A0A3Q0KJ79_SCHMA Loading...

Putative gyf domain AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KJ79, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,120 aa.

						>A0A3Q0KJ79_SCHMA|A0A3Q0KJ79
MQPNVERSETGRRLSYSRAEILALYDCGKSIALHNDVVKKSHTGTRAPRPKPQRKKTSYSQSSDGDAQKTHGSSGEDLTTQEVDPNTHSWHRMNRNAWNAQSGSSSHHPHQRYPSGPTGDVDPSTLVSQANGPLRPTNETKRGGHGDWSRGCAGWRQRSYSGSEQSDIFYYNHSNHRGRGNGHPSNEVDGNTGRGRGRGRGSGRQGLTHREPVGGGQSQTSGGNACRPASCLVDTPGGQLNQQTKNGRIYSKSFCSDPPPGFDLPIHEKPSNESSFDKTCQKEDVFIDNIDSVPIHHCQPVNDDSSKSSTQINSKQSIIHPCHWYYIDLFTCTQGPFTNQQMSTWLASGYLPLSLKIRRDCDECFLSLADHMNLAGRIPFWTGYNQPPITNVNLSTLSGLNYNSNNNNGNQVLIHSTIINNQTPSSSTPPGITNRKTDCEISLPQSTLTTFDENTIQLQNKGDVNVSDNDQTQVTINNDSITSHISTLSSNTISSSIAEYSESQTLHHSSSFTGIDEKALLDLYNEAKTIALHTSKIEAERLALANKLAEINSTTAKLLSNLCPTQLSSTLTESLIRTTNAVQTELARILEPCINNDGDNNTIPGTTFSNTLDDGSNNNIKTDNDIISPILNDHSNSTTVNSSSKPSTLPSLGIELTKSLSTLTILDNEHPLDSTINNHEPNKHTNNNAHVGNNNVAADDDDNDNDKKHQQFQSIEKSIPECDIAVSLTSNNEQETLTTTKKSKRKNKKTNKKLTADEVRQLAWESEFNRRKAASLEQSLAEEERLKKLAEEEAMAIAAEKALAVQEKNRTLIEQRKREISRLKADSELAQLKLPESARWAAAATSNINITNKAAPIDLRSIQAAQAAEEAKRKYHDALMSEQVAVLIAAEAAPLSTKTSLSWSQIAKSDTISLTSINPCISKDDKTTERSKCAVVISSNSNNNGPIQKSTGHSSNSNNTSSLTQLDYLKITSSSKTSLNNNITSISSSTSISCTPKVNNTIINSVTTTTTNTPSIWDLPVTNNLDNTNSGTGKKGSSKKKKKNREVSLLPAKEELAHWCESQLSSIPLSGVDLPTLVDLLCELQATDEILEFIETSLGRSKRITQFSKDFLQKRSLFRQ
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	42.8	Very low	38.4	Very low	242 Å²	242	149.7 Å²	149.7	100%	1.192	80%	0.804	S	S	*	*				0	111	0	-76.9	-62.4	148.2	0	0	108
2	Q	31.3	Very low	38.6	Very low	161 Å²	161	158.4 Å²	158.4	75%	0.752	82%	0.817	S	S	*	*			trans	-133.6	153.2	170.6	-76.9	175.4	-87.3	0	0	106.8	N4	Q2-N4 PolarHBondContact NE2-OD1 3.24Å
3	P	51.7	Low	38.6	Very low	124 Å²	124	164.7 Å²	164.7	81%	0.805	82%	0.824	S	S	*	*			trans	-91.7	117	139.8	31.8	-23.3	0	0	0	109.1
4	N	35.6	Very low	39.2	Very low	112 Å²	112	162.9 Å²	162.9	60%	0.599	82%	0.817	S	S	*	*			trans	-74.9	140.8	159.2	-92.7	3	0	0	0	108.4	Q2	Q2-N4 PolarHBondContact NE2-OD1 3.24Å
5	V	46.6	Very low	39.8	Very low	135 Å²	135	159.3 Å²	159.3	82%	0.818	81%	0.813	S	S	*	*			trans	-134.3	98.4	153.5	-177.9	0	0	0	0	107
6	E	34.1	Very low	41.5	Very low	175 Å²	175	157.9 Å²	157.9	82%	0.818	80%	0.796	S	S	*	*			trans	-78.4	140.3	164.7	-69.4	175.5	114.5	0	0	109.1
7	R	37.6	Very low	43.1	Very low	240 Å²	240	151.6 Å²	151.6	91%	0.906	77%	0.77	S	S	*	*			trans	-150.2	128.6	152.6	-131.3	178.1	-173.5	-174.1	0.3	110.5
8	S	32.8	Very low	44.3	Very low	86 Å²	86	153.1 Å²	153.1	60%	0.601	77%	0.765	S	S	*	*			trans	-69.9	171.3	159.2	49.3	0	0	0	0	109.8
9	E	37.2	Very low	45.4	Very low	155 Å²	155	148.6 Å²	148.6	72%	0.724	75%	0.754	S	S	*	*			cis	-131.5	169	15	-98.7	94.3	-129	0	0	112.8
10	T	37	Very low	46.5	Very low	145 Å²	145	145.7 Å²	145.7	89%	0.89	74%	0.738	S	S	*	*			trans	40.6	84.9	152.1	57.5	0	0	0	0	118.8
11	G	36.2	Very low	47.3	Very low	72 Å²	72	142.5 Å²	142.5	74%	0.742	72%	0.722	S	S	*	*			trans	-129.6	105.3	162.3	0	0	0	0	0	111.9	R13	G11-R13 PolarHBondContact O-N 3.28Å; G11-R13 VanDerWaalsContact O-N 3.1Å
12	R	39.8	Very low	48.3	Very low	254 Å²	254	135 Å²	135	96%	0.958	69%	0.686	S	S	*	*			trans	-72.2	100.8	169	-81.8	-167.5	180	-133.5	3.8	108.8	L14	R12-L14 PolarHBondContact O-N 3.4Å; R12-L14 VanDerWaalsContact O-N 3.11Å
13	R	39.1	Very low	49.7	Very low	240 Å²	240	129.9 Å²	129.9	91%	0.906	67%	0.672	S	S	*	*			trans	-76.1	96.4	177.7	-165.6	179.7	-165.7	-174	4.3	109.8	G11 S15	G11-R13 PolarHBondContact O-N 3.28Å; G11-R13 VanDerWaalsContact O-N 3.1Å; R13-S15 PolarHBondContact O-N 3Å
14	L	47	Very low	49.8	Very low	139 Å²	139	130 Å²	130	73%	0.728	67%	0.665	S	S	*	*			trans	-56.6	128	168.8	-76.2	162	0	0	0	109.4	R12	R12-L14 PolarHBondContact O-N 3.4Å; R12-L14 VanDerWaalsContact O-N 3.11Å
15	S	48.3	Very low	50.7	Low	109 Å²	109	132.5 Å²	132.5	76%	0.762	67%	0.667	S	S	*	*			trans	-110.2	88.7	177.6	55.5	0	0	0	0	108.9	R13 S17	R13-S15 PolarHBondContact O-N 3Å; S15-S17 PolarHBondContact O-N 3.45Å
16	Y	66.5	Low	51	Low	137 Å²	137	132.7 Å²	132.7	54%	0.537	66%	0.663	S	S	.	*			trans	-56.8	129.6	173.9	-61.8	-73.7	0	0	0	110.4	E20	Y16-E20 HydrophobicContact CD1-CB 4.23Å
17	S	68.6	Low	51.1	Low	51 Å²	51	129.6 Å²	129.6	36%	0.357	66%	0.66	S	S	.	*			trans	-65.8	159.2	170.4	62.9	0	0	0	0	111	S15 A19 E20 I21	S15-S17 PolarHBondContact O-N 3.45Å; S17-A19 PolarHBondContact O-N 2.92Å; S17-E20 VanDerWaalsContact CB-OE2 3.28Å; S17-E20 WeakPolarHBondContact CB-OE2 3.46Å; S17-E20 PolarHBondContact N-OE2 3.4Å; S17-E20 PolarHBondContact O-N 3.45Å; S17-E20 VanDerWaalsContact O-N 3.17Å; S17-E20 WeakPolarHBondContact OG-CG 3.27Å; S17-E20 PolarHBondContact OG-N 3.17Å; S17-E20 PolarHBondContact OG-OE2 3.36Å; S17-I21 WeakPolarHBondContact O-CG1 3.32Å; S17-I21 PolarHBondContact O-N 3.45Å
18	R	66.2	Low	51	Low	178 Å²	178	121.3 Å²	121.3	67%	0.672	65%	0.649	S	S	*	*	H	α-helix	trans	-59.2	-27	170.7	-175.3	170.1	173.6	-179.5	-7.6	111.4	L22	R18-L22 HydrophobicContact CG-CD1 3.97Å; R18-L22 HydrophobicContact CG-CG 4.43Å; R18-L22 VanDerWaalsContact O-CB 3.31Å; R18-L22 WeakPolarHBondContact O-CB 3.38Å; R18-L22 WeakPolarHBondContact O-CG 3.42Å; R18-L22 PolarHBondContact O-N 3.46Å
19	A	64	Low	51.2	Low	68 Å²	68	126.4 Å²	126.4	56%	0.562	66%	0.661	S	S	*	*	H	α-helix	trans	-71.6	-42.1	174.7	0	0	0	0	0	112.9	S17 L22 A23	S17-A19 PolarHBondContact O-N 2.92Å; A19-L22 PolarHBondContact O-N 3.13Å; A19-A23 VanDerWaalsContact O-CB 3.25Å; A19-A23 WeakPolarHBondContact O-CB 3.21Å; A19-A23 PolarHBondContact O-N 2.92Å
20	E	67.7	Low	50.9	Low	90 Å²	90	124.4 Å²	124.4	42%	0.421	66%	0.664	S	S	.	*	H	α-helix	trans	-65.6	-41.7	173.7	-74.9	158.1	102.7	0	0	111.7	Y16 S17 A23 L24	Y16-E20 HydrophobicContact CD1-CB 4.23Å; S17-E20 VanDerWaalsContact CB-OE2 3.28Å; S17-E20 WeakPolarHBondContact CB-OE2 3.46Å; S17-E20 PolarHBondContact N-OE2 3.4Å; S17-E20 PolarHBondContact O-N 3.45Å; S17-E20 VanDerWaalsContact O-N 3.17Å; S17-E20 WeakPolarHBondContact OG-CG 3.27Å; S17-E20 PolarHBondContact OG-N 3.17Å; S17-E20 PolarHBondContact OG-OE2 3.36Å; E20-A23 PolarHBondContact O-N 3.17Å; E20-L24 VanDerWaalsContact O-CG 3.31Å; E20-L24 WeakPolarHBondContact O-CG 3.31Å; E20-L24 PolarHBondContact O-N 3.13Å
21	I	63.3	Low	50.6	Low	79 Å²	79	124.3 Å²	124.3	41%	0.405	66%	0.656	S	S	.	*	H	α-helix	trans	-61.6	-46.7	175.5	-64.1	169.4	0	0	0	109.9	S17 L24 Y25	S17-I21 WeakPolarHBondContact O-CG1 3.32Å; S17-I21 PolarHBondContact O-N 3.45Å; I21-L24 PolarHBondContact O-N 3.5Å; I21-Y25 HydrophobicContact CG2-CD2 4.01Å; I21-Y25 HydrophobicContact CG2-CE2 4.14Å; I21-Y25 WeakPolarHBondContact O-CD2 3.38Å; I21-Y25 PolarHBondContact O-N 2.63Å; I21-Y25 VanDerWaalsContact O-N 3.11Å
22	L	64.7	Low	50.5	Low	84 Å²	84	125.1 Å²	125.1	44%	0.44	66%	0.656	S	S	.	*	H	α-helix	trans	-67.3	-36.5	177.2	-72.5	170.5	0	0	0	112.7	R18 A19 L24 Y25 D26	R18-L22 HydrophobicContact CG-CD1 3.97Å; R18-L22 HydrophobicContact CG-CG 4.43Å; R18-L22 VanDerWaalsContact O-CB 3.31Å; R18-L22 WeakPolarHBondContact O-CB 3.38Å; R18-L22 WeakPolarHBondContact O-CG 3.42Å; R18-L22 PolarHBondContact O-N 3.46Å; A19-L22 PolarHBondContact O-N 3.13Å; L22-L24 VanDerWaalsContact C-N 3.33Å; L22-L24 PolarHBondContact O-N 3.49Å; L22-Y25 CarbonylContact O-C 3.6Å; L22-Y25 PolarHBondContact O-N 3.31Å; L22-Y25 VanDerWaalsContact O-N 3.14Å; L22-D26 WeakPolarHBondContact O-CB 3.37Å; L22-D26 PolarHBondContact O-N 2.86Å
23	A	59.5	Low	50.3	Low	55 Å²	55	120.1 Å²	120.1	46%	0.455	65%	0.647	S	S	.	*	H	α-helix	trans	-64.3	-36.7	175.1	0	0	0	0	0	112.4	A19 E20 C27	A19-A23 VanDerWaalsContact O-CB 3.25Å; A19-A23 WeakPolarHBondContact O-CB 3.21Å; A19-A23 PolarHBondContact O-N 2.92Å; E20-A23 PolarHBondContact O-N 3.17Å; A23-C27 PolarHBondContact O-N 2.89Å; A23-C27 PolarHBondContact O-SG 3.06Å
24	L	55.3	Low	50.1	Low	127 Å²	127	116.2 Å²	116.2	67%	0.665	64%	0.639	S	S	*	*	H	α-helix	trans	-66.6	-35.1	172.2	-71.2	166.1	0	0	0	112.1	E20 I21 L22	E20-L24 VanDerWaalsContact O-CG 3.31Å; E20-L24 WeakPolarHBondContact O-CG 3.31Å; E20-L24 PolarHBondContact O-N 3.13Å; I21-L24 PolarHBondContact O-N 3.5Å; L22-L24 VanDerWaalsContact C-N 3.33Å; L22-L24 PolarHBondContact O-N 3.49Å
25	Y	53.3	Low	49.6	Very low	163 Å²	163	116.7 Å²	116.7	64%	0.639	64%	0.642	S	S	*	*	H	α-helix	trans	-79.4	-34.6	176.3	-87	-73.3	0	0	0	114.4	I21 L22 C27 G28	I21-Y25 HydrophobicContact CG2-CD2 4.01Å; I21-Y25 HydrophobicContact CG2-CE2 4.14Å; I21-Y25 WeakPolarHBondContact O-CD2 3.38Å; I21-Y25 PolarHBondContact O-N 2.63Å; I21-Y25 VanDerWaalsContact O-N 3.11Å; L22-Y25 CarbonylContact O-C 3.6Å; L22-Y25 PolarHBondContact O-N 3.31Å; L22-Y25 VanDerWaalsContact O-N 3.14Å; Y25-C27 VanDerWaalsContact C-N 3.31Å; Y25-C27 PolarHBondContact O-N 3.19Å; Y25-G28 PolarHBondContact O-N 2.81Å
26	D	52.1	Low	49	Very low	139 Å²	139	117.7 Å²	117.7	74%	0.743	64%	0.639	S	S	*	*	H	α-helix	trans	-77.4	-13.8	-180	-84.9	-31.7	0	0	0	113.3	L22 G28	L22-D26 WeakPolarHBondContact O-CB 3.37Å; L22-D26 PolarHBondContact O-N 2.86Å; D26-G28 PolarHBondContact O-N 3.23Å
27	C	37.7	Very low	47.6	Very low	110 Å²	110	117 Å²	117	74%	0.743	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	18.4	165.9	-79.7	0	0	0	0	114.2	A23 Y25 K29	A23-C27 PolarHBondContact O-N 2.89Å; A23-C27 PolarHBondContact O-SG 3.06Å; Y25-C27 VanDerWaalsContact C-N 3.31Å; Y25-C27 PolarHBondContact O-N 3.19Å; C27-K29 VanDerWaalsContact C-N 3.29Å; C27-K29 PolarHBondContact O-N 3.08Å
28	G	35.2	Very low	46.1	Very low	66 Å²	66	120.7 Å²	120.7	68%	0.68	67%	0.669	S	S	*	*			trans	-75	45.4	-176.2	0	0	0	0	0	117.1	Y25 D26	Y25-G28 PolarHBondContact O-N 2.81Å; D26-G28 PolarHBondContact O-N 3.23Å
29	K	36.4	Very low	44.6	Very low	194 Å²	194	122 Å²	122	84%	0.843	68%	0.679	S	S	*	*			trans	-133.4	95.9	173.2	-77.8	-165.1	175.1	-174.7	0	115.4	C27	C27-K29 VanDerWaalsContact C-N 3.29Å; C27-K29 PolarHBondContact O-N 3.08Å
30	S	31.9	Very low	43.4	Very low	113 Å²	113	128.4 Å²	128.4	79%	0.79	70%	0.695	S	S	*	*			trans	41.1	94	141.5	-167.7	0	0	0	0	118.5	A32	S30-A32 PolarHBondContact O-N 2.95Å
31	I	30.9	Very low	41.9	Very low	142 Å²	142	129 Å²	129	73%	0.728	71%	0.709	S	S	*	*			trans	-67.8	112.2	159	-58.8	170.5	0	0	0	108.5	L33	I31-L33 HydrophobicContact CG2-CD2 4.29Å; I31-L33 HydrophobicContact CG2-CG 4.19Å
32	A	32.5	Very low	40.6	Very low	89 Å²	89	133.1 Å²	133.1	74%	0.736	73%	0.726	S	S	*	*			trans	-93.1	101.9	169	0	0	0	0	0	109.5	S30 H34	S30-A32 PolarHBondContact O-N 2.95Å; A32-H34 PolarHBondContact O-N 3.29Å
33	L	35.7	Very low	39.2	Very low	149 Å²	149	135.3 Å²	135.3	78%	0.78	74%	0.743	S	S	*	*			trans	-77.5	102.5	170.9	-72.7	176.3	0	0	0	109.8	I31 N35	I31-L33 HydrophobicContact CG2-CD2 4.29Å; I31-L33 HydrophobicContact CG2-CG 4.19Å; L33-N35 PolarHBondContact O-N 3.47Å
34	H	34.7	Very low	38	Very low	159 Å²	159	136.1 Å²	136.1	74%	0.736	76%	0.756	S	S	*	*			trans	-79.9	93.5	168.8	-171.7	3.9	0	0	0	109.1	A32 D36	A32-H34 PolarHBondContact O-N 3.29Å; H34-D36 IonicContact CE1-OD2 3.62Å; H34-D36 PolarHBondContact CE1-OD2 2.95Å
35	N	38.1	Very low	37.2	Very low	148 Å²	148	136.4 Å²	136.4	79%	0.791	76%	0.764	S	S	*	*			trans	-95.1	142.5	157.7	-77.4	-14.8	0	0	0	108.2	L33	L33-N35 PolarHBondContact O-N 3.47Å
36	D	34.3	Very low	36.2	Very low	131 Å²	131	139.7 Å²	139.7	70%	0.701	78%	0.775	S	S	*	*			trans	-137.4	177.6	176.7	-147.1	-23.8	0	0	0	109.9	H34	H34-D36 IonicContact CE1-OD2 3.62Å; H34-D36 PolarHBondContact CE1-OD2 2.95Å
37	V	37	Very low	35.4	Very low	121 Å²	121	137.5 Å²	137.5	73%	0.733	78%	0.776	S	S	*	*			trans	81.6	146.4	177.2	-163.4	0	0	0	0	115.8
38	V	38.7	Very low	35.6	Very low	130 Å²	130	138.2 Å²	138.2	79%	0.788	78%	0.779	S	S	*	*			trans	75.8	84.7	-179.9	-160.5	0	0	0	0	117
39	K	34.4	Very low	35.8	Very low	204 Å²	204	145.2 Å²	145.2	89%	0.887	79%	0.785	S	S	*	*			trans	-97.5	165.2	149.3	-84.9	-176.9	177.7	175.5	0	110
40	K	37.1	Very low	35.9	Very low	203 Å²	203	141.9 Å²	141.9	88%	0.883	78%	0.784	S	S	*	*			trans	79.3	136.2	-177.4	-59.1	175	-179.8	172.5	0	113.5
41	S	36.2	Very low	36.2	Very low	102 Å²	102	145.3 Å²	145.3	71%	0.713	78%	0.784	S	S	*	*			cis	-156.5	148.1	-0.6	46.6	0	0	0	0	114.8
42	H	36.9	Very low	36.7	Very low	167 Å²	167	144.2 Å²	144.2	77%	0.773	79%	0.786	S	S	*	*			trans	68.3	108.4	143.5	-82.6	58.3	0	0	0	121
43	T	36.2	Very low	37	Very low	130 Å²	130	149 Å²	149	80%	0.798	79%	0.794	S	S	*	*				43.3	122.7	126.9	61.1	0	0	0	0	120.9
44	G	34.3	Very low	37.1	Very low	71 Å²	71	152 Å²	152	73%	0.732	79%	0.794	S	S	*	*			trans	155.9	82	151.5	0	0	0	0	0	119.9
45	T	37.4	Very low	37.4	Very low	133 Å²	133	153.8 Å²	153.8	82%	0.816	80%	0.8	S	S	*	*				44.1	99.1	129.5	-49.1	0	0	0	0	121.2
46	R	31.9	Very low	37.4	Very low	232 Å²	232	151.6 Å²	151.6	88%	0.875	78%	0.784	S	S	*	*				61.8	90.1	127.1	-171	-165.3	174	-177.9	-1.9	120.9
47	A	36.6	Very low	37.7	Very low	94 Å²	94	152.5 Å²	152.5	78%	0.777	79%	0.794	S	S	*	*			trans	56.1	172.5	134.8	0	0	0	0	0	120.7
48	P	40.4	Very low	37.9	Very low	124 Å²	124	150.9 Å²	150.9	81%	0.805	79%	0.788	S	S	*	*			cis	-123.2	-166.2	-11.9	40.8	-23.9	0	0	0	114
49	R	39.9	Very low	38	Very low	214 Å²	214	154.3 Å²	154.3	81%	0.808	79%	0.788	S	S	*	*			trans	-63.3	157.6	176	-69.3	176.6	173.5	-112.2	7	114.4
50	P	38.9	Very low	38.3	Very low	124 Å²	124	148.2 Å²	148.2	81%	0.805	77%	0.771	S	S	*	*				-123.8	-179.5	127.7	31.6	-20.4	0	0	0	114.2
51	K	38.3	Very low	38.6	Very low	184 Å²	184	146 Å²	146	80%	0.8	76%	0.764	S	S	*	*			trans	-122.6	164.4	-178.5	-104.3	-174.9	176.6	-178.3	0	110.9
52	P	41.3	Very low	38.8	Very low	120 Å²	120	146.6 Å²	146.6	78%	0.779	77%	0.768	S	S	*	*			trans	-89.8	169.9	-162.7	36.4	-38.4	0	0	0	115.4
53	Q	39	Very low	39.2	Very low	190 Å²	190	143 Å²	143	89%	0.888	76%	0.762	S	S	*	*			trans	-129.5	161.8	161.8	-80.1	-155.9	-4.3	0	0	112.7
54	R	36.7	Very low	39.5	Very low	210 Å²	210	144.2 Å²	144.2	79%	0.792	76%	0.763	S	S	*	*			trans	-143.2	143.4	-173.4	171.7	-175.2	178	-176.3	3.4	109.1
55	K	41	Very low	39.9	Very low	198 Å²	198	144 Å²	144	86%	0.861	76%	0.761	S	S	*	*			trans	-123.9	162.7	164.4	-73.6	-173.4	176.7	177.9	0	111
56	K	38.7	Very low	40.2	Very low	102 Å²	102	145.2 Å²	145.2	44%	0.443	76%	0.763	S	S	.	*			trans	-135.6	150.1	-175.1	-44.7	163.2	-167.3	157.4	0	109	D924	K56-D924 IonicContact NZ-OD1 2.72Å; K56-D924 PolarHBondContact NZ-OD1 2.89Å; K56-D924 IonicContact NZ-OD2 3.4Å
57	T	42	Very low	40.8	Very low	149 Å²	149	137.6 Å²	137.6	91%	0.914	75%	0.749	S	S	*	*			trans	-140.3	179.2	148.1	39.8	0	0	0	0	108.7
58	S	40.8	Very low	41.2	Very low	88 Å²	88	140.7 Å²	140.7	62%	0.615	75%	0.748	S	S	*	*			trans	-147	172.3	-152.9	-39.9	0	0	0	0	113.8
59	Y	41.2	Very low	41.2	Very low	202 Å²	202	141.6 Å²	141.6	79%	0.792	74%	0.739	S	S	*	*				134.9	113.9	122.5	-150.7	-113.3	0	0	0	117.3
60	S	39.4	Very low	41.4	Very low	75 Å²	75	136.6 Å²	136.6	52%	0.524	73%	0.732	S	S	.	*			trans	65.7	156.2	138.8	-61.3	0	0	0	0	122
61	Q	43.7	Very low	41.5	Very low	158 Å²	158	138.6 Å²	138.6	74%	0.738	73%	0.73	S	S	*	*			cis	-166	159.5	-10	-118.2	176.3	-20.1	0	0	112.6
62	S	40.6	Very low	41.5	Very low	114 Å²	114	132.8 Å²	132.8	80%	0.797	72%	0.723	S	S	*	*			trans	69	157	151.2	80.5	0	0	0	0	119
63	S	44.5	Very low	41.1	Very low	91 Å²	91	133.1 Å²	133.1	64%	0.636	73%	0.728	S	S	*	*			cis	-159.8	167.2	-7.9	-139.6	0	0	0	0	112.8
64	D	42.5	Very low	40.8	Very low	155 Å²	155	128.6 Å²	128.6	83%	0.829	72%	0.718	S	S	*	*			trans	62.8	144.8	153.5	-44.3	-23.7	0	0	0	120.5
65	G	42.9	Very low	40.8	Very low	66 Å²	66	121.3 Å²	121.3	68%	0.68	71%	0.708	S	S	*	*			cis	170.7	159	-7.5	0	0	0	0	0	114.2
66	D	43.4	Very low	40.6	Very low	160 Å²	160	119.7 Å²	119.7	86%	0.856	70%	0.703	S	S	*	*			trans	64.5	153.8	163.9	-87.7	-45.5	0	0	0	120
67	A	45.2	Very low	40.4	Very low	71 Å²	71	120.8 Å²	120.8	59%	0.587	71%	0.714	S	S	*	*			cis	-158.5	144.9	4.4	0	0	0	0	0	114.4
68	Q	44.2	Very low	40.2	Very low	160 Å²	160	120 Å²	120	75%	0.748	70%	0.703	S	S	*	*			trans	65.8	154.2	142.2	-53	-88.1	-43.3	0	0	120.1
69	K	41.2	Very low	39.9	Very low	142 Å²	142	120.6 Å²	120.6	62%	0.617	70%	0.704	S	S	*	*			cis	-177.2	137.6	-28.9	-160.5	177	164.5	-175.6	0	106.4
70	T	43.8	Very low	39.9	Very low	109 Å²	109	116.8 Å²	116.8	67%	0.669	70%	0.701	S	S	*	*				170.3	146.1	93.3	32.1	0	0	0	0	111.7
71	H	41.7	Very low	39.6	Very low	166 Å²	166	120.3 Å²	120.3	77%	0.769	71%	0.709	S	S	*	*			trans	23.8	143.1	148.3	-45.6	-59.9	0	0	0	121.8
72	G	37.2	Very low	39	Very low	63 Å²	63	120 Å²	120	65%	0.649	71%	0.708	S	S	*	*			cis	-161.5	161.9	2.4	0	0	0	0	0	109.9
73	S	33.7	Very low	39	Very low	126 Å²	126	120.7 Å²	120.7	88%	0.881	71%	0.707	S	S	*	*				61.4	125.9	57.6	-163.5	0	0	0	0	111.7
74	S	33.4	Very low	38.5	Very low	96 Å²	96	122.9 Å²	122.9	67%	0.671	71%	0.712	S	S	*	*			cis	-133.9	166.1	-0.2	42.3	0	0	0	0	108.2
75	G	34.8	Very low	38.9	Very low	57 Å²	57	120.5 Å²	120.5	59%	0.588	71%	0.705	S	S	*	*			cis	108.7	157.3	29.2	0	0	0	0	0	109
76	E	37	Very low	38.4	Very low	164 Å²	164	123.1 Å²	123.1	77%	0.766	70%	0.703	S	S	*	*			trans	64	148.2	169.2	-66.1	109.2	-113.2	0	0	117
77	D	35.2	Very low	38	Very low	124 Å²	124	120.3 Å²	120.3	66%	0.663	69%	0.692	S	S	*	*			cis	-157	178.9	2	-133.2	-15	0	0	0	113.6
78	L	37.9	Very low	37.7	Very low	133 Å²	133	123.6 Å²	123.6	70%	0.696	70%	0.695	S	S	*	*			trans	36.5	137.1	140.9	-65.9	167.8	0	0	0	120.4
79	T	35	Very low	37	Very low	101 Å²	101	120.7 Å²	120.7	62%	0.62	69%	0.692	S	S	*	*			cis	-176.1	-178.1	-11.6	9.7	0	0	0	0	106.3
80	T	39.7	Very low	36.8	Very low	121 Å²	121	125 Å²	125	74%	0.742	71%	0.705	S	S	*	*			trans	66.4	149.9	147.5	41.2	0	0	0	0	117.3
81	Q	34	Very low	36.2	Very low	149 Å²	149	127.5 Å²	127.5	70%	0.696	71%	0.708	S	S	*	*			cis	-156.5	173.4	-15.8	-178.4	158.4	-2.8	0	0	107.8
82	E	30.9	Very low	35.5	Very low	152 Å²	152	129.5 Å²	129.5	71%	0.71	71%	0.709	S	S	*	*			trans	-32	141	165.8	-55.5	149.7	110.2	0	0	114.5
83	V	40.8	Very low	35.4	Very low	129 Å²	129	133.1 Å²	133.1	78%	0.782	71%	0.711	S	S	*	*				-165.1	123.9	92.2	150.7	0	0	0	0	108.7	P85	V83-P85 WeakPolarHBondContact O-CD 3.49Å
84	D	33.9	Very low	35.4	Very low	137 Å²	137	134.6 Å²	134.6	73%	0.733	71%	0.709	S	S	*	*			trans	-99.6	115.2	172.5	-164.3	-3.2	0	0	0	109	N86	D84-N86 PolarHBondContact OD1-N 3.46Å
