	0	0	0	111.9	K303 L304 K305 Q309 I310 Y311	K303-Y307 VanDerWaalsContact O-CB 3.3Å; K303-Y307 WeakPolarHBondContact O-CB 3.37Å; K303-Y307 PolarHBondContact O-N 3.16Å; L304-Y307 PolarHBondContact O-N 3.29Å; K305-Y307 PolarHBondContact O-N 3.43Å; Y307-Q309 VanDerWaalsContact C-N 3.31Å; Y307-Q309 PolarHBondContact O-N 3.49Å; Y307-I310 PolarHBondContact O-N 3.32Å; Y307-Y311 HydrophobicContact CD1-CD2 4.01Å; Y307-Y311 HydrophobicContact CD1-CG 4.42Å; Y307-Y311 HydrophobicContact CD2-CD2 4.03Å; Y307-Y311 HydrophobicContact CD2-CE2 4.35Å; Y307-Y311 AromaticContact CE1-CD2 3.78Å; Y307-Y311 HydrophobicContact CE1-CD2 3.78Å; Y307-Y311 HydrophobicContact CE1-CG 4.02Å; Y307-Y311 AromaticContact CE2-CD2 3.8Å; Y307-Y311 HydrophobicContact CE2-CD2 3.8Å; Y307-Y311 AromaticContact CE2-CE2 3.9Å; Y307-Y311 HydrophobicContact CE2-CE2 3.9Å; Y307-Y311 HydrophobicContact CG-CD2 4.14Å; Y307-Y311 AromaticContact CZ-CD2 3.67Å; Y307-Y311 WeakPolarHBondContact O-CB 3.31Å; Y307-Y311 PolarHBondContact O-N 3.49Å
308	H	71.6	Confident	64	Low	139 Å²	139	114.2 Å²	114.2	64%	0.644	60%	0.596	S	S	*	*	H	α-helix	trans	-60.9	-40.3	171.3	-104.4	76.3	0	0	0	111.7	L304 K305 G312	L304-H308 WeakPolarHBondContact O-CB 3.4Å; L304-H308 PolarHBondContact O-N 2.87Å; K305-H308 PolarHBondContact O-N 3Å; H308-G312 CarbonylContact O-C 3.56Å; H308-G312 VanDerWaalsContact O-CA 3.31Å; H308-G312 WeakPolarHBondContact O-CA 3.49Å; H308-G312 PolarHBondContact O-N 3.17Å
309	Q	71.7	Confident	61.4	Low	172 Å²	172	119.2 Å²	119.2	80%	0.804	62%	0.615	S	S	*	*	H	α-helix	trans	-67.7	-33.1	177.4	-113.4	170.8	-1.1	0	0	113.5	K305 A306 Y307	K305-Q309 PolarHBondContact O-N 3.12Å; A306-Q309 PolarHBondContact O-N 2.96Å; Y307-Q309 VanDerWaalsContact C-N 3.31Å; Y307-Q309 PolarHBondContact O-N 3.49Å
310	I	67.8	Low	58.6	Low	122 Å²	122	119.9 Å²	119.9	63%	0.626	63%	0.631	S	S	*	*	H	α-helix	trans	-86.9	-34.4	-178.4	-62.4	165	0	0	0	111.6	A306 Y307	A306-I310 WeakPolarHBondContact O-CD1 3.45Å; A306-I310 WeakPolarHBondContact O-CG1 3.34Å; A306-I310 PolarHBondContact O-N 3.5Å; Y307-I310 PolarHBondContact O-N 3.32Å
311	Y	60.7	Low	56.2	Low	148 Å²	148	122.8 Å²	122.8	58%	0.58	66%	0.655	S	S	*	*	H	α-helix	trans	-123.8	-9.2	-168.6	-70.1	-79.3	0	0	0	116	Y307 P314	Y307-Y311 HydrophobicContact CD1-CD2 4.01Å; Y307-Y311 HydrophobicContact CD1-CG 4.42Å; Y307-Y311 HydrophobicContact CD2-CD2 4.03Å; Y307-Y311 HydrophobicContact CD2-CE2 4.35Å; Y307-Y311 AromaticContact CE1-CD2 3.78Å; Y307-Y311 HydrophobicContact CE1-CD2 3.78Å; Y307-Y311 HydrophobicContact CE1-CG 4.02Å; Y307-Y311 AromaticContact CE2-CD2 3.8Å; Y307-Y311 HydrophobicContact CE2-CD2 3.8Å; Y307-Y311 AromaticContact CE2-CE2 3.9Å; Y307-Y311 HydrophobicContact CE2-CE2 3.9Å; Y307-Y311 HydrophobicContact CG-CD2 4.14Å; Y307-Y311 AromaticContact CZ-CD2 3.67Å; Y307-Y311 WeakPolarHBondContact O-CB 3.31Å; Y307-Y311 PolarHBondContact O-N 3.49Å; Y311-P314 WeakPolarHBondContact O-CD 3.2Å
312	G	46.6	Very low	53.6	Low	45 Å²	45	128.1 Å²	128.1	46%	0.464	68%	0.675	S	S	.	*	S	Bend	trans	-105.9	107.5	170.4	0	0	0	0	0	109.4	H308	H308-G312 CarbonylContact O-C 3.56Å; H308-G312 VanDerWaalsContact O-CA 3.31Å; H308-G312 WeakPolarHBondContact O-CA 3.49Å; H308-G312 PolarHBondContact O-N 3.17Å
313	D	38.9	Very low	51.1	Low	136 Å²	136	127 Å²	127	73%	0.727	68%	0.679	S	S	*	*			cis	-158.7	103.8	38.7	-171.7	-0.5	0	0	0	109.8	N315	D313-N315 PolarHBondContact O-N 3.19Å
314	P	43.8	Very low	48.7	Very low	115 Å²	115	126.4 Å²	126.4	75%	0.747	69%	0.689	S	S	*	*	S	Bend	trans	-88.5	95.1	164.5	31.7	-25.3	0	0	0	109.1	Y311	Y311-P314 WeakPolarHBondContact O-CD 3.2Å
315	N	38.7	Very low	46.2	Very low	127 Å²	127	126.6 Å²	126.6	68%	0.679	70%	0.695	S	S	*	*			trans	93.5	80.7	155	-104.7	-10.1	0	0	0	119.9	D313 S317	D313-N315 PolarHBondContact O-N 3.19Å; N315-S317 VanDerWaalsContact CG-OG 3.3Å; N315-S317 PolarHBondContact ND2-OG 3.44Å; N315-S317 PolarHBondContact O-N 2.93Å; N315-S317 PolarHBondContact OD1-OG 2.98Å
316	K	31.7	Very low	43.7	Very low	197 Å²	197	126.6 Å²	126.6	86%	0.857	71%	0.705	S	S	*	*				-72.8	77.7	128.1	-165.8	179.3	-174.9	179.5	0	110.1
317	S	32.2	Very low	41.2	Very low	82 Å²	82	131 Å²	131	57%	0.573	73%	0.728	S	S	*	*			trans	-146.8	88.5	152.7	69.4	0	0	0	0	111.1	N315	N315-S317 VanDerWaalsContact CG-OG 3.3Å; N315-S317 PolarHBondContact ND2-OG 3.44Å; N315-S317 PolarHBondContact O-N 2.93Å; N315-S317 PolarHBondContact OD1-OG 2.98Å
318	T	29.4	Very low	39	Very low	132 Å²	132	127.5 Å²	127.5	81%	0.81	74%	0.736	S	S	*	*			trans	-94.4	109.5	160	35.5	0	0	0	0	108.5
319	N	30.8	Very low	36.8	Very low	158 Å²	158	126.8 Å²	126.8	85%	0.845	75%	0.747	S	S	*	*			trans	-175.2	89.7	142.3	-93.4	-17.5	0	0	0	107.6
320	S	28.1	Very low	34.6	Very low	112 Å²	112	122.4 Å²	122.4	78%	0.783	75%	0.748	S	S	*	*				71.6	88.7	94.2	-166.1	0	0	0	0	112.7
321	A	32.5	Very low	32.6	Very low	105 Å²	105	120.2 Å²	120.2	87%	0.868	76%	0.756	S	S	*	*			trans	-132.4	105.6	161.6	0	0	0	0	0	109
322	K	28.3	Very low	31.1	Very low	188 Å²	188	117.4 Å²	117.4	82%	0.817	76%	0.763	S	S	*	*			trans	-65.1	139.9	172.1	-88.3	167.3	170.5	167.4	0	110.6
323	T	32	Very low	30.2	Very low	125 Å²	125	121.1 Å²	121.1	77%	0.767	78%	0.777	S	S	*	*			trans	-28.4	142.5	152.6	29.8	0	0	0	0	115.9
324	P	32.5	Very low	29.8	Very low	129 Å²	129	118.9 Å²	118.9	84%	0.838	77%	0.768	S	S	*	*			trans	-131.9	118.3	131	31	-15.6	0	0	0	111.9
325	T	25.5	Very low	29.8	Very low	116 Å²	116	120 Å²	120	71%	0.712	78%	0.778	S	S	*	*			trans	-81.5	169.7	160.3	-11.4	0	0	0	0	109.7
326	T	26.3	Very low	30.4	Very low	120 Å²	120	115.4 Å²	115.4	74%	0.736	76%	0.755	S	S	*	*			trans	93.7	99.7	165	68.3	0	0	0	0	115.6
327	T	24.9	Very low	31.4	Very low	137 Å²	137	112.1 Å²	112.1	84%	0.84	75%	0.747	S	S	*	*				70.4	127.4	74	61	0	0	0	0	114.8
328	G	24.5	Very low	32.3	Very low	72 Å²	72	113 Å²	113	74%	0.742	75%	0.753	S	S	*	*			trans	119.5	92.6	155.3	0	0	0	0	0	111.6
329	S	26.2	Very low	33.7	Very low	125 Å²	125	113.4 Å²	113.4	87%	0.874	75%	0.746	S	S	*	*				61.2	109	77.9	176.8	0	0	0	0	113.4
330	G	26.1	Very low	34.9	Very low	79 Å²	79	108.7 Å²	108.7	81%	0.814	72%	0.72	S	S	*	*			trans	92.1	128.4	137.4	0	0	0	0	0	115.1
331	G	25.2	Very low	36.6	Very low	77 Å²	77	108.3 Å²	108.3	79%	0.794	71%	0.709	S	S	*	*			trans	157.2	74.9	166.1	0	0	0	0	0	112.2
332	A	29.2	Very low	38.4	Very low	88 Å²	88	110 Å²	110	73%	0.727	70%	0.698	S	S	*	*			trans	-46.7	147.9	151.5	0	0	0	0	0	109.6
333	T	28.1	Very low	40.4	Very low	124 Å²	124	106.5 Å²	106.5	76%	0.761	69%	0.685	S	S	*	*				164.3	168.3	126.9	42.1	0	0	0	0	110.9	V336	T333-V336 WeakPolarHBondContact O-CG2 3.44Å
334	T	30.5	Very low	42.4	Very low	88 Å²	88	104.5 Å²	104.5	54%	0.54	67%	0.669	S	S	.	*			trans	76.3	132	-152.9	44.8	0	0	0	0	106.4	V336	T334-V336 VanDerWaalsContact CB-CA 3.43Å; T334-V336 VanDerWaalsContact CB-CB 3.43Å; T334-V336 VanDerWaalsContact CB-CG2 3.44Å; T334-V336 WeakPolarHBondContact O-CG2 3.44Å; T334-V336 PolarHBondContact O-N 3.28Å; T334-V336 WeakPolarHBondContact OG1-CB 3.18Å; T334-V336 WeakPolarHBondContact OG1-CG1 3.43Å; T334-V336 WeakPolarHBondContact OG1-CG2 3.5Å
335	S	42.6	Very low	44.5	Very low	138 Å²	138	103.4 Å²	103.4	97%	0.965	65%	0.653	S	S	*	*			cis	39.2	14.7	40.2	-161.8	0	0	0	0	111.5
336	V	51.4	Low	47	Very low	31 Å²	31	103.9 Å²	103.9	19%	0.188	65%	0.645	C	S	.	*			trans	-90.4	112.7	-178.9	-127.6	0	0	0	0	102.5	T333 T334 L340	T333-V336 WeakPolarHBondContact O-CG2 3.44Å; T334-V336 VanDerWaalsContact CB-CA 3.43Å; T334-V336 VanDerWaalsContact CB-CB 3.43Å; T334-V336 VanDerWaalsContact CB-CG2 3.44Å; T334-V336 WeakPolarHBondContact O-CG2 3.44Å; T334-V336 PolarHBondContact O-N 3.28Å; T334-V336 WeakPolarHBondContact OG1-CB 3.18Å; T334-V336 WeakPolarHBondContact OG1-CG1 3.43Å; T334-V336 WeakPolarHBondContact OG1-CG2 3.5Å; V336-L340 HydrophobicContact CB-CB 3.62Å; V336-L340 HydrophobicContact CB-CD1 4.12Å; V336-L340 HydrophobicContact CB-CD2 3.91Å; V336-L340 HydrophobicContact CB-CG 4.02Å; V336-L340 HydrophobicContact CG1-CB 3.47Å; V336-L340 VanDerWaalsContact CG1-CB 3.47Å; V336-L340 HydrophobicContact CG1-CD1 3.69Å; V336-L340 HydrophobicContact CG1-CD2 4.38Å; V336-L340 HydrophobicContact CG1-CG 3.95Å; V336-L340 HydrophobicContact CG2-CD1 4.28Å; V336-L340 HydrophobicContact CG2-CD2 3.99Å; V336-L340 HydrophobicContact CG2-CG 4.45Å
337	N	53.6	Low	49.6	Very low	128 Å²	128	102.7 Å²	102.7	68%	0.684	63%	0.631	S	S	*	*	S	Bend	trans	-151.8	-10.9	163.6	-120.2	-0.9	0	0	0	112.4
338	S	51.5	Low	52.2	Low	100 Å²	100	100 Å²	100	70%	0.699	61%	0.612	S	S	*	*	S	Bend	trans	-108.2	-48.4	170	-159	0	0	0	0	112	L340 L341 E342	S338-L340 VanDerWaalsContact C-N 3.32Å; S338-L341 PolarHBondContact O-N 3.32Å; S338-L341 VanDerWaalsContact O-N 3.15Å; S338-E342 PolarHBondContact O-N 3.06Å
339	Q	58.8	Low	55	Low	142 Å²	142	101.5 Å²	101.5	66%	0.664	60%	0.599	S	S	*	*	H	α-helix	trans	-67.8	-32.6	171.3	-78.8	177.6	-25	0	0	112	L341 E342 E343	Q339-L341 PolarHBondContact O-N 2.89Å; Q339-E342 PolarHBondContact O-N 2.86Å; Q339-E343 WeakPolarHBondContact O-CB 3.4Å; Q339-E343 WeakPolarHBondContact O-CG 3.39Å; Q339-E343 PolarHBondContact O-N 2.94Å
340	L	55.7	Low	57.6	Low	59 Å²	59	100.6 Å²	100.6	31%	0.309	58%	0.581	S	S	.	*	H	α-helix	trans	-61.6	-34.5	170.7	-152.5	50.2	0	0	0	112.2	V336 S338 L344	V336-L340 HydrophobicContact CB-CB 3.62Å; V336-L340 HydrophobicContact CB-CD1 4.12Å; V336-L340 HydrophobicContact CB-CD2 3.91Å; V336-L340 HydrophobicContact CB-CG 4.02Å; V336-L340 HydrophobicContact CG1-CB 3.47Å; V336-L340 VanDerWaalsContact CG1-CB 3.47Å; V336-L340 HydrophobicContact CG1-CD1 3.69Å; V336-L340 HydrophobicContact CG1-CD2 4.38Å; V336-L340 HydrophobicContact CG1-CG 3.95Å; V336-L340 HydrophobicContact CG2-CD1 4.28Å; V336-L340 HydrophobicContact CG2-CD2 3.99Å; V336-L340 HydrophobicContact CG2-CG 4.45Å; S338-L340 VanDerWaalsContact C-N 3.32Å; L340-L344 HydrophobicContact CD1-CD1 4.02Å; L340-L344 HydrophobicContact CD2-CD1 4.27Å; L340-L344 HydrophobicContact CG-CD1 3.67Å; L340-L344 WeakPolarHBondContact O-CA 3.47Å; L340-L344 WeakPolarHBondContact O-CB 3.41Å; L340-L344 WeakPolarHBondContact O-CD1 3.43Å; L340-L344 PolarHBondContact O-N 3.37Å
341	L	64	Low	60.3	Low	104 Å²	104	104 Å²	104	55%	0.545	57%	0.571	S	S	.	*	H	α-helix	trans	-75.7	-38.6	-173.8	-141.4	106.5	0	0	0	109.6	S338 Q339 Q345	S338-L341 PolarHBondContact O-N 3.32Å; S338-L341 VanDerWaalsContact O-N 3.15Å; Q339-L341 PolarHBondContact O-N 2.89Å; L341-Q345 VanDerWaalsContact O-CB 3.32Å; L341-Q345 WeakPolarHBondContact O-CB 3.27Å; L341-Q345 PolarHBondContact O-N 3.2Å
342	E	69.7	Low	63.2	Low	139 Å²	139	107.9 Å²	107.9	65%	0.65	56%	0.561	S	S	*	*	H	α-helix	trans	-67.5	-42.9	171	-105.9	176.5	169.9	0	0	111.9	S338 Q339 Q345 K346	S338-E342 PolarHBondContact O-N 3.06Å; Q339-E342 PolarHBondContact O-N 2.86Å; E342-Q345 PolarHBondContact O-N 2.91Å; E342-K346 WeakPolarHBondContact O-CB 3.32Å; E342-K346 PolarHBondContact O-N 3.42Å
343	E	69.3	Low	65.9	Low	116 Å²	116	109.9 Å²	109.9	54%	0.542	56%	0.555	S	S	.	*	H	α-helix	trans	-64.9	-42.3	172.9	-77.2	178.6	168.1	0	0	111.5	Q339 Q345 K346 E347	Q339-E343 WeakPolarHBondContact O-CB 3.4Å; Q339-E343 WeakPolarHBondContact O-CG 3.39Å; Q339-E343 PolarHBondContact O-N 2.94Å; E343-Q345 VanDerWaalsContact C-N 3.33Å; E343-Q345 PolarHBondContact O-N 2.89Å; E343-K346 PolarHBondContact O-N 3.43Å; E343-E347 WeakPolarHBondContact O-CB 3.33Å; E343-E347 WeakPolarHBondContact O-CG 3.47Å; E343-E347 PolarHBondContact O-N 3.1Å
344	L	75.4	Confident	68.7	Low	83 Å²	83	109 Å²	109	44%	0.435	55%	0.545	S	S	.	.	H	α-helix	trans	-65.6	-35.4	174.1	-110.9	100.2	0	0	0	111.7	L340 L348	L340-L344 HydrophobicContact CD1-CD1 4.02Å; L340-L344 HydrophobicContact CD2-CD1 4.27Å; L340-L344 HydrophobicContact CG-CD1 3.67Å; L340-L344 WeakPolarHBondContact O-CA 3.47Å; L340-L344 WeakPolarHBondContact O-CB 3.41Å; L340-L344 WeakPolarHBondContact O-CD1 3.43Å; L340-L344 PolarHBondContact O-N 3.37Å; L344-L348 WeakPolarHBondContact O-CB 3.36Å; L344-L348 PolarHBondContact O-N 3.38Å
345	Q	75.3	Confident	71.4	Confident	106 Å²	106	107.6 Å²	107.6	50%	0.495	54%	0.543	S	S	.	.	H	α-helix	trans	-66.1	-44.2	175	-101.7	178.6	-63.3	0	0	110.6	L341 E342 E343 L348 E349	L341-Q345 VanDerWaalsContact O-CB 3.32Å; L341-Q345 WeakPolarHBondContact O-CB 3.27Å; L341-Q345 PolarHBondContact O-N 3.2Å; E342-Q345 PolarHBondContact O-N 2.91Å; E343-Q345 VanDerWaalsContact C-N 3.33Å; E343-Q345 PolarHBondContact O-N 2.89Å; Q345-L348 WeakPolarHBondContact O-CB 3.25Å; Q345-L348 PolarHBondContact O-N 3.4Å; Q345-E349 WeakPolarHBondContact O-CB 3.29Å; Q345-E349 WeakPolarHBondContact O-CG 3.41Å; Q345-E349 PolarHBondContact O-N 3.12Å
346	K	79.4	Confident	73.7	Confident	126 Å²	126	105.6 Å²	105.6	55%	0.548	52%	0.521	S	S	.	.	H	α-helix	trans	-65	-43.7	175.8	-168.9	-177.4	175.3	-167.6	0	111.5	E342 E343 L348 E349 E350	E342-K346 WeakPolarHBondContact O-CB 3.32Å; E342-K346 PolarHBondContact O-N 3.42Å; E343-K346 PolarHBondContact O-N 3.43Å; K346-L348 VanDerWaalsContact C-N 3.34Å; K346-L348 PolarHBondContact O-N 2.84Å; K346-E349 CarbonylContact O-C 3.39Å; K346-E349 PolarHBondContact O-N 3.3Å; K346-E350 WeakPolarHBondContact CE-OE1 3.42Å; K346-E350 WeakPolarHBondContact O-CB 3.38Å; K346-E350 WeakPolarHBondContact O-CG 3.37Å; K346-E350 PolarHBondContact O-N 3.02Å
347	E	81	Confident	75.5	Confident	94 Å²	94	108 Å²	108	44%	0.439	53%	0.533	S	S	.	.	H	α-helix	trans	-61.6	-41.7	172.7	-77	-177.4	176	0	0	110.8	E343 E349 E350 Y351	E343-E347 WeakPolarHBondContact O-CB 3.33Å; E343-E347 WeakPolarHBondContact O-CG 3.47Å; E343-E347 PolarHBondContact O-N 3.1Å; E347-E349 VanDerWaalsContact C-N 3.31Å; E347-E349 PolarHBondContact O-N 2.95Å; E347-E350 PolarHBondContact O-N 3.49Å; E347-Y351 HydrophobicContact CB-CD2 4.3Å; E347-Y351 HydrophobicContact CB-CE2 4.22Å; E347-Y351 WeakPolarHBondContact O-CB 3.49Å; E347-Y351 WeakPolarHBondContact O-CD2 3.29Å; E347-Y351 PolarHBondContact O-N 3.13Å
348	L	79.3	Confident	77.2	Confident	82 Å²	82	109.4 Å²	109.4	43%	0.429	53%	0.529	S	S	.	.	H	α-helix	trans	-62.6	-37.9	174.6	-105.5	157.7	0	0	0	112.1	L344 Q345 K346 R352	L344-L348 WeakPolarHBondContact O-CB 3.36Å; L344-L348 PolarHBondContact O-N 3.38Å; Q345-L348 WeakPolarHBondContact O-CB 3.25Å; Q345-L348 PolarHBondContact O-N 3.4Å; K346-L348 VanDerWaalsContact C-N 3.34Å; K346-L348 PolarHBondContact O-N 2.84Å; L348-R352 VanDerWaalsContact O-CB 3.32Å; L348-R352 WeakPolarHBondContact O-CB 3.43Å; L348-R352 WeakPolarHBondContact O-CG 3.47Å; L348-R352 PolarHBondContact O-N 3.47Å
349	E	82.5	Confident	79.1	Confident	103 Å²	103	109.1 Å²	109.1	48%	0.481	52%	0.519	S	S	.	.	H	α-helix	trans	-69.1	-43.5	175	-79.8	160.4	-176.4	0	0	111.1	Q345 K346 E347 Y351 R352 E353	Q345-E349 WeakPolarHBondContact O-CB 3.29Å; Q345-E349 WeakPolarHBondContact O-CG 3.41Å; Q345-E349 PolarHBondContact O-N 3.12Å; K346-E349 CarbonylContact O-C 3.39Å; K346-E349 PolarHBondContact O-N 3.3Å; E347-E349 VanDerWaalsContact C-N 3.31Å; E347-E349 PolarHBondContact O-N 2.95Å; E349-Y351 PolarHBondContact O-N 3.35Å; E349-R352 PolarHBondContact O-N 3Å; E349-E353 WeakPolarHBondContact O-CB 3.47Å; E349-E353 WeakPolarHBondContact O-CG 3.32Å; E349-E353 PolarHBondContact O-N 3.41Å
350	E	81.8	Confident	80.7	Confident	105 Å²	105	107.6 Å²	107.6	49%	0.491	51%	0.512	S	S	.	.	H	α-helix	trans	-61.7	-41.4	172.5	-72.8	177.8	-168.3	0	0	111.5	K346 E347 E353 L354	K346-E350 WeakPolarHBondContact CE-OE1 3.42Å; K346-E350 WeakPolarHBondContact O-CB 3.38Å; K346-E350 WeakPolarHBondContact O-CG 3.37Å; K346-E350 PolarHBondContact O-N 3.02Å; E347-E350 PolarHBondContact O-N 3.49Å; E350-E353 PolarHBondContact O-N 2.89Å; E350-L354 WeakPolarHBondContact O-CB 3.31Å; E350-L354 PolarHBondContact O-N 3.2Å
351	Y	82.7	Confident	82.2	Confident	152 Å²	152	109.5 Å²	109.5	60%	0.596	52%	0.519	S	S	*	.	H	α-helix	trans	-68	-35.9	174.9	-78.2	-57.6	0	0	0	112.1	E347 E349 A355	E347-Y351 HydrophobicContact CB-CD2 4.3Å; E347-Y351 HydrophobicContact CB-CE2 4.22Å; E347-Y351 WeakPolarHBondContact O-CB 3.49Å; E347-Y351 WeakPolarHBondContact O-CD2 3.29Å; E347-Y351 PolarHBondContact O-N 3.13Å; E349-Y351 PolarHBondContact O-N 3.35Å; Y351-A355 WeakPolarHBondContact O-CB 3.42Å; Y351-A355 PolarHBondContact O-N 2.93Å
352	R	85.7	Confident	83.3	Confident	158 Å²	158	108.4 Å²	108.4	60%	0.596	51%	0.514	S	S	*	.	H	α-helix	trans	-69.2	-42.1	173.9	-79.8	173.2	-176.4	167.6	3.3	111.7	L348 E349 A355 N356	L348-R352 VanDerWaalsContact O-CB 3.32Å; L348-R352 WeakPolarHBondContact O-CB 3.43Å; L348-R352 WeakPolarHBondContact O-CG 3.47Å; L348-R352 PolarHBondContact O-N 3.47Å; E349-R352 PolarHBondContact O-N 3Å; R352-A355 PolarHBondContact O-N 3.33Å; R352-N356 WeakPolarHBondContact O-CB 3.36Å; R352-N356 PolarHBondContact O-N 3.38Å
353	E	85.3	Confident	84.4	Confident	129 Å²	129	106.3 Å²	106.3	60%	0.603	51%	0.507	S	S	*	.	H	α-helix	trans	-64.4	-44.5	174	-78	-169.6	169.7	0	0	111	E349 E350 A355 N356 N357	E349-E353 WeakPolarHBondContact O-CB 3.47Å; E349-E353 WeakPolarHBondContact O-CG 3.32Å; E349-E353 PolarHBondContact O-N 3.41Å; E350-E353 PolarHBondContact O-N 2.89Å; E353-A355 VanDerWaalsContact C-N 3.35Å; E353-A355 PolarHBondContact O-N 3.47Å; E353-N356 PolarHBondContact O-N 3.22Å; E353-N357 WeakPolarHBondContact O-CB 3.34Å; E353-N357 VanDerWaalsContact O-CG 3.25Å; E353-N357 PolarHBondContact O-N 2.87Å; E353-N357 PolarHBondContact O-ND2 3.5Å
354	L	87.7	Confident	85.5	Confident	106 Å²	106	107.7 Å²	107.7	56%	0.555	51%	0.511	S	S	*	.	H	α-helix	trans	-62.3	-42.4	175.7	-175.4	64.4	0	0	0	111.5	E350 N357 R358	E350-L354 WeakPolarHBondContact O-CB 3.31Å; E350-L354 PolarHBondContact O-N 3.2Å; L354-N357 PolarHBondContact O-N 3.22Å; L354-R358 VanDerWaalsContact O-CB 3.31Å; L354-R358 WeakPolarHBondContact O-CB 3.46Å; L354-R358 PolarHBondContact O-N 3.41Å
355	A	87.4	Confident	86.3	Confident	59 Å²	59	109.1 Å²	109.1	49%	0.488	52%	0.518	S	S	.	.	H	α-helix	trans	-63.4	-42.1	175.2	0	0	0	0	0	111.8	Y351 R352 E353 R358 L359	Y351-A355 WeakPolarHBondContact O-CB 3.42Å; Y351-A355 PolarHBondContact O-N 2.93Å; R352-A355 PolarHBondContact O-N 3.33Å; E353-A355 VanDerWaalsContact C-N 3.35Å; E353-A355 PolarHBondContact O-N 3.47Å; A355-R358 PolarHBondContact O-N 3.37Å; A355-L359 WeakPolarHBondContact O-CB 3.34Å; A355-L359 PolarHBondContact O-N 3.49Å
356	N	89.3	Confident	86.9	Confident	96 Å²	96	109.2 Å²	109.2	51%	0.513	52%	0.519	S	S	.	.	H	α-helix	trans	-65.5	-42	174.7	-89.1	-23.2	0	0	0	112.4	R352 E353 R358 L359 Q360	R352-N356 WeakPolarHBondContact O-CB 3.36Å; R352-N356 PolarHBondContact O-N 3.38Å; E353-N356 PolarHBondContact O-N 3.22Å; N356-R358 VanDerWaalsContact C-N 3.32Å; N356-R358 PolarHBondContact O-N 2.84Å; N356-L359 PolarHBondContact O-N 3.46Å; N356-Q360 WeakPolarHBondContact O-CG 3.43Å; N356-Q360 PolarHBondContact O-N 2.86Å
357	N	90	Very high	87.6	Confident	81 Å²	81	105.5 Å²	105.5	43%	0.433	51%	0.511	S	S	.	.	H	α-helix	trans	-61.9	-43.4	174.4	-74.9	-31.2	0	0	0	110.5	E353 L354 L359 Q360 E361	E353-N357 WeakPolarHBondContact O-CB 3.34Å; E353-N357 VanDerWaalsContact O-CG 3.25Å; E353-N357 PolarHBondContact O-N 2.87Å; E353-N357 PolarHBondContact O-ND2 3.5Å; L354-N357 PolarHBondContact O-N 3.22Å; N357-L359 VanDerWaalsContact C-N 3.33Å; N357-L359 PolarHBondContact O-N 2.83Å; N357-Q360 PolarHBondContact O-N 3.45Å; N357-E361 WeakPolarHBondContact O-CB 3.48Å; N357-E361 WeakPolarHBondContact O-CG 3.46Å; N357-E361 PolarHBondContact O-N 2.94Å
358	R	89.6	Confident	88.1	Confident	157 Å²	157	104.9 Å²	104.9	59%	0.592	51%	0.514	S	S	*	.	H	α-helix	trans	-66.1	-36.9	177.9	-160.8	63.5	174.3	168.1	-1.5	112.1	L354 A355 N356 E361 L362	L354-R358 VanDerWaalsContact O-CB 3.31Å; L354-R358 WeakPolarHBondContact O-CB 3.46Å; L354-R358 PolarHBondContact O-N 3.41Å; A355-R358 PolarHBondContact O-N 3.37Å; N356-R358 VanDerWaalsContact C-N 3.32Å; N356-R358 PolarHBondContact O-N 2.84Å; R358-E361 WeakPolarHBondContact CD-OE2 3.44Å; R358-E361 IonicContact CZ-OE2 2.86Å; R358-E361 IonicContact NE-OE2 2.99Å; R358-E361 IonicContact NH1-OE2 2.74Å; R358-E361 PolarHBondContact NH1-OE2 3.15Å; R358-E361 PolarHBondContact O-N 2.92Å; R358-L362 WeakPolarHBondContact O-CB 3.29Å; R358-L362 VanDerWaalsContact O-CG 3.31Å; R358-L362 WeakPolarHBondContact O-CG 3.37Å; R358-L362 PolarHBondContact O-N 2.85Å
359	L	91.2	Very high	88.7	Confident	95 Å²	95	106.3 Å²	106.3	50%	0.497	52%	0.518	S	S	.	.	H	α-helix	trans	-65.2	-45.6	173.6	-171.7	67.2	0	0	0	111.2	A355 N356 N357 E361 L362 D363	A355-L359 WeakPolarHBondContact O-CB 3.34Å; A355-L359 PolarHBondContact O-N 3.49Å; N356-L359 PolarHBondContact O-N 3.46Å; N357-L359 VanDerWaalsContact C-N 3.33Å; N357-L359 PolarHBondContact O-N 2.83Å; L359-E361 VanDerWaalsContact C-N 3.34Å; L359-E361 PolarHBondContact O-N 3.23Å; L359-L362 PolarHBondContact O-N 2.8Å; L359-D363 PolarHBondContact O-N 2.99Å
360	Q	91.5	Very high	89.2	Confident	109 Å²	109	109 Å²	109	51%	0.509	52%	0.524	S	S	.	.	H	α-helix	trans	-63.1	-38.1	175.2	-73.4	-179.6	18.5	0	0	112.8	N356 N357 D363 K364	N356-Q360 WeakPolarHBondContact O-CG 3.43Å; N356-Q360 PolarHBondContact O-N 2.86Å; N357-Q360 PolarHBondContact O-N 3.45Å; Q360-D363 PolarHBondContact O-N 3.07Å; Q360-K364 WeakPolarHBondContact O-CB 3.37Å; Q360-K364 WeakPolarHBondContact O-CG 3.44Å; Q360-K364 PolarHBondContact O-N 2.87Å
361	E	88.7	Confident	89.8	Confident	100 Å²	100	109.3 Å²	109.3	47%	0.467	53%	0.525	S	S	.	.	H	α-helix	trans	-62	-44.6	172.8	-78.1	177.7	179.4	0	0	111.2	N357 R358 L359 K364 L365	N357-E361 WeakPolarHBondContact O-CB 3.48Å; N357-E361 WeakPolarHBondContact O-CG 3.46Å; N357-E361 PolarHBondContact O-N 2.94Å; R358-E361 WeakPolarHBondContact CD-OE2 3.44Å; R358-E361 IonicContact CZ-OE2 2.86Å; R358-E361 IonicContact NE-OE2 2.99Å; R358-E361 IonicContact NH1-OE2 2.74Å; R358-E361 PolarHBondContact NH1-OE2 3.15Å; R358-E361 PolarHBondContact O-N 2.92Å; L359-E361 VanDerWaalsContact C-N 3.34Å; L359-E361 PolarHBondContact O-N 3.23Å; E361-K364 PolarHBondContact O-N 2.83Å; E361-L365 WeakPolarHBondContact O-CB 3.34Å; E361-L365 PolarHBondContact O-N 3.32Å
362	L	87.5	Confident	90.3	Very high	81 Å²	81	105.2 Å²	105.2	42%	0.424	52%	0.516	S	S	.	.	H	α-helix	trans	-64	-40.8	176.2	-75.1	169	0	0	0	111.9	R358 L359 L365 H366	R358-L362 WeakPolarHBondContact O-CB 3.29Å; R358-L362 VanDerWaalsContact O-CG 3.31Å; R358-L362 WeakPolarHBondContact O-CG 3.37Å; R358-L362 PolarHBondContact O-N 2.85Å; L359-L362 PolarHBondContact O-N 2.8Å; L362-L365 PolarHBondContact O-N 3.47Å; L362-H366 WeakPolarHBondContact O-CB 3.43Å; L362-H366 PolarHBondContact O-N 2.85Å
363	D	92.3	Very high	90.5	Very high	94 Å²	94	101.7 Å²	101.7	50%	0.503	51%	0.509	S	S	.	.	H	α-helix	trans	-66	-41.9	176.5	-76.9	-27.2	0	0	0	112.2	L359 Q360 L365 H366 A367	L359-D363 PolarHBondContact O-N 2.99Å; Q360-D363 PolarHBondContact O-N 3.07Å; D363-L365 VanDerWaalsContact C-N 3.35Å; D363-H366 PolarHBondContact O-N 3.02Å; D363-A367 WeakPolarHBondContact O-CB 3.42Å; D363-A367 PolarHBondContact O-N 3.3Å
364	K	92.6	Very high	90.9	Very high	145 Å²	145	101.7 Å²	101.7	63%	0.63	51%	0.507	S	S	*	.	H	α-helix	trans	-61.4	-44.7	171.9	-78.4	177.7	-177.6	173.5	0	110.9	Q360 E361 H366 A367 T368	Q360-K364 WeakPolarHBondContact O-CB 3.37Å; Q360-K364 WeakPolarHBondContact O-CG 3.44Å; Q360-K364 PolarHBondContact O-N 2.87Å; E361-K364 PolarHBondContact O-N 2.83Å; K364-H366 VanDerWaalsContact C-N 3.34Å; K364-H366 PolarHBondContact O-N 3.34Å; K364-A367 WeakPolarHBondContact O-CB 3.37Å; K364-A367 PolarHBondContact O-N 2.89Å; K364-T368 WeakPolarHBondContact O-CG2 3.49Å; K364-T368 PolarHBondContact O-N 2.78Å; K364-T368 PolarHBondContact O-OG1 2.92Å
365	L	91.5	Very high	91.2	Very high	113 Å²	113	102.2 Å²	102.2	59%	0.592	51%	0.507	S	S	*	.	H	α-helix	trans	-62.3	-43.6	178.1	-158.6	78	0	0	0	110.8	E361 L362 D363 A367 T368 H369	E361-L365 WeakPolarHBondContact O-CB 3.34Å; E361-L365 PolarHBondContact O-N 3.32Å; L362-L365 PolarHBondContact O-N 3.47Å; D363-L365 VanDerWaalsContact C-N 3.35Å; L365-A367 VanDerWaalsContact C-N 3.34Å; L365-A367 PolarHBondContact O-N 3.11Å; L365-T368 WeakPolarHBondContact CA-OG1 3.4Å; L365-T368 PolarHBondContact O-N 3.45Å; L365-T368 PolarHBondContact O-OG1 2.83Å; L365-H369 WeakPolarHBondContact O-CB 3.3Å; L365-H369 PolarHBondContact O-N 3.35Å
366	H	88.7	Confident	91.3	Very high	109 Å²	109	102.6 Å²	102.6	51%	0.505	50%	0.503	S	S	.	.	H	α-helix	trans	-63.4	-36	174.1	-81.3	-167.9	0	0	0	113.2	L362 D363 K364 R370	L362-H366 WeakPolarHBondContact O-CB 3.43Å; L362-H366 PolarHBondContact O-N 2.85Å; D363-H366 PolarHBondContact O-N 3.02Å; K364-H366 VanDerWaalsContact C-N 3.34Å; K364-H366 PolarHBondContact O-N 3.34Å; H366-R370 PolarHBondContact O-N 2.83Å; H366-R370 VanDerWaalsContact O-N 3.1Å
367	A	93.3	Very high	91.4	Very high	47 Å²	47	104.6 Å²	104.6	39%	0.388	51%	0.509	S	S	.	.	H	α-helix	trans	-65.7	-48.8	173.3	0	0	0	0	0	111	D363 K364 L365 H369 R370 E371	D363-A367 WeakPolarHBondContact O-CB 3.42Å; D363-A367 PolarHBondContact O-N 3.3Å; K364-A367 WeakPolarHBondContact O-CB 3.37Å; K364-A367 PolarHBondContact O-N 2.89Å; L365-A367 VanDerWaalsContact C-N 3.34Å; L365-A367 PolarHBondContact O-N 3.11Å; A367-H369 VanDerWaalsContact C-N 3.31Å; A367-H369 PolarHBondContact O-N 2.77Å; A367-R370 PolarHBondContact O-N 2.8Å; A367-E371 PolarHBondContact O-N 3.4Å
368	T	92.6	Very high	91.3	Very high	82 Å²	82	107.3 Å²	107.3	50%	0.503	52%	0.517	S	S	.	.	H	α-helix	trans	-60.6	-40.5	176.5	57.7	0	0	0	0	112	K364 L365 R370 E371 T372	K364-T368 WeakPolarHBondContact O-CG2 3.49Å; K364-T368 PolarHBondContact O-N 2.78Å; K364-T368 PolarHBondContact O-OG1 2.92Å; L365-T368 WeakPolarHBondContact CA-OG1 3.4Å; L365-T368 PolarHBondContact O-N 3.45Å; L365-T368 PolarHBondContact O-OG1 2.83Å; T368-R370 PolarHBondContact O-N 2.81Å; T368-E371 PolarHBondContact O-N 3.39Å; T368-T372 WeakPolarHBondContact O-CG2 3.43Å; T368-T372 PolarHBondContact O-N 3.49Å; T368-T372 PolarHBondContact O-OG1 3.05Å
369	H	91.2	Very high	91.2	Very high	111 Å²	111	104.7 Å²	104.7	51%	0.514	51%	0.514	S	S	.	.	H	α-helix	trans	-62.8	-43.2	177.6	-171.9	58	0	0	0	111.7	L365 A367 E371 T372 L373	L365-H369 WeakPolarHBondContact O-CB 3.3Å; L365-H369 PolarHBondContact O-N 3.35Å; A367-H369 VanDerWaalsContact C-N 3.31Å; A367-H369 PolarHBondContact O-N 2.77Å; H369-E371 PolarHBondContact O-N 3.22Å; H369-T372 WeakPolarHBondContact CA-OG1 3.49Å; H369-T372 PolarHBondContact O-N 3.37Å; H369-T372 PolarHBondContact O-OG1 2.84Å; H369-L373 WeakPolarHBondContact O-CG 3.23Å; H369-L373 PolarHBondContact O-N 3.5Å
370	R	92.9	Very high	91	Very high	160 Å²	160	106.4 Å²	106.4	60%	0.604	52%	0.517	S	S	*	.	H	α-helix	trans	-63.2	-40.1	174.5	-81.2	-174.7	-76.1	-167.1	-3.5	112.9	H366 A367 T368 L373 K374	H366-R370 PolarHBondContact O-N 2.83Å; H366-R370 VanDerWaalsContact O-N 3.1Å; A367-R370 PolarHBondContact O-N 2.8Å; T368-R370 PolarHBondContact O-N 2.81Å; R370-L373 PolarHBondContact O-N 2.77Å; R370-K374 WeakPolarHBondContact O-CG 3.17Å; R370-K374 PolarHBondContact O-N 2.94Å; R370-K374 VanDerWaalsContact O-N 3.11Å
371	E	94.6	Very high	90.6	Very high	111 Å²	111	106.9 Å²	106.9	52%	0.519	52%	0.521	S	S	.	.	H	α-helix	trans	-62.5	-47.2	176.2	-149.9	73.5	-167.3	0	0	110.7	A367 T368 H369 L373 K374 E375	A367-E371 PolarHBondContact O-N 3.4Å; T368-E371 PolarHBondContact O-N 3.39Å; H369-E371 PolarHBondContact O-N 3.22Å; E371-L373 VanDerWaalsContact C-N 3.3Å; E371-L373 PolarHBondContact O-N 3.5Å; E371-K374 WeakPolarHBondContact O-CB 3.22Å; E371-K374 PolarHBondContact O-N 2.92Å; E371-K374 VanDerWaalsContact O-N 3.14Å; E371-E375 PolarHBondContact O-N 3Å
372	T	91.8	Very high	90.3	Very high	66 Å²	66	105.6 Å²	105.6	41%	0.405	52%	0.517	S	S	.	.	H	α-helix	trans	-62.2	-35.8	177.4	57.5	0	0	0	0	112.6	T368 H369 E375 V376	T368-T372 WeakPolarHBondContact O-CG2 3.43Å; T368-T372 PolarHBondContact O-N 3.49Å; T368-T372 PolarHBondContact O-OG1 3.05Å; H369-T372 WeakPolarHBondContact CA-OG1 3.49Å; H369-T372 PolarHBondContact O-N 3.37Å; H369-T372 PolarHBondContact O-OG1 2.84Å; T372-E375 PolarHBondContact O-N 2.88Å; T372-V376 WeakPolarHBondContact O-CB 3.45Å; T372-V376 VanDerWaalsContact O-CG2 3.25Å; T372-V376 WeakPolarHBondContact O-CG2 3.36Å; T372-V376 PolarHBondContact O-N 3.4Å
373	L	91.6	Very high	90	Very high	85 Å²	85	107.7 Å²	107.7	45%	0.445	53%	0.528	S	S	.	.	H	α-helix	trans	-65.8	-40.4	175.3	-76.4	172.7	0	0	0	112	H369 R370 E371 V376 E377	H369-L373 WeakPolarHBondContact O-CG 3.23Å; H369-L373 PolarHBondContact O-N 3.5Å; R370-L373 PolarHBondContact O-N 2.77Å; E371-L373 VanDerWaalsContact C-N 3.3Å; E371-L373 PolarHBondContact O-N 3.5Å; L373-V376 PolarHBondContact O-N 2.98Å; L373-E377 PolarHBondContact O-N 2.97Å
374	K	93.6	Very high	89.6	Confident	129 Å²	129	113.6 Å²	113.6	56%	0.561	54%	0.543	S	S	*	.	H	α-helix	trans	-63.4	-42.4	174.5	-69.8	174	-175.9	170.7	0	111.8	R370 E371 V376 E377 K378	R370-K374 WeakPolarHBondContact O-CG 3.17Å; R370-K374 PolarHBondContact O-N 2.94Å; R370-K374 VanDerWaalsContact O-N 3.11Å; E371-K374 WeakPolarHBondContact O-CB 3.22Å; E371-K374 PolarHBondContact O-N 2.92Å; E371-K374 VanDerWaalsContact O-N 3.14Å; K374-V376 VanDerWaalsContact C-N 3.33Å; K374-E377 PolarHBondContact O-N 2.73Å; K374-K378 WeakPolarHBondContact O-CB 3.32Å; K374-K378 PolarHBondContact O-N 3.46Å
375	E	92.7	Very high	89.1	Confident	117 Å²	117	113.7 Å²	113.7	55%	0.547	55%	0.546	S	S	.	.	H	α-helix	trans	-62.1	-41.7	175.3	-73.7	-177.7	165.5	0	0	111.6	E371 T372 K378 L379	E371-E375 PolarHBondContact O-N 3Å; T372-E375 PolarHBondContact O-N 2.88Å; E375-K378 PolarHBondContact O-N 3.25Å; E375-L379 WeakPolarHBondContact O-CB 3.25Å; E375-L379 VanDerWaalsContact O-CG 3.31Å; E375-L379 WeakPolarHBondContact O-CG 3.24Å; E375-L379 PolarHBondContact O-N 3.48Å
376	V	91.1	Very high	88.7	Confident	67 Å²	67	112.4 Å²	112.4	41%	0.406	54%	0.539	S	S	.	.	H	α-helix	trans	-62.9	-41.8	175.4	168.6	0	0	0	0	111.6	T372 L373 K374 K380	T372-V376 WeakPolarHBondContact O-CB 3.45Å; T372-V376 VanDerWaalsContact O-CG2 3.25Å; T372-V376 WeakPolarHBondContact O-CG2 3.36Å; T372-V376 PolarHBondContact O-N 3.4Å; L373-V376 PolarHBondContact O-N 2.98Å; K374-V376 VanDerWaalsContact C-N 3.33Å; V376-K380 HydrophobicContact CG1-CD 4.24Å; V376-K380 WeakPolarHBondContact O-CB 3.36Å; V376-K380 VanDerWaalsContact O-CG 3.28Å; V376-K380 WeakPolarHBondContact O-CG 3.5Å; V376-K380 PolarHBondContact O-N 3.47Å
377	E	90.2	Very high	88.4	Confident	137 Å²	137	110.2 Å²	110.2	64%	0.64	53%	0.534	S	S	*	.	H	α-helix	trans	-65.3	-41.5	175.5	-76.1	-174.3	165.4	0	0	112.3	L373 K374 K380 M381	L373-E377 PolarHBondContact O-N 2.97Å; K374-E377 PolarHBondContact O-N 2.73Å; E377-K380 WeakPolarHBondContact O-CB 3.42Å; E377-K380 PolarHBondContact O-N 2.93Å; E377-M381 PolarHBondContact O-N 3.47Å
378	K	88.7	Confident	88	Confident	138 Å²	138	115.6 Å²	115.6	60%	0.6	55%	0.551	S	S	*	*	H	α-helix	trans	-60.2	-51.1	174.5	-176.3	-174.3	173.8	-171.8	0	111.2	K374 E375 K380 M381 D382	K374-K378 WeakPolarHBondContact O-CB 3.32Å; K374-K378 PolarHBondContact O-N 3.46Å; E375-K378 PolarHBondContact O-N 3.25Å; K378-K380 VanDerWaalsContact C-N 3.27Å; K378-K380 PolarHBondContact O-N 2.9Å; K378-M381 WeakPolarHBondContact O-CA 3.18Å; K378-M381 WeakPolarHBondContact O-CB 3.08Å; K378-M381 PolarHBondContact O-N 2.93Å; K378-D382 PolarHBondContact O-N 3.44Å
379	L	86	Confident	87.8	Confident	103 Å²	103	115.2 Å²	115.2	54%	0.539	55%	0.552	S	S	.	*	H	α-helix	trans	-61.7	-35.3	177.5	-70.7	171.4	0	0	0	111.9	E375 D382 I383	E375-L379 WeakPolarHBondContact O-CB 3.25Å; E375-L379 VanDerWaalsContact O-CG 3.31Å; E375-L379 WeakPolarHBondContact O-CG 3.24Å; E375-L379 PolarHBondContact O-N 3.48Å; L379-D382 PolarHBondContact O-N 3.3Å; L379-I383 WeakPolarHBondContact O-CB 3.46Å; L379-I383 WeakPolarHBondContact O-CD1 3.43Å; L379-I383 WeakPolarHBondContact O-CG1 3.44Å; L379-I383 PolarHBondContact O-N 3Å
380	K	86.8	Confident	87.5	Confident	130 Å²	130	113.2 Å²	113.2	57%	0.565	55%	0.548	S	S	*	.	H	α-helix	trans	-64.2	-38.2	172.3	-80.8	175.9	179	176.9	0	112.5	V376 E377 K378 R384	V376-K380 HydrophobicContact CG1-CD 4.24Å; V376-K380 WeakPolarHBondContact O-CB 3.36Å; V376-K380 VanDerWaalsContact O-CG 3.28Å; V376-K380 WeakPolarHBondContact O-CG 3.5Å; V376-K380 PolarHBondContact O-N 3.47Å; E377-K380 WeakPolarHBondContact O-CB 3.42Å; E377-K380 PolarHBondContact O-N 2.93Å; K378-K380 VanDerWaalsContact C-N 3.27Å; K378-K380 PolarHBondContact O-N 2.9Å; K380-R384 WeakPolarHBondContact O-CB 3.44Å; K380-R384 WeakPolarHBondContact O-CG 3.3Å; K380-R384 PolarHBondContact O-N 3.45Å
381	M	83.6	Confident	87.3	Confident	120 Å²	120	109 Å²	109	59%	0.591	54%	0.536	S	S	*	.	H	α-helix	trans	-67.1	-47.2	173	-100.2	-169.1	72.4	0	0	111.4	E377 K378 I383 R384 Q385	E377-M381 PolarHBondContact O-N 3.47Å; K378-M381 WeakPolarHBondContact O-CA 3.18Å; K378-M381 WeakPolarHBondContact O-CB 3.08Å; K378-M381 PolarHBondContact O-N 2.93Å; M381-I383 VanDerWaalsContact C-N 3.28Å; M381-I383 PolarHBondContact O-N 3.03Å; M381-R384 PolarHBondContact O-N 3.31Å; M381-Q385 PolarHBondContact O-N 2.88Å
382	D	82.9	Confident	87.1	Confident	72 Å²	72	106.6 Å²	106.6	39%	0.385	53%	0.529	S	S	.	.	H	α-helix	trans	-60.3	-38.4	-179.9	-67.2	-15.7	0	0	0	111.3	K378 L379 Q385 L386	K378-D382 PolarHBondContact O-N 3.44Å; L379-D382 PolarHBondContact O-N 3.3Å; D382-Q385 CarbonylContact O-C 3.58Å; D382-L386 WeakPolarHBondContact O-CA 3.45Å; D382-L386 WeakPolarHBondContact O-CD1 3.4Å; D382-L386 PolarHBondContact O-N 3.48Å
383	I	82	Confident	86.9	Confident	125 Å²	125	110 Å²	110	64%	0.641	54%	0.541	S	S	*	.	H	α-helix	trans	-68.9	-35.4	174.3	-70.1	167.5	0	0	0	112.1	L379 M381	L379-I383 WeakPolarHBondContact O-CB 3.46Å; L379-I383 WeakPolarHBondContact O-CD1 3.43Å; L379-I383 WeakPolarHBondContact O-CG1 3.44Å; L379-I383 PolarHBondContact O-N 3Å; M381-I383 VanDerWaalsContact C-N 3.28Å; M381-I383 PolarHBondContact O-N 3.03Å
384	R	83.1	Confident	86.8	Confident	219 Å²	219	108.3 Å²	108.3	83%	0.826	53%	0.534	S	S	*	.	H	α-helix	trans	-75.3	-31	179.8	-79.8	-179.7	177.7	-171.1	-0.1	113.2	K380 M381	K380-R384 WeakPolarHBondContact O-CB 3.44Å; K380-R384 WeakPolarHBondContact O-CG 3.3Å; K380-R384 PolarHBondContact O-N 3.45Å; M381-R384 PolarHBondContact O-N 3.31Å
385	Q	81.8	Confident	86.7	Confident	147 Å²	147	106.8 Å²	106.8	69%	0.687	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.3	67.2	-179.2	-66.3	-176.9	4.1	0	0	109.2	M381 D382 P387	M381-Q385 PolarHBondContact O-N 2.88Å; D382-Q385 CarbonylContact O-C 3.58Å; Q385-P387 WeakPolarHBondContact O-CD 3.21Å; Q385-P387 VanDerWaalsContact O-N 3.16Å
386	L	82.3	Confident	86.6	Confident	85 Å²	85	106.6 Å²	106.6	45%	0.445	53%	0.534	S	S	.	.			trans	-57.7	119.2	178.8	-123.7	87.5	0	0	0	109.5	D382 V390 I391	D382-L386 WeakPolarHBondContact O-CA 3.45Å; D382-L386 WeakPolarHBondContact O-CD1 3.4Å; D382-L386 PolarHBondContact O-N 3.48Å; L386-V390 HydrophobicContact CD2-CG1 4.29Å; L386-I391 HydrophobicContact CB-CD1 4.45Å; L386-I391 HydrophobicContact CB-CG1 4.47Å; L386-I391 HydrophobicContact CD2-CG1 3.96Å
387	P	82.4	Confident	86.7	Confident	63 Å²	63	107.7 Å²	107.7	41%	0.409	53%	0.532	S	S	.	.			trans	-62.6	138.8	177.1	-22.7	34.2	0	0	0	111	Q385 S389 V390 I391	Q385-P387 WeakPolarHBondContact O-CD 3.21Å; Q385-P387 VanDerWaalsContact O-N 3.16Å; P387-S389 PolarHBondContact O-N 3.38Å; P387-S389 VanDerWaalsContact O-N 3.09Å; P387-V390 HydrophobicContact CB-CG2 4.35Å; P387-V390 HydrophobicContact CG-CG2 4.42Å; P387-V390 WeakPolarHBondContact O-CB 3.28Å; P387-V390 PolarHBondContact O-N 2.71Å; P387-I391 PolarHBondContact O-N 3.27Å
388	E	86.2	Confident	86.9	Confident	160 Å²	160	106.5 Å²	106.5	75%	0.748	53%	0.525	S	S	*	.	H	α-helix	trans	-54.7	-31.7	-180	-76.3	177	170.7	0	0	112.9	V390 I391 V392	E388-V390 VanDerWaalsContact C-N 3.29Å; E388-V390 PolarHBondContact O-N 2.95Å; E388-I391 PolarHBondContact O-N 2.85Å; E388-V392 VanDerWaalsContact O-CG2 3.28Å; E388-V392 WeakPolarHBondContact O-CG2 3.44Å; E388-V392 PolarHBondContact O-N 2.83Å
389	S	88	Confident	87	Confident	75 Å²	75	103.4 Å²	103.4	52%	0.524	52%	0.52	S	S	.	.	H	α-helix	trans	-59.3	-38.7	175.7	59.7	0	0	0	0	112.8	P387 E393	P387-S389 PolarHBondContact O-N 3.38Å; P387-S389 VanDerWaalsContact O-N 3.09Å; S389-E393 WeakPolarHBondContact O-CG 3.4Å; S389-E393 PolarHBondContact O-N 2.92Å; S389-E393 VanDerWaalsContact O-N 3.17Å
390	V	85.2	Confident	87.4	Confident	68 Å²	68	103.8 Å²	103.8	41%	0.412	52%	0.522	S	S	.	.	H	α-helix	trans	-68.3	-41.9	177.5	-179.4	0	0	0	0	109.8	L386 P387 E388 E393 T394	L386-V390 HydrophobicContact CD2-CG1 4.29Å; P387-V390 HydrophobicContact CB-CG2 4.35Å; P387-V390 HydrophobicContact CG-CG2 4.42Å; P387-V390 WeakPolarHBondContact O-CB 3.28Å; P387-V390 PolarHBondContact O-N 2.71Å; E388-V390 VanDerWaalsContact C-N 3.29Å; E388-V390 PolarHBondContact O-N 2.95Å; V390-E393 PolarHBondContact O-N 3.24Å; V390-T394 VanDerWaalsContact O-CG2 3.26Å; V390-T394 WeakPolarHBondContact O-CG2 3.48Å; V390-T394 PolarHBondContact O-N 2.98Å
391	I	88.3	Confident	87.8	Confident	71 Å²	71	102.4 Å²	102.4	36%	0.364	52%	0.517	S	S	.	.	H	α-helix	trans	-61.7	-47.7	178.8	-59.3	175.2	0	0	0	110.2	L386 P387 E388 E393 T394 Y397	L386-I391 HydrophobicContact CB-CD1 4.45Å; L386-I391 HydrophobicContact CB-CG1 4.47Å; L386-I391 HydrophobicContact CD2-CG1 3.96Å; P387-I391 PolarHBondContact O-N 3.27Å; E388-I391 PolarHBondContact O-N 2.85Å; I391-E393 PolarHBondContact O-N 3.45Å; I391-T394 WeakPolarHBondContact O-CB 3.38Å; I391-T394 PolarHBondContact O-N 2.77Å; I391-T394 VanDerWaalsContact O-N 3.11Å; I391-T394 PolarHBondContact O-OG1 3.21Å; I391-Y397 HydrophobicContact CG2-CD2 4.09Å; I391-Y397 WeakPolarHBondContact O-CB 3.46Å
392	V	91.2	Very high	88.1	Confident	62 Å²	62	100.2 Å²	100.2	38%	0.376	51%	0.514	S	S	.	.	H	α-helix	trans	-64.2	-29.1	-180	176.7	0	0	0	0	112.4	E388 Y397	E388-V392 VanDerWaalsContact O-CG2 3.28Å; E388-V392 WeakPolarHBondContact O-CG2 3.44Å; E388-V392 PolarHBondContact O-N 2.83Å; V392-Y397 HydrophobicContact CB-CD1 4.12Å; V392-Y397 HydrophobicContact CB-CE1 4.05Å; V392-Y397 HydrophobicContact CG1-CD1 4.01Å; V392-Y397 HydrophobicContact CG1-CE1 3.74Å; V392-Y397 HydrophobicContact CG2-CD1 4.28Å; V392-Y397 HydrophobicContact CG2-CE1 3.86Å; V392-Y397 HydrophobicContact CG2-CE2 4.35Å
393	E	87.5	Confident	88.6	Confident	138 Å²	138	102.4 Å²	102.4	65%	0.645	52%	0.522	S	S	*	.	H	α-helix	trans	-77	-22.7	176.6	-76.1	178.4	-171.9	0	0	113.8	S389 V390 I391 K398	S389-E393 WeakPolarHBondContact O-CG 3.4Å; S389-E393 PolarHBondContact O-N 2.92Å; S389-E393 VanDerWaalsContact O-N 3.17Å; V390-E393 PolarHBondContact O-N 3.24Å; I391-E393 PolarHBondContact O-N 3.45Å; E393-K398 PolarHBondContact O-NZ 2.68Å
394	T	89.8	Confident	89.2	Confident	48 Å²	48	102.9 Å²	102.9	29%	0.294	52%	0.519	S	S	.	.	S	Bend	trans	-59.3	148.2	178.5	67.6	0	0	0	0	112.3	V390 I391 E396 Y397 K398	V390-T394 VanDerWaalsContact O-CG2 3.26Å; V390-T394 WeakPolarHBondContact O-CG2 3.48Å; V390-T394 PolarHBondContact O-N 2.98Å; I391-T394 WeakPolarHBondContact O-CB 3.38Å; I391-T394 PolarHBondContact O-N 2.77Å; I391-T394 VanDerWaalsContact O-N 3.11Å; I391-T394 PolarHBondContact O-OG1 3.21Å; T394-E396 VanDerWaalsContact C-N 3.27Å; T394-E396 PolarHBondContact O-N 3.42Å; T394-Y397 PolarHBondContact O-N 2.69Å; T394-Y397 WeakPolarHBondContact OG1-CB 3.38Å; T394-Y397 PolarHBondContact OG1-N 3.16Å; T394-K398 PolarHBondContact O-N 3.41Å
395	T	90.7	Very high	89.7	Confident	98 Å²	98	95 Å²	95	60%	0.601	50%	0.498	S	S	*	.	H	α-helix	trans	-61.6	-37.6	177.8	38.7	0	0	0	0	112.2	K398 C399	T395-K398 PolarHBondContact O-N 3.33Å; T395-C399 WeakPolarHBondContact O-CB 3.38Å; T395-C399 PolarHBondContact O-N 3.36Å; T395-C399 PolarHBondContact O-SG 2.96Å
396	E	90.8	Very high	90.2	Very high	112 Å²	112	91.5 Å²	91.5	52%	0.523	49%	0.487	S	S	.	.	H	α-helix	trans	-63.7	-46.9	-178.9	-67.5	82.3	170.8	0	0	111	T394 C399 L400	T394-E396 VanDerWaalsContact C-N 3.27Å; T394-E396 PolarHBondContact O-N 3.42Å; E396-C399 PolarHBondContact O-N 2.81Å; E396-L400 WeakPolarHBondContact O-CB 3.48Å; E396-L400 PolarHBondContact O-N 2.95Å
397	Y	93.2	Very high	90.7	Very high	91 Å²	91	92.6 Å²	92.6	36%	0.357	49%	0.492	S	S	.	.	H	α-helix	trans	-63.5	-44.9	176.8	-176.9	-87.6	0	0	0	111.9	I391 V392 T394 C399 L400 Q401	I391-Y397 HydrophobicContact CG2-CD2 4.09Å; I391-Y397 WeakPolarHBondContact O-CB 3.46Å; V392-Y397 HydrophobicContact CB-CD1 4.12Å; V392-Y397 HydrophobicContact CB-CE1 4.05Å; V392-Y397 HydrophobicContact CG1-CD1 4.01Å; V392-Y397 HydrophobicContact CG1-CE1 3.74Å; V392-Y397 HydrophobicContact CG2-CD1 4.28Å; V392-Y397 HydrophobicContact CG2-CE1 3.86Å; V392-Y397 HydrophobicContact CG2-CE2 4.35Å; T394-Y397 PolarHBondContact O-N 2.69Å; T394-Y397 WeakPolarHBondContact OG1-CB 3.38Å; T394-Y397 PolarHBondContact OG1-N 3.16Å; Y397-C399 VanDerWaalsContact C-N 3.34Å; Y397-C399 PolarHBondContact O-N 2.98Å; Y397-L400 PolarHBondContact O-N 2.91Å; Y397-Q401 HydrophobicContact CE1-CB 4.35Å; Y397-Q401 WeakPolarHBondContact O-CB 3.45Å; Y397-Q401 PolarHBondContact O-N 3.45Å