85	P	51.3	Low	35.3	Very low	104 Å²	104	137.9 Å²	137.9	68%	0.675	71%	0.707	S	S	*	*			trans	-97.4	102.1	151.7	32.5	-22.6	0	0	0	107.3	V83	V83-P85 WeakPolarHBondContact O-CD 3.49Å
86	N	31.4	Very low	35.3	Very low	122 Å²	122	141.5 Å²	141.5	65%	0.652	71%	0.713	S	S	*	*				18.1	124.1	85.1	-76.5	-66.1	0	0	0	112	D84	D84-N86 PolarHBondContact OD1-N 3.46Å
87	T	36.4	Very low	34.9	Very low	100 Å²	100	137.9 Å²	137.9	61%	0.613	71%	0.711	S	S	*	*				-174.8	174.1	57.2	-33.1	0	0	0	0	109.3
88	H	39.1	Very low	34.9	Very low	140 Å²	140	143.6 Å²	143.6	65%	0.648	72%	0.723	S	S	*	*			trans	73.6	106.8	167.4	-43.6	-38.9	0	0	0	114
89	S	29	Very low	34.7	Very low	99 Å²	99	144.4 Å²	144.4	69%	0.692	73%	0.728	S	S	*	*			cis	54.3	88.2	38.1	-163.4	0	0	0	0	113.2
90	W	36.5	Very low	34.7	Very low	232 Å²	232	143.1 Å²	143.1	88%	0.879	73%	0.728	S	S	*	*			trans	-105.5	57.9	169.7	-76.3	102.9	0	0	0	111.7
91	H	30.3	Very low	34.5	Very low	162 Å²	162	146.1 Å²	146.1	75%	0.75	73%	0.733	S	S	*	*			trans	-86	150.4	152	-90.3	-52.9	0	0	0	109.5
92	R	28.5	Very low	34.6	Very low	209 Å²	209	144.3 Å²	144.3	79%	0.789	74%	0.737	S	S	*	*			trans	77.9	145.9	-178.3	-45	175.7	-159.1	-85.5	0	112
93	M	34.7	Very low	34.9	Very low	138 Å²	138	140.3 Å²	140.3	68%	0.68	74%	0.737	S	S	*	*			cis	-118.2	118.4	20.2	-50.6	-147	-170.3	0	0	115.3	R95	M93-R95 HydrophobicContact CB-CB 4.45Å; M93-R95 PolarHBondContact SD-NE 3.32Å; M93-R95 PolarHBondContact SD-NH2 2.96Å
94	N	33.2	Very low	34.7	Very low	158 Å²	158	140.3 Å²	140.3	85%	0.845	74%	0.742	S	S	*	*			trans	-82.8	103.9	137.6	174	6.7	0	0	0	107.1
95	R	32.3	Very low	34.8	Very low	165 Å²	165	139 Å²	139	62%	0.623	74%	0.744	S	S	*	*			trans	-159.3	144.1	166.8	-75.6	-157.4	-95.6	-136.5	-1.7	107.7	M93	M93-R95 HydrophobicContact CB-CB 4.45Å; M93-R95 PolarHBondContact SD-NE 3.32Å; M93-R95 PolarHBondContact SD-NH2 2.96Å
96	N	34.1	Very low	34.1	Very low	133 Å²	133	138.3 Å²	138.3	71%	0.711	74%	0.741	S	S	*	*			cis	-152.3	158.4	-7.7	-111	1.8	0	0	0	110.2
97	A	29.8	Very low	34.5	Very low	88 Å²	88	140.9 Å²	140.9	73%	0.727	75%	0.749	S	S	*	*			trans	-71.1	134.7	-173.3	0	0	0	0	0	115.6
98	W	35.1	Very low	34.7	Very low	244 Å²	244	144.6 Å²	144.6	92%	0.924	76%	0.759	S	S	*	*			trans	-146.1	108	148.6	-62.4	80.3	0	0	0	103.6
99	N	31.8	Very low	35.1	Very low	149 Å²	149	142.7 Å²	142.7	80%	0.797	76%	0.76	S	S	*	*			cis	53.9	78.5	35.3	-163.6	30.2	0	0	0	115.1
100	A	35.1	Very low	35.7	Very low	74 Å²	74	145.7 Å²	145.7	61%	0.612	76%	0.762	S	S	*	*				-178.9	139.7	126	0	0	0	0	0	110.9
101	Q	36	Very low	35.9	Very low	185 Å²	185	142.5 Å²	142.5	86%	0.864	76%	0.757	S	S	*	*			trans	45.5	144.8	130.3	-60	168.3	10.5	0	0	120.4
102	S	36.8	Very low	36.4	Very low	111 Å²	111	146.4 Å²	146.4	78%	0.776	77%	0.765	S	S	*	*			cis	-174.6	171.7	-6.3	50.3	0	0	0	0	109.3
103	G	37	Very low	37.2	Very low	68 Å²	68	147.3 Å²	147.3	70%	0.701	77%	0.77	S	S	*	*			trans	79.7	117.5	165.8	0	0	0	0	0	115.1
104	S	35.7	Very low	38.1	Very low	128 Å²	128	146 Å²	146	90%	0.895	77%	0.772	S	S	*	*			cis	95.1	139.6	36.4	-62.9	0	0	0	0	114.8
105	S	36.2	Very low	38.6	Very low	109 Å²	109	144.5 Å²	144.5	76%	0.762	77%	0.774	S	S	*	*			trans	81.8	97.7	161.5	-153	0	0	0	0	119.8
106	S	36.9	Very low	39.2	Very low	90 Å²	90	140.1 Å²	140.1	63%	0.629	78%	0.78	S	S	*	*			trans	-24.2	151.6	141.1	46.2	0	0	0	0	118.1
107	H	39.4	Very low	40	Very low	177 Å²	177	139.7 Å²	139.7	82%	0.819	78%	0.784	S	S	*	*				-175.2	151.3	104.2	-96.2	80.1	0	0	0	113.5
108	H	41.3	Very low	40.7	Very low	178 Å²	178	142.8 Å²	142.8	82%	0.824	79%	0.794	S	S	*	*			trans	-77.1	178.2	161.5	-78.1	-55.2	0	0	0	110
109	P	48.4	Very low	41	Very low	100 Å²	100	134.6 Å²	134.6	65%	0.649	79%	0.786	S	S	*	*			cis	-153	-169.1	26.1	40.5	-15.6	0	0	0	119.4
110	H	40.8	Very low	41.3	Very low	162 Å²	162	135.5 Å²	135.5	75%	0.75	79%	0.79	S	S	*	*			trans	73.8	108	152.7	-68.9	-50.7	0	0	0	123.9
111	Q	40.1	Very low	41.8	Very low	165 Å²	165	138.1 Å²	138.1	77%	0.771	80%	0.799	S	S	*	*				24.8	128.5	125.5	-63	-178.6	-6.1	0	0	120.9
112	R	40.6	Very low	42.2	Very low	243 Å²	243	136.6 Å²	136.6	92%	0.917	80%	0.796	S	S	*	*				-163.9	176.9	107.1	-103.4	163.2	-167.6	-97.5	-1.7	112.4
113	Y	46.4	Very low	42.7	Very low	229 Å²	229	136.3 Å²	136.3	90%	0.898	79%	0.792	S	S	*	*			trans	-105.6	-178	-159.6	-107.5	-47.5	0	0	0	112.9
114	P	53.2	Low	42.7	Very low	109 Å²	109	137.6 Å²	137.6	71%	0.708	79%	0.79	S	S	*	*			trans	-116.8	-178.1	-133.9	44	-31.2	0	0	0	115.3
115	S	43.8	Very low	42.8	Very low	128 Å²	128	137 Å²	137	90%	0.895	78%	0.782	S	S	*	*			trans	-154	161	154	-79.5	0	0	0	0	110.6
116	G	44.5	Very low	42.8	Very low	72 Å²	72	139.7 Å²	139.7	74%	0.742	79%	0.786	S	S	*	*			trans	-104.1	-147.1	-164.1	0	0	0	0	0	116.7
117	P	50.2	Low	42.9	Very low	125 Å²	125	140.8 Å²	140.8	81%	0.812	79%	0.789	S	S	*	*			trans	-127.5	164.5	-134.4	41.4	-27.5	0	0	0	116.6
118	T	45	Very low	42.9	Very low	152 Å²	152	136.8 Å²	136.8	93%	0.933	78%	0.781	S	S	*	*			trans	-172.9	153.1	156.5	18.8	0	0	0	0	111.9
119	G	41.4	Very low	42.9	Very low	72 Å²	72	137.3 Å²	137.3	74%	0.742	78%	0.784	S	S	*	*			trans	81.7	113.2	171.7	0	0	0	0	0	113.9
120	D	39	Very low	42.4	Very low	168 Å²	168	137 Å²	137	90%	0.898	79%	0.789	S	S	*	*			cis	78.3	152.4	25.1	-146.8	-2.2	0	0	0	115
121	V	45.3	Very low	42.3	Very low	129 Å²	129	137.5 Å²	137.5	78%	0.782	80%	0.798	S	S	*	*			trans	100.4	105.8	-171.7	-177.5	0	0	0	0	116.5
122	D	43.6	Very low	42.2	Very low	153 Å²	153	133.2 Å²	133.2	82%	0.818	80%	0.798	S	S	*	*			trans	-92.3	152.3	159.7	-138.2	-4.8	0	0	0	109.5
123	P	48.8	Very low	42.2	Very low	106 Å²	106	127.3 Å²	127.3	69%	0.688	79%	0.791	S	S	*	*			trans	-148.4	110.4	135.5	32.1	-12.6	0	0	0	116.7
124	S	36.9	Very low	41.8	Very low	94 Å²	94	124.1 Å²	124.1	66%	0.657	79%	0.788	S	S	*	*				43.9	118.6	125.4	67	0	0	0	0	123
125	T	36.9	Very low	41	Very low	117 Å²	117	129.6 Å²	129.6	72%	0.718	80%	0.795	S	S	*	*				78.1	116	122.6	-52.9	0	0	0	0	122.3	V127	T125-V127 HydrophobicContact CG2-CG2 3.68Å
126	L	37.3	Very low	41	Very low	165 Å²	165	128.9 Å²	128.9	86%	0.864	79%	0.787	S	S	*	*			trans	-163.3	113.8	144	-97.4	165.7	0	0	0	105.4
127	V	38.4	Very low	40.9	Very low	112 Å²	112	131.7 Å²	131.7	68%	0.679	79%	0.79	S	S	*	*			cis	64.7	98.1	42.4	-174.7	0	0	0	0	114.2	T125	T125-V127 HydrophobicContact CG2-CG2 3.68Å
128	S	38.2	Very low	40.1	Very low	93 Å²	93	132 Å²	132	65%	0.65	79%	0.785	S	S	*	*			trans	-176.8	125.3	131.1	-86	0	0	0	0	114.8
129	Q	41.5	Very low	39.8	Very low	190 Å²	190	132.3 Å²	132.3	89%	0.888	78%	0.776	S	S	*	*			trans	64.6	154.4	138.9	-55	177.5	12.7	0	0	119
130	A	39.5	Very low	39.8	Very low	93 Å²	93	133.5 Å²	133.5	77%	0.769	77%	0.769	S	S	*	*			cis	-137.6	162.6	6.4	0	0	0	0	0	113
131	N	38.7	Very low	40.1	Very low	173 Å²	173	132.8 Å²	132.8	93%	0.925	76%	0.758	S	S	*	*			trans	-100.9	154.6	173.4	-63.1	-60	0	0	0	111.3
132	G	36	Very low	39.8	Very low	75 Å²	75	137.5 Å²	137.5	77%	0.773	76%	0.762	S	S	*	*			trans	170.8	110.8	167.6	0	0	0	0	0	116.1
133	P	40.6	Very low	39.5	Very low	119 Å²	119	133.8 Å²	133.8	77%	0.773	76%	0.759	S	S	*	*			trans	-103.1	-164.8	174.5	39.5	-33.5	0	0	0	113.2
134	L	38.3	Very low	39.1	Very low	161 Å²	161	132.3 Å²	132.3	84%	0.843	76%	0.764	S	S	*	*			trans	80.5	152.3	-178	-47	169	0	0	0	113.9
135	R	37.4	Very low	39.2	Very low	225 Å²	225	137.8 Å²	137.8	85%	0.849	78%	0.778	S	S	*	*			cis	-156	168.6	-20.5	-117.2	-174.2	101.1	161.4	4.5	107.3
136	P	43.7	Very low	39.3	Very low	112 Å²	112	135.4 Å²	135.4	73%	0.727	78%	0.777	S	S	*	*			trans	-91.9	144.1	-177.9	35.2	-33.2	0	0	0	114.7
137	T	43	Very low	39.6	Very low	132 Å²	132	133.2 Å²	133.2	81%	0.81	77%	0.766	S	S	*	*			trans	-142.5	113.9	160.4	49.9	0	0	0	0	105.7
138	N	33.5	Very low	39.5	Very low	132 Å²	132	140.4 Å²	140.4	71%	0.706	78%	0.781	S	S	*	*				67.1	145.5	59.6	-160.9	37.5	0	0	0	113.6
139	E	37.9	Very low	39.3	Very low	158 Å²	158	139.5 Å²	139.5	74%	0.738	78%	0.775	S	S	*	*			trans	74.6	140.5	165.3	-89.1	174.8	-98.4	0	0	118.3
140	T	42.2	Very low	39.1	Very low	96 Å²	96	141.7 Å²	141.7	59%	0.589	78%	0.775	S	S	*	*			cis	-162.4	168.6	2.9	-161.5	0	0	0	0	115.4
141	K	43.5	Very low	39.2	Very low	153 Å²	153	141.2 Å²	141.2	67%	0.665	78%	0.779	S	S	*	*			trans	82.2	109.4	156.9	-71	162.4	-162.8	160.7	0	122.5
142	R	40.1	Very low	39.1	Very low	229 Å²	229	139 Å²	139	86%	0.864	78%	0.776	S	S	*	*				71	139	129.6	-55.8	172.6	-166.5	-71.8	1.5	118.5
143	G	38.2	Very low	39.2	Very low	75 Å²	75	140.2 Å²	140.2	77%	0.773	78%	0.778	S	S	*	*			cis	168.9	161.5	-6.3	0	0	0	0	0	113
144	G	39.5	Very low	39.2	Very low	75 Å²	75	137.9 Å²	137.9	77%	0.773	78%	0.776	S	S	*	*			trans	86.4	128.4	-172.8	0	0	0	0	0	111.8
145	H	38.1	Very low	39.1	Very low	208 Å²	208	142.5 Å²	142.5	96%	0.963	78%	0.782	S	S	*	*			cis	75.6	114.9	14.2	-141.7	-52.2	0	0	0	115.5
146	G	39.1	Very low	38.8	Very low	67 Å²	67	143.6 Å²	143.6	69%	0.691	79%	0.787	S	S	*	*			trans	126.7	80.1	-169.5	0	0	0	0	0	109.2
147	D	43.3	Very low	38.5	Very low	119 Å²	119	145.5 Å²	145.5	64%	0.636	79%	0.786	S	S	*	*				72.5	100.4	79.3	-171.2	25.8	0	0	0	114.1	S149	D147-S149 PolarHBondContact OD1-N 2.99Å; D147-S149 PolarHBondContact OD1-OG 3.27Å
148	W	36.5	Very low	38.2	Very low	263 Å²	263	146.4 Å²	146.4	100%	0.996	77%	0.774	S	S	*	*			trans	-136.5	60.1	146.9	-89.1	-18.1	0	0	0	110.1
149	S	35.2	Very low	38.2	Very low	75 Å²	75	146.2 Å²	146.2	52%	0.524	78%	0.783	S	S	.	*			trans	-72.3	145.5	147.4	65.7	0	0	0	0	109.1	D147	D147-S149 PolarHBondContact OD1-N 2.99Å; D147-S149 PolarHBondContact OD1-OG 3.27Å
150	R	37.6	Very low	38.3	Very low	236 Å²	236	147.5 Å²	147.5	89%	0.891	78%	0.783	S	S	*	*			trans	81.3	103.1	178.5	-52.8	160.1	165.2	-88.1	-5	116.6
151	G	40.4	Very low	38.1	Very low	82 Å²	82	148.8 Å²	148.8	85%	0.845	80%	0.795	S	S	*	*			trans	-151.7	37.3	167.5	0	0	0	0	0	112.3
152	C	36.5	Very low	37.8	Very low	128 Å²	128	144.4 Å²	144.4	87%	0.865	79%	0.794	S	S	*	*			trans	-87.7	121	-166.7	-54.3	0	0	0	0	113.3
153	A	39.5	Very low	37.6	Very low	99 Å²	99	138.6 Å²	138.6	82%	0.818	79%	0.788	S	S	*	*			trans	-157.1	76.1	166.2	0	0	0	0	0	114
154	G	39	Very low	37.6	Very low	71 Å²	71	143.2 Å²	143.2	73%	0.732	79%	0.79	S	S	*	*	S	Bend	trans	75.6	150.2	173.7	0	0	0	0	0	115
155	W	36.4	Very low	37.4	Very low	257 Å²	257	148 Å²	148	97%	0.973	79%	0.792	S	S	*	*			cis	-118.8	134.8	1.6	-78.7	54.4	0	0	0	111.1
156	R	32.1	Very low	37.4	Very low	249 Å²	249	142.5 Å²	142.5	94%	0.94	78%	0.777	S	S	*	*			trans	-146.7	89.6	168.7	-94.1	-169.5	174.2	-101	4	110.7
157	Q	37.9	Very low	37.4	Very low	152 Å²	152	146.2 Å²	146.2	71%	0.71	78%	0.781	S	S	*	*			trans	-158	134.9	164.4	-77.8	-165	10.9	0	0	107.8
158	R	35.1	Very low	37.2	Very low	151 Å²	151	147.7 Å²	147.7	57%	0.57	79%	0.787	S	S	*	*			cis	-140.2	150	-14.9	-77.2	119.6	-178.6	-70.5	-3	108.2	Y160	R158-Y160 HydrophobicContact CB-CD2 3.85Å; R158-Y160 HydrophobicContact CB-CE2 4.02Å; R158-Y160 HydrophobicContact CG-CD2 4.37Å; R158-Y160 HydrophobicContact CG-CE2 4.01Å; R158-Y160 PolarHBondContact NH1-OH 2.91Å; R158-Y160 VanDerWaalsContact NH1-OH 3.07Å
159	S	34.6	Very low	37.2	Very low	127 Å²	127	143.7 Å²	143.7	89%	0.888	78%	0.777	S	S	*	*			trans	-81.7	130.5	151	-56.2	0	0	0	0	107.8
160	Y	40.5	Very low	37.3	Very low	186 Å²	186	151.1 Å²	151.1	73%	0.729	80%	0.795	S	S	*	*			trans	-126.9	138.1	166.1	-94.5	-67.9	0	0	0	109.4	R158	R158-Y160 HydrophobicContact CB-CD2 3.85Å; R158-Y160 HydrophobicContact CB-CE2 4.02Å; R158-Y160 HydrophobicContact CG-CD2 4.37Å; R158-Y160 HydrophobicContact CG-CE2 4.01Å; R158-Y160 PolarHBondContact NH1-OH 2.91Å; R158-Y160 VanDerWaalsContact NH1-OH 3.07Å
161	S	37.2	Very low	37.2	Very low	122 Å²	122	148.5 Å²	148.5	85%	0.853	79%	0.787	S	S	*	*			trans	-101.2	155.1	165.4	-54.2	0	0	0	0	109
162	G	36.9	Very low	36.8	Very low	62 Å²	62	151.7 Å²	151.7	64%	0.639	78%	0.784	S	S	*	*			trans	110.4	113.1	-169.5	0	0	0	0	0	109.1
163	S	35.4	Very low	36.6	Very low	106 Å²	106	153.9 Å²	153.9	74%	0.741	78%	0.781	S	S	*	*			cis	95.3	141.6	49.9	66	0	0	0	0	111.4
164	E	39.3	Very low	36.5	Very low	172 Å²	172	155 Å²	155	80%	0.804	78%	0.783	S	S	*	*			trans	74.2	108.1	-177.3	-60.5	161.6	-148.5	0	0	112.7
165	Q	35.3	Very low	36.4	Very low	177 Å²	177	159.4 Å²	159.4	83%	0.827	79%	0.79	S	S	*	*				73.5	136.7	95.3	-107.7	69.5	8.6	0	0	112.7
166	S	38.7	Very low	36.4	Very low	91 Å²	91	156.6 Å²	156.6	64%	0.636	79%	0.788	S	S	*	*			cis	-154.5	151.2	27.9	54.4	0	0	0	0	114.2
167	D	38.8	Very low	36.6	Very low	146 Å²	146	156.8 Å²	156.8	78%	0.781	79%	0.788	S	S	*	*			trans	58.1	143.8	151.3	-48.1	-25.7	0	0	0	119.8
168	I	37.9	Very low	36.6	Very low	149 Å²	149	153.3 Å²	153.3	76%	0.764	79%	0.793	S	S	*	*			cis	-123.8	132.7	18.7	-66	163.1	0	0	0	111.2
169	F	36.3	Very low	36.7	Very low	179 Å²	179	158.5 Å²	158.5	79%	0.785	81%	0.813	S	S	*	*			trans	-125.1	124.8	166.3	-99.8	-89	0	0	0	109.7	Y171	F169-Y171 HydrophobicContact CB-CD2 4.41Å; F169-Y171 AromaticContact CD1-CD2 3.78Å; F169-Y171 HydrophobicContact CD1-CD2 3.78Å; F169-Y171 AromaticContact CD1-CE2 3.95Å; F169-Y171 HydrophobicContact CD1-CE2 3.95Å; F169-Y171 HydrophobicContact CE1-CD2 4.44Å; F169-Y171 HydrophobicContact CE1-CE2 4.14Å; F169-Y171 HydrophobicContact CG-CD2 4.39Å; F169-Y171 PolarHBondContact O-N 3.43Å
170	Y	37.2	Very low	36.9	Very low	232 Å²	232	156 Å²	156	91%	0.91	81%	0.808	S	S	*	*			trans	-89.7	79	164.2	-105.8	-81.5	0	0	0	110.4
171	Y	35.8	Very low	37	Very low	181 Å²	181	155.5 Å²	155.5	71%	0.71	82%	0.817	S	S	*	*			trans	-82	131.6	166.8	-111.6	-83.7	0	0	0	109.8	F169	F169-Y171 HydrophobicContact CB-CD2 4.41Å; F169-Y171 AromaticContact CD1-CD2 3.78Å; F169-Y171 HydrophobicContact CD1-CD2 3.78Å; F169-Y171 AromaticContact CD1-CE2 3.95Å; F169-Y171 HydrophobicContact CD1-CE2 3.95Å; F169-Y171 HydrophobicContact CE1-CD2 4.44Å; F169-Y171 HydrophobicContact CE1-CE2 4.14Å; F169-Y171 HydrophobicContact CG-CD2 4.39Å; F169-Y171 PolarHBondContact O-N 3.43Å
172	N	32.2	Very low	37.2	Very low	149 Å²	149	153.6 Å²	153.6	80%	0.797	82%	0.817	S	S	*	*			trans	-118.9	57.5	-176	-159	-6.7	0	0	0	112.9
173	H	32.4	Very low	37.4	Very low	173 Å²	173	159.4 Å²	159.4	80%	0.801	83%	0.827	S	S	*	*			trans	-143	107.7	178.3	-75.9	-11	0	0	0	112
174	S	37.1	Very low	38.1	Very low	123 Å²	123	159.1 Å²	159.1	86%	0.86	82%	0.823	S	S	*	*			trans	-154.5	81.4	163.1	56.1	0	0	0	0	113.7
175	N	36.6	Very low	38.1	Very low	163 Å²	163	155.3 Å²	155.3	87%	0.872	82%	0.815	S	S	*	*			trans	-94.9	93.2	159.8	-96.2	-51.5	0	0	0	109.3
176	H	37.6	Very low	38.3	Very low	199 Å²	199	153.2 Å²	153.2	92%	0.921	81%	0.81	S	S	*	*			trans	-152.7	148.5	162.9	-97.8	-67.3	0	0	0	113.4
177	R	35.5	Very low	38.5	Very low	253 Å²	253	156.4 Å²	156.4	96%	0.955	81%	0.814	S	S	*	*			trans	-88.3	141.8	-179.6	-65.5	173.7	169.4	-176.7	-4.9	111.7
178	G	37.7	Very low	39.2	Very low	79 Å²	79	155 Å²	155	81%	0.814	81%	0.811	S	S	*	*			trans	-143.8	148.9	161.2	0	0	0	0	0	109.8
179	R	38.3	Very low	39.5	Very low	259 Å²	259	155.5 Å²	155.5	98%	0.977	82%	0.815	S	S	*	*			trans	-105.7	147.3	-177.7	-71.4	-171.8	-179	-90.9	11.9	112
180	G	38.9	Very low	40	Very low	76 Å²	76	150.7 Å²	150.7	78%	0.784	82%	0.816	S	S	*	*			trans	-150.4	108.4	169.2	0	0	0	0	0	111.7
181	N	41.6	Very low	40.3	Very low	174 Å²	174	146.3 Å²	146.3	93%	0.93	81%	0.809	S	S	*	*			trans	-27.4	138.1	-174.6	-59.8	-13.6	0	0	0	120.8
182	G	40.9	Very low	40.8	Very low	83 Å²	83	144.1 Å²	144.1	86%	0.856	81%	0.814	S	S	*	*			trans	-158.7	135.3	157.7	0	0	0	0	0	109.3
183	H	41.7	Very low	41.2	Very low	184 Å²	184	140.4 Å²	140.4	85%	0.852	81%	0.811	S	S	*	*			trans	-126.4	165.4	-162.6	-155.5	-126.6	0	0	0	110
184	P	49.4	Very low	41.5	Very low	99 Å²	99	144.8 Å²	144.8	64%	0.643	82%	0.821	S	S	*	*			cis	-115	-162.1	-20.2	26	-1	0	0	0	110.7
185	S	40.1	Very low	41.6	Very low	92 Å²	92	142.4 Å²	142.4	64%	0.643	82%	0.815	S	S	*	*			cis	-159.4	154.9	20.9	-44	0	0	0	0	112.4
186	N	39.8	Very low	41.9	Very low	133 Å²	133	147 Å²	147	71%	0.711	82%	0.821	S	S	*	*			trans	50.1	145.7	146.1	-60.2	29.5	0	0	0	120.3
187	E	43.3	Very low	42.1	Very low	158 Å²	158	141 Å²	141	74%	0.738	81%	0.813	S	S	*	*			cis	-164.1	156.4	8.5	-120.1	160.9	-125.8	0	0	112.2
188	V	51.9	Low	42.6	Very low	117 Å²	117	141.5 Å²	141.5	71%	0.709	81%	0.814	S	S	*	*			trans	66.3	120.5	153	-178.6	0	0	0	0	123.8
189	D	45.7	Very low	42.9	Very low	160 Å²	160	141 Å²	141	86%	0.856	81%	0.81	S	S	*	*			trans	16.1	152.5	141	-43.6	-33.3	0	0	0	122.9
190	G	46.4	Very low	43.4	Very low	78 Å²	78	141.3 Å²	141.3	80%	0.804	81%	0.811	S	S	*	*			cis	174.7	-161.9	9.7	0	0	0	0	0	109.9
191	N	43	Very low	43.7	Very low	140 Å²	140	141.4 Å²	141.4	75%	0.749	81%	0.812	S	S	*	*			cis	-173.4	133.2	-20.2	178.1	39.1	0	0	0	112.9
192	T	46	Very low	43.9	Very low	135 Å²	135	139.4 Å²	139.4	83%	0.828	81%	0.811	S	S	*	*			trans	57.6	163.2	170	53.5	0	0	0	0	120.8
193	G	41	Very low	44	Very low	71 Å²	71	138.8 Å²	138.8	73%	0.732	81%	0.805	S	S	*	*			cis	164.1	126.9	-15.4	0	0	0	0	0	118.1
194	R	38.2	Very low	44.1	Very low	264 Å²	264	141.2 Å²	141.2	100%	0.996	81%	0.807	S	S	*	*			trans	55.1	128.9	155.2	-61.1	-174	-179.4	-134.8	1.1	124.8
195	G	40.7	Very low	43.9	Very low	73 Å²	73	145.9 Å²	145.9	75%	0.753	82%	0.82	S	S	*	*			trans	144.1	152.8	149.4	0	0	0	0	0	114.8
196	R	41.5	Very low	44	Very low	261 Å²	261	144.7 Å²	144.7	99%	0.985	82%	0.822	S	S	*	*			cis	160.2	120.6	-22.3	-110.3	-164.3	-170.4	-111.7	11.2	107.2
197	G	42.1	Very low	44	Very low	73 Å²	73	145.7 Å²	145.7	75%	0.753	83%	0.827	S	S	*	*			trans	145.3	116.5	149.3	0	0	0	0	0	123.6
198	R	46.7	Very low	43.9	Very low	262 Å²	262	144.2 Å²	144.2	99%	0.989	83%	0.829	S	S	*	*			trans	45.9	145.7	136	-46.1	-179.2	-173.9	-147.6	0.1	121.7
199	G	43.5	Very low	43.2	Very low	70 Å²	70	146.3 Å²	146.3	72%	0.722	83%	0.831	S	S	*	*			cis	149.2	154.1	-11	0	0	0	0	0	116.1
200	R	49.2	Very low	42.8	Very low	264 Å²	264	147.6 Å²	147.6	100%	0.996	82%	0.824	S	S	*	*			trans	76.7	154.7	176	-51.8	176.4	-178	-106.8	-1.1	116.1
201	G	44.6	Very low	42.3	Very low	78 Å²	78	150.9 Å²	150.9	80%	0.804	82%	0.818	S	S	*	*			cis	155.9	169.5	-2.9	0	0	0	0	0	111.4
202	S	46.6	Very low	42.4	Very low	132 Å²	132	149.2 Å²	149.2	92%	0.923	82%	0.815	S	S	*	*			cis	-176.5	135.7	-13.6	-166.1	0	0	0	0	113
203	G	42.6	Very low	42	Very low	70 Å²	70	149.7 Å²	149.7	72%	0.722	82%	0.817	S	S	*	*			trans	94.8	175.6	162.9	0	0	0	0	0	118.5
204	R	43.5	Very low	41.8	Very low	235 Å²	235	150 Å²	150	89%	0.887	82%	0.82	S	S	*	*			cis	-173.2	175.3	-24	-130.2	-178.7	-170.8	-109.6	1.9	110.6
205	Q	45.7	Very low	41.8	Very low	197 Å²	197	141.1 Å²	141.1	92%	0.921	81%	0.811	S	S	*	*			trans	78.4	152.5	172.5	-45.8	-177.5	51.7	0	0	116.4
206	G	41.2	Very low	41.6	Very low	67 Å²	67	141 Å²	141	69%	0.691	81%	0.81	S	S	*	*			cis	175.6	135.9	-10.5	0	0	0	0	0	116
207	L	41.2	Very low	41.2	Very low	154 Å²	154	138.1 Å²	138.1	81%	0.806	81%	0.808	S	S	*	*			trans	34.8	130.4	149.1	-86.8	70.9	0	0	0	123.3
208	T	41.5	Very low	40.9	Very low	127 Å²	127	140.1 Å²	140.1	78%	0.779	81%	0.81	S	S	*	*			trans	67.2	170.7	143.6	67.3	0	0	0	0	117.3
209	H	37.2	Very low	40.3	Very low	162 Å²	162	135.9 Å²	135.9	75%	0.75	80%	0.801	S	S	*	*			cis	-142.7	-177.5	-0.8	-159.7	-122	0	0	0	112.5
210	R	35.9	Very low	40	Very low	187 Å²	187	138.7 Å²	138.7	71%	0.706	81%	0.805	S	S	*	*			trans	-61.6	163.4	178.4	-79.4	171	152.9	-148.2	10	117.1
211	E	36.4	Very low	39.4	Very low	146 Å²	146	131.5 Å²	131.5	68%	0.682	80%	0.795	S	S	*	*			trans	89.2	158.6	135.8	-86.9	178.1	-116.5	0	0	121.7
212	P	45.9	Very low	39	Very low	105 Å²	105	131.9 Å²	131.9	68%	0.682	80%	0.798	S	S	*	*			trans	-140.4	-143.4	-138.6	33.1	-4.1	0	0	0	113
213	V	37.9	Very low	38.5	Very low	145 Å²	145	128.7 Å²	128.7	88%	0.879	79%	0.786	S	S	*	*			trans	79	138.7	162.3	-179.1	0	0	0	0	117.5
214	G	36.1	Very low	38.3	Very low	77 Å²	77	133.1 Å²	133.1	79%	0.794	79%	0.794	S	S	*	*			trans	107.6	139	166.9	0	0	0	0	0	114.1
215	G	37.7	Very low	37.7	Very low	79 Å²	79	126.5 Å²	126.5	81%	0.814	79%	0.789	S	S	*	*			cis	165.2	157.9	-4.9	0	0	0	0	0	112.1
216	G	36.7	Very low	37.3	Very low	70 Å²	70	123 Å²	123	72%	0.722	79%	0.785	S	S	*	*			trans	83.1	127	-175.7	0	0	0	0	0	112.1
217	Q	33.7	Very low	36.8	Very low	201 Å²	201	131.1 Å²	131.1	94%	0.939	80%	0.795	S	S	*	*			cis	61.5	107.5	34.8	-48.9	-175.8	0.2	0	0	114.1
218	S	35.8	Very low	36.6	Very low	115 Å²	115	129.1 Å²	129.1	80%	0.804	79%	0.791	S	S	*	*				-166.2	161.2	107.9	-156.2	0	0	0	0	113.4
219	Q	33.8	Very low	36.3	Very low	173 Å²	173	127.7 Å²	127.7	81%	0.808	79%	0.792	S	S	*	*			trans	-68.9	146.7	-177.6	-51.8	149.1	5.5	0	0	113.6
220	T	38	Very low	36	Very low	129 Å²	129	124.9 Å²	124.9	79%	0.791	79%	0.791	S	S	*	*			trans	177.9	115	135.1	39.8	0	0	0	0	106.8
221	S	34.9	Very low	35.9	Very low	113 Å²	113	121.6 Å²	121.6	79%	0.79	80%	0.795	S	S	*	*				77.5	111	59.8	76.4	0	0	0	0	114
222	G	37.6	Very low	35.5	Very low	85 Å²	85	120.8 Å²	120.8	88%	0.876	80%	0.795	S	S	*	*			trans	98.7	142.7	-176.5	0	0	0	0	0	112.6
223	G	36.5	Very low	35	Very low	65 Å²	65	122 Å²	122	67%	0.67	80%	0.8	S	S	*	*			cis	174.7	156	-5.8	0	0	0	0	0	111.3
224	N	37.2	Very low	34.7	Very low	164 Å²	164	121.1 Å²	121.1	88%	0.877	79%	0.79	S	S	*	*			trans	66.6	126.1	-179.4	-48.1	-24	0	0	0	114.1
225	A	32	Very low	34.8	Very low	95 Å²	95	123.8 Å²	123.8	79%	0.785	79%	0.791	S	S	*	*			cis	81.2	55.6	15.5	0	0	0	0	0	117.5
226	C	35.7	Very low	34.7	Very low	125 Å²	125	126 Å²	126	85%	0.845	79%	0.792	S	S	*	*			trans	-133	123.7	147.2	-74.9	0	0	0	0	106.1
227	R	31.4	Very low	34.4	Very low	236 Å²	236	126.2 Å²	126.2	89%	0.891	79%	0.794	S	S	*	*			cis	66.7	144.2	18.2	-95.9	-165.1	177.1	-119.3	-0.9	114.3
228	P	38.1	Very low	34.3	Very low	113 Å²	113	119.9 Å²	119.9	73%	0.734	78%	0.782	S	S	*	*				-135.5	164	-107	39.4	-23.5	0	0	0	116
229	A	34.2	Very low	34.2	Very low	97 Å²	97	123.3 Å²	123.3	80%	0.802	79%	0.785	S	S	*	*			trans	-141.2	137.4	157.1	0	0	0	0	0	108
230	S	31.3	Very low	34	Very low	103 Å²	103	121.3 Å²	121.3	72%	0.72	78%	0.779	S	S	*	*			cis	78.9	80.2	16.2	-159.7	0	0	0	0	116.6
231	C	33.1	Very low	33.6	Very low	117 Å²	117	120.8 Å²	120.8	79%	0.791	77%	0.772	S	S	*	*			trans	-143.1	123.6	134.9	50.5	0	0	0	0	106
232	L	28.1	Very low	33.6	Very low	130 Å²	130	122.2 Å²	122.2	68%	0.681	77%	0.766	S	S	*	*			cis	52	69.2	6	-155.2	78.1	0	0	0	115.8
233	V	34.7	Very low	33.3	Very low	131 Å²	131	125.4 Å²	125.4	79%	0.794	76%	0.758	S	S	*	*			trans	-133.6	97.5	130.5	175.1	0	0	0	0	103.4
234	D	33	Very low	33.2	Very low	125 Å²	125	128.3 Å²	128.3	67%	0.668	76%	0.763	S	S	*	*				60.9	119.9	87.1	-74.5	-37	0	0	0	114.6
235	T	36.9	Very low	33.1	Very low	133 Å²	133	129.5 Å²	129.5	82%	0.816	76%	0.76	S	S	*	*			trans	-69	153.2	170.5	0.4	0	0	0	0	111
236	P	36.8	Very low	33.4	Very low	127 Å²	127	133.1 Å²	133.1	83%	0.825	77%	0.767	S	S	*	*				-128.6	177.6	66.5	13.1	11.1	0	0	0	112.7
237	G	30.3	Very low	33.2	Very low	74 Å²	74	131 Å²	131	76%	0.763	77%	0.766	S	S	*	*			cis	129.7	125.5	7.5	0	0	0	0	0	110.9
238	G	31.5	Very low	33.2	Very low	67 Å²	67	131.4 Å²	131.4	69%	0.691	77%	0.768	S	S	*	*			trans	116.6	110.6	-167.4	0	0	0	0	0	109.7
239	Q	32.3	Very low	33.1	Very low	187 Å²	187	133.5 Å²	133.5	87%	0.874	77%	0.771	S	S	*	*				55.9	128.8	85.6	-63.1	-159.4	55.1	0	0	112.3
240	L	30.1	Very low	33.1	Very low	131 Å²	131	139.5 Å²	139.5	69%	0.686	77%	0.774	S	S	*	*			cis	-161.6	142.6	45.9	-171.2	65.9	0	0	0	113.3
241	N	30.8	Very low	33.2	Very low	118 Å²	118	140.4 Å²	140.4	63%	0.631	78%	0.781	S	S	*	*			trans	58.7	125.8	150.8	-79	-12.3	0	0	0	124.9
242	Q	33.5	Very low	33.7	Very low	144 Å²	144	143.9 Å²	143.9	67%	0.673	78%	0.783	S	S	*	*				101.3	114.6	120.6	-78.5	-176.1	120.4	0	0	123.3
243	Q	31.2	Very low	34.2	Very low	152 Å²	152	143.2 Å²	143.2	71%	0.71	79%	0.789	S	S	*	*			trans	86.9	153.6	131.2	-67.8	-172.8	38.9	0	0	121.6
244	T	35.5	Very low	34.4	Very low	125 Å²	125	146.7 Å²	146.7	77%	0.767	79%	0.794	S	S	*	*			trans	65.6	115.4	-176	67.1	0	0	0	0	114.6
245	K	34.6	Very low	34.7	Very low	189 Å²	189	145.5 Å²	145.5	82%	0.822	79%	0.794	S	S	*	*			cis	87.7	146.3	45.2	-71.4	-176.7	175.9	178.5	0	112.9
246	N	37.6	Very low	35.3	Very low	172 Å²	172	144.6 Å²	144.6	92%	0.92	79%	0.793	S	S	*	*			trans	73.6	134.3	-172.4	-44.4	-18.6	0	0	0	112.7
247	G	31.6	Very low	35.8	Very low	81 Å²	81	144.6 Å²	144.6	84%	0.835	79%	0.786	S	S	*	*			cis	166	89.2	-6.2	0	0	0	0	0	110.7
248	R	33	Very low	36.9	Very low	244 Å²	244	144.2 Å²	144.2	92%	0.921	77%	0.77	S	S	*	*			trans	-132.7	95.1	-178.8	-174.2	175.3	-73	-174.6	-2.7	111.2
249	I	35.3	Very low	37.7	Very low	157 Å²	157	145 Å²	145	81%	0.805	76%	0.764	S	S	*	*			trans	-117.9	113.9	167.6	-60.4	172	0	0	0	106.1
250	Y	35	Very low	38.3	Very low	222 Å²	222	142.9 Å²	142.9	87%	0.871	77%	0.766	S	S	*	*			trans	174.6	78.3	148.1	-97.8	-63.2	0	0	0	108.3
251	S	33.4	Very low	39.3	Very low	123 Å²	123	140 Å²	140	86%	0.86	77%	0.768	S	S	*	*			trans	-119.7	93.1	173	-56.1	0	0	0	0	108.7
252	K	42.7	Very low	39.9	Very low	189 Å²	189	140.6 Å²	140.6	82%	0.822	77%	0.765	S	S	*	*			trans	-123.3	131.9	162.4	-82.4	-172.9	173.8	-178.8	0	107.9	F254	K252-F254 PolarHBondContact O-N 2.93Å
253	S	38.3	Very low	40.6	Very low	117 Å²	117	141 Å²	141	82%	0.818	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-66.2	120.8	-175.1	47.8	0	0	0	0	111.5
254	F	38.7	Very low	41	Very low	204 Å²	204	139.4 Å²	139.4	90%	0.895	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-91.3	118.2	159.3	-73	-85.9	0	0	0	108.1	K252	K252-F254 PolarHBondContact O-N 2.93Å
255	C	39.7	Very low	41.4	Very low	99 Å²	99	139.2 Å²	139.2	67%	0.669	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-67.7	159.3	169.3	-62.7	0	0	0	0	110.1	D257	C255-D257 PolarHBondContact O-N 2.6Å
256	S	48.5	Very low	41.6	Very low	115 Å²	115	138 Å²	138	80%	0.804	77%	0.769	S	S	*	*	S	Bend	trans	-74.3	9.3	-173.8	-50.7	0	0	0	0	115.3
257	D	48.5	Very low	41.6	Very low	127 Å²	127	138 Å²	138	68%	0.679	76%	0.764	S	S	*	*	S	Bend	trans	-99.4	147.1	-175.2	-60.6	-61	0	0	0	111.9	C255	C255-D257 PolarHBondContact O-N 2.6Å
258	P	53.9	Low	41.8	Very low	65 Å²	65	142.1 Å²	142.1	42%	0.422	76%	0.761	S	S	.	*	P	Polyproline II helix	trans	-60.5	150	169.6	23.6	-31.2	0	0	0	111.7	F262 W381	P258-F262 HydrophobicContact CB-CB 4.32Å; P258-W381 HydrophobicContact CB-CZ3 3.98Å; P258-W381 HydrophobicContact CG-CZ3 4.43Å
259	P	48.4	Very low	41.9	Very low	85 Å²	85	139.8 Å²	139.8	55%	0.552	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-60.4	140.3	171.5	26.4	-33.8	0	0	0	110.7	G261 F262	P259-G261 PolarHBondContact O-N 2.99Å; P259-F262 HydrophobicContact CG-CD2 4.07Å; P259-F262 PolarHBondContact O-N 3.43Å
260	P	44.2	Very low	41.9	Very low	141 Å²	141	137.6 Å²	137.6	92%	0.916	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.1	128.3	179	-27.2	35.2	0	0	0	112.1
261	G	50.5	Low	41.9	Very low	72 Å²	72	132.4 Å²	132.4	74%	0.742	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	112.8	-12.5	-174.1	0	0	0	0	0	114.9	P259 D263	P259-G261 PolarHBondContact O-N 2.99Å; G261-D263 PolarHBondContact O-N 3.47Å
262	F	44.7	Very low	42	Very low	129 Å²	129	134.2 Å²	134.2	57%	0.566	75%	0.75	S	S	*	*			trans	-95.4	52.7	176.7	-94.6	-86.8	0	0	0	114	P258 P259 G376	P258-F262 HydrophobicContact CB-CB 4.32Å; P259-F262 HydrophobicContact CG-CD2 4.07Å; P259-F262 PolarHBondContact O-N 3.43Å; F262-G376 WeakPolarHBondContact CE1-O 3.44Å; F262-G376 WeakPolarHBondContact CZ-O 3.26Å
263	D	47.2	Very low	41.6	Very low	154 Å²	154	133.9 Å²	133.9	82%	0.824	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-75.9	129	174.4	-84.3	-47.7	0	0	0	112.4	G261	G261-D263 PolarHBondContact O-N 3.47Å
264	L	40.1	Very low	41.5	Very low	118 Å²	118	134.1 Å²	134.1	62%	0.618	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-76.2	136.4	172.5	-75.7	169.3	0	0	0	110.7	I266	L264-I266 PolarHBondContact O-N 3.27Å; L264-I266 VanDerWaalsContact O-N 3.08Å
265	P	43.9	Very low	41.4	Very low	121 Å²	121	129.8 Å²	129.8	79%	0.786	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-57.2	117.1	171.7	-25.2	34.5	0	0	0	111.3	H267	P265-H267 PolarHBondContact O-N 3.22Å
266	I	38.7	Very low	41.2	Very low	162 Å²	162	133.8 Å²	133.8	83%	0.831	75%	0.754	S	S	*	*			trans	-68.5	96.3	176.9	-59.4	176	0	0	0	108.2	L264 E268	L264-I266 PolarHBondContact O-N 3.27Å; L264-I266 VanDerWaalsContact O-N 3.08Å; I266-E268 PolarHBondContact O-N 3.39Å
267	H	37.8	Very low	40.6	Very low	173 Å²	173	136.2 Å²	136.2	80%	0.801	76%	0.758	S	S	*	*			trans	-70.6	104.1	174.6	-164.6	-47.2	0	0	0	109	P265 K269	P265-H267 PolarHBondContact O-N 3.22Å; H267-K269 PolarHBondContact O-N 3.12Å
268	E	35.3	Very low	40.2	Very low	168 Å²	168	138 Å²	138	79%	0.785	76%	0.76	S	S	*	*			trans	-55.9	138.9	173.7	-71.3	-152.3	139.4	0	0	110.6	I266	I266-E268 PolarHBondContact O-N 3.39Å
269	K	34.2	Very low	39.3	Very low	194 Å²	194	141.8 Å²	141.8	84%	0.843	78%	0.782	S	S	*	*			trans	-97.9	113.4	-179.5	-173.5	170.7	-176.4	169.9	0	108.6	H267 S271	H267-K269 PolarHBondContact O-N 3.12Å; K269-S271 PolarHBondContact O-N 2.92Å; K269-S271 VanDerWaalsContact O-N 3.1Å
270	P	35.9	Very low	38.4	Very low	111 Å²	111	142.9 Å²	142.9	72%	0.721	79%	0.791	S	S	*	*			trans	-63.5	116.7	-175.3	24.6	-33.5	0	0	0	110.5	N272	P270-N272 PolarHBondContact O-N 3.49Å
271	S	35.1	Very low	38.2	Very low	113 Å²	113	145.1 Å²	145.1	79%	0.79	79%	0.789	S	S	*	*			trans	-92.1	83.3	177.8	39.3	0	0	0	0	110.1	K269 E273	K269-S271 PolarHBondContact O-N 2.92Å; K269-S271 VanDerWaalsContact O-N 3.1Å; S271-E273 VanDerWaalsContact C-N 3.3Å; S271-E273 PolarHBondContact O-N 3.3Å
272	N	34.9	Very low	37.4	Very low	162 Å²	162	149.2 Å²	149.2	87%	0.866	79%	0.786	S	S	*	*			trans	-68.7	85.8	167.6	-78.9	-7.7	0	0	0	110.3	P270	P270-N272 PolarHBondContact O-N 3.49Å
273	E	35.5	Very low	37.2	Very low	181 Å²	181	150 Å²	150	85%	0.846	79%	0.792	S	S	*	*			trans	-106.9	103	159.1	-73.5	-162.9	168.2	0	0	109.6	S271 S275	S271-E273 VanDerWaalsContact C-N 3.3Å; S271-E273 PolarHBondContact O-N 3.3Å; E273-S275 PolarHBondContact O-N 3.25Å
274	S	36.1	Very low	36.9	Very low	122 Å²	122	148.9 Å²	148.9	85%	0.853	79%	0.786	S	S	*	*			trans	-77.9	115.4	176.5	57.2	0	0	0	0	111.1
275	S	36.7	Very low	37.1	Very low	114 Å²	114	149.5 Å²	149.5	80%	0.797	79%	0.794	S	S	*	*			trans	-129	105.1	163.9	44.4	0	0	0	0	110.3	E273	E273-S275 PolarHBondContact O-N 3.25Å
276	F	35.1	Very low	36.8	Very low	183 Å²	183	152.2 Å²	152.2	80%	0.803	79%	0.794	S	S	*	*			trans	-60.4	137.8	159.9	-88	-102	0	0	0	108.9
277	D	36.6	Very low	37.1	Very low	166 Å²	166	150.6 Å²	150.6	89%	0.888	79%	0.786	S	S	*	*			trans	-140.4	151.2	134.4	-122.4	-36.5	0	0	0	110.6
278	K	38.7	Very low	37.4	Very low	163 Å²	163	147.8 Å²	147.8	71%	0.709	78%	0.777	S	S	*	*			trans	-109.4	144.9	-164.8	-60	171.4	-177.3	174.5	0	111.6
279	T	35.7	Very low	37.7	Very low	146 Å²	146	146.2 Å²	146.2	90%	0.896	77%	0.773	S	S	*	*			trans	-150.7	137.3	146.7	-69.8	0	0	0	0	108.9
280	C	29.9	Very low	38.2	Very low	107 Å²	107	144.3 Å²	144.3	72%	0.723	77%	0.771	S	S	*	*			trans	-99.7	146.2	-172.5	-49.6	0	0	0	0	112.1
281	Q	39.2	Very low	38.3	Very low	189 Å²	189	145.9 Å²	145.9	88%	0.883	77%	0.773	S	S	*	*				-139.4	130.5	121.4	-57.4	-164.6	21.1	0	0	105.4
282	K	35	Very low	38.7	Very low	158 Å²	158	146 Å²	146	69%	0.687	77%	0.774	S	S	*	*				58.9	128.5	73.8	-125.9	-155.8	158.3	-138.5	0	110.3
283	E	39.1	Very low	39.2	Very low	145 Å²	145	144.8 Å²	144.8	68%	0.678	77%	0.772	S	S	*	*			cis	-143.8	152.8	33.8	-73.7	170.9	149.8	0	0	114.6
284	D	41.8	Very low	39.5	Very low	131 Å²	131	141.5 Å²	141.5	70%	0.701	77%	0.767	S	S	*	*			trans	37.9	137.1	145.2	-42.3	-18	0	0	0	119.9
285	V	42.9	Very low	39.6	Very low	131 Å²	131	142.9 Å²	142.9	79%	0.794	76%	0.763	S	S	*	*				-164.1	132.5	56.4	163.6	0	0	0	0	110.9
286	F	38.8	Very low	39.9	Very low	178 Å²	178	145.5 Å²	145.5	78%	0.781	76%	0.762	S	S	*	*				35.4	137.3	128.7	-117.4	-150.3	0	0	0	120.1
287	I	43.8	Very low	40.1	Very low	128 Å²	128	144.8 Å²	144.8	66%	0.656	76%	0.761	S	S	*	*			cis	-154.2	138.4	29.5	-79.5	-176.3	0	0	0	112.5
288	D	44.1	Very low	40	Very low	114 Å²	114	141 Å²	141	61%	0.61	75%	0.747	S	S	*	*			trans	32.8	127.9	139.5	-53	0.6	0	0	0	125.9
289	N	43.5	Very low	39.8	Very low	134 Å²	134	142 Å²	142	72%	0.717	75%	0.754	S	S	*	*				75.4	153.2	119.7	-67.2	-18.1	0	0	0	122.2
290	I	43	Very low	40	Very low	155 Å²	155	140.1 Å²	140.1	80%	0.795	74%	0.744	S	S	*	*			cis	-141.9	156.7	12.1	-113.9	134.5	0	0	0	110.9
291	D	39.6	Very low	40.3	Very low	143 Å²	143	141.1 Å²	141.1	77%	0.765	75%	0.746	S	S	*	*			trans	-69.8	153.7	174.6	-62.9	-83.6	0	0	0	116
292	S	42.2	Very low	40.2	Very low	117 Å²	117	138 Å²	138	82%	0.818	74%	0.736	S	S	*	*				-179.1	102.7	127.9	-82.2	0	0	0	0	115.7
293	V	45.9	Very low	40.4	Very low	135 Å²	135	136.9 Å²	136.9	82%	0.818	74%	0.737	S	S	*	*			trans	32.8	129.1	138	-169.4	0	0	0	0	121.3
294	P	41.7	Very low	40.3	Very low	112 Å²	112	137.5 Å²	137.5	73%	0.727	75%	0.745	S	S	*	*			trans	-100.7	-175.1	-179.8	42.3	-38.5	0	0	0	114.7
295	I	38.4	Very low	40.1	Very low	152 Å²	152	135.6 Å²	135.6	78%	0.779	74%	0.742	S	S	*	*			trans	-173.7	127.8	149.5	-100.2	150.1	0	0	0	112.9
296	H	43.2	Very low	39.8	Very low	168 Å²	168	133.9 Å²	133.9	78%	0.778	74%	0.736	S	S	*	*			trans	40.7	155.2	147.9	-72.1	-94.8	0	0	0	123.2
297	H	39.2	Very low	39.8	Very low	169 Å²	169	134.1 Å²	134.1	78%	0.782	74%	0.737	S	S	*	*			cis	-168.7	-176.8	-10.5	178.9	59.6	0	0	0	109.3
298	C	33.8	Very low	39.2	Very low	86 Å²	86	133 Å²	133	58%	0.581	74%	0.74	S	S	*	*			trans	-104.2	154.8	-152.2	-46.7	0	0	0	0	117.9
299	Q	35.5	Very low	38.7	Very low	185 Å²	185	133.6 Å²	133.6	86%	0.864	75%	0.753	S	S	*	*			trans	64.6	170.7	140.4	-88.4	167.7	-40.8	0	0	118.9
300	P	38.6	Very low	38.2	Very low	105 Å²	105	134 Å²	134	68%	0.682	76%	0.761	S	S	*	*			cis	-138	179.1	21.4	39.3	-17.8	0	0	0	118.6
301	V	37.7	Very low	37.7	Very low	128 Å²	128	135.6 Å²	135.6	78%	0.776	77%	0.765	S	S	*	*			trans	47.5	140.9	159.3	-67.4	0	0	0	0	120
302	N	37.1	Very low	37.4	Very low	124 Å²	124	136.3 Å²	136.3	66%	0.663	77%	0.767	S	S	*	*			cis	-159.8	175.9	30.8	-136.1	28.2	0	0	0	112.6
303	D	38.7	Very low	36.9	Very low	135 Å²	135	137.2 Å²	137.2	72%	0.722	76%	0.763	S	S	*	*			trans	64.9	97.9	153.4	-53	-32.8	0	0	0	122.7
304	D	36	Very low	36	Very low	158 Å²	158	136.2 Å²	136.2	85%	0.845	76%	0.762	S	S	*	*				87.4	149.5	127.6	-151.5	20.5	0	0	0	122.7
305	S	39.2	Very low	35.8	Very low	91 Å²	91	139.6 Å²	139.6	64%	0.636	77%	0.765	S	S	*	*			trans	78.6	106.4	167.8	80.9	0	0	0	0	119.6
306	S	36.3	Very low	35.4	Very low	94 Å²	94	141 Å²	141	66%	0.657	77%	0.768	S	S	*	*			trans	77.9	139.9	141.1	-38.2	0	0	0	0	122.3
307	K	38	Very low	34.9	Very low	184 Å²	184	138.4 Å²	138.4	80%	0.8	77%	0.769	S	S	*	*			trans	72.7	98.2	139.2	-70.3	158.2	-169.7	163.6	0	120
308	S	31.7	Very low	34.6	Very low	105 Å²	105	135.9 Å²	135.9	73%	0.734	76%	0.76	S	S	*	*				51.1	108	125	63.2	0	0	0	0	120.2
309	S	34.4	Very low	35.1	Very low	125 Å²	125	139.2 Å²	139.2	87%	0.874	77%	0.77	S	S	*	*			trans	-156.3	136.6	141.4	-81	0	0	0	0	109.8
310	T	31.6	Very low	35.7	Very low	143 Å²	143	136.9 Å²	136.9	88%	0.877	76%	0.759	S	S	*	*			trans	-94.6	107.8	-161.4	-51.2	0	0	0	0	113.2
311	Q	33.3	Very low	36.8	Very low	189 Å²	189	136.8 Å²	136.8	88%	0.883	76%	0.758	S	S	*	*			trans	-152.3	101.7	161.3	-112.9	-176.9	37	0	0	111.9
312	I	33.2	Very low	38.5	Very low	157 Å²	157	131.9 Å²	131.9	81%	0.805	73%	0.73	S	S	*	*			trans	-146.3	97.7	165.8	20.4	175.5	0	0	0	106.1
313	N	32.6	Very low	41	Very low	136 Å²	136	129 Å²	129	73%	0.727	71%	0.712	S	S	*	*				76.5	115.9	77.4	-169.5	6.7	0	0	0	111.2	K315	N313-K315 PolarHBondContact O-N 3Å
314	S	26.9	Very low	43.7	Very low	114 Å²	114	122.6 Å²	122.6	80%	0.797	68%	0.678	S	S	*	*			trans	-66.2	113.1	-170.1	49.6	0	0	0	0	112.2
315	K	35.7	Very low	46.5	Very low	184 Å²	184	117.5 Å²	117.5	80%	0.8	65%	0.647	S	S	*	*			trans	-118.8	119.9	162.5	-72	-176.2	176.9	-179	0	108.9	N313	N313-K315 PolarHBondContact O-N 3Å
316	Q	30.2	Very low	49.2	Very low	182 Å²	182	115.7 Å²	115.7	85%	0.85	63%	0.626	S	S	*	*			trans	-53.8	140	155.2	-66.8	162.2	-8.2	0	0	107.2	I318	Q316-I318 PolarHBondContact O-N 2.9Å
317	S	33.3	Very low	52.1	Low	112 Å²	112	113.2 Å²	113.2	78%	0.783	61%	0.605	S	S	*	*			trans	-60.8	103.5	168.8	35.6	0	0	0	0	107.8	I319	S317-I319 PolarHBondContact O-N 3.3Å
318	I	33.2	Very low	54.6	Low	117 Å²	117	106 Å²	106	60%	0.6	58%	0.575	S	S	*	*			trans	-60.4	114.4	172.4	-63.9	174.1	0	0	0	105.1	Q316 H320	Q316-I318 PolarHBondContact O-N 2.9Å; I318-H320 PolarHBondContact O-CD2 3.42Å; I318-H320 PolarHBondContact O-N 2.94Å
319	I	44.2	Very low	57.3	Low	156 Å²	156	109.3 Å²	109.3	80%	0.8	58%	0.584	S	S	*	*			trans	-70.3	83.5	170.2	-56.2	174.6	0	0	0	105	S317 P321	S317-I319 PolarHBondContact O-N 3.3Å; I319-P321 WeakPolarHBondContact O-CD 3.46Å