398	K	93.8	Very high	91.3	Very high	111 Å²	111	95.7 Å²	95.7	48%	0.483	50%	0.497	S	S	.	.	H	α-helix	trans	-62.4	-40.7	178.3	-72.9	172.7	178.4	155.8	0	112.2	E393 T394 T395 Q401 S402	E393-K398 PolarHBondContact O-NZ 2.68Å; T394-K398 PolarHBondContact O-N 3.41Å; T395-K398 PolarHBondContact O-N 3.33Å; K398-Q401 PolarHBondContact O-N 3.4Å; K398-S402 WeakPolarHBondContact O-CB 3.48Å; K398-S402 PolarHBondContact O-N 2.99Å
399	C	90.9	Very high	91.6	Very high	74 Å²	74	92.5 Å²	92.5	50%	0.5	49%	0.485	S	S	.	.	H	α-helix	trans	-61.3	-45.7	173.3	-74.2	0	0	0	0	111.3	T395 E396 Y397 S402 Q403	T395-C399 WeakPolarHBondContact O-CB 3.38Å; T395-C399 PolarHBondContact O-N 3.36Å; T395-C399 PolarHBondContact O-SG 2.96Å; E396-C399 PolarHBondContact O-N 2.81Å; Y397-C399 VanDerWaalsContact C-N 3.34Å; Y397-C399 PolarHBondContact O-N 2.98Å; C399-S402 WeakPolarHBondContact O-CB 3.19Å; C399-S402 PolarHBondContact O-N 3.37Å; C399-Q403 WeakPolarHBondContact O-CG 3.43Å; C399-Q403 PolarHBondContact O-N 3.21Å
400	L	95	Very high	91.8	Very high	111 Å²	111	93.6 Å²	93.6	58%	0.581	48%	0.481	S	S	*	.	H	α-helix	trans	-65.9	-40.7	178.6	-172.1	63.5	0	0	0	112.3	E396 Y397 S402 Q403 F404	E396-L400 WeakPolarHBondContact O-CB 3.48Å; E396-L400 PolarHBondContact O-N 2.95Å; Y397-L400 PolarHBondContact O-N 2.91Å; L400-S402 VanDerWaalsContact C-N 3.32Å; L400-S402 PolarHBondContact O-N 2.79Å; L400-Q403 PolarHBondContact O-N 2.96Å; L400-F404 WeakPolarHBondContact O-CB 3.31Å; L400-F404 PolarHBondContact O-N 2.93Å
401	Q	94.4	Very high	92.1	Very high	100 Å²	100	94 Å²	94	47%	0.467	49%	0.487	S	S	.	.	H	α-helix	trans	-61.7	-40.9	174.7	-174.7	-176.8	22.7	0	0	111.6	Y397 K398 S405	Y397-Q401 HydrophobicContact CE1-CB 4.35Å; Y397-Q401 WeakPolarHBondContact O-CB 3.45Å; Y397-Q401 PolarHBondContact O-N 3.45Å; K398-Q401 PolarHBondContact O-N 3.4Å; Q401-S405 WeakPolarHBondContact O-CB 3.4Å; Q401-S405 PolarHBondContact O-N 3.25Å; Q401-S405 PolarHBondContact O-OG 2.94Å
402	S	91.4	Very high	92.4	Very high	74 Å²	74	94.5 Å²	94.5	52%	0.517	49%	0.489	S	S	.	.	H	α-helix	trans	-64.3	-47.6	174.5	-174.2	0	0	0	0	111.3	K398 C399 L400 F404 S405 V406	K398-S402 WeakPolarHBondContact O-CB 3.48Å; K398-S402 PolarHBondContact O-N 2.99Å; C399-S402 WeakPolarHBondContact O-CB 3.19Å; C399-S402 PolarHBondContact O-N 3.37Å; L400-S402 VanDerWaalsContact C-N 3.32Å; L400-S402 PolarHBondContact O-N 2.79Å; S402-F404 PolarHBondContact O-N 2.94Å; S402-S405 PolarHBondContact O-N 3.49Å; S402-V406 WeakPolarHBondContact O-CG2 3.45Å; S402-V406 PolarHBondContact O-N 2.67Å
403	Q	92	Very high	92.5	Very high	118 Å²	118	97.5 Å²	97.5	55%	0.551	50%	0.499	S	S	*	.	H	α-helix	trans	-60.3	-45.5	177.1	-73	176.8	16	0	0	111.7	C399 L400 S405 V406 L407	C399-Q403 WeakPolarHBondContact O-CG 3.43Å; C399-Q403 PolarHBondContact O-N 3.21Å; L400-Q403 PolarHBondContact O-N 2.96Å; Q403-S405 VanDerWaalsContact C-N 3.3Å; Q403-S405 PolarHBondContact O-N 3.39Å; Q403-V406 PolarHBondContact O-N 3.3Å; Q403-L407 WeakPolarHBondContact O-CG 3.48Å; Q403-L407 PolarHBondContact O-N 3.27Å
404	F	94.8	Very high	92.7	Very high	135 Å²	135	96 Å²	96	59%	0.592	49%	0.494	S	S	*	.	H	α-helix	trans	-58.9	-41.9	174.9	179.4	-93.7	0	0	0	111.8	L400 S402 V406 L407 Y408	L400-F404 WeakPolarHBondContact O-CB 3.31Å; L400-F404 PolarHBondContact O-N 2.93Å; S402-F404 PolarHBondContact O-N 2.94Å; F404-V406 VanDerWaalsContact C-N 3.35Å; F404-V406 PolarHBondContact O-N 3.45Å; F404-L407 PolarHBondContact O-N 2.9Å; F404-Y408 HydrophobicContact CE1-CD2 4.49Å; F404-Y408 HydrophobicContact CZ-CD2 4.36Å; F404-Y408 WeakPolarHBondContact O-CB 3.34Å; F404-Y408 PolarHBondContact O-N 2.91Å
405	S	93.2	Very high	92.9	Very high	54 Å²	54	99.5 Å²	99.5	38%	0.378	51%	0.506	S	S	.	.	H	α-helix	trans	-63.7	-39.6	178.3	-61.8	0	0	0	0	112.2	Q401 S402 Q403 N409	Q401-S405 WeakPolarHBondContact O-CB 3.4Å; Q401-S405 PolarHBondContact O-N 3.25Å; Q401-S405 PolarHBondContact O-OG 2.94Å; S402-S405 PolarHBondContact O-N 3.49Å; Q403-S405 VanDerWaalsContact C-N 3.3Å; Q403-S405 PolarHBondContact O-N 3.39Å; S405-N409 WeakPolarHBondContact O-CB 3.32Å; S405-N409 VanDerWaalsContact O-CG 3.25Å; S405-N409 PolarHBondContact O-N 3.47Å; S405-N409 VanDerWaalsContact O-N 3.09Å; S405-N409 PolarHBondContact O-ND2 3.43Å
406	V	93	Very high	93.1	Very high	74 Å²	74	98.2 Å²	98.2	45%	0.448	50%	0.498	S	S	.	.	H	α-helix	trans	-64.5	-52.3	174.7	174.9	0	0	0	0	110.4	S402 Q403 F404 Y408 N409 E410	S402-V406 WeakPolarHBondContact O-CG2 3.45Å; S402-V406 PolarHBondContact O-N 2.67Å; Q403-V406 PolarHBondContact O-N 3.3Å; F404-V406 VanDerWaalsContact C-N 3.35Å; F404-V406 PolarHBondContact O-N 3.45Å; V406-Y408 VanDerWaalsContact C-N 3.3Å; V406-Y408 PolarHBondContact O-N 3.32Å; V406-N409 PolarHBondContact O-N 3.19Å; V406-N409 VanDerWaalsContact O-N 3.14Å; V406-E410 HydrophobicContact CG1-CG 4.42Å; V406-E410 WeakPolarHBondContact O-CG 3.42Å; V406-E410 PolarHBondContact O-N 3.42Å
407	L	92.7	Very high	93	Very high	108 Å²	108	98 Å²	98	57%	0.565	50%	0.498	S	S	*	.	H	α-helix	trans	-61.3	-37.6	-180	-69.1	173.7	0	0	0	112.7	Q403 F404 E410 S411	Q403-L407 WeakPolarHBondContact O-CG 3.48Å; Q403-L407 PolarHBondContact O-N 3.27Å; F404-L407 PolarHBondContact O-N 2.9Å; L407-E410 PolarHBondContact O-N 2.89Å; L407-S411 VanDerWaalsContact O-CB 3.31Å; L407-S411 WeakPolarHBondContact O-CB 3.46Å; L407-S411 PolarHBondContact O-N 3.17Å
408	Y	95.4	Very high	92.8	Very high	128 Å²	128	97.4 Å²	97.4	50%	0.502	50%	0.5	S	S	.	.	H	α-helix	trans	-64.8	-43.7	175.8	-177.2	-95.6	0	0	0	111.5	F404 V406 S411 M412	F404-Y408 HydrophobicContact CE1-CD2 4.49Å; F404-Y408 HydrophobicContact CZ-CD2 4.36Å; F404-Y408 WeakPolarHBondContact O-CB 3.34Å; F404-Y408 PolarHBondContact O-N 2.91Å; V406-Y408 VanDerWaalsContact C-N 3.3Å; V406-Y408 PolarHBondContact O-N 3.32Å; Y408-S411 PolarHBondContact O-N 3Å; Y408-M412 HydrophobicContact CE1-CE 4.27Å; Y408-M412 WeakPolarHBondContact O-CB 3.45Å; Y408-M412 PolarHBondContact O-N 3.11Å; Y408-M412 WeakPolarHBondContact OH-CE 3.49Å
409	N	92.9	Very high	92.8	Very high	92 Å²	92	95.3 Å²	95.3	49%	0.492	50%	0.495	S	S	.	.	H	α-helix	trans	-66.4	-41.3	176.5	-74	-35.8	0	0	0	112	S405 V406 M412 Q413	S405-N409 WeakPolarHBondContact O-CB 3.32Å; S405-N409 VanDerWaalsContact O-CG 3.25Å; S405-N409 PolarHBondContact O-N 3.47Å; S405-N409 VanDerWaalsContact O-N 3.09Å; S405-N409 PolarHBondContact O-ND2 3.43Å; V406-N409 PolarHBondContact O-N 3.19Å; V406-N409 VanDerWaalsContact O-N 3.14Å; N409-M412 PolarHBondContact O-N 2.94Å; N409-Q413 WeakPolarHBondContact O-CG 3.35Å; N409-Q413 PolarHBondContact O-N 2.91Å
410	E	91.1	Very high	92.9	Very high	98 Å²	98	96.9 Å²	96.9	46%	0.458	50%	0.495	S	S	.	.	H	α-helix	trans	-62.2	-45.4	174.6	-73.7	179	170.9	0	0	111.7	V406 L407 M412 Q413 I414	V406-E410 HydrophobicContact CG1-CG 4.42Å; V406-E410 WeakPolarHBondContact O-CG 3.42Å; V406-E410 PolarHBondContact O-N 3.42Å; L407-E410 PolarHBondContact O-N 2.89Å; E410-M412 VanDerWaalsContact C-N 3.3Å; E410-M412 PolarHBondContact O-N 3.31Å; E410-Q413 PolarHBondContact O-N 3.29Å; E410-I414 WeakPolarHBondContact O-CG1 3.41Å; E410-I414 PolarHBondContact O-N 2.94Å
411	S	92.1	Very high	92.5	Very high	77 Å²	77	95.2 Å²	95.2	54%	0.538	49%	0.489	S	S	.	.	H	α-helix	trans	-59.1	-42.5	175.3	-175.5	0	0	0	0	111.7	L407 Y408 I414 K415	L407-S411 VanDerWaalsContact O-CB 3.31Å; L407-S411 WeakPolarHBondContact O-CB 3.46Å; L407-S411 PolarHBondContact O-N 3.17Å; Y408-S411 PolarHBondContact O-N 3Å; S411-I414 PolarHBondContact O-N 2.92Å; S411-K415 WeakPolarHBondContact O-CB 3.33Å; S411-K415 PolarHBondContact O-N 3.08Å
412	M	95	Very high	92.5	Very high	82 Å²	82	97.3 Å²	97.3	40%	0.404	49%	0.493	S	S	.	.	H	α-helix	trans	-67.1	-38	177.6	-161.2	64.8	86.2	0	0	112	Y408 N409 E410 K415 T416	Y408-M412 HydrophobicContact CE1-CE 4.27Å; Y408-M412 WeakPolarHBondContact O-CB 3.45Å; Y408-M412 PolarHBondContact O-N 3.11Å; Y408-M412 WeakPolarHBondContact OH-CE 3.49Å; N409-M412 PolarHBondContact O-N 2.94Å; E410-M412 VanDerWaalsContact C-N 3.3Å; E410-M412 PolarHBondContact O-N 3.31Å; M412-K415 PolarHBondContact O-N 2.92Å; M412-K415 HydrophobicContact SD-CD 4.37Å; M412-T416 PolarHBondContact O-N 3.49Å; M412-T416 PolarHBondContact O-OG1 3.03Å; M412-T416 VanDerWaalsContact O-OG1 3.11Å
413	Q	92.5	Very high	92.6	Very high	125 Å²	125	98.9 Å²	98.9	58%	0.584	50%	0.495	S	S	*	.	H	α-helix	trans	-64.3	-45.2	174.1	-73.9	174.1	21.8	0	0	112.1	N409 E410 K415 T416 M417	N409-Q413 WeakPolarHBondContact O-CG 3.35Å; N409-Q413 PolarHBondContact O-N 2.91Å; E410-Q413 PolarHBondContact O-N 3.29Å; Q413-K415 VanDerWaalsContact C-N 3.28Å; Q413-K415 PolarHBondContact O-N 3.29Å; Q413-T416 PolarHBondContact O-N 2.95Å; Q413-M417 WeakPolarHBondContact O-CG 3.39Å; Q413-M417 PolarHBondContact O-N 3.31Å
414	I	92	Very high	92.4	Very high	105 Å²	105	99.2 Å²	99.2	54%	0.538	50%	0.497	S	S	.	.	H	α-helix	trans	-60.9	-40.2	176.4	-67.7	167.6	0	0	0	110.7	E410 S411 M417 L418	E410-I414 WeakPolarHBondContact O-CG1 3.41Å; E410-I414 PolarHBondContact O-N 2.94Å; S411-I414 PolarHBondContact O-N 2.92Å; I414-M417 HydrophobicContact CB-CE 4.48Å; I414-M417 HydrophobicContact CG1-CE 4.05Å; I414-M417 PolarHBondContact O-N 3.42Å; I414-L418 WeakPolarHBondContact O-CB 3.37Å; I414-L418 PolarHBondContact O-N 2.91Å
415	K	94.5	Very high	92.2	Very high	123 Å²	123	98.7 Å²	98.7	54%	0.535	50%	0.5	S	S	.	.	H	α-helix	trans	-61.5	-45.3	175.7	-171.5	178	178.8	-177.5	0	112.1	S411 M412 Q413 L418 D419	S411-K415 WeakPolarHBondContact O-CB 3.33Å; S411-K415 PolarHBondContact O-N 3.08Å; M412-K415 PolarHBondContact O-N 2.92Å; M412-K415 HydrophobicContact SD-CD 4.37Å; Q413-K415 VanDerWaalsContact C-N 3.28Å; Q413-K415 PolarHBondContact O-N 3.29Å; K415-L418 WeakPolarHBondContact O-CB 3.48Å; K415-L418 PolarHBondContact O-N 3.2Å; K415-D419 PolarHBondContact O-N 3.27Å
416	T	94.5	Very high	92.2	Very high	71 Å²	71	100.8 Å²	100.8	44%	0.436	50%	0.503	S	S	.	.	H	α-helix	trans	-61	-45.2	175.8	-56.2	0	0	0	0	111.7	M412 Q413 L418 D419 E420	M412-T416 PolarHBondContact O-N 3.49Å; M412-T416 PolarHBondContact O-OG1 3.03Å; M412-T416 VanDerWaalsContact O-OG1 3.11Å; Q413-T416 PolarHBondContact O-N 2.95Å; T416-L418 VanDerWaalsContact C-N 3.3Å; T416-L418 PolarHBondContact O-N 3.05Å; T416-D419 PolarHBondContact O-N 3.22Å; T416-E420 WeakPolarHBondContact O-CG 3.48Å; T416-E420 PolarHBondContact O-N 3.49Å
417	M	88.6	Confident	92.2	Very high	108 Å²	108	100.8 Å²	100.8	53%	0.532	50%	0.504	S	S	.	.	H	α-helix	trans	-62.3	-36.6	176.9	-69.1	-169.7	-61.7	0	0	112.6	Q413 I414 E420 T421	Q413-M417 WeakPolarHBondContact O-CG 3.39Å; Q413-M417 PolarHBondContact O-N 3.31Å; I414-M417 HydrophobicContact CB-CE 4.48Å; I414-M417 HydrophobicContact CG1-CE 4.05Å; I414-M417 PolarHBondContact O-N 3.42Å; M417-E420 PolarHBondContact O-N 3.13Å; M417-T421 PolarHBondContact O-N 3.29Å; M417-T421 PolarHBondContact O-OG1 3.49Å
418	L	88.9	Confident	91.9	Very high	77 Å²	77	98.1 Å²	98.1	40%	0.403	49%	0.494	S	S	.	.	H	α-helix	trans	-65.1	-41.2	175.4	-178.1	67.1	0	0	0	111.7	I414 K415 T416 T421 R422	I414-L418 WeakPolarHBondContact O-CB 3.37Å; I414-L418 PolarHBondContact O-N 2.91Å; K415-L418 WeakPolarHBondContact O-CB 3.48Å; K415-L418 PolarHBondContact O-N 3.2Å; T416-L418 VanDerWaalsContact C-N 3.3Å; T416-L418 PolarHBondContact O-N 3.05Å; L418-T421 WeakPolarHBondContact CA-OG1 3.31Å; L418-T421 PolarHBondContact O-OG1 3.43Å; L418-T421 VanDerWaalsContact O-OG1 3.05Å; L418-R422 WeakPolarHBondContact O-CB 3.26Å; L418-R422 VanDerWaalsContact O-CG 3.29Å; L418-R422 WeakPolarHBondContact O-CG 3.44Å; L418-R422 PolarHBondContact O-N 3.46Å
419	D	94.1	Very high	91.8	Very high	68 Å²	68	97.8 Å²	97.8	36%	0.364	50%	0.495	S	S	.	.	H	α-helix	trans	-70.4	-36.9	178.2	-70.5	-23.2	0	0	0	111.6	K415 T416 R422 N423	K415-D419 PolarHBondContact O-N 3.27Å; T416-D419 PolarHBondContact O-N 3.22Å; D419-R422 PolarHBondContact O-N 2.82Å; D419-R422 IonicContact OD1-NH1 3.46Å; D419-N423 WeakPolarHBondContact O-CB 3.2Å; D419-N423 VanDerWaalsContact O-CG 3.29Å; D419-N423 PolarHBondContact O-N 2.86Å; D419-N423 PolarHBondContact O-ND2 3.43Å
420	E	92	Very high	91.8	Very high	107 Å²	107	96.5 Å²	96.5	50%	0.5	49%	0.488	S	S	.	.	H	α-helix	trans	-62.3	-47.5	172.1	-73.7	175.2	-179.7	0	0	112.4	T416 M417 R422 N423 Q424	T416-E420 WeakPolarHBondContact O-CG 3.48Å; T416-E420 PolarHBondContact O-N 3.49Å; M417-E420 PolarHBondContact O-N 3.13Å; E420-R422 PolarHBondContact O-N 2.97Å; E420-N423 PolarHBondContact O-N 3.23Å; E420-Q424 WeakPolarHBondContact O-CG 3.33Å; E420-Q424 PolarHBondContact O-N 3.47Å
421	T	88.3	Confident	91.7	Very high	76 Å²	76	97.1 Å²	97.1	47%	0.466	49%	0.491	S	S	.	.	H	α-helix	trans	-65.9	-37	178.1	38.3	0	0	0	0	112.4	M417 L418 Q424 L425	M417-T421 PolarHBondContact O-N 3.29Å; M417-T421 PolarHBondContact O-OG1 3.49Å; L418-T421 WeakPolarHBondContact CA-OG1 3.31Å; L418-T421 PolarHBondContact O-OG1 3.43Å; L418-T421 VanDerWaalsContact O-OG1 3.05Å; T421-Q424 PolarHBondContact O-N 3.08Å; T421-L425 WeakPolarHBondContact O-CB 3.25Å; T421-L425 PolarHBondContact O-N 2.93Å
422	R	93.7	Very high	91.5	Very high	143 Å²	143	98.5 Å²	98.5	54%	0.54	49%	0.489	S	S	.	.	H	α-helix	trans	-61.7	-43.8	171.4	-78.8	173.5	174.6	155.9	-2.1	112.3	L418 D419 E420 L425 Q426	L418-R422 WeakPolarHBondContact O-CB 3.26Å; L418-R422 VanDerWaalsContact O-CG 3.29Å; L418-R422 WeakPolarHBondContact O-CG 3.44Å; L418-R422 PolarHBondContact O-N 3.46Å; D419-R422 PolarHBondContact O-N 2.82Å; D419-R422 IonicContact OD1-NH1 3.46Å; E420-R422 PolarHBondContact O-N 2.97Å; R422-L425 PolarHBondContact O-N 3.45Å; R422-Q426 WeakPolarHBondContact O-CB 3.36Å; R422-Q426 PolarHBondContact O-N 3.45Å
423	N	93.6	Very high	91.3	Very high	108 Å²	108	98.7 Å²	98.7	58%	0.578	49%	0.491	S	S	*	.	H	α-helix	trans	-64.4	-41.1	176.9	-75.1	-28.8	0	0	0	111.7	D419 E420 Q426 T427	D419-N423 WeakPolarHBondContact O-CB 3.2Å; D419-N423 VanDerWaalsContact O-CG 3.29Å; D419-N423 PolarHBondContact O-N 2.86Å; D419-N423 PolarHBondContact O-ND2 3.43Å; E420-N423 PolarHBondContact O-N 3.23Å; N423-Q426 PolarHBondContact O-N 2.79Å; N423-T427 WeakPolarHBondContact O-CB 3.4Å; N423-T427 PolarHBondContact O-N 3.01Å; N423-T427 PolarHBondContact O-OG1 2.99Å
424	Q	88.4	Confident	91.3	Very high	125 Å²	125	100.7 Å²	100.7	58%	0.584	49%	0.493	S	S	*	.	H	α-helix	trans	-61.7	-46.4	174.3	-71.9	172.9	7.4	0	0	111.8	E420 T421 Q426 T427 S428	E420-Q424 WeakPolarHBondContact O-CG 3.33Å; E420-Q424 PolarHBondContact O-N 3.47Å; T421-Q424 PolarHBondContact O-N 3.08Å; Q424-Q426 PolarHBondContact O-N 2.76Å; Q424-T427 PolarHBondContact O-N 3.33Å; Q424-S428 PolarHBondContact O-N 3.08Å
425	L	89.4	Confident	91.2	Very high	124 Å²	124	100.8 Å²	100.8	65%	0.649	49%	0.492	S	S	*	.	H	α-helix	trans	-59.8	-45	176.8	180	63.4	0	0	0	111.6	T421 R422 T427 S428 K429	T421-L425 WeakPolarHBondContact O-CB 3.25Å; T421-L425 PolarHBondContact O-N 2.93Å; R422-L425 PolarHBondContact O-N 3.45Å; L425-T427 VanDerWaalsContact C-N 3.32Å; L425-T427 PolarHBondContact O-N 3.14Å; L425-S428 PolarHBondContact O-N 3.22Å; L425-K429 WeakPolarHBondContact O-CB 3.47Å; L425-K429 PolarHBondContact O-N 3.34Å
426	Q	93.9	Very high	90.8	Very high	97 Å²	97	99 Å²	99	45%	0.453	49%	0.487	S	S	.	.	H	α-helix	trans	-64	-38.3	177.7	-173.2	65.1	4.3	0	0	111.9	R422 N423 Q424 N430	R422-Q426 WeakPolarHBondContact O-CB 3.36Å; R422-Q426 PolarHBondContact O-N 3.45Å; N423-Q426 PolarHBondContact O-N 2.79Å; Q424-Q426 PolarHBondContact O-N 2.76Å; Q426-N430 WeakPolarHBondContact O-CB 3.29Å; Q426-N430 VanDerWaalsContact O-CG 3.24Å; Q426-N430 PolarHBondContact O-N 3.32Å; Q426-N430 PolarHBondContact O-ND2 3.01Å
427	T	92	Very high	90.6	Very high	75 Å²	75	101.5 Å²	101.5	46%	0.46	49%	0.494	S	S	.	.	H	α-helix	trans	-66.2	-44.5	176.9	-48.6	0	0	0	0	111.2	N423 Q424 L425 N430 Q431	N423-T427 WeakPolarHBondContact O-CB 3.4Å; N423-T427 PolarHBondContact O-N 3.01Å; N423-T427 PolarHBondContact O-OG1 2.99Å; Q424-T427 PolarHBondContact O-N 3.33Å; L425-T427 VanDerWaalsContact C-N 3.32Å; L425-T427 PolarHBondContact O-N 3.14Å; T427-N430 PolarHBondContact O-N 2.89Å; T427-Q431 WeakPolarHBondContact O-CG 3.26Å; T427-Q431 PolarHBondContact O-N 3.3Å
428	S	86.1	Confident	90.7	Very high	51 Å²	51	99.8 Å²	99.8	36%	0.357	49%	0.489	S	S	.	.	H	α-helix	trans	-61.9	-46.1	175.5	178.1	0	0	0	0	111.8	Q424 L425 N430 Q431 H432	Q424-S428 PolarHBondContact O-N 3.08Å; L425-S428 PolarHBondContact O-N 3.22Å; S428-N430 VanDerWaalsContact C-N 3.33Å; S428-N430 PolarHBondContact O-N 2.95Å; S428-Q431 PolarHBondContact O-N 3.19Å; S428-Q431 VanDerWaalsContact O-N 3.14Å; S428-H432 PolarHBondContact O-N 3.37Å
429	K	93.7	Very high	90.4	Very high	122 Å²	122	102.3 Å²	102.3	53%	0.53	50%	0.5	S	S	.	.	H	α-helix	trans	-56.5	-45.5	174.6	-177.9	-179.2	175.8	-179.6	0	112.1	L425 Q431 H432 L433	L425-K429 WeakPolarHBondContact O-CB 3.47Å; L425-K429 PolarHBondContact O-N 3.34Å; K429-Q431 VanDerWaalsContact C-N 3.35Å; K429-H432 PolarHBondContact O-N 3.43Å; K429-L433 HydrophobicContact CG-CD1 4.42Å; K429-L433 WeakPolarHBondContact O-CG 3.43Å; K429-L433 PolarHBondContact O-N 3.49Å
430	N	92.6	Very high	90.3	Very high	65 Å²	65	105.2 Å²	105.2	35%	0.348	51%	0.512	S	S	.	.	H	α-helix	trans	-66.7	-34.7	178.1	-73	-21.4	0	0	0	112.6	Q426 T427 S428 R434	Q426-N430 WeakPolarHBondContact O-CB 3.29Å; Q426-N430 VanDerWaalsContact O-CG 3.24Å; Q426-N430 PolarHBondContact O-N 3.32Å; Q426-N430 PolarHBondContact O-ND2 3.01Å; T427-N430 PolarHBondContact O-N 2.89Å; S428-N430 VanDerWaalsContact C-N 3.33Å; S428-N430 PolarHBondContact O-N 2.95Å; N430-R434 WeakPolarHBondContact O-CG 3.42Å; N430-R434 PolarHBondContact O-N 3.36Å
431	Q	89.8	Confident	90.2	Very high	110 Å²	110	102.9 Å²	102.9	51%	0.514	51%	0.507	S	S	.	.	H	α-helix	trans	-67.1	-43.1	174.6	-73.8	173.6	7	0	0	111.6	T427 S428 K429 R434 Q435	T427-Q431 WeakPolarHBondContact O-CG 3.26Å; T427-Q431 PolarHBondContact O-N 3.3Å; S428-Q431 PolarHBondContact O-N 3.19Å; S428-Q431 VanDerWaalsContact O-N 3.14Å; K429-Q431 VanDerWaalsContact C-N 3.35Å; Q431-R434 PolarHBondContact O-N 3.29Å; Q431-Q435 WeakPolarHBondContact O-CG 3.35Å; Q431-Q435 PolarHBondContact O-N 3.01Å
432	H	87.6	Confident	90.3	Very high	106 Å²	106	104.9 Å²	104.9	49%	0.491	51%	0.511	S	S	.	.	H	α-helix	trans	-63.5	-41.4	175.6	-84.7	-51.5	0	0	0	112.9	S428 K429 R434 Q435 I436	S428-H432 PolarHBondContact O-N 3.37Å; K429-H432 PolarHBondContact O-N 3.43Å; H432-R434 VanDerWaalsContact C-N 3.34Å; H432-R434 PolarHBondContact O-N 3.46Å; H432-Q435 PolarHBondContact ND1-OE1 2.98Å; H432-Q435 WeakPolarHBondContact O-CB 3.34Å; H432-Q435 PolarHBondContact O-N 3.37Å; H432-I436 WeakPolarHBondContact O-CG1 3.49Å; H432-I436 PolarHBondContact O-N 3.01Å
433	L	92.1	Very high	90.1	Very high	86 Å²	86	103.1 Å²	103.1	45%	0.45	51%	0.509	S	S	.	.	H	α-helix	trans	-59.3	-43.6	175.2	-76	169.9	0	0	0	112.1	K429 Q435 I436 E437	K429-L433 HydrophobicContact CG-CD1 4.42Å; K429-L433 WeakPolarHBondContact O-CG 3.43Å; K429-L433 PolarHBondContact O-N 3.49Å; L433-Q435 VanDerWaalsContact C-N 3.34Å; L433-Q435 PolarHBondContact O-N 3.06Å; L433-I436 PolarHBondContact O-N 3Å; L433-E437 WeakPolarHBondContact O-CG 3.26Å; L433-E437 PolarHBondContact O-N 3.36Å
434	R	92.1	Very high	90.1	Very high	167 Å²	167	102.3 Å²	102.3	63%	0.63	51%	0.505	S	S	*	.	H	α-helix	trans	-64.2	-36.6	175.6	-69.4	-179.9	-160	179	4.2	112.9	N430 Q431 H432 I436 E437 V438	N430-R434 WeakPolarHBondContact O-CG 3.42Å; N430-R434 PolarHBondContact O-N 3.36Å; Q431-R434 PolarHBondContact O-N 3.29Å; H432-R434 VanDerWaalsContact C-N 3.34Å; H432-R434 PolarHBondContact O-N 3.46Å; R434-I436 VanDerWaalsContact C-N 3.33Å; R434-E437 PolarHBondContact O-N 3.05Å; R434-V438 WeakPolarHBondContact O-CG2 3.26Å; R434-V438 PolarHBondContact O-N 3.23Å
435	Q	88.6	Confident	90.2	Very high	108 Å²	108	101.6 Å²	101.6	51%	0.505	50%	0.504	S	S	.	.	H	α-helix	trans	-63.6	-41.3	175.9	-74.3	172.6	-7.9	0	0	111.5	Q431 H432 L433 V438 M439	Q431-Q435 WeakPolarHBondContact O-CG 3.35Å; Q431-Q435 PolarHBondContact O-N 3.01Å; H432-Q435 PolarHBondContact ND1-OE1 2.98Å; H432-Q435 WeakPolarHBondContact O-CB 3.34Å; H432-Q435 PolarHBondContact O-N 3.37Å; L433-Q435 VanDerWaalsContact C-N 3.34Å; L433-Q435 PolarHBondContact O-N 3.06Å; Q435-V438 PolarHBondContact O-N 3.01Å; Q435-M439 WeakPolarHBondContact O-CG 3.4Å; Q435-M439 PolarHBondContact O-N 3.33Å
436	I	86.6	Confident	90.2	Very high	85 Å²	85	97.9 Å²	97.9	44%	0.436	49%	0.491	S	S	.	.	H	α-helix	trans	-62.4	-46.9	176	-65.8	167.2	0	0	0	110.4	H432 L433 R434 V438 M439 E440	H432-I436 WeakPolarHBondContact O-CG1 3.49Å; H432-I436 PolarHBondContact O-N 3.01Å; L433-I436 PolarHBondContact O-N 3Å; R434-I436 VanDerWaalsContact C-N 3.33Å; I436-V438 VanDerWaalsContact C-N 3.29Å; I436-V438 PolarHBondContact O-N 3.32Å; I436-M439 PolarHBondContact O-N 2.89Å; I436-M439 VanDerWaalsContact O-N 3.16Å; I436-E440 HydrophobicContact CG2-CG 4.36Å; I436-E440 WeakPolarHBondContact O-CG 3.3Å; I436-E440 PolarHBondContact O-N 2.96Å
437	E	90.6	Very high	90	Very high	124 Å²	124	96.9 Å²	96.9	58%	0.579	49%	0.486	S	S	*	.	H	α-helix	trans	-57.7	-40.1	176.4	-71.5	172.3	178	0	0	112.4	L433 R434 S441	L433-E437 WeakPolarHBondContact O-CG 3.26Å; L433-E437 PolarHBondContact O-N 3.36Å; R434-E437 PolarHBondContact O-N 3.05Å; E437-S441 WeakPolarHBondContact O-CB 3.25Å; E437-S441 PolarHBondContact O-N 3.13Å
438	V	90.5	Very high	90.1	Very high	72 Å²	72	99.5 Å²	99.5	44%	0.436	49%	0.491	S	S	.	.	H	α-helix	trans	-64.5	-48.4	175.5	171.7	0	0	0	0	110.8	R434 Q435 I436 E440 S441 E442	R434-V438 WeakPolarHBondContact O-CG2 3.26Å; R434-V438 PolarHBondContact O-N 3.23Å; Q435-V438 PolarHBondContact O-N 3.01Å; I436-V438 VanDerWaalsContact C-N 3.29Å; I436-V438 PolarHBondContact O-N 3.32Å; V438-E440 VanDerWaalsContact C-N 3.34Å; V438-E440 PolarHBondContact O-N 3.43Å; V438-S441 PolarHBondContact O-N 2.93Å; V438-S441 VanDerWaalsContact O-N 3.14Å; V438-S441 PolarHBondContact O-OG 2.97Å; V438-E442 HydrophobicContact CG1-CG 4.36Å; V438-E442 WeakPolarHBondContact O-CG 3.37Å; V438-E442 PolarHBondContact O-N 3.01Å
439	M	83.6	Confident	90.3	Very high	130 Å²	130	102.4 Å²	102.4	64%	0.64	50%	0.497	S	S	*	.	H	α-helix	trans	-59.5	-42	178	-71.6	177.1	62.1	0	0	112.4	Q435 I436 S441 E442 E443	Q435-M439 WeakPolarHBondContact O-CG 3.4Å; Q435-M439 PolarHBondContact O-N 3.33Å; I436-M439 PolarHBondContact O-N 2.89Å; I436-M439 VanDerWaalsContact O-N 3.16Å; M439-S441 VanDerWaalsContact C-N 3.34Å; M439-S441 PolarHBondContact O-N 3.41Å; M439-E442 PolarHBondContact O-N 3.43Å; M439-E443 WeakPolarHBondContact O-CB 3.49Å; M439-E443 PolarHBondContact O-N 2.97Å
440	E	91.3	Very high	90.1	Very high	128 Å²	128	101 Å²	101	60%	0.598	50%	0.499	S	S	*	.	H	α-helix	trans	-63.9	-38.9	176.1	-72.1	178	170.1	0	0	111.9	I436 V438 L444	I436-E440 HydrophobicContact CG2-CG 4.36Å; I436-E440 WeakPolarHBondContact O-CG 3.3Å; I436-E440 PolarHBondContact O-N 2.96Å; V438-E440 VanDerWaalsContact C-N 3.34Å; V438-E440 PolarHBondContact O-N 3.43Å; E440-L444 WeakPolarHBondContact O-CB 3.32Å; E440-L444 PolarHBondContact O-N 3.33Å; E440-L444 VanDerWaalsContact O-N 3.09Å
441	S	89.8	Confident	90.1	Very high	58 Å²	58	105 Å²	105	41%	0.406	51%	0.509	S	S	.	.	H	α-helix	trans	-67.9	-38.6	176.1	79.1	0	0	0	0	112.7	E437 V438 M439 L444 I445	E437-S441 WeakPolarHBondContact O-CB 3.25Å; E437-S441 PolarHBondContact O-N 3.13Å; V438-S441 PolarHBondContact O-N 2.93Å; V438-S441 VanDerWaalsContact O-N 3.14Å; V438-S441 PolarHBondContact O-OG 2.97Å; M439-S441 VanDerWaalsContact C-N 3.34Å; M439-S441 PolarHBondContact O-N 3.41Å; S441-L444 PolarHBondContact O-N 3.45Å; S441-I445 WeakPolarHBondContact O-CG1 3.24Å; S441-I445 PolarHBondContact O-N 2.9Å; S441-I445 VanDerWaalsContact O-N 3.11Å
442	E	90.9	Very high	90.1	Very high	119 Å²	119	102.7 Å²	102.7	56%	0.556	51%	0.505	S	S	*	.	H	α-helix	trans	-68.1	-43	177.5	-73.4	177.1	170.7	0	0	111.4	V438 M439 L444 I445 A446	V438-E442 HydrophobicContact CG1-CG 4.36Å; V438-E442 WeakPolarHBondContact O-CG 3.37Å; V438-E442 PolarHBondContact O-N 3.01Å; M439-E442 PolarHBondContact O-N 3.43Å; E442-L444 VanDerWaalsContact C-N 3.32Å; E442-L444 PolarHBondContact O-N 2.93Å; E442-I445 PolarHBondContact O-N 3.48Å; E442-I445 VanDerWaalsContact O-N 3.16Å; E442-A446 PolarHBondContact O-N 2.66Å
443	E	90	Very high	90.3	Very high	106 Å²	106	101.9 Å²	101.9	50%	0.495	50%	0.501	S	S	.	.	H	α-helix	trans	-59.9	-42.3	174.1	178.5	57.5	-153.9	0	0	111.2	M439 I445 A446 Q447	M439-E443 WeakPolarHBondContact O-CB 3.49Å; M439-E443 PolarHBondContact O-N 2.97Å; E443-I445 VanDerWaalsContact C-N 3.32Å; E443-I445 PolarHBondContact O-N 2.98Å; E443-A446 PolarHBondContact O-N 3.37Å; E443-Q447 WeakPolarHBondContact O-CG 3.44Å; E443-Q447 PolarHBondContact O-N 3.21Å; E443-Q447 PolarHBondContact OE1-NE2 2.94Å
444	L	91.9	Very high	90.2	Very high	91 Å²	91	102.8 Å²	102.8	48%	0.476	50%	0.504	S	S	.	.	H	α-helix	trans	-63	-37.7	176	-172.5	67.8	0	0	0	112.3	E440 S441 E442 K448	E440-L444 WeakPolarHBondContact O-CB 3.32Å; E440-L444 PolarHBondContact O-N 3.33Å; E440-L444 VanDerWaalsContact O-N 3.09Å; S441-L444 PolarHBondContact O-N 3.45Å; E442-L444 VanDerWaalsContact C-N 3.32Å; E442-L444 PolarHBondContact O-N 2.93Å; L444-K448 WeakPolarHBondContact O-CG 3.31Å; L444-K448 PolarHBondContact O-N 3.43Å; L444-K448 VanDerWaalsContact O-N 3.12Å
445	I	90.5	Very high	90.1	Very high	110 Å²	110	99 Å²	99	56%	0.564	50%	0.496	S	S	*	.	H	α-helix	trans	-68.1	-43.7	175.7	-68.3	165.2	0	0	0	110.5	S441 E442 E443 Q447 K448 K449	S441-I445 WeakPolarHBondContact O-CG1 3.24Å; S441-I445 PolarHBondContact O-N 2.9Å; S441-I445 VanDerWaalsContact O-N 3.11Å; E442-I445 PolarHBondContact O-N 3.48Å; E442-I445 VanDerWaalsContact O-N 3.16Å; E443-I445 VanDerWaalsContact C-N 3.32Å; E443-I445 PolarHBondContact O-N 2.98Å; I445-Q447 PolarHBondContact O-N 3.19Å; I445-K448 PolarHBondContact O-N 3.17Å; I445-K449 PolarHBondContact O-N 2.96Å
446	A	89.9	Confident	90.2	Very high	46 Å²	46	99.4 Å²	99.4	38%	0.38	50%	0.498	S	S	.	.	H	α-helix	trans	-59.8	-45.3	177	0	0	0	0	0	111.4	E442 E443 K448 K449 V450	E442-A446 PolarHBondContact O-N 2.66Å; E443-A446 PolarHBondContact O-N 3.37Å; A446-K448 PolarHBondContact O-N 2.93Å; A446-K449 WeakPolarHBondContact O-CB 3.4Å; A446-K449 PolarHBondContact O-N 2.98Å; A446-K449 VanDerWaalsContact O-N 3.16Å; A446-V450 WeakPolarHBondContact O-CG2 3.38Å; A446-V450 PolarHBondContact O-N 3.43Å
447	Q	90.9	Very high	90.4	Very high	76 Å²	76	101.4 Å²	101.4	36%	0.355	51%	0.507	S	S	.	.	H	α-helix	trans	-61.1	-41.2	175.5	-72.1	179.6	15.3	0	0	112.7	E443 I445 K449 V450 R451	E443-Q447 WeakPolarHBondContact O-CG 3.44Å; E443-Q447 PolarHBondContact O-N 3.21Å; E443-Q447 PolarHBondContact OE1-NE2 2.94Å; I445-Q447 PolarHBondContact O-N 3.19Å; Q447-K449 VanDerWaalsContact C-N 3.32Å; Q447-K449 PolarHBondContact O-N 3.32Å; Q447-V450 PolarHBondContact O-N 3.16Å; Q447-R451 WeakPolarHBondContact O-CG 3.45Å; Q447-R451 PolarHBondContact O-N 2.97Å
448	K	92.9	Very high	90.2	Very high	130 Å²	130	100.7 Å²	100.7	57%	0.565	50%	0.503	S	S	*	.	H	α-helix	trans	-61.6	-40.7	174.6	-76.9	176.5	-179.6	178.4	0	111.8	L444 I445 A446 R451 S452	L444-K448 WeakPolarHBondContact O-CG 3.31Å; L444-K448 PolarHBondContact O-N 3.43Å; L444-K448 VanDerWaalsContact O-N 3.12Å; I445-K448 PolarHBondContact O-N 3.17Å; A446-K448 PolarHBondContact O-N 2.93Å; K448-R451 PolarHBondContact O-N 3.29Å; K448-S452 PolarHBondContact O-N 2.94Å
449	K	91.2	Very high	90.3	Very high	111 Å²	111	102.3 Å²	102.3	48%	0.483	51%	0.51	S	S	.	.	H	α-helix	trans	-64.5	-49	178.5	-171.3	178.5	179.2	-174.3	0	111.7	I445 A446 Q447 R451 S452 E453	I445-K449 PolarHBondContact O-N 2.96Å; A446-K449 WeakPolarHBondContact O-CB 3.4Å; A446-K449 PolarHBondContact O-N 2.98Å; A446-K449 VanDerWaalsContact O-N 3.16Å; Q447-K449 VanDerWaalsContact C-N 3.32Å; Q447-K449 PolarHBondContact O-N 3.32Å; K449-R451 VanDerWaalsContact C-N 3.32Å; K449-R451 PolarHBondContact O-N 2.87Å; K449-S452 WeakPolarHBondContact O-CB 3.46Å; K449-S452 PolarHBondContact O-N 3.05Å; K449-E453 WeakPolarHBondContact CE-OE1 3.32Å; K449-E453 WeakPolarHBondContact O-CG 3.39Å; K449-E453 PolarHBondContact O-N 3.43Å
450	V	89.5	Confident	90.7	Very high	93 Å²	93	99.7 Å²	99.7	56%	0.564	50%	0.501	S	S	*	.	H	α-helix	trans	-60.3	-41.3	177.7	173.5	0	0	0	0	111.3	A446 Q447 S452 E453 M454	A446-V450 WeakPolarHBondContact O-CG2 3.38Å; A446-V450 PolarHBondContact O-N 3.43Å; Q447-V450 PolarHBondContact O-N 3.16Å; V450-S452 VanDerWaalsContact C-N 3.33Å; V450-S452 PolarHBondContact O-N 3Å; V450-E453 PolarHBondContact O-N 3.14Å; V450-M454 WeakPolarHBondContact O-CB 3.43Å; V450-M454 PolarHBondContact O-N 3.46Å
451	R	91.2	Very high	90.5	Very high	150 Å²	150	98.1 Å²	98.1	57%	0.566	50%	0.496	S	S	*	.	H	α-helix	trans	-61	-41.4	173.7	-75.2	-177.9	-168.3	152.9	8.2	112.3	Q447 K448 K449 M454 I455	Q447-R451 WeakPolarHBondContact O-CG 3.45Å; Q447-R451 PolarHBondContact O-N 2.97Å; K448-R451 PolarHBondContact O-N 3.29Å; K449-R451 VanDerWaalsContact C-N 3.32Å; K449-R451 PolarHBondContact O-N 2.87Å; R451-M454 PolarHBondContact O-N 2.81Å; R451-I455 WeakPolarHBondContact O-CG1 3.45Å; R451-I455 PolarHBondContact O-N 3.43Å; R451-I455 VanDerWaalsContact O-N 3.11Å
452	S	91	Very high	90.5	Very high	61 Å²	61	98 Å²	98	43%	0.427	50%	0.499	S	S	.	.	H	α-helix	trans	-67	-38.5	178.3	-159	0	0	0	0	112.2	K448 K449 V450 I455 Q456	K448-S452 PolarHBondContact O-N 2.94Å; K449-S452 WeakPolarHBondContact O-CB 3.46Å; K449-S452 PolarHBondContact O-N 3.05Å; V450-S452 VanDerWaalsContact C-N 3.33Å; V450-S452 PolarHBondContact O-N 3Å; S452-I455 PolarHBondContact O-N 3.34Å; S452-Q456 WeakPolarHBondContact O-CG 3.42Å; S452-Q456 PolarHBondContact O-N 3.04Å; S452-Q456 VanDerWaalsContact O-N 3.11Å
453	E	90.4	Very high	90.5	Very high	88 Å²	88	96.8 Å²	96.8	41%	0.411	50%	0.495	S	S	.	.	H	α-helix	trans	-66.6	-40.6	174.9	-71.8	172.4	-176.6	0	0	111.4	K449 V450 I455 Q456 M457	K449-E453 WeakPolarHBondContact CE-OE1 3.32Å; K449-E453 WeakPolarHBondContact O-CG 3.39Å; K449-E453 PolarHBondContact O-N 3.43Å; V450-E453 PolarHBondContact O-N 3.14Å; E453-I455 PolarHBondContact O-N 3.27Å; E453-Q456 PolarHBondContact O-N 3.39Å; E453-M457 VanDerWaalsContact O-CG 3.31Å; E453-M457 WeakPolarHBondContact O-CG 3.42Å; E453-M457 PolarHBondContact O-N 3.19Å
454	M	90	Very high	90.6	Very high	105 Å²	105	96 Å²	96	52%	0.517	49%	0.494	S	S	.	.	H	α-helix	trans	-58.9	-46.4	175.2	-171.4	-174.9	82.3	0	0	111.6	V450 R451 Q456 M457 E458	V450-M454 WeakPolarHBondContact O-CB 3.43Å; V450-M454 PolarHBondContact O-N 3.46Å; R451-M454 PolarHBondContact O-N 2.81Å; M454-Q456 VanDerWaalsContact C-N 3.34Å; M454-Q456 PolarHBondContact O-N 3.44Å; M454-M457 PolarHBondContact O-N 3.19Å; M454-E458 WeakPolarHBondContact O-CG 3.44Å; M454-E458 PolarHBondContact O-N 3.06Å
455	I	91.4	Very high	90.6	Very high	88 Å²	88	100.5 Å²	100.5	45%	0.451	50%	0.504	S	S	.	.	H	α-helix	trans	-60.2	-44.4	176.3	-66.8	165.4	0	0	0	110.8	R451 S452 E453 M457 E458 D459	R451-I455 WeakPolarHBondContact O-CG1 3.45Å; R451-I455 PolarHBondContact O-N 3.43Å; R451-I455 VanDerWaalsContact O-N 3.11Å; S452-I455 PolarHBondContact O-N 3.34Å; E453-I455 PolarHBondContact O-N 3.27Å; I455-M457 VanDerWaalsContact C-N 3.34Å; I455-M457 PolarHBondContact O-N 3.06Å; I455-E458 WeakPolarHBondContact O-CB 3.49Å; I455-E458 PolarHBondContact O-N 3.02Å; I455-D459 PolarHBondContact O-N 3.05Å
456	Q	89.4	Confident	90.7	Very high	117 Å²	117	102.2 Å²	102.2	55%	0.547	51%	0.508	S	S	.	.	H	α-helix	trans	-62.2	-40	177.6	-72.8	172.9	5.2	0	0	112.5	S452 E453 M454 E458 D459 V460	S452-Q456 WeakPolarHBondContact O-CG 3.42Å; S452-Q456 PolarHBondContact O-N 3.04Å; S452-Q456 VanDerWaalsContact O-N 3.11Å; E453-Q456 PolarHBondContact O-N 3.39Å; M454-Q456 VanDerWaalsContact C-N 3.34Å; M454-Q456 PolarHBondContact O-N 3.44Å; Q456-E458 VanDerWaalsContact C-N 3.35Å; Q456-D459 PolarHBondContact O-N 3.41Å; Q456-V460 WeakPolarHBondContact O-CG2 3.4Å; Q456-V460 PolarHBondContact O-N 3.23Å
457	M	90.7	Very high	90.7	Very high	127 Å²	127	105.4 Å²	105.4	63%	0.626	52%	0.515	S	S	*	.	H	α-helix	trans	-68.4	-35.6	177.1	-66.1	-62.3	-85.7	0	0	111.7	E453 M454 I455 V460 L461	E453-M457 VanDerWaalsContact O-CG 3.31Å; E453-M457 WeakPolarHBondContact O-CG 3.42Å; E453-M457 PolarHBondContact O-N 3.19Å; M454-M457 PolarHBondContact O-N 3.19Å; I455-M457 VanDerWaalsContact C-N 3.34Å; I455-M457 PolarHBondContact O-N 3.06Å; M457-V460 PolarHBondContact O-N 2.99Å; M457-L461 WeakPolarHBondContact O-CB 3.37Å; M457-L461 VanDerWaalsContact O-CG 3.28Å; M457-L461 WeakPolarHBondContact O-CG 3.49Å; M457-L461 PolarHBondContact O-N 2.95Å
458	E	87.5	Confident	90.7	Very high	109 Å²	109	109.4 Å²	109.4	51%	0.509	53%	0.528	S	S	.	.	H	α-helix	trans	-63.3	-42.1	172	-73.1	175.9	170	0	0	111.7	M454 I455 Q456 L461 A462	M454-E458 WeakPolarHBondContact O-CG 3.44Å; M454-E458 PolarHBondContact O-N 3.06Å; I455-E458 WeakPolarHBondContact O-CB 3.49Å; I455-E458 PolarHBondContact O-N 3.02Å; Q456-E458 VanDerWaalsContact C-N 3.35Å; E458-L461 PolarHBondContact O-N 3.47Å; E458-A462 WeakPolarHBondContact O-CB 3.48Å; E458-A462 PolarHBondContact O-N 3.43Å
459	D	93.5	Very high	90.7	Very high	106 Å²	106	107.1 Å²	107.1	57%	0.567	52%	0.519	S	S	*	.	H	α-helix	trans	-63.7	-42.9	175.6	-73.2	-23.7	0	0	0	112.1	I455 Q456 A462 L463	I455-D459 PolarHBondContact O-N 3.05Å; Q456-D459 PolarHBondContact O-N 3.41Å; D459-A462 WeakPolarHBondContact O-CB 3.41Å; D459-A462 PolarHBondContact O-N 3Å; D459-L463 PolarHBondContact O-N 2.85Å
460	V	90.1	Very high	90.6	Very high	75 Å²	75	104.8 Å²	104.8	46%	0.455	51%	0.514	S	S	.	.	H	α-helix	trans	-64.1	-43.1	175.8	171.7	0	0	0	0	111	Q456 M457 A462 L463 I464	Q456-V460 WeakPolarHBondContact O-CG2 3.4Å; Q456-V460 PolarHBondContact O-N 3.23Å; M457-V460 PolarHBondContact O-N 2.99Å; V460-A462 VanDerWaalsContact C-N 3.31Å; V460-A462 PolarHBondContact O-N 3.05Å; V460-L463 WeakPolarHBondContact O-CB 3.39Å; V460-L463 PolarHBondContact O-N 2.86Å; V460-I464 HydrophobicContact CG1-CD1 3.89Å; V460-I464 HydrophobicContact CG1-CG1 4.45Å; V460-I464 WeakPolarHBondContact O-CG1 3.29Å; V460-I464 PolarHBondContact O-N 2.98Å
461	L	87.5	Confident	90.7	Very high	94 Å²	94	105.7 Å²	105.7	49%	0.492	52%	0.515	S	S	.	.	H	α-helix	trans	-62.2	-39	174.9	-76	171	0	0	0	111.8	M457 E458 L463 R465	M457-L461 WeakPolarHBondContact O-CB 3.37Å; M457-L461 VanDerWaalsContact O-CG 3.28Å; M457-L461 WeakPolarHBondContact O-CG 3.49Å; M457-L461 PolarHBondContact O-N 2.95Å; E458-L461 PolarHBondContact O-N 3.47Å; L461-L463 VanDerWaalsContact C-N 3.34Å; L461-R465 WeakPolarHBondContact O-CB 3.37Å; L461-R465 VanDerWaalsContact O-CG 3.27Å; L461-R465 WeakPolarHBondContact O-CG 3.26Å; L461-R465 PolarHBondContact O-N 2.89Å
462	A	90.4	Very high	90.8	Very high	56 Å²	56	104.1 Å²	104.1	46%	0.463	51%	0.509	S	S	.	.	H	α-helix	trans	-64.3	-39.5	174.6	0	0	0	0	0	111.8	E458 D459 V460 R465 K466	E458-A462 WeakPolarHBondContact O-CB 3.48Å; E458-A462 PolarHBondContact O-N 3.43Å; D459-A462 WeakPolarHBondContact O-CB 3.41Å; D459-A462 PolarHBondContact O-N 3Å; V460-A462 VanDerWaalsContact C-N 3.31Å; V460-A462 PolarHBondContact O-N 3.05Å; A462-R465 PolarHBondContact O-N 3.41Å; A462-K466 PolarHBondContact O-N 3.06Å; A462-K466 VanDerWaalsContact O-N 3.08Å
463	L	90.5	Very high	90.8	Very high	93 Å²	93	104.8 Å²	104.8	49%	0.487	51%	0.507	S	S	.	.	H	α-helix	trans	-63.6	-49.5	175.3	-173.5	69.2	0	0	0	111.6	D459 V460 L461 R465 K466 E467	D459-L463 PolarHBondContact O-N 2.85Å; V460-L463 WeakPolarHBondContact O-CB 3.39Å; V460-L463 PolarHBondContact O-N 2.86Å; L461-L463 VanDerWaalsContact C-N 3.34Å; L463-R465 VanDerWaalsContact C-N 3.28Å; L463-R465 PolarHBondContact O-N 3.17Å; L463-K466 WeakPolarHBondContact O-CA 3.45Å; L463-K466 WeakPolarHBondContact O-CB 3.44Å; L463-K466 PolarHBondContact O-N 3.02Å; L463-E467 WeakPolarHBondContact O-CG 3.38Å; L463-E467 PolarHBondContact O-N 3.4Å
464	I	91.9	Very high	90.7	Very high	90 Å²	90	105.2 Å²	105.2	46%	0.462	51%	0.509	S	S	.	.	H	α-helix	trans	-59.5	-40.3	178.3	-67.8	167.8	0	0	0	110.8	V460 K466 E467 Y468	V460-I464 HydrophobicContact CG1-CD1 3.89Å; V460-I464 HydrophobicContact CG1-CG1 4.45Å; V460-I464 WeakPolarHBondContact O-CG1 3.29Å; V460-I464 PolarHBondContact O-N 2.98Å; I464-K466 VanDerWaalsContact C-N 3.33Å; I464-K466 PolarHBondContact O-N 2.91Å; I464-E467 PolarHBondContact O-N 3.31Å; I464-Y468 WeakPolarHBondContact O-CB 3.3Å; I464-Y468 PolarHBondContact O-N 3.4Å
465	R	92.2	Very high	90.5	Very high	186 Å²	186	106.5 Å²	106.5	70%	0.702	51%	0.512	S	S	*	.	H	α-helix	trans	-61.3	-41	174.7	-75.5	173.5	-178.2	179.2	2.9	112	L461 A462 L463 E469	L461-R465 WeakPolarHBondContact O-CB 3.37Å; L461-R465 VanDerWaalsContact O-CG 3.27Å; L461-R465 WeakPolarHBondContact O-CG 3.26Å; L461-R465 PolarHBondContact O-N 2.89Å; A462-R465 PolarHBondContact O-N 3.41Å; L463-R465 VanDerWaalsContact C-N 3.28Å; L463-R465 PolarHBondContact O-N 3.17Å; R465-E469 PolarHBondContact O-N 3.39Å
466	K	92.7	Very high	90.3	Very high	146 Å²	146	107.1 Å²	107.1	64%	0.635	51%	0.513	S	S	*	.	H	α-helix	trans	-67	-41.2	176.7	-175.2	-176.2	175.9	-175.2	0	112	A462 L463 I464 E469 T470	A462-K466 PolarHBondContact O-N 3.06Å; A462-K466 VanDerWaalsContact O-N 3.08Å; L463-K466 WeakPolarHBondContact O-CA 3.45Å; L463-K466 WeakPolarHBondContact O-CB 3.44Å; L463-K466 PolarHBondContact O-N 3.02Å; I464-K466 VanDerWaalsContact C-N 3.33Å; I464-K466 PolarHBondContact O-N 2.91Å; K466-E469 PolarHBondContact O-N 3.47Å; K466-T470 PolarHBondContact O-N 3.37Å; K466-T470 PolarHBondContact O-OG1 3.48Å
467	E	90.5	Very high	89.9	Confident	113 Å²	113	107.6 Å²	107.6	53%	0.528	52%	0.516	S	S	.	.	H	α-helix	trans	-64.2	-43.5	175.9	-71.3	178.6	167.8	0	0	111.4	L463 I464 E469 T470 L471	L463-E467 WeakPolarHBondContact O-CG 3.38Å; L463-E467 PolarHBondContact O-N 3.4Å; I464-E467 PolarHBondContact O-N 3.31Å; E467-E469 PolarHBondContact O-N 2.86Å; E467-T470 WeakPolarHBondContact O-CB 3.41Å; E467-T470 PolarHBondContact O-N 2.95Å; E467-L471 WeakPolarHBondContact O-CB 3.4Å; E467-L471 PolarHBondContact O-N 3.45Å
468	Y	91.2	Very high	89.4	Confident	159 Å²	159	106.5 Å²	106.5	62%	0.624	51%	0.512	S	S	*	.	H	α-helix	trans	-58.7	-46.1	174.2	177.4	-95.2	0	0	0	112	I464 T470 L471 R472	I464-Y468 WeakPolarHBondContact O-CB 3.3Å; I464-Y468 PolarHBondContact O-N 3.4Å; Y468-T470 VanDerWaalsContact C-N 3.32Å; Y468-T470 PolarHBondContact O-N 2.95Å; Y468-L471 PolarHBondContact O-N 2.91Å; Y468-R472 WeakPolarHBondContact O-CB 3.31Å; Y468-R472 PolarHBondContact O-N 3.04Å
469	E	93.2	Very high	89	Confident	82 Å²	82	106 Å²	106	38%	0.383	51%	0.511	S	S	.	.	H	α-helix	trans	-64.5	-38.1	177.5	-169.9	61.5	-161.6	0	0	111.7	R465 K466 E467 R472 I473	R465-E469 PolarHBondContact O-N 3.39Å; K466-E469 PolarHBondContact O-N 3.47Å; E467-E469 PolarHBondContact O-N 2.86Å; E469-R472 WeakPolarHBondContact O-CB 3.48Å; E469-R472 PolarHBondContact O-N 2.79Å; E469-R472 IonicContact OE1-NH1 3.56Å; E469-R472 IonicContact OE2-NH1 2.69Å; E469-I473 HydrophobicContact CG-CD1 4.27Å; E469-I473 VanDerWaalsContact O-CG1 3.29Å; E469-I473 WeakPolarHBondContact O-CG1 3.43Å; E469-I473 PolarHBondContact O-N 3.35Å
470	T	88.3	Confident	88.4	Confident	63 Å²	63	103.5 Å²	103.5	39%	0.387	51%	0.505	S	S	.	.	H	α-helix	trans	-62.9	-48.2	175.5	-53.9	0	0	0	0	110.9	K466 E467 Y468 R472 I473 E474	K466-T470 PolarHBondContact O-N 3.37Å; K466-T470 PolarHBondContact O-OG1 3.48Å; E467-T470 WeakPolarHBondContact O-CB 3.41Å; E467-T470 PolarHBondContact O-N 2.95Å; Y468-T470 VanDerWaalsContact C-N 3.32Å; Y468-T470 PolarHBondContact O-N 2.95Å; T470-R472 VanDerWaalsContact C-N 3.28Å; T470-R472 PolarHBondContact O-N 2.83Å; T470-I473 PolarHBondContact O-N 3.16Å; T470-E474 WeakPolarHBondContact O-CG 3.31Å; T470-E474 PolarHBondContact O-N 3.48Å
471	L	91.7	Very high	87.8	Confident	111 Å²	111	102.4 Å²	102.4	58%	0.581	50%	0.504	S	S	*	.	H	α-helix	trans	-63.3	-36.8	178.7	-172.7	65.4	0	0	0	111.8	E467 Y468 E474 F475	E467-L471 WeakPolarHBondContact O-CB 3.4Å; E467-L471 PolarHBondContact O-N 3.45Å; Y468-L471 PolarHBondContact O-N 2.91Å; L471-E474 PolarHBondContact O-N 2.8Å; L471-F475 WeakPolarHBondContact O-CB 3.49Å; L471-F475 PolarHBondContact O-N 3.29Å
472	R	92.8	Very high	87.1	Confident	117 Å²	117	103.2 Å²	103.2	44%	0.442	51%	0.508	S	S	.	.	H	α-helix	trans	-62.3	-46.3	174	-178.6	-175.9	168.9	-153.1	-3.4	111.5	Y468 E469 T470 F475 E476	Y468-R472 WeakPolarHBondContact O-CB 3.31Å; Y468-R472 PolarHBondContact O-N 3.04Å; E469-R472 WeakPolarHBondContact O-CB 3.48Å; E469-R472 PolarHBondContact O-N 2.79Å; E469-R472 IonicContact OE1-NH1 3.56Å; E469-R472 IonicContact OE2-NH1 2.69Å; T470-R472 VanDerWaalsContact C-N 3.28Å; T470-R472 PolarHBondContact O-N 2.83Å; R472-F475 WeakPolarHBondContact O-CB 3.42Å; R472-F475 PolarHBondContact O-N 3.33Å; R472-E476 IonicContact CZ-OE1 3.81Å; R472-E476 IonicContact NE-OE1 2.9Å; R472-E476 PolarHBondContact NE-OE1 2.87Å; R472-E476 IonicContact NH2-OE1 3.64Å; R472-E476 PolarHBondContact NH2-OE1 3.15Å; R472-E476 PolarHBondContact O-N 2.97Å