320	H	48.8	Very low	59.9	Low	136 Å²	136	111.4 Å²	111.4	63%	0.63	58%	0.578	S	S	*	*			trans	-58.1	120.8	174.8	-75.3	-83.9	0	0	0	106.7	I318 C322	I318-H320 PolarHBondContact O-CD2 3.42Å; I318-H320 PolarHBondContact O-N 2.94Å; H320-C322 PolarHBondContact O-N 2.69Å
321	P	60.2	Low	62.7	Low	102 Å²	102	110.2 Å²	110.2	66%	0.662	57%	0.571	S	S	*	*			trans	-63	104.1	179.8	25.4	-32.6	0	0	0	107.2	I319 H323	I319-P321 WeakPolarHBondContact O-CD 3.46Å; P321-H323 PolarHBondContact O-N 3.41Å
322	C	74.1	Confident	65.5	Low	26 Å²	26	104.3 Å²	104.3	18%	0.176	55%	0.549	C	S	.	.			trans	-83.8	113.7	-169.5	-160.3	0	0	0	0	108.7	H320 R359	H320-C322 PolarHBondContact O-N 2.69Å; C322-R359 WeakPolarHBondContact SG-CB 3.29Å; C322-R359 VanDerWaalsContact SG-CD 3.54Å; C322-R359 VanDerWaalsContact SG-CG 3.51Å
323	H	90.5	Very high	68.4	Low	62 Å²	62	100.4 Å²	100.4	29%	0.287	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	157.1	167.3	-56.6	-78.5	0	0	0	110.9	P321 P336 F337 R359 D360	P321-H323 PolarHBondContact O-N 3.41Å; H323-P336 HydrophobicContact CB-CB 3.56Å; H323-F337 CarbonylContact C-O 3.58Å; H323-F337 WeakPolarHBondContact CA-O 3.4Å; H323-R359 CarbonylContact O-C 3.57Å; H323-R359 WeakPolarHBondContact O-CA 3.08Å; H323-D360 IonicContact CD2-OD2 3.83Å; H323-D360 PolarHBondContact CD2-OD2 2.95Å; H323-D360 IonicContact CG-OD2 3.15Å; H323-D360 PolarHBondContact O-N 3.25Å
324	W	93.8	Very high	71.4	Confident	1 Å²	1	97.3 Å²	97.3	0%	0.004	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	147.5	-177.9	-67	86.7	0	0	0	110.7	F337 N339 M342 I357 R358 R359 H371 P379 F380 Y384	W324-F337 PolarHBondContact N-O 2.68Å; W324-F337 PolarHBondContact O-N 3.21Å; W324-N339 PolarHBondContact NE1-OD1 3.17Å; W324-M342 HydrophobicContact CB-CE 4.25Å; W324-M342 HydrophobicContact CB-CG 3.72Å; W324-M342 HydrophobicContact CB-SD 4.17Å; W324-M342 HydrophobicContact CG-CG 3.86Å; W324-I357 HydrophobicContact CE3-CB 4.48Å; W324-I357 HydrophobicContact CE3-CD1 4.25Å; W324-I357 HydrophobicContact CZ3-CD1 3.87Å; W324-I357 HydrophobicContact CZ3-CG1 4.32Å; W324-R358 WeakPolarHBondContact CA-O 3.37Å; W324-R359 HydrophobicContact CD2-CG 3.95Å; W324-R359 HydrophobicContact CE3-CG 3.75Å; W324-R359 HydrophobicContact CH2-CG 3.4Å; W324-R359 HydrophobicContact CZ2-CG 3.61Å; W324-R359 HydrophobicContact CZ3-CG 3.48Å; W324-R359 VanDerWaalsContact CZ3-CG 3.48Å; W324-H371 AromaticContact CH2-CD2 3.78Å; W324-H371 AromaticContact CZ3-CD2 3.57Å; W324-H371 AromaticContact CZ3-NE2 3.7Å; W324-P379 HydrophobicContact CH2-CB 3.54Å; W324-P379 HydrophobicContact CZ2-CB 3.96Å; W324-P379 HydrophobicContact CZ3-CB 4.35Å; W324-F380 AromaticContact CD2-CD1 3.96Å; W324-F380 HydrophobicContact CD2-CD1 3.96Å; W324-F380 AromaticContact CD2-CE1 3.76Å; W324-F380 HydrophobicContact CD2-CE1 3.76Å; W324-F380 AromaticContact CE2-CD1 3.62Å; W324-F380 AromaticContact CE2-CE1 3.87Å; W324-F380 HydrophobicContact CE3-CD1 4.43Å; W324-F380 AromaticContact CE3-CE1 3.84Å; W324-F380 HydrophobicContact CE3-CE1 3.84Å; W324-F380 HydrophobicContact CG-CD1 4.42Å; W324-F380 HydrophobicContact CG-CE1 4.34Å; W324-F380 HydrophobicContact CH2-CD1 4.33Å; W324-F380 HydrophobicContact CH2-CE1 4.17Å; W324-F380 AromaticContact CZ2-CD1 3.83Å; W324-F380 HydrophobicContact CZ2-CD1 3.83Å; W324-F380 HydrophobicContact CZ2-CE1 4.08Å; W324-F380 HydrophobicContact CZ3-CE1 4.05Å; W324-F380 AromaticContact NE1-CD1 3.87Å; W324-Y384 HydrophobicContact CH2-CE1 4.17Å
325	Y	96	Very high	74.5	Confident	51 Å²	51	93.5 Å²	93.5	20%	0.2	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	152	163.1	-52.6	-85.3	0	0	0	110.2	T333 Q334 P336 I357 R358 D360	Y325-T333 HydrophobicContact CD1-CG2 3.97Å; Y325-T333 HydrophobicContact CG-CG2 4.06Å; Y325-Q334 CarbonylContact C-O 3.6Å; Y325-Q334 WeakPolarHBondContact CA-O 3.36Å; Y325-Q334 WeakPolarHBondContact CB-O 3.43Å; Y325-P336 HydrophobicContact CE1-CB 4.12Å; Y325-I357 CarbonylContact O-C 3.58Å; Y325-I357 VanDerWaalsContact O-CA 3.3Å; Y325-I357 WeakPolarHBondContact O-CA 3.23Å; Y325-R358 HydrophobicContact CD2-CG 4.23Å; Y325-R358 PolarHBondContact N-O 3.42Å; Y325-R358 PolarHBondContact O-N 3.23Å; Y325-D360 WeakPolarHBondContact CE2-OD1 3.28Å; Y325-D360 VanDerWaalsContact CZ-OD1 3.23Å; Y325-D360 PolarHBondContact OH-OD1 2.85Å
326	Y	96.4	Very high	77.3	Confident	53 Å²	53	88.3 Å²	88.3	21%	0.208	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	158.2	165.2	72.3	-99.1	0	0	0	111.4	D328 T333 Q334 F337 W345 L355 K356	Y326-D328 HydrophobicContact CD2-CB 4.36Å; Y326-D328 HydrophobicContact CE2-CB 3.84Å; Y326-T333 CarbonylContact O-C 3.51Å; Y326-T333 WeakPolarHBondContact O-CA 3.49Å; Y326-Q334 HydrophobicContact CD1-CB 4.16Å; Y326-Q334 HydrophobicContact CD2-CB 4.24Å; Y326-Q334 HydrophobicContact CD2-CG 4.44Å; Y326-Q334 HydrophobicContact CE1-CB 3.77Å; Y326-Q334 HydrophobicContact CE2-CB 3.86Å; Y326-Q334 HydrophobicContact CE2-CG 3.81Å; Y326-Q334 HydrophobicContact CG-CB 4.37Å; Y326-Q334 PolarHBondContact N-O 3.42Å; Y326-Q334 PolarHBondContact O-N 2.97Å; Y326-F337 AromaticContact CD1-CD2 3.92Å; Y326-F337 HydrophobicContact CD1-CD2 3.92Å; Y326-F337 AromaticContact CD1-CE2 3.58Å; Y326-F337 HydrophobicContact CD1-CE2 3.58Å; Y326-F337 AromaticContact CE1-CD2 3.97Å; Y326-F337 HydrophobicContact CE1-CD2 3.97Å; Y326-F337 AromaticContact CE1-CE2 3.29Å; Y326-F337 HydrophobicContact CE1-CE2 3.29Å; Y326-F337 HydrophobicContact CE1-CZ 4.04Å; Y326-W345 HydrophobicContact CD1-CZ3 4.48Å; Y326-W345 AromaticContact CE1-CZ3 3.87Å; Y326-W345 HydrophobicContact CE1-CZ3 3.87Å; Y326-L355 HydrophobicContact CD2-CD1 4Å; Y326-L355 HydrophobicContact CD2-CD2 4.16Å; Y326-L355 HydrophobicContact CD2-CG 4.43Å; Y326-L355 HydrophobicContact CG-CD2 4.03Å; Y326-K356 CarbonylContact C-O 3.48Å; Y326-K356 WeakPolarHBondContact CA-O 3.48Å
327	I	95.6	Very high	80.4	Confident	42 Å²	42	81.2 Å²	81.2	22%	0.215	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	123.8	171.5	-58.5	177.7	0	0	0	108.3	C332 L355 K356 F365	I327-C332 WeakPolarHBondContact CA-O 3.44Å; I327-L355 VanDerWaalsContact O-CD1 3.29Å; I327-L355 WeakPolarHBondContact O-CD1 3.32Å; I327-K356 HydrophobicContact CB-CB 4.18Å; I327-K356 HydrophobicContact CD1-CB 4.14Å; I327-K356 HydrophobicContact CD1-CD 4.37Å; I327-K356 HydrophobicContact CG1-CB 4.32Å; I327-K356 PolarHBondContact N-O 2.96Å; I327-F365 HydrophobicContact CD1-CB 4.08Å; I327-F365 HydrophobicContact CD1-CD1 3.89Å; I327-F365 HydrophobicContact CD1-CD2 3.87Å; I327-F365 HydrophobicContact CD1-CE1 4.22Å; I327-F365 HydrophobicContact CD1-CE2 4.2Å; I327-F365 HydrophobicContact CD1-CG 3.7Å; I327-F365 HydrophobicContact CD1-CZ 4.36Å; I327-F365 HydrophobicContact CG1-CD1 3.73Å; I327-F365 HydrophobicContact CG1-CD2 4.39Å; I327-F365 HydrophobicContact CG1-CE1 3.7Å; I327-F365 HydrophobicContact CG1-CE2 4.36Å; I327-F365 HydrophobicContact CG1-CG 4.08Å; I327-F365 HydrophobicContact CG1-CZ 4.03Å
328	D	91.9	Very high	83.2	Confident	32 Å²	32	78.4 Å²	78.4	17%	0.171	42%	0.423	C	S	.	.			trans	-85.5	-178.5	-179.3	72.7	20	0	0	0	114	Y326 F330 T331 C332 Q334	Y326-D328 HydrophobicContact CD2-CB 4.36Å; Y326-D328 HydrophobicContact CE2-CB 3.84Å; D328-F330 PolarHBondContact O-N 3.17Å; D328-F330 VanDerWaalsContact OD1-C 3.29Å; D328-F330 VanDerWaalsContact OD1-CA 3.27Å; D328-F330 WeakPolarHBondContact OD1-CA 3.37Å; D328-F330 WeakPolarHBondContact OD1-CB 2.78Å; D328-F330 PolarHBondContact OD1-N 2.99Å; D328-T331 WeakPolarHBondContact O-CA 3.48Å; D328-T331 PolarHBondContact O-N 3.35Å; D328-T331 PolarHBondContact OD1-N 3.37Å; D328-T331 VanDerWaalsContact OD1-N 3.08Å; D328-C332 PolarHBondContact N-O 3.33Å; D328-C332 PolarHBondContact OD1-N 2.94Å; D328-Q334 HydrophobicContact CB-CG 4.14Å; D328-Q334 PolarHBondContact OD2-NE2 3.03Å
329	L	88.1	Confident	86	Confident	175 Å²	175	75.3 Å²	75.3	92%	0.916	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-19.5	179.1	-63.8	176	0	0	0	113.7	T331	L329-T331 VanDerWaalsContact C-N 3.29Å
330	F	89.4	Confident	88.3	Confident	169 Å²	169	74.2 Å²	74.2	74%	0.741	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	8.4	173.6	-54.7	-72.5	0	0	0	111.9	D328 C332	D328-F330 PolarHBondContact O-N 3.17Å; D328-F330 VanDerWaalsContact OD1-C 3.29Å; D328-F330 VanDerWaalsContact OD1-CA 3.27Å; D328-F330 WeakPolarHBondContact OD1-CA 3.37Å; D328-F330 WeakPolarHBondContact OD1-CB 2.78Å; D328-F330 PolarHBondContact OD1-N 2.99Å; F330-C332 PolarHBondContact O-N 3.44Å
331	T	88.8	Confident	90.4	Very high	118 Å²	118	71.6 Å²	71.6	72%	0.724	39%	0.387	S	S	*	.	S	Bend	trans	62.7	12.2	-173.6	68.2	0	0	0	0	115	D328 L329	D328-T331 WeakPolarHBondContact O-CA 3.48Å; D328-T331 PolarHBondContact O-N 3.35Å; D328-T331 PolarHBondContact OD1-N 3.37Å; D328-T331 VanDerWaalsContact OD1-N 3.08Å; L329-T331 VanDerWaalsContact C-N 3.29Å
332	C	92.7	Very high	92.1	Very high	65 Å²	65	66.7 Å²	66.7	44%	0.439	36%	0.355	S	S	.	.			trans	-75.9	139.6	175.4	-65.1	0	0	0	0	110.7	I327 D328 F330	I327-C332 WeakPolarHBondContact CA-O 3.44Å; D328-C332 PolarHBondContact N-O 3.33Å; D328-C332 PolarHBondContact OD1-N 2.94Å; F330-C332 PolarHBondContact O-N 3.44Å
333	T	95.1	Very high	92.9	Very high	76 Å²	76	66.3 Å²	66.3	47%	0.466	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	117.3	172.8	-63.6	0	0	0	0	109.3	Y325 Y326 F365	Y325-T333 HydrophobicContact CD1-CG2 3.97Å; Y325-T333 HydrophobicContact CG-CG2 4.06Å; Y326-T333 CarbonylContact O-C 3.51Å; Y326-T333 WeakPolarHBondContact O-CA 3.49Å; T333-F365 HydrophobicContact CG2-CE1 4.45Å; T333-F365 HydrophobicContact CG2-CZ 3.79Å
334	Q	94.6	Very high	93	Very high	70 Å²	70	66.5 Å²	66.5	33%	0.327	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	135.5	-179.5	-58.2	-63.6	-10.6	0	0	110	Y325 Y326 D328 F337	Y325-Q334 CarbonylContact C-O 3.6Å; Y325-Q334 WeakPolarHBondContact CA-O 3.36Å; Y325-Q334 WeakPolarHBondContact CB-O 3.43Å; Y326-Q334 HydrophobicContact CD1-CB 4.16Å; Y326-Q334 HydrophobicContact CD2-CB 4.24Å; Y326-Q334 HydrophobicContact CD2-CG 4.44Å; Y326-Q334 HydrophobicContact CE1-CB 3.77Å; Y326-Q334 HydrophobicContact CE2-CB 3.86Å; Y326-Q334 HydrophobicContact CE2-CG 3.81Å; Y326-Q334 HydrophobicContact CG-CB 4.37Å; Y326-Q334 PolarHBondContact N-O 3.42Å; Y326-Q334 PolarHBondContact O-N 2.97Å; D328-Q334 HydrophobicContact CB-CG 4.14Å; D328-Q334 PolarHBondContact OD2-NE2 3.03Å; Q334-F337 HydrophobicContact CB-CE2 3.8Å; Q334-F337 HydrophobicContact CB-CZ 4.02Å; Q334-F337 WeakPolarHBondContact O-CE2 3.26Å
335	G	93	Very high	93.1	Very high	34 Å²	34	69.8 Å²	69.8	35%	0.351	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	148.8	-174.4	179.4	0	0	0	0	0	111.7	F337	G335-F337 VanDerWaalsContact CA-CE2 3.4Å; G335-F337 VanDerWaalsContact N-CE2 3.31Å
336	P	94.3	Very high	93	Very high	75 Å²	75	69.1 Å²	69.1	49%	0.487	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	cis	-75.8	135.6	1.2	27.6	-33.4	0	0	0	113.7	H323 Y325	H323-P336 HydrophobicContact CB-CB 3.56Å; Y325-P336 HydrophobicContact CE1-CB 4.12Å
337	F	94.5	Very high	92.8	Very high	34 Å²	34	70.9 Å²	70.9	15%	0.149	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	144.8	174.3	-55.3	-57.6	0	0	0	112.1	H323 W324 Y326 Q334 G335 Q341 M342 W345	H323-F337 CarbonylContact C-O 3.58Å; H323-F337 WeakPolarHBondContact CA-O 3.4Å; W324-F337 PolarHBondContact N-O 2.68Å; W324-F337 PolarHBondContact O-N 3.21Å; Y326-F337 AromaticContact CD1-CD2 3.92Å; Y326-F337 HydrophobicContact CD1-CD2 3.92Å; Y326-F337 AromaticContact CD1-CE2 3.58Å; Y326-F337 HydrophobicContact CD1-CE2 3.58Å; Y326-F337 AromaticContact CE1-CD2 3.97Å; Y326-F337 HydrophobicContact CE1-CD2 3.97Å; Y326-F337 AromaticContact CE1-CE2 3.29Å; Y326-F337 HydrophobicContact CE1-CE2 3.29Å; Y326-F337 HydrophobicContact CE1-CZ 4.04Å; Q334-F337 HydrophobicContact CB-CE2 3.8Å; Q334-F337 HydrophobicContact CB-CZ 4.02Å; Q334-F337 WeakPolarHBondContact O-CE2 3.26Å; G335-F337 VanDerWaalsContact CA-CE2 3.4Å; G335-F337 VanDerWaalsContact N-CE2 3.31Å; F337-Q341 HydrophobicContact CB-CB 4.49Å; F337-M342 HydrophobicContact CB-CG 3.99Å; F337-M342 HydrophobicContact CB-SD 3.86Å; F337-M342 HydrophobicContact CD2-SD 4.01Å; F337-M342 HydrophobicContact CG-SD 4.27Å; F337-W345 HydrophobicContact CB-CZ3 4.31Å; F337-W345 AromaticContact CD1-CH2 3.57Å; F337-W345 HydrophobicContact CD1-CH2 3.57Å; F337-W345 AromaticContact CD1-CZ3 3.89Å; F337-W345 HydrophobicContact CD1-CZ3 3.89Å; F337-W345 HydrophobicContact CD2-CH2 4.11Å; F337-W345 AromaticContact CD2-CZ3 3.65Å; F337-W345 HydrophobicContact CD2-CZ3 3.65Å; F337-W345 AromaticContact CE1-CH2 3.55Å; F337-W345 HydrophobicContact CE1-CH2 3.55Å; F337-W345 HydrophobicContact CE1-CZ3 4.12Å; F337-W345 HydrophobicContact CE2-CH2 4.06Å; F337-W345 AromaticContact CE2-CZ3 3.85Å; F337-W345 HydrophobicContact CE2-CZ3 3.85Å; F337-W345 AromaticContact CG-CH2 3.86Å; F337-W345 HydrophobicContact CG-CH2 3.86Å; F337-W345 AromaticContact CG-CZ3 3.66Å; F337-W345 HydrophobicContact CG-CZ3 3.66Å; F337-W345 AromaticContact CZ-CH2 3.79Å; F337-W345 HydrophobicContact CZ-CH2 3.79Å; F337-W345 HydrophobicContact CZ-CZ3 4.08Å
338	T	93.1	Very high	92.7	Very high	53 Å²	53	71.9 Å²	71.9	33%	0.325	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	156.8	176.7	59.9	0	0	0	0	112.1	Q340 Q341 M342	T338-Q340 PolarHBondContact O-N 2.83Å; T338-Q341 PolarHBondContact O-N 3.01Å; T338-Q341 VanDerWaalsContact O-N 3.16Å; T338-Q341 WeakPolarHBondContact OG1-CG 2.98Å; T338-Q341 PolarHBondContact OG1-N 3.47Å; T338-Q341 PolarHBondContact OG1-OE1 2.93Å; T338-M342 PolarHBondContact O-N 3Å
339	N	91.9	Very high	92.8	Very high	52 Å²	52	73.2 Å²	73.2	28%	0.278	43%	0.428	S	S	.	.	H	α-helix	trans	-43.2	-45.8	164.9	-81.7	-26.5	0	0	0	112.2	W324 M342 S343 F380	W324-N339 PolarHBondContact NE1-OD1 3.17Å; N339-M342 PolarHBondContact O-N 2.86Å; N339-S343 VanDerWaalsContact O-CB 3.3Å; N339-S343 WeakPolarHBondContact O-CB 3.45Å; N339-S343 PolarHBondContact O-N 2.97Å; N339-S343 PolarHBondContact O-OG 3.43Å; N339-F380 WeakPolarHBondContact CB-O 3.35Å
340	Q	91.7	Very high	93	Very high	132 Å²	132	72.3 Å²	72.3	62%	0.617	41%	0.414	S	S	*	.	H	α-helix	trans	-60.7	-53.1	-179.4	-169.8	63.2	33.6	0	0	111.5	T338 M342 S343 T344	T338-Q340 PolarHBondContact O-N 2.83Å; Q340-M342 PolarHBondContact O-N 3.46Å; Q340-S343 PolarHBondContact O-N 3Å; Q340-S343 VanDerWaalsContact O-N 3.14Å; Q340-S343 PolarHBondContact O-OG 3.13Å; Q340-T344 PolarHBondContact O-N 3.21Å; Q340-T344 PolarHBondContact O-OG1 3.04Å
341	Q	93.8	Very high	93.2	Very high	81 Å²	81	64.9 Å²	64.9	38%	0.379	38%	0.382	S	S	.	.	H	α-helix	trans	-58.4	-46.4	-179.5	-72.6	160.8	-61.4	0	0	112	F337 T338 S343 T344 W345	F337-Q341 HydrophobicContact CB-CB 4.49Å; T338-Q341 PolarHBondContact O-N 3.01Å; T338-Q341 VanDerWaalsContact O-N 3.16Å; T338-Q341 WeakPolarHBondContact OG1-CG 2.98Å; T338-Q341 PolarHBondContact OG1-N 3.47Å; T338-Q341 PolarHBondContact OG1-OE1 2.93Å; Q341-S343 VanDerWaalsContact C-N 3.33Å; Q341-S343 PolarHBondContact O-N 3.27Å; Q341-T344 PolarHBondContact O-N 3.47Å; Q341-W345 VanDerWaalsContact O-CG 3.27Å; Q341-W345 PolarHBondContact O-N 3.42Å
342	M	94	Very high	93.4	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-64.5	-37.3	177.5	-63	-63.4	-71	0	0	112.2	W324 F337 T338 N339 Q340 W345 L346 L351 I357 F380	W324-M342 HydrophobicContact CB-CE 4.25Å; W324-M342 HydrophobicContact CB-CG 3.72Å; W324-M342 HydrophobicContact CB-SD 4.17Å; W324-M342 HydrophobicContact CG-CG 3.86Å; F337-M342 HydrophobicContact CB-CG 3.99Å; F337-M342 HydrophobicContact CB-SD 3.86Å; F337-M342 HydrophobicContact CD2-SD 4.01Å; F337-M342 HydrophobicContact CG-SD 4.27Å; T338-M342 PolarHBondContact O-N 3Å; N339-M342 PolarHBondContact O-N 2.86Å; Q340-M342 PolarHBondContact O-N 3.46Å; M342-W345 PolarHBondContact O-N 3Å; M342-W345 HydrophobicContact SD-CE3 3.76Å; M342-W345 HydrophobicContact SD-CZ3 3.89Å; M342-L346 WeakPolarHBondContact O-CB 3.39Å; M342-L346 PolarHBondContact O-N 3.19Å; M342-L351 HydrophobicContact CE-CD1 3.79Å; M342-L351 WeakPolarHBondContact O-CD1 3.48Å; M342-L351 HydrophobicContact SD-CD1 4.47Å; M342-I357 HydrophobicContact CE-CG2 4.2Å; M342-F380 HydrophobicContact CB-CB 4.17Å; M342-F380 HydrophobicContact CB-CD1 3.39Å; M342-F380 HydrophobicContact CB-CD2 3.87Å; M342-F380 HydrophobicContact CB-CE1 3.65Å; M342-F380 HydrophobicContact CB-CE2 4.09Å; M342-F380 HydrophobicContact CB-CG 3.51Å; M342-F380 HydrophobicContact CB-CZ 3.98Å; M342-F380 HydrophobicContact CE-CE1 3.84Å; M342-F380 HydrophobicContact CE-CZ 3.75Å; M342-F380 HydrophobicContact CG-CD1 4.17Å; M342-F380 HydrophobicContact CG-CE1 4.15Å; M342-F380 WeakPolarHBondContact O-CD2 3.39Å
343	S	92.1	Very high	93.5	Very high	18 Å²	18	64.2 Å²	64.2	13%	0.126	37%	0.372	C	S	.	.	H	α-helix	trans	-66.7	-40.1	176	78.1	0	0	0	0	112.5	N339 Q340 Q341 L346 A347	N339-S343 VanDerWaalsContact O-CB 3.3Å; N339-S343 WeakPolarHBondContact O-CB 3.45Å; N339-S343 PolarHBondContact O-N 2.97Å; N339-S343 PolarHBondContact O-OG 3.43Å; Q340-S343 PolarHBondContact O-N 3Å; Q340-S343 VanDerWaalsContact O-N 3.14Å; Q340-S343 PolarHBondContact O-OG 3.13Å; Q341-S343 VanDerWaalsContact C-N 3.33Å; Q341-S343 PolarHBondContact O-N 3.27Å; S343-L346 PolarHBondContact O-N 2.89Å; S343-A347 WeakPolarHBondContact O-CB 3.38Å; S343-A347 PolarHBondContact O-N 2.56Å
344	T	93.5	Very high	93.4	Very high	65 Å²	65	65.2 Å²	65.2	40%	0.399	38%	0.382	S	S	.	.	H	α-helix	trans	-64.2	-47.2	174.1	-59.9	0	0	0	0	110.6	Q340 Q341 L346 A347 S348	Q340-T344 PolarHBondContact O-N 3.21Å; Q340-T344 PolarHBondContact O-OG1 3.04Å; Q341-T344 PolarHBondContact O-N 3.47Å; T344-L346 VanDerWaalsContact C-N 3.29Å; T344-L346 PolarHBondContact O-N 3.18Å; T344-A347 PolarHBondContact O-N 3.49Å; T344-A347 VanDerWaalsContact O-N 3.15Å; T344-S348 PolarHBondContact O-N 3.49Å; T344-S348 PolarHBondContact O-OG 2.88Å