473	I	90.8	Very high	86.5	Confident	76 Å²	76	107.7 Å²	107.7	39%	0.39	52%	0.52	S	S	.	.	H	α-helix	trans	-62.7	-44.2	176.4	-67.4	164.5	0	0	0	110.6	E469 T470 F475 E476 Q477	E469-I473 HydrophobicContact CG-CD1 4.27Å; E469-I473 VanDerWaalsContact O-CG1 3.29Å; E469-I473 WeakPolarHBondContact O-CG1 3.43Å; E469-I473 PolarHBondContact O-N 3.35Å; T470-I473 PolarHBondContact O-N 3.16Å; I473-F475 VanDerWaalsContact C-N 3.29Å; I473-F475 PolarHBondContact O-N 3.3Å; I473-E476 PolarHBondContact O-N 3.44Å; I473-Q477 HydrophobicContact CG2-CG 4.45Å; I473-Q477 WeakPolarHBondContact O-CG 3.38Å; I473-Q477 PolarHBondContact O-N 3.08Å
474	E	87.6	Confident	86	Confident	97 Å²	97	109.5 Å²	109.5	45%	0.453	53%	0.526	S	S	.	.	H	α-helix	trans	-60.6	-38.9	176.1	-73.2	178.2	179.6	0	0	112.1	T470 L471 Q477 N478	T470-E474 WeakPolarHBondContact O-CG 3.31Å; T470-E474 PolarHBondContact O-N 3.48Å; L471-E474 PolarHBondContact O-N 2.8Å; E474-Q477 PolarHBondContact O-N 3.03Å; E474-N478 WeakPolarHBondContact O-CB 3.42Å; E474-N478 PolarHBondContact O-N 3.32Å; E474-N478 PolarHBondContact O-ND2 2.9Å
475	F	86.1	Confident	85.3	Confident	131 Å²	131	108.2 Å²	108.2	58%	0.575	52%	0.522	S	S	*	.	H	α-helix	trans	-65.6	-45.9	175.2	-179.2	-95.1	0	0	0	111.9	L471 R472 I473 Q477 N478 M479	L471-F475 WeakPolarHBondContact O-CB 3.49Å; L471-F475 PolarHBondContact O-N 3.29Å; R472-F475 WeakPolarHBondContact O-CB 3.42Å; R472-F475 PolarHBondContact O-N 3.33Å; I473-F475 VanDerWaalsContact C-N 3.29Å; I473-F475 PolarHBondContact O-N 3.3Å; F475-Q477 VanDerWaalsContact C-N 3.33Å; F475-Q477 PolarHBondContact O-N 2.71Å; F475-N478 PolarHBondContact O-N 3.32Å; F475-M479 HydrophobicContact CD1-CG 4.09Å; F475-M479 HydrophobicContact CE1-CG 3.66Å; F475-M479 HydrophobicContact CE1-SD 3.91Å; F475-M479 HydrophobicContact CE2-CG 4.43Å; F475-M479 HydrophobicContact CZ-CG 3.85Å; F475-M479 HydrophobicContact CZ-SD 3.89Å; F475-M479 WeakPolarHBondContact O-CB 3.37Å; F475-M479 WeakPolarHBondContact O-CG 3.46Å; F475-M479 PolarHBondContact O-N 3.13Å
476	E	87.1	Confident	84.6	Confident	102 Å²	102	102.4 Å²	102.4	48%	0.477	51%	0.514	S	S	.	.	H	α-helix	trans	-61	-40.8	175.8	-75.9	176.5	-170.2	0	0	111.4	R472 I473 M479 A480	R472-E476 IonicContact CZ-OE1 3.81Å; R472-E476 IonicContact NE-OE1 2.9Å; R472-E476 PolarHBondContact NE-OE1 2.87Å; R472-E476 IonicContact NH2-OE1 3.64Å; R472-E476 PolarHBondContact NH2-OE1 3.15Å; R472-E476 PolarHBondContact O-N 2.97Å; I473-E476 PolarHBondContact O-N 3.44Å; E476-M479 PolarHBondContact O-N 3.49Å; E476-A480 PolarHBondContact O-N 3.06Å
477	Q	82.2	Confident	83.9	Confident	127 Å²	127	98.4 Å²	98.4	59%	0.593	50%	0.503	S	S	*	.	H	α-helix	trans	-63.9	-43.4	174.4	-73.4	178.5	4.5	0	0	112.5	I473 E474 F475 A480 A481	I473-Q477 HydrophobicContact CG2-CG 4.45Å; I473-Q477 WeakPolarHBondContact O-CG 3.38Å; I473-Q477 PolarHBondContact O-N 3.08Å; E474-Q477 PolarHBondContact O-N 3.03Å; F475-Q477 VanDerWaalsContact C-N 3.33Å; F475-Q477 PolarHBondContact O-N 2.71Å; Q477-A480 PolarHBondContact O-N 2.92Å; Q477-A481 WeakPolarHBondContact O-CB 3.44Å; Q477-A481 PolarHBondContact O-N 3.44Å
478	N	79.5	Confident	83.2	Confident	103 Å²	103	97.9 Å²	97.9	55%	0.551	50%	0.503	S	S	*	.	H	α-helix	trans	-65.3	-38.5	176.4	-85.4	-35.7	0	0	0	112.4	E474 F475 A481 N482	E474-N478 WeakPolarHBondContact O-CB 3.42Å; E474-N478 PolarHBondContact O-N 3.32Å; E474-N478 PolarHBondContact O-ND2 2.9Å; F475-N478 PolarHBondContact O-N 3.32Å; N478-A481 PolarHBondContact O-N 3.37Å; N478-N482 WeakPolarHBondContact O-CB 3.37Å; N478-N482 PolarHBondContact O-N 3.03Å
479	M	79.5	Confident	82.6	Confident	100 Å²	100	93.5 Å²	93.5	49%	0.493	49%	0.49	S	S	.	.	H	α-helix	trans	-60.9	-47.6	173.7	-77.2	-110.3	55.5	0	0	111.1	F475 E476 A481 N482 E483	F475-M479 HydrophobicContact CD1-CG 4.09Å; F475-M479 HydrophobicContact CE1-CG 3.66Å; F475-M479 HydrophobicContact CE1-SD 3.91Å; F475-M479 HydrophobicContact CE2-CG 4.43Å; F475-M479 HydrophobicContact CZ-CG 3.85Å; F475-M479 HydrophobicContact CZ-SD 3.89Å; F475-M479 WeakPolarHBondContact O-CB 3.37Å; F475-M479 WeakPolarHBondContact O-CG 3.46Å; F475-M479 PolarHBondContact O-N 3.13Å; E476-M479 PolarHBondContact O-N 3.49Å; M479-A481 PolarHBondContact O-N 3.2Å; M479-N482 PolarHBondContact O-N 3.16Å; M479-E483 PolarHBondContact O-N 2.97Å
480	A	81	Confident	82	Confident	53 Å²	53	98.2 Å²	98.2	44%	0.438	50%	0.504	S	S	.	.	H	α-helix	trans	-61.9	-41.8	176.8	0	0	0	0	0	112.4	E476 Q477 E483 Q484	E476-A480 PolarHBondContact O-N 3.06Å; Q477-A480 PolarHBondContact O-N 2.92Å; A480-E483 PolarHBondContact O-N 3.24Å; A480-Q484 WeakPolarHBondContact O-CG 3.32Å; A480-Q484 PolarHBondContact O-N 2.96Å; A480-Q484 VanDerWaalsContact O-N 3.15Å
481	A	76.4	Confident	81.7	Confident	51 Å²	51	101.7 Å²	101.7	42%	0.421	52%	0.516	S	S	.	.	H	α-helix	trans	-64.3	-41.6	176.3	0	0	0	0	0	112.3	Q477 N478 M479 E483 Q484 T485	Q477-A481 WeakPolarHBondContact O-CB 3.44Å; Q477-A481 PolarHBondContact O-N 3.44Å; N478-A481 PolarHBondContact O-N 3.37Å; M479-A481 PolarHBondContact O-N 3.2Å; A481-E483 VanDerWaalsContact C-N 3.33Å; A481-E483 PolarHBondContact O-N 3.23Å; A481-Q484 PolarHBondContact O-N 2.93Å; A481-T485 PolarHBondContact O-N 2.83Å; A481-T485 PolarHBondContact O-OG1 2.89Å
482	N	74.4	Confident	81.2	Confident	111 Å²	111	101.8 Å²	101.8	59%	0.594	52%	0.515	S	S	*	.	H	α-helix	trans	-64.6	-37.7	175.9	-84.2	-13.2	0	0	0	112.1	N478 M479 Q484 T485	N478-N482 WeakPolarHBondContact O-CB 3.37Å; N478-N482 PolarHBondContact O-N 3.03Å; M479-N482 PolarHBondContact O-N 3.16Å; N482-Q484 VanDerWaalsContact C-N 3.34Å; N482-Q484 PolarHBondContact O-N 3.4Å; N482-T485 WeakPolarHBondContact O-CB 3.36Å; N482-T485 PolarHBondContact O-N 3.09Å; N482-T485 VanDerWaalsContact O-N 3.15Å
483	E	76.9	Confident	80.9	Confident	151 Å²	151	104.3 Å²	104.3	71%	0.706	53%	0.525	S	S	*	.	H	α-helix	trans	-62.6	-40.8	175.8	-168.8	171	-170.3	0	0	111.8	M479 A480 A481 T485 A486 P487	M479-E483 PolarHBondContact O-N 2.97Å; A480-E483 PolarHBondContact O-N 3.24Å; A481-E483 VanDerWaalsContact C-N 3.33Å; A481-E483 PolarHBondContact O-N 3.23Å; E483-T485 PolarHBondContact O-N 3.06Å; E483-A486 PolarHBondContact O-N 3.5Å; E483-P487 WeakPolarHBondContact O-CD 3.33Å
484	Q	79.1	Confident	80.6	Confident	131 Å²	131	106.8 Å²	106.8	61%	0.612	53%	0.534	S	S	*	.	H	α-helix	trans	-66.7	-22	174.8	-66.7	-68.9	-17.3	0	0	113.7	A480 A481 N482 P487 I488	A480-Q484 WeakPolarHBondContact O-CG 3.32Å; A480-Q484 PolarHBondContact O-N 2.96Å; A480-Q484 VanDerWaalsContact O-N 3.15Å; A481-Q484 PolarHBondContact O-N 2.93Å; N482-Q484 VanDerWaalsContact C-N 3.34Å; N482-Q484 PolarHBondContact O-N 3.4Å; Q484-P487 WeakPolarHBondContact O-CD 3.47Å; Q484-I488 WeakPolarHBondContact O-CD1 3.41Å; Q484-I488 WeakPolarHBondContact O-CG1 3.26Å
485	T	77.5	Confident	80.7	Confident	62 Å²	62	107.2 Å²	107.2	38%	0.38	54%	0.539	S	S	.	.	H	α-helix	trans	-74.6	-27.4	-177.4	-50.5	0	0	0	0	112.1	A481 N482 E483 N489	A481-T485 PolarHBondContact O-N 2.83Å; A481-T485 PolarHBondContact O-OG1 2.89Å; N482-T485 WeakPolarHBondContact O-CB 3.36Å; N482-T485 PolarHBondContact O-N 3.09Å; N482-T485 VanDerWaalsContact O-N 3.15Å; E483-T485 PolarHBondContact O-N 3.06Å; T485-N489 WeakPolarHBondContact O-CB 3.29Å; T485-N489 PolarHBondContact O-N 3.13Å; T485-N489 VanDerWaalsContact O-N 3.1Å; T485-N489 PolarHBondContact O-ND2 2.78Å
486	A	78.3	Confident	80.7	Confident	64 Å²	64	104.8 Å²	104.8	53%	0.529	53%	0.531	S	S	.	.	H	α-helix	trans	-69.5	-46.1	-178.2	0	0	0	0	0	114	E483 N489 R490	E483-A486 PolarHBondContact O-N 3.5Å; A486-N489 PolarHBondContact O-N 2.96Å; A486-R490 PolarHBondContact O-N 3.33Å
487	P	78.1	Confident	80.8	Confident	63 Å²	63	103.2 Å²	103.2	41%	0.409	53%	0.529	S	S	.	.	H	α-helix	trans	-57	-47.7	172.8	-24.8	31.9	0	0	0	113	E483 Q484 N489 R490 E491	E483-P487 WeakPolarHBondContact O-CD 3.33Å; Q484-P487 WeakPolarHBondContact O-CD 3.47Å; P487-N489 VanDerWaalsContact C-N 3.32Å; P487-N489 PolarHBondContact O-N 3.18Å; P487-R490 WeakPolarHBondContact O-CA 3.28Å; P487-R490 VanDerWaalsContact O-CB 3.27Å; P487-R490 WeakPolarHBondContact O-CB 3.39Å; P487-R490 PolarHBondContact O-N 2.94Å; P487-E491 PolarHBondContact O-N 3.04Å
488	I	76.3	Confident	81.1	Confident	102 Å²	102	100.7 Å²	100.7	52%	0.523	53%	0.525	S	S	.	.	H	α-helix	trans	-58.3	-46.2	179.6	-63.2	171.5	0	0	0	110.4	Q484 R490 E491 M492	Q484-I488 WeakPolarHBondContact O-CD1 3.41Å; Q484-I488 WeakPolarHBondContact O-CG1 3.26Å; I488-R490 PolarHBondContact O-N 2.7Å; I488-E491 PolarHBondContact O-N 3.43Å; I488-M492 WeakPolarHBondContact O-CB 3.42Å; I488-M492 PolarHBondContact O-N 2.86Å
489	N	77.5	Confident	81.5	Confident	67 Å²	67	100.7 Å²	100.7	36%	0.358	52%	0.524	S	S	.	.	H	α-helix	trans	-64.5	-27.5	176.3	-79.2	-32.3	0	0	0	113.1	T485 A486 P487 R493	T485-N489 WeakPolarHBondContact O-CB 3.29Å; T485-N489 PolarHBondContact O-N 3.13Å; T485-N489 VanDerWaalsContact O-N 3.1Å; T485-N489 PolarHBondContact O-ND2 2.78Å; A486-N489 PolarHBondContact O-N 2.96Å; P487-N489 VanDerWaalsContact C-N 3.32Å; P487-N489 PolarHBondContact O-N 3.18Å; N489-R493 VanDerWaalsContact O-CG 3.27Å; N489-R493 WeakPolarHBondContact O-CG 3.4Å; N489-R493 PolarHBondContact O-N 2.86Å; N489-R493 PolarHBondContact O-NE 3.37Å
490	R	80.9	Confident	81.9	Confident	181 Å²	181	101.8 Å²	101.8	68%	0.683	53%	0.528	S	S	*	.	H	α-helix	trans	-74.7	-45.3	176.7	-140.1	177	-167.8	159.7	2.8	110.6	A486 P487 I488 R493 H494	A486-R490 PolarHBondContact O-N 3.33Å; P487-R490 WeakPolarHBondContact O-CA 3.28Å; P487-R490 VanDerWaalsContact O-CB 3.27Å; P487-R490 WeakPolarHBondContact O-CB 3.39Å; P487-R490 PolarHBondContact O-N 2.94Å; I488-R490 PolarHBondContact O-N 2.7Å; R490-R493 PolarHBondContact O-N 3.35Å; R490-H494 PolarHBondContact O-CD2 2.85Å; R490-H494 PolarHBondContact O-N 3.25Å
491	E	81.9	Confident	82.2	Confident	136 Å²	136	104.1 Å²	104.1	64%	0.636	53%	0.534	S	S	*	.	H	α-helix	trans	-61	-44.4	175.1	-69.7	178.8	179.2	0	0	111.7	P487 I488 R493 H494 L495	P487-E491 PolarHBondContact O-N 3.04Å; I488-E491 PolarHBondContact O-N 3.43Å; E491-R493 VanDerWaalsContact C-N 3.31Å; E491-R493 PolarHBondContact O-N 3.41Å; E491-H494 PolarHBondContact O-N 2.99Å; E491-H494 VanDerWaalsContact O-N 3.14Å; E491-L495 PolarHBondContact O-N 3.35Å
492	M	80.7	Confident	82.8	Confident	113 Å²	113	106.4 Å²	106.4	56%	0.557	54%	0.535	S	S	*	.	H	α-helix	trans	-60.6	-40.4	178	-165.7	-177.1	177.5	0	0	111.8	I488 L495 I496	I488-M492 WeakPolarHBondContact O-CB 3.42Å; I488-M492 PolarHBondContact O-N 2.86Å; M492-L495 PolarHBondContact O-N 3.45Å; M492-I496 HydrophobicContact CG-CD1 4.39Å; M492-I496 VanDerWaalsContact O-CG1 3.29Å; M492-I496 WeakPolarHBondContact O-CG1 3.29Å; M492-I496 PolarHBondContact O-N 2.87Å; M492-I496 VanDerWaalsContact O-N 3.1Å
493	R	86.2	Confident	83.3	Confident	169 Å²	169	105.2 Å²	105.2	64%	0.638	53%	0.529	S	S	*	.	H	α-helix	trans	-64.3	-44.3	174.1	-72.1	174.2	-141.5	-101.6	4.2	111.8	N489 R490 E491 L495 I496 T497	N489-R493 VanDerWaalsContact O-CG 3.27Å; N489-R493 WeakPolarHBondContact O-CG 3.4Å; N489-R493 PolarHBondContact O-N 2.86Å; N489-R493 PolarHBondContact O-NE 3.37Å; R490-R493 PolarHBondContact O-N 3.35Å; E491-R493 VanDerWaalsContact C-N 3.31Å; E491-R493 PolarHBondContact O-N 3.41Å; R493-L495 VanDerWaalsContact C-N 3.33Å; R493-L495 PolarHBondContact O-N 3.08Å; R493-I496 PolarHBondContact O-N 3.4Å; R493-T497 PolarHBondContact O-N 2.88Å; R493-T497 PolarHBondContact O-OG1 3.46Å; R493-T497 VanDerWaalsContact O-OG1 3.08Å
494	H	85.5	Confident	83.8	Confident	128 Å²	128	100.1 Å²	100.1	59%	0.593	52%	0.517	S	S	*	.	H	α-helix	trans	-60.9	-41.1	176.9	-75.9	-55.6	0	0	0	112.5	R490 E491 T497 S498	R490-H494 PolarHBondContact O-CD2 2.85Å; R490-H494 PolarHBondContact O-N 3.25Å; E491-H494 PolarHBondContact O-N 2.99Å; E491-H494 VanDerWaalsContact O-N 3.14Å; H494-T497 PolarHBondContact O-N 3.41Å; H494-S498 WeakPolarHBondContact O-CB 3.3Å; H494-S498 PolarHBondContact O-N 3.31Å
495	L	89	Confident	84.2	Confident	106 Å²	106	99.7 Å²	99.7	56%	0.555	52%	0.515	S	S	*	.	H	α-helix	trans	-62.6	-45.6	177	-175.3	64.5	0	0	0	111.6	E491 M492 R493 T497 S498 L499	E491-L495 PolarHBondContact O-N 3.35Å; M492-L495 PolarHBondContact O-N 3.45Å; R493-L495 VanDerWaalsContact C-N 3.33Å; R493-L495 PolarHBondContact O-N 3.08Å; L495-T497 PolarHBondContact O-N 3.28Å; L495-S498 PolarHBondContact O-N 2.74Å; L495-L499 HydrophobicContact CD1-CD1 4.45Å; L495-L499 HydrophobicContact CD1-CG 4.49Å; L495-L499 HydrophobicContact CG-CD1 4.14Å; L495-L499 WeakPolarHBondContact O-CB 3.28Å; L495-L499 WeakPolarHBondContact O-CG 3.48Å; L495-L499 PolarHBondContact O-N 3.19Å
496	I	86.4	Confident	84.5	Confident	80 Å²	80	100.4 Å²	100.4	41%	0.41	52%	0.516	S	S	.	.	H	α-helix	trans	-59.6	-47.1	177.2	-68.9	165.9	0	0	0	110.5	M492 R493 S498 L499 Q500	M492-I496 HydrophobicContact CG-CD1 4.39Å; M492-I496 VanDerWaalsContact O-CG1 3.29Å; M492-I496 WeakPolarHBondContact O-CG1 3.29Å; M492-I496 PolarHBondContact O-N 2.87Å; M492-I496 VanDerWaalsContact O-N 3.1Å; R493-I496 PolarHBondContact O-N 3.4Å; I496-S498 VanDerWaalsContact C-N 3.33Å; I496-S498 PolarHBondContact O-N 3.46Å; I496-L499 PolarHBondContact O-N 3.11Å; I496-Q500 HydrophobicContact CG2-CG 4.45Å; I496-Q500 WeakPolarHBondContact O-CB 3.4Å; I496-Q500 VanDerWaalsContact O-CG 3.26Å; I496-Q500 WeakPolarHBondContact O-CG 3.48Å; I496-Q500 PolarHBondContact O-N 3.41Å
497	T	90	Very high	84.8	Confident	69 Å²	69	103.7 Å²	103.7	42%	0.423	52%	0.518	S	S	.	.	H	α-helix	trans	-62.6	-40.2	177.8	-54.3	0	0	0	0	112.1	R493 H494 L495 Q500 N501	R493-T497 PolarHBondContact O-N 2.88Å; R493-T497 PolarHBondContact O-OG1 3.46Å; R493-T497 VanDerWaalsContact O-OG1 3.08Å; H494-T497 PolarHBondContact O-N 3.41Å; L495-T497 PolarHBondContact O-N 3.28Å; T497-Q500 PolarHBondContact O-N 2.89Å; T497-N501 PolarHBondContact O-N 2.66Å
498	S	89	Confident	85.2	Confident	74 Å²	74	102.2 Å²	102.2	52%	0.517	52%	0.515	S	S	.	.	H	α-helix	trans	-64.2	-45.7	177.6	-169.9	0	0	0	0	111.9	H494 L495 I496 Q500 N501 H502	H494-S498 WeakPolarHBondContact O-CB 3.3Å; H494-S498 PolarHBondContact O-N 3.31Å; L495-S498 PolarHBondContact O-N 2.74Å; I496-S498 VanDerWaalsContact C-N 3.33Å; I496-S498 PolarHBondContact O-N 3.46Å; S498-Q500 VanDerWaalsContact C-N 3.35Å; S498-Q500 PolarHBondContact O-N 2.76Å; S498-N501 PolarHBondContact O-N 3.19Å; S498-H502 PolarHBondContact O-N 3.2Å
499	L	87.3	Confident	85.6	Confident	103 Å²	103	102.3 Å²	102.3	54%	0.539	51%	0.513	S	S	.	.	H	α-helix	trans	-63.6	-39.3	176.1	-72.1	172.6	0	0	0	112.1	L495 I496 H502 N503	L495-L499 HydrophobicContact CD1-CD1 4.45Å; L495-L499 HydrophobicContact CD1-CG 4.49Å; L495-L499 HydrophobicContact CG-CD1 4.14Å; L495-L499 WeakPolarHBondContact O-CB 3.28Å; L495-L499 WeakPolarHBondContact O-CG 3.48Å; L495-L499 PolarHBondContact O-N 3.19Å; I496-L499 PolarHBondContact O-N 3.11Å; L499-H502 PolarHBondContact O-N 3.35Å; L499-N503 WeakPolarHBondContact O-CB 3.43Å; L499-N503 PolarHBondContact O-N 2.96Å
500	Q	87.7	Confident	85.9	Confident	123 Å²	123	103.7 Å²	103.7	58%	0.575	52%	0.524	S	S	*	.	H	α-helix	trans	-61.9	-43.8	174.6	-76.2	173.4	-20.3	0	0	111.9	I496 T497 S498 N503 G504	I496-Q500 HydrophobicContact CG2-CG 4.45Å; I496-Q500 WeakPolarHBondContact O-CB 3.4Å; I496-Q500 VanDerWaalsContact O-CG 3.26Å; I496-Q500 WeakPolarHBondContact O-CG 3.48Å; I496-Q500 PolarHBondContact O-N 3.41Å; T497-Q500 PolarHBondContact O-N 2.89Å; S498-Q500 VanDerWaalsContact C-N 3.35Å; S498-Q500 PolarHBondContact O-N 2.76Å; Q500-N503 PolarHBondContact O-N 2.77Å; Q500-G504 PolarHBondContact O-N 3.27Å
501	N	87.7	Confident	86.1	Confident	102 Å²	102	101.6 Å²	101.6	55%	0.545	52%	0.522	S	S	.	.	H	α-helix	trans	-64	-44.5	176.5	-75.7	-16.6	0	0	0	112.1	T497 S498 N503 G504 Q505	T497-N501 PolarHBondContact O-N 2.66Å; S498-N501 PolarHBondContact O-N 3.19Å; N501-N503 VanDerWaalsContact C-N 3.33Å; N501-N503 PolarHBondContact O-N 2.92Å; N501-G504 PolarHBondContact O-N 3.33Å; N501-G504 VanDerWaalsContact O-N 3.15Å; N501-Q505 PolarHBondContact O-N 3.22Å
502	H	87.8	Confident	86.3	Confident	99 Å²	99	104.8 Å²	104.8	46%	0.458	53%	0.528	S	S	.	.	H	α-helix	trans	-62.7	-40.8	177.8	-173	49	0	0	0	112	S498 L499 G504 Q505 L506	S498-H502 PolarHBondContact O-N 3.2Å; L499-H502 PolarHBondContact O-N 3.35Å; H502-G504 VanDerWaalsContact C-N 3.28Å; H502-G504 PolarHBondContact O-N 2.94Å; H502-Q505 WeakPolarHBondContact O-CB 3.42Å; H502-Q505 PolarHBondContact O-N 2.85Å; H502-Q505 VanDerWaalsContact O-N 3.17Å; H502-L506 PolarHBondContact O-N 3.25Å
503	N	85	Confident	86.5	Confident	87 Å²	87	107 Å²	107	47%	0.465	53%	0.531	S	S	.	.	H	α-helix	trans	-62.5	-37.4	175	-151	-69.8	0	0	0	111.7	L499 Q500 N501 K507	L499-N503 WeakPolarHBondContact O-CB 3.43Å; L499-N503 PolarHBondContact O-N 2.96Å; Q500-N503 PolarHBondContact O-N 2.77Å; N501-N503 VanDerWaalsContact C-N 3.33Å; N501-N503 PolarHBondContact O-N 2.92Å; N503-K507 WeakPolarHBondContact O-CG 3.32Å; N503-K507 PolarHBondContact O-N 3.14Å; N503-K507 VanDerWaalsContact O-N 3.08Å; N503-K507 WeakPolarHBondContact OD1-CE 3.42Å
504	G	86.9	Confident	86.3	Confident	44 Å²	44	105.8 Å²	105.8	45%	0.454	53%	0.531	S	S	.	.	H	α-helix	trans	-61.6	-43.1	172	0	0	0	0	0	113.3	Q500 N501 H502 K507 G508	Q500-G504 PolarHBondContact O-N 3.27Å; N501-G504 PolarHBondContact O-N 3.33Å; N501-G504 VanDerWaalsContact O-N 3.15Å; H502-G504 VanDerWaalsContact C-N 3.28Å; H502-G504 PolarHBondContact O-N 2.94Å; G504-K507 PolarHBondContact O-N 3.09Å; G504-G508 PolarHBondContact O-N 3.4Å
505	Q	88	Confident	86.3	Confident	122 Å²	122	108.1 Å²	108.1	57%	0.57	53%	0.534	S	S	*	.	H	α-helix	trans	-63.2	-48.4	176.5	-70.1	173.1	-6.7	0	0	111.9	N501 H502 K507 G508 E509	N501-Q505 PolarHBondContact O-N 3.22Å; H502-Q505 WeakPolarHBondContact O-CB 3.42Å; H502-Q505 PolarHBondContact O-N 2.85Å; H502-Q505 VanDerWaalsContact O-N 3.17Å; Q505-K507 VanDerWaalsContact C-N 3.29Å; Q505-K507 PolarHBondContact O-N 3.4Å; Q505-G508 WeakPolarHBondContact O-CA 3.5Å; Q505-G508 PolarHBondContact O-N 3.05Å; Q505-E509 PolarHBondContact O-N 2.89Å
506	L	83.7	Confident	86.1	Confident	76 Å²	76	109.9 Å²	109.9	40%	0.398	54%	0.537	S	S	.	.	H	α-helix	trans	-57	-41.9	177	-80.5	163.5	0	0	0	111.9	H502 G508 E509 V510	H502-L506 PolarHBondContact O-N 3.25Å; L506-G508 VanDerWaalsContact C-N 3.3Å; L506-G508 PolarHBondContact O-N 3.22Å; L506-E509 PolarHBondContact O-N 3.16Å; L506-V510 VanDerWaalsContact O-CG2 3.31Å; L506-V510 WeakPolarHBondContact O-CG2 3.47Å; L506-V510 PolarHBondContact O-N 3.49Å
507	K	84.5	Confident	85.9	Confident	133 Å²	133	114.3 Å²	114.3	58%	0.578	55%	0.55	S	S	*	*	H	α-helix	trans	-59.8	-39.4	173.8	-76.2	177.2	-178.6	178.8	0	112.4	N503 G504 Q505 Q511	N503-K507 WeakPolarHBondContact O-CG 3.32Å; N503-K507 PolarHBondContact O-N 3.14Å; N503-K507 VanDerWaalsContact O-N 3.08Å; N503-K507 WeakPolarHBondContact OD1-CE 3.42Å; G504-K507 PolarHBondContact O-N 3.09Å; Q505-K507 VanDerWaalsContact C-N 3.29Å; Q505-K507 PolarHBondContact O-N 3.4Å; K507-Q511 WeakPolarHBondContact O-CG 3.33Å; K507-Q511 PolarHBondContact O-N 3.16Å
508	G	86.6	Confident	85.6	Confident	33 Å²	33	117.4 Å²	117.4	34%	0.34	56%	0.558	S	S	.	*	H	α-helix	trans	-66.9	-40.6	175.9	0	0	0	0	0	113.4	G504 Q505 L506 Q511 R512	G504-G508 PolarHBondContact O-N 3.4Å; Q505-G508 WeakPolarHBondContact O-CA 3.5Å; Q505-G508 PolarHBondContact O-N 3.05Å; L506-G508 VanDerWaalsContact C-N 3.3Å; L506-G508 PolarHBondContact O-N 3.22Å; G508-Q511 PolarHBondContact O-N 3.27Å; G508-R512 PolarHBondContact O-N 2.96Å
509	E	85	Confident	85.4	Confident	104 Å²	104	118 Å²	118	49%	0.486	56%	0.555	S	S	.	*	H	α-helix	trans	-64.7	-44.9	176.3	-70.6	-177.9	174.3	0	0	112	Q505 L506 Q511 R512 Y513	Q505-E509 PolarHBondContact O-N 2.89Å; L506-E509 PolarHBondContact O-N 3.16Å; E509-Q511 VanDerWaalsContact C-N 3.27Å; E509-Q511 PolarHBondContact O-N 3.36Å; E509-R512 WeakPolarHBondContact O-CA 3.47Å; E509-R512 WeakPolarHBondContact O-CB 3.32Å; E509-R512 PolarHBondContact O-N 3.36Å; E509-Y513 HydrophobicContact CB-CE2 4.4Å; E509-Y513 WeakPolarHBondContact O-CD2 3.45Å; E509-Y513 PolarHBondContact O-N 3.11Å
510	V	84.2	Confident	85	Confident	96 Å²	96	117 Å²	117	58%	0.582	55%	0.553	S	S	*	*	H	α-helix	trans	-56.9	-42.7	174.9	170.4	0	0	0	0	110.9	L506 R512 Y513 K514	L506-V510 VanDerWaalsContact O-CG2 3.31Å; L506-V510 WeakPolarHBondContact O-CG2 3.47Å; L506-V510 PolarHBondContact O-N 3.49Å; V510-R512 VanDerWaalsContact C-N 3.34Å; V510-R512 PolarHBondContact O-N 3.16Å; V510-Y513 PolarHBondContact O-N 3.44Å; V510-K514 WeakPolarHBondContact O-CB 3.41Å; V510-K514 PolarHBondContact O-N 3.01Å
511	Q	84.7	Confident	84.6	Confident	136 Å²	136	113.7 Å²	113.7	64%	0.636	54%	0.544	S	S	*	.	H	α-helix	trans	-63.6	-37.8	175.1	-75.4	-179.9	-2.6	0	0	112.8	K507 G508 E509 R515	K507-Q511 WeakPolarHBondContact O-CG 3.33Å; K507-Q511 PolarHBondContact O-N 3.16Å; G508-Q511 PolarHBondContact O-N 3.27Å; E509-Q511 VanDerWaalsContact C-N 3.27Å; E509-Q511 PolarHBondContact O-N 3.36Å; Q511-R515 PolarHBondContact O-N 3.46Å; Q511-R515 VanDerWaalsContact O-N 3.14Å
512	R	86.1	Confident	84.3	Confident	204 Å²	204	112.1 Å²	112.1	77%	0.77	54%	0.538	S	S	*	.	H	α-helix	trans	-63.6	-48.8	175	-102.6	-174.1	168.8	-148.5	-1.9	112	G508 E509 V510 K514 R515 K516	G508-R512 PolarHBondContact O-N 2.96Å; E509-R512 WeakPolarHBondContact O-CA 3.47Å; E509-R512 WeakPolarHBondContact O-CB 3.32Å; E509-R512 PolarHBondContact O-N 3.36Å; V510-R512 VanDerWaalsContact C-N 3.34Å; V510-R512 PolarHBondContact O-N 3.16Å; R512-K514 VanDerWaalsContact C-N 3.31Å; R512-K514 PolarHBondContact O-N 2.91Å; R512-R515 PolarHBondContact O-N 3.5Å; R512-K516 PolarHBondContact O-N 2.92Å
513	Y	84.7	Confident	83.9	Confident	160 Å²	160	111.3 Å²	111.3	63%	0.627	54%	0.537	S	S	*	.	H	α-helix	trans	-62.4	-39.8	178.1	-73.6	-63.5	0	0	0	111.9	E509 V510 R515 K516 Y517	E509-Y513 HydrophobicContact CB-CE2 4.4Å; E509-Y513 WeakPolarHBondContact O-CD2 3.45Å; E509-Y513 PolarHBondContact O-N 3.11Å; V510-Y513 PolarHBondContact O-N 3.44Å; Y513-R515 VanDerWaalsContact C-N 3.28Å; Y513-R515 PolarHBondContact O-N 3.12Å; Y513-K516 PolarHBondContact O-N 3.18Å; Y513-Y517 WeakPolarHBondContact O-CB 3.49Å; Y513-Y517 PolarHBondContact O-N 3.47Å
514	K	82.3	Confident	83.3	Confident	143 Å²	143	111 Å²	111	62%	0.622	54%	0.535	S	S	*	.	H	α-helix	trans	-61	-36.2	175.7	-165.4	171.7	-174	172.9	0	112.6	V510 R512 K518	V510-K514 WeakPolarHBondContact O-CB 3.41Å; V510-K514 PolarHBondContact O-N 3.01Å; R512-K514 VanDerWaalsContact C-N 3.31Å; R512-K514 PolarHBondContact O-N 2.91Å; K514-K518 PolarHBondContact O-N 3.3Å
515	R	86.6	Confident	82.9	Confident	176 Å²	176	114.4 Å²	114.4	66%	0.664	54%	0.543	S	S	*	.	H	α-helix	trans	-69.4	-48.4	174.9	-165.3	-176.9	-55.7	-150.4	1	111.4	Q511 R512 Y513 Y517 K518 D519	Q511-R515 PolarHBondContact O-N 3.46Å; Q511-R515 VanDerWaalsContact O-N 3.14Å; R512-R515 PolarHBondContact O-N 3.5Å; Y513-R515 VanDerWaalsContact C-N 3.28Å; Y513-R515 PolarHBondContact O-N 3.12Å; R515-Y517 VanDerWaalsContact C-N 3.27Å; R515-Y517 PolarHBondContact O-N 3.07Å; R515-K518 WeakPolarHBondContact O-CB 3.49Å; R515-K518 PolarHBondContact O-N 2.78Å; R515-D519 PolarHBondContact O-N 2.74Å
516	K	84.8	Confident	82.5	Confident	143 Å²	143	114.1 Å²	114.1	62%	0.622	54%	0.54	S	S	*	.	H	α-helix	trans	-59.8	-37.5	179.5	-155.8	177.6	-174.1	-175	0	112.3	R512 Y513 T520	R512-K516 PolarHBondContact O-N 2.92Å; Y513-K516 PolarHBondContact O-N 3.18Å; K516-T520 WeakPolarHBondContact O-CB 3.44Å; K516-T520 PolarHBondContact O-N 3.2Å; K516-T520 PolarHBondContact O-OG1 2.98Å
517	Y	80.8	Confident	82.2	Confident	173 Å²	173	115.4 Å²	115.4	68%	0.678	55%	0.546	S	S	*	.	H	α-helix	trans	-62.3	-46.8	172.8	178.6	-95.7	0	0	0	112.2	Y513 R515 D519 T520 S521	Y513-Y517 WeakPolarHBondContact O-CB 3.49Å; Y513-Y517 PolarHBondContact O-N 3.47Å; R515-Y517 VanDerWaalsContact C-N 3.27Å; R515-Y517 PolarHBondContact O-N 3.07Å; Y517-D519 PolarHBondContact O-N 3.33Å; Y517-T520 PolarHBondContact O-N 3.2Å; Y517-S521 WeakPolarHBondContact O-CB 3.45Å; Y517-S521 PolarHBondContact O-N 3.39Å
518	K	84.9	Confident	81.7	Confident	135 Å²	135	117.9 Å²	117.9	59%	0.587	55%	0.552	S	S	*	*	H	α-helix	trans	-58.8	-46.5	176.4	-78.2	-173.1	173.5	-166.9	0	111.9	K514 R515 S521 T522	K514-K518 PolarHBondContact O-N 3.3Å; R515-K518 WeakPolarHBondContact O-CB 3.49Å; R515-K518 PolarHBondContact O-N 2.78Å; K518-S521 PolarHBondContact O-N 2.9Å; K518-T522 WeakPolarHBondContact O-CG2 3.45Å; K518-T522 PolarHBondContact O-N 3.39Å; K518-T522 PolarHBondContact O-OG1 3.27Å
519	D	83.2	Confident	81.3	Confident	86 Å²	86	122.6 Å²	122.6	46%	0.46	57%	0.565	S	S	.	*	H	α-helix	trans	-62.3	-46.4	-179.8	-59.3	-23.4	0	0	0	111	R515 Y517 S521 T522 D523	R515-D519 PolarHBondContact O-N 2.74Å; Y517-D519 PolarHBondContact O-N 3.33Å; D519-S521 VanDerWaalsContact C-N 3.33Å; D519-S521 PolarHBondContact O-N 2.88Å; D519-T522 PolarHBondContact O-N 3.46Å; D519-T522 VanDerWaalsContact O-N 3.16Å; D519-T522 PolarHBondContact O-OG1 2.88Å; D519-D523 PolarHBondContact O-N 3.42Å
520	T	80.5	Confident	81	Confident	81 Å²	81	123.5 Å²	123.5	50%	0.497	57%	0.569	S	S	.	*	H	α-helix	trans	-63.3	-39.1	178.4	-46.4	0	0	0	0	111.8	K516 Y517 T522 D523 N524	K516-T520 WeakPolarHBondContact O-CB 3.44Å; K516-T520 PolarHBondContact O-N 3.2Å; K516-T520 PolarHBondContact O-OG1 2.98Å; Y517-T520 PolarHBondContact O-N 3.2Å; T520-T522 VanDerWaalsContact C-N 3.34Å; T520-D523 PolarHBondContact O-N 2.94Å; T520-N524 PolarHBondContact O-N 3.33Å
521	S	78.6	Confident	80.5	Confident	54 Å²	54	124.4 Å²	124.4	38%	0.378	57%	0.57	S	S	.	*	H	α-helix	trans	-63.2	-39.9	175.6	178.4	0	0	0	0	111.8	Y517 K518 D519 N524 L525	Y517-S521 WeakPolarHBondContact O-CB 3.45Å; Y517-S521 PolarHBondContact O-N 3.39Å; K518-S521 PolarHBondContact O-N 2.9Å; D519-S521 VanDerWaalsContact C-N 3.33Å; D519-S521 PolarHBondContact O-N 2.88Å; S521-N524 PolarHBondContact O-N 3.49Å; S521-L525 PolarHBondContact O-N 3.47Å
522	T	82.4	Confident	80	Confident	70 Å²	70	120.6 Å²	120.6	43%	0.429	56%	0.562	S	S	.	*	H	α-helix	trans	-69.4	-34.2	176.6	54.1	0	0	0	0	113.4	K518 D519 T520 L525 K526	K518-T522 WeakPolarHBondContact O-CG2 3.45Å; K518-T522 PolarHBondContact O-N 3.39Å; K518-T522 PolarHBondContact O-OG1 3.27Å; D519-T522 PolarHBondContact O-N 3.46Å; D519-T522 VanDerWaalsContact O-N 3.16Å; D519-T522 PolarHBondContact O-OG1 2.88Å; T520-T522 VanDerWaalsContact C-N 3.34Å; T522-L525 PolarHBondContact O-N 2.9Å; T522-K526 PolarHBondContact O-N 3.49Å
523	D	79.1	Confident	79.5	Confident	82 Å²	82	116.1 Å²	116.1	44%	0.439	55%	0.553	S	S	.	*	H	α-helix	trans	-73.3	-33.7	176.2	-72.9	-19	0	0	0	112	D519 T520 L525 K526 L527	D519-D523 PolarHBondContact O-N 3.42Å; T520-D523 PolarHBondContact O-N 2.94Å; D523-L525 VanDerWaalsContact C-N 3.32Å; D523-L525 PolarHBondContact O-N 3.27Å; D523-K526 PolarHBondContact O-N 3.48Å; D523-K526 IonicContact OD1-NZ 3.29Å; D523-K526 PolarHBondContact OD1-NZ 2.85Å; D523-L527 WeakPolarHBondContact O-CG 3.27Å; D523-L527 PolarHBondContact O-N 3.35Å
524	N	71.3	Confident	78.8	Confident	80 Å²	80	110.9 Å²	110.9	43%	0.428	54%	0.543	S	S	.	.	H	α-helix	trans	-61.8	-39.8	173.5	-132.4	-89.3	0	0	0	112.1	T520 S521 L527 R528	T520-N524 PolarHBondContact O-N 3.33Å; S521-N524 PolarHBondContact O-N 3.49Å; N524-L527 PolarHBondContact O-N 3.2Å; N524-R528 WeakPolarHBondContact O-CG 3.47Å; N524-R528 PolarHBondContact O-N 3.34Å
525	L	78.5	Confident	78.2	Confident	116 Å²	116	108.8 Å²	108.8	61%	0.607	54%	0.538	S	S	*	.	H	α-helix	trans	-59.2	-44.8	174	-95.1	150.4	0	0	0	112	S521 T522 D523 R528 Q529	S521-L525 PolarHBondContact O-N 3.47Å; T522-L525 PolarHBondContact O-N 2.9Å; D523-L525 VanDerWaalsContact C-N 3.32Å; D523-L525 PolarHBondContact O-N 3.27Å; L525-R528 PolarHBondContact O-N 2.86Å; L525-Q529 PolarHBondContact O-N 3.46Å
526	K	80.8	Confident	77.2	Confident	116 Å²	116	103.6 Å²	103.6	50%	0.504	53%	0.533	S	S	.	.	H	α-helix	trans	-64.5	-45.9	177	-66.1	173.9	-168.6	156.6	0	112	T522 D523 R528 Q529 E530	T522-K526 PolarHBondContact O-N 3.49Å; D523-K526 PolarHBondContact O-N 3.48Å; D523-K526 IonicContact OD1-NZ 3.29Å; D523-K526 PolarHBondContact OD1-NZ 2.85Å; K526-R528 VanDerWaalsContact C-N 3.32Å; K526-R528 PolarHBondContact O-N 2.98Å; K526-Q529 WeakPolarHBondContact O-CB 3.45Å; K526-Q529 PolarHBondContact O-N 3.05Å; K526-Q529 VanDerWaalsContact O-N 3.08Å; K526-E530 PolarHBondContact O-N 2.88Å
527	L	76.3	Confident	76.2	Confident	103 Å²	103	101.5 Å²	101.5	54%	0.539	53%	0.533	S	S	.	.	H	α-helix	trans	-62.5	-37.9	179.2	-75	168.5	0	0	0	112.3	D523 N524 Q529 E530 L531	D523-L527 WeakPolarHBondContact O-CG 3.27Å; D523-L527 PolarHBondContact O-N 3.35Å; N524-L527 PolarHBondContact O-N 3.2Å; L527-Q529 VanDerWaalsContact C-N 3.29Å; L527-Q529 PolarHBondContact O-N 3.44Å; L527-E530 PolarHBondContact O-N 3.45Å; L527-L531 WeakPolarHBondContact O-CB 3.48Å; L527-L531 PolarHBondContact O-N 3.23Å
528	R	75.6	Confident	75.1	Confident	184 Å²	184	97.9 Å²	97.9	69%	0.694	52%	0.524	S	S	*	.	H	α-helix	trans	-63.8	-36.6	173.9	-76.2	-173.9	179.3	-149.5	0.8	112	N524 L525 K526 A532	N524-R528 WeakPolarHBondContact O-CG 3.47Å; N524-R528 PolarHBondContact O-N 3.34Å; L525-R528 PolarHBondContact O-N 2.86Å; K526-R528 VanDerWaalsContact C-N 3.32Å; K526-R528 PolarHBondContact O-N 2.98Å; R528-A532 PolarHBondContact O-N 3.38Å; R528-A532 VanDerWaalsContact O-N 3.12Å
529	Q	77.6	Confident	73.8	Confident	133 Å²	133	99 Å²	99	62%	0.621	53%	0.532	S	S	*	.	H	α-helix	trans	-69.4	-43.5	177.8	-155.2	158.8	12.5	0	0	111.4	L525 K526 L527 L531 A532 D533	L525-Q529 PolarHBondContact O-N 3.46Å; K526-Q529 WeakPolarHBondContact O-CB 3.45Å; K526-Q529 PolarHBondContact O-N 3.05Å; K526-Q529 VanDerWaalsContact O-N 3.08Å; L527-Q529 VanDerWaalsContact C-N 3.29Å; L527-Q529 PolarHBondContact O-N 3.44Å; Q529-L531 VanDerWaalsContact C-N 3.34Å; Q529-L531 PolarHBondContact O-N 2.96Å; Q529-A532 PolarHBondContact O-N 2.91Å; Q529-D533 PolarHBondContact O-N 3.48Å; Q529-D533 VanDerWaalsContact O-N 3.16Å
530	E	78.3	Confident	72.4	Confident	123 Å²	123	97.9 Å²	97.9	58%	0.575	54%	0.54	S	S	*	.	H	α-helix	trans	-62.5	-37.7	173.9	-69.7	175.4	-178.5	0	0	112.7	K526 L527 D533 A534	K526-E530 PolarHBondContact O-N 2.88Å; L527-E530 PolarHBondContact O-N 3.45Å; E530-D533 PolarHBondContact O-N 2.77Å; E530-A534 PolarHBondContact O-N 2.89Å
531	L	73.2	Confident	70.9	Confident	115 Å²	115	100.9 Å²	100.9	60%	0.602	55%	0.553	S	S	*	*	H	α-helix	trans	-66.2	-39.7	176.7	-164.6	85.1	0	0	0	111.9	L527 Q529 D533 A534 L535	L527-L531 WeakPolarHBondContact O-CB 3.48Å; L527-L531 PolarHBondContact O-N 3.23Å; Q529-L531 VanDerWaalsContact C-N 3.34Å; Q529-L531 PolarHBondContact O-N 2.96Å; L531-D533 VanDerWaalsContact C-N 3.33Å; L531-A534 PolarHBondContact O-N 3.49Å; L531-L535 PolarHBondContact O-N 3.36Å
532	A	74.2	Confident	69.3	Low	56 Å²	56	106 Å²	106	46%	0.463	57%	0.569	S	S	.	*	H	α-helix	trans	-62.6	-41.5	175.9	0	0	0	0	0	111.4	R528 Q529 A534 L535 A536	R528-A532 PolarHBondContact O-N 3.38Å; R528-A532 VanDerWaalsContact O-N 3.12Å; Q529-A532 PolarHBondContact O-N 2.91Å; A532-A534 PolarHBondContact O-N 3.39Å; A532-L535 PolarHBondContact O-N 2.99Å; A532-A536 PolarHBondContact O-N 3.42Å; A532-A536 VanDerWaalsContact O-N 3.08Å
533	D	76.1	Confident	67	Low	109 Å²	109	110.7 Å²	110.7	58%	0.583	59%	0.59	S	S	*	*	H	α-helix	trans	-65.7	-36.8	176.7	-68.1	-20.2	0	0	0	112.3	Q529 E530 L531 T537	Q529-D533 PolarHBondContact O-N 3.48Å; Q529-D533 VanDerWaalsContact O-N 3.16Å; E530-D533 PolarHBondContact O-N 2.77Å; L531-D533 VanDerWaalsContact C-N 3.33Å; D533-T537 PolarHBondContact O-N 2.99Å; D533-T537 PolarHBondContact O-OG1 3.47Å
534	A	70.8	Confident	64.7	Low	50 Å²	50	115.3 Å²	115.3	41%	0.413	61%	0.609	S	S	.	*	H	α-helix	trans	-70.3	-35.5	176.6	0	0	0	0	0	113.2	E530 L531 A532 T537 L538	E530-A534 PolarHBondContact O-N 2.89Å; L531-A534 PolarHBondContact O-N 3.49Å; A532-A534 PolarHBondContact O-N 3.39Å; A534-T537 WeakPolarHBondContact CA-OG1 3.49Å; A534-T537 PolarHBondContact O-OG1 3.16Å; A534-L538 PolarHBondContact O-N 3.24Å
535	L	68.8	Low	62.7	Low	100 Å²	100	116.1 Å²	116.1	52%	0.524	63%	0.627	S	S	.	*	H	α-helix	trans	-72.5	-38.7	176.1	-75.9	169.8	0	0	0	111.9	L531 A532 T537 L538 E539	L531-L535 PolarHBondContact O-N 3.36Å; A532-L535 PolarHBondContact O-N 2.99Å; L535-T537 VanDerWaalsContact C-N 3.27Å; L535-T537 PolarHBondContact O-N 3.44Å; L535-L538 PolarHBondContact O-N 3.12Å; L535-L538 VanDerWaalsContact O-N 3.07Å; L535-E539 PolarHBondContact O-N 3.44Å
536	A	64.6	Low	60.3	Low	67 Å²	67	114.5 Å²	114.5	55%	0.554	63%	0.63	S	S	*	*	H	α-helix	trans	-60.9	-35.5	175.1	0	0	0	0	0	112.5	A532	A532-A536 PolarHBondContact O-N 3.42Å; A532-A536 VanDerWaalsContact O-N 3.08Å
537	T	64.5	Low	57.6	Low	99 Å²	99	116 Å²	116	61%	0.607	65%	0.649	S	S	*	*	H	α-helix	trans	-73.8	-28.9	174.2	38.9	0	0	0	0	113	D533 A534 L535	D533-T537 PolarHBondContact O-N 2.99Å; D533-T537 PolarHBondContact O-OG1 3.47Å; A534-T537 WeakPolarHBondContact CA-OG1 3.49Å; A534-T537 PolarHBondContact O-OG1 3.16Å; L535-T537 VanDerWaalsContact C-N 3.27Å; L535-T537 PolarHBondContact O-N 3.44Å
538	L	57.4	Low	55.2	Low	96 Å²	96	114.7 Å²	114.7	50%	0.503	66%	0.661	S	S	.	*	H	α-helix	trans	-79.3	-37.2	179.2	-139.9	105.1	0	0	0	113.2	A534 L535 G540 N541 K542	A534-L538 PolarHBondContact O-N 3.24Å; L535-L538 PolarHBondContact O-N 3.12Å; L535-L538 VanDerWaalsContact O-N 3.07Å; L538-G540 VanDerWaalsContact C-N 3.3Å; L538-G540 PolarHBondContact O-N 3.43Å; L538-N541 PolarHBondContact O-N 3.48Å; L538-K542 HydrophobicContact CD2-CD 4.4Å
539	E	57.7	Low	52.8	Low	160 Å²	160	110.8 Å²	110.8	75%	0.748	67%	0.668	S	S	*	*	H	α-helix	trans	-67.1	-30.5	175.4	-84.1	-174.5	152.8	0	0	112.4	L535 N541	L535-E539 PolarHBondContact O-N 3.44Å; E539-N541 PolarHBondContact O-N 2.92Å
540	G	53.5	Low	50.3	Low	61 Å²	61	109.8 Å²	109.8	63%	0.629	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.3	-25.6	174	0	0	0	0	0	114.5	L538	L538-G540 VanDerWaalsContact C-N 3.3Å; L538-G540 PolarHBondContact O-N 3.43Å
541	N	49.3	Very low	47.8	Very low	145 Å²	145	107.6 Å²	107.6	78%	0.775	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	-1.1	-171.1	-88.3	1.2	0	0	0	115.8	L538 E539	L538-N541 PolarHBondContact O-N 3.48Å; E539-N541 PolarHBondContact O-N 2.92Å
542	K	44.6	Very low	45.4	Very low	162 Å²	162	111 Å²	111	70%	0.704	71%	0.705	S	S	*	*			trans	-108.4	11.5	-175.5	-77.7	-172.8	176.8	-179.4	0	116.4	L538 Q544	L538-K542 HydrophobicContact CD2-CD 4.4Å; K542-Q544 PolarHBondContact O-N 2.97Å
543	L	33.8	Very low	43.2	Very low	167 Å²	167	116.3 Å²	116.3	87%	0.874	72%	0.721	S	S	*	*	S	Bend	trans	-82.4	13.1	173	-109.7	143.2	0	0	0	114.7
544	Q	31.1	Very low	40.9	Very low	179 Å²	179	119.3 Å²	119.3	84%	0.836	74%	0.735	S	S	*	*	S	Bend	trans	-129.2	126.6	170.2	-78.3	179.5	-5.2	0	0	111.7	K542	K542-Q544 PolarHBondContact O-N 2.97Å
545	A	30.6	Very low	38.9	Very low	97 Å²	97	126 Å²	126	80%	0.802	76%	0.755	S	S	*	*			trans	79.9	80.6	160.5	0	0	0	0	0	118.7
546	A	26.8	Very low	36.7	Very low	83 Å²	83	128.7 Å²	128.7	69%	0.686	76%	0.764	S	S	*	*				53.1	116.9	109.9	0	0	0	0	0	121.1
547	T	25.1	Very low	34.8	Very low	146 Å²	146	132.5 Å²	132.5	90%	0.896	77%	0.771	S	S	*	*				69.2	125.8	126.2	60.6	0	0	0	0	121.9
548	G	25.1	Very low	33	Very low	76 Å²	76	134.5 Å²	134.5	78%	0.784	78%	0.778	S	S	*	*			trans	132.7	92.6	159.2	0	0	0	0	0	112.3
549	A	25.3	Very low	31.5	Very low	103 Å²	103	134.7 Å²	134.7	85%	0.851	79%	0.787	S	S	*	*				77.5	103.2	82.9	0	0	0	0	0	115.7
550	A	26.2	Very low	30	Very low	112 Å²	112	133.4 Å²	133.4	93%	0.926	79%	0.791	S	S	*	*			trans	55.5	136	137.5	0	0	0	0	0	124.1
551	G	24.5	Very low	28.7	Very low	76 Å²	76	134.4 Å²	134.4	78%	0.784	80%	0.801	S	S	*	*			trans	131.5	114.4	158	0	0	0	0	0	111.7
552	E	24.2	Very low	27.8	Very low	186 Å²	186	133.9 Å²	133.9	87%	0.869	80%	0.802	S	S	*	*				118.9	126.5	53.2	-133.3	177.1	-170.8	0	0	109
553	E	26.8	Very low	26.9	Very low	169 Å²	169	135.4 Å²	135.4	79%	0.79	81%	0.809	S	S	*	*			trans	38.4	133.8	158.4	-66.1	-173.2	155.3	0	0	124.4
554	I	29	Very low	26.6	Very low	171 Å²	171	136.7 Å²	136.7	88%	0.877	81%	0.811	S	S	*	*				175.4	149.2	116.3	-84.5	157.8	0	0	0	112
555	K	27.4	Very low	26.4	Very low	192 Å²	192	137.5 Å²	137.5	84%	0.835	82%	0.815	S	S	*	*			trans	-61.4	163.4	-176.6	-69.9	167.5	168.7	172.9	0	117.7
556	Q	23.7	Very low	26.2	Very low	155 Å²	155	139.8 Å²	139.8	72%	0.724	81%	0.813	S	S	*	*			trans	112.5	111.3	140	-103.2	-177.1	-31.7	0	0	120.4
557	E	24.8	Very low	26.2	Very low	148 Å²	148	140.6 Å²	140.6	69%	0.692	81%	0.814	S	S	*	*			trans	66.5	129.7	130.4	-76.4	171.2	-142.8	0	0	124.5
558	N	25.2	Very low	26.1	Very low	141 Å²	141	141.1 Å²	141.1	75%	0.754	81%	0.811	S	S	*	*			trans	91.9	119.3	137.9	-83.3	-3.3	0	0	0	124.1
559	S	26.6	Very low	26.2	Very low	100 Å²	100	144.6 Å²	144.6	70%	0.699	81%	0.812	S	S	*	*			trans	74.8	140	136	75.5	0	0	0	0	118.3
560	T	25.8	Very low	26.3	Very low	133 Å²	133	144.9 Å²	144.9	82%	0.816	80%	0.802	S	S	*	*			cis	-166.3	120.8	0	12.5	0	0	0	0	106.4
561	G	26.7	Very low	26.4	Very low	82 Å²	82	145 Å²	145	85%	0.845	80%	0.797	S	S	*	*			trans	-111.8	128.1	172.3	0	0	0	0	0	110.1
562	V	29.8	Very low	26.4	Very low	133 Å²	133	146.1 Å²	146.1	81%	0.806	80%	0.798	S	S	*	*			trans	-113.3	103.3	-175.6	176.5	0	0	0	0	110.1
563	K	27.3	Very low	26.4	Very low	195 Å²	195	143.5 Å²	143.5	85%	0.848	80%	0.8	S	S	*	*			trans	47.2	102.4	135.2	-66.3	-176.4	171.6	-176.2	0	120.4
564	E	25.6	Very low	26.5	Very low	194 Å²	194	138.7 Å²	138.7	91%	0.907	80%	0.796	S	S	*	*				-102.4	140.6	129.3	-77.1	-177	145.8	0	0	108.6
565	E	27.5	Very low	26.3	Very low	196 Å²	196	139.1 Å²	139.1	92%	0.916	80%	0.795	S	S	*	*			trans	-165.6	113.1	153.4	-114.7	-179.6	-168.7	0	0	111.9
566	N	26.3	Very low	26.2	Very low	145 Å²	145	135.5 Å²	135.5	78%	0.775	79%	0.789	S	S	*	*			trans	25.4	122.9	134.5	-125.7	16.7	0	0	0	123.4
567	S	26.6	Very low	26.4	Very low	99 Å²	99	134.9 Å²	134.9	69%	0.692	79%	0.791	S	S	*	*				43.9	127.8	115.6	-47	0	0	0	0	124.2
568	N	24.7	Very low	26.4	Very low	158 Å²	158	135.8 Å²	135.8	85%	0.845	80%	0.795	S	S	*	*			trans	-16.9	133.1	144.6	-71.1	-16.7	0	0	0	116.6
569	N	26.4	Very low	26.4	Very low	148 Å²	148	135.6 Å²	135.6	79%	0.791	80%	0.799	S	S	*	*				161.6	147.7	80.6	-150.2	8	0	0	0	112.8
570	V	27.1	Very low	26.3	Very low	109 Å²	109	137.5 Å²	137.5	66%	0.661	80%	0.801	S	S	*	*			trans	59.8	115.3	158.4	-136.7	0	0	0	0	121.6
571	S	27.7	Very low	26.4	Very low	116 Å²	116	136.2 Å²	136.2	81%	0.811	80%	0.798	S	S	*	*				161.1	146.6	102	-72.6	0	0	0	0	114.4
572	A	24.6	Very low	26.4	Very low	98 Å²	98	135.9 Å²	135.9	81%	0.81	79%	0.794	S	S	*	*			trans	-71.6	165.1	-170.7	0	0	0	0	0	117
573	S	25	Very low	26.3	Very low	131 Å²	131	136.1 Å²	136.1	92%	0.916	79%	0.791	S	S	*	*			trans	105	133.2	145.4	-155.5	0	0	0	0	118.1
574	G	27.8	Very low	26.3	Very low	68 Å²	68	132.6 Å²	132.6	70%	0.701	78%	0.781	S	S	*	*			trans	121.1	75.5	169.6	0	0	0	0	0	113.7
575	Q	26.6	Very low	26.4	Very low	180 Å²	180	129.7 Å²	129.7	84%	0.841	78%	0.777	S	S	*	*				58.1	107.4	87.7	-114.1	179.4	-6.1	0	0	116.4
576	T	24.1	Very low	26.5	Very low	117 Å²	117	127.9 Å²	127.9	72%	0.718	77%	0.773	S	S	*	*			trans	44.9	113.7	135	49.5	0	0	0	0	121
577	N	27.5	Very low	26.7	Very low	142 Å²	142	128 Å²	128	76%	0.759	78%	0.779	S	S	*	*				-178	114.8	121.1	-106.8	-10.6	0	0	0	108.5
578	Q	24.8	Very low	26.7	Very low	167 Å²	167	127.3 Å²	127.3	78%	0.78	78%	0.779	S	S	*	*				62.1	139.5	94.4	-80.7	-165.9	27.6	0	0	115.1
579	T	26.3	Very low	26.8	Very low	136 Å²	136	126.3 Å²	126.3	83%	0.834	77%	0.773	S	S	*	*			trans	85.1	138.1	171.1	73.7	0	0	0	0	115.3
580	N	25.3	Very low	27	Very low	141 Å²	141	128.2 Å²	128.2	75%	0.754	77%	0.774	S	S	*	*			cis	-175.4	151	-11.9	-175.8	18	0	0	0	106
581	S	26.6	Very low	27	Very low	106 Å²	106	130.1 Å²	130.1	74%	0.741	78%	0.776	S	S	*	*			trans	74.8	133.3	151.7	-67.2	0	0	0	0	121.8
582	G	26.9	Very low	27.1	Very low	74 Å²	74	132.7 Å²	132.7	76%	0.763	78%	0.775	S	S	*	*			trans	129.7	65	164.7	0	0	0	0	0	113.2
583	N	27.6	Very low	27.3	Very low	139 Å²	139	135.7 Å²	135.7	74%	0.743	78%	0.777	S	S	*	*				87.7	123.7	73.5	-153.5	50.8	0	0	0	113.9
584	D	27.7	Very low	27.6	Very low	121 Å²	121	137.6 Å²	137.6	65%	0.647	77%	0.771	S	S	*	*			trans	65.4	109.7	157.3	-62.6	-24.3	0	0	0	121.4
585	T	28.2	Very low	27.7	Very low	132 Å²	132	140.5 Å²	140.5	81%	0.81	77%	0.769	S	S	*	*				175.1	150.4	92.5	31.6	0	0	0	0	112.5
586	N	28.4	Very low	27.6	Very low	158 Å²	158	137 Å²	137	85%	0.845	77%	0.765	S	S	*	*			trans	75.5	102.2	168.4	-84.5	-15.4	0	0	0	118.2
587	V	30.9	Very low	27.7	Very low	149 Å²	149	135.2 Å²	135.2	90%	0.903	76%	0.762	S	S	*	*				-168.3	125.1	109.8	154.8	0	0	0	0	107.7
588	A	27.2	Very low	27.7	Very low	84 Å²	84	136.8 Å²	136.8	69%	0.694	77%	0.765	S	S	*	*			trans	-110.8	119.7	179.1	0	0	0	0	0	111.2
589	I	26.5	Very low	28	Very low	137 Å²	137	136.2 Å²	136.2	70%	0.703	77%	0.767	S	S	*	*			trans	63.1	111.5	131.3	-50.3	171.8	0	0	0	119.4	E591	I589-E591 HydrophobicContact CG2-CG 4.15Å
590	K	30.2	Very low	28.2	Very low	188 Å²	188	139 Å²	139	82%	0.817	77%	0.771	S	S	*	*				-172.1	99	118.9	-99.2	174.1	178.6	-176.4	0	107.8
591	E	28	Very low	28.5	Very low	149 Å²	149	136.7 Å²	136.7	70%	0.696	77%	0.771	S	S	*	*				62.9	127.9	87.7	-71.1	179.4	175.6	0	0	112	I589	I589-E591 HydrophobicContact CG2-CG 4.15Å
592	E	29.6	Very low	28.7	Very low	170 Å²	170	138.8 Å²	138.8	79%	0.794	77%	0.774	S	S	*	*			cis	-164.8	148.3	9.8	-112.6	174.6	178.2	0	0	108.9
593	N	27.5	Very low	29	Very low	160 Å²	160	142.3 Å²	142.3	86%	0.856	78%	0.775	S	S	*	*			trans	-91.3	137.2	168.3	-92.2	-27.8	0	0	0	109.5
594	H	32.4	Very low	29	Very low	171 Å²	171	144.2 Å²	144.2	79%	0.792	78%	0.78	S	S	*	*			trans	-156.3	99.5	160.3	-140.2	-90.7	0	0	0	108.7
595	I	28.8	Very low	29.1	Very low	129 Å²	129	142.2 Å²	142.2	66%	0.662	78%	0.78	S	S	*	*				68.8	107.9	99	-64.8	173.3	0	0	0	114.1
596	S	25.3	Very low	29.3	Very low	107 Å²	107	141.8 Å²	141.8	75%	0.748	78%	0.783	S	S	*	*			trans	14	137.6	144.2	54.7	0	0	0	0	121.8
597	A	26.2	Very low	29.3	Very low	80 Å²	80	137.6 Å²	137.6	66%	0.661	78%	0.777	S	S	*	*				135.9	142.1	118.8	0	0	0	0	0	113.2
598	E	27.5	Very low	29.4	Very low	174 Å²	174	140.4 Å²	140.4	81%	0.813	78%	0.777	S	S	*	*			trans	74.4	109.6	153.2	-67.2	165.7	-158.7	0	0	118.3
599	D	31.9	Very low	29.6	Very low	155 Å²	155	143.7 Å²	143.7	83%	0.829	78%	0.783	S	S	*	*				-172.8	88.4	112.1	-89.5	-22.5	0	0	0	109.2
600	E	29.2	Very low	30	Very low	196 Å²	196	143.7 Å²	143.7	92%	0.916	79%	0.789	S	S	*	*			trans	-77.2	127	143.4	-73.7	-151.2	159.1	0	0	106.9
601	A	32.8	Very low	30.1	Very low	92 Å²	92	142.8 Å²	142.8	76%	0.76	79%	0.785	S	S	*	*			trans	-144.3	114.3	165.9	0	0	0	0	0	109.2
602	D	29.5	Very low	30.1	Very low	150 Å²	150	142.4 Å²	142.4	80%	0.802	79%	0.787	S	S	*	*			trans	-48.6	152.6	166.7	-66.8	-60.5	0	0	0	114.1
603	D	33.1	Very low	30	Very low	148 Å²	148	137.7 Å²	137.7	79%	0.791	79%	0.785	S	S	*	*				171.3	104.5	124.2	-97.3	-24.4	0	0	0	108.3
604	E	27.5	Very low	30.4	Very low	178 Å²	178	138.5 Å²	138.5	83%	0.832	79%	0.787	S	S	*	*				77.3	121	86.9	-86.1	-115.7	153.3	0	0	114.6
605	A	29.6	Very low	30.2	Very low	80 Å²	80	139.2 Å²	139.2	66%	0.661	79%	0.788	S	S	*	*				117.6	121.8	128	0	0	0	0	0	118.9
606	S	32.7	Very low	30.1	Very low	123 Å²	123	140.6 Å²	140.6	86%	0.86	79%	0.792	S	S	*	*			trans	76.3	120.1	154.8	76.7	0	0	0	0	116.6
607	G	28	Very low	30.3	Very low	70 Å²	70	144.3 Å²	144.3	72%	0.722	80%	0.797	S	S	*	*			cis	117.2	106.5	23.7	0	0	0	0	0	108.5
608	K	34.5	Very low	30.4	Very low	207 Å²	207	150 Å²	150	90%	0.9	81%	0.807	S	S	*	*			trans	-174.1	115	148	-106.4	164.9	-173.7	174.9	0	111.9
609	D	30.8	Very low	30.6	Very low	153 Å²	153	149.9 Å²	149.9	82%	0.818	81%	0.811	S	S	*	*			trans	-49.3	152.3	167	-60.7	-80.8	0	0	0	114.8
610	V	35	Very low	30.4	Very low	137 Å²	137	147.5 Å²	147.5	83%	0.83	81%	0.806	S	S	*	*				-178.9	97.8	112.8	172.5	0	0	0	0	106.5
611	K	31.6	Very low	30.3	Very low	170 Å²	170	144 Å²	144	74%	0.739	80%	0.804	S	S	*	*				79.8	122.1	84.4	-127.8	-161.4	174.8	-169.6	0	116.1
612	D	29.9	Very low	30.1	Very low	140 Å²	140	143.2 Å²	143.2	75%	0.749	80%	0.804	S	S	*	*			trans	58.6	125.4	153.1	-55.4	-27.6	0	0	0	117.9
613	G	27.2	Very low	30	Very low	72 Å²	72	143.8 Å²	143.8	74%	0.742	81%	0.808	S	S	*	*			cis	132	98.4	25.5	0	0	0	0	0	107.5
614	I	35.2	Very low	29.7	Very low	176 Å²	176	141.5 Å²	141.5	90%	0.903	81%	0.809	S	S	*	*			trans	-132.2	92	167.4	-61.1	-179.2	0	0	0	107.7
615	K	29.1	Very low	29.8	Very low	187 Å²	187	137.7 Å²	137.7	81%	0.813	81%	0.808	S	S	*	*			trans	-82.5	125	169.2	-124	175.4	179.5	176.8	0	107.7
616	Q	26.4	Very low	29.7	Very low	158 Å²	158	138.6 Å²	138.6	74%	0.738	82%	0.815	S	S	*	*				50.7	111.6	128.6	-157.6	178.1	13.5	0	0	117.2
617	E	28.7	Very low	29.4	Very low	184 Å²	184	137.3 Å²	137.3	86%	0.86	81%	0.812	S	S	*	*			trans	-153	119.2	136.7	-114.6	170.1	-152.8	0	0	113
618	K	28.5	Very low	29.4	Very low	201 Å²	201	141 Å²	141	87%	0.874	81%	0.811	S	S	*	*			trans	-76.7	110.1	172.8	-125.5	176.5	176.3	-179	0	106	S620	K618-S620 PolarHBondContact O-N 3.27Å
619	L	31.1	Very low	29.1	Very low	170 Å²	170	139.1 Å²	139.1	89%	0.89	80%	0.802	S	S	*	*			trans	-86.2	103.2	174.1	-80.8	159.7	0	0	0	109.8
620	S	28.3	Very low	29.1	Very low	105 Å²	105	140.6 Å²	140.6	73%	0.734	80%	0.801	S	S	*	*			trans	-71.3	139.6	171.2	49.6	0	0	0	0	112	K618	K618-S620 PolarHBondContact O-N 3.27Å
621	S	27.6	Very low	28.7	Very low	124 Å²	124	140.1 Å²	140.1	87%	0.867	79%	0.794	S	S	*	*			trans	-46.9	133	159.4	49.1	0	0	0	0	112.8
622	G	28.7	Very low	28.7	Very low	74 Å²	74	137.3 Å²	137.3	76%	0.763	80%	0.796	S	S	*	*			trans	-151.8	135.8	176.8	0	0	0	0	0	111.9
623	D	26.2	Very low	29.6	Very low	163 Å²	163	136.3 Å²	136.3	87%	0.872	80%	0.798	S	S	*	*			trans	-74.8	159.8	-163.7	-70.6	-66.6	0	0	0	118.3
624	A	26.7	Very low	29.6	Very low	99 Å²	99	136.6 Å²	136.6	82%	0.818	80%	0.8	S	S	*	*			trans	37.7	125	133.7	0	0	0	0	0	122.5
625	A	30.3	Very low	30.2	Very low	98 Å²	98	134.4 Å²	134.4	81%	0.81	80%	0.798	S	S	*	*			trans	176.7	117.6	138.5	0	0	0	0	0	108.4
626	A	26.8	Very low	30	Very low	99 Å²	99	129.1 Å²	129.1	82%	0.818	80%	0.796	S	S	*	*				91.8	140.9	72.5	0	0	0	0	0	114.3
627	A	27.6	Very low	30.4	Very low	96 Å²	96	129.2 Å²	129.2	79%	0.793	80%	0.801	S	S	*	*			trans	77.7	139.8	164.1	0	0	0	0	0	117.7
628	E	28.2	Very low	30.2	Very low	148 Å²	148	125.2 Å²	125.2	69%	0.692	79%	0.794	S	S	*	*			cis	-172.7	148.7	9.8	-116.7	-174.3	161.2	0	0	111.4
629	K	26.4	Very low	30.1	Very low	167 Å²	167	121.5 Å²	121.5	73%	0.726	79%	0.788	S	S	*	*			trans	55.3	125.5	138.6	-69.4	169.5	177	157.1	0	123.9
630	K	31	Very low	29.8	Very low	184 Å²	184	118.5 Å²	118.5	80%	0.8	78%	0.782	S	S	*	*				170.2	126.6	99.6	-106.1	-169.3	163.3	175.2	0	115.8
631	D	28.4	Very low	29.9	Very low	127 Å²	127	118.7 Å²	118.7	68%	0.679	78%	0.783	S	S	*	*			trans	43.5	112.6	138.1	-53.7	-30.2	0	0	0	122.4
632	S	29.9	Very low	29.8	Very low	112 Å²	112	117.4 Å²	117.4	78%	0.783	78%	0.78	S	S	*	*				80.2	158.9	81.9	-69.1	0	0	0	0	116
633	P	49.2	Very low	29.9	Very low	119 Å²	119	120.2 Å²	120.2	77%	0.773	78%	0.782	S	S	*	*			cis	-142.3	161.9	-49.7	39.8	-22.5	0	0	0	115.9
634	G	27.5	Very low	29.9	Very low	77 Å²	77	120.2 Å²	120.2	79%	0.794	78%	0.782	S	S	*	*			trans	53.3	178.9	153.1	0	0	0	0	0	121.3
635	P	48.4	Very low	30.2	Very low	131 Å²	131	121.3 Å²	121.3	85%	0.851	78%	0.784	S	S	*	*			cis	-120.7	160.5	-17.8	38.8	-21.9	0	0	0	112.6
636	G	25.3	Very low	30.2	Very low	76 Å²	76	123 Å²	123	78%	0.784	78%	0.784	S	S	*	*				74.6	98.8	82.7	0	0	0	0	0	114.6
637	N	33.3	Very low	31.2	Very low	159 Å²	159	123.8 Å²	123.8	85%	0.85	78%	0.781	S	S	*	*			trans	-154.2	131.7	151.5	-152.4	13	0	0	0	113.1
638	S	25.9	Very low	31.4	Very low	101 Å²	101	125.9 Å²	125.9	71%	0.706	78%	0.783	S	S	*	*			trans	-135.4	121.7	-175.2	50.6	0	0	0	0	107.4
639	T	25.8	Very low	31.5	Very low	122 Å²	122	128.1 Å²	128.1	75%	0.748	79%	0.791	S	S	*	*			trans	-179.4	116.4	161.9	17.8	0	0	0	0	108.4
640	S	24.7	Very low	31.5	Very low	108 Å²	108	128 Å²	128	76%	0.755	80%	0.798	S	S	*	*				99.5	122.5	96.2	67.5	0	0	0	0	112.4
641	S	30.8	Very low	31.3	Very low	109 Å²	109	127 Å²	127	76%	0.762	80%	0.796	S	S	*	*				179.8	117.8	113.5	-164.3	0	0	0	0	109.8
642	A	25.3	Very low	31.4	Very low	96 Å²	96	129.4 Å²	129.4	79%	0.793	80%	0.8	S	S	*	*			trans	-88.3	136.7	168.5	0	0	0	0	0	108.7
643	T	30.3	Very low	31.4	Very low	134 Å²	134	130.8 Å²	130.8	82%	0.822	80%	0.799	S	S	*	*			trans	-119.1	114.2	169.5	40.1	0	0	0	0	110.2
644	N	25.8	Very low	30.6	Very low	163 Å²	163	130.3 Å²	130.3	87%	0.872	80%	0.799	S	S	*	*			trans	-65.7	141.6	169.6	-84	-30.3	0	0	0	112.3
645	S	32.5	Very low	30.9	Very low	122 Å²	122	135.7 Å²	135.7	85%	0.853	80%	0.8	S	S	*	*			trans	-146.7	128.7	149.5	58.9	0	0	0	0	110.6
646	V	30.7	Very low	30.3	Very low	134 Å²	134	136.8 Å²	136.8	81%	0.812	80%	0.799	S	S	*	*			trans	-84.6	158.8	-164.9	166.2	0	0	0	0	112.4
647	P	49.3	Very low	31	Very low	115 Å²	115	136.8 Å²	136.8	75%	0.747	80%	0.799	S	S	*	*			trans	-101.1	156.3	-166.4	36.8	-27.2	0	0	0	114.2
648	V	31.3	Very low	31.9	Very low	139 Å²	139	135.4 Å²	135.4	84%	0.842	80%	0.796	S	S	*	*			trans	-134.9	115	171	180	0	0	0	0	111.6
649	K	28.9	Very low	32.9	Very low	195 Å²	195	139.3 Å²	139.3	85%	0.848	80%	0.8	S	S	*	*			trans	18	120.6	149.5	-68.2	174.2	171.3	178.1	0	118.9
650	N	27.5	Very low	34	Very low	165 Å²	165	135.4 Å²	135.4	88%	0.882	78%	0.784	S	S	*	*				67.9	134.6	57.5	-111.3	14.6	0	0	0	117.5
651	E	25.7	Very low	35.3	Very low	163 Å²	163	139.2 Å²	139.2	76%	0.762	79%	0.787	S	S	*	*			trans	86.5	131.8	-179.5	-56.3	-160.2	175.2	0	0	115.6
652	K	32	Very low	36.6	Very low	177 Å²	177	139.8 Å²	139.8	77%	0.77	78%	0.782	S	S	*	*			cis	-162.4	158.2	25.9	-142.7	167.1	-171.9	157.4	0	112.2
653	D	29.4	Very low	38.2	Very low	141 Å²	141	139.1 Å²	139.1	75%	0.754	77%	0.767	S	S	*	*			trans	-50.9	147.2	-175.4	-55.5	-77.1	0	0	0	118.4
654	S	31.5	Very low	39.6	Very low	109 Å²	109	140.3 Å²	140.3	76%	0.762	76%	0.761	S	S	*	*				154	133.2	105.6	-71.2	0	0	0	0	113.5
655	K	33.8	Very low	41.5	Very low	190 Å²	190	134.7 Å²	134.7	83%	0.826	74%	0.737	S	S	*	*			trans	63.3	96.6	153.5	-80.6	176.9	169.4	175.7	0	118.6
656	D	36.8	Very low	43.4	Very low	155 Å²	155	133 Å²	133	83%	0.829	72%	0.722	S	S	*	*				177.2	82.4	101.9	-88.2	-21	0	0	0	109.1	V658	D656-V658 PolarHBondContact O-N 3.4Å
657	G	40.7	Very low	45	Very low	75 Å²	75	131.9 Å²	131.9	77%	0.773	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	95.4	175	0	0	0	0	0	110.8
658	V	50.7	Low	46.2	Very low	130 Å²	130	129 Å²	129	79%	0.788	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.1	-19.7	142.6	-177	0	0	0	0	112.7	D656	D656-V658 PolarHBondContact O-N 3.4Å
659	K	47.7	Very low	48.4	Very low	183 Å²	183	127.9 Å²	127.9	80%	0.796	68%	0.676	S	S	*	*	S	Bend	trans	-90.5	-7.8	175.8	-68.5	-175	176.2	180	0	115.4
660	G	47.8	Very low	50.5	Low	41 Å²	41	121.7 Å²	121.7	42%	0.423	66%	0.655	S	S	.	*	H	α-helix	trans	-83.3	-12.6	-175.6	0	0	0	0	0	116.2	K664	G660-K664 WeakPolarHBondContact O-CB 3.49Å; G660-K664 PolarHBondContact O-N 3.44Å
661	K	53.4	Low	52.7	Low	187 Å²	187	117.6 Å²	117.6	81%	0.813	64%	0.635	S	S	*	*	H	α-helix	trans	-75.5	-37.8	177.1	-99.9	-177.9	174.4	179	0	112	A665	K661-A665 WeakPolarHBondContact O-CB 3.43Å; K661-A665 PolarHBondContact O-N 3.09Å
662	D	57.7	Low	55.1	Low	122 Å²	122	117.8 Å²	117.8	65%	0.652	63%	0.629	S	S	*	*	H	α-helix	trans	-71.7	-38.5	176.1	-68.2	-38.9	0	0	0	111.7	K664 A665 V666	D662-K664 PolarHBondContact O-N 3.24Å; D662-A665 PolarHBondContact O-N 3.42Å; D662-V666 VanDerWaalsContact O-CG2 3.26Å; D662-V666 WeakPolarHBondContact O-CG2 3.4Å; D662-V666 PolarHBondContact O-N 3.25Å
663	V	58.5	Low	57.2	Low	81 Å²	81	113.7 Å²	113.7	49%	0.491	62%	0.615	S	S	.	*	H	α-helix	trans	-66.1	-41.9	177.2	-177.5	0	0	0	0	111.4	A665 V666 E667	V663-A665 VanDerWaalsContact C-N 3.34Å; V663-A665 PolarHBondContact O-N 3.26Å; V663-V666 PolarHBondContact O-N 3.48Å; V663-E667 HydrophobicContact CG1-CG 4.36Å; V663-E667 WeakPolarHBondContact O-CB 3.31Å; V663-E667 WeakPolarHBondContact O-CG 3.33Å; V663-E667 PolarHBondContact O-N 3.49Å
664	K	59.8	Low	59.3	Low	159 Å²	159	112 Å²	112	69%	0.691	61%	0.606	S	S	*	*	H	α-helix	trans	-68.7	-30.8	175.5	-78.9	-174.7	175.9	-180	0	113.2	G660 D662 S668	G660-K664 WeakPolarHBondContact O-CB 3.49Å; G660-K664 PolarHBondContact O-N 3.44Å; D662-K664 PolarHBondContact O-N 3.24Å; K664-S668 VanDerWaalsContact O-CB 3.25Å; K664-S668 WeakPolarHBondContact O-CB 3.44Å; K664-S668 PolarHBondContact O-N 2.93Å
665	A	65.7	Low	61.3	Low	45 Å²	45	113.9 Å²	113.9	37%	0.372	60%	0.6	S	S	.	*	H	α-helix	trans	-66.1	-49.2	173.3	0	0	0	0	0	110.4	K661 D662 V663 E667 S668 E669	K661-A665 WeakPolarHBondContact O-CB 3.43Å; K661-A665 PolarHBondContact O-N 3.09Å; D662-A665 PolarHBondContact O-N 3.42Å; V663-A665 VanDerWaalsContact C-N 3.34Å; V663-A665 PolarHBondContact O-N 3.26Å; A665-E667 PolarHBondContact O-N 3.24Å; A665-S668 PolarHBondContact O-N 3.5Å; A665-S668 VanDerWaalsContact O-N 3.16Å; A665-S668 PolarHBondContact O-OG 3.16Å; A665-E669 WeakPolarHBondContact O-CB 3.41Å; A665-E669 PolarHBondContact O-N 3.09Å
666	V	72.3	Confident	63.5	Low	86 Å²	86	107.6 Å²	107.6	52%	0.521	58%	0.584	S	S	.	*	H	α-helix	trans	-62.3	-42.1	176.6	174.9	0	0	0	0	111.5	D662 V663 E669 T670	D662-V666 VanDerWaalsContact O-CG2 3.26Å; D662-V666 WeakPolarHBondContact O-CG2 3.4Å; D662-V666 PolarHBondContact O-N 3.25Å; V663-V666 PolarHBondContact O-N 3.48Å; V666-E669 PolarHBondContact O-N 3.05Å; V666-T670 HydrophobicContact CG1-CG2 4.33Å; V666-T670 WeakPolarHBondContact O-CB 3.34Å; V666-T670 VanDerWaalsContact O-CG2 3.25Å; V666-T670 WeakPolarHBondContact O-CG2 3.35Å; V666-T670 PolarHBondContact O-N 3.28Å; V666-T670 PolarHBondContact O-OG1 2.92Å
667	E	63.8	Low	65.2	Low	112 Å²	112	105.9 Å²	105.9	52%	0.523	57%	0.571	S	S	.	*	H	α-helix	trans	-64.9	-39.3	173.6	-77.2	179.7	167.7	0	0	111.9	V663 A665 E669 T670 V671	V663-E667 HydrophobicContact CG1-CG 4.36Å; V663-E667 WeakPolarHBondContact O-CB 3.31Å; V663-E667 WeakPolarHBondContact O-CG 3.33Å; V663-E667 PolarHBondContact O-N 3.49Å; A665-E667 PolarHBondContact O-N 3.24Å; E667-E669 VanDerWaalsContact C-N 3.34Å; E667-T670 VanDerWaalsContact CA-OG1 3.24Å; E667-T670 WeakPolarHBondContact CA-OG1 3.39Å; E667-T670 PolarHBondContact O-OG1 3.25Å; E667-V671 VanDerWaalsContact O-CB 3.32Å; E667-V671 WeakPolarHBondContact O-CB 3.46Å; E667-V671 WeakPolarHBondContact O-CG2 3.2Å; E667-V671 PolarHBondContact O-N 3.1Å
668	S	76.3	Confident	66.9	Low	54 Å²	54	107.7 Å²	107.7	38%	0.378	56%	0.562	S	S	.	*	H	α-helix	trans	-69	-34.6	176.7	85.9	0	0	0	0	112.4	K664 A665 R672	K664-S668 VanDerWaalsContact O-CB 3.25Å; K664-S668 WeakPolarHBondContact O-CB 3.44Å; K664-S668 PolarHBondContact O-N 2.93Å; A665-S668 PolarHBondContact O-N 3.5Å; A665-S668 VanDerWaalsContact O-N 3.16Å; A665-S668 PolarHBondContact O-OG 3.16Å; S668-R672 VanDerWaalsContact O-CB 3.22Å; S668-R672 WeakPolarHBondContact O-CB 3.5Å; S668-R672 PolarHBondContact O-N 2.71Å
669	E	77.1	Confident	68.4	Low	116 Å²	116	109.4 Å²	109.4	54%	0.542	56%	0.559	S	S	.	*	H	α-helix	trans	-73.5	-45.9	179.1	-170.1	161.2	-150.8	0	0	110.3	A665 V666 E667 V671 R672 D673	A665-E669 WeakPolarHBondContact O-CB 3.41Å; A665-E669 PolarHBondContact O-N 3.09Å; V666-E669 PolarHBondContact O-N 3.05Å; E667-E669 VanDerWaalsContact C-N 3.34Å; E669-V671 PolarHBondContact O-N 2.67Å; E669-R672 CarbonylContact O-C 3.49Å; E669-R672 WeakPolarHBondContact O-CB 3.46Å; E669-R672 PolarHBondContact O-N 3.08Å; E669-R672 VanDerWaalsContact O-N 3.12Å; E669-D673 WeakPolarHBondContact O-CB 3.41Å; E669-D673 PolarHBondContact O-N 2.9Å
670	T	71.4	Confident	70.1	Confident	65 Å²	65	107.4 Å²	107.4	40%	0.399	55%	0.55	S	S	.	*	H	α-helix	trans	-61.6	-41.4	173	50.7	0	0	0	0	112.3	V666 E667 R672 D673 L674	V666-T670 HydrophobicContact CG1-CG2 4.33Å; V666-T670 WeakPolarHBondContact O-CB 3.34Å; V666-T670 VanDerWaalsContact O-CG2 3.25Å; V666-T670 WeakPolarHBondContact O-CG2 3.35Å; V666-T670 PolarHBondContact O-N 3.28Å; V666-T670 PolarHBondContact O-OG1 2.92Å; E667-T670 VanDerWaalsContact CA-OG1 3.24Å; E667-T670 WeakPolarHBondContact CA-OG1 3.39Å; E667-T670 PolarHBondContact O-OG1 3.25Å; T670-R672 VanDerWaalsContact C-N 3.32Å; T670-R672 PolarHBondContact O-N 3.25Å; T670-D673 PolarHBondContact O-N 3.22Å; T670-L674 VanDerWaalsContact O-CB 3.31Å; T670-L674 WeakPolarHBondContact O-CB 3.38Å; T670-L674 WeakPolarHBondContact O-CG 3.42Å; T670-L674 PolarHBondContact O-N 2.86Å
671	V	74.4	Confident	71.4	Confident	78 Å²	78	107.9 Å²	107.9	47%	0.473	55%	0.55	S	S	.	*	H	α-helix	trans	-66.5	-35.3	174.5	170.6	0	0	0	0	111.5	E667 E669 K675	E667-V671 VanDerWaalsContact O-CB 3.32Å; E667-V671 WeakPolarHBondContact O-CB 3.46Å; E667-V671 WeakPolarHBondContact O-CG2 3.2Å; E667-V671 PolarHBondContact O-N 3.1Å; E669-V671 PolarHBondContact O-N 2.67Å; V671-K675 WeakPolarHBondContact O-CB 3.26Å; V671-K675 WeakPolarHBondContact O-CG 3.45Å; V671-K675 PolarHBondContact O-N 3.36Å
672	R	76.9	Confident	72.6	Confident	168 Å²	168	103 Å²	103	63%	0.634	53%	0.533	S	S	*	.	H	α-helix	trans	-69.5	-40.9	176.4	-162.9	-178	-68.4	140.9	-1.3	111.1	S668 E669 T670 K675 A676	S668-R672 VanDerWaalsContact O-CB 3.22Å; S668-R672 WeakPolarHBondContact O-CB 3.5Å; S668-R672 PolarHBondContact O-N 2.71Å; E669-R672 CarbonylContact O-C 3.49Å; E669-R672 WeakPolarHBondContact O-CB 3.46Å; E669-R672 PolarHBondContact O-N 3.08Å; E669-R672 VanDerWaalsContact O-N 3.12Å; T670-R672 VanDerWaalsContact C-N 3.32Å; T670-R672 PolarHBondContact O-N 3.25Å; R672-K675 PolarHBondContact O-N 3.5Å; R672-A676 WeakPolarHBondContact O-CB 3.41Å; R672-A676 PolarHBondContact O-N 3.19Å
673	D	75.7	Confident	73.7	Confident	90 Å²	90	101.2 Å²	101.2	48%	0.481	52%	0.523	S	S	.	.	H	α-helix	trans	-63.1	-45.9	172.2	-93.6	8.1	0	0	0	111.6	E669 T670 K675 A676 Q677	E669-D673 WeakPolarHBondContact O-CB 3.41Å; E669-D673 PolarHBondContact O-N 2.9Å; T670-D673 PolarHBondContact O-N 3.22Å; D673-K675 VanDerWaalsContact C-N 3.3Å; D673-K675 PolarHBondContact O-N 2.96Å; D673-A676 CarbonylContact O-C 3.58Å; D673-A676 WeakPolarHBondContact O-CB 3.42Å; D673-A676 PolarHBondContact O-N 3.07Å; D673-A676 VanDerWaalsContact O-N 3.11Å; D673-Q677 WeakPolarHBondContact O-CB 3.36Å; D673-Q677 VanDerWaalsContact O-CG 3.26Å; D673-Q677 WeakPolarHBondContact O-CG 3.4Å; D673-Q677 PolarHBondContact O-N 3.45Å
674	L	73.3	Confident	74.9	Confident	105 Å²	105	100.8 Å²	100.8	55%	0.55	52%	0.518	S	S	.	.	H	α-helix	trans	-63	-37.1	176.4	-74	170	0	0	0	111.6	T670 L678	T670-L674 VanDerWaalsContact O-CB 3.31Å; T670-L674 WeakPolarHBondContact O-CB 3.38Å; T670-L674 WeakPolarHBondContact O-CG 3.42Å; T670-L674 PolarHBondContact O-N 2.86Å; L674-L678 VanDerWaalsContact O-CB 3.23Å; L674-L678 WeakPolarHBondContact O-CB 3.08Å; L674-L678 PolarHBondContact O-N 3.05Å
675	K	74.5	Confident	75.6	Confident	150 Å²	150	99.6 Å²	99.6	65%	0.652	52%	0.515	S	S	*	.	H	α-helix	trans	-66.8	-39.5	171.9	-82.8	-177.3	177.8	178.6	0	112.4	V671 R672 D673 K679	V671-K675 WeakPolarHBondContact O-CB 3.26Å; V671-K675 WeakPolarHBondContact O-CG 3.45Å; V671-K675 PolarHBondContact O-N 3.36Å; R672-K675 PolarHBondContact O-N 3.5Å; D673-K675 VanDerWaalsContact C-N 3.3Å; D673-K675 PolarHBondContact O-N 2.96Å; K675-K679 VanDerWaalsContact O-CB 3.3Å; K675-K679 WeakPolarHBondContact O-CB 3.5Å; K675-K679 PolarHBondContact O-N 3.09Å
676	A	78	Confident	76.4	Confident	58 Å²	58	104 Å²	104	48%	0.479	53%	0.526	S	S	.	.	H	α-helix	trans	-65.6	-44.3	176.2	0	0	0	0	0	111	R672 D673 K679 K680	R672-A676 WeakPolarHBondContact O-CB 3.41Å; R672-A676 PolarHBondContact O-N 3.19Å; D673-A676 CarbonylContact O-C 3.58Å; D673-A676 WeakPolarHBondContact O-CB 3.42Å; D673-A676 PolarHBondContact O-N 3.07Å; D673-A676 VanDerWaalsContact O-N 3.11Å; A676-K679 PolarHBondContact O-N 2.87Å; A676-K680 WeakPolarHBondContact O-CB 3.49Å; A676-K680 PolarHBondContact O-N 2.74Å
677	Q	74.4	Confident	76.4	Confident	118 Å²	118	104.7 Å²	104.7	55%	0.551	52%	0.523	S	S	*	.	H	α-helix	trans	-63.3	-43.3	175.2	-71	176.2	27	0	0	111.6	D673 K680 A681	D673-Q677 WeakPolarHBondContact O-CB 3.36Å; D673-Q677 VanDerWaalsContact O-CG 3.26Å; D673-Q677 WeakPolarHBondContact O-CG 3.4Å; D673-Q677 PolarHBondContact O-N 3.45Å; Q677-K680 PolarHBondContact O-N 2.74Å; Q677-A681 WeakPolarHBondContact O-CB 3.28Å; Q677-A681 PolarHBondContact O-N 3.39Å
678	L	76.3	Confident	76.8	Confident	114 Å²	114	104.9 Å²	104.9	60%	0.597	53%	0.525	S	S	*	.	H	α-helix	trans	-63.8	-43.3	176.1	-175.4	68.5	0	0	0	111.3	L674 K680 A681 L682	L674-L678 VanDerWaalsContact O-CB 3.23Å; L674-L678 WeakPolarHBondContact O-CB 3.08Å; L674-L678 PolarHBondContact O-N 3.05Å; L678-K680 VanDerWaalsContact C-N 3.33Å; L678-A681 PolarHBondContact O-N 2.93Å; L678-L682 WeakPolarHBondContact O-CB 3.41Å; L678-L682 PolarHBondContact O-N 3.4Å
679	K	80.8	Confident	76.8	Confident	165 Å²	165	108.8 Å²	108.8	72%	0.717	54%	0.536	S	S	*	.	H	α-helix	trans	-65.6	-38.7	177.8	-165.5	176.7	-176.5	-177	0	111.4	K675 A676 N683	K675-K679 VanDerWaalsContact O-CB 3.3Å; K675-K679 WeakPolarHBondContact O-CB 3.5Å; K675-K679 PolarHBondContact O-N 3.09Å; A676-K679 PolarHBondContact O-N 2.87Å; K679-N683 WeakPolarHBondContact O-CB 3.47Å; K679-N683 PolarHBondContact O-N 2.89Å
680	K	83.2	Confident	76.7	Confident	142 Å²	142	108.9 Å²	108.9	62%	0.617	54%	0.539	S	S	*	.	H	α-helix	trans	-61.3	-52	172.2	-173.1	-178.1	176.7	-173.7	0	110.5	A676 Q677 L678 L682 N683 D684	A676-K680 WeakPolarHBondContact O-CB 3.49Å; A676-K680 PolarHBondContact O-N 2.74Å; Q677-K680 PolarHBondContact O-N 2.74Å; L678-K680 VanDerWaalsContact C-N 3.33Å; K680-L682 VanDerWaalsContact C-N 3.31Å; K680-L682 PolarHBondContact O-N 2.74Å; K680-N683 CarbonylContact O-C 3.58Å; K680-N683 WeakPolarHBondContact O-CA 3.37Å; K680-N683 WeakPolarHBondContact O-CB 3Å; K680-N683 PolarHBondContact O-N 3.23Å; K680-D684 PolarHBondContact O-N 3.44Å
681	A	76.8	Confident	76.4	Confident	51 Å²	51	109.7 Å²	109.7	42%	0.421	54%	0.541	S	S	.	.	H	α-helix	trans	-60.4	-37.7	178.5	0	0	0	0	0	113.1	Q677 L678 N683 D684 Q685	Q677-A681 WeakPolarHBondContact O-CB 3.28Å; Q677-A681 PolarHBondContact O-N 3.39Å; L678-A681 PolarHBondContact O-N 2.93Å; A681-N683 VanDerWaalsContact C-N 3.33Å; A681-D684 PolarHBondContact O-N 3.36Å; A681-Q685 VanDerWaalsContact O-CB 3.32Å; A681-Q685 WeakPolarHBondContact O-CB 3.34Å; A681-Q685 PolarHBondContact O-N 3.12Å
682	L	77.8	Confident	76.1	Confident	84 Å²	84	111 Å²	111	44%	0.44	54%	0.544	S	S	.	.	H	α-helix	trans	-67.4	-34.4	174.4	-118	160.7	0	0	0	112.2	L678 K680 K686	L678-L682 WeakPolarHBondContact O-CB 3.41Å; L678-L682 PolarHBondContact O-N 3.4Å; K680-L682 VanDerWaalsContact C-N 3.31Å; K680-L682 PolarHBondContact O-N 2.74Å; L682-K686 WeakPolarHBondContact O-CG 3.45Å; L682-K686 PolarHBondContact O-N 3.48Å; L682-K686 VanDerWaalsContact O-N 3.15Å
683	N	80.8	Confident	75.8	Confident	85 Å²	85	107.2 Å²	107.2	46%	0.455	54%	0.537	S	S	.	.	H	α-helix	trans	-71.5	-45.5	174.6	-145.3	63.7	0	0	0	110.7	K679 K680 A681 Q685 K686 E687	K679-N683 WeakPolarHBondContact O-CB 3.47Å; K679-N683 PolarHBondContact O-N 2.89Å; K680-N683 CarbonylContact O-C 3.58Å; K680-N683 WeakPolarHBondContact O-CA 3.37Å; K680-N683 WeakPolarHBondContact O-CB 3Å; K680-N683 PolarHBondContact O-N 3.23Å; A681-N683 VanDerWaalsContact C-N 3.33Å; N683-Q685 VanDerWaalsContact C-N 3.26Å; N683-Q685 PolarHBondContact O-N 3.28Å; N683-K686 WeakPolarHBondContact O-CB 3.23Å; N683-K686 PolarHBondContact O-N 2.85Å; N683-E687 PolarHBondContact ND2-OE1 2.98Å; N683-E687 WeakPolarHBondContact O-CG 3.4Å; N683-E687 PolarHBondContact O-N 2.8Å
684	D	82.7	Confident	75.4	Confident	72 Å²	72	109.1 Å²	109.1	39%	0.385	54%	0.544	S	S	.	.	H	α-helix	trans	-58.4	-39.1	174.8	-60.6	-13.3	0	0	0	110.9	K680 A681 E687 M688	K680-D684 PolarHBondContact O-N 3.44Å; A681-D684 PolarHBondContact O-N 3.36Å; D684-E687 PolarHBondContact O-N 2.9Å; D684-M688 WeakPolarHBondContact O-CB 3.5Å; D684-M688 WeakPolarHBondContact O-CG 3.47Å; D684-M688 PolarHBondContact O-N 3.03Å
685	Q	75.1	Confident	74.7	Confident	133 Å²	133	109.7 Å²	109.7	62%	0.621	54%	0.54	S	S	*	.	H	α-helix	trans	-66.5	-40.1	175.4	-170	-175.2	30.1	0	0	112.3	A681 N683 M688 K689	A681-Q685 VanDerWaalsContact O-CB 3.32Å; A681-Q685 WeakPolarHBondContact O-CB 3.34Å; A681-Q685 PolarHBondContact O-N 3.12Å; N683-Q685 VanDerWaalsContact C-N 3.26Å; N683-Q685 PolarHBondContact O-N 3.28Å; Q685-M688 PolarHBondContact O-N 2.89Å; Q685-K689 WeakPolarHBondContact O-CB 3.33Å; Q685-K689 PolarHBondContact O-N 3.23Å
686	K	82.1	Confident	74.3	Confident	138 Å²	138	110.7 Å²	110.7	60%	0.6	54%	0.544	S	S	*	.	H	α-helix	trans	-67.3	-40.9	175.6	-75.5	176.6	-178.7	-178	0	111.5	L682 N683 K689 L690	L682-K686 WeakPolarHBondContact O-CG 3.45Å; L682-K686 PolarHBondContact O-N 3.48Å; L682-K686 VanDerWaalsContact O-N 3.15Å; N683-K686 WeakPolarHBondContact O-CB 3.23Å; N683-K686 PolarHBondContact O-N 2.85Å; K686-K689 PolarHBondContact O-N 2.98Å; K686-L690 WeakPolarHBondContact O-CB 3.42Å; K686-L690 PolarHBondContact O-N 2.87Å
687	E	73.2	Confident	73.5	Confident	101 Å²	101	111.2 Å²	111.2	47%	0.472	56%	0.556	S	S	.	*	H	α-helix	trans	-62.8	-45.9	174.1	-74.5	178	-165.7	0	0	110.9	N683 D684 K689 L690 L691	N683-E687 PolarHBondContact ND2-OE1 2.98Å; N683-E687 WeakPolarHBondContact O-CG 3.4Å; N683-E687 PolarHBondContact O-N 2.8Å; D684-E687 PolarHBondContact O-N 2.9Å; E687-K689 VanDerWaalsContact C-N 3.33Å; E687-K689 PolarHBondContact O-N 3.34Å; E687-L690 PolarHBondContact O-N 3.39Å; E687-L691 WeakPolarHBondContact O-CB 3.42Å; E687-L691 WeakPolarHBondContact O-CD1 3.38Å; E687-L691 PolarHBondContact O-N 2.88Å
688	M	72.2	Confident	72.5	Confident	115 Å²	115	108.3 Å²	108.3	57%	0.567	55%	0.546	S	S	*	.	H	α-helix	trans	-62.3	-38.5	175.8	-80.6	-66.1	140.7	0	0	112.7	D684 Q685 L691 L692	D684-M688 WeakPolarHBondContact O-CB 3.5Å; D684-M688 WeakPolarHBondContact O-CG 3.47Å; D684-M688 PolarHBondContact O-N 3.03Å; Q685-M688 PolarHBondContact O-N 2.89Å; M688-L691 HydrophobicContact CE-CD1 4.21Å; M688-L691 PolarHBondContact O-N 3.45Å; M688-L692 WeakPolarHBondContact O-CB 3.37Å; M688-L692 VanDerWaalsContact O-CG 3.31Å; M688-L692 WeakPolarHBondContact O-CG 3.49Å; M688-L692 PolarHBondContact O-N 3.28Å
689	K	76.7	Confident	72	Confident	137 Å²	137	106.6 Å²	106.6	60%	0.596	54%	0.544	S	S	*	.	H	α-helix	trans	-66	-43.2	174.7	-171.6	176	179.7	-179.8	0	111.6	Q685 K686 E687 L691 L692 D693	Q685-K689 WeakPolarHBondContact O-CB 3.33Å; Q685-K689 PolarHBondContact O-N 3.23Å; K686-K689 PolarHBondContact O-N 2.98Å; E687-K689 VanDerWaalsContact C-N 3.33Å; E687-K689 PolarHBondContact O-N 3.34Å; K689-L691 VanDerWaalsContact C-N 3.33Å; K689-L691 PolarHBondContact O-N 2.82Å; K689-L692 PolarHBondContact O-N 3.04Å; K689-D693 PolarHBondContact O-N 3.42Å
690	L	73.7	Confident	71.6	Confident	118 Å²	118	105.4 Å²	105.4	62%	0.618	54%	0.538	S	S	*	.	H	α-helix	trans	-62.3	-42.4	176	-172.3	71.7	0	0	0	111.4	K686 E687 D693 M694	K686-L690 WeakPolarHBondContact O-CB 3.42Å; K686-L690 PolarHBondContact O-N 2.87Å; E687-L690 PolarHBondContact O-N 3.39Å; L690-D693 PolarHBondContact O-N 3.34Å; L690-M694 PolarHBondContact O-N 2.92Å
691	L	66.2	Low	71	Confident	82 Å²	82	104.7 Å²	104.7	43%	0.429	54%	0.541	S	S	.	.	H	α-helix	trans	-59.1	-47.2	172.4	-96.8	136	0	0	0	111.1	E687 M688 K689 D693 M694 Y695	E687-L691 WeakPolarHBondContact O-CB 3.42Å; E687-L691 WeakPolarHBondContact O-CD1 3.38Å; E687-L691 PolarHBondContact O-N 2.88Å; M688-L691 HydrophobicContact CE-CD1 4.21Å; M688-L691 PolarHBondContact O-N 3.45Å; K689-L691 VanDerWaalsContact C-N 3.33Å; K689-L691 PolarHBondContact O-N 2.82Å; L691-D693 PolarHBondContact O-N 2.93Å; L691-M694 PolarHBondContact O-N 2.99Å; L691-Y695 HydrophobicContact CD2-CD2 4.41Å; L691-Y695 HydrophobicContact CD2-CE2 4.17Å; L691-Y695 VanDerWaalsContact O-CB 3.32Å; L691-Y695 WeakPolarHBondContact O-CB 3.45Å; L691-Y695 VanDerWaalsContact O-CD2 3.31Å; L691-Y695 WeakPolarHBondContact O-CD2 3.42Å; L691-Y695 PolarHBondContact O-N 3.26Å
692	L	68.1	Low	70.6	Confident	104 Å²	104	106.9 Å²	106.9	55%	0.545	54%	0.543	S	S	.	.	H	α-helix	trans	-62.5	-40.4	177.9	-78.9	164.8	0	0	0	112.7	M688 K689 Y695 K696	M688-L692 WeakPolarHBondContact O-CB 3.37Å; M688-L692 VanDerWaalsContact O-CG 3.31Å; M688-L692 WeakPolarHBondContact O-CG 3.49Å; M688-L692 PolarHBondContact O-N 3.28Å; K689-L692 PolarHBondContact O-N 3.04Å; L692-Y695 WeakPolarHBondContact O-CB 3.44Å; L692-Y695 PolarHBondContact O-N 2.95Å; L692-K696 WeakPolarHBondContact O-CG 3.46Å; L692-K696 PolarHBondContact O-N 3.46Å
693	D	71	Confident	70.2	Confident	89 Å²	89	107.2 Å²	107.2	48%	0.476	54%	0.538	S	S	.	.	H	α-helix	trans	-69.3	-38.1	178.1	-72	-20.7	0	0	0	111.1	K689 L690 L691 K696 G697	K689-D693 PolarHBondContact O-N 3.42Å; L690-D693 PolarHBondContact O-N 3.34Å; L691-D693 PolarHBondContact O-N 2.93Å; D693-K696 PolarHBondContact O-N 2.86Å; D693-G697 PolarHBondContact O-N 3.29Å
694	M	65.8	Low	70	Confident	130 Å²	130	106.5 Å²	106.5	64%	0.64	53%	0.534	S	S	*	.	H	α-helix	trans	-62.6	-41.7	166.7	-87.5	-178.3	60	0	0	112.2	L690 L691 K696 G697 V698	L690-M694 PolarHBondContact O-N 2.92Å; L691-M694 PolarHBondContact O-N 2.99Å; M694-K696 VanDerWaalsContact C-N 3.28Å; M694-K696 PolarHBondContact O-N 3.41Å; M694-G697 PolarHBondContact O-N 2.9Å; M694-V698 VanDerWaalsContact O-CG2 3.24Å; M694-V698 WeakPolarHBondContact O-CG2 3.36Å; M694-V698 PolarHBondContact O-N 3.38Å
695	Y	58.3	Low	69.4	Low	118 Å²	118	108.9 Å²	108.9	46%	0.463	54%	0.541	S	S	.	.	H	α-helix	trans	-64.9	-29	-179.9	-106.3	-93.8	0	0	0	113.4	L691 L692 R703	L691-Y695 HydrophobicContact CD2-CD2 4.41Å; L691-Y695 HydrophobicContact CD2-CE2 4.17Å; L691-Y695 VanDerWaalsContact O-CB 3.32Å; L691-Y695 WeakPolarHBondContact O-CB 3.45Å; L691-Y695 VanDerWaalsContact O-CD2 3.31Å; L691-Y695 WeakPolarHBondContact O-CD2 3.42Å; L691-Y695 PolarHBondContact O-N 3.26Å; L692-Y695 WeakPolarHBondContact O-CB 3.44Å; L692-Y695 PolarHBondContact O-N 2.95Å; Y695-R703 PolarHBondContact O-NH1 3.01Å
696	K	66.7	Low	69.3	Low	170 Å²	170	106.8 Å²	106.8	74%	0.739	54%	0.537	S	S	*	.	H	α-helix	trans	-77.8	-32.3	177	-78.3	179	179.5	178.5	0	113.1	L692 D693 M694	L692-K696 WeakPolarHBondContact O-CG 3.46Å; L692-K696 PolarHBondContact O-N 3.46Å; D693-K696 PolarHBondContact O-N 2.86Å; M694-K696 VanDerWaalsContact C-N 3.28Å; M694-K696 PolarHBondContact O-N 3.41Å
697	G	62.4	Low	69	Low	70 Å²	70	106 Å²	106	72%	0.722	54%	0.536	S	S	*	.	H	α-helix	trans	-84.7	-12.9	-177.8	0	0	0	0	0	115	D693 M694	D693-G697 PolarHBondContact O-N 3.29Å; M694-G697 PolarHBondContact O-N 2.9Å
698	V	52.4	Low	69.2	Low	56 Å²	56	106.9 Å²	106.9	34%	0.339	54%	0.543	S	S	.	.	S	Bend	trans	-107.5	127.2	-170.9	177.9	0	0	0	0	110.4	M694 Q702 R703	M694-V698 VanDerWaalsContact O-CG2 3.24Å; M694-V698 WeakPolarHBondContact O-CG2 3.36Å; M694-V698 PolarHBondContact O-N 3.38Å; V698-Q702 HydrophobicContact CG1-CB 3.47Å; V698-Q702 VanDerWaalsContact CG1-CB 3.47Å; V698-Q702 HydrophobicContact CG1-CG 3.6Å; V698-R703 HydrophobicContact CB-CG 4.41Å; V698-R703 HydrophobicContact CG1-CG 4.05Å
699	S	65.5	Low	69.3	Low	79 Å²	79	106.8 Å²	106.8	55%	0.552	54%	0.543	S	S	*	.			trans	-58.5	153.2	-179.2	62.4	0	0	0	0	111.9	D701 Q702 R703	S699-D701 VanDerWaalsContact C-N 3.3Å; S699-D701 PolarHBondContact O-N 2.87Å; S699-Q702 PolarHBondContact O-N 3.5Å; S699-Q702 VanDerWaalsContact O-N 3.08Å; S699-R703 PolarHBondContact O-N 3.03Å
700	K	73	Confident	69.4	Low	140 Å²	140	103.1 Å²	103.1	61%	0.609	54%	0.538	S	S	*	.	H	α-helix	trans	-51.8	-47.1	-177.2	-172.5	-176	172.6	-171.1	0	112.2	Q702 R703 D704	K700-Q702 VanDerWaalsContact C-N 3.3Å; K700-Q702 PolarHBondContact O-N 2.92Å; K700-R703 WeakPolarHBondContact O-CB 3.19Å; K700-R703 PolarHBondContact O-N 3.45Å; K700-D704 PolarHBondContact O-N 3.07Å
701	D	69.9	Low	69.7	Low	126 Å²	126	100.7 Å²	100.7	67%	0.674	53%	0.528	S	S	*	.	H	α-helix	trans	-58	-39.9	179.1	-73.5	6	0	0	0	113.6	S699 R703 D704 K705	S699-D701 VanDerWaalsContact C-N 3.3Å; S699-D701 PolarHBondContact O-N 2.87Å; D701-R703 VanDerWaalsContact C-N 3.31Å; D701-R703 PolarHBondContact O-N 3.48Å; D701-D704 PolarHBondContact O-N 3.01Å; D701-K705 WeakPolarHBondContact O-CB 3.37Å; D701-K705 PolarHBondContact O-N 3.39Å
702	Q	70	Confident	70.4	Confident	98 Å²	98	101 Å²	101	46%	0.458	53%	0.527	S	S	.	.	H	α-helix	trans	-72.1	-29.8	-179.6	-166.9	74.4	11.3	0	0	111.2	V698 S699 K700 V706	V698-Q702 HydrophobicContact CG1-CB 3.47Å; V698-Q702 VanDerWaalsContact CG1-CB 3.47Å; V698-Q702 HydrophobicContact CG1-CG 3.6Å; S699-Q702 PolarHBondContact O-N 3.5Å; S699-Q702 VanDerWaalsContact O-N 3.08Å; K700-Q702 VanDerWaalsContact C-N 3.3Å; K700-Q702 PolarHBondContact O-N 2.92Å; Q702-V706 WeakPolarHBondContact O-CG2 3.48Å; Q702-V706 PolarHBondContact O-N 2.73Å
703	R	68.3	Low	71.3	Confident	91 Å²	91	103.9 Å²	103.9	34%	0.343	54%	0.535	S	S	.	.	H	α-helix	trans	-70	-46	172.4	-62.5	-174.3	-62.7	-155.8	2.4	111.5	Y695 V698 S699 K700 D701 K705 V706 Q707	Y695-R703 PolarHBondContact O-NH1 3.01Å; V698-R703 HydrophobicContact CB-CG 4.41Å; V698-R703 HydrophobicContact CG1-CG 4.05Å; S699-R703 PolarHBondContact O-N 3.03Å; K700-R703 WeakPolarHBondContact O-CB 3.19Å; K700-R703 PolarHBondContact O-N 3.45Å; D701-R703 VanDerWaalsContact C-N 3.31Å; D701-R703 PolarHBondContact O-N 3.48Å; R703-K705 VanDerWaalsContact C-N 3.26Å; R703-K705 PolarHBondContact O-N 2.97Å; R703-V706 PolarHBondContact O-N 3.29Å; R703-Q707 PolarHBondContact O-N 3.5Å
704	D	77.7	Confident	72.2	Confident	70 Å²	70	105.9 Å²	105.9	37%	0.374	54%	0.54	S	S	.	.	H	α-helix	trans	-61.4	-39.3	178.9	-65.7	-10.7	0	0	0	110.2	K700 D701 Q707 L708	K700-D704 PolarHBondContact O-N 3.07Å; D701-D704 PolarHBondContact O-N 3.01Å; D704-Q707 PolarHBondContact O-N 2.93Å; D704-L708 WeakPolarHBondContact O-CB 3.15Å; D704-L708 VanDerWaalsContact O-CG 3.3Å; D704-L708 WeakPolarHBondContact O-CG 3.42Å; D704-L708 PolarHBondContact O-N 3.45Å
705	K	69.7	Low	73.2	Confident	121 Å²	121	104.4 Å²	104.4	53%	0.526	53%	0.534	S	S	.	.	H	α-helix	trans	-61.4	-45.9	173.7	-173.3	175	-178.1	175.2	0	113.4	D701 R703 L708 M709	D701-K705 WeakPolarHBondContact O-CB 3.37Å; D701-K705 PolarHBondContact O-N 3.39Å; R703-K705 VanDerWaalsContact C-N 3.26Å; R703-K705 PolarHBondContact O-N 2.97Å; K705-L708 PolarHBondContact O-N 3.18Å; K705-M709 HydrophobicContact CG-SD 4.46Å; K705-M709 VanDerWaalsContact O-CG 3.29Å; K705-M709 WeakPolarHBondContact O-CG 3.44Å; K705-M709 PolarHBondContact O-N 3.39Å
706	V	73.3	Confident	74.5	Confident	90 Å²	90	106.6 Å²	106.6	55%	0.545	54%	0.542	S	S	.	.	H	α-helix	trans	-66.6	-39.7	179.4	171.9	0	0	0	0	111.1	Q702 R703 M709 A710	Q702-V706 WeakPolarHBondContact O-CG2 3.48Å; Q702-V706 PolarHBondContact O-N 2.73Å; R703-V706 PolarHBondContact O-N 3.29Å; V706-M709 PolarHBondContact O-N 3.33Å; V706-A710 WeakPolarHBondContact O-CB 3.45Å; V706-A710 PolarHBondContact O-N 3.23Å
707	Q	75.4	Confident	75.4	Confident	121 Å²	121	101.3 Å²	101.3	57%	0.565	53%	0.526	S	S	*	.	H	α-helix	trans	-65.2	-43.8	177	-173.2	167.1	-13.1	0	0	111.5	R703 D704 M709 A710 T711	R703-Q707 PolarHBondContact O-N 3.5Å; D704-Q707 PolarHBondContact O-N 2.93Å; Q707-M709 PolarHBondContact O-N 3.27Å; Q707-A710 PolarHBondContact O-N 2.66Å; Q707-T711 PolarHBondContact O-N 3.32Å; Q707-T711 PolarHBondContact O-OG1 3Å
708	L	76.8	Confident	76.5	Confident	120 Å²	120	101.5 Å²	101.5	63%	0.628	51%	0.508	S	S	*	.	H	α-helix	trans	-59.8	-44	174.1	-76.1	169.8	0	0	0	111.9	D704 K705 A710 T711 E712	D704-L708 WeakPolarHBondContact O-CB 3.15Å; D704-L708 VanDerWaalsContact O-CG 3.3Å; D704-L708 WeakPolarHBondContact O-CG 3.42Å; D704-L708 PolarHBondContact O-N 3.45Å; K705-L708 PolarHBondContact O-N 3.18Å; L708-A710 VanDerWaalsContact C-N 3.34Å; L708-A710 PolarHBondContact O-N 2.97Å; L708-T711 WeakPolarHBondContact CA-OG1 3.4Å; L708-T711 PolarHBondContact O-N 2.96Å; L708-T711 PolarHBondContact O-OG1 3.03Å; L708-E712 VanDerWaalsContact O-CB 3.31Å; L708-E712 WeakPolarHBondContact O-CB 3.26Å; L708-E712 PolarHBondContact O-N 3.37Å
709	M	75.4	Confident	78	Confident	113 Å²	113	102.7 Å²	102.7	56%	0.557	51%	0.512	S	S	*	.	H	α-helix	trans	-63.4	-37.2	175.8	-73	-178.1	78.1	0	0	112.7	K705 V706 Q707 K713	K705-M709 HydrophobicContact CG-SD 4.46Å; K705-M709 VanDerWaalsContact O-CG 3.29Å; K705-M709 WeakPolarHBondContact O-CG 3.44Å; K705-M709 PolarHBondContact O-N 3.39Å; V706-M709 PolarHBondContact O-N 3.33Å; Q707-M709 PolarHBondContact O-N 3.27Å; M709-K713 WeakPolarHBondContact O-CB 3.42Å; M709-K713 PolarHBondContact O-N 3.22Å
710	A	77.4	Confident	79	Confident	59 Å²	59	103.3 Å²	103.3	49%	0.488	51%	0.506	S	S	.	.	H	α-helix	trans	-68.1	-43	176.3	0	0	0	0	0	111.7	V706 Q707 L708 K713 K714	V706-A710 WeakPolarHBondContact O-CB 3.45Å; V706-A710 PolarHBondContact O-N 3.23Å; Q707-A710 PolarHBondContact O-N 2.66Å; L708-A710 VanDerWaalsContact C-N 3.34Å; L708-A710 PolarHBondContact O-N 2.97Å; A710-K713 PolarHBondContact O-N 3.06Å; A710-K714 PolarHBondContact O-N 2.7Å
711	T	80.9	Confident	79.6	Confident	67 Å²	67	102.1 Å²	102.1	41%	0.411	50%	0.502	S	S	.	.	H	α-helix	trans	-65.1	-39.9	174.9	51.4	0	0	0	0	111.8	Q707 L708 K714 L715	Q707-T711 PolarHBondContact O-N 3.32Å; Q707-T711 PolarHBondContact O-OG1 3Å; L708-T711 WeakPolarHBondContact CA-OG1 3.4Å; L708-T711 PolarHBondContact O-N 2.96Å; L708-T711 PolarHBondContact O-OG1 3.03Å; T711-K714 PolarHBondContact O-N 3.47Å; T711-L715 WeakPolarHBondContact O-CG 3.32Å; T711-L715 PolarHBondContact O-N 3.49Å
712	E	81.5	Confident	80.2	Confident	90 Å²	90	101.1 Å²	101.1	42%	0.421	50%	0.496	S	S	.	.	H	α-helix	trans	-63.3	-44.3	176.2	-168.7	-164.2	162.8	0	0	111	L708 K714 L715 R716	L708-E712 VanDerWaalsContact O-CB 3.31Å; L708-E712 WeakPolarHBondContact O-CB 3.26Å; L708-E712 PolarHBondContact O-N 3.37Å; E712-K714 VanDerWaalsContact C-N 3.31Å; E712-K714 PolarHBondContact O-N 3.49Å; E712-L715 PolarHBondContact O-N 3.5Å; E712-R716 WeakPolarHBondContact O-CB 3.28Å; E712-R716 VanDerWaalsContact O-CG 3.28Å; E712-R716 WeakPolarHBondContact O-CG 3.32Å; E712-R716 PolarHBondContact O-N 3.21Å; E712-R716 IonicContact OE1-CZ 2.73Å; E712-R716 IonicContact OE1-NE 3.32Å; E712-R716 PolarHBondContact OE1-NE 3.47Å; E712-R716 IonicContact OE1-NH2 2.93Å; E712-R716 PolarHBondContact OE1-NH2 3.48Å
713	K	87.1	Confident	81	Confident	164 Å²	164	104.2 Å²	104.2	71%	0.713	50%	0.504	S	S	*	.	H	α-helix	trans	-61.6	-39.8	176.8	-172.2	177.9	179.1	-178.2	0	112	M709 A710 R716 S717	M709-K713 WeakPolarHBondContact O-CB 3.42Å; M709-K713 PolarHBondContact O-N 3.22Å; A710-K713 PolarHBondContact O-N 3.06Å; K713-R716 PolarHBondContact O-N 3.38Å; K713-S717 PolarHBondContact O-N 3.05Å; K713-S717 PolarHBondContact O-OG 3.18Å
714	K	88.4	Confident	81.6	Confident	131 Å²	131	105.1 Å²	105.1	57%	0.57	51%	0.512	S	S	*	.	H	α-helix	trans	-66.4	-45.7	176.6	-168.2	-172	178.7	-158	0	111.9	A710 T711 E712 R716 S717 E718	A710-K714 PolarHBondContact O-N 2.7Å; T711-K714 PolarHBondContact O-N 3.47Å; E712-K714 VanDerWaalsContact C-N 3.31Å; E712-K714 PolarHBondContact O-N 3.49Å; K714-R716 VanDerWaalsContact C-N 3.29Å; K714-R716 PolarHBondContact O-N 3.16Å; K714-S717 PolarHBondContact O-N 3.24Å; K714-S717 PolarHBondContact O-OG 2.89Å; K714-E718 WeakPolarHBondContact CE-OE1 3.46Å; K714-E718 IonicContact NZ-OE1 2.93Å; K714-E718 WeakPolarHBondContact O-CG 3.35Å; K714-E718 PolarHBondContact O-N 2.88Å
715	L	87.2	Confident	81.8	Confident	99 Å²	99	106.9 Å²	106.9	52%	0.518	52%	0.518	S	S	.	.	H	α-helix	trans	-63.2	-37.2	175.7	-70.2	171.1	0	0	0	111.5	T711 E712 E718 I719	T711-L715 WeakPolarHBondContact O-CG 3.32Å; T711-L715 PolarHBondContact O-N 3.49Å; E712-L715 PolarHBondContact O-N 3.5Å; L715-E718 PolarHBondContact O-N 3.3Å; L715-I719 WeakPolarHBondContact O-CB 3.45Å; L715-I719 VanDerWaalsContact O-CG1 3.23Å; L715-I719 WeakPolarHBondContact O-CG1 3.28Å; L715-I719 PolarHBondContact O-N 3.31Å
716	R	85.5	Confident	82.3	Confident	164 Å²	164	106.1 Å²	106.1	62%	0.619	52%	0.519	S	S	*	.	H	α-helix	trans	-63.8	-39.2	174	-75.2	175.3	-178.8	-93.4	3	112.5	E712 K713 K714 E720	E712-R716 WeakPolarHBondContact O-CB 3.28Å; E712-R716 VanDerWaalsContact O-CG 3.28Å; E712-R716 WeakPolarHBondContact O-CG 3.32Å; E712-R716 PolarHBondContact O-N 3.21Å; E712-R716 IonicContact OE1-CZ 2.73Å; E712-R716 IonicContact OE1-NE 3.32Å; E712-R716 PolarHBondContact OE1-NE 3.47Å; E712-R716 IonicContact OE1-NH2 2.93Å; E712-R716 PolarHBondContact OE1-NH2 3.48Å; K713-R716 PolarHBondContact O-N 3.38Å; K714-R716 VanDerWaalsContact C-N 3.29Å; K714-R716 PolarHBondContact O-N 3.16Å; R716-E720 PolarHBondContact O-N 3.29Å; R716-E720 VanDerWaalsContact O-N 3.11Å
717	S	85.4	Confident	82.8	Confident	58 Å²	58	108.2 Å²	108.2	41%	0.406	52%	0.521	S	S	.	.	H	α-helix	trans	-68.5	-40.2	174	55.4	0	0	0	0	112.4	K713 K714 I719 E720 E721	K713-S717 PolarHBondContact O-N 3.05Å; K713-S717 PolarHBondContact O-OG 3.18Å; K714-S717 PolarHBondContact O-N 3.24Å; K714-S717 PolarHBondContact O-OG 2.89Å; S717-I719 PolarHBondContact O-N 3.43Å; S717-E720 PolarHBondContact O-N 2.94Å; S717-E721 PolarHBondContact O-N 2.99Å
718	E	85.4	Confident	83.1	Confident	75 Å²	75	109.7 Å²	109.7	35%	0.35	53%	0.525	S	S	.	.	H	α-helix	trans	-63.6	-40.4	176.5	-72.1	171.7	-168.9	0	0	111.4	K714 L715 E720 E721 L722	K714-E718 WeakPolarHBondContact CE-OE1 3.46Å; K714-E718 IonicContact NZ-OE1 2.93Å; K714-E718 WeakPolarHBondContact O-CG 3.35Å; K714-E718 PolarHBondContact O-N 2.88Å; L715-E718 PolarHBondContact O-N 3.3Å; E718-E720 VanDerWaalsContact C-N 3.34Å; E718-E720 PolarHBondContact O-N 3.42Å; E718-E721 PolarHBondContact O-N 3.36Å; E718-L722 WeakPolarHBondContact O-CB 3.45Å; E718-L722 VanDerWaalsContact O-CG 3.29Å; E718-L722 WeakPolarHBondContact O-CG 3.39Å; E718-L722 PolarHBondContact O-N 3.13Å
719	I	84.5	Confident	83.1	Confident	81 Å²	81	109.8 Å²	109.8	42%	0.415	53%	0.526	S	S	.	.	H	α-helix	trans	-62.4	-40.7	173.7	-71.5	166.6	0	0	0	111.3	L715 S717 L722 R723	L715-I719 WeakPolarHBondContact O-CB 3.45Å; L715-I719 VanDerWaalsContact O-CG1 3.23Å; L715-I719 WeakPolarHBondContact O-CG1 3.28Å; L715-I719 PolarHBondContact O-N 3.31Å; S717-I719 PolarHBondContact O-N 3.43Å; I719-L722 PolarHBondContact O-N 3.41Å; I719-R723 WeakPolarHBondContact O-CB 3.35Å; I719-R723 VanDerWaalsContact O-CG 3.28Å; I719-R723 WeakPolarHBondContact O-CG 3.29Å; I719-R723 PolarHBondContact O-N 3.46Å