345	W	94.6	Very high	93.4	Very high	70 Å²	70	63 Å²	63	27%	0.265	37%	0.373	S	S	.	.	H	α-helix	trans	-65.2	-31.1	178.6	-65.7	-20.6	0	0	0	113.6	Y326 F337 Q341 M342 G349 Y350 L351	Y326-W345 HydrophobicContact CD1-CZ3 4.48Å; Y326-W345 AromaticContact CE1-CZ3 3.87Å; Y326-W345 HydrophobicContact CE1-CZ3 3.87Å; F337-W345 HydrophobicContact CB-CZ3 4.31Å; F337-W345 AromaticContact CD1-CH2 3.57Å; F337-W345 HydrophobicContact CD1-CH2 3.57Å; F337-W345 AromaticContact CD1-CZ3 3.89Å; F337-W345 HydrophobicContact CD1-CZ3 3.89Å; F337-W345 HydrophobicContact CD2-CH2 4.11Å; F337-W345 AromaticContact CD2-CZ3 3.65Å; F337-W345 HydrophobicContact CD2-CZ3 3.65Å; F337-W345 AromaticContact CE1-CH2 3.55Å; F337-W345 HydrophobicContact CE1-CH2 3.55Å; F337-W345 HydrophobicContact CE1-CZ3 4.12Å; F337-W345 HydrophobicContact CE2-CH2 4.06Å; F337-W345 AromaticContact CE2-CZ3 3.85Å; F337-W345 HydrophobicContact CE2-CZ3 3.85Å; F337-W345 AromaticContact CG-CH2 3.86Å; F337-W345 HydrophobicContact CG-CH2 3.86Å; F337-W345 AromaticContact CG-CZ3 3.66Å; F337-W345 HydrophobicContact CG-CZ3 3.66Å; F337-W345 AromaticContact CZ-CH2 3.79Å; F337-W345 HydrophobicContact CZ-CH2 3.79Å; F337-W345 HydrophobicContact CZ-CZ3 4.08Å; Q341-W345 VanDerWaalsContact O-CG 3.27Å; Q341-W345 PolarHBondContact O-N 3.42Å; M342-W345 PolarHBondContact O-N 3Å; M342-W345 HydrophobicContact SD-CE3 3.76Å; M342-W345 HydrophobicContact SD-CZ3 3.89Å; W345-G349 PolarHBondContact O-N 2.85Å; W345-Y350 PolarHBondContact O-N 2.91Å; W345-L351 HydrophobicContact CB-CD1 4.01Å; W345-L351 HydrophobicContact CB-CD2 3.96Å; W345-L351 HydrophobicContact CB-CG 3.75Å; W345-L351 HydrophobicContact CE3-CD2 4.28Å; W345-L351 PolarHBondContact O-N 3.45Å
346	L	94.1	Very high	93.5	Very high	38 Å²	38	67 Å²	67	20%	0.199	38%	0.381	C	S	.	.	H	α-helix	trans	-66.1	-48.3	170	-175.2	60.8	0	0	0	111.2	M342 S343 T344 S348 G349 L351 L368 I378 F380	M342-L346 WeakPolarHBondContact O-CB 3.39Å; M342-L346 PolarHBondContact O-N 3.19Å; S343-L346 PolarHBondContact O-N 2.89Å; T344-L346 VanDerWaalsContact C-N 3.29Å; T344-L346 PolarHBondContact O-N 3.18Å; L346-S348 VanDerWaalsContact C-N 3.34Å; L346-S348 PolarHBondContact O-N 2.68Å; L346-G349 PolarHBondContact O-N 3.24Å; L346-L351 HydrophobicContact CB-CD1 4.22Å; L346-L351 HydrophobicContact CD1-CB 4.33Å; L346-L368 HydrophobicContact CD1-CD2 3.68Å; L346-I378 HydrophobicContact CD2-CG1 4.32Å; L346-I378 HydrophobicContact CD2-CG2 3.58Å; L346-F380 HydrophobicContact CB-CD2 4.1Å; L346-F380 HydrophobicContact CB-CE2 4.13Å; L346-F380 HydrophobicContact CD2-CD2 3.9Å; L346-F380 HydrophobicContact CD2-CE2 4Å
347	A	92.3	Very high	93.6	Very high	89 Å²	89	63.5 Å²	63.5	74%	0.736	36%	0.358	S	S	*	.	H	α-helix	trans	-63.8	-36.8	-179.3	0	0	0	0	0	112.7	S343 T344 G349	S343-A347 WeakPolarHBondContact O-CB 3.38Å; S343-A347 PolarHBondContact O-N 2.56Å; T344-A347 PolarHBondContact O-N 3.49Å; T344-A347 VanDerWaalsContact O-N 3.15Å; A347-G349 PolarHBondContact O-N 2.7Å
348	S	93.5	Very high	93.5	Very high	63 Å²	63	65.2 Å²	65.2	44%	0.441	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-3.3	172.9	-58	0	0	0	0	114.1	T344 L346 Y350	T344-S348 PolarHBondContact O-N 3.49Å; T344-S348 PolarHBondContact O-OG 2.88Å; L346-S348 VanDerWaalsContact C-N 3.34Å; L346-S348 PolarHBondContact O-N 2.68Å; S348-Y350 VanDerWaalsContact CB-CD2 3.46Å; S348-Y350 PolarHBondContact O-N 3.25Å
349	G	93.5	Very high	93.5	Very high	61 Å²	61	63.1 Å²	63.1	63%	0.629	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	74	17.9	179.3	0	0	0	0	0	115.4	W345 L346 A347	W345-G349 PolarHBondContact O-N 2.85Å; L346-G349 PolarHBondContact O-N 3.24Å; A347-G349 PolarHBondContact O-N 2.7Å
350	Y	93.3	Very high	93.4	Very high	156 Å²	156	64.5 Å²	64.5	61%	0.612	36%	0.357	S	S	*	.			trans	-81.6	-19	178.1	-61.2	-52.4	0	0	0	113.7	W345 S348 P352	W345-Y350 PolarHBondContact O-N 2.91Å; S348-Y350 VanDerWaalsContact CB-CD2 3.46Å; S348-Y350 PolarHBondContact O-N 3.25Å; Y350-P352 VanDerWaalsContact O-CD 3.26Å; Y350-P352 WeakPolarHBondContact O-CD 3.46Å
351	L	93.4	Very high	93.3	Very high	13 Å²	13	61 Å²	61	7%	0.068	35%	0.346	C	S	.	.	S	Bend	trans	-99.6	101.4	178.3	-53.7	-176	0	0	0	110.5	M342 W345 L346 L355 L368 F380	M342-L351 HydrophobicContact CE-CD1 3.79Å; M342-L351 WeakPolarHBondContact O-CD1 3.48Å; M342-L351 HydrophobicContact SD-CD1 4.47Å; W345-L351 HydrophobicContact CB-CD1 4.01Å; W345-L351 HydrophobicContact CB-CD2 3.96Å; W345-L351 HydrophobicContact CB-CG 3.75Å; W345-L351 HydrophobicContact CE3-CD2 4.28Å; W345-L351 PolarHBondContact O-N 3.45Å; L346-L351 HydrophobicContact CB-CD1 4.22Å; L346-L351 HydrophobicContact CD1-CB 4.33Å; L351-L355 HydrophobicContact CB-CD2 4.23Å; L351-L355 HydrophobicContact CD2-CD2 3.6Å; L351-L355 HydrophobicContact CG-CD2 4.42Å; L351-L368 HydrophobicContact CB-CD2 4.03Å; L351-F380 HydrophobicContact CD1-CE2 3.7Å; L351-F380 HydrophobicContact CD1-CZ 4.01Å
352	P	93.3	Very high	93.1	Very high	69 Å²	69	57.4 Å²	57.4	45%	0.448	33%	0.33	S	S	.	.			trans	-68.8	149.3	174.7	27.6	-32.6	0	0	0	110.8	Y350 S354 L355	Y350-P352 VanDerWaalsContact O-CD 3.26Å; Y350-P352 WeakPolarHBondContact O-CD 3.46Å; P352-S354 PolarHBondContact O-N 2.9Å; P352-S354 VanDerWaalsContact O-N 3.1Å; P352-L355 HydrophobicContact CG-CB 4.1Å; P352-L355 WeakPolarHBondContact O-CB 3.44Å; P352-L355 PolarHBondContact O-N 3.11Å
353	L	93.8	Very high	92.9	Very high	99 Å²	99	62 Å²	62	52%	0.518	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-24.2	-177	-65.7	178.9	0	0	0	114	L355 L368 A369 M372	L353-L355 VanDerWaalsContact C-N 3.34Å; L353-L368 HydrophobicContact CD2-CD2 4.07Å; L353-L368 HydrophobicContact CD2-CG 4.16Å; L353-L368 PolarHBondContact O-N 2.83Å; L353-A369 HydrophobicContact CB-CB 4.33Å; L353-A369 PolarHBondContact O-N 2.87Å; L353-M372 HydrophobicContact CD2-SD 3.83Å
354	S	93.5	Very high	92.8	Very high	97 Å²	97	61.8 Å²	61.8	68%	0.678	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-6.8	174.1	53.5	0	0	0	0	114.4	P352 K356	P352-S354 PolarHBondContact O-N 2.9Å; P352-S354 VanDerWaalsContact O-N 3.1Å; S354-K356 PolarHBondContact O-N 3.13Å
355	L	95	Very high	92.9	Very high	25 Å²	25	61.1 Å²	61.1	13%	0.131	34%	0.341	C	S	.	.			trans	-62.1	127.3	179.8	-171.2	70.1	0	0	0	110.1	Y326 I327 L351 P352 L353 I357 S367 L368	Y326-L355 HydrophobicContact CD2-CD1 4Å; Y326-L355 HydrophobicContact CD2-CD2 4.16Å; Y326-L355 HydrophobicContact CD2-CG 4.43Å; Y326-L355 HydrophobicContact CG-CD2 4.03Å; I327-L355 VanDerWaalsContact O-CD1 3.29Å; I327-L355 WeakPolarHBondContact O-CD1 3.32Å; L351-L355 HydrophobicContact CB-CD2 4.23Å; L351-L355 HydrophobicContact CD2-CD2 3.6Å; L351-L355 HydrophobicContact CG-CD2 4.42Å; P352-L355 HydrophobicContact CG-CB 4.1Å; P352-L355 WeakPolarHBondContact O-CB 3.44Å; P352-L355 PolarHBondContact O-N 3.11Å; L353-L355 VanDerWaalsContact C-N 3.34Å; L355-I357 HydrophobicContact CD2-CG2 4.14Å; L355-I357 HydrophobicContact CG-CG2 4.23Å; L355-I357 PolarHBondContact O-N 3.38Å; L355-S367 CarbonylContact O-C 3.57Å; L355-S367 WeakPolarHBondContact O-CA 3.49Å; L355-L368 PolarHBondContact O-N 3.3Å
356	K	95.3	Very high	92.8	Very high	118 Å²	118	58.6 Å²	58.6	51%	0.513	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	117.4	177	-79.1	-175.5	179.2	-178	0	110.3	Y326 I327 S354 F365 L366	Y326-K356 CarbonylContact C-O 3.48Å; Y326-K356 WeakPolarHBondContact CA-O 3.48Å; I327-K356 HydrophobicContact CB-CB 4.18Å; I327-K356 HydrophobicContact CD1-CB 4.14Å; I327-K356 HydrophobicContact CD1-CD 4.37Å; I327-K356 HydrophobicContact CG1-CB 4.32Å; I327-K356 PolarHBondContact N-O 2.96Å; S354-K356 PolarHBondContact O-N 3.13Å; K356-F365 HydrophobicContact CB-CB 4.21Å; K356-L366 CarbonylContact C-O 3.5Å; K356-L366 VanDerWaalsContact CA-O 3.3Å; K356-L366 WeakPolarHBondContact CA-O 3.39Å
357	I	94.9	Very high	92.8	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	157	-179.1	66.9	174.3	0	0	0	111.4	W324 Y325 M342 L355 F365 L366 L368 H371 F380	W324-I357 HydrophobicContact CE3-CB 4.48Å; W324-I357 HydrophobicContact CE3-CD1 4.25Å; W324-I357 HydrophobicContact CZ3-CD1 3.87Å; W324-I357 HydrophobicContact CZ3-CG1 4.32Å; Y325-I357 CarbonylContact O-C 3.58Å; Y325-I357 VanDerWaalsContact O-CA 3.3Å; Y325-I357 WeakPolarHBondContact O-CA 3.23Å; M342-I357 HydrophobicContact CE-CG2 4.2Å; L355-I357 HydrophobicContact CD2-CG2 4.14Å; L355-I357 HydrophobicContact CG-CG2 4.23Å; L355-I357 PolarHBondContact O-N 3.38Å; I357-F365 WeakPolarHBondContact O-CA 3.28Å; I357-L366 PolarHBondContact N-O 3.03Å; I357-L366 PolarHBondContact O-N 3.39Å; I357-L366 VanDerWaalsContact O-O 3.14Å; I357-L368 HydrophobicContact CD1-CB 4.16Å; I357-L368 HydrophobicContact CD1-CD1 3.91Å; I357-H371 HydrophobicContact CD1-CB 4.02Å; I357-H371 HydrophobicContact CG1-CB 4.48Å; I357-H371 PolarHBondContact O-CE1 2.99Å; I357-F380 HydrophobicContact CD1-CE1 3.96Å; I357-F380 HydrophobicContact CD1-CZ 3.77Å
358	R	94.2	Very high	92.9	Very high	71 Å²	71	53.6 Å²	53.6	27%	0.268	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	162.9	166.1	79.1	175.8	-174.9	167.5	5.1	111.5	W324 Y325 D362 E363 C364 F365	W324-R358 WeakPolarHBondContact CA-O 3.37Å; Y325-R358 HydrophobicContact CD2-CG 4.23Å; Y325-R358 PolarHBondContact N-O 3.42Å; Y325-R358 PolarHBondContact O-N 3.23Å; R358-D362 HydrophobicContact CB-CB 4.1Å; R358-D362 PolarHBondContact NH1-O 3.43Å; R358-E363 PolarHBondContact NH1-O 2.82Å; R358-C364 VanDerWaalsContact CB-O 3.24Å; R358-C364 WeakPolarHBondContact CB-O 3.48Å; R358-F365 HydrophobicContact CB-CD1 3.94Å; R358-F365 HydrophobicContact CB-CE1 4.27Å; R358-F365 HydrophobicContact CB-CG 4.21Å; R358-F365 HydrophobicContact CG-CD1 3.84Å; R358-F365 HydrophobicContact CG-CD2 4.4Å; R358-F365 HydrophobicContact CG-CE1 3.66Å; R358-F365 HydrophobicContact CG-CE2 4.25Å; R358-F365 HydrophobicContact CG-CG 4.22Å; R358-F365 HydrophobicContact CG-CZ 3.88Å
359	R	92	Very high	93	Very high	9 Å²	9	52 Å²	52	3%	0.034	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	163.3	168.5	-63.1	173.4	-65.6	165.3	5.9	112.3	C322 H323 W324 C361 D362 Q386 P387	C322-R359 WeakPolarHBondContact SG-CB 3.29Å; C322-R359 VanDerWaalsContact SG-CD 3.54Å; C322-R359 VanDerWaalsContact SG-CG 3.51Å; H323-R359 CarbonylContact O-C 3.57Å; H323-R359 WeakPolarHBondContact O-CA 3.08Å; W324-R359 HydrophobicContact CD2-CG 3.95Å; W324-R359 HydrophobicContact CE3-CG 3.75Å; W324-R359 HydrophobicContact CH2-CG 3.4Å; W324-R359 HydrophobicContact CZ2-CG 3.61Å; W324-R359 HydrophobicContact CZ3-CG 3.48Å; W324-R359 VanDerWaalsContact CZ3-CG 3.48Å; R359-C361 PolarHBondContact O-N 3.48Å; R359-C361 VanDerWaalsContact O-N 3.14Å; R359-D362 HydrophobicContact CB-CB 4.42Å; R359-D362 WeakPolarHBondContact CB-OD2 3.42Å; R359-D362 WeakPolarHBondContact CG-OD2 3.33Å; R359-D362 IonicContact CZ-OD1 2.75Å; R359-D362 IonicContact CZ-OD2 3.44Å; R359-D362 PolarHBondContact N-OD2 2.87Å; R359-D362 VanDerWaalsContact N-OD2 3.14Å; R359-D362 IonicContact NE-OD1 3.19Å; R359-D362 PolarHBondContact NE-OD1 3.33Å; R359-D362 IonicContact NE-OD2 3.29Å; R359-D362 PolarHBondContact NE-OD2 3.14Å; R359-D362 IonicContact NH2-OD1 3.16Å; R359-D362 PolarHBondContact NH2-OD1 3.08Å; R359-D362 IonicContact NH2-OD2 2.71Å; R359-D362 PolarHBondContact NH2-OD2 3.46Å; R359-D362 PolarHBondContact O-N 2.92Å; R359-Q386 PolarHBondContact NH1-O 3.43Å; R359-P387 PolarHBondContact NH2-O 3.43Å
360	D	90.5	Very high	93	Very high	81 Å²	81	52.4 Å²	52.4	43%	0.433	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51	-29.9	166.3	-87.7	6.6	0	0	0	113.6	H323 Y325	H323-D360 IonicContact CD2-OD2 3.83Å; H323-D360 PolarHBondContact CD2-OD2 2.95Å; H323-D360 IonicContact CG-OD2 3.15Å; H323-D360 PolarHBondContact O-N 3.25Å; Y325-D360 WeakPolarHBondContact CE2-OD1 3.28Å; Y325-D360 VanDerWaalsContact CZ-OD1 3.23Å; Y325-D360 PolarHBondContact OH-OD1 2.85Å
361	C	88.1	Confident	92.9	Very high	58 Å²	58	45 Å²	45	39%	0.392	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	2.5	-179.7	58.7	0	0	0	0	114.5	R359 P388	R359-C361 PolarHBondContact O-N 3.48Å; R359-C361 VanDerWaalsContact O-N 3.14Å; C361-P388 WeakPolarHBondContact O-CB 3.39Å
362	D	90.6	Very high	92.8	Very high	6 Å²	6	47 Å²	47	3%	0.032	25%	0.254	C	S	.	.			trans	-105.5	139	179.4	-64	-34	0	0	0	111.1	R358 R359 H371 I389	R358-D362 HydrophobicContact CB-CB 4.1Å; R358-D362 PolarHBondContact NH1-O 3.43Å; R359-D362 HydrophobicContact CB-CB 4.42Å; R359-D362 WeakPolarHBondContact CB-OD2 3.42Å; R359-D362 WeakPolarHBondContact CG-OD2 3.33Å; R359-D362 IonicContact CZ-OD1 2.75Å; R359-D362 IonicContact CZ-OD2 3.44Å; R359-D362 PolarHBondContact N-OD2 2.87Å; R359-D362 VanDerWaalsContact N-OD2 3.14Å; R359-D362 IonicContact NE-OD1 3.19Å; R359-D362 PolarHBondContact NE-OD1 3.33Å; R359-D362 IonicContact NE-OD2 3.29Å; R359-D362 PolarHBondContact NE-OD2 3.14Å; R359-D362 IonicContact NH2-OD1 3.16Å; R359-D362 PolarHBondContact NH2-OD1 3.08Å; R359-D362 IonicContact NH2-OD2 2.71Å; R359-D362 PolarHBondContact NH2-OD2 3.46Å; R359-D362 PolarHBondContact O-N 2.92Å; D362-H371 IonicContact OD2-NE2 3.64Å; D362-I389 HydrophobicContact CB-CB 4.13Å; D362-I389 WeakPolarHBondContact OD1-CB 3.47Å; D362-I389 WeakPolarHBondContact OD1-CG1 3.45Å; D362-I389 PolarHBondContact OD1-N 3.48Å
363	E	90	Very high	92.6	Very high	97 Å²	97	48.2 Å²	48.2	45%	0.453	26%	0.257	S	S	.	.	S	Bend	trans	-76.8	-46.6	173.7	-62.7	176	174.7	0	0	110.1	R358 I389 T390 N391	R358-E363 PolarHBondContact NH1-O 2.82Å; E363-I389 PolarHBondContact N-O 3.3Å; E363-T390 HydrophobicContact CG-CG2 4.31Å; E363-T390 VanDerWaalsContact OE2-CA 3.27Å; E363-T390 WeakPolarHBondContact OE2-CA 3.47Å; E363-T390 WeakPolarHBondContact OE2-CB 3.29Å; E363-N391 PolarHBondContact OE2-N 3.44Å; E363-N391 PolarHBondContact OE2-ND2 3.43Å
364	C	90.3	Very high	92.3	Very high	13 Å²	13	44.9 Å²	44.9	9%	0.088	24%	0.24	C	C	.	.	S	Bend	trans	-91.5	144.1	-169.6	-51.1	0	0	0	0	112.8	R358 L366 I389 N391 L394	R358-C364 VanDerWaalsContact CB-O 3.24Å; R358-C364 WeakPolarHBondContact CB-O 3.48Å; C364-L366 HydrophobicContact CB-CD2 4.32Å; C364-I389 HydrophobicContact CB-CG2 4.47Å; C364-N391 VanDerWaalsContact SG-CG 3.52Å; C364-N391 PolarHBondContact SG-OD1 2.94Å; C364-N391 VanDerWaalsContact SG-OD1 3.34Å; C364-L394 HydrophobicContact CB-CD2 4.5Å
365	F	94.1	Very high	91.8	Very high	50 Å²	50	41.2 Å²	41.2	22%	0.219	22%	0.215	C	C	.	.			trans	-88.9	125.3	161.5	-71.4	-94.2	0	0	0	110.2	I327 T333 K356 I357 R358	I327-F365 HydrophobicContact CD1-CB 4.08Å; I327-F365 HydrophobicContact CD1-CD1 3.89Å; I327-F365 HydrophobicContact CD1-CD2 3.87Å; I327-F365 HydrophobicContact CD1-CE1 4.22Å; I327-F365 HydrophobicContact CD1-CE2 4.2Å; I327-F365 HydrophobicContact CD1-CG 3.7Å; I327-F365 HydrophobicContact CD1-CZ 4.36Å; I327-F365 HydrophobicContact CG1-CD1 3.73Å; I327-F365 HydrophobicContact CG1-CD2 4.39Å; I327-F365 HydrophobicContact CG1-CE1 3.7Å; I327-F365 HydrophobicContact CG1-CE2 4.36Å; I327-F365 HydrophobicContact CG1-CG 4.08Å; I327-F365 HydrophobicContact CG1-CZ 4.03Å; T333-F365 HydrophobicContact CG2-CE1 4.45Å; T333-F365 HydrophobicContact CG2-CZ 3.79Å; K356-F365 HydrophobicContact CB-CB 4.21Å; I357-F365 WeakPolarHBondContact O-CA 3.28Å; R358-F365 HydrophobicContact CB-CD1 3.94Å; R358-F365 HydrophobicContact CB-CE1 4.27Å; R358-F365 HydrophobicContact CB-CG 4.21Å; R358-F365 HydrophobicContact CG-CD1 3.84Å; R358-F365 HydrophobicContact CG-CD2 4.4Å; R358-F365 HydrophobicContact CG-CE1 3.66Å; R358-F365 HydrophobicContact CG-CE2 4.25Å; R358-F365 HydrophobicContact CG-CG 4.22Å; R358-F365 HydrophobicContact CG-CZ 3.88Å
366	L	93.4	Very high	91.3	Very high	18 Å²	18	42.2 Å²	42.2	9%	0.094	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	167.3	172.3	-47.9	177.6	0	0	0	109.4	K356 I357 C364 D370 L374 I389 L394	K356-L366 CarbonylContact C-O 3.5Å; K356-L366 VanDerWaalsContact CA-O 3.3Å; K356-L366 WeakPolarHBondContact CA-O 3.39Å; I357-L366 PolarHBondContact N-O 3.03Å; I357-L366 PolarHBondContact O-N 3.39Å; I357-L366 VanDerWaalsContact O-O 3.14Å; C364-L366 HydrophobicContact CB-CD2 4.32Å; L366-D370 HydrophobicContact CB-CB 3.84Å; L366-D370 HydrophobicContact CD1-CB 4.38Å; L366-L374 HydrophobicContact CD1-CD1 3.61Å; L366-I389 HydrophobicContact CD1-CD1 4.1Å; L366-I389 HydrophobicContact CD1-CG2 4.14Å; L366-L394 HydrophobicContact CD1-CD1 3.81Å; L366-L394 HydrophobicContact CD2-CD1 3.63Å; L366-L394 HydrophobicContact CD2-CD2 3.89Å; L366-L394 HydrophobicContact CD2-CG 4.44Å; L366-L394 HydrophobicContact CG-CD1 4.35Å
367	S	94.9	Very high	90.8	Very high	21 Å²	21	40.3 Å²	40.3	15%	0.147	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	158	172.7	73.2	0	0	0	0	111.4	L355 A369 D370 H371	L355-S367 CarbonylContact O-C 3.57Å; L355-S367 WeakPolarHBondContact O-CA 3.49Å; S367-A369 PolarHBondContact O-N 3.44Å; S367-D370 WeakPolarHBondContact CA-OD2 3.45Å; S367-D370 VanDerWaalsContact CB-OD2 3.27Å; S367-D370 WeakPolarHBondContact CB-OD2 3.35Å; S367-D370 PolarHBondContact N-OD2 3.48Å; S367-D370 WeakPolarHBondContact O-CB 3.4Å; S367-D370 PolarHBondContact O-N 3.15Å; S367-D370 VanDerWaalsContact O-N 3.14Å; S367-D370 PolarHBondContact OG-N 2.86Å; S367-D370 PolarHBondContact OG-OD2 3.3Å; S367-H371 PolarHBondContact O-N 3.27Å
368	L	94.2	Very high	90.5	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-57.1	-37.6	170	168.2	61.7	0	0	0	111.2	L346 L351 L353 L355 I357 H371 M372 P379 F380	L346-L368 HydrophobicContact CD1-CD2 3.68Å; L351-L368 HydrophobicContact CB-CD2 4.03Å; L353-L368 HydrophobicContact CD2-CD2 4.07Å; L353-L368 HydrophobicContact CD2-CG 4.16Å; L353-L368 PolarHBondContact O-N 2.83Å; L355-L368 PolarHBondContact O-N 3.3Å; I357-L368 HydrophobicContact CD1-CB 4.16Å; I357-L368 HydrophobicContact CD1-CD1 3.91Å; L368-H371 PolarHBondContact O-N 2.76Å; L368-M372 HydrophobicContact CD1-CG 4.21Å; L368-M372 HydrophobicContact CD1-SD 4.02Å; L368-M372 HydrophobicContact CG-SD 4.08Å; L368-M372 VanDerWaalsContact O-CG 3.32Å; L368-M372 WeakPolarHBondContact O-CG 3.42Å; L368-M372 PolarHBondContact O-N 2.71Å; L368-P379 HydrophobicContact CD1-CG 4.17Å; L368-F380 HydrophobicContact CD1-CE2 3.9Å; L368-F380 HydrophobicContact CD1-CZ 3.89Å