720	E	86	Confident	83.3	Confident	92 Å²	92	110.3 Å²	110.3	43%	0.43	53%	0.527	S	S	.	.	H	α-helix	trans	-69	-39.2	178.7	-169	57.9	-150.5	0	0	112	R716 S717 E718 R723 Q724	R716-E720 PolarHBondContact O-N 3.29Å; R716-E720 VanDerWaalsContact O-N 3.11Å; S717-E720 PolarHBondContact O-N 2.94Å; E718-E720 VanDerWaalsContact C-N 3.34Å; E718-E720 PolarHBondContact O-N 3.42Å; E720-R723 PolarHBondContact O-N 2.95Å; E720-Q724 WeakPolarHBondContact O-CG 3.35Å; E720-Q724 PolarHBondContact O-N 3.37Å
721	E	85.4	Confident	83.5	Confident	115 Å²	115	112.3 Å²	112.3	54%	0.537	53%	0.526	S	S	.	.	H	α-helix	trans	-62.6	-44.8	172.3	-75.3	-179.3	-176.3	0	0	111.8	S717 E718 R723 Q724 Q725	S717-E721 PolarHBondContact O-N 2.99Å; E718-E721 PolarHBondContact O-N 3.36Å; E721-R723 VanDerWaalsContact C-N 3.35Å; E721-R723 PolarHBondContact O-N 2.9Å; E721-Q724 PolarHBondContact O-N 3.23Å; E721-Q725 WeakPolarHBondContact O-CG 3.42Å; E721-Q725 PolarHBondContact O-N 3.15Å
722	L	83.4	Confident	83.4	Confident	104 Å²	104	111.6 Å²	111.6	55%	0.545	52%	0.524	S	S	.	.	H	α-helix	trans	-62.9	-40.3	175.7	-73.9	170.8	0	0	0	111.7	E718 I719 Q724 Q725 L726	E718-L722 WeakPolarHBondContact O-CB 3.45Å; E718-L722 VanDerWaalsContact O-CG 3.29Å; E718-L722 WeakPolarHBondContact O-CG 3.39Å; E718-L722 PolarHBondContact O-N 3.13Å; I719-L722 PolarHBondContact O-N 3.41Å; L722-Q724 PolarHBondContact O-N 3.4Å; L722-Q725 PolarHBondContact O-N 3Å; L722-L726 VanDerWaalsContact O-CB 3.32Å; L722-L726 WeakPolarHBondContact O-CB 3.14Å; L722-L726 PolarHBondContact O-N 2.97Å
723	R	86.4	Confident	83.3	Confident	164 Å²	164	113.2 Å²	113.2	62%	0.619	53%	0.529	S	S	*	.	H	α-helix	trans	-62.3	-41.4	173.9	-78.2	174.5	177.3	173.6	-0.5	111.9	I719 E720 E721 L726 K727	I719-R723 WeakPolarHBondContact O-CB 3.35Å; I719-R723 VanDerWaalsContact O-CG 3.28Å; I719-R723 WeakPolarHBondContact O-CG 3.29Å; I719-R723 PolarHBondContact O-N 3.46Å; E720-R723 PolarHBondContact O-N 2.95Å; E721-R723 VanDerWaalsContact C-N 3.35Å; E721-R723 PolarHBondContact O-N 2.9Å; R723-L726 PolarHBondContact O-N 2.85Å; R723-K727 WeakPolarHBondContact O-CB 3.46Å; R723-K727 PolarHBondContact O-N 2.95Å
724	Q	81.1	Confident	82.8	Confident	109 Å²	109	114.5 Å²	114.5	51%	0.509	53%	0.53	S	S	.	.	H	α-helix	trans	-66	-39.8	175	-75	-180	14.6	0	0	112.3	E720 E721 L722 K727 K728	E720-Q724 WeakPolarHBondContact O-CG 3.35Å; E720-Q724 PolarHBondContact O-N 3.37Å; E721-Q724 PolarHBondContact O-N 3.23Å; L722-Q724 PolarHBondContact O-N 3.4Å; Q724-K727 PolarHBondContact O-N 2.88Å; Q724-K728 WeakPolarHBondContact O-CG 3.47Å; Q724-K728 PolarHBondContact O-N 2.91Å
725	Q	82.3	Confident	82.3	Confident	108 Å²	108	113.9 Å²	113.9	51%	0.505	53%	0.529	S	S	.	.	H	α-helix	trans	-63.8	-42.8	174.5	-71.7	176.7	16	0	0	111.7	E721 L722 K727 K728 L729	E721-Q725 WeakPolarHBondContact O-CG 3.42Å; E721-Q725 PolarHBondContact O-N 3.15Å; L722-Q725 PolarHBondContact O-N 3Å; Q725-K727 VanDerWaalsContact C-N 3.32Å; Q725-K727 PolarHBondContact O-N 3.26Å; Q725-K728 PolarHBondContact O-N 2.88Å; Q725-L729 PolarHBondContact O-N 2.91Å
726	L	78.8	Confident	81.7	Confident	104 Å²	104	114.5 Å²	114.5	55%	0.545	53%	0.529	S	S	.	.	H	α-helix	trans	-65.5	-37.5	178.2	-153.6	143	0	0	0	111.3	L722 R723 L729 Q730	L722-L726 VanDerWaalsContact O-CB 3.32Å; L722-L726 WeakPolarHBondContact O-CB 3.14Å; L722-L726 PolarHBondContact O-N 2.97Å; R723-L726 PolarHBondContact O-N 2.85Å; L726-L729 PolarHBondContact O-N 3.47Å; L726-Q730 HydrophobicContact CD2-CG 4.45Å; L726-Q730 WeakPolarHBondContact O-CG 3.34Å; L726-Q730 PolarHBondContact O-N 2.9Å
727	K	84.2	Confident	81.2	Confident	134 Å²	134	114.7 Å²	114.7	58%	0.583	53%	0.53	S	S	*	.	H	α-helix	trans	-64.6	-45.1	172.7	-158.6	175.7	-175.4	-178.8	0	111.9	R723 Q724 Q725 L729 Q730 E731	R723-K727 WeakPolarHBondContact O-CB 3.46Å; R723-K727 PolarHBondContact O-N 2.95Å; Q724-K727 PolarHBondContact O-N 2.88Å; Q725-K727 VanDerWaalsContact C-N 3.32Å; Q725-K727 PolarHBondContact O-N 3.26Å; K727-L729 PolarHBondContact O-N 3.37Å; K727-Q730 PolarHBondContact O-N 3.38Å; K727-E731 PolarHBondContact O-N 3.46Å
728	K	82	Confident	80.9	Confident	152 Å²	152	118.9 Å²	118.9	66%	0.661	54%	0.541	S	S	*	.	H	α-helix	trans	-59.9	-42.4	174.1	-76.1	178.9	-179.8	177.8	0	112.5	Q724 Q725 E731 S732	Q724-K728 WeakPolarHBondContact O-CG 3.47Å; Q724-K728 PolarHBondContact O-N 2.91Å; Q725-K728 PolarHBondContact O-N 2.88Å; K728-E731 PolarHBondContact O-N 2.93Å; K728-S732 WeakPolarHBondContact O-CB 3.45Å; K728-S732 PolarHBondContact O-N 3.33Å
729	L	77.7	Confident	80.5	Confident	122 Å²	122	121.5 Å²	121.5	64%	0.639	55%	0.551	S	S	*	*	H	α-helix	trans	-64.3	-40.5	175.7	-82.1	162.9	0	0	0	111.9	Q725 L726 K727 S732 K733	Q725-L729 PolarHBondContact O-N 2.91Å; L726-L729 PolarHBondContact O-N 3.47Å; K727-L729 PolarHBondContact O-N 3.37Å; L729-S732 PolarHBondContact O-N 2.95Å; L729-K733 VanDerWaalsContact O-CB 3.32Å; L729-K733 WeakPolarHBondContact O-CB 3.31Å; L729-K733 PolarHBondContact O-N 2.68Å
730	Q	78.1	Confident	80	Confident	124 Å²	124	122.6 Å²	122.6	58%	0.579	56%	0.557	S	S	*	*	H	α-helix	trans	-65.3	-41.6	174.7	-79.4	-177.7	-15.7	0	0	112.4	L726 K727 K733 R734	L726-Q730 HydrophobicContact CD2-CG 4.45Å; L726-Q730 WeakPolarHBondContact O-CG 3.34Å; L726-Q730 PolarHBondContact O-N 2.9Å; K727-Q730 PolarHBondContact O-N 3.38Å; Q730-K733 PolarHBondContact O-N 3.23Å; Q730-R734 WeakPolarHBondContact O-CB 3.31Å; Q730-R734 PolarHBondContact O-N 2.95Å
731	E	81.2	Confident	79.5	Confident	101 Å²	101	120.7 Å²	120.7	47%	0.472	56%	0.557	S	S	.	*	H	α-helix	trans	-62.1	-47.9	174.8	-131.4	94.2	-132.6	0	0	110.7	K727 K728 K733 R734 E735	K727-E731 PolarHBondContact O-N 3.46Å; K728-E731 PolarHBondContact O-N 2.93Å; E731-K733 PolarHBondContact O-N 3.49Å; E731-R734 WeakPolarHBondContact O-CA 3.43Å; E731-R734 WeakPolarHBondContact O-CB 3.37Å; E731-R734 PolarHBondContact O-N 3.44Å; E731-R734 VanDerWaalsContact O-N 3.1Å; E731-E735 PolarHBondContact O-N 3.43Å
732	S	80.6	Confident	79.1	Confident	52 Å²	52	119.5 Å²	119.5	36%	0.364	56%	0.555	S	S	.	*	H	α-helix	trans	-58.1	-45.8	176.5	-173.8	0	0	0	0	112.1	K728 L729 R734 E735 E736	K728-S732 WeakPolarHBondContact O-CB 3.45Å; K728-S732 PolarHBondContact O-N 3.33Å; L729-S732 PolarHBondContact O-N 2.95Å; S732-R734 VanDerWaalsContact C-N 3.28Å; S732-R734 PolarHBondContact O-N 2.9Å; S732-E735 PolarHBondContact O-N 3.42Å; S732-E736 PolarHBondContact O-N 3.46Å
733	K	79	Confident	78.7	Confident	124 Å²	124	119.8 Å²	119.8	54%	0.539	55%	0.553	S	S	.	*	H	α-helix	trans	-66.4	-31.1	178.1	-165.4	173.9	-174.6	173.5	0	111.9	L729 Q730 E731 R737	L729-K733 VanDerWaalsContact O-CB 3.32Å; L729-K733 WeakPolarHBondContact O-CB 3.31Å; L729-K733 PolarHBondContact O-N 2.68Å; Q730-K733 PolarHBondContact O-N 3.23Å; E731-K733 PolarHBondContact O-N 3.49Å; K733-R737 WeakPolarHBondContact O-CB 3.24Å; K733-R737 VanDerWaalsContact O-CG 3.28Å; K733-R737 WeakPolarHBondContact O-CG 3.48Å; K733-R737 PolarHBondContact O-N 3.16Å; K733-R737 VanDerWaalsContact O-N 3.14Å
734	R	76.2	Confident	78.4	Confident	191 Å²	191	118 Å²	118	72%	0.721	55%	0.552	S	S	*	*	H	α-helix	trans	-69.4	-43	172.2	-108.7	-177.7	169.4	161.3	-1.4	111.6	Q730 E731 S732 R737 K738	Q730-R734 WeakPolarHBondContact O-CB 3.31Å; Q730-R734 PolarHBondContact O-N 2.95Å; E731-R734 WeakPolarHBondContact O-CA 3.43Å; E731-R734 WeakPolarHBondContact O-CB 3.37Å; E731-R734 PolarHBondContact O-N 3.44Å; E731-R734 VanDerWaalsContact O-N 3.1Å; S732-R734 VanDerWaalsContact C-N 3.28Å; S732-R734 PolarHBondContact O-N 2.9Å; R734-R737 PolarHBondContact O-N 2.9Å; R734-K738 PolarHBondContact O-N 3.1Å
735	E	78.6	Confident	78.2	Confident	119 Å²	119	115.2 Å²	115.2	56%	0.556	55%	0.547	S	S	*	.	H	α-helix	trans	-64.4	-42	176.4	-76	-179.7	172	0	0	112.1	E731 S732 K738 K739	E731-E735 PolarHBondContact O-N 3.43Å; S732-E735 PolarHBondContact O-N 3.42Å; E735-K738 PolarHBondContact O-N 3.11Å; E735-K739 WeakPolarHBondContact O-CG 3.36Å; E735-K739 PolarHBondContact O-N 3.5Å
736	E	73.4	Confident	77.9	Confident	111 Å²	111	115.6 Å²	115.6	52%	0.519	55%	0.552	S	S	.	*	H	α-helix	trans	-62.3	-44.2	174.3	-77.3	176.8	178.3	0	0	112.4	S732 K738 K739 L740	S732-E736 PolarHBondContact O-N 3.46Å; E736-K738 VanDerWaalsContact C-N 3.26Å; E736-K738 PolarHBondContact O-N 3.41Å; E736-K739 PolarHBondContact O-N 3.23Å; E736-L740 WeakPolarHBondContact O-CG 3.41Å; E736-L740 PolarHBondContact O-N 3.39Å
737	R	74.6	Confident	78.1	Confident	169 Å²	169	118 Å²	118	64%	0.638	55%	0.554	S	S	*	*	H	α-helix	trans	-60.3	-37.7	174.3	-77.5	176.1	175.6	-168.5	-2.1	112.1	K733 R734 A741	K733-R737 WeakPolarHBondContact O-CB 3.24Å; K733-R737 VanDerWaalsContact O-CG 3.28Å; K733-R737 WeakPolarHBondContact O-CG 3.48Å; K733-R737 PolarHBondContact O-N 3.16Å; K733-R737 VanDerWaalsContact O-N 3.14Å; R734-R737 PolarHBondContact O-N 2.9Å; R737-A741 PolarHBondContact O-N 3.11Å; R737-A741 VanDerWaalsContact O-N 3.11Å
738	K	79.3	Confident	78	Confident	145 Å²	145	117.2 Å²	117.2	63%	0.63	55%	0.55	S	S	*	*	H	α-helix	trans	-68.3	-43.8	177	-161.2	179.4	179.6	-173.5	0	111.3	R734 E735 E736 L740 A741 D742	R734-K738 PolarHBondContact O-N 3.1Å; E735-K738 PolarHBondContact O-N 3.11Å; E736-K738 VanDerWaalsContact C-N 3.26Å; E736-K738 PolarHBondContact O-N 3.41Å; K738-L740 PolarHBondContact O-N 2.91Å; K738-A741 PolarHBondContact O-N 3.34Å; K738-D742 PolarHBondContact O-N 2.93Å
739	K	78.6	Confident	77.8	Confident	130 Å²	130	114.3 Å²	114.3	57%	0.565	54%	0.541	S	S	*	.	H	α-helix	trans	-59.3	-45.1	174.4	-73.4	177.2	-178	176	0	112.3	E735 E736 A741 D742 E743	E735-K739 WeakPolarHBondContact O-CG 3.36Å; E735-K739 PolarHBondContact O-N 3.5Å; E736-K739 PolarHBondContact O-N 3.23Å; K739-A741 PolarHBondContact O-N 3.17Å; K739-D742 PolarHBondContact O-N 2.86Å; K739-E743 WeakPolarHBondContact O-CB 3.34Å; K739-E743 WeakPolarHBondContact O-CG 3.45Å; K739-E743 PolarHBondContact O-N 2.91Å
740	L	73.6	Confident	78.1	Confident	104 Å²	104	114.5 Å²	114.5	55%	0.545	54%	0.537	S	S	.	.	H	α-helix	trans	-61.7	-42.8	177.3	-75.8	166.8	0	0	0	111.9	E736 K738 E743 E744	E736-L740 WeakPolarHBondContact O-CG 3.41Å; E736-L740 PolarHBondContact O-N 3.39Å; K738-L740 PolarHBondContact O-N 2.91Å; L740-E743 PolarHBondContact O-N 3.44Å; L740-E744 VanDerWaalsContact O-CB 3.32Å; L740-E744 WeakPolarHBondContact O-CB 3.49Å; L740-E744 PolarHBondContact O-N 2.93Å
741	A	75.4	Confident	78.3	Confident	53 Å²	53	113.6 Å²	113.6	44%	0.438	53%	0.533	S	S	.	.	H	α-helix	trans	-65	-40.6	176.8	0	0	0	0	0	112.3	R737 K738 K739 E744 A745	R737-A741 PolarHBondContact O-N 3.11Å; R737-A741 VanDerWaalsContact O-N 3.11Å; K738-A741 PolarHBondContact O-N 3.34Å; K739-A741 PolarHBondContact O-N 3.17Å; A741-E744 PolarHBondContact O-N 3.24Å; A741-A745 WeakPolarHBondContact O-CB 3.26Å; A741-A745 PolarHBondContact O-N 3.4Å
742	D	76.1	Confident	78.4	Confident	90 Å²	90	113.1 Å²	113.1	48%	0.481	53%	0.533	S	S	.	.	H	α-helix	trans	-66.1	-41.7	176.6	-69.5	-21.7	0	0	0	111.3	K738 K739 A745 L746	K738-D742 PolarHBondContact O-N 2.93Å; K739-D742 PolarHBondContact O-N 2.86Å; D742-A745 PolarHBondContact O-N 2.93Å; D742-L746 WeakPolarHBondContact O-CB 3.49Å; D742-L746 WeakPolarHBondContact O-CD1 3.32Å; D742-L746 WeakPolarHBondContact O-CG 3.29Å; D742-L746 PolarHBondContact O-N 2.93Å
743	E	76.4	Confident	78.4	Confident	109 Å²	109	116.5 Å²	116.5	51%	0.509	54%	0.543	S	S	.	.	H	α-helix	trans	-64.9	-37.7	175.2	-77.2	179.6	-175.2	0	0	113	K739 L740 R747	K739-E743 WeakPolarHBondContact O-CB 3.34Å; K739-E743 WeakPolarHBondContact O-CG 3.45Å; K739-E743 PolarHBondContact O-N 2.91Å; L740-E743 PolarHBondContact O-N 3.44Å; E743-R747 PolarHBondContact O-N 2.91Å
744	E	78.5	Confident	78.5	Confident	128 Å²	128	116 Å²	116	60%	0.598	54%	0.542	S	S	*	.	H	α-helix	trans	-71.5	-39.6	177.9	-157.1	168.4	-146.4	0	0	111.3	L740 A741 R747 K748	L740-E744 VanDerWaalsContact O-CB 3.32Å; L740-E744 WeakPolarHBondContact O-CB 3.49Å; L740-E744 PolarHBondContact O-N 2.93Å; A741-E744 PolarHBondContact O-N 3.24Å; E744-R747 PolarHBondContact O-N 3.22Å; E744-K748 PolarHBondContact O-N 3.46Å
745	A	77.9	Confident	78.7	Confident	49 Å²	49	112.7 Å²	112.7	41%	0.405	54%	0.535	S	S	.	.	H	α-helix	trans	-62.9	-43.4	171.6	0	0	0	0	0	112	A741 D742 K748 I749	A741-A745 WeakPolarHBondContact O-CB 3.26Å; A741-A745 PolarHBondContact O-N 3.4Å; D742-A745 PolarHBondContact O-N 2.93Å; A745-K748 PolarHBondContact O-N 2.94Å; A745-I749 WeakPolarHBondContact O-CG1 3.4Å; A745-I749 PolarHBondContact O-N 3.33Å
746	L	75.8	Confident	78.8	Confident	116 Å²	116	113.4 Å²	113.4	61%	0.607	54%	0.537	S	S	*	.	H	α-helix	trans	-60.8	-43.8	174.5	-88.3	154.5	0	0	0	112.2	D742 K748 I749 K750	D742-L746 WeakPolarHBondContact O-CB 3.49Å; D742-L746 WeakPolarHBondContact O-CD1 3.32Å; D742-L746 WeakPolarHBondContact O-CG 3.29Å; D742-L746 PolarHBondContact O-N 2.93Å; L746-K748 VanDerWaalsContact C-N 3.3Å; L746-K748 PolarHBondContact O-N 3.26Å; L746-I749 PolarHBondContact O-N 3.43Å; L746-K750 PolarHBondContact O-N 2.73Å
747	R	82.4	Confident	79.1	Confident	154 Å²	154	115.5 Å²	115.5	58%	0.581	54%	0.541	S	S	*	.	H	α-helix	trans	-60.5	-39.9	173.5	-90.2	-172.8	-83.7	150.2	-6.8	112	E743 E744 K750 Q751	E743-R747 PolarHBondContact O-N 2.91Å; E744-R747 PolarHBondContact O-N 3.22Å; R747-K750 PolarHBondContact O-N 3Å; R747-Q751 PolarHBondContact O-N 3.36Å
748	K	83.1	Confident	79.3	Confident	118 Å²	118	111.3 Å²	111.3	51%	0.513	53%	0.529	S	S	.	.	H	α-helix	trans	-68.4	-41.6	178.8	-165.5	69.1	-176.9	175.5	0	112.4	E744 A745 L746 K750 Q751 L752	E744-K748 PolarHBondContact O-N 3.46Å; A745-K748 PolarHBondContact O-N 2.94Å; L746-K748 VanDerWaalsContact C-N 3.3Å; L746-K748 PolarHBondContact O-N 3.26Å; K748-K750 VanDerWaalsContact C-N 3.34Å; K748-Q751 PolarHBondContact O-N 3.41Å; K748-L752 HydrophobicContact CG-CD1 4.45Å; K748-L752 WeakPolarHBondContact O-CG 3.45Å; K748-L752 PolarHBondContact O-N 3.38Å
749	I	77.7	Confident	79.1	Confident	91 Å²	91	109.4 Å²	109.4	47%	0.467	53%	0.525	S	S	.	.	H	α-helix	trans	-60	-47.1	174.5	-69.9	167.2	0	0	0	110	A745 L746 Q751 L752 E753	A745-I749 WeakPolarHBondContact O-CG1 3.4Å; A745-I749 PolarHBondContact O-N 3.33Å; L746-I749 PolarHBondContact O-N 3.43Å; I749-Q751 VanDerWaalsContact C-N 3.35Å; I749-Q751 PolarHBondContact O-N 3.23Å; I749-L752 PolarHBondContact O-N 3.34Å; I749-L752 VanDerWaalsContact O-N 3.08Å; I749-E753 HydrophobicContact CG2-CG 4.33Å; I749-E753 WeakPolarHBondContact O-CG 3.42Å; I749-E753 PolarHBondContact O-N 2.93Å
750	K	84.6	Confident	78.9	Confident	126 Å²	126	108.8 Å²	108.8	55%	0.548	52%	0.524	S	S	.	.	H	α-helix	trans	-59.6	-42.8	178.3	-167.1	-179.6	177.5	-174	0	112.7	L746 R747 K748 L752 E753 E754	L746-K750 PolarHBondContact O-N 2.73Å; R747-K750 PolarHBondContact O-N 3Å; K748-K750 VanDerWaalsContact C-N 3.34Å; K750-L752 VanDerWaalsContact C-N 3.34Å; K750-L752 PolarHBondContact O-N 3.05Å; K750-E753 PolarHBondContact O-N 2.84Å; K750-E754 WeakPolarHBondContact O-CG 3.5Å; K750-E754 PolarHBondContact O-N 3.2Å
751	Q	82.2	Confident	79	Confident	105 Å²	105	108.5 Å²	108.5	49%	0.491	52%	0.518	S	S	.	.	H	α-helix	trans	-60.5	-41.7	173.3	-88	-174.9	-11.6	0	0	112.7	R747 K748 I749 E754 Q755	R747-Q751 PolarHBondContact O-N 3.36Å; K748-Q751 PolarHBondContact O-N 3.41Å; I749-Q751 VanDerWaalsContact C-N 3.35Å; I749-Q751 PolarHBondContact O-N 3.23Å; Q751-E754 PolarHBondContact O-N 3.48Å; Q751-Q755 WeakPolarHBondContact O-CG 3.43Å; Q751-Q755 PolarHBondContact O-N 3.34Å
752	L	81.7	Confident	79	Confident	91 Å²	91	111.2 Å²	111.2	48%	0.476	52%	0.522	S	S	.	.	H	α-helix	trans	-69.4	-34.5	178.8	-70.8	170.9	0	0	0	111.8	K748 I749 K750 Q755 K756	K748-L752 HydrophobicContact CG-CD1 4.45Å; K748-L752 WeakPolarHBondContact O-CG 3.45Å; K748-L752 PolarHBondContact O-N 3.38Å; I749-L752 PolarHBondContact O-N 3.34Å; I749-L752 VanDerWaalsContact O-N 3.08Å; K750-L752 VanDerWaalsContact C-N 3.34Å; K750-L752 PolarHBondContact O-N 3.05Å; L752-Q755 PolarHBondContact O-N 3.46Å; L752-K756 WeakPolarHBondContact O-CB 3.39Å; L752-K756 PolarHBondContact O-N 3.13Å
753	E	80.6	Confident	78.4	Confident	124 Å²	124	113.9 Å²	113.9	58%	0.579	53%	0.533	S	S	*	.	H	α-helix	trans	-66.1	-42.1	172.9	-72.9	178.1	159.1	0	0	111.9	I749 K750 K756 Y757	I749-E753 HydrophobicContact CG2-CG 4.33Å; I749-E753 WeakPolarHBondContact O-CG 3.42Å; I749-E753 PolarHBondContact O-N 2.93Å; K750-E753 PolarHBondContact O-N 2.84Å; E753-K756 PolarHBondContact O-N 2.84Å; E753-Y757 WeakPolarHBondContact O-CB 3.5Å; E753-Y757 PolarHBondContact O-N 3.3Å
754	E	82.6	Confident	77.7	Confident	112 Å²	112	111.9 Å²	111.9	52%	0.523	54%	0.535	S	S	.	.	H	α-helix	trans	-62.6	-44.2	173.2	-75.3	169.8	-174	0	0	111.5	K750 Q751 K756 Y757 E758	K750-E754 WeakPolarHBondContact O-CG 3.5Å; K750-E754 PolarHBondContact O-N 3.2Å; Q751-E754 PolarHBondContact O-N 3.48Å; E754-K756 PolarHBondContact O-N 3.31Å; E754-Y757 PolarHBondContact O-N 3.08Å; E754-E758 PolarHBondContact O-N 2.98Å
755	Q	80.1	Confident	76.8	Confident	122 Å²	122	112.1 Å²	112.1	57%	0.57	54%	0.54	S	S	*	.	H	α-helix	trans	-62.6	-42	174.8	-77.2	-176.6	-17.1	0	0	112.5	Q751 L752 Y757 E758 L759	Q751-Q755 WeakPolarHBondContact O-CG 3.43Å; Q751-Q755 PolarHBondContact O-N 3.34Å; L752-Q755 PolarHBondContact O-N 3.46Å; Q755-Y757 VanDerWaalsContact C-N 3.32Å; Q755-Y757 PolarHBondContact O-N 3.14Å; Q755-E758 PolarHBondContact O-N 2.84Å; Q755-L759 WeakPolarHBondContact O-CB 3.41Å; Q755-L759 WeakPolarHBondContact O-CG 3.19Å; Q755-L759 PolarHBondContact O-N 3.39Å
756	K	80.1	Confident	75.3	Confident	134 Å²	134	117.5 Å²	117.5	58%	0.583	56%	0.557	S	S	*	*	H	α-helix	trans	-61.7	-41.5	174.9	-178.5	-171.2	172.6	-172.1	0	111.2	L752 E753 E754 L759 Q760	L752-K756 WeakPolarHBondContact O-CB 3.39Å; L752-K756 PolarHBondContact O-N 3.13Å; E753-K756 PolarHBondContact O-N 2.84Å; E754-K756 PolarHBondContact O-N 3.31Å; K756-L759 PolarHBondContact O-N 2.96Å; K756-Q760 WeakPolarHBondContact O-CB 3.43Å; K756-Q760 PolarHBondContact O-N 3.29Å
757	Y	80.5	Confident	73.4	Confident	155 Å²	155	120.4 Å²	120.4	61%	0.608	57%	0.565	S	S	*	*	H	α-helix	trans	-64.3	-44.3	177.1	-175.6	-99.1	0	0	0	111.7	E753 E754 Q755 L759 Q760 K761	E753-Y757 WeakPolarHBondContact O-CB 3.5Å; E753-Y757 PolarHBondContact O-N 3.3Å; E754-Y757 PolarHBondContact O-N 3.08Å; Q755-Y757 VanDerWaalsContact C-N 3.32Å; Q755-Y757 PolarHBondContact O-N 3.14Å; Y757-L759 PolarHBondContact O-N 2.86Å; Y757-Q760 PolarHBondContact O-N 3.35Å; Y757-K761 WeakPolarHBondContact O-CB 3.5Å; Y757-K761 PolarHBondContact O-N 3.49Å
758	E	78.8	Confident	71.4	Confident	82 Å²	82	118.5 Å²	118.5	38%	0.383	57%	0.572	S	S	.	*	H	α-helix	trans	-66	-38.2	177.7	-150.8	66	-144.6	0	0	111.6	E754 Q755 K761 Q762	E754-E758 PolarHBondContact O-N 2.98Å; Q755-E758 PolarHBondContact O-N 2.84Å; E758-K761 WeakPolarHBondContact O-CB 3.35Å; E758-K761 PolarHBondContact O-N 2.82Å; E758-K761 IonicContact OE1-NZ 2.71Å; E758-K761 PolarHBondContact OE1-NZ 3.48Å; E758-Q762 WeakPolarHBondContact O-CG 3.27Å; E758-Q762 PolarHBondContact O-N 3.36Å
759	L	73.5	Confident	69.1	Low	104 Å²	104	119.7 Å²	119.7	55%	0.545	59%	0.59	S	S	.	*	H	α-helix	trans	-65.2	-40.4	173	-76.1	170	0	0	0	112.4	Q755 K756 Y757 K761 Q762 M763	Q755-L759 WeakPolarHBondContact O-CB 3.41Å; Q755-L759 WeakPolarHBondContact O-CG 3.19Å; Q755-L759 PolarHBondContact O-N 3.39Å; K756-L759 PolarHBondContact O-N 2.96Å; Y757-L759 PolarHBondContact O-N 2.86Å; L759-K761 VanDerWaalsContact C-N 3.3Å; L759-K761 PolarHBondContact O-N 2.84Å; L759-Q762 PolarHBondContact O-N 3.21Å; L759-M763 WeakPolarHBondContact O-CB 3.47Å; L759-M763 VanDerWaalsContact O-CG 3.31Å; L759-M763 WeakPolarHBondContact O-CG 3.33Å; L759-M763 PolarHBondContact O-N 3.4Å
760	Q	74.6	Confident	67.1	Low	117 Å²	117	122.6 Å²	122.6	55%	0.547	61%	0.606	S	S	.	*	H	α-helix	trans	-63.5	-37.2	173.8	-86.8	-176	-32.9	0	0	112.1	K756 Y757 M763 A764	K756-Q760 WeakPolarHBondContact O-CB 3.43Å; K756-Q760 PolarHBondContact O-N 3.29Å; Y757-Q760 PolarHBondContact O-N 3.35Å; Q760-M763 PolarHBondContact O-N 2.87Å; Q760-A764 WeakPolarHBondContact O-CB 3.38Å; Q760-A764 PolarHBondContact O-N 2.94Å
761	K	76.7	Confident	64.6	Low	99 Å²	99	124.2 Å²	124.2	43%	0.43	62%	0.621	S	S	.	*	H	α-helix	trans	-67.4	-39.9	174.5	-175.9	-179.9	163.4	-154.8	0	111.9	Y757 E758 L759 A764 N765	Y757-K761 WeakPolarHBondContact O-CB 3.5Å; Y757-K761 PolarHBondContact O-N 3.49Å; E758-K761 WeakPolarHBondContact O-CB 3.35Å; E758-K761 PolarHBondContact O-N 2.82Å; E758-K761 IonicContact OE1-NZ 2.71Å; E758-K761 PolarHBondContact OE1-NZ 3.48Å; L759-K761 VanDerWaalsContact C-N 3.3Å; L759-K761 PolarHBondContact O-N 2.84Å; K761-A764 PolarHBondContact O-N 3.24Å; K761-N765 PolarHBondContact O-N 3Å
762	Q	74.1	Confident	62.1	Low	109 Å²	109	124 Å²	124	51%	0.509	63%	0.631	S	S	.	*	H	α-helix	trans	-64.4	-40.2	173.1	-71.6	174.1	22.8	0	0	111.9	E758 L759 N765 H766	E758-Q762 WeakPolarHBondContact O-CG 3.27Å; E758-Q762 PolarHBondContact O-N 3.36Å; L759-Q762 PolarHBondContact O-N 3.21Å; Q762-N765 PolarHBondContact O-N 2.92Å; Q762-H766 PolarHBondContact O-N 3.01Å
763	M	64.6	Low	59.5	Low	147 Å²	147	132.2 Å²	132.2	72%	0.724	66%	0.656	S	S	*	*	H	α-helix	trans	-64.7	-37.6	173.4	-75.8	-74.1	-57.4	0	0	112.6	L759 Q760 H766	L759-M763 WeakPolarHBondContact O-CB 3.47Å; L759-M763 VanDerWaalsContact O-CG 3.31Å; L759-M763 WeakPolarHBondContact O-CG 3.33Å; L759-M763 PolarHBondContact O-N 3.4Å; Q760-M763 PolarHBondContact O-N 2.87Å; M763-H766 PolarHBondContact O-N 3.37Å
764	A	61.9	Low	56.9	Low	67 Å²	67	129.5 Å²	129.5	55%	0.554	66%	0.66	S	S	*	*	H	α-helix	trans	-68.8	-36	176.8	0	0	0	0	0	112.2	Q760 K761 H766	Q760-A764 WeakPolarHBondContact O-CB 3.38Å; Q760-A764 PolarHBondContact O-N 2.94Å; K761-A764 PolarHBondContact O-N 3.24Å; A764-H766 PolarHBondContact O-N 3.42Å
765	N	58.8	Low	54.3	Low	132 Å²	132	130.5 Å²	130.5	71%	0.706	68%	0.68	S	S	*	*	H	α-helix	trans	-72.6	-14	175.8	-77.4	3.3	0	0	0	113.8	K761 Q762	K761-N765 PolarHBondContact O-N 3Å; Q762-N765 PolarHBondContact O-N 2.92Å
766	H	47.1	Very low	51.9	Low	162 Å²	162	128.4 Å²	128.4	75%	0.75	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.5	10.5	178.7	-92.3	-81	0	0	0	114.5	Q762 M763 A764 P768	Q762-H766 PolarHBondContact O-N 3.01Å; M763-H766 PolarHBondContact O-N 3.37Å; A764-H766 PolarHBondContact O-N 3.42Å; H766-P768 WeakPolarHBondContact O-CD 3.37Å
767	K	35.7	Very low	49.4	Very low	178 Å²	178	126.8 Å²	126.8	77%	0.774	70%	0.703	S	S	*	*			trans	-80.6	113.6	176.5	-143.8	171.8	-174.5	178.9	0	109.9	T769	K767-T769 PolarHBondContact O-N 2.9Å
768	P	40.2	Very low	47.9	Very low	114 Å²	114	125.5 Å²	125.5	74%	0.74	71%	0.713	S	S	*	*			trans	-74.6	123.1	-170.5	-1	16.5	0	0	0	110.5	H766 D770	H766-P768 WeakPolarHBondContact O-CD 3.37Å; P768-D770 VanDerWaalsContact C-N 3.33Å; P768-D770 PolarHBondContact O-N 3.22Å; P768-D770 VanDerWaalsContact O-N 3.14Å
769	T	35.6	Very low	45.4	Very low	143 Å²	143	124.7 Å²	124.7	88%	0.877	73%	0.727	S	S	*	*			trans	-76.1	87.4	162.9	-53.6	0	0	0	0	107.8	K767	K767-T769 PolarHBondContact O-N 2.9Å
770	D	34.7	Very low	43.2	Very low	151 Å²	151	126.6 Å²	126.6	81%	0.807	74%	0.743	S	S	*	*			trans	-136.1	73.7	163.4	-137.6	-5.5	0	0	0	109.3	P768	P768-D770 VanDerWaalsContact C-N 3.33Å; P768-D770 PolarHBondContact O-N 3.22Å; P768-D770 VanDerWaalsContact O-N 3.14Å
771	N	31.9	Very low	40.9	Very low	160 Å²	160	125.3 Å²	125.3	86%	0.856	75%	0.753	S	S	*	*			trans	-92	111.9	159.5	-89	14.5	0	0	0	106.6
772	S	29.5	Very low	38.6	Very low	100 Å²	100	127.1 Å²	127.1	70%	0.699	77%	0.767	S	S	*	*			trans	175.1	70	142.6	179.6	0	0	0	0	112.2
773	W	27.1	Very low	36.6	Very low	265 Å²	265	133.1 Å²	133.1	100%	1.004	79%	0.787	S	S	*	*			trans	-129.8	99.7	145.5	-95.8	69.7	0	0	0	107.5
774	G	27.2	Very low	34.9	Very low	66 Å²	66	131.6 Å²	131.6	68%	0.68	79%	0.786	S	S	*	*			trans	-74	150.8	-172.6	0	0	0	0	0	113.5
775	S	27	Very low	33.4	Very low	134 Å²	134	139.8 Å²	139.8	94%	0.937	80%	0.802	S	S	*	*			trans	33.4	99.2	132.4	-60.3	0	0	0	0	117.8
776	G	30.9	Very low	32.5	Very low	78 Å²	78	138.9 Å²	138.9	80%	0.804	80%	0.804	S	S	*	*			trans	-132.9	105.8	151.6	0	0	0	0	0	108.2
777	A	28.3	Very low	32	Very low	100 Å²	100	140.5 Å²	140.5	83%	0.826	81%	0.809	S	S	*	*			trans	-81.8	-161.9	179.6	0	0	0	0	0	111.1
778	P	48.3	Very low	32.1	Very low	127 Å²	127	138.8 Å²	138.8	83%	0.825	81%	0.813	S	S	*	*				-115.8	162.6	-109.7	35	-17.1	0	0	0	114.5
779	G	26.7	Very low	32.1	Very low	65 Å²	65	135.3 Å²	135.3	67%	0.67	80%	0.798	S	S	*	*			trans	104.8	160.5	144.6	0	0	0	0	0	118
780	T	25.8	Very low	33.2	Very low	145 Å²	145	131.4 Å²	131.4	89%	0.89	78%	0.776	S	S	*	*			trans	77.1	96.8	169.3	63.8	0	0	0	0	115.4
781	A	26.8	Very low	34.3	Very low	90 Å²	90	132 Å²	132	74%	0.744	77%	0.774	S	S	*	*				87.5	103.2	80.3	0	0	0	0	0	112.5
782	N	28.6	Very low	35.5	Very low	136 Å²	136	131.3 Å²	131.3	73%	0.727	77%	0.766	S	S	*	*				53.9	101.4	129.1	-148.2	44.1	0	0	0	117.5
783	Y	32	Very low	36.9	Very low	236 Å²	236	132.9 Å²	132.9	93%	0.925	76%	0.762	S	S	*	*			trans	-148.6	112.7	137.4	-101.1	-77.3	0	0	0	111.1
784	T	29.1	Very low	38.7	Very low	115 Å²	115	126 Å²	126	71%	0.706	74%	0.741	S	S	*	*			trans	-59.8	130.3	173.3	-27.7	0	0	0	0	111.5
785	R	31	Very low	40.9	Very low	238 Å²	238	124.9 Å²	124.9	90%	0.898	73%	0.726	S	S	*	*			trans	-146.9	102.6	156	-144.9	178.4	-168.3	-146.7	2	109.6	F787	R785-F787 PolarHBondContact O-N 3.39Å
786	P	39.3	Very low	43.1	Very low	113 Å²	113	123.8 Å²	123.8	73%	0.734	71%	0.709	S	S	*	*			trans	-80.2	114.5	177.9	29.9	-26.7	0	0	0	108.8
787	F	37.5	Very low	45.3	Very low	197 Å²	197	125 Å²	125	86%	0.864	70%	0.696	S	S	*	*			trans	-109.2	102.7	172.8	-175.3	-104.5	0	0	0	108.3	R785	R785-F787 PolarHBondContact O-N 3.39Å
788	V	37	Very low	47.7	Very low	141 Å²	141	124.4 Å²	124.4	86%	0.855	68%	0.679	S	S	*	*			trans	-80.1	110.9	176.7	177.8	0	0	0	0	107
789	G	40.8	Very low	49.2	Very low	42 Å²	42	124.2 Å²	124.2	43%	0.433	67%	0.667	S	S	.	*			trans	-141.2	96.3	-178.2	0	0	0	0	0	111.3
790	S	57.1	Low	51.8	Low	60 Å²	60	127.2 Å²	127.2	42%	0.42	67%	0.665	S	S	.	*			trans	58.2	110.2	156.3	-169.6	0	0	0	0	119.1	E792 E793	S790-E792 PolarHBondContact O-N 2.9Å; S790-E792 WeakPolarHBondContact OG-CB 3.44Å; S790-E792 PolarHBondContact OG-N 3.23Å; S790-E793 PolarHBondContact O-N 3.14Å; S790-E793 VanDerWaalsContact O-N 3.1Å
791	H	57.6	Low	54.5	Low	163 Å²	163	127 Å²	127	76%	0.755	65%	0.654	S	S	*	*	H	α-helix	trans	-49.9	-15.7	164.3	-85.6	-60.9	0	0	0	114.5	E794 A795	H791-E794 IonicContact ND1-OE2 3.91Å; H791-A795 WeakPolarHBondContact O-CB 3.46Å; H791-A795 PolarHBondContact O-N 3.42Å
792	E	58.8	Low	57.4	Low	147 Å²	147	127.6 Å²	127.6	69%	0.687	65%	0.648	S	S	*	*	H	α-helix	trans	-75.8	-35.8	177.4	-59.8	176.7	155.8	0	0	112.9	S790 A795 L796	S790-E792 PolarHBondContact O-N 2.9Å; S790-E792 WeakPolarHBondContact OG-CB 3.44Å; S790-E792 PolarHBondContact OG-N 3.23Å; E792-A795 PolarHBondContact O-N 2.95Å; E792-L796 WeakPolarHBondContact O-CG 3.11Å; E792-L796 PolarHBondContact O-N 2.96Å
793	E	57.7	Low	60	Low	133 Å²	133	125.7 Å²	125.7	62%	0.621	64%	0.642	S	S	*	*	H	α-helix	trans	-72.2	-38.5	177.2	-70.8	-174.6	173.5	0	0	111	S790 L796 L797	S790-E793 PolarHBondContact O-N 3.14Å; S790-E793 VanDerWaalsContact O-N 3.1Å; E793-L796 PolarHBondContact O-N 3.25Å; E793-L797 WeakPolarHBondContact O-CG 3.32Å; E793-L797 PolarHBondContact O-N 3.46Å
794	E	66.2	Low	62.5	Low	119 Å²	119	116 Å²	116	56%	0.556	61%	0.614	S	S	*	*	H	α-helix	trans	-66.6	-36.7	173.2	-165.2	173.9	-160.2	0	0	111.5	H791 N798	H791-E794 IonicContact ND1-OE2 3.91Å; E794-N798 WeakPolarHBondContact O-CB 3.43Å; E794-N798 VanDerWaalsContact O-CG 3.27Å; E794-N798 PolarHBondContact O-N 3.46Å; E794-N798 PolarHBondContact O-ND2 2.91Å
795	A	73.2	Confident	65.4	Low	44 Å²	44	115.4 Å²	115.4	36%	0.364	60%	0.603	S	S	.	*	H	α-helix	trans	-65.6	-43.3	173.5	0	0	0	0	0	112.5	H791 E792 N798 E799	H791-A795 WeakPolarHBondContact O-CB 3.46Å; H791-A795 PolarHBondContact O-N 3.42Å; E792-A795 PolarHBondContact O-N 2.95Å; A795-N798 PolarHBondContact O-N 2.97Å; A795-E799 WeakPolarHBondContact O-CG 3.25Å; A795-E799 PolarHBondContact O-N 3.27Å
796	L	73.5	Confident	68	Low	110 Å²	110	106.7 Å²	106.7	58%	0.576	58%	0.582	S	S	*	*	H	α-helix	trans	-67.1	-37.8	177.5	-75	170.2	0	0	0	112.8	E792 E793 E799 M800	E792-L796 WeakPolarHBondContact O-CG 3.11Å; E792-L796 PolarHBondContact O-N 2.96Å; E793-L796 PolarHBondContact O-N 3.25Å; L796-E799 PolarHBondContact O-N 3.33Å; L796-M800 WeakPolarHBondContact O-CB 3.49Å; L796-M800 PolarHBondContact O-N 2.9Å
797	L	76.1	Confident	70.4	Confident	105 Å²	105	107.6 Å²	107.6	55%	0.55	57%	0.574	S	S	.	*	H	α-helix	trans	-63.3	-43.7	173.2	-74	171.9	0	0	0	110.9	E793 M800 E801	E793-L797 WeakPolarHBondContact O-CG 3.32Å; E793-L797 PolarHBondContact O-N 3.46Å; L797-M800 HydrophobicContact CD2-CE 4.05Å; L797-M800 PolarHBondContact O-N 3.36Å; L797-E801 WeakPolarHBondContact O-CB 3.44Å; L797-E801 PolarHBondContact O-N 2.93Å
798	N	78	Confident	72.8	Confident	87 Å²	87	103.9 Å²	103.9	47%	0.465	56%	0.56	S	S	.	*	H	α-helix	trans	-63.6	-40.9	174.6	-75.2	-25	0	0	0	112.3	E794 A795 E801 V802	E794-N798 WeakPolarHBondContact O-CB 3.43Å; E794-N798 VanDerWaalsContact O-CG 3.27Å; E794-N798 PolarHBondContact O-N 3.46Å; E794-N798 PolarHBondContact O-ND2 2.91Å; A795-N798 PolarHBondContact O-N 2.97Å; N798-E801 PolarHBondContact O-N 2.64Å; N798-V802 WeakPolarHBondContact O-CB 3.22Å; N798-V802 VanDerWaalsContact O-CG2 3.23Å; N798-V802 WeakPolarHBondContact O-CG2 3.45Å; N798-V802 PolarHBondContact O-N 3.28Å
799	E	80.6	Confident	75.4	Confident	123 Å²	123	100.4 Å²	100.4	58%	0.575	54%	0.537	S	S	*	.	H	α-helix	trans	-65.5	-38.8	175.8	-78	-177.3	-178.4	0	0	112.6	A795 L796 E801 V802 T803	A795-E799 WeakPolarHBondContact O-CG 3.25Å; A795-E799 PolarHBondContact O-N 3.27Å; L796-E799 PolarHBondContact O-N 3.33Å; E799-E801 VanDerWaalsContact C-N 3.35Å; E799-V802 PolarHBondContact O-N 2.93Å; E799-T803 VanDerWaalsContact O-CB 3.32Å; E799-T803 WeakPolarHBondContact O-CB 3.34Å; E799-T803 PolarHBondContact O-N 2.99Å; E799-T803 PolarHBondContact O-OG1 3.45Å
800	M	82	Confident	77.8	Confident	128 Å²	128	104 Å²	104	63%	0.631	54%	0.543	S	S	*	.	H	α-helix	trans	-66.6	-38.7	175.4	-172.6	173.4	65.3	0	0	111.3	L796 L797 T803 G804	L796-M800 WeakPolarHBondContact O-CB 3.49Å; L796-M800 PolarHBondContact O-N 2.9Å; L797-M800 HydrophobicContact CD2-CE 4.05Å; L797-M800 PolarHBondContact O-N 3.36Å; M800-T803 PolarHBondContact O-N 3Å; M800-G804 PolarHBondContact O-N 3.49Å
801	E	82.3	Confident	79.2	Confident	141 Å²	141	106.9 Å²	106.9	66%	0.659	55%	0.55	S	S	*	*	H	α-helix	trans	-67.6	-43.2	176	-159.6	168.1	-154.4	0	0	111.3	L797 N798 E799 T803 G804 Q805	L797-E801 WeakPolarHBondContact O-CB 3.44Å; L797-E801 PolarHBondContact O-N 2.93Å; N798-E801 PolarHBondContact O-N 2.64Å; E799-E801 VanDerWaalsContact C-N 3.35Å; E801-T803 PolarHBondContact O-N 3.46Å; E801-G804 PolarHBondContact O-N 3.49Å; E801-Q805 WeakPolarHBondContact O-CB 3.44Å; E801-Q805 PolarHBondContact O-N 3.49Å
802	V	87.2	Confident	80.8	Confident	101 Å²	101	103.6 Å²	103.6	61%	0.612	54%	0.535	S	S	*	.	H	α-helix	trans	-63.2	-41.8	173.8	171.1	0	0	0	0	111.8	N798 E799 Q805 A806	N798-V802 WeakPolarHBondContact O-CB 3.22Å; N798-V802 VanDerWaalsContact O-CG2 3.23Å; N798-V802 WeakPolarHBondContact O-CG2 3.45Å; N798-V802 PolarHBondContact O-N 3.28Å; E799-V802 PolarHBondContact O-N 2.93Å; V802-Q805 PolarHBondContact O-N 3.49Å; V802-A806 WeakPolarHBondContact O-CB 3.34Å; V802-A806 PolarHBondContact O-N 3.03Å
803	T	83	Confident	82.3	Confident	96 Å²	96	101.5 Å²	101.5	59%	0.589	53%	0.525	S	S	*	.	H	α-helix	trans	-69.8	-37.7	178.2	-53.3	0	0	0	0	111.4	E799 M800 E801 A806 F807	E799-T803 VanDerWaalsContact O-CB 3.32Å; E799-T803 WeakPolarHBondContact O-CB 3.34Å; E799-T803 PolarHBondContact O-N 2.99Å; E799-T803 PolarHBondContact O-OG1 3.45Å; M800-T803 PolarHBondContact O-N 3Å; E801-T803 PolarHBondContact O-N 3.46Å; T803-A806 PolarHBondContact O-N 3.35Å; T803-F807 WeakPolarHBondContact O-CB 3.22Å; T803-F807 PolarHBondContact O-N 3.26Å
804	G	85.5	Confident	83.7	Confident	33 Å²	33	99.6 Å²	99.6	34%	0.34	52%	0.519	S	S	.	.	H	α-helix	trans	-60.4	-48.9	172.3	0	0	0	0	0	111.3	M800 E801 A806 F807 E808	M800-G804 PolarHBondContact O-N 3.49Å; E801-G804 PolarHBondContact O-N 3.49Å; G804-A806 PolarHBondContact O-N 3.01Å; G804-F807 PolarHBondContact O-N 2.78Å; G804-F807 VanDerWaalsContact O-N 3.16Å; G804-E808 WeakPolarHBondContact O-CG 3.44Å; G804-E808 PolarHBondContact O-N 2.96Å
805	Q	89.3	Confident	84.8	Confident	102 Å²	102	96.9 Å²	96.9	48%	0.477	51%	0.514	S	S	.	.	H	α-helix	trans	-60.1	-45.2	176.3	-169.8	62.6	51.1	0	0	111.9	E801 V802 F807 E808 D809	E801-Q805 WeakPolarHBondContact O-CB 3.44Å; E801-Q805 PolarHBondContact O-N 3.49Å; V802-Q805 PolarHBondContact O-N 3.49Å; Q805-F807 VanDerWaalsContact C-N 3.28Å; Q805-F807 PolarHBondContact O-N 3.13Å; Q805-E808 PolarHBondContact O-N 3.08Å; Q805-D809 PolarHBondContact NE2-OD1 2.83Å; Q805-D809 WeakPolarHBondContact O-CB 3.46Å; Q805-D809 PolarHBondContact O-N 3.26Å
806	A	86.4	Confident	85.7	Confident	55 Å²	55	101.2 Å²	101.2	46%	0.455	52%	0.521	S	S	.	.	H	α-helix	trans	-63.2	-33.6	177.3	0	0	0	0	0	112.8	V802 T803 G804 M810	V802-A806 WeakPolarHBondContact O-CB 3.34Å; V802-A806 PolarHBondContact O-N 3.03Å; T803-A806 PolarHBondContact O-N 3.35Å; G804-A806 PolarHBondContact O-N 3.01Å; A806-M810 WeakPolarHBondContact O-CB 3.5Å; A806-M810 PolarHBondContact O-N 2.92Å
807	F	88.2	Confident	86.6	Confident	132 Å²	132	100.9 Å²	100.9	58%	0.579	52%	0.519	S	S	*	.	H	α-helix	trans	-72	-43.3	175.2	-176.4	-94.7	0	0	0	112	T803 G804 Q805 M810 Q811	T803-F807 WeakPolarHBondContact O-CB 3.22Å; T803-F807 PolarHBondContact O-N 3.26Å; G804-F807 PolarHBondContact O-N 2.78Å; G804-F807 VanDerWaalsContact O-N 3.16Å; Q805-F807 VanDerWaalsContact C-N 3.28Å; Q805-F807 PolarHBondContact O-N 3.13Å; F807-M810 PolarHBondContact O-N 3.2Å; F807-Q811 WeakPolarHBondContact O-CB 3.32Å; F807-Q811 PolarHBondContact O-N 3.39Å
808	E	88.9	Confident	87.4	Confident	119 Å²	119	99.3 Å²	99.3	56%	0.556	51%	0.51	S	S	*	.	H	α-helix	trans	-61.2	-45	174.4	-73.4	-176.8	-178.5	0	0	111.1	G804 Q805 M810 Q811 E812	G804-E808 WeakPolarHBondContact O-CG 3.44Å; G804-E808 PolarHBondContact O-N 2.96Å; Q805-E808 PolarHBondContact O-N 3.08Å; E808-M810 VanDerWaalsContact C-N 3.34Å; E808-M810 PolarHBondContact O-N 2.9Å; E808-Q811 PolarHBondContact O-N 3.29Å; E808-Q811 VanDerWaalsContact O-N 3.17Å; E808-E812 WeakPolarHBondContact O-CB 3.36Å; E808-E812 PolarHBondContact O-N 3.23Å
809	D	91.1	Very high	87.9	Confident	69 Å²	69	100.5 Å²	100.5	37%	0.369	51%	0.513	S	S	.	.	H	α-helix	trans	-60.1	-42.4	175.5	-71.6	-2.3	0	0	0	111.6	Q805 E812 Q813	Q805-D809 PolarHBondContact NE2-OD1 2.83Å; Q805-D809 WeakPolarHBondContact O-CB 3.46Å; Q805-D809 PolarHBondContact O-N 3.26Å; D809-E812 PolarHBondContact O-N 3.02Å; D809-Q813 WeakPolarHBondContact O-CB 3.37Å; D809-Q813 VanDerWaalsContact O-CG 3.27Å; D809-Q813 WeakPolarHBondContact O-CG 3.33Å; D809-Q813 PolarHBondContact O-N 3.19Å
810	M	90.2	Very high	88.4	Confident	116 Å²	116	100 Å²	100	57%	0.571	51%	0.511	S	S	*	.	H	α-helix	trans	-66.6	-40.1	175.9	-175.3	67.6	64.2	0	0	111.8	A806 F807 E808 E812 Q813 N814	A806-M810 WeakPolarHBondContact O-CB 3.5Å; A806-M810 PolarHBondContact O-N 2.92Å; F807-M810 PolarHBondContact O-N 3.2Å; E808-M810 VanDerWaalsContact C-N 3.34Å; E808-M810 PolarHBondContact O-N 2.9Å; M810-E812 VanDerWaalsContact C-N 3.32Å; M810-Q813 PolarHBondContact O-N 3.14Å; M810-N814 WeakPolarHBondContact O-CB 3.36Å; M810-N814 PolarHBondContact O-N 3.15Å
811	Q	88	Confident	88.8	Confident	122 Å²	122	98.9 Å²	98.9	57%	0.57	51%	0.506	S	S	*	.	H	α-helix	trans	-67.1	-37.3	178	-165	170.2	24.4	0	0	110.9	F807 E808 N814 S815	F807-Q811 WeakPolarHBondContact O-CB 3.32Å; F807-Q811 PolarHBondContact O-N 3.39Å; E808-Q811 PolarHBondContact O-N 3.29Å; E808-Q811 VanDerWaalsContact O-N 3.17Å; Q811-N814 PolarHBondContact O-N 3.13Å; Q811-S815 PolarHBondContact O-N 3.12Å
812	E	91	Very high	89.1	Confident	94 Å²	94	100.3 Å²	100.3	44%	0.439	51%	0.506	S	S	.	.	H	α-helix	trans	-68.8	-39.3	172.7	-162	-175.4	175.9	0	0	112.2	E808 D809 M810 N814 S815 R816	E808-E812 WeakPolarHBondContact O-CB 3.36Å; E808-E812 PolarHBondContact O-N 3.23Å; D809-E812 PolarHBondContact O-N 3.02Å; M810-E812 VanDerWaalsContact C-N 3.32Å; E812-N814 VanDerWaalsContact C-N 3.35Å; E812-N814 PolarHBondContact O-N 3.37Å; E812-S815 WeakPolarHBondContact CA-OG 3.48Å; E812-S815 PolarHBondContact O-N 3.43Å; E812-S815 PolarHBondContact O-OG 3.46Å; E812-R816 VanDerWaalsContact CD-NH2 3.25Å; E812-R816 VanDerWaalsContact O-CG 3.29Å; E812-R816 WeakPolarHBondContact O-CG 3.42Å; E812-R816 PolarHBondContact O-N 2.95Å; E812-R816 IonicContact OE1-CZ 3.64Å; E812-R816 IonicContact OE1-NE 3.26Å; E812-R816 IonicContact OE1-NH2 3.53Å; E812-R816 PolarHBondContact OE1-NH2 3.02Å; E812-R816 IonicContact OE2-NH2 2.8Å
813	Q	90	Very high	89.3	Confident	102 Å²	102	100.5 Å²	100.5	48%	0.477	50%	0.5	S	S	.	.	H	α-helix	trans	-61	-44.8	171.8	-75.4	175.4	25.6	0	0	111.4	D809 M810 S815 R816 L817	D809-Q813 WeakPolarHBondContact O-CB 3.37Å; D809-Q813 VanDerWaalsContact O-CG 3.27Å; D809-Q813 WeakPolarHBondContact O-CG 3.33Å; D809-Q813 PolarHBondContact O-N 3.19Å; M810-Q813 PolarHBondContact O-N 3.14Å; Q813-S815 PolarHBondContact O-N 3.34Å; Q813-R816 PolarHBondContact O-N 3.4Å; Q813-L817 WeakPolarHBondContact O-CD1 3.33Å; Q813-L817 PolarHBondContact O-N 3.05Å
814	N	87.4	Confident	89.6	Confident	93 Å²	93	102.9 Å²	102.9	50%	0.497	50%	0.502	S	S	.	.	H	α-helix	trans	-64.7	-40.3	179.1	-157.7	-31.1	0	0	0	111.7	M810 Q811 E812 R816 L817 I818	M810-N814 WeakPolarHBondContact O-CB 3.36Å; M810-N814 PolarHBondContact O-N 3.15Å; Q811-N814 PolarHBondContact O-N 3.13Å; E812-N814 VanDerWaalsContact C-N 3.35Å; E812-N814 PolarHBondContact O-N 3.37Å; N814-R816 PolarHBondContact O-N 3.25Å; N814-L817 PolarHBondContact O-N 3.23Å; N814-I818 WeakPolarHBondContact O-CG1 3.45Å; N814-I818 PolarHBondContact O-N 2.85Å; N814-I818 WeakPolarHBondContact OD1-CD1 3.31Å
815	S	89.6	Confident	89.9	Confident	62 Å²	62	105.2 Å²	105.2	43%	0.434	51%	0.507	S	S	.	.	H	α-helix	trans	-62.9	-40.6	175.1	73.1	0	0	0	0	111.9	Q811 E812 Q813 I818 Q819	Q811-S815 PolarHBondContact O-N 3.12Å; E812-S815 WeakPolarHBondContact CA-OG 3.48Å; E812-S815 PolarHBondContact O-N 3.43Å; E812-S815 PolarHBondContact O-OG 3.46Å; Q813-S815 PolarHBondContact O-N 3.34Å; S815-I818 PolarHBondContact O-N 3.44Å; S815-Q819 WeakPolarHBondContact O-CB 3.49Å; S815-Q819 PolarHBondContact O-N 3.35Å
816	R	92.3	Very high	90	Very high	136 Å²	136	105 Å²	105	51%	0.513	51%	0.509	S	S	.	.	H	α-helix	trans	-62.8	-43	173	-70.3	173.8	-172.1	178.2	5.2	112.3	E812 Q813 N814 Q819 Q820	E812-R816 VanDerWaalsContact CD-NH2 3.25Å; E812-R816 VanDerWaalsContact O-CG 3.29Å; E812-R816 WeakPolarHBondContact O-CG 3.42Å; E812-R816 PolarHBondContact O-N 2.95Å; E812-R816 IonicContact OE1-CZ 3.64Å; E812-R816 IonicContact OE1-NE 3.26Å; E812-R816 IonicContact OE1-NH2 3.53Å; E812-R816 PolarHBondContact OE1-NH2 3.02Å; E812-R816 IonicContact OE2-NH2 2.8Å; Q813-R816 PolarHBondContact O-N 3.4Å; N814-R816 PolarHBondContact O-N 3.25Å; R816-Q819 PolarHBondContact O-N 2.99Å; R816-Q820 WeakPolarHBondContact O-CG 3.33Å; R816-Q820 PolarHBondContact O-N 2.87Å
817	L	92.4	Very high	90.2	Very high	102 Å²	102	104.6 Å²	104.6	53%	0.534	51%	0.506	S	S	.	.	H	α-helix	trans	-64.3	-41.9	176.5	-93.1	111.2	0	0	0	112.4	Q813 N814 Q819 Q820 L821	Q813-L817 WeakPolarHBondContact O-CD1 3.33Å; Q813-L817 PolarHBondContact O-N 3.05Å; N814-L817 PolarHBondContact O-N 3.23Å; L817-Q819 VanDerWaalsContact C-N 3.33Å; L817-Q820 PolarHBondContact O-N 3.46Å; L817-L821 PolarHBondContact O-N 2.9Å
818	I	90.9	Very high	90.2	Very high	73 Å²	73	103 Å²	103	37%	0.374	50%	0.503	S	S	.	.	H	α-helix	trans	-63.8	-41.6	176	-69.6	168.7	0	0	0	110.6	N814 S815 L821 R822	N814-I818 WeakPolarHBondContact O-CG1 3.45Å; N814-I818 PolarHBondContact O-N 2.85Å; N814-I818 WeakPolarHBondContact OD1-CD1 3.31Å; S815-I818 PolarHBondContact O-N 3.44Å; I818-L821 PolarHBondContact O-N 3.49Å; I818-R822 WeakPolarHBondContact O-CG 3.45Å; I818-R822 PolarHBondContact O-N 2.98Å
819	Q	90.5	Very high	90.2	Very high	111 Å²	111	103.9 Å²	103.9	52%	0.519	51%	0.506	S	S	.	.	H	α-helix	trans	-63	-45.3	176.1	-178.3	170.5	-5.7	0	0	111.5	S815 R816 L817 L821 R822 E823	S815-Q819 WeakPolarHBondContact O-CB 3.49Å; S815-Q819 PolarHBondContact O-N 3.35Å; R816-Q819 PolarHBondContact O-N 2.99Å; L817-Q819 VanDerWaalsContact C-N 3.33Å; Q819-L821 VanDerWaalsContact C-N 3.31Å; Q819-L821 PolarHBondContact O-N 3.34Å; Q819-R822 PolarHBondContact O-N 3.28Å; Q819-E823 HydrophobicContact CG-CG 4.42Å; Q819-E823 VanDerWaalsContact CG-OE1 3.31Å; Q819-E823 WeakPolarHBondContact CG-OE1 3.41Å; Q819-E823 PolarHBondContact NE2-OE1 3.23Å; Q819-E823 WeakPolarHBondContact O-CG 3.31Å; Q819-E823 PolarHBondContact O-N 2.93Å
820	Q	90	Very high	90.2	Very high	113 Å²	113	107.4 Å²	107.4	53%	0.528	52%	0.518	S	S	.	.	H	α-helix	trans	-61.3	-37.4	175.8	-74.1	177	4.1	0	0	112.9	R816 L817 K824	R816-Q820 WeakPolarHBondContact O-CG 3.33Å; R816-Q820 PolarHBondContact O-N 2.87Å; L817-Q820 PolarHBondContact O-N 3.46Å; Q820-K824 WeakPolarHBondContact O-CB 3.41Å; Q820-K824 WeakPolarHBondContact O-CG 3.44Å; Q820-K824 PolarHBondContact O-N 3.11Å