369	A	94.2	Very high	90.1	Very high	29 Å²	29	39.3 Å²	39.3	24%	0.24	22%	0.221	C	C	.	.	H	α-helix	trans	-59.2	-47.1	171.9	0	0	0	0	0	112.2	L353 S367 H371 M372 N373	L353-A369 HydrophobicContact CB-CB 4.33Å; L353-A369 PolarHBondContact O-N 2.87Å; S367-A369 PolarHBondContact O-N 3.44Å; A369-H371 VanDerWaalsContact C-N 3.34Å; A369-H371 PolarHBondContact O-N 2.98Å; A369-M372 PolarHBondContact O-N 3.09Å; A369-N373 WeakPolarHBondContact O-CB 3.27Å; A369-N373 PolarHBondContact O-N 3.37Å; A369-N373 PolarHBondContact O-ND2 3.23Å
370	D	93.4	Very high	90	Very high	70 Å²	70	39.1 Å²	39.1	37%	0.374	22%	0.22	S	C	.	.	H	α-helix	trans	-60.2	-44.4	177.1	-57	-48.6	0	0	0	111.2	L366 S367 M372 N373 L374	L366-D370 HydrophobicContact CB-CB 3.84Å; L366-D370 HydrophobicContact CD1-CB 4.38Å; S367-D370 WeakPolarHBondContact CA-OD2 3.45Å; S367-D370 VanDerWaalsContact CB-OD2 3.27Å; S367-D370 WeakPolarHBondContact CB-OD2 3.35Å; S367-D370 PolarHBondContact N-OD2 3.48Å; S367-D370 WeakPolarHBondContact O-CB 3.4Å; S367-D370 PolarHBondContact O-N 3.15Å; S367-D370 VanDerWaalsContact O-N 3.14Å; S367-D370 PolarHBondContact OG-N 2.86Å; S367-D370 PolarHBondContact OG-OD2 3.3Å; D370-M372 VanDerWaalsContact C-N 3.31Å; D370-M372 PolarHBondContact O-N 3.48Å; D370-N373 PolarHBondContact O-N 2.68Å; D370-L374 VanDerWaalsContact O-CB 3.3Å; D370-L374 WeakPolarHBondContact O-CB 3.02Å; D370-L374 VanDerWaalsContact O-CG 3.23Å; D370-L374 WeakPolarHBondContact O-CG 3.28Å; D370-L374 PolarHBondContact O-N 3.06Å
371	H	91.2	Very high	89.6	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.2	-32.3	177.9	-93.2	70	0	0	0	113.7	W324 I357 D362 S367 L368 A369 P379 Y384	W324-H371 AromaticContact CH2-CD2 3.78Å; W324-H371 AromaticContact CZ3-CD2 3.57Å; W324-H371 AromaticContact CZ3-NE2 3.7Å; I357-H371 HydrophobicContact CD1-CB 4.02Å; I357-H371 HydrophobicContact CG1-CB 4.48Å; I357-H371 PolarHBondContact O-CE1 2.99Å; D362-H371 IonicContact OD2-NE2 3.64Å; S367-H371 PolarHBondContact O-N 3.27Å; L368-H371 PolarHBondContact O-N 2.76Å; A369-H371 VanDerWaalsContact C-N 3.34Å; A369-H371 PolarHBondContact O-N 2.98Å; H371-P379 HydrophobicContact CB-CB 4.4Å; H371-P379 HydrophobicContact CB-CG 3.67Å; H371-Y384 PolarHBondContact CD2-OH 3.32Å; H371-Y384 PolarHBondContact O-OH 3.48Å; H371-Y384 VanDerWaalsContact O-OH 3.11Å
372	M	91.9	Very high	88.8	Confident	56 Å²	56	43.2 Å²	43.2	28%	0.276	24%	0.235	S	C	.	.	H	α-helix	trans	-71.5	-47.3	172.9	-74.1	170.3	66	0	0	110.9	L353 L368 A369 D370 A375 G376 R377 P379	L353-M372 HydrophobicContact CD2-SD 3.83Å; L368-M372 HydrophobicContact CD1-CG 4.21Å; L368-M372 HydrophobicContact CD1-SD 4.02Å; L368-M372 HydrophobicContact CG-SD 4.08Å; L368-M372 VanDerWaalsContact O-CG 3.32Å; L368-M372 WeakPolarHBondContact O-CG 3.42Å; L368-M372 PolarHBondContact O-N 2.71Å; A369-M372 PolarHBondContact O-N 3.09Å; D370-M372 VanDerWaalsContact C-N 3.31Å; D370-M372 PolarHBondContact O-N 3.48Å; M372-A375 PolarHBondContact O-N 3.19Å; M372-G376 WeakPolarHBondContact O-CA 3.06Å; M372-G376 PolarHBondContact O-N 3.44Å; M372-R377 PolarHBondContact O-N 3.01Å; M372-P379 HydrophobicContact CG-CG 4.15Å
373	N	90	Very high	87.7	Confident	94 Å²	94	44.7 Å²	44.7	50%	0.503	25%	0.252	S	S	.	.	H	α-helix	trans	-62.2	-47.9	179.9	-68.7	-18.7	0	0	0	111.8	A369 D370 A375 G376	A369-N373 WeakPolarHBondContact O-CB 3.27Å; A369-N373 PolarHBondContact O-N 3.37Å; A369-N373 PolarHBondContact O-ND2 3.23Å; D370-N373 PolarHBondContact O-N 2.68Å; N373-A375 PolarHBondContact O-N 2.82Å; N373-A375 VanDerWaalsContact O-N 3.12Å; N373-G376 PolarHBondContact O-N 2.87Å
374	L	86.8	Confident	86.8	Confident	30 Å²	30	41.2 Å²	41.2	16%	0.157	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-22	178.7	-75.1	176.8	0	0	0	113.8	L366 D370 Q386 I389 L397	L366-L374 HydrophobicContact CD1-CD1 3.61Å; D370-L374 VanDerWaalsContact O-CB 3.3Å; D370-L374 WeakPolarHBondContact O-CB 3.02Å; D370-L374 VanDerWaalsContact O-CG 3.23Å; D370-L374 WeakPolarHBondContact O-CG 3.28Å; D370-L374 PolarHBondContact O-N 3.06Å; L374-Q386 PolarHBondContact O-NE2 2.77Å; L374-I389 HydrophobicContact CD1-CD1 4.4Å; L374-L397 HydrophobicContact CD2-CB 3.86Å; L374-L397 VanDerWaalsContact CD2-O 3.29Å; L374-L397 WeakPolarHBondContact CD2-O 3.49Å
375	A	82.9	Confident	85.8	Confident	19 Å²	19	47 Å²	47	16%	0.157	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	-7.2	-175.9	0	0	0	0	0	115.4	M372 N373 R377 Y384 Q386	M372-A375 PolarHBondContact O-N 3.19Å; N373-A375 PolarHBondContact O-N 2.82Å; N373-A375 VanDerWaalsContact O-N 3.12Å; A375-R377 HydrophobicContact CB-CG 4.16Å; A375-R377 WeakPolarHBondContact O-CG 3.31Å; A375-R377 PolarHBondContact O-N 3.33Å; A375-Y384 HydrophobicContact CB-CD2 3.94Å; A375-Y384 HydrophobicContact CB-CE2 3.2Å; A375-Q386 HydrophobicContact CB-CG 3.93Å
376	G	84.1	Confident	84.9	Confident	47 Å²	47	46.6 Å²	46.6	49%	0.485	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	16.7	-171.6	0	0	0	0	0	114.4	F262 M372 N373	F262-G376 WeakPolarHBondContact CE1-O 3.44Å; F262-G376 WeakPolarHBondContact CZ-O 3.26Å; M372-G376 WeakPolarHBondContact O-CA 3.06Å; M372-G376 PolarHBondContact O-N 3.44Å; N373-G376 PolarHBondContact O-N 2.87Å
377	R	86.2	Confident	84.3	Confident	78 Å²	78	48.8 Å²	48.8	29%	0.294	28%	0.279	S	S	.	.	S	Bend	trans	-164.4	167.8	-173.5	65.7	-171.5	153.5	151.4	-2.7	113.6	M372 A375 G383	M372-R377 PolarHBondContact O-N 3.01Å; A375-R377 HydrophobicContact CB-CG 4.16Å; A375-R377 WeakPolarHBondContact O-CG 3.31Å; A375-R377 PolarHBondContact O-N 3.33Å; R377-G383 VanDerWaalsContact NH1-C 3.28Å; R377-G383 PolarHBondContact NH1-O 2.88Å; R377-G383 PolarHBondContact NH2-O 3.4Å
378	I	87.6	Confident	83.9	Confident	50 Å²	50	51 Å²	51	26%	0.256	29%	0.293	S	S	.	.			trans	-58.1	127.5	174.9	-65.7	169.7	0	0	0	110.8	L346 F380 W381	L346-I378 HydrophobicContact CD2-CG1 4.32Å; L346-I378 HydrophobicContact CD2-CG2 3.58Å; I378-F380 VanDerWaalsContact C-N 3.33Å; I378-F380 HydrophobicContact CG2-CB 4.5Å; I378-F380 HydrophobicContact CG2-CD2 4.35Å; I378-F380 PolarHBondContact O-N 3.36Å; I378-W381 HydrophobicContact CB-CD2 4.34Å; I378-W381 HydrophobicContact CB-CG 4.18Å; I378-W381 HydrophobicContact CD1-CD2 4.35Å; I378-W381 HydrophobicContact CD1-CH2 4.39Å; I378-W381 HydrophobicContact CD1-CZ2 3.87Å; I378-W381 HydrophobicContact CG2-CD2 4.46Å; I378-W381 HydrophobicContact CG2-CG 3.99Å
379	P	85.4	Confident	83.5	Confident	0 Å²	0	51 Å²	51	0%	0	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-26.4	-172.4	-22.1	34.5	0	0	0	115.4	W324 L368 H371 M372 W381 Y384	W324-P379 HydrophobicContact CH2-CB 3.54Å; W324-P379 HydrophobicContact CZ2-CB 3.96Å; W324-P379 HydrophobicContact CZ3-CB 4.35Å; L368-P379 HydrophobicContact CD1-CG 4.17Å; H371-P379 HydrophobicContact CB-CB 4.4Å; H371-P379 HydrophobicContact CB-CG 3.67Å; M372-P379 HydrophobicContact CG-CG 4.15Å; P379-W381 VanDerWaalsContact C-N 3.34Å; P379-W381 PolarHBondContact O-N 2.91Å; P379-Y384 VanDerWaalsContact CA-CD2 3.46Å; P379-Y384 VanDerWaalsContact CA-CE2 3.45Å; P379-Y384 HydrophobicContact CB-CD2 4.15Å; P379-Y384 HydrophobicContact CB-CE1 4.45Å; P379-Y384 HydrophobicContact CB-CE2 3.69Å; P379-Y384 HydrophobicContact CG-CE2 4.21Å; P379-Y384 WeakPolarHBondContact O-CB 3.41Å; P379-Y384 VanDerWaalsContact O-CG 3.32Å
380	F	89.4	Confident	83.1	Confident	5 Å²	5	51 Å²	51	2%	0.022	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-2.9	-170.2	-45.8	-49.3	0	0	0	113.6	W324 N339 M342 L346 L351 I357 L368 I378	W324-F380 AromaticContact CD2-CD1 3.96Å; W324-F380 HydrophobicContact CD2-CD1 3.96Å; W324-F380 AromaticContact CD2-CE1 3.76Å; W324-F380 HydrophobicContact CD2-CE1 3.76Å; W324-F380 AromaticContact CE2-CD1 3.62Å; W324-F380 AromaticContact CE2-CE1 3.87Å; W324-F380 HydrophobicContact CE3-CD1 4.43Å; W324-F380 AromaticContact CE3-CE1 3.84Å; W324-F380 HydrophobicContact CE3-CE1 3.84Å; W324-F380 HydrophobicContact CG-CD1 4.42Å; W324-F380 HydrophobicContact CG-CE1 4.34Å; W324-F380 HydrophobicContact CH2-CD1 4.33Å; W324-F380 HydrophobicContact CH2-CE1 4.17Å; W324-F380 AromaticContact CZ2-CD1 3.83Å; W324-F380 HydrophobicContact CZ2-CD1 3.83Å; W324-F380 HydrophobicContact CZ2-CE1 4.08Å; W324-F380 HydrophobicContact CZ3-CE1 4.05Å; W324-F380 AromaticContact NE1-CD1 3.87Å; N339-F380 WeakPolarHBondContact CB-O 3.35Å; M342-F380 HydrophobicContact CB-CB 4.17Å; M342-F380 HydrophobicContact CB-CD1 3.39Å; M342-F380 HydrophobicContact CB-CD2 3.87Å; M342-F380 HydrophobicContact CB-CE1 3.65Å; M342-F380 HydrophobicContact CB-CE2 4.09Å; M342-F380 HydrophobicContact CB-CG 3.51Å; M342-F380 HydrophobicContact CB-CZ 3.98Å; M342-F380 HydrophobicContact CE-CE1 3.84Å; M342-F380 HydrophobicContact CE-CZ 3.75Å; M342-F380 HydrophobicContact CG-CD1 4.17Å; M342-F380 HydrophobicContact CG-CE1 4.15Å; M342-F380 WeakPolarHBondContact O-CD2 3.39Å; L346-F380 HydrophobicContact CB-CD2 4.1Å; L346-F380 HydrophobicContact CB-CE2 4.13Å; L346-F380 HydrophobicContact CD2-CD2 3.9Å; L346-F380 HydrophobicContact CD2-CE2 4Å; L351-F380 HydrophobicContact CD1-CE2 3.7Å; L351-F380 HydrophobicContact CD1-CZ 4.01Å; I357-F380 HydrophobicContact CD1-CE1 3.96Å; I357-F380 HydrophobicContact CD1-CZ 3.77Å; L368-F380 HydrophobicContact CD1-CE2 3.9Å; L368-F380 HydrophobicContact CD1-CZ 3.89Å; I378-F380 VanDerWaalsContact C-N 3.33Å; I378-F380 HydrophobicContact CG2-CB 4.5Å; I378-F380 HydrophobicContact CG2-CD2 4.35Å; I378-F380 PolarHBondContact O-N 3.36Å
381	W	82.9	Confident	82.6	Confident	99 Å²	99	52.8 Å²	52.8	38%	0.375	30%	0.3	S	S	.	.	S	Bend	trans	-89.2	155	-176.7	-74.2	18.5	0	0	0	112.1	P258 I378 P379 G383 Y384	P258-W381 HydrophobicContact CB-CZ3 3.98Å; P258-W381 HydrophobicContact CG-CZ3 4.43Å; I378-W381 HydrophobicContact CB-CD2 4.34Å; I378-W381 HydrophobicContact CB-CG 4.18Å; I378-W381 HydrophobicContact CD1-CD2 4.35Å; I378-W381 HydrophobicContact CD1-CH2 4.39Å; I378-W381 HydrophobicContact CD1-CZ2 3.87Å; I378-W381 HydrophobicContact CG2-CD2 4.46Å; I378-W381 HydrophobicContact CG2-CG 3.99Å; P379-W381 VanDerWaalsContact C-N 3.34Å; P379-W381 PolarHBondContact O-N 2.91Å; W381-G383 PolarHBondContact O-N 3.02Å; W381-Y384 PolarHBondContact O-N 3.41Å
382	T	71.6	Confident	82.2	Confident	126 Å²	126	58.5 Å²	58.5	77%	0.773	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	133.3	-174	49.4	0	0	0	0	112.7
383	G	66.3	Low	81.7	Confident	37 Å²	37	58.9 Å²	58.9	38%	0.381	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.1	14.9	179	0	0	0	0	0	115.1	R377 W381 N385	R377-G383 VanDerWaalsContact NH1-C 3.28Å; R377-G383 PolarHBondContact NH1-O 2.88Å; R377-G383 PolarHBondContact NH2-O 3.4Å; W381-G383 PolarHBondContact O-N 3.02Å; G383-N385 VanDerWaalsContact C-N 3.34Å; G383-N385 PolarHBondContact O-N 3.31Å; G383-N385 PolarHBondContact O-ND2 2.85Å; G383-N385 PolarHBondContact O-OD1 2.79Å
384	Y	72.2	Confident	81.1	Confident	24 Å²	24	56.5 Å²	56.5	9%	0.094	32%	0.324	C	S	.	.			trans	-63.1	90.6	169.6	-170.6	-98.5	0	0	0	111.3	W324 H371 A375 P379 W381 Q386	W324-Y384 HydrophobicContact CH2-CE1 4.17Å; H371-Y384 PolarHBondContact CD2-OH 3.32Å; H371-Y384 PolarHBondContact O-OH 3.48Å; H371-Y384 VanDerWaalsContact O-OH 3.11Å; A375-Y384 HydrophobicContact CB-CD2 3.94Å; A375-Y384 HydrophobicContact CB-CE2 3.2Å; P379-Y384 VanDerWaalsContact CA-CD2 3.46Å; P379-Y384 VanDerWaalsContact CA-CE2 3.45Å; P379-Y384 HydrophobicContact CB-CD2 4.15Å; P379-Y384 HydrophobicContact CB-CE1 4.45Å; P379-Y384 HydrophobicContact CB-CE2 3.69Å; P379-Y384 HydrophobicContact CG-CE2 4.21Å; P379-Y384 WeakPolarHBondContact O-CB 3.41Å; P379-Y384 VanDerWaalsContact O-CG 3.32Å; W381-Y384 PolarHBondContact O-N 3.41Å; Y384-Q386 HydrophobicContact CD1-CB 4.26Å; Y384-Q386 HydrophobicContact CD1-CG 4.41Å; Y384-Q386 HydrophobicContact CE1-CB 3.71Å; Y384-Q386 HydrophobicContact CE1-CG 3.75Å; Y384-Q386 HydrophobicContact CE2-CG 4.07Å
385	N	68.7	Low	80.4	Confident	134 Å²	134	59.8 Å²	59.8	72%	0.717	35%	0.35	S	S	*	.			trans	-101.8	35.3	-170.6	-63.6	-19.8	0	0	0	112.4	G383	G383-N385 VanDerWaalsContact C-N 3.34Å; G383-N385 PolarHBondContact O-N 3.31Å; G383-N385 PolarHBondContact O-ND2 2.85Å; G383-N385 PolarHBondContact O-OD1 2.79Å
386	Q	76.2	Confident	79.8	Confident	41 Å²	41	63.2 Å²	63.2	19%	0.192	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-66.1	137.8	170.5	-74.4	-61.9	-31.2	0	0	110	R359 L374 A375 Y384	R359-Q386 PolarHBondContact NH1-O 3.43Å; L374-Q386 PolarHBondContact O-NE2 2.77Å; A375-Q386 HydrophobicContact CB-CG 3.93Å; Y384-Q386 HydrophobicContact CD1-CB 4.26Å; Y384-Q386 HydrophobicContact CD1-CG 4.41Å; Y384-Q386 HydrophobicContact CE1-CB 3.71Å; Y384-Q386 HydrophobicContact CE1-CG 3.75Å; Y384-Q386 HydrophobicContact CE2-CG 4.07Å
387	P	80.7	Confident	79	Confident	64 Å²	64	61.9 Å²	61.9	42%	0.416	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-63.5	165.6	172.4	30.1	-35.6	0	0	0	111	R359 I389 L397	R359-P387 PolarHBondContact NH2-O 3.43Å; P387-I389 PolarHBondContact O-N 2.76Å; P387-L397 HydrophobicContact CG-CD2 4.49Å
388	P	85.5	Confident	77.8	Confident	67 Å²	67	61.1 Å²	61.1	44%	0.435	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-49.7	121.4	169.5	-32	39.4	0	0	0	112.9	C361 T390 N393	C361-P388 WeakPolarHBondContact O-CB 3.39Å; P388-T390 PolarHBondContact O-N 3.08Å; P388-T390 VanDerWaalsContact O-N 3.15Å; P388-N393 PolarHBondContact O-ND2 2.72Å; P388-N393 VanDerWaalsContact O-ND2 3.08Å
389	I	86.4	Confident	75.9	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	36%	0.364	C	S	.	.			trans	-83.7	89.3	177	-55.1	175.3	0	0	0	107.7	D362 E363 C364 L366 L374 P387 L394 L397	D362-I389 HydrophobicContact CB-CB 4.13Å; D362-I389 WeakPolarHBondContact OD1-CB 3.47Å; D362-I389 WeakPolarHBondContact OD1-CG1 3.45Å; D362-I389 PolarHBondContact OD1-N 3.48Å; E363-I389 PolarHBondContact N-O 3.3Å; C364-I389 HydrophobicContact CB-CG2 4.47Å; L366-I389 HydrophobicContact CD1-CD1 4.1Å; L366-I389 HydrophobicContact CD1-CG2 4.14Å; L374-I389 HydrophobicContact CD1-CD1 4.4Å; P387-I389 PolarHBondContact O-N 2.76Å; I389-L394 HydrophobicContact CG2-CD1 4.24Å; I389-L397 HydrophobicContact CB-CD1 4.46Å; I389-L397 HydrophobicContact CG1-CD1 4.04Å; I389-L397 HydrophobicContact CG2-CD1 4.23Å
390	T	86.3	Confident	74	Confident	29 Å²	29	66.7 Å²	66.7	18%	0.178	40%	0.396	C	S	.	.			trans	-87.1	160.6	171.2	66.3	0	0	0	0	110.8	E363 P388 V392 N393 L394	E363-T390 HydrophobicContact CG-CG2 4.31Å; E363-T390 VanDerWaalsContact OE2-CA 3.27Å; E363-T390 WeakPolarHBondContact OE2-CA 3.47Å; E363-T390 WeakPolarHBondContact OE2-CB 3.29Å; P388-T390 PolarHBondContact O-N 3.08Å; P388-T390 VanDerWaalsContact O-N 3.15Å; T390-V392 PolarHBondContact O-N 2.82Å; T390-V392 VanDerWaalsContact O-N 3.12Å; T390-N393 PolarHBondContact O-N 2.98Å; T390-N393 VanDerWaalsContact O-N 3.11Å; T390-N393 WeakPolarHBondContact OG1-CB 3.37Å; T390-N393 VanDerWaalsContact OG1-CG 3.24Å; T390-N393 PolarHBondContact OG1-N 3.11Å; T390-N393 VanDerWaalsContact OG1-N 3.15Å; T390-N393 PolarHBondContact OG1-ND2 3.43Å; T390-L394 PolarHBondContact O-N 3.37Å; T390-L394 VanDerWaalsContact O-N 3.08Å
391	N	82.9	Confident	71.7	Confident	109 Å²	109	71.4 Å²	71.4	58%	0.583	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-26.9	174.6	-69	-87.3	0	0	0	112.4	E363 C364	E363-N391 PolarHBondContact OE2-N 3.44Å; E363-N391 PolarHBondContact OE2-ND2 3.43Å; C364-N391 VanDerWaalsContact SG-CG 3.52Å; C364-N391 PolarHBondContact SG-OD1 2.94Å; C364-N391 VanDerWaalsContact SG-OD1 3.34Å
392	V	81.9	Confident	69.4	Low	119 Å²	119	75.5 Å²	75.5	72%	0.721	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-42.9	176.8	-174.7	0	0	0	0	111.6	T390 L394	T390-V392 PolarHBondContact O-N 2.82Å; T390-V392 VanDerWaalsContact O-N 3.12Å; V392-L394 VanDerWaalsContact C-N 3.33Å; V392-L394 PolarHBondContact O-N 2.71Å
393	N	80.8	Confident	67.4	Low	65 Å²	65	76.3 Å²	76.3	35%	0.348	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-25.1	-177.1	-70	-14.8	0	0	0	112.8	P388 T390 S395 T396 L397	P388-N393 PolarHBondContact O-ND2 2.72Å; P388-N393 VanDerWaalsContact O-ND2 3.08Å; T390-N393 PolarHBondContact O-N 2.98Å; T390-N393 VanDerWaalsContact O-N 3.11Å; T390-N393 WeakPolarHBondContact OG1-CB 3.37Å; T390-N393 VanDerWaalsContact OG1-CG 3.24Å; T390-N393 PolarHBondContact OG1-N 3.11Å; T390-N393 VanDerWaalsContact OG1-N 3.15Å; T390-N393 PolarHBondContact OG1-ND2 3.43Å; N393-S395 PolarHBondContact O-N 3.17Å; N393-T396 WeakPolarHBondContact O-CB 3.36Å; N393-T396 PolarHBondContact O-N 3.1Å; N393-L397 HydrophobicContact CB-CD1 4.02Å; N393-L397 HydrophobicContact CB-CG 4.47Å; N393-L397 WeakPolarHBondContact O-CG 3.4Å; N393-L397 PolarHBondContact O-N 2.87Å
394	L	77.7	Confident	65.7	Low	43 Å²	43	78.9 Å²	78.9	23%	0.225	45%	0.45	C	S	.	.	H	α-helix	trans	-55.5	-46.5	-171.2	-177.9	55.7	0	0	0	113.1	C364 L366 I389 T390 V392 T396 L397 S398	C364-L394 HydrophobicContact CB-CD2 4.5Å; L366-L394 HydrophobicContact CD1-CD1 3.81Å; L366-L394 HydrophobicContact CD2-CD1 3.63Å; L366-L394 HydrophobicContact CD2-CD2 3.89Å; L366-L394 HydrophobicContact CD2-CG 4.44Å; L366-L394 HydrophobicContact CG-CD1 4.35Å; I389-L394 HydrophobicContact CG2-CD1 4.24Å; T390-L394 PolarHBondContact O-N 3.37Å; T390-L394 VanDerWaalsContact O-N 3.08Å; V392-L394 VanDerWaalsContact C-N 3.33Å; V392-L394 PolarHBondContact O-N 2.71Å; L394-T396 VanDerWaalsContact C-N 3.3Å; L394-T396 PolarHBondContact O-N 3.09Å; L394-L397 PolarHBondContact O-N 3.07Å; L394-S398 PolarHBondContact O-N 3.31Å; L394-S398 PolarHBondContact O-OG 3.03Å
395	S	72.9	Confident	63.7	Low	100 Å²	100	84.9 Å²	84.9	70%	0.699	48%	0.483	S	S	*	.	H	α-helix	trans	-62.3	-35.4	178.2	-53.5	0	0	0	0	113	N393 G399	N393-S395 PolarHBondContact O-N 3.17Å; S395-G399 PolarHBondContact O-N 3.42Å
396	T	70.9	Confident	61.9	Low	90 Å²	90	84.3 Å²	84.3	55%	0.552	48%	0.48	S	S	*	.	H	α-helix	trans	-72.8	-43.2	176.3	-47.8	0	0	0	0	111.2	N393 L394 S398 G399 L400	N393-T396 WeakPolarHBondContact O-CB 3.36Å; N393-T396 PolarHBondContact O-N 3.1Å; L394-T396 VanDerWaalsContact C-N 3.3Å; L394-T396 PolarHBondContact O-N 3.09Å; T396-S398 PolarHBondContact O-N 2.94Å; T396-G399 PolarHBondContact O-N 3.27Å; T396-G399 VanDerWaalsContact O-N 3.1Å; T396-L400 WeakPolarHBondContact O-CG 3.32Å; T396-L400 PolarHBondContact O-N 2.97Å; T396-L400 VanDerWaalsContact O-N 3.09Å