821	L	89.5	Confident	90.2	Very high	104 Å²	104	106.9 Å²	106.9	55%	0.545	52%	0.517	S	S	.	.	H	α-helix	trans	-64.2	-46.2	174.5	-80.8	166.2	0	0	0	111.4	L817 I818 Q819 E823 K824 D825	L817-L821 PolarHBondContact O-N 2.9Å; I818-L821 PolarHBondContact O-N 3.49Å; Q819-L821 VanDerWaalsContact C-N 3.31Å; Q819-L821 PolarHBondContact O-N 3.34Å; L821-E823 PolarHBondContact O-N 3.37Å; L821-K824 PolarHBondContact O-N 3.3Å; L821-D825 PolarHBondContact O-N 3.27Å
822	R	90.6	Very high	90.2	Very high	171 Å²	171	106.3 Å²	106.3	65%	0.645	52%	0.515	S	S	*	.	H	α-helix	trans	-61.2	-43.7	175.9	-70.7	177.2	-176.6	172.6	1.9	112.1	I818 Q819 K824 D825 D826	I818-R822 WeakPolarHBondContact O-CG 3.45Å; I818-R822 PolarHBondContact O-N 2.98Å; Q819-R822 PolarHBondContact O-N 3.28Å; R822-K824 VanDerWaalsContact C-N 3.33Å; R822-K824 PolarHBondContact O-N 3.47Å; R822-D825 PolarHBondContact O-N 2.95Å; R822-D826 WeakPolarHBondContact O-CB 3.4Å; R822-D826 PolarHBondContact O-N 3.48Å
823	E	91.5	Very high	90.1	Very high	105 Å²	105	104.4 Å²	104.4	49%	0.491	51%	0.512	S	S	.	.	H	α-helix	trans	-63.4	-37.8	177	-72.6	172	-173.1	0	0	112	Q819 L821 A827	Q819-E823 HydrophobicContact CG-CG 4.42Å; Q819-E823 VanDerWaalsContact CG-OE1 3.31Å; Q819-E823 WeakPolarHBondContact CG-OE1 3.41Å; Q819-E823 PolarHBondContact NE2-OE1 3.23Å; Q819-E823 WeakPolarHBondContact O-CG 3.31Å; Q819-E823 PolarHBondContact O-N 2.93Å; L821-E823 PolarHBondContact O-N 3.37Å; E823-A827 WeakPolarHBondContact O-CB 3.26Å; E823-A827 PolarHBondContact O-N 2.93Å
824	K	89.1	Confident	90.1	Very high	147 Å²	147	105.2 Å²	105.2	64%	0.639	52%	0.516	S	S	*	.	H	α-helix	trans	-67.9	-39.9	173.2	-79.7	-167.4	177.8	-175.5	0	112.8	Q820 L821 R822 A827 N828	Q820-K824 WeakPolarHBondContact O-CB 3.41Å; Q820-K824 WeakPolarHBondContact O-CG 3.44Å; Q820-K824 PolarHBondContact O-N 3.11Å; L821-K824 PolarHBondContact O-N 3.3Å; R822-K824 VanDerWaalsContact C-N 3.33Å; R822-K824 PolarHBondContact O-N 3.47Å; K824-A827 PolarHBondContact O-N 2.9Å; K824-N828 WeakPolarHBondContact O-CB 3.31Å; K824-N828 PolarHBondContact O-N 3.45Å; K824-N828 PolarHBondContact O-ND2 3.44Å
825	D	91.4	Very high	90.3	Very high	82 Å²	82	109.2 Å²	109.2	44%	0.439	52%	0.524	S	S	.	.	H	α-helix	trans	-65.2	-44.5	175.8	-73	-22.6	0	0	0	110.9	L821 R822 A827 N828 F829	L821-D825 PolarHBondContact O-N 3.27Å; R822-D825 PolarHBondContact O-N 2.95Å; D825-A827 VanDerWaalsContact C-N 3.33Å; D825-A827 PolarHBondContact O-N 3.28Å; D825-N828 WeakPolarHBondContact O-CB 3.49Å; D825-N828 PolarHBondContact O-N 3.08Å; D825-N828 VanDerWaalsContact O-N 3.14Å; D825-F829 HydrophobicContact CB-CE2 4.35Å; D825-F829 WeakPolarHBondContact O-CD2 3.35Å; D825-F829 PolarHBondContact O-N 3.02Å
826	D	90.9	Very high	90.3	Very high	96 Å²	96	110.5 Å²	110.5	51%	0.513	53%	0.525	S	S	.	.	H	α-helix	trans	-61.4	-39.7	175.3	-77.2	-17.2	0	0	0	112.3	R822 F829 K830	R822-D826 WeakPolarHBondContact O-CB 3.4Å; R822-D826 PolarHBondContact O-N 3.48Å; D826-F829 PolarHBondContact O-N 2.89Å; D826-K830 WeakPolarHBondContact O-CG 3.39Å; D826-K830 PolarHBondContact O-N 2.73Å
827	A	90.6	Very high	90.2	Very high	48 Å²	48	110.3 Å²	110.3	40%	0.397	53%	0.528	S	S	.	.	H	α-helix	trans	-64.3	-42.5	173.2	0	0	0	0	0	111.8	E823 K824 D825 K830 L831	E823-A827 WeakPolarHBondContact O-CB 3.26Å; E823-A827 PolarHBondContact O-N 2.93Å; K824-A827 PolarHBondContact O-N 2.9Å; D825-A827 VanDerWaalsContact C-N 3.33Å; D825-A827 PolarHBondContact O-N 3.28Å; A827-K830 PolarHBondContact O-N 3.2Å; A827-L831 WeakPolarHBondContact O-CG 3.45Å; A827-L831 PolarHBondContact O-N 3.49Å
828	N	88.5	Confident	90	Very high	97 Å²	97	107.5 Å²	107.5	52%	0.519	52%	0.52	S	S	.	.	H	α-helix	trans	-64.1	-41.2	175.6	-84	-38.6	0	0	0	112.4	K824 D825 L831 M832	K824-N828 WeakPolarHBondContact O-CB 3.31Å; K824-N828 PolarHBondContact O-N 3.45Å; K824-N828 PolarHBondContact O-ND2 3.44Å; D825-N828 WeakPolarHBondContact O-CB 3.49Å; D825-N828 PolarHBondContact O-N 3.08Å; D825-N828 VanDerWaalsContact O-N 3.14Å; N828-L831 PolarHBondContact O-N 3.36Å; N828-M832 WeakPolarHBondContact O-CB 3.36Å; N828-M832 PolarHBondContact O-N 3.41Å
829	F	89	Confident	90	Very high	138 Å²	138	108.4 Å²	108.4	61%	0.605	53%	0.525	S	S	*	.	H	α-helix	trans	-63.6	-40.2	175.5	-77.3	-61	0	0	0	111.9	D825 D826 M832 S833	D825-F829 HydrophobicContact CB-CE2 4.35Å; D825-F829 WeakPolarHBondContact O-CD2 3.35Å; D825-F829 PolarHBondContact O-N 3.02Å; D826-F829 PolarHBondContact O-N 2.89Å; F829-M832 PolarHBondContact O-N 3.49Å; F829-S833 WeakPolarHBondContact O-CB 3.45Å; F829-S833 PolarHBondContact O-N 2.92Å
830	K	91.9	Very high	90	Very high	144 Å²	144	108.8 Å²	108.8	63%	0.626	53%	0.527	S	S	*	.	H	α-helix	trans	-62.1	-48.4	173.5	-75.1	175.2	-176.3	173	0	111.6	D826 A827 M832 S833 E834	D826-K830 WeakPolarHBondContact O-CG 3.39Å; D826-K830 PolarHBondContact O-N 2.73Å; A827-K830 PolarHBondContact O-N 3.2Å; K830-M832 VanDerWaalsContact C-N 3.34Å; K830-M832 PolarHBondContact O-N 3.18Å; K830-S833 WeakPolarHBondContact O-CB 3.46Å; K830-S833 PolarHBondContact O-N 3.37Å; K830-E834 WeakPolarHBondContact O-CB 3.26Å; K830-E834 WeakPolarHBondContact O-CG 3.28Å; K830-E834 PolarHBondContact O-N 2.95Å
831	L	89.9	Confident	89.9	Confident	104 Å²	104	108.3 Å²	108.3	55%	0.545	53%	0.528	S	S	.	.	H	α-helix	trans	-62.6	-38.7	177.6	-71.7	173.5	0	0	0	112.5	A827 N828 E834 R835	A827-L831 WeakPolarHBondContact O-CG 3.45Å; A827-L831 PolarHBondContact O-N 3.49Å; N828-L831 PolarHBondContact O-N 3.36Å; L831-E834 PolarHBondContact O-N 3.12Å; L831-R835 VanDerWaalsContact O-CB 3.31Å; L831-R835 WeakPolarHBondContact O-CB 3.49Å; L831-R835 PolarHBondContact O-N 3.15Å
832	M	87.5	Confident	89.8	Confident	111 Å²	111	108.1 Å²	108.1	55%	0.547	52%	0.524	S	S	.	.	H	α-helix	trans	-65.2	-42.8	175	-171.4	179.9	-67.2	0	0	111.3	N828 F829 K830 R835 I836	N828-M832 WeakPolarHBondContact O-CB 3.36Å; N828-M832 PolarHBondContact O-N 3.41Å; F829-M832 PolarHBondContact O-N 3.49Å; K830-M832 VanDerWaalsContact C-N 3.34Å; K830-M832 PolarHBondContact O-N 3.18Å; M832-R835 PolarHBondContact O-N 3.27Å; M832-I836 HydrophobicContact CG-CD1 4.31Å; M832-I836 WeakPolarHBondContact O-CG1 3.4Å; M832-I836 PolarHBondContact O-N 3.11Å
833	S	89.2	Confident	89.9	Confident	53 Å²	53	106.1 Å²	106.1	37%	0.371	52%	0.52	S	S	.	.	H	α-helix	trans	-62.6	-44.5	174.9	-170.4	0	0	0	0	111.9	F829 K830 I836 K837	F829-S833 WeakPolarHBondContact O-CB 3.45Å; F829-S833 PolarHBondContact O-N 2.92Å; K830-S833 WeakPolarHBondContact O-CB 3.46Å; K830-S833 PolarHBondContact O-N 3.37Å; S833-I836 PolarHBondContact O-N 3.04Å; S833-K837 WeakPolarHBondContact O-CG 3.36Å; S833-K837 PolarHBondContact O-N 2.87Å
834	E	89.9	Confident	89.8	Confident	119 Å²	119	106 Å²	106	56%	0.556	52%	0.522	S	S	*	.	H	α-helix	trans	-62.5	-41.9	175.8	-74.5	176.9	-178.6	0	0	111.9	K830 L831 I836 K837 A838	K830-E834 WeakPolarHBondContact O-CB 3.26Å; K830-E834 WeakPolarHBondContact O-CG 3.28Å; K830-E834 PolarHBondContact O-N 2.95Å; L831-E834 PolarHBondContact O-N 3.12Å; E834-I836 PolarHBondContact O-N 3.03Å; E834-K837 PolarHBondContact O-N 3.05Å; E834-A838 WeakPolarHBondContact O-CB 3.42Å; E834-A838 PolarHBondContact O-N 2.58Å
835	R	90.6	Very high	89.9	Confident	178 Å²	178	103.2 Å²	103.2	67%	0.672	51%	0.514	S	S	*	.	H	α-helix	trans	-61.1	-42.7	174.4	179.3	-179	164.2	-154.9	-4.9	112.2	L831 M832 A838 N839	L831-R835 VanDerWaalsContact O-CB 3.31Å; L831-R835 WeakPolarHBondContact O-CB 3.49Å; L831-R835 PolarHBondContact O-N 3.15Å; M832-R835 PolarHBondContact O-N 3.27Å; R835-A838 PolarHBondContact O-N 2.93Å; R835-N839 WeakPolarHBondContact O-CB 3.4Å; R835-N839 PolarHBondContact O-N 2.99Å; R835-N839 PolarHBondContact O-ND2 2.88Å
836	I	89.9	Confident	89.8	Confident	89 Å²	89	106.8 Å²	106.8	46%	0.456	52%	0.521	S	S	.	.	H	α-helix	trans	-64.6	-46.1	177	-68.1	166.4	0	0	0	110.5	M832 S833 E834 A838 N839 Q840	M832-I836 HydrophobicContact CG-CD1 4.31Å; M832-I836 WeakPolarHBondContact O-CG1 3.4Å; M832-I836 PolarHBondContact O-N 3.11Å; S833-I836 PolarHBondContact O-N 3.04Å; E834-I836 PolarHBondContact O-N 3.03Å; I836-A838 PolarHBondContact O-N 3.31Å; I836-N839 PolarHBondContact O-N 2.72Å; I836-Q840 WeakPolarHBondContact O-CG 3.48Å; I836-Q840 PolarHBondContact O-N 3.06Å
837	K	90.1	Very high	89.8	Confident	132 Å²	132	106.2 Å²	106.2	57%	0.574	52%	0.515	S	S	*	.	H	α-helix	trans	-61.5	-42.8	177.2	-71.7	174.5	-176.2	176.4	0	112	S833 E834 Q840 L841	S833-K837 WeakPolarHBondContact O-CG 3.36Å; S833-K837 PolarHBondContact O-N 2.87Å; E834-K837 PolarHBondContact O-N 3.05Å; K837-Q840 PolarHBondContact O-N 3.22Å; K837-L841 WeakPolarHBondContact O-CB 3.49Å; K837-L841 PolarHBondContact O-N 2.92Å
838	A	88.9	Confident	89.8	Confident	43 Å²	43	109.5 Å²	109.5	36%	0.355	52%	0.522	S	S	.	.	H	α-helix	trans	-62.4	-42.8	176.1	0	0	0	0	0	111.7	E834 R835 I836 L841 H842	E834-A838 WeakPolarHBondContact O-CB 3.42Å; E834-A838 PolarHBondContact O-N 2.58Å; R835-A838 PolarHBondContact O-N 2.93Å; I836-A838 PolarHBondContact O-N 3.31Å; A838-L841 PolarHBondContact O-N 3.16Å; A838-H842 WeakPolarHBondContact O-CB 3.28Å; A838-H842 PolarHBondContact O-CD2 2.98Å; A838-H842 PolarHBondContact O-N 3.37Å
839	N	89.9	Confident	89.9	Confident	91 Å²	91	110.9 Å²	110.9	49%	0.487	52%	0.524	S	S	.	.	H	α-helix	trans	-63.5	-41.3	176	-77.7	-21	0	0	0	112.7	R835 I836 H842 K843	R835-N839 WeakPolarHBondContact O-CB 3.4Å; R835-N839 PolarHBondContact O-N 2.99Å; R835-N839 PolarHBondContact O-ND2 2.88Å; I836-N839 PolarHBondContact O-N 2.72Å; N839-H842 PolarHBondContact O-N 2.87Å; N839-K843 PolarHBondContact O-N 3.39Å
840	Q	90.9	Very high	89.9	Confident	119 Å²	119	107.7 Å²	107.7	56%	0.556	52%	0.515	S	S	*	.	H	α-helix	trans	-63.5	-43.9	174.7	-72.3	173.8	-11.5	0	0	111.4	I836 K837 K843 L844	I836-Q840 WeakPolarHBondContact O-CG 3.48Å; I836-Q840 PolarHBondContact O-N 3.06Å; K837-Q840 PolarHBondContact O-N 3.22Å; Q840-K843 WeakPolarHBondContact O-CB 3.41Å; Q840-K843 PolarHBondContact O-N 3.4Å; Q840-L844 PolarHBondContact O-N 3.38Å
841	L	89.2	Confident	89.9	Confident	104 Å²	104	104.4 Å²	104.4	55%	0.545	51%	0.507	S	S	.	.	H	α-helix	trans	-62.8	-43.3	176.1	-176.6	63.3	0	0	0	111.9	K837 A838 K843 L844 L845	K837-L841 WeakPolarHBondContact O-CB 3.49Å; K837-L841 PolarHBondContact O-N 2.92Å; A838-L841 PolarHBondContact O-N 3.16Å; L841-K843 VanDerWaalsContact C-N 3.27Å; L841-K843 PolarHBondContact O-N 3.45Å; L841-L844 PolarHBondContact O-N 3.42Å; L841-L845 HydrophobicContact CG-CD1 4.16Å; L841-L845 WeakPolarHBondContact O-CB 3.34Å; L841-L845 WeakPolarHBondContact O-CG 3.37Å; L841-L845 PolarHBondContact O-N 3.4Å
842	H	87.4	Confident	89.9	Confident	99 Å²	99	103.7 Å²	103.7	46%	0.458	50%	0.504	S	S	.	.	H	α-helix	trans	-62.4	-33.9	174.3	-81.4	-61.3	0	0	0	112.6	A838 N839 R846	A838-H842 WeakPolarHBondContact O-CB 3.28Å; A838-H842 PolarHBondContact O-CD2 2.98Å; A838-H842 PolarHBondContact O-N 3.37Å; N839-H842 PolarHBondContact O-N 2.87Å; H842-R846 WeakPolarHBondContact O-CG 3.4Å; H842-R846 PolarHBondContact O-N 2.92Å; H842-R846 VanDerWaalsContact O-N 3.15Å; H842-R846 PolarHBondContact O-NH1 2.95Å; H842-R846 VanDerWaalsContact O-NH1 3.12Å
843	K	92	Very high	90	Very high	129 Å²	129	103 Å²	103	56%	0.561	50%	0.499	S	S	*	.	H	α-helix	trans	-65.3	-50.1	174.4	-167.4	-170.8	-178.7	-148.3	0	110.8	N839 Q840 L841 L845 R846 E847	N839-K843 PolarHBondContact O-N 3.39Å; Q840-K843 WeakPolarHBondContact O-CB 3.41Å; Q840-K843 PolarHBondContact O-N 3.4Å; L841-K843 VanDerWaalsContact C-N 3.27Å; L841-K843 PolarHBondContact O-N 3.45Å; K843-L845 VanDerWaalsContact C-N 3.35Å; K843-L845 PolarHBondContact O-N 2.83Å; K843-R846 PolarHBondContact O-N 3.24Å; K843-R846 VanDerWaalsContact O-N 3.12Å; K843-E847 WeakPolarHBondContact CE-OE1 3.39Å; K843-E847 IonicContact NZ-OE1 3.42Å; K843-E847 PolarHBondContact NZ-OE1 2.98Å; K843-E847 WeakPolarHBondContact O-CG 3.33Å; K843-E847 PolarHBondContact O-N 3.45Å
844	L	89.8	Confident	90.1	Very high	104 Å²	104	105.6 Å²	105.6	55%	0.545	51%	0.509	S	S	.	.	H	α-helix	trans	-60.1	-42.1	178.3	-68.6	172.3	0	0	0	112.4	Q840 L841 R846 E847 E848	Q840-L844 PolarHBondContact O-N 3.38Å; L841-L844 PolarHBondContact O-N 3.42Å; L844-R846 VanDerWaalsContact C-N 3.3Å; L844-R846 PolarHBondContact O-N 2.91Å; L844-E847 PolarHBondContact O-N 3.44Å; L844-E848 WeakPolarHBondContact O-CB 3.47Å; L844-E848 PolarHBondContact O-N 2.96Å
845	L	90.4	Very high	90	Very high	88 Å²	88	105.2 Å²	105.2	46%	0.461	51%	0.507	S	S	.	.	H	α-helix	trans	-65.7	-31.8	176.7	-73.1	172	0	0	0	112.8	L841 K843 K849	L841-L845 HydrophobicContact CG-CD1 4.16Å; L841-L845 WeakPolarHBondContact O-CB 3.34Å; L841-L845 WeakPolarHBondContact O-CG 3.37Å; L841-L845 PolarHBondContact O-N 3.4Å; K843-L845 VanDerWaalsContact C-N 3.35Å; K843-L845 PolarHBondContact O-N 2.83Å; L845-K849 WeakPolarHBondContact O-CB 3.29Å; L845-K849 PolarHBondContact O-N 3.48Å
846	R	89	Confident	89.8	Confident	157 Å²	157	102.8 Å²	102.8	59%	0.592	51%	0.505	S	S	*	.	H	α-helix	trans	-70.3	-43.8	172.9	-74.7	-175.6	-159.2	95.3	-5.8	111.2	H842 K843 L844 E848 K849 T850	H842-R846 WeakPolarHBondContact O-CG 3.4Å; H842-R846 PolarHBondContact O-N 2.92Å; H842-R846 VanDerWaalsContact O-N 3.15Å; H842-R846 PolarHBondContact O-NH1 2.95Å; H842-R846 VanDerWaalsContact O-NH1 3.12Å; K843-R846 PolarHBondContact O-N 3.24Å; K843-R846 VanDerWaalsContact O-N 3.12Å; L844-R846 VanDerWaalsContact C-N 3.3Å; L844-R846 PolarHBondContact O-N 2.91Å; R846-E848 VanDerWaalsContact C-N 3.34Å; R846-E848 PolarHBondContact O-N 3.41Å; R846-K849 PolarHBondContact O-N 2.94Å; R846-T850 WeakPolarHBondContact O-CG2 3.28Å; R846-T850 PolarHBondContact O-N 2.7Å; R846-T850 PolarHBondContact O-OG1 2.96Å
847	E	91.3	Very high	89.9	Confident	84 Å²	84	101.1 Å²	101.1	39%	0.393	51%	0.505	S	S	.	.	H	α-helix	trans	-60.7	-42.6	176.1	-69.5	168.9	-175.9	0	0	111	K843 L844 T850 V851	K843-E847 WeakPolarHBondContact CE-OE1 3.39Å; K843-E847 IonicContact NZ-OE1 3.42Å; K843-E847 PolarHBondContact NZ-OE1 2.98Å; K843-E847 WeakPolarHBondContact O-CG 3.33Å; K843-E847 PolarHBondContact O-N 3.45Å; L844-E847 PolarHBondContact O-N 3.44Å; E847-T850 WeakPolarHBondContact CA-OG1 3.49Å; E847-T850 PolarHBondContact O-N 3.18Å; E847-T850 PolarHBondContact O-OG1 3.43Å; E847-V851 WeakPolarHBondContact O-CG2 3.37Å; E847-V851 PolarHBondContact O-N 3.35Å
848	E	89.7	Confident	89.8	Confident	117 Å²	117	98.3 Å²	98.3	55%	0.547	50%	0.499	S	S	.	.	H	α-helix	trans	-63.7	-42.4	174.6	-172	176.9	-173.8	0	0	112.2	L844 R846 T850 V851 L852	L844-E848 WeakPolarHBondContact O-CB 3.47Å; L844-E848 PolarHBondContact O-N 2.96Å; R846-E848 VanDerWaalsContact C-N 3.34Å; R846-E848 PolarHBondContact O-N 3.41Å; E848-T850 PolarHBondContact O-N 2.94Å; E848-V851 PolarHBondContact O-N 2.88Å; E848-L852 HydrophobicContact CG-CD1 4.4Å; E848-L852 WeakPolarHBondContact O-CG 3.47Å; E848-L852 PolarHBondContact O-N 3.3Å
849	K	90.6	Very high	89.7	Confident	126 Å²	126	98 Å²	98	55%	0.548	50%	0.496	S	S	.	.	H	α-helix	trans	-60.2	-45.2	175	-174.6	179.4	-175.8	-91.7	0	111.7	L845 R846 V851 L852 E853	L845-K849 WeakPolarHBondContact O-CB 3.29Å; L845-K849 PolarHBondContact O-N 3.48Å; R846-K849 PolarHBondContact O-N 2.94Å; K849-V851 PolarHBondContact O-N 3.49Å; K849-L852 PolarHBondContact O-N 2.87Å; K849-E853 WeakPolarHBondContact CE-OE1 3.27Å; K849-E853 IonicContact NZ-OE1 3.96Å; K849-E853 PolarHBondContact NZ-OE1 2.87Å; K849-E853 WeakPolarHBondContact O-CG 3.24Å; K849-E853 PolarHBondContact O-N 3.45Å
850	T	90.3	Very high	89.7	Confident	70 Å²	70	96.9 Å²	96.9	43%	0.429	49%	0.492	S	S	.	.	H	α-helix	trans	-63.7	-40.6	178.7	47.7	0	0	0	0	112	R846 E847 E848 L852 E853 D854	R846-T850 WeakPolarHBondContact O-CG2 3.28Å; R846-T850 PolarHBondContact O-N 2.7Å; R846-T850 PolarHBondContact O-OG1 2.96Å; E847-T850 WeakPolarHBondContact CA-OG1 3.49Å; E847-T850 PolarHBondContact O-N 3.18Å; E847-T850 PolarHBondContact O-OG1 3.43Å; E848-T850 PolarHBondContact O-N 2.94Å; T850-L852 VanDerWaalsContact C-N 3.34Å; T850-L852 PolarHBondContact O-N 3.43Å; T850-E853 PolarHBondContact O-N 2.97Å; T850-D854 PolarHBondContact O-N 3.44Å
851	V	91.1	Very high	89.6	Confident	76 Å²	76	95.1 Å²	95.1	46%	0.461	49%	0.49	S	S	.	.	H	α-helix	trans	-64.7	-39.3	176.4	171.7	0	0	0	0	111.4	E847 E848 K849 D854 Q855	E847-V851 WeakPolarHBondContact O-CG2 3.37Å; E847-V851 PolarHBondContact O-N 3.35Å; E848-V851 PolarHBondContact O-N 2.88Å; K849-V851 PolarHBondContact O-N 3.49Å; V851-D854 PolarHBondContact O-N 2.95Å; V851-Q855 VanDerWaalsContact O-CG 3.31Å; V851-Q855 WeakPolarHBondContact O-CG 3.31Å; V851-Q855 PolarHBondContact O-N 3.4Å
852	L	89.8	Confident	89.6	Confident	89 Å²	89	96.4 Å²	96.4	47%	0.466	49%	0.493	S	S	.	.	H	α-helix	trans	-67.7	-36.7	175.5	-72.1	172	0	0	0	112.4	E848 K849 T850 Q855 M856	E848-L852 HydrophobicContact CG-CD1 4.4Å; E848-L852 WeakPolarHBondContact O-CG 3.47Å; E848-L852 PolarHBondContact O-N 3.3Å; K849-L852 PolarHBondContact O-N 2.87Å; T850-L852 VanDerWaalsContact C-N 3.34Å; T850-L852 PolarHBondContact O-N 3.43Å; L852-Q855 PolarHBondContact O-N 2.9Å; L852-M856 WeakPolarHBondContact O-CB 3.26Å; L852-M856 WeakPolarHBondContact O-CG 3.48Å; L852-M856 PolarHBondContact O-N 3.02Å
853	E	90.8	Very high	89.6	Confident	95 Å²	95	96 Å²	96	44%	0.444	49%	0.494	S	S	.	.	H	α-helix	trans	-63.2	-44.1	174.1	-75.1	168.9	172.5	0	0	111.3	K849 T850 Q855 M856 A857	K849-E853 WeakPolarHBondContact CE-OE1 3.27Å; K849-E853 IonicContact NZ-OE1 3.96Å; K849-E853 PolarHBondContact NZ-OE1 2.87Å; K849-E853 WeakPolarHBondContact O-CG 3.24Å; K849-E853 PolarHBondContact O-N 3.45Å; T850-E853 PolarHBondContact O-N 2.97Å; E853-Q855 PolarHBondContact O-N 2.78Å; E853-M856 PolarHBondContact O-N 3.46Å; E853-A857 PolarHBondContact O-N 3.33Å
854	D	90.3	Very high	89.5	Confident	109 Å²	109	95.1 Å²	95.1	58%	0.583	49%	0.491	S	S	*	.	H	α-helix	trans	-64	-39.8	175	-71.5	-18.8	0	0	0	112.1	T850 V851 A857 T858	T850-D854 PolarHBondContact O-N 3.44Å; V851-D854 PolarHBondContact O-N 2.95Å; D854-A857 PolarHBondContact O-N 2.88Å; D854-T858 WeakPolarHBondContact O-CG2 3.47Å; D854-T858 PolarHBondContact O-N 3.23Å; D854-T858 PolarHBondContact O-OG1 3.47Å
855	Q	88.2	Confident	89.5	Confident	110 Å²	110	92.6 Å²	92.6	51%	0.514	49%	0.486	S	S	.	.	H	α-helix	trans	-64.1	-39.1	174.2	-75	177.5	7	0	0	112.3	V851 L852 E853 T858 A859	V851-Q855 VanDerWaalsContact O-CG 3.31Å; V851-Q855 WeakPolarHBondContact O-CG 3.31Å; V851-Q855 PolarHBondContact O-N 3.4Å; L852-Q855 PolarHBondContact O-N 2.9Å; E853-Q855 PolarHBondContact O-N 2.78Å; Q855-T858 WeakPolarHBondContact CA-OG1 3.42Å; Q855-T858 PolarHBondContact O-OG1 3.34Å; Q855-A859 WeakPolarHBondContact O-CB 3.47Å; Q855-A859 PolarHBondContact O-N 3.12Å
856	M	86.9	Confident	89.1	Confident	127 Å²	127	95.2 Å²	95.2	63%	0.626	50%	0.497	S	S	*	.	H	α-helix	trans	-68.5	-39.4	175.6	-75.4	-62.9	-59.8	0	0	112.1	L852 E853 A859 T860	L852-M856 WeakPolarHBondContact O-CB 3.26Å; L852-M856 WeakPolarHBondContact O-CG 3.48Å; L852-M856 PolarHBondContact O-N 3.02Å; E853-M856 PolarHBondContact O-N 3.46Å; M856-A859 PolarHBondContact O-N 3.04Å; M856-T860 WeakPolarHBondContact O-CB 3.13Å; M856-T860 PolarHBondContact O-N 3.44Å; M856-T860 PolarHBondContact O-OG1 3.36Å
857	A	90.8	Very high	89.1	Confident	55 Å²	55	92.9 Å²	92.9	46%	0.455	49%	0.493	S	S	.	.	H	α-helix	trans	-63.8	-44.9	175.3	0	0	0	0	0	111.6	E853 D854 T860 T861	E853-A857 PolarHBondContact O-N 3.33Å; D854-A857 PolarHBondContact O-N 2.88Å; A857-T860 PolarHBondContact O-N 2.98Å; A857-T861 WeakPolarHBondContact O-CG2 3.41Å; A857-T861 PolarHBondContact O-N 2.86Å; A857-T861 PolarHBondContact O-OG1 2.88Å
858	T	89.8	Confident	89	Confident	73 Å²	73	92.7 Å²	92.7	45%	0.448	49%	0.494	S	S	.	.	H	α-helix	trans	-65.1	-39.5	175.7	51.2	0	0	0	0	112.5	D854 Q855 T860 T861 Q862	D854-T858 WeakPolarHBondContact O-CG2 3.47Å; D854-T858 PolarHBondContact O-N 3.23Å; D854-T858 PolarHBondContact O-OG1 3.47Å; Q855-T858 WeakPolarHBondContact CA-OG1 3.42Å; Q855-T858 PolarHBondContact O-OG1 3.34Å; T858-T860 PolarHBondContact O-N 3.12Å; T858-T861 WeakPolarHBondContact CA-OG1 3.28Å; T858-T861 PolarHBondContact O-OG1 3.32Å; T858-Q862 VanDerWaalsContact O-CG 3.27Å; T858-Q862 WeakPolarHBondContact O-CG 3.47Å; T858-Q862 PolarHBondContact O-N 2.93Å
859	A	85.3	Confident	89	Confident	37 Å²	37	91.2 Å²	91.2	31%	0.306	49%	0.492	S	S	.	.	H	α-helix	trans	-64.3	-39.5	173.6	0	0	0	0	0	112.3	Q855 M856 Q862 I863	Q855-A859 WeakPolarHBondContact O-CB 3.47Å; Q855-A859 PolarHBondContact O-N 3.12Å; M856-A859 PolarHBondContact O-N 3.04Å; A859-Q862 PolarHBondContact O-N 3.48Å; A859-I863 VanDerWaalsContact O-CG1 3.31Å; A859-I863 WeakPolarHBondContact O-CG1 3.45Å; A859-I863 PolarHBondContact O-N 3.49Å
860	T	90.5	Very high	88.7	Confident	66 Å²	66	89.6 Å²	89.6	41%	0.405	49%	0.49	S	S	.	.	H	α-helix	trans	-63.7	-47.8	178.2	-56.1	0	0	0	0	111.1	M856 A857 T858 Q862 I863 E864	M856-T860 WeakPolarHBondContact O-CB 3.13Å; M856-T860 PolarHBondContact O-N 3.44Å; M856-T860 PolarHBondContact O-OG1 3.36Å; A857-T860 PolarHBondContact O-N 2.98Å; T858-T860 PolarHBondContact O-N 3.12Å; T860-Q862 VanDerWaalsContact C-N 3.32Å; T860-Q862 PolarHBondContact O-N 3.41Å; T860-I863 PolarHBondContact O-N 3.17Å; T860-E864 WeakPolarHBondContact O-CG 3.45Å; T860-E864 PolarHBondContact O-N 3.39Å
861	T	89.5	Confident	88.5	Confident	83 Å²	83	91.9 Å²	91.9	51%	0.509	49%	0.49	S	S	.	.	H	α-helix	trans	-62.3	-36	175.6	52.8	0	0	0	0	112.8	A857 T858 E864 A865	A857-T861 WeakPolarHBondContact O-CG2 3.41Å; A857-T861 PolarHBondContact O-N 2.86Å; A857-T861 PolarHBondContact O-OG1 2.88Å; T858-T861 WeakPolarHBondContact CA-OG1 3.28Å; T858-T861 PolarHBondContact O-OG1 3.32Å; T861-E864 PolarHBondContact O-N 3.35Å; T861-A865 WeakPolarHBondContact O-CB 3.29Å; T861-A865 PolarHBondContact O-N 2.76Å
862	Q	88.1	Confident	88.4	Confident	130 Å²	130	94.8 Å²	94.8	61%	0.607	50%	0.497	S	S	*	.	H	α-helix	trans	-65.1	-42.4	173.2	-74	175.4	14.7	0	0	112.3	T858 A859 T860 E864 A865 M866	T858-Q862 VanDerWaalsContact O-CG 3.27Å; T858-Q862 WeakPolarHBondContact O-CG 3.47Å; T858-Q862 PolarHBondContact O-N 2.93Å; A859-Q862 PolarHBondContact O-N 3.48Å; T860-Q862 VanDerWaalsContact C-N 3.32Å; T860-Q862 PolarHBondContact O-N 3.41Å; Q862-E864 VanDerWaalsContact C-N 3.35Å; Q862-A865 PolarHBondContact O-N 3Å; Q862-M866 WeakPolarHBondContact O-CG 3.4Å; Q862-M866 PolarHBondContact O-N 3.26Å
863	I	87.7	Confident	88.1	Confident	91 Å²	91	95.7 Å²	95.7	47%	0.467	50%	0.502	S	S	.	.	H	α-helix	trans	-62	-43.5	176	-72.3	166.9	0	0	0	110.6	A859 T860 A865 M866 H867	A859-I863 VanDerWaalsContact O-CG1 3.31Å; A859-I863 WeakPolarHBondContact O-CG1 3.45Å; A859-I863 PolarHBondContact O-N 3.49Å; T860-I863 PolarHBondContact O-N 3.17Å; I863-A865 PolarHBondContact O-N 2.85Å; I863-M866 PolarHBondContact O-N 3.48Å; I863-H867 WeakPolarHBondContact CG2-CE1 3.45Å; I863-H867 PolarHBondContact O-N 3.37Å; I863-H867 PolarHBondContact O-ND1 3.22Å
864	E	89.6	Confident	87.9	Confident	110 Å²	110	95.2 Å²	95.2	51%	0.514	50%	0.499	S	S	.	.	H	α-helix	trans	-61	-43.8	175.6	-71.5	171.5	178.1	0	0	112.2	T860 T861 Q862 M866 H867 I868	T860-E864 WeakPolarHBondContact O-CG 3.45Å; T860-E864 PolarHBondContact O-N 3.39Å; T861-E864 PolarHBondContact O-N 3.35Å; Q862-E864 VanDerWaalsContact C-N 3.35Å; E864-M866 PolarHBondContact O-N 3.04Å; E864-H867 PolarHBondContact O-N 3.37Å; E864-I868 WeakPolarHBondContact O-CG1 3.49Å; E864-I868 PolarHBondContact O-N 3.46Å; E864-I868 VanDerWaalsContact O-N 3.09Å
865	A	89.2	Confident	87.8	Confident	52 Å²	52	95.3 Å²	95.3	43%	0.43	50%	0.496	S	S	.	.	H	α-helix	trans	-61.4	-42.3	174.5	0	0	0	0	0	111.9	T861 Q862 I863 H867 I868 V869	T861-A865 WeakPolarHBondContact O-CB 3.29Å; T861-A865 PolarHBondContact O-N 2.76Å; Q862-A865 PolarHBondContact O-N 3Å; I863-A865 PolarHBondContact O-N 2.85Å; A865-H867 PolarHBondContact O-N 2.85Å; A865-I868 PolarHBondContact O-N 3.3Å; A865-V869 PolarHBondContact O-N 3.46Å; A865-V869 VanDerWaalsContact O-N 3.16Å
866	M	82.4	Confident	87.7	Confident	142 Å²	142	96.4 Å²	96.4	70%	0.7	50%	0.499	S	S	*	.	H	α-helix	trans	-63.2	-39.5	174.9	-71.8	-168.1	87.8	0	0	112.3	Q862 I863 E864 I868 V869 L870	Q862-M866 WeakPolarHBondContact O-CG 3.4Å; Q862-M866 PolarHBondContact O-N 3.26Å; I863-M866 PolarHBondContact O-N 3.48Å; E864-M866 PolarHBondContact O-N 3.04Å; M866-I868 VanDerWaalsContact C-N 3.31Å; M866-I868 PolarHBondContact O-N 2.88Å; M866-V869 PolarHBondContact O-N 2.88Å; M866-L870 WeakPolarHBondContact O-CB 3.49Å; M866-L870 PolarHBondContact O-N 3.02Å
867	H	89.2	Confident	87.7	Confident	108 Å²	108	95.7 Å²	95.7	50%	0.5	49%	0.494	S	S	.	.	H	α-helix	trans	-64	-32.9	175.2	-71	141.4	0	0	0	113.2	I863 E864 A865 R871	I863-H867 WeakPolarHBondContact CG2-CE1 3.45Å; I863-H867 PolarHBondContact O-N 3.37Å; I863-H867 PolarHBondContact O-ND1 3.22Å; E864-H867 PolarHBondContact O-N 3.37Å; A865-H867 PolarHBondContact O-N 2.85Å; H867-R871 WeakPolarHBondContact O-CG 3.36Å; H867-R871 PolarHBondContact O-N 2.82Å; H867-R871 VanDerWaalsContact O-N 3.16Å; H867-R871 PolarHBondContact O-NE 3.07Å
868	I	90.2	Very high	87.6	Confident	80 Å²	80	100.4 Å²	100.4	41%	0.41	50%	0.5	S	S	.	.	H	α-helix	trans	-67.1	-44.2	173.6	-66	164.8	0	0	0	110.5	E864 A865 M866 R871 K872	E864-I868 WeakPolarHBondContact O-CG1 3.49Å; E864-I868 PolarHBondContact O-N 3.46Å; E864-I868 VanDerWaalsContact O-N 3.09Å; A865-I868 PolarHBondContact O-N 3.3Å; M866-I868 VanDerWaalsContact C-N 3.31Å; M866-I868 PolarHBondContact O-N 2.88Å; I868-R871 PolarHBondContact O-N 3.03Å; I868-K872 PolarHBondContact O-N 3.4Å; I868-K872 VanDerWaalsContact O-N 3.16Å
869	V	88.2	Confident	87.3	Confident	86 Å²	86	100 Å²	100	52%	0.521	50%	0.501	S	S	.	.	H	α-helix	trans	-64	-42.1	178	175.6	0	0	0	0	111.1	A865 M866 R871 K872 L873	A865-V869 PolarHBondContact O-N 3.46Å; A865-V869 VanDerWaalsContact O-N 3.16Å; M866-V869 PolarHBondContact O-N 2.88Å; V869-R871 PolarHBondContact O-N 3.31Å; V869-K872 PolarHBondContact O-N 2.73Å; V869-L873 HydrophobicContact CG1-CD1 4.18Å; V869-L873 WeakPolarHBondContact O-CG 3.27Å; V869-L873 PolarHBondContact O-N 2.95Å
870	L	84.2	Confident	87.2	Confident	93 Å²	93	103 Å²	103	49%	0.487	51%	0.511	S	S	.	.	H	α-helix	trans	-62.2	-44	179.1	-167.1	141.7	0	0	0	111.7	M866 K872 L873 E874	M866-L870 WeakPolarHBondContact O-CB 3.49Å; M866-L870 PolarHBondContact O-N 3.02Å; L870-K872 PolarHBondContact O-N 3.3Å; L870-L873 WeakPolarHBondContact O-CB 3.48Å; L870-L873 PolarHBondContact O-N 3.49Å; L870-L873 VanDerWaalsContact O-N 3.12Å; L870-E874 HydrophobicContact CD2-CG 4.15Å; L870-E874 VanDerWaalsContact CD2-OE1 3.26Å; L870-E874 WeakPolarHBondContact CD2-OE1 3.49Å; L870-E874 WeakPolarHBondContact O-CG 3.36Å; L870-E874 PolarHBondContact O-N 3.38Å
871	R	87.6	Confident	87.1	Confident	117 Å²	117	105.2 Å²	105.2	44%	0.442	52%	0.516	S	S	.	.	H	α-helix	trans	-59.5	-43.8	174.1	-76.6	-175.1	-73.4	155.2	-6.2	112.8	H867 I868 V869 L873 E874 E875	H867-R871 WeakPolarHBondContact O-CG 3.36Å; H867-R871 PolarHBondContact O-N 2.82Å; H867-R871 VanDerWaalsContact O-N 3.16Å; H867-R871 PolarHBondContact O-NE 3.07Å; I868-R871 PolarHBondContact O-N 3.03Å; V869-R871 PolarHBondContact O-N 3.31Å; R871-L873 VanDerWaalsContact C-N 3.27Å; R871-L873 PolarHBondContact O-N 3.34Å; R871-E874 PolarHBondContact O-N 3.46Å; R871-E875 WeakPolarHBondContact O-CG 3.5Å; R871-E875 PolarHBondContact O-N 3.45Å
872	K	88.6	Confident	87.1	Confident	138 Å²	138	104.2 Å²	104.2	60%	0.6	52%	0.517	S	S	*	.	H	α-helix	trans	-61.9	-35	175.3	-72.7	-176.2	177.1	-176.2	0	112.4	I868 V869 L870 K876	I868-K872 PolarHBondContact O-N 3.4Å; I868-K872 VanDerWaalsContact O-N 3.16Å; V869-K872 PolarHBondContact O-N 2.73Å; L870-K872 PolarHBondContact O-N 3.3Å; K872-K876 WeakPolarHBondContact O-CB 3.38Å; K872-K876 PolarHBondContact O-N 3.39Å
873	L	82.3	Confident	87	Confident	108 Å²	108	101.4 Å²	101.4	57%	0.565	51%	0.509	S	S	*	.	H	α-helix	trans	-71.3	-40.4	175.6	-70.1	173.5	0	0	0	111.8	V869 L870 R871 E875 K876 E877	V869-L873 HydrophobicContact CG1-CD1 4.18Å; V869-L873 WeakPolarHBondContact O-CG 3.27Å; V869-L873 PolarHBondContact O-N 2.95Å; L870-L873 WeakPolarHBondContact O-CB 3.48Å; L870-L873 PolarHBondContact O-N 3.49Å; L870-L873 VanDerWaalsContact O-N 3.12Å; R871-L873 VanDerWaalsContact C-N 3.27Å; R871-L873 PolarHBondContact O-N 3.34Å; L873-E875 PolarHBondContact O-N 2.9Å; L873-K876 PolarHBondContact O-N 3.17Å; L873-E877 PolarHBondContact O-N 3.43Å
874	E	87.7	Confident	86.8	Confident	84 Å²	84	100.8 Å²	100.8	39%	0.393	51%	0.509	S	S	.	.	H	α-helix	trans	-63.9	-37.2	174.4	-70.5	176.2	161.9	0	0	112.7	L870 R871 R878	L870-E874 HydrophobicContact CD2-CG 4.15Å; L870-E874 VanDerWaalsContact CD2-OE1 3.26Å; L870-E874 WeakPolarHBondContact CD2-OE1 3.49Å; L870-E874 WeakPolarHBondContact O-CG 3.36Å; L870-E874 PolarHBondContact O-N 3.38Å; R871-E874 PolarHBondContact O-N 3.46Å; E874-R878 WeakPolarHBondContact O-CB 3.49Å; E874-R878 WeakPolarHBondContact O-CG 3.26Å; E874-R878 PolarHBondContact O-N 3.46Å; E874-R878 PolarHBondContact O-NE 3.05Å
875	E	87.1	Confident	86.8	Confident	112 Å²	112	97.5 Å²	97.5	52%	0.523	50%	0.501	S	S	.	.	H	α-helix	trans	-66.1	-41.8	172.6	-72.8	164.7	-168.5	0	0	111.5	R871 L873 R878 S879	R871-E875 WeakPolarHBondContact O-CG 3.5Å; R871-E875 PolarHBondContact O-N 3.45Å; L873-E875 PolarHBondContact O-N 2.9Å; E875-R878 PolarHBondContact O-N 3.32Å; E875-S879 PolarHBondContact O-N 2.91Å; E875-S879 PolarHBondContact O-OG 2.91Å
876	K	86.8	Confident	86.7	Confident	133 Å²	133	97.7 Å²	97.7	58%	0.578	50%	0.499	S	S	*	.	H	α-helix	trans	-65.6	-38.9	175.5	-168.2	175.1	-178.8	177.3	0	111.7	K872 L873 S879 L880	K872-K876 WeakPolarHBondContact O-CB 3.38Å; K872-K876 PolarHBondContact O-N 3.39Å; L873-K876 PolarHBondContact O-N 3.17Å; K876-S879 WeakPolarHBondContact CA-OG 3.34Å; K876-S879 PolarHBondContact O-N 3.43Å; K876-S879 PolarHBondContact O-OG 2.98Å; K876-L880 HydrophobicContact CG-CD1 4.33Å; K876-L880 WeakPolarHBondContact O-CB 3.34Å; K876-L880 VanDerWaalsContact O-CG 3.27Å; K876-L880 WeakPolarHBondContact O-CG 3.48Å; K876-L880 PolarHBondContact O-N 2.98Å
877	E	86.6	Confident	86.7	Confident	112 Å²	112	96.1 Å²	96.1	52%	0.523	49%	0.492	S	S	.	.	H	α-helix	trans	-63.8	-46.3	174.2	-171.6	-176	170.1	0	0	111.3	L873 S879 L880 Q881	L873-E877 PolarHBondContact O-N 3.43Å; E877-S879 VanDerWaalsContact C-N 3.35Å; E877-S879 PolarHBondContact O-N 3.18Å; E877-L880 PolarHBondContact O-N 3.38Å; E877-Q881 WeakPolarHBondContact O-CG 3.5Å; E877-Q881 PolarHBondContact O-N 3.47Å; E877-Q881 PolarHBondContact OE1-NE2 3.37Å
878	R	89.5	Confident	86.7	Confident	154 Å²	154	96.9 Å²	96.9	58%	0.581	50%	0.496	S	S	*	.	H	α-helix	trans	-59.7	-42.4	176.3	-80.9	-176.4	-88.8	176.5	-8.1	112.6	E874 E875 Q881 A882	E874-R878 WeakPolarHBondContact O-CB 3.49Å; E874-R878 WeakPolarHBondContact O-CG 3.26Å; E874-R878 PolarHBondContact O-N 3.46Å; E874-R878 PolarHBondContact O-NE 3.05Å; E875-R878 PolarHBondContact O-N 3.32Å; R878-Q881 PolarHBondContact O-N 3Å; R878-A882 PolarHBondContact O-N 2.9Å
879	S	83.4	Confident	86.8	Confident	65 Å²	65	100 Å²	100	46%	0.455	51%	0.507	S	S	.	.	H	α-helix	trans	-66.6	-39.5	176.3	58.6	0	0	0	0	112.4	E875 K876 E877 A882 T883	E875-S879 PolarHBondContact O-N 2.91Å; E875-S879 PolarHBondContact O-OG 2.91Å; K876-S879 WeakPolarHBondContact CA-OG 3.34Å; K876-S879 PolarHBondContact O-N 3.43Å; K876-S879 PolarHBondContact O-OG 2.98Å; E877-S879 VanDerWaalsContact C-N 3.35Å; E877-S879 PolarHBondContact O-N 3.18Å; S879-A882 PolarHBondContact O-N 3.35Å; S879-T883 WeakPolarHBondContact O-CG2 3.41Å; S879-T883 PolarHBondContact O-N 2.9Å
880	L	83.1	Confident	86.5	Confident	98 Å²	98	101.1 Å²	101.1	51%	0.513	51%	0.506	S	S	.	.	H	α-helix	trans	-66	-38.5	174	-72.1	171.8	0	0	0	112.8	K876 E877 A882 T883 V884	K876-L880 HydrophobicContact CG-CD1 4.33Å; K876-L880 WeakPolarHBondContact O-CB 3.34Å; K876-L880 VanDerWaalsContact O-CG 3.27Å; K876-L880 WeakPolarHBondContact O-CG 3.48Å; K876-L880 PolarHBondContact O-N 2.98Å; E877-L880 PolarHBondContact O-N 3.38Å; L880-A882 VanDerWaalsContact C-N 3.3Å; L880-A882 PolarHBondContact O-N 3.46Å; L880-T883 WeakPolarHBondContact CA-OG1 3.18Å; L880-T883 PolarHBondContact O-N 3.45Å; L880-T883 PolarHBondContact O-OG1 3.38Å; L880-V884 VanDerWaalsContact O-CG2 3.29Å; L880-V884 WeakPolarHBondContact O-CG2 3.41Å; L880-V884 PolarHBondContact O-N 3.45Å
881	Q	89.1	Confident	86.6	Confident	113 Å²	113	101.4 Å²	101.4	53%	0.528	51%	0.507	S	S	.	.	H	α-helix	trans	-63.4	-38.3	174	-72.7	175.5	5.5	0	0	111.4	E877 R878 A885	E877-Q881 WeakPolarHBondContact O-CG 3.5Å; E877-Q881 PolarHBondContact O-N 3.47Å; E877-Q881 PolarHBondContact OE1-NE2 3.37Å; R878-Q881 PolarHBondContact O-N 3Å; Q881-A885 WeakPolarHBondContact O-CB 3.38Å; Q881-A885 PolarHBondContact O-N 2.87Å
882	A	88.3	Confident	86.7	Confident	63 Å²	63	101.2 Å²	101.2	52%	0.521	51%	0.513	S	S	.	.	H	α-helix	trans	-66.5	-40.4	175.4	0	0	0	0	0	112.7	R878 S879 L880 A885 S886	R878-A882 PolarHBondContact O-N 2.9Å; S879-A882 PolarHBondContact O-N 3.35Å; L880-A882 VanDerWaalsContact C-N 3.3Å; L880-A882 PolarHBondContact O-N 3.46Å; A882-A885 PolarHBondContact O-N 3.48Å; A882-S886 PolarHBondContact O-N 3Å
883	T	86.3	Confident	86.7	Confident	71 Å²	71	99.8 Å²	99.8	44%	0.436	51%	0.511	S	S	.	.	H	α-helix	trans	-67.5	-41.1	176.4	57.7	0	0	0	0	111.8	S879 L880 A885 S886 I887	S879-T883 WeakPolarHBondContact O-CG2 3.41Å; S879-T883 PolarHBondContact O-N 2.9Å; L880-T883 WeakPolarHBondContact CA-OG1 3.18Å; L880-T883 PolarHBondContact O-N 3.45Å; L880-T883 PolarHBondContact O-OG1 3.38Å; T883-A885 PolarHBondContact O-N 3Å; T883-S886 WeakPolarHBondContact O-CB 3.43Å; T883-S886 PolarHBondContact O-N 3.38Å; T883-I887 WeakPolarHBondContact O-CG1 3.43Å; T883-I887 PolarHBondContact O-N 2.98Å
884	V	84.1	Confident	86.5	Confident	77 Å²	77	103.4 Å²	103.4	47%	0.467	52%	0.518	S	S	.	.	H	α-helix	trans	-58.6	-48.1	173.4	170.9	0	0	0	0	110.7	L880 S886 I887 E888	L880-V884 VanDerWaalsContact O-CG2 3.29Å; L880-V884 WeakPolarHBondContact O-CG2 3.41Å; L880-V884 PolarHBondContact O-N 3.45Å; V884-S886 VanDerWaalsContact C-N 3.26Å; V884-S886 PolarHBondContact O-N 3.34Å; V884-I887 PolarHBondContact O-N 3.27Å; V884-E888 HydrophobicContact CG1-CG 4.41Å; V884-E888 WeakPolarHBondContact O-CG 3.44Å; V884-E888 PolarHBondContact O-N 3.36Å
885	A	88.9	Confident	86.5	Confident	41 Å²	41	104.4 Å²	104.4	34%	0.339	52%	0.522	S	S	.	.	H	α-helix	trans	-62.4	-31.8	177.6	0	0	0	0	0	113.2	Q881 A882 T883 K889	Q881-A885 WeakPolarHBondContact O-CB 3.38Å; Q881-A885 PolarHBondContact O-N 2.87Å; A882-A885 PolarHBondContact O-N 3.48Å; T883-A885 PolarHBondContact O-N 3Å; A885-K889 WeakPolarHBondContact O-CG 3.3Å; A885-K889 PolarHBondContact O-N 3.31Å
886	S	86.4	Confident	86.5	Confident	57 Å²	57	104.5 Å²	104.5	40%	0.399	52%	0.523	S	S	.	.	H	α-helix	trans	-68.5	-46.7	173.3	-165.7	0	0	0	0	111.6	A882 T883 V884 E888 K889 E890	A882-S886 PolarHBondContact O-N 3Å; T883-S886 WeakPolarHBondContact O-CB 3.43Å; T883-S886 PolarHBondContact O-N 3.38Å; V884-S886 VanDerWaalsContact C-N 3.26Å; V884-S886 PolarHBondContact O-N 3.34Å; S886-E888 VanDerWaalsContact C-N 3.32Å; S886-E888 PolarHBondContact O-N 2.97Å; S886-K889 WeakPolarHBondContact O-CB 3.38Å; S886-K889 PolarHBondContact O-N 3.2Å; S886-E890 PolarHBondContact O-N 3.36Å
887	I	83.8	Confident	86.3	Confident	108 Å²	108	100.1 Å²	100.1	55%	0.554	51%	0.511	S	S	*	.	H	α-helix	trans	-63	-38.9	178.3	-67.3	166.7	0	0	0	110.9	T883 V884 K889 E890 L891	T883-I887 WeakPolarHBondContact O-CG1 3.43Å; T883-I887 PolarHBondContact O-N 2.98Å; V884-I887 PolarHBondContact O-N 3.27Å; I887-K889 VanDerWaalsContact C-N 3.35Å; I887-K889 PolarHBondContact O-N 2.85Å; I887-E890 PolarHBondContact O-N 2.95Å; I887-L891 WeakPolarHBondContact O-CB 3.4Å; I887-L891 PolarHBondContact O-N 2.84Å
888	E	89.5	Confident	86.1	Confident	125 Å²	125	100.8 Å²	100.8	58%	0.584	52%	0.516	S	S	*	.	H	α-helix	trans	-62	-40.1	175.2	-74.9	178.7	163.4	0	0	112.4	V884 S886 L891 M892	V884-E888 HydrophobicContact CG1-CG 4.41Å; V884-E888 WeakPolarHBondContact O-CG 3.44Å; V884-E888 PolarHBondContact O-N 3.36Å; S886-E888 VanDerWaalsContact C-N 3.32Å; S886-E888 PolarHBondContact O-N 2.97Å; E888-L891 PolarHBondContact O-N 3.42Å; E888-M892 PolarHBondContact O-N 3.47Å
889	K	90.8	Very high	86.1	Confident	146 Å²	146	98.7 Å²	98.7	64%	0.635	51%	0.513	S	S	*	.	H	α-helix	trans	-65.7	-44	174.4	-72.6	171.7	-175.7	173.3	0	111.8	A885 S886 I887 L891 M892 L893	A885-K889 WeakPolarHBondContact O-CG 3.3Å; A885-K889 PolarHBondContact O-N 3.31Å; S886-K889 WeakPolarHBondContact O-CB 3.38Å; S886-K889 PolarHBondContact O-N 3.2Å; I887-K889 VanDerWaalsContact C-N 3.35Å; I887-K889 PolarHBondContact O-N 2.85Å; K889-L891 VanDerWaalsContact C-N 3.34Å; K889-M892 PolarHBondContact O-N 3.33Å; K889-L893 WeakPolarHBondContact O-CG 3.44Å; K889-L893 PolarHBondContact O-N 2.98Å
890	E	82.8	Confident	86.4	Confident	109 Å²	109	99.6 Å²	99.6	51%	0.509	51%	0.511	S	S	.	.	H	α-helix	trans	-61.7	-42.3	175.5	-73.8	-178.4	-166.8	0	0	111.8	S886 I887 M892 L893 R894	S886-E890 PolarHBondContact O-N 3.36Å; I887-E890 PolarHBondContact O-N 2.95Å; E890-M892 VanDerWaalsContact C-N 3.35Å; E890-M892 PolarHBondContact O-N 3.4Å; E890-L893 PolarHBondContact O-N 3.48Å; E890-R894 WeakPolarHBondContact O-CB 3.32Å; E890-R894 VanDerWaalsContact O-CG 3.26Å; E890-R894 WeakPolarHBondContact O-CG 3.35Å; E890-R894 PolarHBondContact O-N 3.36Å
891	L	86	Confident	86.4	Confident	98 Å²	98	100.3 Å²	100.3	51%	0.513	51%	0.511	S	S	.	.	H	α-helix	trans	-60.3	-44.4	175.6	-178.6	65.7	0	0	0	111.3	I887 E888 K889 L893 R894 Q895	I887-L891 WeakPolarHBondContact O-CB 3.4Å; I887-L891 PolarHBondContact O-N 2.84Å; E888-L891 PolarHBondContact O-N 3.42Å; K889-L891 VanDerWaalsContact C-N 3.34Å; L891-L893 PolarHBondContact O-N 2.94Å; L891-R894 PolarHBondContact O-N 3.2Å; L891-Q895 WeakPolarHBondContact O-CB 3.32Å; L891-Q895 VanDerWaalsContact O-CG 3.32Å; L891-Q895 WeakPolarHBondContact O-CG 3.45Å; L891-Q895 PolarHBondContact O-N 3.27Å
892	M	90.7	Very high	86.3	Confident	114 Å²	114	100.5 Å²	100.5	56%	0.562	51%	0.51	S	S	*	.	H	α-helix	trans	-60.9	-43.9	176.5	-173.7	-173.7	-75.3	0	0	111.5	E888 K889 E890 Q895 Q896	E888-M892 PolarHBondContact O-N 3.47Å; K889-M892 PolarHBondContact O-N 3.33Å; E890-M892 VanDerWaalsContact C-N 3.35Å; E890-M892 PolarHBondContact O-N 3.4Å; M892-Q895 PolarHBondContact O-N 3.02Å; M892-Q896 WeakPolarHBondContact O-CG 3.44Å; M892-Q896 PolarHBondContact O-N 2.89Å
893	L	87.9	Confident	86.3	Confident	107 Å²	107	105.6 Å²	105.6	56%	0.56	52%	0.516	S	S	*	.	H	α-helix	trans	-64.4	-41.5	176.6	-70	172.6	0	0	0	112	K889 E890 L891 Q895 Q896 A897	K889-L893 WeakPolarHBondContact O-CG 3.44Å; K889-L893 PolarHBondContact O-N 2.98Å; E890-L893 PolarHBondContact O-N 3.48Å; L891-L893 PolarHBondContact O-N 2.94Å; L893-Q895 VanDerWaalsContact C-N 3.34Å; L893-Q895 PolarHBondContact O-N 2.82Å; L893-Q896 PolarHBondContact O-N 3.26Å; L893-A897 PolarHBondContact O-N 2.89Å
894	R	78.5	Confident	86.4	Confident	185 Å²	185	107.7 Å²	107.7	70%	0.698	52%	0.519	S	S	*	.	H	α-helix	trans	-63.9	-38.3	175.4	-69.6	-72.4	-177.8	94.4	3.4	111.8	E890 L891 A897 M898	E890-R894 WeakPolarHBondContact O-CB 3.32Å; E890-R894 VanDerWaalsContact O-CG 3.26Å; E890-R894 WeakPolarHBondContact O-CG 3.35Å; E890-R894 PolarHBondContact O-N 3.36Å; L891-R894 PolarHBondContact O-N 3.2Å; R894-A897 PolarHBondContact O-N 3.48Å; R894-M898 WeakPolarHBondContact O-CB 3.38Å; R894-M898 PolarHBondContact O-N 2.94Å
895	Q	86.2	Confident	86.3	Confident	104 Å²	104	106.9 Å²	106.9	49%	0.486	52%	0.521	S	S	.	.	H	α-helix	trans	-64.9	-44.2	174.2	-75.3	174.1	-6.1	0	0	111.8	L891 M892 L893 A897 M898 E899	L891-Q895 WeakPolarHBondContact O-CB 3.32Å; L891-Q895 VanDerWaalsContact O-CG 3.32Å; L891-Q895 WeakPolarHBondContact O-CG 3.45Å; L891-Q895 PolarHBondContact O-N 3.27Å; M892-Q895 PolarHBondContact O-N 3.02Å; L893-Q895 VanDerWaalsContact C-N 3.34Å; L893-Q895 PolarHBondContact O-N 2.82Å; Q895-A897 PolarHBondContact O-N 3.08Å; Q895-M898 PolarHBondContact O-N 3.36Å; Q895-E899 PolarHBondContact O-N 3.43Å
896	Q	87.4	Confident	86.3	Confident	115 Å²	115	109 Å²	109	54%	0.537	53%	0.526	S	S	.	.	H	α-helix	trans	-61.5	-43.6	175.7	-72.2	175.9	-0.6	0	0	112.1	M892 L893 E899 M900	M892-Q896 WeakPolarHBondContact O-CG 3.44Å; M892-Q896 PolarHBondContact O-N 2.89Å; L893-Q896 PolarHBondContact O-N 3.26Å; Q896-E899 PolarHBondContact O-N 2.86Å; Q896-M900 PolarHBondContact O-N 3.32Å
897	A	82.6	Confident	86.5	Confident	41 Å²	41	110.6 Å²	110.6	34%	0.339	53%	0.527	S	S	.	.	H	α-helix	trans	-62.9	-42.7	175.4	0	0	0	0	0	112	L893 R894 Q895 M900 H901	L893-A897 PolarHBondContact O-N 2.89Å; R894-A897 PolarHBondContact O-N 3.48Å; Q895-A897 PolarHBondContact O-N 3.08Å; A897-M900 PolarHBondContact O-N 3.39Å; A897-H901 PolarHBondContact O-CD2 3.46Å; A897-H901 PolarHBondContact O-N 2.9Å