397	L	66.4	Low	59.9	Low	20 Å²	20	87.3 Å²	87.3	11%	0.105	50%	0.498	C	S	.	.	H	α-helix	trans	-60.9	-44.2	178.5	-73.8	169.1	0	0	0	111.6	L374 P387 I389 N393 L394 G399 L400	L374-L397 HydrophobicContact CD2-CB 3.86Å; L374-L397 VanDerWaalsContact CD2-O 3.29Å; L374-L397 WeakPolarHBondContact CD2-O 3.49Å; P387-L397 HydrophobicContact CG-CD2 4.49Å; I389-L397 HydrophobicContact CB-CD1 4.46Å; I389-L397 HydrophobicContact CG1-CD1 4.04Å; I389-L397 HydrophobicContact CG2-CD1 4.23Å; N393-L397 HydrophobicContact CB-CD1 4.02Å; N393-L397 HydrophobicContact CB-CG 4.47Å; N393-L397 WeakPolarHBondContact O-CG 3.4Å; N393-L397 PolarHBondContact O-N 2.87Å; L394-L397 PolarHBondContact O-N 3.07Å; L397-G399 VanDerWaalsContact C-N 3.29Å; L397-G399 PolarHBondContact O-N 2.88Å; L397-L400 PolarHBondContact O-N 3.39Å
398	S	61.8	Low	57.6	Low	62 Å²	62	90.1 Å²	90.1	43%	0.434	51%	0.509	S	S	.	.	H	α-helix	trans	-60.1	-36.3	172.7	-62.4	0	0	0	0	112.9	L394 T396 Y402	L394-S398 PolarHBondContact O-N 3.31Å; L394-S398 PolarHBondContact O-OG 3.03Å; T396-S398 PolarHBondContact O-N 2.94Å; S398-Y402 WeakPolarHBondContact O-CD2 3.2Å
399	G	48	Very low	54.8	Low	38 Å²	38	90.3 Å²	90.3	39%	0.392	52%	0.524	S	S	.	.	H	α-helix	trans	-74.5	-27.2	180	0	0	0	0	0	115	S395 T396 L397 N401 Y402	S395-G399 PolarHBondContact O-N 3.42Å; T396-G399 PolarHBondContact O-N 3.27Å; T396-G399 VanDerWaalsContact O-N 3.1Å; L397-G399 VanDerWaalsContact C-N 3.29Å; L397-G399 PolarHBondContact O-N 2.88Å; G399-N401 VanDerWaalsContact C-N 3.25Å; G399-N401 PolarHBondContact O-N 3.33Å; G399-Y402 PolarHBondContact O-N 2.97Å; G399-Y402 VanDerWaalsContact O-N 3.15Å
400	L	45.2	Very low	52.3	Low	129 Å²	129	98 Å²	98	68%	0.675	57%	0.565	S	S	*	*	H	α-helix	trans	-68.6	-21.2	-176.3	-74.9	171.3	0	0	0	113.8	T396 L397	T396-L400 WeakPolarHBondContact O-CG 3.32Å; T396-L400 PolarHBondContact O-N 2.97Å; T396-L400 VanDerWaalsContact O-N 3.09Å; L397-L400 PolarHBondContact O-N 3.39Å
401	N	40	Very low	49.8	Very low	104 Å²	104	104.3 Å²	104.3	56%	0.556	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	3.9	175.7	-153.3	35.9	0	0	0	113.8	G399	G399-N401 VanDerWaalsContact C-N 3.25Å; G399-N401 PolarHBondContact O-N 3.33Å
402	Y	34.5	Very low	47.3	Very low	184 Å²	184	105.4 Å²	105.4	72%	0.722	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107	7.3	179.2	-89	-84.9	0	0	0	114	S398 G399	S398-Y402 WeakPolarHBondContact O-CD2 3.2Å; G399-Y402 PolarHBondContact O-N 2.97Å; G399-Y402 VanDerWaalsContact O-N 3.15Å
403	N	30.1	Very low	44.8	Very low	143 Å²	143	104.9 Å²	104.9	77%	0.765	60%	0.595	S	S	*	*	S	Bend	trans	-123.1	21.1	-178.6	-102.2	-25.4	0	0	0	114.3
404	S	31.2	Very low	42.4	Very low	91 Å²	91	108.6 Å²	108.6	64%	0.636	61%	0.613	S	S	*	*	S	Bend	trans	-120.6	139.1	153	-167.9	0	0	0	0	107.4
405	N	30.6	Very low	40	Very low	150 Å²	150	113.6 Å²	113.6	80%	0.802	64%	0.635	S	S	*	*			trans	69.3	44.9	-179.5	-50.3	17.1	0	0	0	115.2	N407	N405-N407 VanDerWaalsContact C-N 3.28Å; N405-N407 PolarHBondContact O-N 3.3Å; N405-N407 VanDerWaalsContact O-N 3.13Å
406	N	29.2	Very low	38	Very low	122 Å²	122	114 Å²	114	65%	0.652	64%	0.638	S	S	*	*			trans	-76.8	84.4	153	-92.5	-38.5	0	0	0	109.6
407	N	34.1	Very low	36.3	Very low	104 Å²	104	115.8 Å²	115.8	56%	0.556	65%	0.649	S	S	*	*	S	Bend	trans	-171.8	137.5	135.3	-91.7	-22.9	0	0	0	111	N405	N405-N407 VanDerWaalsContact C-N 3.28Å; N405-N407 PolarHBondContact O-N 3.3Å; N405-N407 VanDerWaalsContact O-N 3.13Å
408	N	33.3	Very low	34.6	Very low	123 Å²	123	121.4 Å²	121.4	66%	0.658	68%	0.678	S	S	*	*	S	Bend	trans	54	96.6	158.8	-58.8	-14.8	0	0	0	119.7
409	G	27.5	Very low	33.2	Very low	72 Å²	72	126.3 Å²	126.3	74%	0.742	70%	0.698	S	S	*	*				95.8	46.1	119.1	0	0	0	0	0	119.2
410	N	32.2	Very low	32.5	Very low	160 Å²	160	130.1 Å²	130.1	86%	0.856	71%	0.709	S	S	*	*			trans	-155.5	96.3	147.2	-104	-44.5	0	0	0	111.7	V412	N410-V412 PolarHBondContact O-N 2.96Å
411	Q	33.9	Very low	31.8	Very low	163 Å²	163	129.9 Å²	129.9	76%	0.762	71%	0.708	S	S	*	*			trans	-73.4	116.3	165	-70	-166.9	77.5	0	0	108.5	L413	Q411-L413 HydrophobicContact CB-CB 4.32Å; Q411-L413 PolarHBondContact O-N 3.39Å
412	V	32.2	Very low	31.5	Very low	132 Å²	132	134.2 Å²	134.2	80%	0.8	73%	0.725	S	S	*	*			trans	-75.9	66.8	165.3	-176.1	0	0	0	0	108.2	N410 I414	N410-V412 PolarHBondContact O-N 2.96Å; V412-I414 VanDerWaalsContact C-N 3.29Å; V412-I414 HydrophobicContact CG1-CG1 4.14Å; V412-I414 PolarHBondContact O-N 3.2Å
413	L	27.9	Very low	31.3	Very low	107 Å²	107	131.4 Å²	131.4	56%	0.56	73%	0.728	S	S	*	*			trans	-77.7	82.6	178.7	-153.4	72.5	0	0	0	107.8	Q411 H415	Q411-L413 HydrophobicContact CB-CB 4.32Å; Q411-L413 PolarHBondContact O-N 3.39Å; L413-H415 VanDerWaalsContact C-N 3.31Å; L413-H415 PolarHBondContact O-CD2 2.74Å; L413-H415 PolarHBondContact O-N 2.85Å
414	I	31.9	Very low	31.5	Very low	143 Å²	143	130.6 Å²	130.6	73%	0.733	73%	0.73	S	S	*	*			trans	-66.1	98.1	168.5	-59.7	179.9	0	0	0	106.5	V412 S416	V412-I414 VanDerWaalsContact C-N 3.29Å; V412-I414 HydrophobicContact CG1-CG1 4.14Å; V412-I414 PolarHBondContact O-N 3.2Å; I414-S416 PolarHBondContact O-N 3.33Å
415	H	27.4	Very low	31.5	Very low	148 Å²	148	131.8 Å²	131.8	69%	0.685	74%	0.739	S	S	*	*			trans	-58.3	93.9	-176.3	-76.6	-168.2	0	0	0	111.1	L413 T417	L413-H415 VanDerWaalsContact C-N 3.31Å; L413-H415 PolarHBondContact O-CD2 2.74Å; L413-H415 PolarHBondContact O-N 2.85Å; H415-T417 PolarHBondContact O-N 2.7Å; H415-T417 VanDerWaalsContact O-N 3.14Å
416	S	29.9	Very low	31.7	Very low	109 Å²	109	129.9 Å²	129.9	76%	0.762	74%	0.737	S	S	*	*			trans	-70	102.3	157.9	-64.7	0	0	0	0	106.7	I414 I418	I414-S416 PolarHBondContact O-N 3.33Å; S416-I418 PolarHBondContact O-N 3.39Å; S416-I418 VanDerWaalsContact O-N 3.16Å
417	T	34.9	Very low	32.1	Very low	127 Å²	127	129.6 Å²	129.6	78%	0.779	74%	0.744	S	S	*	*			trans	-55.5	121.2	-174.7	-52.3	0	0	0	0	110.8	H415 I419	H415-T417 PolarHBondContact O-N 2.7Å; H415-T417 VanDerWaalsContact O-N 3.14Å; T417-I419 PolarHBondContact O-N 2.9Å; T417-I419 VanDerWaalsContact O-N 3.12Å
418	I	30.1	Very low	32.3	Very low	138 Å²	138	130.8 Å²	130.8	71%	0.708	76%	0.755	S	S	*	*			trans	-69.4	108.9	-179.5	-61.8	169.7	0	0	0	109	S416 N420	S416-I418 PolarHBondContact O-N 3.39Å; S416-I418 VanDerWaalsContact O-N 3.16Å; I418-N420 HydrophobicContact CG2-CB 3.74Å
419	I	34	Very low	32.5	Very low	166 Å²	166	130.3 Å²	130.3	85%	0.851	76%	0.759	S	S	*	*			trans	-104	103.4	153.1	-62.2	-178.9	0	0	0	105.8	T417	T417-I419 PolarHBondContact O-N 2.9Å; T417-I419 VanDerWaalsContact O-N 3.12Å
420	N	33.5	Very low	33.1	Very low	118 Å²	118	132.9 Å²	132.9	63%	0.631	76%	0.763	S	S	*	*			trans	-91	134.9	-169.6	-137.1	-2.9	0	0	0	111.5	I418	I418-N420 HydrophobicContact CG2-CB 3.74Å
421	N	30.4	Very low	33.2	Very low	123 Å²	123	128.7 Å²	128.7	66%	0.658	76%	0.757	S	S	*	*			trans	53.5	110.7	155.4	-58.9	-32.8	0	0	0	119.6
422	Q	32.7	Very low	33.3	Very low	195 Å²	195	128.4 Å²	128.4	91%	0.911	76%	0.76	S	S	*	*				-151.5	160.8	97.5	-107.6	147.5	105.6	0	0	113.2
423	T	30.6	Very low	33.6	Very low	126 Å²	126	127.5 Å²	127.5	77%	0.773	75%	0.754	S	S	*	*			trans	-78.2	167.4	-171.2	50.8	0	0	0	0	112.6
424	P	33.8	Very low	33.7	Very low	125 Å²	125	129 Å²	129	81%	0.812	76%	0.763	S	S	*	*				-138.3	139.9	106	36.4	-25.7	0	0	0	114.4
425	S	31.2	Very low	33.8	Very low	117 Å²	117	133.6 Å²	133.6	82%	0.818	77%	0.771	S	S	*	*			trans	-81.6	158.4	158.7	47.7	0	0	0	0	110.4
426	S	34.8	Very low	34	Very low	110 Å²	110	134.4 Å²	134.4	77%	0.769	77%	0.772	S	S	*	*			trans	-148.2	162.1	177.9	67.2	0	0	0	0	112.9
427	S	37	Very low	34.4	Very low	115 Å²	115	135.9 Å²	135.9	80%	0.804	78%	0.777	S	S	*	*			trans	65.6	133.5	-161.2	78.5	0	0	0	0	113
428	T	38.7	Very low	34.2	Very low	129 Å²	129	135.5 Å²	135.5	79%	0.791	77%	0.771	S	S	*	*			cis	-140.5	149.6	13.2	-53.6	0	0	0	0	110.4
429	P	38.2	Very low	34.2	Very low	113 Å²	113	135.6 Å²	135.6	73%	0.734	78%	0.782	S	S	*	*			trans	-108	-163.6	-166.7	45.2	-38.5	0	0	0	113
430	P	40.4	Very low	34	Very low	126 Å²	126	136.4 Å²	136.4	82%	0.818	78%	0.782	S	S	*	*			cis	-127.3	175.5	-14.3	36.3	-18.8	0	0	0	114.9
431	G	34.2	Very low	33.9	Very low	72 Å²	72	138.3 Å²	138.3	74%	0.742	79%	0.791	S	S	*	*			trans	-176.3	61.7	177.5	0	0	0	0	0	122.3
432	I	35.2	Very low	34	Very low	158 Å²	158	137.2 Å²	137.2	81%	0.81	79%	0.793	S	S	*	*			trans	59.7	109.1	137.8	-66.6	175.2	0	0	0	121.6
433	T	38.2	Very low	34	Very low	112 Å²	112	135.1 Å²	135.1	69%	0.687	79%	0.787	S	S	*	*			trans	76.4	105.7	143.6	58	0	0	0	0	126.2
434	N	31.4	Very low	34.2	Very low	139 Å²	139	135.2 Å²	135.2	74%	0.743	79%	0.789	S	S	*	*				73.2	141.2	112	-70.8	-24.4	0	0	0	126
435	R	34.2	Very low	34	Very low	239 Å²	239	137.8 Å²	137.8	90%	0.902	79%	0.791	S	S	*	*			trans	75.1	121.8	165.9	-59.5	158.3	-167.1	-130.6	2.6	114.4
436	K	30.9	Very low	34.1	Very low	165 Å²	165	137.5 Å²	137.5	72%	0.717	79%	0.789	S	S	*	*			cis	79.3	108.5	28.4	-165.8	-174.6	176.6	177.9	0	116	D438	K436-D438 WeakPolarHBondContact CE-OD1 3.38Å; K436-D438 WeakPolarHBondContact CE-OD2 3.42Å; K436-D438 IonicContact NZ-OD1 3.91Å; K436-D438 IonicContact NZ-OD2 3.88Å
437	T	37	Very low	34	Very low	141 Å²	141	139.2 Å²	139.2	87%	0.865	80%	0.795	S	S	*	*			trans	-158	139.7	139.3	26.8	0	0	0	0	110.9
438	D	32.2	Very low	33.4	Very low	119 Å²	119	141.4 Å²	141.4	64%	0.636	80%	0.796	S	S	*	*			trans	-82.4	168	-172.4	-33	-85.1	0	0	0	113.3	K436	K436-D438 WeakPolarHBondContact CE-OD1 3.38Å; K436-D438 WeakPolarHBondContact CE-OD2 3.42Å; K436-D438 IonicContact NZ-OD1 3.91Å; K436-D438 IonicContact NZ-OD2 3.88Å
439	C	30.6	Very low	33.1	Very low	139 Å²	139	141.8 Å²	141.8	94%	0.939	80%	0.799	S	S	*	*			trans	-177.7	159.1	140.8	-104.2	0	0	0	0	113.6
440	E	28.8	Very low	32.6	Very low	183 Å²	183	141.3 Å²	141.3	86%	0.855	79%	0.794	S	S	*	*			trans	-114.6	-153.9	-166.1	-52	175.5	99.8	0	0	114.2
441	I	31.8	Very low	32	Very low	159 Å²	159	143.8 Å²	143.8	82%	0.815	79%	0.792	S	S	*	*			trans	93	131.6	164.2	-53.3	163.4	0	0	0	115.4
442	S	31.6	Very low	31.7	Very low	100 Å²	100	147.1 Å²	147.1	70%	0.699	79%	0.793	S	S	*	*			cis	-169.1	154.9	-25.4	58.2	0	0	0	0	110.3
443	L	32.5	Very low	31.7	Very low	151 Å²	151	147.3 Å²	147.3	79%	0.791	79%	0.791	S	S	*	*			trans	-76	165.9	169.7	-96.4	72.7	0	0	0	113.2
444	P	35.8	Very low	31.3	Very low	127 Å²	127	148.6 Å²	148.6	83%	0.825	79%	0.793	S	S	*	*				-137.8	165.6	115.1	38.5	-28.5	0	0	0	115.3
445	Q	29.3	Very low	31.4	Very low	180 Å²	180	147.4 Å²	147.4	84%	0.841	79%	0.791	S	S	*	*			trans	-110.5	150	177.3	-58.2	171.3	-49.3	0	0	112.1
446	S	32.6	Very low	31.4	Very low	111 Å²	111	143.1 Å²	143.1	78%	0.776	79%	0.785	S	S	*	*			trans	175.5	146.3	156.8	47.8	0	0	0	0	110
447	T	33.9	Very low	31.4	Very low	146 Å²	146	142.9 Å²	142.9	90%	0.896	79%	0.786	S	S	*	*			cis	-160.1	162.9	-10.2	14.2	0	0	0	0	108.7
448	L	25	Very low	31.3	Very low	160 Å²	160	144.1 Å²	144.1	84%	0.838	79%	0.786	S	S	*	*			trans	-112.3	136.3	-176.6	-122.4	167.2	0	0	0	111.7
449	T	32.5	Very low	31.3	Very low	137 Å²	137	144.4 Å²	144.4	84%	0.84	78%	0.784	S	S	*	*			trans	-148.7	170.7	165.2	43.9	0	0	0	0	111.2
450	T	26.3	Very low	31.6	Very low	103 Å²	103	144.8 Å²	144.8	63%	0.632	78%	0.777	S	S	*	*			trans	-137.3	169.6	-147.3	-40.4	0	0	0	0	113.3
451	F	27.7	Very low	31.6	Very low	178 Å²	178	144.9 Å²	144.9	78%	0.781	77%	0.774	S	S	*	*			trans	78.1	149.3	168.2	-52.6	-72.6	0	0	0	116.1
452	D	29.2	Very low	31.8	Very low	143 Å²	143	140.4 Å²	140.4	77%	0.765	77%	0.768	S	S	*	*			cis	-154.3	176.6	-7.9	-127.8	-26.7	0	0	0	111.9
453	E	34	Very low	31.8	Very low	162 Å²	162	142.3 Å²	142.3	76%	0.757	77%	0.77	S	S	*	*			trans	-69.4	144.3	171	-64.8	-174.4	124.1	0	0	113.7
454	N	30	Very low	31.6	Very low	138 Å²	138	140.8 Å²	140.8	74%	0.738	77%	0.766	S	S	*	*				153.7	138.5	117.6	-87.6	-74.2	0	0	0	117.5
455	T	32.7	Very low	31.3	Very low	114 Å²	114	141.7 Å²	141.7	70%	0.699	77%	0.765	S	S	*	*			trans	79.1	159.6	150	-45.9	0	0	0	0	121.4
456	I	34.8	Very low	31.3	Very low	150 Å²	150	139 Å²	139	77%	0.769	76%	0.76	S	S	*	*			trans	92.6	94.7	168.8	-51.5	178.6	0	0	0	113.6
457	Q	30.7	Very low	31.2	Very low	159 Å²	159	139.4 Å²	139.4	74%	0.743	76%	0.763	S	S	*	*				68.8	122.8	57.8	-71.9	-155	71.8	0	0	116.9
458	L	34.6	Very low	31	Very low	168 Å²	168	139.4 Å²	139.4	88%	0.88	76%	0.757	S	S	*	*			trans	-177.4	153.9	148.2	-93	149	0	0	0	107.4
459	Q	32.3	Very low	31.2	Very low	125 Å²	125	139 Å²	139	58%	0.584	76%	0.756	S	S	*	*			cis	-169.3	164.7	-40.2	-178.4	62.3	0.3	0	0	107.4
460	N	36.8	Very low	31.3	Very low	147 Å²	147	138.7 Å²	138.7	79%	0.786	75%	0.749	S	S	*	*			trans	86.5	104.2	176	-49.2	-35.5	0	0	0	114.5
461	K	30	Very low	31.4	Very low	184 Å²	184	143.4 Å²	143.4	80%	0.8	76%	0.764	S	S	*	*			cis	99.3	116.5	15.7	-161.8	-174.3	178.2	-175.8	0	114.8
462	G	35.5	Very low	31.5	Very low	66 Å²	66	141.3 Å²	141.3	68%	0.68	77%	0.766	S	S	*	*			trans	117.8	137.5	165.2	0	0	0	0	0	114.5
463	D	30.9	Very low	31.4	Very low	140 Å²	140	142.5 Å²	142.5	75%	0.749	77%	0.767	S	S	*	*			cis	-171	147.6	-29.2	-112.8	-38.8	0	0	0	109.9
464	V	29.2	Very low	31.1	Very low	118 Å²	118	141.3 Å²	141.3	72%	0.715	77%	0.771	S	S	*	*			trans	77.5	134.7	150.8	173.8	0	0	0	0	122.5
465	N	29	Very low	31	Very low	147 Å²	147	139.2 Å²	139.2	79%	0.786	76%	0.763	S	S	*	*			trans	71.9	85.6	157.4	-72	-3	0	0	0	124
466	V	28.9	Very low	31	Very low	123 Å²	123	140.3 Å²	140.3	75%	0.745	76%	0.763	S	S	*	*				-2.4	130	122.2	-178.9	0	0	0	0	118.3
467	S	30.8	Very low	30.7	Very low	120 Å²	120	138.7 Å²	138.7	84%	0.839	76%	0.756	S	S	*	*			trans	-164.1	136.5	132	-76.8	0	0	0	0	110
468	D	30.6	Very low	30.7	Very low	145 Å²	145	137.7 Å²	137.7	78%	0.775	76%	0.756	S	S	*	*			trans	-81.6	136.6	-172.8	-55.3	-80.1	0	0	0	114.1
469	N	29.3	Very low	30.4	Very low	151 Å²	151	136.6 Å²	136.6	81%	0.807	75%	0.751	S	S	*	*				-178.4	169.7	128.1	-99.9	-25	0	0	0	113.8
470	D	32.9	Very low	30.3	Very low	132 Å²	132	135.2 Å²	135.2	71%	0.706	76%	0.755	S	S	*	*			trans	65.1	72.6	156.7	-58.3	-17.6	0	0	0	119.4	T472	D470-T472 PolarHBondContact O-N 3.14Å
471	Q	29	Very low	30	Very low	202 Å²	202	136 Å²	136	94%	0.944	76%	0.757	S	S	*	*				28	89.2	117.9	-172.8	163.6	56.5	0	0	116.9
472	T	30.4	Very low	30	Very low	134 Å²	134	133.5 Å²	133.5	82%	0.822	76%	0.758	S	S	*	*			trans	-108.7	133.8	168.1	36.1	0	0	0	0	111.3	D470	D470-T472 PolarHBondContact O-N 3.14Å
473	Q	27.8	Very low	29.7	Very low	167 Å²	167	134 Å²	134	78%	0.78	75%	0.751	S	S	*	*			trans	-73.4	134.6	171.5	-73.2	178.7	-32.7	0	0	109.9	T475	Q473-T475 VanDerWaalsContact C-N 3.3Å; Q473-T475 PolarHBondContact O-N 2.94Å
474	V	27	Very low	29.8	Very low	138 Å²	138	135.4 Å²	135.4	84%	0.836	75%	0.753	S	S	*	*			trans	-80.1	83.9	167.2	-178.3	0	0	0	0	108.3	I476	V474-I476 PolarHBondContact O-N 3.41Å
475	T	27.3	Very low	29.9	Very low	94 Å²	94	137.9 Å²	137.9	58%	0.577	76%	0.76	S	S	*	*			trans	-68.3	113.4	168.4	-49.4	0	0	0	0	108.5	Q473 N477	Q473-T475 VanDerWaalsContact C-N 3.3Å; Q473-T475 PolarHBondContact O-N 2.94Å; T475-N477 VanDerWaalsContact C-N 3.31Å; T475-N477 WeakPolarHBondContact CG2-OD1 3.45Å; T475-N477 PolarHBondContact O-N 2.87Å
476	I	32.2	Very low	29.9	Very low	137 Å²	137	136.1 Å²	136.1	70%	0.703	76%	0.759	S	S	*	*			trans	-76.1	89.6	171.2	-56.6	179.2	0	0	0	107.4	V474 N478	V474-I476 PolarHBondContact O-N 3.41Å; I476-N478 PolarHBondContact O-N 2.94Å
477	N	29.1	Very low	29.9	Very low	116 Å²	116	136.5 Å²	136.5	62%	0.62	76%	0.762	S	S	*	*			trans	-69.6	97.6	174.9	-67.9	-12.3	0	0	0	109.2	T475 D479	T475-N477 VanDerWaalsContact C-N 3.31Å; T475-N477 WeakPolarHBondContact CG2-OD1 3.45Å; T475-N477 PolarHBondContact O-N 2.87Å; N477-D479 PolarHBondContact O-N 3.44Å
478	N	29.9	Very low	29.8	Very low	138 Å²	138	139.1 Å²	139.1	74%	0.738	77%	0.766	S	S	*	*			trans	-74.5	4.2	174.9	-81.9	-7	0	0	0	113.8	I476 S480	I476-N478 PolarHBondContact O-N 2.94Å; N478-S480 PolarHBondContact O-N 2.98Å
479	D	29	Very low	29.8	Very low	144 Å²	144	137.7 Å²	137.7	77%	0.77	77%	0.767	S	S	*	*			trans	-79	64.3	175.1	-63.9	-35.6	0	0	0	111.4	N477	N477-D479 PolarHBondContact O-N 3.44Å
480	S	30.6	Very low	29.8	Very low	97 Å²	97	136.2 Å²	136.2	68%	0.678	77%	0.769	S	S	*	*			trans	-149.2	24	-179.4	-74	0	0	0	0	115.2	N478	N478-S480 PolarHBondContact O-N 2.98Å
481	I	30.5	Very low	29.7	Very low	162 Å²	162	136.9 Å²	136.9	83%	0.831	77%	0.772	S	S	*	*	S	Bend	trans	-131.7	36.2	170.9	-36.8	-178	0	0	0	111.8
482	T	29.9	Very low	29.7	Very low	132 Å²	132	133.3 Å²	133.3	81%	0.81	77%	0.765	S	S	*	*	S	Bend	trans	-143.1	51.2	-178.7	53.4	0	0	0	0	113.4
483	S	30	Very low	29.8	Very low	78 Å²	78	134.9 Å²	134.9	55%	0.545	77%	0.766	S	S	.	*	S	Bend	trans	-137.8	-0.1	-174.6	54	0	0	0	0	116.9
484	H	32.8	Very low	29.9	Very low	169 Å²	169	132.5 Å²	132.5	78%	0.782	77%	0.768	S	S	*	*	S	Bend	trans	-128.1	10.6	-165.7	-68.8	-62.6	0	0	0	117.6
485	I	31.1	Very low	30.2	Very low	169 Å²	169	131 Å²	131	87%	0.867	76%	0.764	S	S	*	*	S	Bend	trans	-130.4	54.9	178	-41.9	-178.1	0	0	0	111.3
486	S	28.3	Very low	30.6	Very low	110 Å²	110	131.3 Å²	131.3	77%	0.769	77%	0.769	S	S	*	*			trans	-139.9	35.8	-175.9	-56.8	0	0	0	0	114.1
487	T	30.1	Very low	30.6	Very low	131 Å²	131	132.8 Å²	132.8	80%	0.804	78%	0.777	S	S	*	*			trans	-138	34.9	-172.7	49.9	0	0	0	0	115.3
488	L	27.7	Very low	30.9	Very low	176 Å²	176	130.8 Å²	130.8	92%	0.921	78%	0.777	S	S	*	*			trans	-127.7	63.6	168.6	-77.1	175.6	0	0	0	111.7
489	S	30.5	Very low	31.1	Very low	115 Å²	115	132.2 Å²	132.2	80%	0.804	78%	0.779	S	S	*	*			trans	-130.3	119.7	168.8	-59.3	0	0	0	0	109.2
490	S	28.8	Very low	31.4	Very low	120 Å²	120	135.6 Å²	135.6	84%	0.839	78%	0.783	S	S	*	*			trans	-65.6	134.8	-167	51.3	0	0	0	0	114
491	N	30.9	Very low	31.7	Very low	146 Å²	146	136.1 Å²	136.1	78%	0.781	79%	0.786	S	S	*	*			trans	-145.5	123.5	163.6	-96.8	-48	0	0	0	112.6
492	T	30.2	Very low	32	Very low	127 Å²	127	137 Å²	137	78%	0.779	79%	0.787	S	S	*	*			trans	56.3	89.9	140.9	-44.5	0	0	0	0	119.9
493	I	31.1	Very low	32.2	Very low	167 Å²	167	135.2 Å²	135.2	86%	0.856	78%	0.779	S	S	*	*			trans	-133.3	134.7	139	-59.1	-177.3	0	0	0	108.7