898	M	83.9	Confident	86.5	Confident	126 Å²	126	109.3 Å²	109.3	62%	0.621	53%	0.527	S	S	*	.	H	α-helix	trans	-60.9	-46	176.6	-172.6	-165.7	-60.7	0	0	111.9	R894 Q895 M900 H901 K902	R894-M898 WeakPolarHBondContact O-CB 3.38Å; R894-M898 PolarHBondContact O-N 2.94Å; Q895-M898 PolarHBondContact O-N 3.36Å; M898-M900 VanDerWaalsContact C-N 3.34Å; M898-M900 PolarHBondContact O-N 2.96Å; M898-H901 PolarHBondContact O-N 3.46Å; M898-K902 WeakPolarHBondContact O-CB 3.49Å; M898-K902 PolarHBondContact O-N 3.48Å
899	E	88.9	Confident	86.4	Confident	110 Å²	110	106.3 Å²	106.3	51%	0.514	52%	0.524	S	S	.	.	H	α-helix	trans	-63.4	-38.8	177.2	-74.1	-62.7	156.6	0	0	111.9	Q895 Q896 K902 R903	Q895-E899 PolarHBondContact O-N 3.43Å; Q896-E899 PolarHBondContact O-N 2.86Å; E899-K902 PolarHBondContact O-N 3.27Å; E899-R903 WeakPolarHBondContact O-CB 3.38Å; E899-R903 PolarHBondContact O-N 2.96Å
900	M	88.9	Confident	86.3	Confident	83 Å²	83	105 Å²	105	41%	0.409	52%	0.52	S	S	.	.	H	α-helix	trans	-61.3	-47.5	172.6	-177.7	-155.9	60.1	0	0	111.7	Q896 A897 M898 K902 R903 K904	Q896-M900 PolarHBondContact O-N 3.32Å; A897-M900 PolarHBondContact O-N 3.39Å; M898-M900 VanDerWaalsContact C-N 3.34Å; M898-M900 PolarHBondContact O-N 2.96Å; M900-K902 VanDerWaalsContact C-N 3.35Å; M900-K902 PolarHBondContact O-N 2.91Å; M900-R903 PolarHBondContact O-N 3.42Å; M900-K904 PolarHBondContact O-N 3.3Å
901	H	83.8	Confident	86.6	Confident	114 Å²	114	102.8 Å²	102.8	53%	0.528	52%	0.517	S	S	.	.	H	α-helix	trans	-65.1	-38.4	178.7	-75.6	-63.1	0	0	0	112.4	A897 M898 R903 K904 A905	A897-H901 PolarHBondContact O-CD2 3.46Å; A897-H901 PolarHBondContact O-N 2.9Å; M898-H901 PolarHBondContact O-N 3.46Å; H901-R903 VanDerWaalsContact C-N 3.34Å; H901-R903 PolarHBondContact O-N 3.4Å; H901-K904 PolarHBondContact O-N 3.28Å; H901-A905 WeakPolarHBondContact O-CB 3.5Å; H901-A905 PolarHBondContact O-N 2.95Å
902	K	86.2	Confident	86.5	Confident	116 Å²	116	101 Å²	101	50%	0.504	52%	0.516	S	S	.	.	H	α-helix	trans	-61	-43.2	174.1	-174.2	-179.2	176.8	-172.5	0	111.3	M898 E899 M900 A905 I906	M898-K902 WeakPolarHBondContact O-CB 3.49Å; M898-K902 PolarHBondContact O-N 3.48Å; E899-K902 PolarHBondContact O-N 3.27Å; M900-K902 VanDerWaalsContact C-N 3.35Å; M900-K902 PolarHBondContact O-N 2.91Å; K902-A905 PolarHBondContact O-N 3.34Å; K902-I906 HydrophobicContact CG-CD1 4.28Å; K902-I906 VanDerWaalsContact O-CG1 3.29Å; K902-I906 WeakPolarHBondContact O-CG1 3.46Å; K902-I906 PolarHBondContact O-N 3.14Å
903	R	88.6	Confident	86.4	Confident	171 Å²	171	98.3 Å²	98.3	65%	0.645	51%	0.512	S	S	*	.	H	α-helix	trans	-62.1	-47.2	174.7	-173.6	175.4	177.4	162.2	4.3	112	E899 M900 H901 A905 I906 E907	E899-R903 WeakPolarHBondContact O-CB 3.38Å; E899-R903 PolarHBondContact O-N 2.96Å; M900-R903 PolarHBondContact O-N 3.42Å; H901-R903 VanDerWaalsContact C-N 3.34Å; H901-R903 PolarHBondContact O-N 3.4Å; R903-A905 VanDerWaalsContact C-N 3.32Å; R903-A905 PolarHBondContact O-N 2.89Å; R903-I906 PolarHBondContact O-N 2.92Å; R903-E907 WeakPolarHBondContact CG-OE1 3.34Å; R903-E907 IonicContact CZ-OE1 2.66Å; R903-E907 IonicContact NE-OE1 3.99Å; R903-E907 PolarHBondContact NE-OE1 2.93Å; R903-E907 WeakPolarHBondContact O-CG 3.38Å; R903-E907 PolarHBondContact O-N 2.85Å
904	K	88.6	Confident	86.4	Confident	114 Å²	114	97.6 Å²	97.6	50%	0.496	51%	0.509	S	S	.	.	H	α-helix	trans	-60.3	-38.8	175.9	-73	-177.7	177.4	-177.4	0	112.6	M900 H901 E907 S908	M900-K904 PolarHBondContact O-N 3.3Å; H901-K904 PolarHBondContact O-N 3.28Å; K904-E907 PolarHBondContact O-N 3.27Å; K904-S908 VanDerWaalsContact O-CB 3.27Å; K904-S908 WeakPolarHBondContact O-CB 3.48Å; K904-S908 PolarHBondContact O-N 3.48Å
905	A	81.5	Confident	86.9	Confident	61 Å²	61	93.9 Å²	93.9	50%	0.504	50%	0.502	S	S	.	.	H	α-helix	trans	-65.8	-40	176.6	0	0	0	0	0	111.9	H901 K902 R903 A909	H901-A905 WeakPolarHBondContact O-CB 3.5Å; H901-A905 PolarHBondContact O-N 2.95Å; K902-A905 PolarHBondContact O-N 3.34Å; R903-A905 VanDerWaalsContact C-N 3.32Å; R903-A905 PolarHBondContact O-N 2.89Å; A905-A909 WeakPolarHBondContact O-CB 3.47Å; A905-A909 PolarHBondContact O-N 2.99Å
906	I	89.1	Confident	87.1	Confident	86 Å²	86	95 Å²	95	44%	0.441	51%	0.505	S	S	.	.	H	α-helix	trans	-65.5	-46.4	174.9	-67.1	164.9	0	0	0	110.8	K902 R903 S908 A909 Q910	K902-I906 HydrophobicContact CG-CD1 4.28Å; K902-I906 VanDerWaalsContact O-CG1 3.29Å; K902-I906 WeakPolarHBondContact O-CG1 3.46Å; K902-I906 PolarHBondContact O-N 3.14Å; R903-I906 PolarHBondContact O-N 2.92Å; I906-S908 VanDerWaalsContact C-N 3.34Å; I906-S908 PolarHBondContact O-N 2.84Å; I906-A909 PolarHBondContact O-N 3.35Å; I906-Q910 WeakPolarHBondContact O-CG 3.42Å; I906-Q910 PolarHBondContact O-N 3.45Å
907	E	90.1	Very high	87.3	Confident	90 Å²	90	95 Å²	95	42%	0.421	51%	0.508	S	S	.	.	H	α-helix	trans	-62.1	-40.7	177.9	-71.8	168.6	-177.7	0	0	111.5	R903 K904 Q910 S911	R903-E907 WeakPolarHBondContact CG-OE1 3.34Å; R903-E907 IonicContact CZ-OE1 2.66Å; R903-E907 IonicContact NE-OE1 3.99Å; R903-E907 PolarHBondContact NE-OE1 2.93Å; R903-E907 WeakPolarHBondContact O-CG 3.38Å; R903-E907 PolarHBondContact O-N 2.85Å; K904-E907 PolarHBondContact O-N 3.27Å; E907-Q910 PolarHBondContact O-N 3.05Å; E907-S911 WeakPolarHBondContact O-CB 3.08Å; E907-S911 PolarHBondContact O-N 3.49Å
908	S	84.8	Confident	87.6	Confident	80 Å²	80	97.4 Å²	97.4	56%	0.559	51%	0.512	S	S	*	.	H	α-helix	trans	-64.9	-43.1	174.3	-177.8	0	0	0	0	112.3	K904 I906 Q910 S911 A912	K904-S908 VanDerWaalsContact O-CB 3.27Å; K904-S908 WeakPolarHBondContact O-CB 3.48Å; K904-S908 PolarHBondContact O-N 3.48Å; I906-S908 VanDerWaalsContact C-N 3.34Å; I906-S908 PolarHBondContact O-N 2.84Å; S908-Q910 VanDerWaalsContact C-N 3.34Å; S908-Q910 PolarHBondContact O-N 2.95Å; S908-S911 PolarHBondContact O-N 3.25Å; S908-A912 WeakPolarHBondContact O-CB 3.46Å; S908-A912 PolarHBondContact O-N 3.36Å
909	A	86.2	Confident	87.8	Confident	63 Å²	63	97.1 Å²	97.1	52%	0.521	51%	0.513	S	S	.	.	H	α-helix	trans	-64.3	-37.9	176	0	0	0	0	0	112.4	A905 I906 A913	A905-A909 WeakPolarHBondContact O-CB 3.47Å; A905-A909 PolarHBondContact O-N 2.99Å; I906-A909 PolarHBondContact O-N 3.35Å; A909-A913 WeakPolarHBondContact O-CB 3.33Å; A909-A913 PolarHBondContact O-N 3.45Å
910	Q	89.4	Confident	88	Confident	117 Å²	117	97.1 Å²	97.1	55%	0.547	51%	0.513	S	S	.	.	H	α-helix	trans	-63.8	-48.6	173.1	-76	176.1	-15.8	0	0	111.4	I906 E907 S908 A912 A913 D914	I906-Q910 WeakPolarHBondContact O-CG 3.42Å; I906-Q910 PolarHBondContact O-N 3.45Å; E907-Q910 PolarHBondContact O-N 3.05Å; S908-Q910 VanDerWaalsContact C-N 3.34Å; S908-Q910 PolarHBondContact O-N 2.95Å; Q910-A912 VanDerWaalsContact C-N 3.32Å; Q910-A912 PolarHBondContact O-N 2.9Å; Q910-A913 WeakPolarHBondContact O-CB 3.45Å; Q910-A913 PolarHBondContact O-N 3.08Å; Q910-A913 VanDerWaalsContact O-N 3.1Å; Q910-D914 PolarHBondContact O-N 3.39Å
911	S	89.2	Confident	88.1	Confident	64 Å²	64	99.1 Å²	99.1	45%	0.448	52%	0.519	S	S	.	.	H	α-helix	trans	-57.6	-43.8	176.1	-178.8	0	0	0	0	112.2	E907 S908 A913 D914 L915	E907-S911 WeakPolarHBondContact O-CB 3.08Å; E907-S911 PolarHBondContact O-N 3.49Å; S908-S911 PolarHBondContact O-N 3.25Å; S911-A913 VanDerWaalsContact C-N 3.35Å; S911-A913 PolarHBondContact O-N 2.67Å; S911-D914 PolarHBondContact O-N 3.49Å; S911-L915 WeakPolarHBondContact O-CD1 3.48Å; S911-L915 PolarHBondContact O-N 3.49Å
912	A	83.5	Confident	88.3	Confident	60 Å²	60	100.7 Å²	100.7	50%	0.496	52%	0.521	S	S	.	.	H	α-helix	trans	-63.2	-38.7	175.9	0	0	0	0	0	112.7	S908 Q910 K916	S908-A912 WeakPolarHBondContact O-CB 3.46Å; S908-A912 PolarHBondContact O-N 3.36Å; Q910-A912 VanDerWaalsContact C-N 3.32Å; Q910-A912 PolarHBondContact O-N 2.9Å; A912-K916 WeakPolarHBondContact O-CB 3.34Å; A912-K916 PolarHBondContact O-N 3.24Å
913	A	88.3	Confident	88.5	Confident	57 Å²	57	101.7 Å²	101.7	47%	0.471	53%	0.527	S	S	.	.	H	α-helix	trans	-66	-41.9	175.3	0	0	0	0	0	111.9	A909 Q910 S911 K916 L917	A909-A913 WeakPolarHBondContact O-CB 3.33Å; A909-A913 PolarHBondContact O-N 3.45Å; Q910-A913 WeakPolarHBondContact O-CB 3.45Å; Q910-A913 PolarHBondContact O-N 3.08Å; Q910-A913 VanDerWaalsContact O-N 3.1Å; S911-A913 VanDerWaalsContact C-N 3.35Å; S911-A913 PolarHBondContact O-N 2.67Å; A913-K916 PolarHBondContact O-N 2.93Å; A913-L917 PolarHBondContact O-N 2.94Å
914	D	88.6	Confident	88.6	Confident	93 Å²	93	95.9 Å²	95.9	50%	0.497	52%	0.516	S	S	.	.	H	α-helix	trans	-64.7	-44.6	176.6	-70.7	-19.9	0	0	0	111.4	Q910 S911 K916 L917 H918	Q910-D914 PolarHBondContact O-N 3.39Å; S911-D914 PolarHBondContact O-N 3.49Å; D914-K916 VanDerWaalsContact C-N 3.29Å; D914-K916 PolarHBondContact O-N 3.37Å; D914-L917 WeakPolarHBondContact O-CB 3.32Å; D914-L917 PolarHBondContact O-N 2.94Å; D914-H918 PolarHBondContact O-CD2 3.21Å; D914-H918 PolarHBondContact O-N 3.39Å
915	L	89.2	Confident	88.7	Confident	106 Å²	106	94.8 Å²	94.8	56%	0.555	51%	0.513	S	S	*	.	H	α-helix	trans	-60.8	-39.6	174.6	-95	76.7	0	0	0	111.6	S911 H918 L919	S911-L915 WeakPolarHBondContact O-CD1 3.48Å; S911-L915 PolarHBondContact O-N 3.49Å; L915-H918 PolarHBondContact O-N 3Å; L915-L919 WeakPolarHBondContact O-CG 3.38Å; L915-L919 PolarHBondContact O-N 2.8Å
916	K	90.7	Very high	89.1	Confident	129 Å²	129	97.6 Å²	97.6	56%	0.561	52%	0.517	S	S	*	.	H	α-helix	trans	-64.3	-43.7	175.7	-171.5	-177.5	176.1	-170.9	0	111.6	A912 A913 D914 H918 L919 E920	A912-K916 WeakPolarHBondContact O-CB 3.34Å; A912-K916 PolarHBondContact O-N 3.24Å; A913-K916 PolarHBondContact O-N 2.93Å; D914-K916 VanDerWaalsContact C-N 3.29Å; D914-K916 PolarHBondContact O-N 3.37Å; K916-H918 VanDerWaalsContact C-N 3.3Å; K916-H918 PolarHBondContact O-N 3.32Å; K916-L919 PolarHBondContact O-N 3.42Å; K916-E920 VanDerWaalsContact CE-OE1 3.31Å; K916-E920 WeakPolarHBondContact CE-OE1 3.41Å; K916-E920 WeakPolarHBondContact O-CG 3.31Å; K916-E920 PolarHBondContact O-N 2.92Å
917	L	90.6	Very high	89.3	Confident	113 Å²	113	100.4 Å²	100.4	59%	0.592	53%	0.526	S	S	*	.	H	α-helix	trans	-59.4	-42.5	174.6	-169.7	90	0	0	0	111.2	A913 D914 E920 K921	A913-L917 PolarHBondContact O-N 2.94Å; D914-L917 WeakPolarHBondContact O-CB 3.32Å; D914-L917 PolarHBondContact O-N 2.94Å; L917-E920 PolarHBondContact O-N 3.47Å; L917-K921 WeakPolarHBondContact O-CB 3.33Å; L917-K921 PolarHBondContact O-N 2.93Å
918	H	90	Very high	89.3	Confident	93 Å²	93	102 Å²	102	43%	0.431	53%	0.534	S	S	.	.	H	α-helix	trans	-63.2	-44.2	175.1	-79.5	-61.9	0	0	0	112.3	D914 L915 K916 K921 Y922	D914-H918 PolarHBondContact O-CD2 3.21Å; D914-H918 PolarHBondContact O-N 3.39Å; L915-H918 PolarHBondContact O-N 3Å; K916-H918 VanDerWaalsContact C-N 3.3Å; K916-H918 PolarHBondContact O-N 3.32Å; H918-K921 WeakPolarHBondContact O-CB 3.37Å; H918-K921 PolarHBondContact O-N 3.48Å; H918-Y922 HydrophobicContact CB-CD2 4.47Å; H918-Y922 HydrophobicContact CB-CE2 4.27Å; H918-Y922 WeakPolarHBondContact O-CD2 3.33Å; H918-Y922 PolarHBondContact O-N 2.97Å
919	L	88.7	Confident	89.6	Confident	120 Å²	120	100.8 Å²	100.8	63%	0.628	53%	0.528	S	S	*	.	H	α-helix	trans	-61.2	-43.9	176.2	-76.4	171.1	0	0	0	111.8	L915 K916 K921 Y922 H923	L915-L919 WeakPolarHBondContact O-CG 3.38Å; L915-L919 PolarHBondContact O-N 2.8Å; K916-L919 PolarHBondContact O-N 3.42Å; L919-K921 VanDerWaalsContact C-N 3.32Å; L919-K921 PolarHBondContact O-N 2.97Å; L919-Y922 PolarHBondContact O-N 3.45Å; L919-H923 VanDerWaalsContact O-CB 3.29Å; L919-H923 WeakPolarHBondContact O-CB 3.37Å; L919-H923 PolarHBondContact O-N 3.41Å
920	E	91.2	Very high	89.8	Confident	110 Å²	110	103.9 Å²	103.9	51%	0.514	53%	0.532	S	S	.	.	H	α-helix	trans	-60.9	-41.9	175.6	-73.4	174.3	-172.2	0	0	111.4	K916 L917 H923 A924	K916-E920 VanDerWaalsContact CE-OE1 3.31Å; K916-E920 WeakPolarHBondContact CE-OE1 3.41Å; K916-E920 WeakPolarHBondContact O-CG 3.31Å; K916-E920 PolarHBondContact O-N 2.92Å; L917-E920 PolarHBondContact O-N 3.47Å; E920-H923 PolarHBondContact O-N 3.25Å; E920-A924 WeakPolarHBondContact O-CB 3.31Å; E920-A924 PolarHBondContact O-N 3.35Å
921	K	91.7	Very high	89.9	Confident	124 Å²	124	103.7 Å²	103.7	54%	0.539	53%	0.531	S	S	.	.	H	α-helix	trans	-62.3	-47.1	174.5	-175.3	-179.3	178.5	-178.6	0	112.3	L917 H918 L919 H923 A924 Q925	L917-K921 WeakPolarHBondContact O-CB 3.33Å; L917-K921 PolarHBondContact O-N 2.93Å; H918-K921 WeakPolarHBondContact O-CB 3.37Å; H918-K921 PolarHBondContact O-N 3.48Å; L919-K921 VanDerWaalsContact C-N 3.32Å; L919-K921 PolarHBondContact O-N 2.97Å; K921-H923 VanDerWaalsContact C-N 3.31Å; K921-H923 PolarHBondContact O-N 3.3Å; K921-A924 PolarHBondContact O-N 3.29Å; K921-Q925 WeakPolarHBondContact O-CG 3.29Å; K921-Q925 PolarHBondContact O-N 3.25Å
922	Y	89	Confident	90.1	Very high	147 Å²	147	104.3 Å²	104.3	58%	0.576	53%	0.532	S	S	*	.	H	α-helix	trans	-65.6	-36.2	177.4	-72.8	-55.3	0	0	0	112	H918 L919 Q925 M926	H918-Y922 HydrophobicContact CB-CD2 4.47Å; H918-Y922 HydrophobicContact CB-CE2 4.27Å; H918-Y922 WeakPolarHBondContact O-CD2 3.33Å; H918-Y922 PolarHBondContact O-N 2.97Å; L919-Y922 PolarHBondContact O-N 3.45Å; Y922-Q925 PolarHBondContact O-N 3.37Å; Y922-M926 WeakPolarHBondContact O-CB 3.38Å; Y922-M926 PolarHBondContact O-N 2.89Å
923	H	89	Confident	90.4	Very high	137 Å²	137	105.7 Å²	105.7	63%	0.634	53%	0.534	S	S	*	.	H	α-helix	trans	-66.2	-41.2	176.1	-158.1	80.2	0	0	0	111.5	L919 E920 K921 M926 K927	L919-H923 VanDerWaalsContact O-CB 3.29Å; L919-H923 WeakPolarHBondContact O-CB 3.37Å; L919-H923 PolarHBondContact O-N 3.41Å; E920-H923 PolarHBondContact O-N 3.25Å; K921-H923 VanDerWaalsContact C-N 3.31Å; K921-H923 PolarHBondContact O-N 3.3Å; H923-M926 PolarHBondContact O-N 3.21Å; H923-K927 WeakPolarHBondContact O-CB 3.33Å; H923-K927 PolarHBondContact O-N 2.9Å
924	A	91.7	Very high	90.6	Very high	49 Å²	49	105.9 Å²	105.9	41%	0.405	54%	0.536	S	S	.	.	H	α-helix	trans	-61.4	-47.2	172.8	0	0	0	0	0	111.7	E920 K921 M926 K927 E928	E920-A924 WeakPolarHBondContact O-CB 3.31Å; E920-A924 PolarHBondContact O-N 3.35Å; K921-A924 PolarHBondContact O-N 3.29Å; A924-M926 VanDerWaalsContact C-N 3.33Å; A924-M926 PolarHBondContact O-N 3.02Å; A924-K927 WeakPolarHBondContact O-CB 3.42Å; A924-K927 PolarHBondContact O-N 3.43Å; A924-K927 VanDerWaalsContact O-N 3.16Å; A924-E928 WeakPolarHBondContact O-CG 3.46Å; A924-E928 PolarHBondContact O-N 2.92Å
925	Q	90.9	Very high	90.8	Very high	92 Å²	92	106.6 Å²	106.6	43%	0.43	54%	0.536	S	S	.	.	H	α-helix	trans	-60.7	-40.4	176.3	-73.3	178.5	-15.5	0	0	112.6	K921 Y922 K927 E928 A929	K921-Q925 WeakPolarHBondContact O-CG 3.29Å; K921-Q925 PolarHBondContact O-N 3.25Å; Y922-Q925 PolarHBondContact O-N 3.37Å; Q925-K927 VanDerWaalsContact C-N 3.34Å; Q925-E928 PolarHBondContact O-N 3.35Å; Q925-A929 WeakPolarHBondContact O-CB 3.37Å; Q925-A929 PolarHBondContact O-N 3.48Å
926	M	89.5	Confident	90.9	Very high	119 Å²	119	108.2 Å²	108.2	59%	0.586	54%	0.538	S	S	*	.	H	α-helix	trans	-64.9	-39.9	176	-171.8	122.7	83.8	0	0	111.3	Y922 H923 A924 A929 Q930	Y922-M926 WeakPolarHBondContact O-CB 3.38Å; Y922-M926 PolarHBondContact O-N 2.89Å; H923-M926 PolarHBondContact O-N 3.21Å; A924-M926 VanDerWaalsContact C-N 3.33Å; A924-M926 PolarHBondContact O-N 3.02Å; M926-A929 PolarHBondContact O-N 2.96Å; M926-Q930 WeakPolarHBondContact O-CB 3.41Å; M926-Q930 VanDerWaalsContact O-CG 3.3Å; M926-Q930 WeakPolarHBondContact O-CG 3.5Å; M926-Q930 PolarHBondContact O-N 2.69Å
927	K	92.7	Very high	90.9	Very high	145 Å²	145	105.2 Å²	105.2	63%	0.63	53%	0.531	S	S	*	.	H	α-helix	trans	-65.6	-41.7	176.5	-168.5	178.9	-179.8	-178	0	112	H923 A924 Q925 Q930 Q931	H923-K927 WeakPolarHBondContact O-CB 3.33Å; H923-K927 PolarHBondContact O-N 2.9Å; A924-K927 WeakPolarHBondContact O-CB 3.42Å; A924-K927 PolarHBondContact O-N 3.43Å; A924-K927 VanDerWaalsContact O-N 3.16Å; Q925-K927 VanDerWaalsContact C-N 3.34Å; K927-Q930 PolarHBondContact O-N 3.26Å; K927-Q931 PolarHBondContact O-N 2.89Å
928	E	91.7	Very high	91	Very high	125 Å²	125	103.2 Å²	103.2	58%	0.584	53%	0.527	S	S	*	.	H	α-helix	trans	-61.3	-45.7	172.7	-73.4	174.9	-178.1	0	0	111.3	A924 Q925 Q930 Q931 V932	A924-E928 WeakPolarHBondContact O-CG 3.46Å; A924-E928 PolarHBondContact O-N 2.92Å; Q925-E928 PolarHBondContact O-N 3.35Å; E928-Q930 PolarHBondContact O-N 3.38Å; E928-Q931 WeakPolarHBondContact O-CB 3.37Å; E928-Q931 PolarHBondContact O-N 3.35Å; E928-V932 WeakPolarHBondContact O-CG2 3.31Å; E928-V932 PolarHBondContact O-N 3.29Å
929	A	89.4	Confident	91.1	Very high	54 Å²	54	101.9 Å²	101.9	45%	0.446	53%	0.528	S	S	.	.	H	α-helix	trans	-61.9	-42.3	176.8	0	0	0	0	0	112.2	Q925 M926 Q931 V932 V933	Q925-A929 WeakPolarHBondContact O-CB 3.37Å; Q925-A929 PolarHBondContact O-N 3.48Å; M926-A929 PolarHBondContact O-N 2.96Å; A929-Q931 VanDerWaalsContact C-N 3.34Å; A929-Q931 PolarHBondContact O-N 2.88Å; A929-V932 PolarHBondContact O-N 3.46Å; A929-V933 VanDerWaalsContact O-CG2 3.3Å; A929-V933 WeakPolarHBondContact O-CG2 3.42Å; A929-V933 PolarHBondContact O-N 3.47Å
930	Q	90.5	Very high	91.1	Very high	127 Å²	127	102.1 Å²	102.1	59%	0.593	53%	0.529	S	S	*	.	H	α-helix	trans	-61.7	-41.3	174.6	-76.4	175	-6.7	0	0	111.9	M926 K927 E928 V933 A934	M926-Q930 WeakPolarHBondContact O-CB 3.41Å; M926-Q930 VanDerWaalsContact O-CG 3.3Å; M926-Q930 WeakPolarHBondContact O-CG 3.5Å; M926-Q930 PolarHBondContact O-N 2.69Å; K927-Q930 PolarHBondContact O-N 3.26Å; E928-Q930 PolarHBondContact O-N 3.38Å; Q930-V933 PolarHBondContact O-N 2.9Å; Q930-A934 WeakPolarHBondContact O-CB 3.39Å; Q930-A934 PolarHBondContact O-N 3.3Å
931	Q	92.7	Very high	91.1	Very high	114 Å²	114	103 Å²	103	53%	0.533	53%	0.533	S	S	.	.	H	α-helix	trans	-62.6	-46.7	175.2	-178.5	177.7	-11.4	0	0	111.3	K927 E928 A929 V933 A934 E935	K927-Q931 PolarHBondContact O-N 2.89Å; E928-Q931 WeakPolarHBondContact O-CB 3.37Å; E928-Q931 PolarHBondContact O-N 3.35Å; A929-Q931 VanDerWaalsContact C-N 3.34Å; A929-Q931 PolarHBondContact O-N 2.88Å; Q931-V933 VanDerWaalsContact C-N 3.31Å; Q931-V933 PolarHBondContact O-N 3.3Å; Q931-A934 PolarHBondContact O-N 2.89Å; Q931-E935 HydrophobicContact CG-CG 4.48Å; Q931-E935 WeakPolarHBondContact CG-OE1 3.47Å; Q931-E935 PolarHBondContact NE2-OE1 2.9Å; Q931-E935 WeakPolarHBondContact O-CG 3.5Å; Q931-E935 PolarHBondContact O-N 3.4Å
932	V	92.5	Very high	91	Very high	76 Å²	76	99.4 Å²	99.4	46%	0.461	53%	0.526	S	S	.	.	H	α-helix	trans	-60.1	-42.4	176.8	172.4	0	0	0	0	111	E928 A929 E935 K936	E928-V932 WeakPolarHBondContact O-CG2 3.31Å; E928-V932 PolarHBondContact O-N 3.29Å; A929-V932 PolarHBondContact O-N 3.46Å; V932-E935 PolarHBondContact O-N 3.01Å; V932-K936 HydrophobicContact CG1-CG 4.26Å; V932-K936 WeakPolarHBondContact O-CB 3.37Å; V932-K936 WeakPolarHBondContact O-CG 3.4Å; V932-K936 PolarHBondContact O-N 3.15Å
933	V	90.3	Very high	91	Very high	90 Å²	90	96.6 Å²	96.6	55%	0.545	52%	0.518	S	S	.	.	H	α-helix	trans	-62.9	-43.5	176.2	169.7	0	0	0	0	111.2	A929 Q930 Q931 K936 T937	A929-V933 VanDerWaalsContact O-CG2 3.3Å; A929-V933 WeakPolarHBondContact O-CG2 3.42Å; A929-V933 PolarHBondContact O-N 3.47Å; Q930-V933 PolarHBondContact O-N 2.9Å; Q931-V933 VanDerWaalsContact C-N 3.31Å; Q931-V933 PolarHBondContact O-N 3.3Å; V933-K936 PolarHBondContact O-N 3.49Å; V933-T937 WeakPolarHBondContact O-CB 3.4Å; V933-T937 PolarHBondContact O-N 3.45Å; V933-T937 PolarHBondContact O-OG1 3.1Å
934	A	91.3	Very high	91	Very high	61 Å²	61	93 Å²	93	50%	0.504	51%	0.512	S	S	.	.	H	α-helix	trans	-62.2	-45.3	177	0	0	0	0	0	111.6	Q930 Q931 T937 S938	Q930-A934 WeakPolarHBondContact O-CB 3.39Å; Q930-A934 PolarHBondContact O-N 3.3Å; Q931-A934 PolarHBondContact O-N 2.89Å; A934-T937 PolarHBondContact O-N 3.3Å; A934-S938 WeakPolarHBondContact O-CB 3.39Å; A934-S938 PolarHBondContact O-N 3.18Å
935	E	93	Very high	90.9	Very high	108 Å²	108	98 Å²	98	51%	0.505	52%	0.521	S	S	.	.	H	α-helix	trans	-62.4	-43.5	176.5	-72.5	173.7	-169.7	0	0	112	Q931 V932 S938 S939	Q931-E935 HydrophobicContact CG-CG 4.48Å; Q931-E935 WeakPolarHBondContact CG-OE1 3.47Å; Q931-E935 PolarHBondContact NE2-OE1 2.9Å; Q931-E935 WeakPolarHBondContact O-CG 3.5Å; Q931-E935 PolarHBondContact O-N 3.4Å; V932-E935 PolarHBondContact O-N 3.01Å; E935-S938 PolarHBondContact O-N 3.15Å; E935-S939 WeakPolarHBondContact O-CB 3.31Å; E935-S939 PolarHBondContact O-N 2.91Å
936	K	91.7	Very high	90.9	Very high	139 Å²	139	98.8 Å²	98.8	60%	0.604	52%	0.524	S	S	*	.	H	α-helix	trans	-66.4	-38.6	176.4	-70.2	-63.8	-179.4	-172.3	0	112.4	V932 V933 S939 L940	V932-K936 HydrophobicContact CG1-CG 4.26Å; V932-K936 WeakPolarHBondContact O-CB 3.37Å; V932-K936 WeakPolarHBondContact O-CG 3.4Å; V932-K936 PolarHBondContact O-N 3.15Å; V933-K936 PolarHBondContact O-N 3.49Å; K936-S939 PolarHBondContact O-N 3.48Å; K936-L940 WeakPolarHBondContact O-CB 3.3Å; K936-L940 PolarHBondContact O-N 2.96Å
937	T	91.1	Very high	90.8	Very high	66 Å²	66	96.2 Å²	96.2	41%	0.405	52%	0.515	S	S	.	.	H	α-helix	trans	-63.7	-47.7	175.7	-55.3	0	0	0	0	110.3	V933 A934 S939 L940 E941	V933-T937 WeakPolarHBondContact O-CB 3.4Å; V933-T937 PolarHBondContact O-N 3.45Å; V933-T937 PolarHBondContact O-OG1 3.1Å; A934-T937 PolarHBondContact O-N 3.3Å; T937-S939 VanDerWaalsContact C-N 3.33Å; T937-S939 PolarHBondContact O-N 3.27Å; T937-L940 WeakPolarHBondContact O-CB 3.26Å; T937-L940 PolarHBondContact O-N 2.93Å; T937-L940 VanDerWaalsContact O-N 3.13Å; T937-E941 WeakPolarHBondContact O-CG 3.39Å; T937-E941 PolarHBondContact O-N 3.34Å
938	S	92.7	Very high	90.6	Very high	72 Å²	72	95.4 Å²	95.4	50%	0.503	51%	0.511	S	S	.	.	H	α-helix	trans	-60.9	-40.7	175.7	-177.2	0	0	0	0	112.5	A934 E935 L940 E941 A942	A934-S938 WeakPolarHBondContact O-CB 3.39Å; A934-S938 PolarHBondContact O-N 3.18Å; E935-S938 PolarHBondContact O-N 3.15Å; S938-L940 PolarHBondContact O-N 3.41Å; S938-E941 PolarHBondContact O-N 3.43Å; S938-A942 WeakPolarHBondContact O-CB 3.42Å; S938-A942 PolarHBondContact O-N 3.47Å
939	S	91.5	Very high	90.3	Very high	65 Å²	65	96.5 Å²	96.5	46%	0.455	51%	0.51	S	S	.	.	H	α-helix	trans	-63.2	-40	174.3	-177.1	0	0	0	0	112.4	E935 K936 T937 A942 E943	E935-S939 WeakPolarHBondContact O-CB 3.31Å; E935-S939 PolarHBondContact O-N 2.91Å; K936-S939 PolarHBondContact O-N 3.48Å; T937-S939 VanDerWaalsContact C-N 3.33Å; T937-S939 PolarHBondContact O-N 3.27Å; S939-A942 PolarHBondContact O-N 3.48Å; S939-E943 WeakPolarHBondContact O-CG 3.41Å; S939-E943 PolarHBondContact O-N 2.92Å
940	L	89.4	Confident	90.2	Very high	124 Å²	124	98.6 Å²	98.6	65%	0.649	51%	0.513	S	S	*	.	H	α-helix	trans	-65.8	-42.7	176.4	-89.3	160.4	0	0	0	111.6	K936 T937 S938 A942 E943 A944	K936-L940 WeakPolarHBondContact O-CB 3.3Å; K936-L940 PolarHBondContact O-N 2.96Å; T937-L940 WeakPolarHBondContact O-CB 3.26Å; T937-L940 PolarHBondContact O-N 2.93Å; T937-L940 VanDerWaalsContact O-N 3.13Å; S938-L940 PolarHBondContact O-N 3.41Å; L940-A942 VanDerWaalsContact C-N 3.35Å; L940-E943 PolarHBondContact O-N 3.27Å; L940-A944 VanDerWaalsContact O-CB 3.3Å; L940-A944 WeakPolarHBondContact O-CB 3.36Å; L940-A944 PolarHBondContact O-N 3Å
941	E	90.2	Very high	89.9	Confident	130 Å²	130	98.2 Å²	98.2	61%	0.607	51%	0.511	S	S	*	.	H	α-helix	trans	-61.9	-42.3	175.5	-72.1	175.5	173.9	0	0	111.8	T937 S938 A944 Y945	T937-E941 WeakPolarHBondContact O-CG 3.39Å; T937-E941 PolarHBondContact O-N 3.34Å; S938-E941 PolarHBondContact O-N 3.43Å; E941-A944 PolarHBondContact O-N 3.4Å; E941-Y945 WeakPolarHBondContact O-CB 3.45Å; E941-Y945 PolarHBondContact O-N 2.96Å
942	A	90.9	Very high	89.5	Confident	47 Å²	47	98 Å²	98	39%	0.388	51%	0.511	S	S	.	.	H	α-helix	trans	-63.3	-43.2	175.9	0	0	0	0	0	112.2	S938 S939 L940 Y945 K946	S938-A942 WeakPolarHBondContact O-CB 3.42Å; S938-A942 PolarHBondContact O-N 3.47Å; S939-A942 PolarHBondContact O-N 3.48Å; L940-A942 VanDerWaalsContact C-N 3.35Å; A942-Y945 PolarHBondContact O-N 2.93Å; A942-K946 WeakPolarHBondContact O-CG 3.34Å; A942-K946 PolarHBondContact O-N 3.44Å
943	E	88	Confident	89.1	Confident	89 Å²	89	98.4 Å²	98.4	42%	0.416	51%	0.507	S	S	.	.	H	α-helix	trans	-68.7	-37.9	175.9	-75.9	-55.5	134.9	0	0	112.6	S939 L940 Y945 K946 T947	S939-E943 WeakPolarHBondContact O-CG 3.41Å; S939-E943 PolarHBondContact O-N 2.92Å; L940-E943 PolarHBondContact O-N 3.27Å; E943-Y945 VanDerWaalsContact C-N 3.33Å; E943-Y945 PolarHBondContact O-N 2.86Å; E943-K946 PolarHBondContact O-N 2.85Å; E943-K946 IonicContact OE1-NZ 2.75Å; E943-K946 PolarHBondContact OE1-NZ 3.35Å; E943-T947 WeakPolarHBondContact O-CB 3.33Å; E943-T947 PolarHBondContact O-N 3.29Å; E943-T947 PolarHBondContact O-OG1 3.35Å
944	A	89.1	Confident	88.7	Confident	61 Å²	61	99.7 Å²	99.7	50%	0.504	51%	0.511	S	S	.	.	H	α-helix	trans	-61.7	-42.3	173.2	0	0	0	0	0	111.2	L940 E941 T947 K948	L940-A944 VanDerWaalsContact O-CB 3.3Å; L940-A944 WeakPolarHBondContact O-CB 3.36Å; L940-A944 PolarHBondContact O-N 3Å; E941-A944 PolarHBondContact O-N 3.4Å; A944-T947 PolarHBondContact O-N 3.37Å; A944-K948 WeakPolarHBondContact O-CB 3.45Å; A944-K948 PolarHBondContact O-N 2.91Å
945	Y	89.1	Confident	88.3	Confident	153 Å²	153	99 Å²	99	60%	0.6	50%	0.504	S	S	*	.	H	α-helix	trans	-62.9	-47.1	175.2	-178.6	-96.1	0	0	0	112.2	E941 A942 E943 T947 K948 R949	E941-Y945 WeakPolarHBondContact O-CB 3.45Å; E941-Y945 PolarHBondContact O-N 2.96Å; A942-Y945 PolarHBondContact O-N 2.93Å; E943-Y945 VanDerWaalsContact C-N 3.33Å; E943-Y945 PolarHBondContact O-N 2.86Å; Y945-T947 VanDerWaalsContact C-N 3.34Å; Y945-T947 PolarHBondContact O-N 3.38Å; Y945-K948 PolarHBondContact O-N 2.92Å; Y945-R949 PolarHBondContact O-N 3.36Å
946	K	91.7	Very high	87.8	Confident	110 Å²	110	99.2 Å²	99.2	48%	0.478	51%	0.506	S	S	.	.	H	α-helix	trans	-59.5	-44.1	174.6	-72.2	176.9	-165.4	166.6	0	111.9	A942 E943 K948 R949 L950	A942-K946 WeakPolarHBondContact O-CG 3.34Å; A942-K946 PolarHBondContact O-N 3.44Å; E943-K946 PolarHBondContact O-N 2.85Å; E943-K946 IonicContact OE1-NZ 2.75Å; E943-K946 PolarHBondContact OE1-NZ 3.35Å; K946-K948 VanDerWaalsContact C-N 3.33Å; K946-K948 PolarHBondContact O-N 3.31Å; K946-R949 WeakPolarHBondContact O-CB 3.42Å; K946-R949 PolarHBondContact O-N 3.34Å; K946-L950 WeakPolarHBondContact O-CG 3.35Å; K946-L950 PolarHBondContact O-N 3.39Å
947	T	86.4	Confident	87.3	Confident	65 Å²	65	98.8 Å²	98.8	40%	0.399	50%	0.504	S	S	.	.	H	α-helix	trans	-60.5	-43.3	178.1	-59.4	0	0	0	0	111.1	E943 A944 Y945 R949 L950 Q951	E943-T947 WeakPolarHBondContact O-CB 3.33Å; E943-T947 PolarHBondContact O-N 3.29Å; E943-T947 PolarHBondContact O-OG1 3.35Å; A944-T947 PolarHBondContact O-N 3.37Å; Y945-T947 VanDerWaalsContact C-N 3.34Å; Y945-T947 PolarHBondContact O-N 3.38Å; T947-R949 VanDerWaalsContact C-N 3.34Å; T947-R949 PolarHBondContact O-N 3.36Å; T947-L950 PolarHBondContact O-N 2.94Å; T947-Q951 VanDerWaalsContact O-CG 3.29Å; T947-Q951 WeakPolarHBondContact O-CG 3.38Å; T947-Q951 PolarHBondContact O-N 3.34Å
948	K	89.1	Confident	86.9	Confident	128 Å²	128	102.2 Å²	102.2	56%	0.557	51%	0.513	S	S	*	.	H	α-helix	trans	-61	-42.6	175.8	-169.6	178.2	178.1	-178.2	0	111.7	A944 Y945 K946 Q951 E952	A944-K948 WeakPolarHBondContact O-CB 3.45Å; A944-K948 PolarHBondContact O-N 2.91Å; Y945-K948 PolarHBondContact O-N 2.92Å; K946-K948 VanDerWaalsContact C-N 3.33Å; K946-K948 PolarHBondContact O-N 3.31Å; K948-Q951 WeakPolarHBondContact O-CB 3.48Å; K948-Q951 PolarHBondContact O-N 3.06Å; K948-E952 WeakPolarHBondContact O-CG 3.49Å; K948-E952 PolarHBondContact O-N 3.31Å
949	R	86.5	Confident	86.3	Confident	147 Å²	147	106.7 Å²	106.7	56%	0.555	52%	0.519	S	S	*	.	H	α-helix	trans	-63.8	-43.1	176.8	-159.2	176.9	-178.1	173.3	2.1	112.3	Y945 K946 T947 Q951 E952 E953	Y945-R949 PolarHBondContact O-N 3.36Å; K946-R949 WeakPolarHBondContact O-CB 3.42Å; K946-R949 PolarHBondContact O-N 3.34Å; T947-R949 VanDerWaalsContact C-N 3.34Å; T947-R949 PolarHBondContact O-N 3.36Å; R949-Q951 VanDerWaalsContact C-N 3.33Å; R949-Q951 PolarHBondContact O-N 3.36Å; R949-E952 WeakPolarHBondContact O-CB 3.36Å; R949-E952 PolarHBondContact O-N 3.32Å; R949-E953 WeakPolarHBondContact O-CG 3.31Å; R949-E953 PolarHBondContact O-N 3.44Å
950	L	86.8	Confident	85.7	Confident	99 Å²	99	109.5 Å²	109.5	52%	0.518	52%	0.523	S	S	.	.	H	α-helix	trans	-65	-35.2	174.4	-71.7	171.5	0	0	0	112.4	K946 T947 E953 L954	K946-L950 WeakPolarHBondContact O-CG 3.35Å; K946-L950 PolarHBondContact O-N 3.39Å; T947-L950 PolarHBondContact O-N 2.94Å; L950-E953 PolarHBondContact O-N 3.1Å; L950-L954 WeakPolarHBondContact O-CB 3.33Å; L950-L954 WeakPolarHBondContact O-CG 3.5Å; L950-L954 PolarHBondContact O-N 2.93Å
951	Q	83.9	Confident	85	Confident	118 Å²	118	106.3 Å²	106.3	55%	0.551	52%	0.515	S	S	*	.	H	α-helix	trans	-65.5	-39.3	173.2	-74.7	176.4	6	0	0	112	T947 K948 R949 A955	T947-Q951 VanDerWaalsContact O-CG 3.29Å; T947-Q951 WeakPolarHBondContact O-CG 3.38Å; T947-Q951 PolarHBondContact O-N 3.34Å; K948-Q951 WeakPolarHBondContact O-CB 3.48Å; K948-Q951 PolarHBondContact O-N 3.06Å; R949-Q951 VanDerWaalsContact C-N 3.33Å; R949-Q951 PolarHBondContact O-N 3.36Å; Q951-A955 WeakPolarHBondContact O-CB 3.33Å; Q951-A955 PolarHBondContact O-N 2.85Å
952	E	83.9	Confident	84.4	Confident	111 Å²	111	105 Å²	105	52%	0.519	51%	0.509	S	S	.	.	H	α-helix	trans	-63.8	-42.6	173.8	-71.4	171.4	-171	0	0	111.5	K948 R949 A955 Q956	K948-E952 WeakPolarHBondContact O-CG 3.49Å; K948-E952 PolarHBondContact O-N 3.31Å; R949-E952 WeakPolarHBondContact O-CB 3.36Å; R949-E952 PolarHBondContact O-N 3.32Å; E952-A955 PolarHBondContact O-N 3.28Å; E952-Q956 WeakPolarHBondContact O-CG 3.36Å; E952-Q956 PolarHBondContact O-N 3.41Å
953	E	85.3	Confident	83.6	Confident	83 Å²	83	111.5 Å²	111.5	39%	0.388	52%	0.523	S	S	.	.	H	α-helix	trans	-64.6	-45.3	175	-72	175.1	-172.4	0	0	112.3	R949 L950 A955 Q956 F957	R949-E953 WeakPolarHBondContact O-CG 3.31Å; R949-E953 PolarHBondContact O-N 3.44Å; L950-E953 PolarHBondContact O-N 3.1Å; E953-A955 VanDerWaalsContact C-N 3.32Å; E953-A955 PolarHBondContact O-N 3.3Å; E953-Q956 WeakPolarHBondContact O-CB 3.47Å; E953-Q956 PolarHBondContact O-N 3.46Å; E953-Q956 VanDerWaalsContact O-N 3.14Å; E953-F957 WeakPolarHBondContact O-CD2 3.4Å; E953-F957 PolarHBondContact O-N 3.06Å
954	L	80.4	Confident	82.7	Confident	118 Å²	118	113.5 Å²	113.5	62%	0.618	53%	0.534	S	S	*	.	H	α-helix	trans	-60	-41.1	174.1	-85.2	168.8	0	0	0	112	L950 Q956 F957 K958	L950-L954 WeakPolarHBondContact O-CB 3.33Å; L950-L954 WeakPolarHBondContact O-CG 3.5Å; L950-L954 PolarHBondContact O-N 2.93Å; L954-Q956 VanDerWaalsContact C-N 3.31Å; L954-Q956 PolarHBondContact O-N 3.45Å; L954-F957 PolarHBondContact O-N 3.34Å; L954-K958 VanDerWaalsContact O-CB 3.32Å; L954-K958 WeakPolarHBondContact O-CB 3.41Å; L954-K958 PolarHBondContact O-N 2.84Å
955	A	83.7	Confident	81.8	Confident	45 Å²	45	117 Å²	117	37%	0.372	54%	0.538	S	S	.	.	H	α-helix	trans	-63.4	-38.5	175.6	0	0	0	0	0	111.6	Q951 E952 E953 R959	Q951-A955 WeakPolarHBondContact O-CB 3.33Å; Q951-A955 PolarHBondContact O-N 2.85Å; E952-A955 PolarHBondContact O-N 3.28Å; E953-A955 VanDerWaalsContact C-N 3.32Å; E953-A955 PolarHBondContact O-N 3.3Å; A955-R959 WeakPolarHBondContact O-CG 3.43Å; A955-R959 PolarHBondContact O-N 3.14Å; A955-R959 VanDerWaalsContact O-N 3.09Å
956	Q	83.3	Confident	80.7	Confident	114 Å²	114	117.5 Å²	117.5	53%	0.533	54%	0.543	S	S	.	.	H	α-helix	trans	-64.2	-46.2	173	-73.2	-177.5	17.2	0	0	112.1	E952 E953 L954 R959 K960	E952-Q956 WeakPolarHBondContact O-CG 3.36Å; E952-Q956 PolarHBondContact O-N 3.41Å; E953-Q956 WeakPolarHBondContact O-CB 3.47Å; E953-Q956 PolarHBondContact O-N 3.46Å; E953-Q956 VanDerWaalsContact O-N 3.14Å; L954-Q956 VanDerWaalsContact C-N 3.31Å; L954-Q956 PolarHBondContact O-N 3.45Å; Q956-R959 PolarHBondContact O-N 3.44Å; Q956-K960 WeakPolarHBondContact O-CG 3.46Å; Q956-K960 PolarHBondContact O-N 3.31Å
957	F	80.3	Confident	79.1	Confident	129 Å²	129	118 Å²	118	57%	0.566	55%	0.549	S	S	*	.	H	α-helix	trans	-65.4	-38.9	177.8	-75.3	-60.1	0	0	0	112.5	E953 L954 R959 K960 A961	E953-F957 WeakPolarHBondContact O-CD2 3.4Å; E953-F957 PolarHBondContact O-N 3.06Å; L954-F957 PolarHBondContact O-N 3.34Å; F957-R959 PolarHBondContact O-N 2.82Å; F957-K960 WeakPolarHBondContact O-CB 3.45Å; F957-K960 PolarHBondContact O-N 3.17Å; F957-K960 VanDerWaalsContact O-N 3.16Å; F957-A961 WeakPolarHBondContact O-CB 3.45Å; F957-A961 PolarHBondContact O-N 2.9Å
958	K	81.9	Confident	77.8	Confident	138 Å²	138	122.5 Å²	122.5	60%	0.6	57%	0.565	S	S	*	*	H	α-helix	trans	-61.6	-44.3	175.6	-168.7	176.7	178.9	-177.9	0	111.7	L954 K960 A961 E962	L954-K958 VanDerWaalsContact O-CB 3.32Å; L954-K958 WeakPolarHBondContact O-CB 3.41Å; L954-K958 PolarHBondContact O-N 2.84Å; K958-K960 VanDerWaalsContact C-N 3.32Å; K958-K960 PolarHBondContact O-N 2.86Å; K958-A961 PolarHBondContact O-N 2.91Å; K958-E962 WeakPolarHBondContact CE-OE1 3.45Å; K958-E962 WeakPolarHBondContact O-CB 3.08Å; K958-E962 WeakPolarHBondContact O-CG 3.33Å; K958-E962 PolarHBondContact O-N 3.14Å
959	R	80.5	Confident	76.3	Confident	166 Å²	166	123.3 Å²	123.3	63%	0.626	57%	0.573	S	S	*	*	H	α-helix	trans	-61	-38.5	173.5	-74	177.3	-175.1	162.1	2.6	112.5	A955 Q956 F957 R963	A955-R959 WeakPolarHBondContact O-CG 3.43Å; A955-R959 PolarHBondContact O-N 3.14Å; A955-R959 VanDerWaalsContact O-N 3.09Å; Q956-R959 PolarHBondContact O-N 3.44Å; F957-R959 PolarHBondContact O-N 2.82Å; R959-R963 WeakPolarHBondContact O-CG 3.47Å; R959-R963 PolarHBondContact O-N 3.14Å
960	K	79.9	Confident	74.7	Confident	124 Å²	124	119.5 Å²	119.5	54%	0.539	57%	0.569	S	S	.	*	H	α-helix	trans	-66.8	-43.7	175.5	-74.2	179.4	179	177.5	0	111.7	Q956 F957 K958 R963 M964	Q956-K960 WeakPolarHBondContact O-CG 3.46Å; Q956-K960 PolarHBondContact O-N 3.31Å; F957-K960 WeakPolarHBondContact O-CB 3.45Å; F957-K960 PolarHBondContact O-N 3.17Å; F957-K960 VanDerWaalsContact O-N 3.16Å; K958-K960 VanDerWaalsContact C-N 3.32Å; K958-K960 PolarHBondContact O-N 2.86Å; K960-R963 PolarHBondContact O-N 2.9Å; K960-M964 WeakPolarHBondContact O-CG 3.44Å; K960-M964 PolarHBondContact O-N 3.05Å; K960-M964 VanDerWaalsContact O-N 3.09Å
961	A	75.2	Confident	72.9	Confident	58 Å²	58	117.7 Å²	117.7	48%	0.479	57%	0.574	S	S	.	*	H	α-helix	trans	-65.4	-41.3	177.8	0	0	0	0	0	112.3	F957 K958 R963 M964 K965	F957-A961 WeakPolarHBondContact O-CB 3.45Å; F957-A961 PolarHBondContact O-N 2.9Å; K958-A961 PolarHBondContact O-N 2.91Å; A961-R963 VanDerWaalsContact C-N 3.31Å; A961-R963 PolarHBondContact O-N 3.38Å; A961-M964 PolarHBondContact O-N 3.43Å; A961-K965 WeakPolarHBondContact O-CB 3.05Å; A961-K965 PolarHBondContact O-N 3.39Å
962	E	76.9	Confident	71.3	Confident	103 Å²	103	114.7 Å²	114.7	48%	0.481	56%	0.564	S	S	.	*	H	α-helix	trans	-62.7	-36.2	175.4	-78	173.2	-172.1	0	0	112.4	K958 K966	K958-E962 WeakPolarHBondContact CE-OE1 3.45Å; K958-E962 WeakPolarHBondContact O-CB 3.08Å; K958-E962 WeakPolarHBondContact O-CG 3.33Å; K958-E962 PolarHBondContact O-N 3.14Å; E962-K966 PolarHBondContact O-N 3.46Å
963	R	72.8	Confident	69.9	Low	182 Å²	182	113.7 Å²	113.7	69%	0.687	57%	0.565	S	S	*	*	H	α-helix	trans	-65.2	-46.1	173.1	-74.7	177.9	-173.6	173	0.6	112	R959 K960 A961 K966 M967	R959-R963 WeakPolarHBondContact O-CG 3.47Å; R959-R963 PolarHBondContact O-N 3.14Å; K960-R963 PolarHBondContact O-N 2.9Å; A961-R963 VanDerWaalsContact C-N 3.31Å; A961-R963 PolarHBondContact O-N 3.38Å; R963-K966 PolarHBondContact O-N 3.38Å; R963-M967 PolarHBondContact O-N 2.91Å
964	M	69.4	Low	68.7	Low	131 Å²	131	115.3 Å²	115.3	65%	0.645	58%	0.576	S	S	*	*	H	α-helix	trans	-60.9	-45.2	176.4	-70.2	-90	-71.9	0	0	111.3	K960 A961 K966 M967 E968	K960-M964 WeakPolarHBondContact O-CG 3.44Å; K960-M964 PolarHBondContact O-N 3.05Å; K960-M964 VanDerWaalsContact O-N 3.09Å; A961-M964 PolarHBondContact O-N 3.43Å; M964-K966 VanDerWaalsContact C-N 3.34Å; M964-K966 PolarHBondContact O-N 2.97Å; M964-M967 WeakPolarHBondContact O-CB 3.29Å; M964-M967 PolarHBondContact O-N 2.93Å; M964-M967 VanDerWaalsContact O-N 3.1Å; M964-E968 PolarHBondContact O-N 3.02Å
965	K	71.5	Confident	67.7	Low	134 Å²	134	115 Å²	115	58%	0.583	58%	0.575	S	S	*	*	H	α-helix	trans	-64.7	-35.6	179	-165	175.5	-175.2	178.9	0	112.6	A961 M967 E968 M969	A961-K965 WeakPolarHBondContact O-CB 3.05Å; A961-K965 PolarHBondContact O-N 3.39Å; K965-M967 VanDerWaalsContact C-N 3.32Å; K965-E968 PolarHBondContact O-N 3.44Å; K965-M969 HydrophobicContact CG-CE 4.44Å; K965-M969 WeakPolarHBondContact O-CB 3.36Å; K965-M969 PolarHBondContact O-N 3.08Å
966	K	65.9	Low	66.8	Low	165 Å²	165	118 Å²	118	72%	0.717	58%	0.581	S	S	*	*	H	α-helix	trans	-64	-36.7	172.5	-85.1	-176.1	175.8	-176.3	0	112.4	E962 R963 M964 S970	E962-K966 PolarHBondContact O-N 3.46Å; R963-K966 PolarHBondContact O-N 3.38Å; M964-K966 VanDerWaalsContact C-N 3.34Å; M964-K966 PolarHBondContact O-N 2.97Å; K966-S970 PolarHBondContact O-N 2.87Å; K966-S970 PolarHBondContact O-OG 3.48Å
967	M	58.6	Low	65.9	Low	121 Å²	121	115.7 Å²	115.7	60%	0.596	57%	0.574	S	S	*	*	H	α-helix	trans	-69.2	-35.5	175.3	-70.5	177	67.8	0	0	112.5	R963 M964 K965 S970	R963-M967 PolarHBondContact O-N 2.91Å; M964-M967 WeakPolarHBondContact O-CB 3.29Å; M964-M967 PolarHBondContact O-N 2.93Å; M964-M967 VanDerWaalsContact O-N 3.1Å; K965-M967 VanDerWaalsContact C-N 3.32Å; M967-S970 PolarHBondContact O-OG 3.47Å
968	E	58.5	Low	65.4	Low	158 Å²	158	114.6 Å²	114.6	74%	0.738	57%	0.572	S	S	*	*	H	α-helix	trans	-71.6	-40.8	174.7	-78.4	-179.1	150.4	0	0	112.5	M964 K965 S970 G971	M964-E968 PolarHBondContact O-N 3.02Å; K965-E968 PolarHBondContact O-N 3.44Å; E968-S970 VanDerWaalsContact C-N 3.34Å; E968-S970 PolarHBondContact O-N 3.31Å; E968-G971 PolarHBondContact O-N 3.25Å
969	M	57.5	Low	65.1	Low	145 Å²	145	113.1 Å²	113.1	71%	0.714	57%	0.57	S	S	*	*	H	α-helix	trans	-72.8	-25.1	-176	-151.1	85.3	79.3	0	0	113.2	K965 G971	K965-M969 HydrophobicContact CG-CE 4.44Å; K965-M969 WeakPolarHBondContact O-CB 3.36Å; K965-M969 PolarHBondContact O-N 3.08Å; M969-G971 PolarHBondContact O-N 3.49Å
970	S	52.1	Low	64.8	Low	67 Å²	67	108.9 Å²	108.9	47%	0.469	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.9	-6.7	179.9	57.1	0	0	0	0	113.6	K966 M967 E968 T972	K966-S970 PolarHBondContact O-N 2.87Å; K966-S970 PolarHBondContact O-OG 3.48Å; M967-S970 PolarHBondContact O-OG 3.47Å; E968-S970 VanDerWaalsContact C-N 3.34Å; E968-S970 PolarHBondContact O-N 3.31Å; S970-T972 PolarHBondContact O-N 3Å; S970-T972 PolarHBondContact OG-OG1 3.16Å
971	G	50.5	Low	64.6	Low	62 Å²	62	107.4 Å²	107.4	64%	0.639	55%	0.552	S	S	*	*			trans	59.7	2.8	176.3	0	0	0	0	0	115	E968 M969 T973	E968-G971 PolarHBondContact O-N 3.25Å; M969-G971 PolarHBondContact O-N 3.49Å; G971-T973 PolarHBondContact O-N 2.85Å
972	T	48.7	Very low	64.7	Low	55 Å²	55	108.8 Å²	108.8	34%	0.337	55%	0.551	S	S	.	*			trans	-74.3	97.3	177.6	48.9	0	0	0	0	107	S970 I974	S970-T972 PolarHBondContact O-N 3Å; S970-T972 PolarHBondContact OG-OG1 3.16Å; T972-I974 PolarHBondContact O-N 3.45Å
973	T	54.9	Low	64.9	Low	89 Å²	89	109.5 Å²	109.5	55%	0.546	55%	0.549	S	S	.	.			trans	-50.9	141.2	170.1	39.3	0	0	0	0	108.8	G971 D975 E976	G971-T973 PolarHBondContact O-N 2.85Å; T973-D975 PolarHBondContact O-N 3.49Å; T973-E976 WeakPolarHBondContact O-CB 3.31Å; T973-E976 PolarHBondContact O-N 3.4Å
974	I	59.2	Low	65.3	Low	117 Å²	117	106 Å²	106	60%	0.6	54%	0.54	S	S	*	.	H	α-helix	trans	-45.7	-31.9	-177.8	-81.4	165.7	0	0	0	112.7	T972 E976 V977 M978	T972-I974 PolarHBondContact O-N 3.45Å; I974-E976 PolarHBondContact O-N 3.25Å; I974-V977 PolarHBondContact O-N 3.31Å; I974-M978 HydrophobicContact CG2-CG 4.24Å; I974-M978 WeakPolarHBondContact O-CB 3.45Å; I974-M978 WeakPolarHBondContact O-CG 3.33Å; I974-M978 PolarHBondContact O-N 3.03Å
975	D	60.3	Low	65.8	Low	112 Å²	112	107.3 Å²	107.3	60%	0.599	54%	0.539	S	S	*	.	H	α-helix	trans	-61.4	-37.1	174.7	-74	-15.1	0	0	0	113.7	T973 M978 I979	T973-D975 PolarHBondContact O-N 3.49Å; D975-M978 PolarHBondContact O-N 2.88Å; D975-I979 VanDerWaalsContact O-CB 3.29Å; D975-I979 WeakPolarHBondContact O-CB 3.15Å; D975-I979 WeakPolarHBondContact O-CD1 3.47Å; D975-I979 WeakPolarHBondContact O-CG1 3.49Å; D975-I979 PolarHBondContact O-N 3.35Å
976	E	64.2	Low	66.3	Low	108 Å²	108	107.7 Å²	107.7	51%	0.505	54%	0.541	S	S	.	.	H	α-helix	trans	-71.1	-39.2	177.9	-68.3	-173.3	157.6	0	0	112.1	T973 I974 M978 I979 E980	T973-E976 WeakPolarHBondContact O-CB 3.31Å; T973-E976 PolarHBondContact O-N 3.4Å; I974-E976 PolarHBondContact O-N 3.25Å; E976-M978 VanDerWaalsContact C-N 3.33Å; E976-I979 PolarHBondContact O-N 3.36Å; E976-E980 WeakPolarHBondContact O-CB 3.47Å; E976-E980 PolarHBondContact O-N 2.94Å
977	V	64.9	Low	67.2	Low	65 Å²	65	105.7 Å²	105.7	39%	0.394	53%	0.534	S	S	.	.	H	α-helix	trans	-64.5	-42.5	174.3	-178.7	0	0	0	0	110	I974 E980 E981	I974-V977 PolarHBondContact O-N 3.31Å; V977-E980 PolarHBondContact O-N 2.83Å; V977-E981 PolarHBondContact O-N 3.17Å
978	M	69.5	Low	68.5	Low	106 Å²	106	104.3 Å²	104.3	52%	0.522	53%	0.533	S	S	.	.	H	α-helix	trans	-64.7	-41.3	175.1	-70.9	-88.9	175.5	0	0	111.9	I974 D975 E976 E980 I982	I974-M978 HydrophobicContact CG2-CG 4.24Å; I974-M978 WeakPolarHBondContact O-CB 3.45Å; I974-M978 WeakPolarHBondContact O-CG 3.33Å; I974-M978 PolarHBondContact O-N 3.03Å; D975-M978 PolarHBondContact O-N 2.88Å; E976-M978 VanDerWaalsContact C-N 3.33Å; M978-E980 VanDerWaalsContact C-N 3.33Å; M978-I982 WeakPolarHBondContact O-CB 3.41Å; M978-I982 WeakPolarHBondContact O-CD1 3.41Å; M978-I982 WeakPolarHBondContact O-CG1 3.37Å; M978-I982 PolarHBondContact O-N 2.94Å
979	I	75.7	Confident	69.8	Low	108 Å²	108	101.1 Å²	101.1	55%	0.554	52%	0.52	S	S	*	.	H	α-helix	trans	-64.5	-39.5	176.8	-74.7	163.3	0	0	0	110.7	D975 E976 I982 R983	D975-I979 VanDerWaalsContact O-CB 3.29Å; D975-I979 WeakPolarHBondContact O-CB 3.15Å; D975-I979 WeakPolarHBondContact O-CD1 3.47Å; D975-I979 WeakPolarHBondContact O-CG1 3.49Å; D975-I979 PolarHBondContact O-N 3.35Å; E976-I979 PolarHBondContact O-N 3.36Å; I979-I982 PolarHBondContact O-N 3.26Å; I979-R983 WeakPolarHBondContact O-CB 3.27Å; I979-R983 PolarHBondContact O-N 3.33Å
980	E	75.4	Confident	71.4	Confident	77 Å²	77	96 Å²	96	36%	0.36	50%	0.497	S	S	.	.	H	α-helix	trans	-71.8	-41.9	179.5	-165.9	61.5	-169.3	0	0	111.8	E976 V977 M978 I982 R983 E984	E976-E980 WeakPolarHBondContact O-CB 3.47Å; E976-E980 PolarHBondContact O-N 2.94Å; V977-E980 PolarHBondContact O-N 2.83Å; M978-E980 VanDerWaalsContact C-N 3.33Å; E980-I982 VanDerWaalsContact C-N 3.33Å; E980-I982 PolarHBondContact O-N 2.99Å; E980-R983 VanDerWaalsContact CD-NE 3.26Å; E980-R983 WeakPolarHBondContact O-CB 3.22Å; E980-R983 PolarHBondContact O-N 3.42Å; E980-R983 VanDerWaalsContact O-N 3.09Å; E980-R983 IonicContact OE1-CZ 3.09Å; E980-R983 IonicContact OE1-NE 3.17Å; E980-R983 PolarHBondContact OE1-NE 3.42Å; E980-R983 IonicContact OE1-NH2 3.13Å; E980-R983 PolarHBondContact OE1-NH2 3.35Å; E980-R983 IonicContact OE2-CZ 3.7Å; E980-R983 IonicContact OE2-NE 3.4Å; E980-R983 PolarHBondContact OE2-NE 2.98Å; E980-E984 WeakPolarHBondContact O-CG 3.41Å; E980-E984 PolarHBondContact O-N 3.01Å
981	E	75.5	Confident	73.2	Confident	92 Å²	92	92.8 Å²	92.8	43%	0.43	48%	0.475	S	S	.	.	H	α-helix	trans	-59.2	-43.8	170.3	-77.5	-173.5	168	0	0	111.2	V977 R983 E984 Y985	V977-E981 PolarHBondContact O-N 3.17Å; E981-R983 VanDerWaalsContact C-N 3.3Å; E981-R983 PolarHBondContact O-N 3.15Å; E981-E984 PolarHBondContact O-N 2.72Å; E981-Y985 HydrophobicContact CB-CE2 4.38Å; E981-Y985 WeakPolarHBondContact O-CD2 3.49Å; E981-Y985 PolarHBondContact O-N 3.39Å
982	I	77.2	Confident	75	Confident	87 Å²	87	92.7 Å²	92.7	45%	0.446	46%	0.463	S	S	.	.	H	α-helix	trans	-62.2	-37.6	175	-71.1	166.4	0	0	0	111.2	M978 I979 E980 K986	M978-I982 WeakPolarHBondContact O-CB 3.41Å; M978-I982 WeakPolarHBondContact O-CD1 3.41Å; M978-I982 WeakPolarHBondContact O-CG1 3.37Å; M978-I982 PolarHBondContact O-N 2.94Å; I979-I982 PolarHBondContact O-N 3.26Å; E980-I982 VanDerWaalsContact C-N 3.33Å; E980-I982 PolarHBondContact O-N 2.99Å; I982-K986 HydrophobicContact CG2-CD 4.07Å; I982-K986 HydrophobicContact CG2-CG 4.46Å; I982-K986 WeakPolarHBondContact O-CB 3.38Å; I982-K986 VanDerWaalsContact O-CG 3.28Å; I982-K986 WeakPolarHBondContact O-CG 3.44Å; I982-K986 PolarHBondContact O-N 3.08Å
983	R	81.6	Confident	76.8	Confident	118 Å²	118	92.4 Å²	92.4	45%	0.445	46%	0.463	S	S	.	.	H	α-helix	trans	-65.5	-46.8	177.4	-167.6	-174	74.9	72	1.5	110.9	I979 E980 E981 K986 E987	I979-R983 WeakPolarHBondContact O-CB 3.27Å; I979-R983 PolarHBondContact O-N 3.33Å; E980-R983 VanDerWaalsContact CD-NE 3.26Å; E980-R983 WeakPolarHBondContact O-CB 3.22Å; E980-R983 PolarHBondContact O-N 3.42Å; E980-R983 VanDerWaalsContact O-N 3.09Å; E980-R983 IonicContact OE1-CZ 3.09Å; E980-R983 IonicContact OE1-NE 3.17Å; E980-R983 PolarHBondContact OE1-NE 3.42Å; E980-R983 IonicContact OE1-NH2 3.13Å; E980-R983 PolarHBondContact OE1-NH2 3.35Å; E980-R983 IonicContact OE2-CZ 3.7Å; E980-R983 IonicContact OE2-NE 3.4Å; E980-R983 PolarHBondContact OE2-NE 2.98Å; E981-R983 VanDerWaalsContact C-N 3.3Å; E981-R983 PolarHBondContact O-N 3.15Å; R983-K986 PolarHBondContact O-N 3.05Å; R983-E987 IonicContact NH1-OE2 3.7Å; R983-E987 PolarHBondContact NH1-OE2 3.42Å; R983-E987 WeakPolarHBondContact O-CB 3.48Å; R983-E987 PolarHBondContact O-N 3.46Å
984	E	81.1	Confident	78.5	Confident	109 Å²	109	90.3 Å²	90.3	51%	0.509	45%	0.451	S	S	.	.	H	α-helix	trans	-62	-43.5	176.6	-72.2	-172.1	169	0	0	111.9	E980 E981 E987 T988	E980-E984 WeakPolarHBondContact O-CG 3.41Å; E980-E984 PolarHBondContact O-N 3.01Å; E981-E984 PolarHBondContact O-N 2.72Å; E984-E987 PolarHBondContact O-N 3.36Å; E984-T988 WeakPolarHBondContact O-CB 3.4Å; E984-T988 PolarHBondContact O-N 3.29Å; E984-T988 PolarHBondContact O-OG1 3.39Å
985	Y	79.2	Confident	79.9	Confident	158 Å²	158	92.8 Å²	92.8	62%	0.62	46%	0.458	S	S	*	.	H	α-helix	trans	-64.3	-40.9	175.1	-73.6	-52.7	0	0	0	112.2	E981 T988 L989	E981-Y985 HydrophobicContact CB-CE2 4.38Å; E981-Y985 WeakPolarHBondContact O-CD2 3.49Å; E981-Y985 PolarHBondContact O-N 3.39Å; Y985-T988 PolarHBondContact O-N 3.03Å; Y985-L989 WeakPolarHBondContact O-CB 3.34Å; Y985-L989 VanDerWaalsContact O-CG 3.31Å; Y985-L989 WeakPolarHBondContact O-CG 3.43Å; Y985-L989 PolarHBondContact O-N 3.44Å; Y985-L989 VanDerWaalsContact O-N 3.07Å
986	K	81.8	Confident	81.3	Confident	142 Å²	142	93.1 Å²	93.1	62%	0.617	46%	0.464	S	S	*	.	H	α-helix	trans	-63.5	-43.3	175.8	-80.6	176.2	-179.9	173.8	0	112.1	I982 R983 L989 T990	I982-K986 HydrophobicContact CG2-CD 4.07Å; I982-K986 HydrophobicContact CG2-CG 4.46Å; I982-K986 WeakPolarHBondContact O-CB 3.38Å; I982-K986 VanDerWaalsContact O-CG 3.28Å; I982-K986 WeakPolarHBondContact O-CG 3.44Å; I982-K986 PolarHBondContact O-N 3.08Å; R983-K986 PolarHBondContact O-N 3.05Å; K986-L989 PolarHBondContact O-N 2.98Å; K986-T990 PolarHBondContact O-N 3.43Å; K986-T990 PolarHBondContact O-OG1 2.93Å
987	E	84.7	Confident	82.5	Confident	123 Å²	123	92.9 Å²	92.9	58%	0.575	46%	0.461	S	S	*	.	H	α-helix	trans	-63.2	-44.1	177.5	-173.3	167.3	-175.5	0	0	110.9	R983 E984 L989 T990	R983-E987 IonicContact NH1-OE2 3.7Å; R983-E987 PolarHBondContact NH1-OE2 3.42Å; R983-E987 WeakPolarHBondContact O-CB 3.48Å; R983-E987 PolarHBondContact O-N 3.46Å; E984-E987 PolarHBondContact O-N 3.36Å; E987-L989 PolarHBondContact O-N 3.1Å; E987-T990 PolarHBondContact O-N 3.01Å; E987-T990 VanDerWaalsContact O-N 3.13Å
988	T	85.4	Confident	83.7	Confident	93 Å²	93	99 Å²	99	57%	0.571	48%	0.477	S	S	*	.	H	α-helix	trans	-63.7	-29.4	178.5	-50.8	0	0	0	0	112.5	E984 Y985 K999	E984-T988 WeakPolarHBondContact O-CB 3.4Å; E984-T988 PolarHBondContact O-N 3.29Å; E984-T988 PolarHBondContact O-OG1 3.39Å; Y985-T988 PolarHBondContact O-N 3.03Å; T988-K999 WeakPolarHBondContact O-CE 3.27Å; T988-K999 PolarHBondContact O-NZ 2.96Å
989	L	86.5	Confident	84.7	Confident	90 Å²	90	96.5 Å²	96.5	47%	0.471	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-2.1	178.2	-68.9	170.9	0	0	0	114.4	Y985 K986 E987 R998 K999	Y985-L989 WeakPolarHBondContact O-CB 3.34Å; Y985-L989 VanDerWaalsContact O-CG 3.31Å; Y985-L989 WeakPolarHBondContact O-CG 3.43Å; Y985-L989 PolarHBondContact O-N 3.44Å; Y985-L989 VanDerWaalsContact O-N 3.07Å; K986-L989 PolarHBondContact O-N 2.98Å; E987-L989 PolarHBondContact O-N 3.1Å; L989-R998 WeakPolarHBondContact O-CA 3.34Å; L989-K999 PolarHBondContact O-N 3.47Å
990	T	89.8	Confident	85.6	Confident	37 Å²	37	92.9 Å²	92.9	23%	0.227	45%	0.445	C	S	.	.	B	Isolated β-bridge	trans	-91.5	139.2	-177.5	-59.3	0	0	0	0	111.8	K986 E987 P992 K995 K999	K986-T990 PolarHBondContact O-N 3.43Å; K986-T990 PolarHBondContact O-OG1 2.93Å; E987-T990 PolarHBondContact O-N 3.01Å; E987-T990 VanDerWaalsContact O-N 3.13Å; T990-P992 WeakPolarHBondContact O-CD 3.41Å; T990-K995 VanDerWaalsContact CG2-C 3.43Å; T990-K999 WeakPolarHBondContact O-CE 3.38Å
991	C	91	Very high	86.3	Confident	0 Å²	0	89.2 Å²	89.2	0%	0	43%	0.428	C	S	.	.			trans	-58.9	122.4	-177.4	172.7	0	0	0	0	111	S993 K995 K997 C1011	C991-S993 PolarHBondContact O-N 2.99Å; C991-S993 PolarHBondContact SG-N 2.97Å; C991-K995 WeakPolarHBondContact O-CA 3.27Å; C991-K995 PolarHBondContact O-N 3.44Å; C991-K997 WeakPolarHBondContact CA-O 3.43Å; C991-K997 WeakPolarHBondContact CB-O 3.5Å; C991-K997 PolarHBondContact N-O 3.33Å; C991-C1011 HydrophobicContact CB-CB 3.87Å; C991-C1011 PolarHBondContact SG-N 3.18Å; C991-C1011 VanDerWaalsContact SG-SG 3.63Å
992	P	88.8	Confident	87.2	Confident	61 Å²	61	85.8 Å²	85.8	40%	0.396	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-24.3	-178.4	-23.2	33.4	0	0	0	114.3	T990 F1010	T990-P992 WeakPolarHBondContact O-CD 3.41Å; P992-F1010 HydrophobicContact CB-CD1 4.44Å; P992-F1010 HydrophobicContact CB-CE1 4.26Å; P992-F1010 HydrophobicContact CG-CD1 4.32Å; P992-F1010 HydrophobicContact CG-CE1 4.29Å
993	S	86.1	Confident	88	Confident	49 Å²	49	81.7 Å²	81.7	34%	0.343	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-44.2	-177.8	-94.6	0	0	0	0	113.4	C991 P1027	C991-S993 PolarHBondContact O-N 2.99Å; C991-S993 PolarHBondContact SG-N 2.97Å; S993-P1027 WeakPolarHBondContact OG-CB 3.29Å; S993-P1027 VanDerWaalsContact OG-CG 3.26Å; S993-P1027 WeakPolarHBondContact OG-CG 3.35Å
994	C	90.4	Very high	88.4	Confident	44 Å²	44	78 Å²	78	30%	0.297	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-16.7	179.9	60.1	0	0	0	0	113.3	V996 K997 C1011	C994-V996 VanDerWaalsContact O-CG2 3.31Å; C994-V996 WeakPolarHBondContact O-CG2 3.33Å; C994-V996 PolarHBondContact O-N 2.98Å; C994-K997 PolarHBondContact SG-N 3.33Å; C994-K997 VanDerWaalsContact SG-N 3.39Å; C994-C1011 VanDerWaalsContact SG-SG 3.68Å
995	K	88.3	Confident	88.8	Confident	170 Å²	170	78.9 Å²	78.9	74%	0.739	39%	0.387	S	S	*	.	S	Bend	trans	51.9	21.9	-172.8	-60.5	-167.7	176.5	-167.2	0	114.6	T990 C991	T990-K995 VanDerWaalsContact CG2-C 3.43Å; C991-K995 WeakPolarHBondContact O-CA 3.27Å; C991-K995 PolarHBondContact O-N 3.44Å
996	V	89.8	Confident	89.5	Confident	119 Å²	119	72.5 Å²	72.5	72%	0.721	37%	0.365	S	S	*	.	S	Bend	trans	-125.6	-56.5	-174.9	172.2	0	0	0	0	110.7	C994	C994-V996 VanDerWaalsContact O-CG2 3.31Å; C994-V996 WeakPolarHBondContact O-CG2 3.33Å; C994-V996 PolarHBondContact O-N 2.98Å
997	K	90.3	Very high	89.9	Confident	102 Å²	102	73.4 Å²	73.4	44%	0.443	37%	0.369	S	S	.	.	S	Bend	trans	-82.1	150.7	-178.5	-65.2	-179.1	175.5	179.5	0	110.5	C991 C994 C1011 D1013	C991-K997 WeakPolarHBondContact CA-O 3.43Å; C991-K997 WeakPolarHBondContact CB-O 3.5Å; C991-K997 PolarHBondContact N-O 3.33Å; C994-K997 PolarHBondContact SG-N 3.33Å; C994-K997 VanDerWaalsContact SG-N 3.39Å; K997-C1011 HydrophobicContact CB-CB 3.75Å; K997-D1013 WeakPolarHBondContact CD-OD2 3.43Å; K997-D1013 WeakPolarHBondContact CE-OD2 3.38Å; K997-D1013 IonicContact NZ-OD2 2.59Å; K997-D1013 PolarHBondContact NZ-OD2 3.19Å
998	R	89.7	Confident	90.4	Very high	195 Å²	195	69.7 Å²	69.7	74%	0.736	35%	0.352	S	S	*	.	B	Isolated β-bridge	trans	-66.6	156.6	172.8	-63	-166	-157.6	167.4	6.5	111.3	L989 D1000 C1011	L989-R998 WeakPolarHBondContact O-CA 3.34Å; R998-D1000 PolarHBondContact O-N 3.43Å; R998-C1011 VanDerWaalsContact O-CB 3.26Å; R998-C1011 WeakPolarHBondContact O-CB 3.41Å
999	K	90.7	Very high	90.7	Very high	53 Å²	53	67.4 Å²	67.4	23%	0.23	34%	0.337	C	S	.	.			trans	-65.4	113.6	170.2	-72	173.6	179	172.6	0	109.4	T988 L989 T990 V1009 F1010 L1043	T988-K999 WeakPolarHBondContact O-CE 3.27Å; T988-K999 PolarHBondContact O-NZ 2.96Å; L989-K999 PolarHBondContact O-N 3.47Å; T990-K999 WeakPolarHBondContact O-CE 3.38Å; K999-V1009 HydrophobicContact CB-CB 4.36Å; K999-V1009 HydrophobicContact CB-CG1 3.72Å; K999-V1009 HydrophobicContact CD-CB 4.31Å; K999-V1009 HydrophobicContact CG-CB 4.48Å; K999-V1009 HydrophobicContact CG-CG1 4.33Å; K999-F1010 CarbonylContact C-O 3.56Å; K999-F1010 WeakPolarHBondContact CA-O 3.49Å; K999-L1043 WeakPolarHBondContact O-CD1 3.4Å
1000	D	93.5	Very high	91	Very high	31 Å²	31	63.2 Å²	63.2	17%	0.166	32%	0.315	C	S	.	.			trans	-139.6	14.7	179.8	74	-21.5	0	0	0	113.4	R998 F1010 C1011 Y1012 R1040 L1041	R998-D1000 PolarHBondContact O-N 3.43Å; D1000-F1010 PolarHBondContact N-O 2.93Å; D1000-C1011 WeakPolarHBondContact OD1-CA 3.38Å; D1000-C1011 WeakPolarHBondContact OD1-CB 3.46Å; D1000-Y1012 PolarHBondContact OD1-N 3.02Å; D1000-R1040 CarbonylContact O-C 3.36Å; D1000-R1040 WeakPolarHBondContact O-CA 3.38Å; D1000-R1040 WeakPolarHBondContact O-CG 3.39Å; D1000-R1040 IonicContact OD2-CZ 2.95Å; D1000-R1040 IonicContact OD2-NH1 3.73Å; D1000-R1040 PolarHBondContact OD2-NH1 3.04Å; D1000-R1040 IonicContact OD2-NH2 2.68Å; D1000-R1040 PolarHBondContact OD2-NH2 3.21Å; D1000-L1041 PolarHBondContact O-N 3.26Å
1001	A	91.6	Very high	91.2	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	139.2	173.8	0	0	0	0	0	112.4	V1009 F1010 Y1012 L1015 H1039	A1001-V1009 CarbonylContact O-C 3.58Å; A1001-V1009 WeakPolarHBondContact O-CA 3.46Å; A1001-V1009 VanDerWaalsContact O-CG1 3.23Å; A1001-V1009 WeakPolarHBondContact O-CG1 3.23Å; A1001-F1010 PolarHBondContact N-O 2.91Å; A1001-F1010 PolarHBondContact O-N 3.14Å; A1001-Y1012 VanDerWaalsContact CB-CA 3.45Å; A1001-Y1012 HydrophobicContact CB-CD2 3.87Å; A1001-Y1012 HydrophobicContact CB-CG 4.34Å; A1001-L1015 HydrophobicContact CB-CD1 3.8Å; A1001-H1039 CarbonylContact C-O 3.55Å; A1001-H1039 WeakPolarHBondContact CA-O 3.42Å
1002	V	93.8	Very high	91.3	Very high	21 Å²	21	64.4 Å²	64.4	13%	0.127	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	141.3	-179.6	64	0	0	0	0	111.1	F1007 V1009 Y1038 H1039 L1041	V1002-F1007 HydrophobicContact CG2-CD1 4.48Å; V1002-V1009 HydrophobicContact CB-CG2 4.36Å; V1002-V1009 HydrophobicContact CG2-CG2 4.16Å; V1002-Y1038 WeakPolarHBondContact O-CA 3.38Å; V1002-H1039 PolarHBondContact N-O 3.49Å; V1002-H1039 PolarHBondContact O-N 2.7Å; V1002-L1041 HydrophobicContact CB-CD1 3.96Å; V1002-L1041 HydrophobicContact CB-CD2 4.32Å; V1002-L1041 HydrophobicContact CB-CG 4.08Å; V1002-L1041 HydrophobicContact CG1-CD1 4.3Å; V1002-L1041 HydrophobicContact CG1-CD2 3.74Å; V1002-L1041 HydrophobicContact CG1-CG 3.91Å
1003	L	93.2	Very high	91.5	Very high	1 Å²	1	64.3 Å²	64.3	1%	0.005	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	109.9	165.7	-74.5	171.6	0	0	0	109.9	K1005 C1006 F1007 H1008 F1010 L1015 C1026 F1033 D1037	L1003-K1005 PolarHBondContact O-N 3.04Å; L1003-K1005 VanDerWaalsContact O-N 3.14Å; L1003-C1006 PolarHBondContact O-N 2.92Å; L1003-C1006 VanDerWaalsContact O-N 3.14Å; L1003-F1007 VanDerWaalsContact O-CA 3.31Å; L1003-F1007 WeakPolarHBondContact O-CA 3.26Å; L1003-F1007 PolarHBondContact O-N 3.3Å; L1003-H1008 PolarHBondContact N-O 3.03Å; L1003-F1010 HydrophobicContact CD1-CD2 4.39Å; L1003-F1010 HydrophobicContact CD1-CE2 4.01Å; L1003-L1015 HydrophobicContact CD1-CD2 3.77Å; L1003-L1015 HydrophobicContact CD2-CD1 4.25Å; L1003-L1015 HydrophobicContact CD2-CD2 4.07Å; L1003-L1015 HydrophobicContact CG-CD1 3.97Å; L1003-L1015 HydrophobicContact CG-CD2 3.83Å; L1003-C1026 HydrophobicContact CD1-CB 3.64Å; L1003-F1033 HydrophobicContact CD1-CD1 4.1Å; L1003-F1033 HydrophobicContact CD1-CE1 4.37Å; L1003-F1033 HydrophobicContact CD1-CG 4.5Å; L1003-F1033 HydrophobicContact CD2-CB 3.75Å; L1003-F1033 HydrophobicContact CD2-CD1 3.77Å; L1003-F1033 HydrophobicContact CD2-CD2 3.46Å; L1003-F1033 VanDerWaalsContact CD2-CD2 3.46Å; L1003-F1033 HydrophobicContact CD2-CE1 4.19Å; L1003-F1033 HydrophobicContact CD2-CE2 3.91Å; L1003-F1033 HydrophobicContact CD2-CG 3.38Å; L1003-F1033 HydrophobicContact CD2-CZ 4.26Å; L1003-D1037 CarbonylContact C-O 3.54Å; L1003-D1037 VanDerWaalsContact CA-O 3.27Å; L1003-D1037 WeakPolarHBondContact CA-O 3.49Å
1004	S	91.2	Very high	91.9	Very high	39 Å²	39	63.2 Å²	63.2	27%	0.273	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-28.3	-174.6	54.3	0	0	0	0	113.7	F1007 D1037	S1004-F1007 WeakPolarHBondContact O-CZ 3.43Å; S1004-D1037 PolarHBondContact N-O 3.21Å; S1004-D1037 WeakPolarHBondContact OG-CA 3.46Å; S1004-D1037 PolarHBondContact OG-O 2.9Å
1005	K	88.9	Confident	91.9	Very high	129 Å²	129	61.1 Å²	61.1	56%	0.561	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-26.5	178.5	-75.9	-177.1	171.9	162.9	0	115.3	L1003 D1037	L1003-K1005 PolarHBondContact O-N 3.04Å; L1003-K1005 VanDerWaalsContact O-N 3.14Å; K1005-D1037 HydrophobicContact CD-CB 4.42Å; K1005-D1037 WeakPolarHBondContact CD-OD2 3.48Å; K1005-D1037 VanDerWaalsContact CE-CG 3.44Å; K1005-D1037 WeakPolarHBondContact CE-OD1 3.34Å; K1005-D1037 WeakPolarHBondContact CE-OD2 3.43Å; K1005-D1037 HydrophobicContact CG-CB 4.49Å; K1005-D1037 IonicContact NZ-OD1 3.21Å; K1005-D1037 IonicContact NZ-OD2 2.7Å; K1005-D1037 PolarHBondContact NZ-OD2 2.99Å
1006	C	93.4	Very high	92.1	Very high	24 Å²	24	58.5 Å²	58.5	16%	0.162	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.7	3	-175.3	64.5	0	0	0	0	114	L1003 H1008 C1029 C1031	L1003-C1006 PolarHBondContact O-N 2.92Å; L1003-C1006 VanDerWaalsContact O-N 3.14Å; C1006-H1008 PolarHBondContact O-N 3.27Å; C1006-H1008 PolarHBondContact O-ND1 3.35Å; C1006-C1029 WeakPolarHBondContact CB-SG 3.47Å; C1006-C1031 HydrophobicContact CB-CB 4.4Å
1007	F	91.7	Very high	92.2	Very high	161 Å²	161	56.5 Å²	56.5	71%	0.706	26%	0.264	S	S	*	.			trans	50.9	19.2	-178.1	-60.8	-76.4	0	0	0	115.2	V1002 L1003 S1004	V1002-F1007 HydrophobicContact CG2-CD1 4.48Å; L1003-F1007 VanDerWaalsContact O-CA 3.31Å; L1003-F1007 WeakPolarHBondContact O-CA 3.26Å; L1003-F1007 PolarHBondContact O-N 3.3Å; S1004-F1007 WeakPolarHBondContact O-CZ 3.43Å
1008	H	93.3	Very high	92.3	Very high	45 Å²	45	55 Å²	55	21%	0.208	26%	0.255	C	S	.	.			trans	-80.8	130.6	174.8	-70.3	128.8	0	0	0	110.4	L1003 C1006 F1010 C1029	L1003-H1008 PolarHBondContact N-O 3.03Å; C1006-H1008 PolarHBondContact O-N 3.27Å; C1006-H1008 PolarHBondContact O-ND1 3.35Å; H1008-F1010 HydrophobicContact CB-CD2 4.48Å; H1008-F1010 HydrophobicContact CB-CE2 3.53Å; H1008-F1010 HydrophobicContact CB-CZ 3.94Å; H1008-C1029 PolarHBondContact ND1-SG 3.19Å
1009	V	92.9	Very high	92.2	Very high	44 Å²	44	47.9 Å²	47.9	27%	0.267	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	129.6	-173.5	-161.3	0	0	0	0	110.4	K999 A1001 V1002 L1041	K999-V1009 HydrophobicContact CB-CB 4.36Å; K999-V1009 HydrophobicContact CB-CG1 3.72Å; K999-V1009 HydrophobicContact CD-CB 4.31Å; K999-V1009 HydrophobicContact CG-CB 4.48Å; K999-V1009 HydrophobicContact CG-CG1 4.33Å; A1001-V1009 CarbonylContact O-C 3.58Å; A1001-V1009 WeakPolarHBondContact O-CA 3.46Å; A1001-V1009 VanDerWaalsContact O-CG1 3.23Å; A1001-V1009 WeakPolarHBondContact O-CG1 3.23Å; V1002-V1009 HydrophobicContact CB-CG2 4.36Å; V1002-V1009 HydrophobicContact CG2-CG2 4.16Å; V1009-L1041 HydrophobicContact CG1-CD1 3.58Å; V1009-L1041 HydrophobicContact CG2-CD1 4.34Å
1010	F	93.7	Very high	92.3	Very high	2 Å²	2	50.8 Å²	50.8	1%	0.009	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	-174.9	178.9	-56.4	-85	0	0	0	108.7	P992 K999 D1000 A1001 L1003 H1008 L1015 P1027 K1028	P992-F1010 HydrophobicContact CB-CD1 4.44Å; P992-F1010 HydrophobicContact CB-CE1 4.26Å; P992-F1010 HydrophobicContact CG-CD1 4.32Å; P992-F1010 HydrophobicContact CG-CE1 4.29Å; K999-F1010 CarbonylContact C-O 3.56Å; K999-F1010 WeakPolarHBondContact CA-O 3.49Å; D1000-F1010 PolarHBondContact N-O 2.93Å; A1001-F1010 PolarHBondContact N-O 2.91Å; A1001-F1010 PolarHBondContact O-N 3.14Å; L1003-F1010 HydrophobicContact CD1-CD2 4.39Å; L1003-F1010 HydrophobicContact CD1-CE2 4.01Å; H1008-F1010 HydrophobicContact CB-CD2 4.48Å; H1008-F1010 HydrophobicContact CB-CE2 3.53Å; H1008-F1010 HydrophobicContact CB-CZ 3.94Å; F1010-L1015 HydrophobicContact CB-CD1 4.31Å; F1010-L1015 HydrophobicContact CB-CD2 4.28Å; F1010-L1015 HydrophobicContact CB-CG 4Å; F1010-L1015 HydrophobicContact CD2-CD1 4.26Å; F1010-L1015 HydrophobicContact CD2-CD2 3.71Å; F1010-L1015 HydrophobicContact CD2-CG 4.2Å; F1010-L1015 HydrophobicContact CE2-CD2 4.38Å; F1010-L1015 HydrophobicContact CG-CD2 4.2Å; F1010-L1015 HydrophobicContact CG-CG 4.45Å; F1010-P1027 HydrophobicContact CD1-CG 4.15Å; F1010-P1027 HydrophobicContact CE1-CB 3.74Å; F1010-P1027 HydrophobicContact CE1-CG 3.72Å; F1010-P1027 HydrophobicContact CE2-CG 4.29Å; F1010-P1027 HydrophobicContact CZ-CB 3.92Å; F1010-P1027 HydrophobicContact CZ-CG 3.79Å; F1010-K1028 HydrophobicContact CE1-CB 4.43Å; F1010-K1028 HydrophobicContact CZ-CB 3.82Å
1011	C	93.6	Very high	92.3	Very high	1 Å²	1	53 Å²	53	1%	0.007	26%	0.258	C	S	.	.			trans	-82.3	147.5	164.4	70.8	0	0	0	0	110.5	C991 C994 K997 R998 D1000 D1013 C1014 L1015	C991-C1011 HydrophobicContact CB-CB 3.87Å; C991-C1011 PolarHBondContact SG-N 3.18Å; C991-C1011 VanDerWaalsContact SG-SG 3.63Å; C994-C1011 VanDerWaalsContact SG-SG 3.68Å; K997-C1011 HydrophobicContact CB-CB 3.75Å; R998-C1011 VanDerWaalsContact O-CB 3.26Å; R998-C1011 WeakPolarHBondContact O-CB 3.41Å; D1000-C1011 WeakPolarHBondContact OD1-CA 3.38Å; D1000-C1011 WeakPolarHBondContact OD1-CB 3.46Å; C1011-D1013 PolarHBondContact O-N 3.02Å; C1011-C1014 PolarHBondContact O-N 3.32Å; C1011-C1014 VanDerWaalsContact O-N 3.14Å; C1011-C1014 PolarHBondContact SG-N 3.4Å; C1011-C1014 PolarHBondContact SG-SG 3.38Å; C1011-L1015 PolarHBondContact O-N 2.91Å
1012	Y	92.7	Very high	92.2	Very high	61 Å²	61	63.3 Å²	63.3	24%	0.239	30%	0.297	C	S	.	.	H	α-helix	trans	-55.3	-40.7	-179.2	-170.5	-96.6	0	0	0	111.4	D1000 A1001 C1014 L1015 R1016 Y1038 R1040	D1000-Y1012 PolarHBondContact OD1-N 3.02Å; A1001-Y1012 VanDerWaalsContact CB-CA 3.45Å; A1001-Y1012 HydrophobicContact CB-CD2 3.87Å; A1001-Y1012 HydrophobicContact CB-CG 4.34Å; Y1012-C1014 PolarHBondContact O-N 3.47Å; Y1012-L1015 PolarHBondContact O-N 3.28Å; Y1012-R1016 HydrophobicContact CE1-CB 4.43Å; Y1012-R1016 VanDerWaalsContact O-CB 3.25Å; Y1012-R1016 WeakPolarHBondContact O-CB 3.46Å; Y1012-R1016 PolarHBondContact O-N 3.46Å; Y1012-Y1038 HydrophobicContact CE2-CD2 4.08Å; Y1012-Y1038 HydrophobicContact CE2-CE2 4.13Å; Y1012-R1040 HydrophobicContact CD2-CB 3.93Å; Y1012-R1040 HydrophobicContact CD2-CG 4.1Å; Y1012-R1040 HydrophobicContact CE2-CB 4.16Å; Y1012-R1040 HydrophobicContact CG-CG 4.5Å
1013	D	93.7	Very high	92	Very high	59 Å²	59	68 Å²	68	32%	0.316	32%	0.317	S	S	.	.	H	α-helix	trans	-62.2	-43.6	179.3	-59.8	-34.8	0	0	0	112	K997 C1011 L1015 R1016 T1017	K997-D1013 WeakPolarHBondContact CD-OD2 3.43Å; K997-D1013 WeakPolarHBondContact CE-OD2 3.38Å; K997-D1013 IonicContact NZ-OD2 2.59Å; K997-D1013 PolarHBondContact NZ-OD2 3.19Å; C1011-D1013 PolarHBondContact O-N 3.02Å; D1013-L1015 PolarHBondContact O-N 3Å; D1013-R1016 PolarHBondContact O-N 3.25Å; D1013-T1017 WeakPolarHBondContact O-CB 3.32Å; D1013-T1017 PolarHBondContact O-N 3.38Å; D1013-T1017 PolarHBondContact O-OG1 3.12Å
1014	C	93.6	Very high	91.9	Very high	26 Å²	26	72.9 Å²	72.9	18%	0.176	34%	0.336	C	S	.	.	H	α-helix	trans	-64.7	-39.3	177.9	-77.8	0	0	0	0	112.5	C1011 Y1012 R1018	C1011-C1014 PolarHBondContact O-N 3.32Å; C1011-C1014 VanDerWaalsContact O-N 3.14Å; C1011-C1014 PolarHBondContact SG-N 3.4Å; C1011-C1014 PolarHBondContact SG-SG 3.38Å; Y1012-C1014 PolarHBondContact O-N 3.47Å; C1014-R1018 PolarHBondContact O-N 3.05Å; C1014-R1018 VanDerWaalsContact O-N 3.16Å
1015	L	91	Very high	91.9	Very high	0 Å²	0	76.3 Å²	76.3	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-69.4	-43.7	177	-70	-179.6	0	0	0	111.5	A1001 L1003 F1010 C1011 Y1012 D1013 R1018 Y1019 F1033 Y1038	A1001-L1015 HydrophobicContact CB-CD1 3.8Å; L1003-L1015 HydrophobicContact CD1-CD2 3.77Å; L1003-L1015 HydrophobicContact CD2-CD1 4.25Å; L1003-L1015 HydrophobicContact CD2-CD2 4.07Å; L1003-L1015 HydrophobicContact CG-CD1 3.97Å; L1003-L1015 HydrophobicContact CG-CD2 3.83Å; F1010-L1015 HydrophobicContact CB-CD1 4.31Å; F1010-L1015 HydrophobicContact CB-CD2 4.28Å; F1010-L1015 HydrophobicContact CB-CG 4Å; F1010-L1015 HydrophobicContact CD2-CD1 4.26Å; F1010-L1015 HydrophobicContact CD2-CD2 3.71Å; F1010-L1015 HydrophobicContact CD2-CG 4.2Å; F1010-L1015 HydrophobicContact CE2-CD2 4.38Å; F1010-L1015 HydrophobicContact CG-CD2 4.2Å; F1010-L1015 HydrophobicContact CG-CG 4.45Å; C1011-L1015 PolarHBondContact O-N 2.91Å; Y1012-L1015 PolarHBondContact O-N 3.28Å; D1013-L1015 PolarHBondContact O-N 3Å; L1015-R1018 PolarHBondContact O-N 3.48Å; L1015-Y1019 WeakPolarHBondContact O-CB 3.41Å; L1015-Y1019 PolarHBondContact O-N 3.01Å; L1015-F1033 HydrophobicContact CD2-CZ 4.36Å; L1015-Y1038 HydrophobicContact CB-CD2 4.3Å; L1015-Y1038 HydrophobicContact CB-CG 4.49Å
1016	R	91.3	Very high	92.1	Very high	116 Å²	116	70.2 Å²	70.2	44%	0.438	32%	0.319	S	S	.	.	H	α-helix	trans	-60.7	-50	176.6	-179.2	179	173	175.8	1	111.6	Y1012 D1013 R1018 Y1019 E1020	Y1012-R1016 HydrophobicContact CE1-CB 4.43Å; Y1012-R1016 VanDerWaalsContact O-CB 3.25Å; Y1012-R1016 WeakPolarHBondContact O-CB 3.46Å; Y1012-R1016 PolarHBondContact O-N 3.46Å; D1013-R1016 PolarHBondContact O-N 3.25Å; R1016-R1018 VanDerWaalsContact C-N 3.32Å; R1016-R1018 PolarHBondContact O-N 2.98Å; R1016-Y1019 WeakPolarHBondContact O-CB 3.4Å; R1016-Y1019 PolarHBondContact O-N 3.44Å; R1016-E1020 HydrophobicContact CG-CG 4.4Å; R1016-E1020 IonicContact CZ-OE1 3.84Å; R1016-E1020 IonicContact NE-OE1 3.88Å; R1016-E1020 PolarHBondContact NE-OE1 3.26Å; R1016-E1020 IonicContact NH2-OE1 2.66Å; R1016-E1020 PolarHBondContact NH2-OE1 3.29Å; R1016-E1020 WeakPolarHBondContact O-CG 3.49Å; R1016-E1020 PolarHBondContact O-N 2.99Å
1017	T	92.7	Very high	91.9	Very high	77 Å²	77	71 Å²	71	47%	0.472	32%	0.324	S	S	.	.	H	α-helix	trans	-59.3	-41.9	177.5	-58.2	0	0	0	0	111.4	D1013 Y1019 E1020 T1021	D1013-T1017 WeakPolarHBondContact O-CB 3.32Å; D1013-T1017 PolarHBondContact O-N 3.38Å; D1013-T1017 PolarHBondContact O-OG1 3.12Å; T1017-Y1019 VanDerWaalsContact C-N 3.31Å; T1017-Y1019 PolarHBondContact O-N 3.37Å; T1017-E1020 PolarHBondContact O-N 3.04Å; T1017-T1021 HydrophobicContact CG2-CG2 4.17Å; T1017-T1021 WeakPolarHBondContact O-CB 3.38Å; T1017-T1021 VanDerWaalsContact O-CG2 3.29Å; T1017-T1021 WeakPolarHBondContact O-CG2 3.47Å; T1017-T1021 PolarHBondContact O-N 2.7Å; T1017-T1021 PolarHBondContact O-OG1 3.16Å
1018	R	91.4	Very high	91.8	Very high	70 Å²	70	70.4 Å²	70.4	26%	0.264	32%	0.321	S	S	.	.	H	α-helix	trans	-63.7	-36.8	174.7	-87.4	-158.3	177.4	-162.9	1.9	112.7	C1014 L1015 R1016 T1021 R1022 Q1023 K1025 P1027 F1033	C1014-R1018 PolarHBondContact O-N 3.05Å; C1014-R1018 VanDerWaalsContact O-N 3.16Å; L1015-R1018 PolarHBondContact O-N 3.48Å; R1016-R1018 VanDerWaalsContact C-N 3.32Å; R1016-R1018 PolarHBondContact O-N 2.98Å; R1018-T1021 WeakPolarHBondContact CA-OG1 3.4Å; R1018-T1021 PolarHBondContact O-OG1 2.97Å; R1018-R1022 PolarHBondContact O-N 3.41Å; R1018-Q1023 HydrophobicContact CG-CB 4.37Å; R1018-Q1023 CarbonylContact O-C 3.46Å; R1018-Q1023 WeakPolarHBondContact O-CA 3.22Å; R1018-Q1023 PolarHBondContact O-N 3.21Å; R1018-K1025 PolarHBondContact NH1-O 3.41Å; R1018-P1027 VanDerWaalsContact NH1-CA 3.25Å; R1018-F1033 HydrophobicContact CB-CZ 4.35Å
1019	Y	89.4	Confident	91.8	Very high	46 Å²	46	70.6 Å²	70.6	18%	0.18	33%	0.327	C	S	.	.	H	α-helix	trans	-67.7	-44.9	177.8	-177.3	-94.4	0	0	0	112.1	L1015 R1016 T1017 R1022 R1024 F1033 A1035 Y1038	L1015-Y1019 WeakPolarHBondContact O-CB 3.41Å; L1015-Y1019 PolarHBondContact O-N 3.01Å; R1016-Y1019 WeakPolarHBondContact O-CB 3.4Å; R1016-Y1019 PolarHBondContact O-N 3.44Å; T1017-Y1019 VanDerWaalsContact C-N 3.31Å; T1017-Y1019 PolarHBondContact O-N 3.37Å; Y1019-R1022 PolarHBondContact O-N 3.07Å; Y1019-R1024 HydrophobicContact CD2-CG 4.05Å; Y1019-R1024 HydrophobicContact CE2-CG 4.46Å; Y1019-R1024 VanDerWaalsContact CE2-CZ 3.46Å; Y1019-R1024 VanDerWaalsContact CZ-CZ 3.47Å; Y1019-R1024 VanDerWaalsContact CZ-NH2 3.35Å; Y1019-R1024 PolarHBondContact O-NE 3.28Å; Y1019-R1024 PolarHBondContact OH-NH1 3.36Å; Y1019-R1024 PolarHBondContact OH-NH2 3.34Å; Y1019-F1033 HydrophobicContact CD2-CE2 4.28Å; Y1019-A1035 HydrophobicContact CE2-CB 4.09Å; Y1019-A1035 VanDerWaalsContact CE2-N 3.34Å; Y1019-A1035 WeakPolarHBondContact OH-CB 3.47Å; Y1019-Y1038 HydrophobicContact CD1-CE1 4.3Å; Y1019-Y1038 AromaticContact CD2-CE1 3.83Å; Y1019-Y1038 HydrophobicContact CD2-CE1 3.83Å; Y1019-Y1038 HydrophobicContact CE2-CE1 4.43Å; Y1019-Y1038 AromaticContact CG-CE1 3.78Å; Y1019-Y1038 HydrophobicContact CG-CE1 3.78Å
1020	E	92.7	Very high	91.6	Very high	114 Å²	114	73.4 Å²	73.4	53%	0.533	34%	0.341	S	S	.	.	H	α-helix	trans	-67.7	-40.8	178.9	-71.5	172.9	173.4	0	0	112.2	R1016 T1017 R1022	R1016-E1020 HydrophobicContact CG-CG 4.4Å; R1016-E1020 IonicContact CZ-OE1 3.84Å; R1016-E1020 IonicContact NE-OE1 3.88Å; R1016-E1020 PolarHBondContact NE-OE1 3.26Å; R1016-E1020 IonicContact NH2-OE1 2.66Å; R1016-E1020 PolarHBondContact NH2-OE1 3.29Å; R1016-E1020 WeakPolarHBondContact O-CG 3.49Å; R1016-E1020 PolarHBondContact O-N 2.99Å; T1017-E1020 PolarHBondContact O-N 3.04Å; E1020-R1022 PolarHBondContact O-N 3.5Å; E1020-R1022 VanDerWaalsContact O-N 3.14Å
1021	T	92.9	Very high	91.5	Very high	77 Å²	77	76.2 Å²	76.2	47%	0.472	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	9.1	176.4	57.2	0	0	0	0	113.9	T1017 R1018 Q1023	T1017-T1021 HydrophobicContact CG2-CG2 4.17Å; T1017-T1021 WeakPolarHBondContact O-CB 3.38Å; T1017-T1021 VanDerWaalsContact O-CG2 3.29Å; T1017-T1021 WeakPolarHBondContact O-CG2 3.47Å; T1017-T1021 PolarHBondContact O-N 2.7Å; T1017-T1021 PolarHBondContact O-OG1 3.16Å; R1018-T1021 WeakPolarHBondContact CA-OG1 3.4Å; R1018-T1021 PolarHBondContact O-OG1 2.97Å; T1021-Q1023 PolarHBondContact O-N 3.39Å; T1021-Q1023 VanDerWaalsContact O-N 3.14Å
1022	R	88.7	Confident	91.3	Very high	216 Å²	216	79.2 Å²	79.2	82%	0.815	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.4	12.7	-178.1	-54.6	-174.9	175.1	-151.2	-0.3	114.9	R1018 Y1019 E1020 R1024	R1018-R1022 PolarHBondContact O-N 3.41Å; Y1019-R1022 PolarHBondContact O-N 3.07Å; E1020-R1022 PolarHBondContact O-N 3.5Å; E1020-R1022 VanDerWaalsContact O-N 3.14Å; R1022-R1024 PolarHBondContact O-N 3.35Å
1023	Q	89.9	Confident	91.3	Very high	119 Å²	119	76.8 Å²	76.8	56%	0.556	38%	0.375	S	S	*	.			trans	-85.9	57.7	173.9	-62.5	-176.5	5.1	0	0	111.5	R1018 T1021 K1025	R1018-Q1023 HydrophobicContact CG-CB 4.37Å; R1018-Q1023 CarbonylContact O-C 3.46Å; R1018-Q1023 WeakPolarHBondContact O-CA 3.22Å; R1018-Q1023 PolarHBondContact O-N 3.21Å; T1021-Q1023 PolarHBondContact O-N 3.39Å; T1021-Q1023 VanDerWaalsContact O-N 3.14Å; Q1023-K1025 PolarHBondContact O-N 3.03Å
1024	R	91.8	Very high	91.1	Very high	105 Å²	105	75.1 Å²	75.1	40%	0.396	37%	0.372	S	S	.	.			trans	-77.3	48.4	-167.8	-66	-179.8	-177.1	-170.4	-0.5	114.8	Y1019 R1022 A1032 F1033	Y1019-R1024 HydrophobicContact CD2-CG 4.05Å; Y1019-R1024 HydrophobicContact CE2-CG 4.46Å; Y1019-R1024 VanDerWaalsContact CE2-CZ 3.46Å; Y1019-R1024 VanDerWaalsContact CZ-CZ 3.47Å; Y1019-R1024 VanDerWaalsContact CZ-NH2 3.35Å; Y1019-R1024 PolarHBondContact O-NE 3.28Å; Y1019-R1024 PolarHBondContact OH-NH1 3.36Å; Y1019-R1024 PolarHBondContact OH-NH2 3.34Å; R1022-R1024 PolarHBondContact O-N 3.35Å; R1024-A1032 WeakPolarHBondContact O-CA 3.35Å; R1024-F1033 WeakPolarHBondContact CB-O 3.37Å; R1024-F1033 PolarHBondContact O-N 3.16Å
1025	K	91.8	Very high	90.8	Very high	110 Å²	110	76.1 Å²	76.1	48%	0.478	38%	0.383	S	S	.	.	B	Isolated β-bridge	trans	-129.9	141	174.8	-63.3	-169.8	179.5	-160.9	0	111.3	R1018 Q1023 N1030 C1031	R1018-K1025 PolarHBondContact NH1-O 3.41Å; Q1023-K1025 PolarHBondContact O-N 3.03Å; K1025-N1030 WeakPolarHBondContact CB-OD1 3.31Å; K1025-N1030 WeakPolarHBondContact CD-OD1 3.44Å; K1025-C1031 CarbonylContact C-O 3.6Å; K1025-C1031 WeakPolarHBondContact CA-O 3.18Å
1026	C	92.8	Very high	90.7	Very high	1 Å²	1	82.5 Å²	82.5	1%	0.007	42%	0.417	C	S	.	.			trans	-58.4	129.7	179.4	176.7	0	0	0	0	111	L1003 K1028 N1030 C1031	L1003-C1026 HydrophobicContact CD1-CB 3.64Å; C1026-K1028 PolarHBondContact O-N 3.45Å; C1026-K1028 PolarHBondContact SG-N 2.96Å; C1026-K1028 VanDerWaalsContact SG-N 3.44Å; C1026-N1030 WeakPolarHBondContact O-CA 3.36Å; C1026-N1030 PolarHBondContact O-N 2.97Å; C1026-C1031 HydrophobicContact CB-CB 4.46Å; C1026-C1031 WeakPolarHBondContact CB-O 3.42Å; C1026-C1031 PolarHBondContact N-O 3.43Å
1027	P	89.2	Confident	90.7	Very high	42 Å²	42	78.2 Å²	78.2	27%	0.273	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-27.7	177.8	-19.7	26	0	0	0	115	S993 F1010 R1018	S993-P1027 WeakPolarHBondContact OG-CB 3.29Å; S993-P1027 VanDerWaalsContact OG-CG 3.26Å; S993-P1027 WeakPolarHBondContact OG-CG 3.35Å; F1010-P1027 HydrophobicContact CD1-CG 4.15Å; F1010-P1027 HydrophobicContact CE1-CB 3.74Å; F1010-P1027 HydrophobicContact CE1-CG 3.72Å; F1010-P1027 HydrophobicContact CE2-CG 4.29Å; F1010-P1027 HydrophobicContact CZ-CB 3.92Å; F1010-P1027 HydrophobicContact CZ-CG 3.79Å; R1018-P1027 VanDerWaalsContact NH1-CA 3.25Å
1028	K	89	Confident	90.5	Very high	147 Å²	147	76 Å²	76	64%	0.639	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-45.2	-172.5	-166.8	171.8	176.3	-149.1	0	113.3	F1010 C1026	F1010-K1028 HydrophobicContact CE1-CB 4.43Å; F1010-K1028 HydrophobicContact CZ-CB 3.82Å; C1026-K1028 PolarHBondContact O-N 3.45Å; C1026-K1028 PolarHBondContact SG-N 2.96Å; C1026-K1028 VanDerWaalsContact SG-N 3.44Å
1029	C	93.6	Very high	90.4	Very high	49 Å²	49	77.4 Å²	77.4	33%	0.331	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.8	2.2	-177.3	64.3	0	0	0	0	114.3	C1006 H1008 C1031	C1006-C1029 WeakPolarHBondContact CB-SG 3.47Å; H1008-C1029 PolarHBondContact ND1-SG 3.19Å; C1029-C1031 PolarHBondContact O-N 3.08Å; C1029-C1031 PolarHBondContact SG-SG 3.47Å
1030	N	89.1	Confident	90.5	Very high	104 Å²	104	80 Å²	80	56%	0.556	40%	0.404	S	S	*	.			trans	61.5	7.9	178.5	-137	12.1	0	0	0	115.9	K1025 C1026 A1032	K1025-N1030 WeakPolarHBondContact CB-OD1 3.31Å; K1025-N1030 WeakPolarHBondContact CD-OD1 3.44Å; C1026-N1030 WeakPolarHBondContact O-CA 3.36Å; C1026-N1030 PolarHBondContact O-N 2.97Å; N1030-A1032 PolarHBondContact O-N 3.08Å
1031	C	89.8	Confident	90.2	Very high	60 Å²	60	77.8 Å²	77.8	41%	0.405	40%	0.396	S	S	.	.			trans	-60.4	131.8	172.7	-67.2	0	0	0	0	110.8	C1006 K1025 C1026 C1029	C1006-C1031 HydrophobicContact CB-CB 4.4Å; K1025-C1031 CarbonylContact C-O 3.6Å; K1025-C1031 WeakPolarHBondContact CA-O 3.18Å; C1026-C1031 HydrophobicContact CB-CB 4.46Å; C1026-C1031 WeakPolarHBondContact CB-O 3.42Å; C1026-C1031 PolarHBondContact N-O 3.43Å; C1029-C1031 PolarHBondContact O-N 3.08Å; C1029-C1031 PolarHBondContact SG-SG 3.47Å
1032	A	90.9	Very high	89.6	Confident	64 Å²	64	83.6 Å²	83.6	53%	0.529	41%	0.41	S	S	.	.	B	Isolated β-bridge	trans	-67.9	142.1	176.8	0	0	0	0	0	111.3	R1024 N1030	R1024-A1032 WeakPolarHBondContact O-CA 3.35Å; N1030-A1032 PolarHBondContact O-N 3.08Å
1033	F	92.8	Very high	88.6	Confident	10 Å²	10	79.5 Å²	79.5	4%	0.044	40%	0.404	C	S	.	.			trans	-139.1	144.3	179.3	74.7	-91.7	0	0	0	111.8	L1003 L1015 R1018 Y1019 R1024 D1037 Y1038	L1003-F1033 HydrophobicContact CD1-CD1 4.1Å; L1003-F1033 HydrophobicContact CD1-CE1 4.37Å; L1003-F1033 HydrophobicContact CD1-CG 4.5Å; L1003-F1033 HydrophobicContact CD2-CB 3.75Å; L1003-F1033 HydrophobicContact CD2-CD1 3.77Å; L1003-F1033 HydrophobicContact CD2-CD2 3.46Å; L1003-F1033 VanDerWaalsContact CD2-CD2 3.46Å; L1003-F1033 HydrophobicContact CD2-CE1 4.19Å; L1003-F1033 HydrophobicContact CD2-CE2 3.91Å; L1003-F1033 HydrophobicContact CD2-CG 3.38Å; L1003-F1033 HydrophobicContact CD2-CZ 4.26Å; L1015-F1033 HydrophobicContact CD2-CZ 4.36Å; R1018-F1033 HydrophobicContact CB-CZ 4.35Å; Y1019-F1033 HydrophobicContact CD2-CE2 4.28Å; R1024-F1033 WeakPolarHBondContact CB-O 3.37Å; R1024-F1033 PolarHBondContact O-N 3.16Å; F1033-D1037 WeakPolarHBondContact CA-OD2 3.36Å; F1033-D1037 HydrophobicContact CB-CB 3.83Å; F1033-Y1038 AromaticContact CD2-CD1 3.96Å; F1033-Y1038 HydrophobicContact CD2-CD1 3.96Å; F1033-Y1038 AromaticContact CE2-CD1 3.83Å; F1033-Y1038 HydrophobicContact CE2-CD1 3.83Å; F1033-Y1038 HydrophobicContact CE2-CE1 4.4Å; F1033-Y1038 HydrophobicContact CE2-CG 4.4Å
1034	G	89.6	Confident	87	Confident	24 Å²	24	86.6 Å²	86.6	25%	0.247	44%	0.437	C	S	.	.			trans	-103.3	-170.9	179.9	0	0	0	0	0	113.5	N1036 D1037 Y1038	G1034-N1036 VanDerWaalsContact C-N 3.28Å; G1034-N1036 PolarHBondContact O-N 3.32Å; G1034-D1037 PolarHBondContact N-OD2 3.06Å; G1034-D1037 PolarHBondContact O-N 3.3Å; G1034-Y1038 WeakPolarHBondContact O-CD1 3.47Å
1035	A	87.1	Confident	86.7	Confident	48 Å²	48	85.7 Å²	85.7	40%	0.397	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-60	-39.5	-177	0	0	0	0	0	112.6	Y1019 D1037 Y1038	Y1019-A1035 HydrophobicContact CE2-CB 4.09Å; Y1019-A1035 VanDerWaalsContact CE2-N 3.34Å; Y1019-A1035 WeakPolarHBondContact OH-CB 3.47Å; A1035-D1037 VanDerWaalsContact C-N 3.3Å; A1035-D1037 PolarHBondContact O-N 3.48Å; A1035-Y1038 WeakPolarHBondContact O-CE1 3.4Å
1036	N	87.9	Confident	86.5	Confident	134 Å²	134	84.4 Å²	84.4	72%	0.717	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-88.8	4.2	-175.8	-60.6	-15.6	0	0	0	112.8	G1034 H1039	G1034-N1036 VanDerWaalsContact C-N 3.28Å; G1034-N1036 PolarHBondContact O-N 3.32Å; N1036-H1039 PolarHBondContact O-CE1 3.39Å; N1036-H1039 PolarHBondContact O-NE2 3.26Å
1037	D	90.8	Very high	86.1	Confident	25 Å²	25	89.1 Å²	89.1	13%	0.134	46%	0.461	C	S	.	.	G	3₁₀ helix	trans	-101.7	-2.5	-172.7	-65.7	-31.1	0	0	0	113.4	L1003 S1004 K1005 F1033 G1034 A1035	L1003-D1037 CarbonylContact C-O 3.54Å; L1003-D1037 VanDerWaalsContact CA-O 3.27Å; L1003-D1037 WeakPolarHBondContact CA-O 3.49Å; S1004-D1037 PolarHBondContact N-O 3.21Å; S1004-D1037 WeakPolarHBondContact OG-CA 3.46Å; S1004-D1037 PolarHBondContact OG-O 2.9Å; K1005-D1037 HydrophobicContact CD-CB 4.42Å; K1005-D1037 WeakPolarHBondContact CD-OD2 3.48Å; K1005-D1037 VanDerWaalsContact CE-CG 3.44Å; K1005-D1037 WeakPolarHBondContact CE-OD1 3.34Å; K1005-D1037 WeakPolarHBondContact CE-OD2 3.43Å; K1005-D1037 HydrophobicContact CG-CB 4.49Å; K1005-D1037 IonicContact NZ-OD1 3.21Å; K1005-D1037 IonicContact NZ-OD2 2.7Å; K1005-D1037 PolarHBondContact NZ-OD2 2.99Å; F1033-D1037 WeakPolarHBondContact CA-OD2 3.36Å; F1033-D1037 HydrophobicContact CB-CB 3.83Å; G1034-D1037 PolarHBondContact N-OD2 3.06Å; G1034-D1037 PolarHBondContact O-N 3.3Å; A1035-D1037 VanDerWaalsContact C-N 3.3Å; A1035-D1037 PolarHBondContact O-N 3.48Å
1038	Y	89.4	Confident	85.9	Confident	32 Å²	32	91.8 Å²	91.8	13%	0.125	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	122.3	175.9	65.5	-81	0	0	0	111	V1002 Y1012 L1015 Y1019 F1033 G1034 A1035	V1002-Y1038 WeakPolarHBondContact O-CA 3.38Å; Y1012-Y1038 HydrophobicContact CE2-CD2 4.08Å; Y1012-Y1038 HydrophobicContact CE2-CE2 4.13Å; L1015-Y1038 HydrophobicContact CB-CD2 4.3Å; L1015-Y1038 HydrophobicContact CB-CG 4.49Å; Y1019-Y1038 HydrophobicContact CD1-CE1 4.3Å; Y1019-Y1038 AromaticContact CD2-CE1 3.83Å; Y1019-Y1038 HydrophobicContact CD2-CE1 3.83Å; Y1019-Y1038 HydrophobicContact CE2-CE1 4.43Å; Y1019-Y1038 AromaticContact CG-CE1 3.78Å; Y1019-Y1038 HydrophobicContact CG-CE1 3.78Å; F1033-Y1038 AromaticContact CD2-CD1 3.96Å; F1033-Y1038 HydrophobicContact CD2-CD1 3.96Å; F1033-Y1038 AromaticContact CE2-CD1 3.83Å; F1033-Y1038 HydrophobicContact CE2-CD1 3.83Å; F1033-Y1038 HydrophobicContact CE2-CE1 4.4Å; F1033-Y1038 HydrophobicContact CE2-CG 4.4Å; G1034-Y1038 WeakPolarHBondContact O-CD1 3.47Å; A1035-Y1038 WeakPolarHBondContact O-CE1 3.4Å
1039	H	89.7	Confident	85.7	Confident	98 Å²	98	88.4 Å²	88.4	45%	0.454	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	143.7	-175.5	-57.8	-65.9	0	0	0	110.9	A1001 V1002 N1036	A1001-H1039 CarbonylContact C-O 3.55Å; A1001-H1039 WeakPolarHBondContact CA-O 3.42Å; V1002-H1039 PolarHBondContact N-O 3.49Å; V1002-H1039 PolarHBondContact O-N 2.7Å; N1036-H1039 PolarHBondContact O-CE1 3.39Å; N1036-H1039 PolarHBondContact O-NE2 3.26Å
1040	R	92.2	Very high	85.2	Confident	102 Å²	102	91 Å²	91	39%	0.385	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	131.1	175.3	-159.6	173.3	-131.9	-68.9	-12	109.3	D1000 Y1012	D1000-R1040 CarbonylContact O-C 3.36Å; D1000-R1040 WeakPolarHBondContact O-CA 3.38Å; D1000-R1040 WeakPolarHBondContact O-CG 3.39Å; D1000-R1040 IonicContact OD2-CZ 2.95Å; D1000-R1040 IonicContact OD2-NH1 3.73Å; D1000-R1040 PolarHBondContact OD2-NH1 3.04Å; D1000-R1040 IonicContact OD2-NH2 2.68Å; D1000-R1040 PolarHBondContact OD2-NH2 3.21Å; Y1012-R1040 HydrophobicContact CD2-CB 3.93Å; Y1012-R1040 HydrophobicContact CD2-CG 4.1Å; Y1012-R1040 HydrophobicContact CE2-CB 4.16Å; Y1012-R1040 HydrophobicContact CG-CG 4.5Å
1041	L	85.8	Confident	84.9	Confident	67 Å²	67	90.1 Å²	90.1	35%	0.351	46%	0.464	S	S	.	.			trans	-94.8	135.9	171.7	-69	176.6	0	0	0	109	D1000 V1002 V1009	D1000-L1041 PolarHBondContact O-N 3.26Å; V1002-L1041 HydrophobicContact CB-CD1 3.96Å; V1002-L1041 HydrophobicContact CB-CD2 4.32Å; V1002-L1041 HydrophobicContact CB-CG 4.08Å; V1002-L1041 HydrophobicContact CG1-CD1 4.3Å; V1002-L1041 HydrophobicContact CG1-CD2 3.74Å; V1002-L1041 HydrophobicContact CG1-CG 3.91Å; V1009-L1041 HydrophobicContact CG1-CD1 3.58Å; V1009-L1041 HydrophobicContact CG2-CD1 4.34Å
1042	Y	80.4	Confident	84.6	Confident	199 Å²	199	92.4 Å²	92.4	78%	0.78	47%	0.469	S	S	*	.			trans	-107	110.2	170.5	-62.2	-85.2	0	0	0	107.5
1043	L	68.1	Low	84	Confident	130 Å²	130	94.8 Å²	94.8	68%	0.681	46%	0.464	S	S	*	.			trans	-87	113.5	172.2	-70.6	130.2	0	0	0	107.1	K999	K999-L1043 WeakPolarHBondContact O-CD1 3.4Å
1044	Q	54.9	Low	83.3	Confident	268 Å²	268	102.5 Å²	102.5	100%	1.252	50%	0.502	S	S	*	.			trans	-81.6	0	169.3	-98.4	178.6	-20.6	0	0	110.7

Retrieved 1,044 of 1,044 residues in 160.6 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).