494	S	29.9	Very low	32.6	Very low	116 Å²	116	140.9 Å²	140.9	81%	0.811	80%	0.797	S	S	*	*			trans	-154	108.1	171.8	-75	0	0	0	0	111.4
495	S	34.2	Very low	32.6	Very low	107 Å²	107	138.2 Å²	138.2	75%	0.748	79%	0.793	S	S	*	*			trans	178	148.2	154.1	44.2	0	0	0	0	112.6
496	S	36.4	Very low	32.7	Very low	100 Å²	100	137.7 Å²	137.7	70%	0.699	79%	0.791	S	S	*	*			trans	63.8	123.1	168.7	21	0	0	0	0	117.6
497	I	31.7	Very low	32.9	Very low	168 Å²	168	139.3 Å²	139.3	86%	0.862	79%	0.786	S	S	*	*				73.9	121.9	55.9	-64.1	166.3	0	0	0	110.7
498	A	34.7	Very low	33.2	Very low	75 Å²	75	141.3 Å²	141.3	62%	0.62	79%	0.786	S	S	*	*			cis	-163.3	175.3	-4.4	0	0	0	0	0	112
499	E	34.5	Very low	33.4	Very low	168 Å²	168	139 Å²	139	79%	0.785	79%	0.785	S	S	*	*			trans	47.3	123.1	155.6	-67	166.6	-178.6	0	0	118.8
500	Y	36.1	Very low	33.5	Very low	215 Å²	215	139 Å²	139	84%	0.843	79%	0.785	S	S	*	*				-156.3	166.2	68.7	-114.6	-100.3	0	0	0	114.2
501	S	36.3	Very low	33.8	Very low	107 Å²	107	138 Å²	138	75%	0.748	78%	0.778	S	S	*	*			trans	-66.3	171.3	171.6	-55.4	0	0	0	0	112.6
502	E	37.1	Very low	34.1	Very low	181 Å²	181	139.9 Å²	139.9	85%	0.846	78%	0.78	S	S	*	*			cis	-159.8	141.8	33.6	-171	167.6	-170.6	0	0	116.4
503	S	34.9	Very low	34.5	Very low	94 Å²	94	139.5 Å²	139.5	66%	0.657	78%	0.777	S	S	*	*			trans	0.9	125	158.3	-47.6	0	0	0	0	122.5
504	Q	37.4	Very low	35.1	Very low	197 Å²	197	135.2 Å²	135.2	92%	0.921	77%	0.774	S	S	*	*				-160.2	166.6	108.4	-111.5	166.1	84.8	0	0	112.7
505	T	32.9	Very low	36.4	Very low	114 Å²	114	135.1 Å²	135.1	70%	0.699	76%	0.763	S	S	*	*			trans	-127.7	141.6	-150.9	46.2	0	0	0	0	115.8
506	L	32.3	Very low	38.4	Very low	157 Å²	157	135.2 Å²	135.2	82%	0.822	76%	0.756	S	S	*	*			trans	-175.1	106.7	139.3	-91.6	142.6	0	0	0	106.4
507	H	32.4	Very low	40.3	Very low	144 Å²	144	138.5 Å²	138.5	67%	0.667	76%	0.76	S	S	*	*				58.7	116	90.5	-65.6	-62.4	0	0	0	112.5
508	H	36.6	Very low	42.7	Very low	173 Å²	173	136.4 Å²	136.4	80%	0.801	75%	0.745	S	S	*	*			cis	-147.2	153.4	12	-47.1	-107.5	0	0	0	111.8
509	S	33.3	Very low	45	Very low	127 Å²	127	135.4 Å²	135.4	89%	0.888	74%	0.736	S	S	*	*			trans	-133.9	129.2	173.1	-50.7	0	0	0	0	111
510	S	31.9	Very low	47.2	Very low	116 Å²	116	132.8 Å²	132.8	81%	0.811	73%	0.727	S	S	*	*			trans	-160.3	132.6	172.3	58.9	0	0	0	0	114.1
511	S	34.7	Very low	49.6	Very low	98 Å²	98	127.2 Å²	127.2	69%	0.685	71%	0.711	S	S	*	*			trans	66	73.2	160.6	-168.7	0	0	0	0	118.3	T513	S511-T513 PolarHBondContact OG-OG1 3.5Å; S511-T513 VanDerWaalsContact OG-OG1 3.1Å
512	F	37.3	Very low	52	Low	187 Å²	187	125.7 Å²	125.7	82%	0.82	70%	0.695	S	S	*	*			trans	-93.5	77.6	147.9	-176.5	-96.7	0	0	0	108.8	I515	F512-I515 HydrophobicContact CE1-CD1 4.29Å; F512-I515 HydrophobicContact CZ-CD1 4.2Å
513	T	38	Very low	54.5	Low	118 Å²	118	120 Å²	120	72%	0.724	67%	0.67	S	S	*	*			trans	-148.4	98.1	-177	48	0	0	0	0	110	S511	S511-T513 PolarHBondContact OG-OG1 3.5Å; S511-T513 VanDerWaalsContact OG-OG1 3.1Å
514	G	44	Very low	57.2	Low	78 Å²	78	122.1 Å²	122.1	80%	0.804	66%	0.664	S	S	*	*			trans	155.6	44.6	-177.3	0	0	0	0	0	114.4	D516	G514-D516 PolarHBondContact O-N 2.88Å
515	I	58.8	Low	59.7	Low	113 Å²	113	116.4 Å²	116.4	58%	0.579	64%	0.64	S	S	*	*			trans	-78.2	110.5	166.5	-57.6	177.2	0	0	0	106.2	F512 E517 L520	F512-I515 HydrophobicContact CE1-CD1 4.29Å; F512-I515 HydrophobicContact CZ-CD1 4.2Å; I515-E517 PolarHBondContact O-N 3.5Å; I515-L520 HydrophobicContact CG2-CD1 4.28Å
516	D	74.8	Confident	62.5	Low	110 Å²	110	115.4 Å²	115.4	59%	0.588	63%	0.628	S	S	*	*			trans	-72.8	107.8	-179.4	-166.1	-2.2	0	0	0	109.1	G514 K518 A519 L520	G514-D516 PolarHBondContact O-N 2.88Å; D516-K518 PolarHBondContact O-N 3.16Å; D516-K518 VanDerWaalsContact O-N 3.09Å; D516-A519 HydrophobicContact CB-CB 4.14Å; D516-A519 WeakPolarHBondContact O-CB 3.3Å; D516-A519 PolarHBondContact O-N 2.69Å; D516-L520 PolarHBondContact O-N 3.44Å
517	E	77.5	Confident	65.3	Low	168 Å²	168	110.6 Å²	110.6	79%	0.785	61%	0.611	S	S	*	*	H	α-helix	trans	-55.8	-31.6	-174.6	-66.4	-173.3	145.2	0	0	112	I515 L520 L521	I515-E517 PolarHBondContact O-N 3.5Å; E517-L520 PolarHBondContact O-N 2.78Å; E517-L521 WeakPolarHBondContact O-CB 3.21Å; E517-L521 PolarHBondContact O-N 2.78Å
518	K	80.7	Confident	68.1	Low	125 Å²	125	109.4 Å²	109.4	54%	0.543	60%	0.603	S	S	.	*	H	α-helix	trans	-63.8	-44.9	174.6	-167.8	-161.5	176	-56.3	0	111.5	D516 L520 L521 D522	D516-K518 PolarHBondContact O-N 3.16Å; D516-K518 VanDerWaalsContact O-N 3.09Å; K518-L520 VanDerWaalsContact C-N 3.29Å; K518-L520 PolarHBondContact O-N 3.49Å; K518-L521 PolarHBondContact O-N 3.33Å; K518-D522 IonicContact NZ-OD1 3.55Å; K518-D522 PolarHBondContact NZ-OD1 3.32Å; K518-D522 IonicContact NZ-OD2 3.52Å; K518-D522 PolarHBondContact NZ-OD2 2.79Å; K518-D522 WeakPolarHBondContact O-CB 3.26Å; K518-D522 PolarHBondContact O-N 3.29Å
519	A	83.1	Confident	70.7	Confident	54 Å²	54	105.2 Å²	105.2	45%	0.446	59%	0.59	S	S	.	*	H	α-helix	trans	-65.3	-34.2	179.4	0	0	0	0	0	111.9	D516 L523	D516-A519 HydrophobicContact CB-CB 4.14Å; D516-A519 WeakPolarHBondContact O-CB 3.3Å; D516-A519 PolarHBondContact O-N 2.69Å; A519-L523 VanDerWaalsContact O-CB 3.26Å; A519-L523 WeakPolarHBondContact O-CB 3.42Å; A519-L523 PolarHBondContact O-N 3.42Å
520	L	81.6	Confident	73.5	Confident	112 Å²	112	103.3 Å²	103.3	59%	0.586	57%	0.569	S	S	*	*	H	α-helix	trans	-69.4	-37.4	174.3	-168.9	131.7	0	0	0	112.2	I515 D516 E517 K518 Y524	I515-L520 HydrophobicContact CG2-CD1 4.28Å; D516-L520 PolarHBondContact O-N 3.44Å; E517-L520 PolarHBondContact O-N 2.78Å; K518-L520 VanDerWaalsContact C-N 3.29Å; K518-L520 PolarHBondContact O-N 3.49Å; L520-Y524 WeakPolarHBondContact O-CB 3.46Å; L520-Y524 PolarHBondContact O-N 3.34Å
521	L	86	Confident	76.2	Confident	99 Å²	99	100.5 Å²	100.5	52%	0.518	55%	0.553	S	S	.	*	H	α-helix	trans	-70.9	-40.4	174	-176.3	62.3	0	0	0	112.5	E517 K518 Y524 N525	E517-L521 WeakPolarHBondContact O-CB 3.21Å; E517-L521 PolarHBondContact O-N 2.78Å; K518-L521 PolarHBondContact O-N 3.33Å; L521-Y524 PolarHBondContact O-N 2.85Å; L521-N525 PolarHBondContact O-N 3.49Å; L521-N525 PolarHBondContact O-ND2 2.92Å
522	D	87.6	Confident	78.8	Confident	74 Å²	74	101.4 Å²	101.4	40%	0.396	55%	0.549	S	S	.	.	H	α-helix	trans	-60.4	-47.2	174	-66.4	-27.2	0	0	0	110.1	K518 Y524 N525 E526	K518-D522 IonicContact NZ-OD1 3.55Å; K518-D522 PolarHBondContact NZ-OD1 3.32Å; K518-D522 IonicContact NZ-OD2 3.52Å; K518-D522 PolarHBondContact NZ-OD2 2.79Å; K518-D522 WeakPolarHBondContact O-CB 3.26Å; K518-D522 PolarHBondContact O-N 3.29Å; D522-Y524 PolarHBondContact O-N 3.11Å; D522-N525 PolarHBondContact O-N 3.46Å; D522-E526 WeakPolarHBondContact O-CB 3.48Å; D522-E526 PolarHBondContact O-N 3.06Å
523	L	89.1	Confident	81.3	Confident	61 Å²	61	98.1 Å²	98.1	32%	0.319	54%	0.536	S	S	.	.	H	α-helix	trans	-63.4	-37.3	176.9	-175.3	66.9	0	0	0	112.8	A519 E526 A527	A519-L523 VanDerWaalsContact O-CB 3.26Å; A519-L523 WeakPolarHBondContact O-CB 3.42Å; A519-L523 PolarHBondContact O-N 3.42Å; L523-E526 PolarHBondContact O-N 2.67Å; L523-A527 WeakPolarHBondContact O-CB 3.45Å; L523-A527 PolarHBondContact O-N 2.88Å
524	Y	90.6	Very high	83.8	Confident	140 Å²	140	95.8 Å²	95.8	55%	0.549	52%	0.522	S	S	.	.	H	α-helix	trans	-63.8	-42.6	173.3	172.9	-94.6	0	0	0	111.9	L520 L521 D522 K528	L520-Y524 WeakPolarHBondContact O-CB 3.46Å; L520-Y524 PolarHBondContact O-N 3.34Å; L521-Y524 PolarHBondContact O-N 2.85Å; D522-Y524 PolarHBondContact O-N 3.11Å; Y524-K528 HydrophobicContact CE1-CD 4.46Å; Y524-K528 WeakPolarHBondContact O-CB 3.45Å; Y524-K528 PolarHBondContact O-N 3.39Å
525	N	90.6	Very high	85.9	Confident	77 Å²	77	95.5 Å²	95.5	41%	0.412	51%	0.507	S	S	.	.	H	α-helix	trans	-66.3	-42.4	176.1	-71.6	-46.2	0	0	0	111.5	L521 D522 K528 T529	L521-N525 PolarHBondContact O-N 3.49Å; L521-N525 PolarHBondContact O-ND2 2.92Å; D522-N525 PolarHBondContact O-N 3.46Å; N525-K528 PolarHBondContact O-N 3.28Å; N525-T529 WeakPolarHBondContact O-CG2 3.08Å; N525-T529 PolarHBondContact O-N 3.28Å; N525-T529 PolarHBondContact O-OG1 2.73Å
526	E	90.7	Very high	87.5	Confident	93 Å²	93	96 Å²	96	44%	0.435	51%	0.506	S	S	.	.	H	α-helix	trans	-58.2	-53.5	174.2	-178	171.8	-148.8	0	0	111.2	D522 L523 K528 T529 I530	D522-E526 WeakPolarHBondContact O-CB 3.48Å; D522-E526 PolarHBondContact O-N 3.06Å; L523-E526 PolarHBondContact O-N 2.67Å; E526-K528 VanDerWaalsContact C-N 3.26Å; E526-K528 PolarHBondContact O-N 2.87Å; E526-T529 PolarHBondContact O-N 3.01Å; E526-T529 PolarHBondContact O-OG1 2.89Å; E526-I530 HydrophobicContact CG-CD1 3.98Å; E526-I530 WeakPolarHBondContact O-CG1 3.18Å; E526-I530 PolarHBondContact O-N 2.94Å
527	A	91.7	Very high	88.2	Confident	56 Å²	56	94.8 Å²	94.8	46%	0.463	50%	0.498	S	S	.	.	H	α-helix	trans	-56.1	-39.1	176.5	0	0	0	0	0	112.7	L523 I530 A531	L523-A527 WeakPolarHBondContact O-CB 3.45Å; L523-A527 PolarHBondContact O-N 2.88Å; A527-I530 PolarHBondContact O-N 3.1Å; A527-A531 WeakPolarHBondContact O-CB 3.43Å; A527-A531 PolarHBondContact O-N 3.12Å
528	K	91.8	Very high	88.6	Confident	118 Å²	118	92.1 Å²	92.1	51%	0.513	49%	0.486	S	S	.	.	H	α-helix	trans	-66.4	-38.5	174.8	-174.1	175	-180	177	0	112.7	Y524 N525 E526 L532	Y524-K528 HydrophobicContact CE1-CD 4.46Å; Y524-K528 WeakPolarHBondContact O-CB 3.45Å; Y524-K528 PolarHBondContact O-N 3.39Å; N525-K528 PolarHBondContact O-N 3.28Å; E526-K528 VanDerWaalsContact C-N 3.26Å; E526-K528 PolarHBondContact O-N 2.87Å; K528-L532 WeakPolarHBondContact O-CG 3.45Å; K528-L532 PolarHBondContact O-N 3.36Å; K528-L532 VanDerWaalsContact O-N 3.11Å
529	T	90.2	Very high	88.9	Confident	86 Å²	86	88.9 Å²	88.9	53%	0.528	48%	0.483	S	S	.	.	H	α-helix	trans	-69.1	-36.6	173.7	58.5	0	0	0	0	112.5	N525 E526 L532 H533	N525-T529 WeakPolarHBondContact O-CG2 3.08Å; N525-T529 PolarHBondContact O-N 3.28Å; N525-T529 PolarHBondContact O-OG1 2.73Å; E526-T529 PolarHBondContact O-N 3.01Å; E526-T529 PolarHBondContact O-OG1 2.89Å; T529-L532 PolarHBondContact O-N 3.4Å; T529-H533 WeakPolarHBondContact O-CB 3.48Å; T529-H533 PolarHBondContact O-N 3.43Å
530	I	92.5	Very high	89.2	Confident	86 Å²	86	91.2 Å²	91.2	44%	0.441	48%	0.484	S	S	.	.	H	α-helix	trans	-63.1	-46.6	174.1	-67	167.9	0	0	0	110.2	E526 A527 L532 H533 T534	E526-I530 HydrophobicContact CG-CD1 3.98Å; E526-I530 WeakPolarHBondContact O-CG1 3.18Å; E526-I530 PolarHBondContact O-N 2.94Å; A527-I530 PolarHBondContact O-N 3.1Å; I530-L532 VanDerWaalsContact C-N 3.34Å; I530-L532 PolarHBondContact O-N 2.95Å; I530-H533 WeakPolarHBondContact O-CB 3.44Å; I530-H533 PolarHBondContact O-N 3.35Å; I530-H533 VanDerWaalsContact O-N 3.08Å; I530-T534 HydrophobicContact CG2-CG2 4.44Å; I530-T534 PolarHBondContact O-N 3.22Å; I530-T534 PolarHBondContact O-OG1 3.04Å
531	A	89.7	Confident	89.4	Confident	57 Å²	57	90.8 Å²	90.8	47%	0.471	48%	0.475	S	S	.	.	H	α-helix	trans	-62.3	-36.3	177.9	0	0	0	0	0	113.5	A527 T534 S535	A527-A531 WeakPolarHBondContact O-CB 3.43Å; A527-A531 PolarHBondContact O-N 3.12Å; A531-T534 WeakPolarHBondContact CA-OG1 3.21Å; A531-T534 PolarHBondContact O-OG1 3.39Å; A531-T534 VanDerWaalsContact O-OG1 3.09Å; A531-S535 VanDerWaalsContact O-CB 3.32Å; A531-S535 WeakPolarHBondContact O-CB 3.11Å; A531-S535 PolarHBondContact O-N 2.7Å; A531-S535 VanDerWaalsContact O-N 3.12Å
532	L	88.5	Confident	89.6	Confident	118 Å²	118	90.8 Å²	90.8	62%	0.618	48%	0.475	S	S	*	.	H	α-helix	trans	-68.1	-37.5	171.9	-75.9	167.4	0	0	0	111.9	K528 T529 I530 K536	K528-L532 WeakPolarHBondContact O-CG 3.45Å; K528-L532 PolarHBondContact O-N 3.36Å; K528-L532 VanDerWaalsContact O-N 3.11Å; T529-L532 PolarHBondContact O-N 3.4Å; I530-L532 VanDerWaalsContact C-N 3.34Å; I530-L532 PolarHBondContact O-N 2.95Å; L532-K536 WeakPolarHBondContact O-CB 3.47Å; L532-K536 PolarHBondContact O-N 3.12Å
533	H	89.9	Confident	89.6	Confident	118 Å²	118	89.2 Å²	89.2	55%	0.546	47%	0.472	S	S	.	.	H	α-helix	trans	-70.6	-41.6	178.8	-170	-113.4	0	0	0	112.5	T529 I530 K536 I537	T529-H533 WeakPolarHBondContact O-CB 3.48Å; T529-H533 PolarHBondContact O-N 3.43Å; I530-H533 WeakPolarHBondContact O-CB 3.44Å; I530-H533 PolarHBondContact O-N 3.35Å; I530-H533 VanDerWaalsContact O-N 3.08Å; H533-K536 PolarHBondContact O-N 2.85Å; H533-I537 WeakPolarHBondContact O-CG1 3.42Å; H533-I537 PolarHBondContact O-N 3.43Å
534	T	90.9	Very high	89.7	Confident	69 Å²	69	91.3 Å²	91.3	42%	0.423	48%	0.483	S	S	.	.	H	α-helix	trans	-64.9	-45	174.4	53.5	0	0	0	0	111.4	I530 A531 K536 I537 E538	I530-T534 HydrophobicContact CG2-CG2 4.44Å; I530-T534 PolarHBondContact O-N 3.22Å; I530-T534 PolarHBondContact O-OG1 3.04Å; A531-T534 WeakPolarHBondContact CA-OG1 3.21Å; A531-T534 PolarHBondContact O-OG1 3.39Å; A531-T534 VanDerWaalsContact O-OG1 3.09Å; T534-K536 VanDerWaalsContact C-N 3.29Å; T534-K536 PolarHBondContact O-N 3.44Å; T534-I537 WeakPolarHBondContact O-CB 3.43Å; T534-I537 PolarHBondContact O-N 3.36Å; T534-E538 PolarHBondContact O-N 2.81Å
535	S	87.8	Confident	89.5	Confident	71 Å²	71	85.4 Å²	85.4	50%	0.497	46%	0.463	S	S	.	.	H	α-helix	trans	-58.8	-38.8	175.3	-176.9	0	0	0	0	112.4	A531 E538 A539	A531-S535 VanDerWaalsContact O-CB 3.32Å; A531-S535 WeakPolarHBondContact O-CB 3.11Å; A531-S535 PolarHBondContact O-N 2.7Å; A531-S535 VanDerWaalsContact O-N 3.12Å; S535-E538 PolarHBondContact O-N 2.85Å; S535-A539 PolarHBondContact O-N 2.95Å
536	K	91.9	Very high	89.3	Confident	124 Å²	124	87.2 Å²	87.2	54%	0.539	47%	0.473	S	S	.	.	H	α-helix	trans	-63.5	-45	172.2	-177.2	-178.3	167.9	-173.7	0	112.2	L532 H533 T534 E538 A539 E540	L532-K536 WeakPolarHBondContact O-CB 3.47Å; L532-K536 PolarHBondContact O-N 3.12Å; H533-K536 PolarHBondContact O-N 2.85Å; T534-K536 VanDerWaalsContact C-N 3.29Å; T534-K536 PolarHBondContact O-N 3.44Å; K536-E538 VanDerWaalsContact C-N 3.31Å; K536-E538 PolarHBondContact O-N 3.3Å; K536-A539 PolarHBondContact O-N 2.85Å; K536-E540 WeakPolarHBondContact CE-OE1 3.19Å; K536-E540 IonicContact NZ-OE1 2.89Å; K536-E540 PolarHBondContact O-N 2.98Å
537	I	89.9	Confident	89.3	Confident	85 Å²	85	88.4 Å²	88.4	44%	0.436	48%	0.476	S	S	.	.	H	α-helix	trans	-60.7	-41	176.8	-71.7	166.4	0	0	0	110.9	H533 T534 E540 R541	H533-I537 WeakPolarHBondContact O-CG1 3.42Å; H533-I537 PolarHBondContact O-N 3.43Å; T534-I537 WeakPolarHBondContact O-CB 3.43Å; T534-I537 PolarHBondContact O-N 3.36Å; I537-E540 PolarHBondContact O-N 3.24Å; I537-R541 VanDerWaalsContact O-CB 3.31Å; I537-R541 WeakPolarHBondContact O-CB 3.45Å; I537-R541 PolarHBondContact O-N 3.33Å
538	E	85.3	Confident	89	Confident	111 Å²	111	88.8 Å²	88.8	52%	0.519	47%	0.47	S	S	.	.	H	α-helix	trans	-65.8	-40.7	176.5	-71.1	-175.7	154.1	0	0	112.5	T534 S535 K536 R541 L542	T534-E538 PolarHBondContact O-N 2.81Å; S535-E538 PolarHBondContact O-N 2.85Å; K536-E538 VanDerWaalsContact C-N 3.31Å; K536-E538 PolarHBondContact O-N 3.3Å; E538-R541 WeakPolarHBondContact O-CB 3.42Å; E538-R541 PolarHBondContact O-N 3.15Å; E538-L542 WeakPolarHBondContact O-CB 3.31Å; E538-L542 WeakPolarHBondContact O-CG 3.35Å; E538-L542 PolarHBondContact O-N 2.98Å
539	A	88.1	Confident	88.6	Confident	58 Å²	58	85.7 Å²	85.7	48%	0.479	47%	0.467	S	S	.	.	H	α-helix	trans	-62.8	-42	174	0	0	0	0	0	112.1	S535 K536 L542 A543	S535-A539 PolarHBondContact O-N 2.95Å; K536-A539 PolarHBondContact O-N 2.85Å; A539-L542 PolarHBondContact O-N 3.29Å; A539-A543 WeakPolarHBondContact O-CB 3.35Å; A539-A543 PolarHBondContact O-N 2.96Å
540	E	88.7	Confident	88.4	Confident	102 Å²	102	87.7 Å²	87.7	48%	0.477	47%	0.47	S	S	.	.	H	α-helix	trans	-66.6	-38.3	173.8	-72.5	-177.9	-170	0	0	111.9	K536 I537 A543 L544	K536-E540 WeakPolarHBondContact CE-OE1 3.19Å; K536-E540 IonicContact NZ-OE1 2.89Å; K536-E540 PolarHBondContact O-N 2.98Å; I537-E540 PolarHBondContact O-N 3.24Å; E540-A543 PolarHBondContact O-N 3.23Å; E540-L544 WeakPolarHBondContact O-CG 3.26Å; E540-L544 PolarHBondContact O-N 2.94Å
541	R	86.3	Confident	88.1	Confident	104 Å²	104	88 Å²	88	39%	0.392	47%	0.472	S	S	.	.	H	α-helix	trans	-61.6	-44.6	174.4	-167.2	176.7	84.1	147.5	9.6	111.7	I537 E538 L544 A545 I589	I537-R541 VanDerWaalsContact O-CB 3.31Å; I537-R541 WeakPolarHBondContact O-CB 3.45Å; I537-R541 PolarHBondContact O-N 3.33Å; E538-R541 WeakPolarHBondContact O-CB 3.42Å; E538-R541 PolarHBondContact O-N 3.15Å; R541-L544 PolarHBondContact O-N 3.32Å; R541-A545 WeakPolarHBondContact O-CB 3.46Å; R541-A545 PolarHBondContact O-N 3.02Å; R541-I589 HydrophobicContact CG-CG2 3.99Å; R541-I589 PolarHBondContact NH1-O 3.21Å; R541-I589 PolarHBondContact NH2-O 2.95Å; R541-I589 VanDerWaalsContact NH2-O 3.16Å
542	L	88.8	Confident	87.5	Confident	98 Å²	98	87.6 Å²	87.6	51%	0.513	46%	0.462	S	S	.	.	H	α-helix	trans	-65.2	-41.2	174.4	-73.9	169.2	0	0	0	111.9	E538 A539 L544 A545 N546	E538-L542 WeakPolarHBondContact O-CB 3.31Å; E538-L542 WeakPolarHBondContact O-CG 3.35Å; E538-L542 PolarHBondContact O-N 2.98Å; A539-L542 PolarHBondContact O-N 3.29Å; L542-L544 VanDerWaalsContact C-N 3.31Å; L542-L544 PolarHBondContact O-N 2.95Å; L542-A545 PolarHBondContact O-N 3.31Å; L542-N546 WeakPolarHBondContact O-CB 3.27Å; L542-N546 PolarHBondContact O-N 2.92Å; L542-N546 PolarHBondContact O-ND2 3.4Å
543	A	88.8	Confident	87.1	Confident	42 Å²	42	84.6 Å²	84.6	35%	0.347	45%	0.45	S	S	.	.	H	α-helix	trans	-63.7	-35.3	175.6	0	0	0	0	0	112.6	A539 E540 K547	A539-A543 WeakPolarHBondContact O-CB 3.35Å; A539-A543 PolarHBondContact O-N 2.96Å; E540-A543 PolarHBondContact O-N 3.23Å; A543-K547 WeakPolarHBondContact O-CD 3.4Å; A543-K547 VanDerWaalsContact O-CG 3.28Å; A543-K547 WeakPolarHBondContact O-CG 3.45Å; A543-K547 PolarHBondContact O-N 3.36Å; A543-K547 VanDerWaalsContact O-N 3.13Å
544	L	90.7	Very high	86.8	Confident	105 Å²	105	82 Å²	82	55%	0.55	44%	0.443	S	S	.	.	H	α-helix	trans	-72.1	-40.5	173.2	-71.6	172.2	0	0	0	112.3	E540 R541 L542 N546 K547 L548	E540-L544 WeakPolarHBondContact O-CG 3.26Å; E540-L544 PolarHBondContact O-N 2.94Å; R541-L544 PolarHBondContact O-N 3.32Å; L542-L544 VanDerWaalsContact C-N 3.31Å; L542-L544 PolarHBondContact O-N 2.95Å; L544-N546 PolarHBondContact O-N 3.02Å; L544-K547 PolarHBondContact O-N 3.24Å; L544-L548 PolarHBondContact O-N 2.8Å
545	A	86.4	Confident	86.2	Confident	15 Å²	15	81.1 Å²	81.1	12%	0.124	44%	0.438	C	S	.	.	H	α-helix	trans	-60.8	-43.5	174.3	0	0	0	0	0	111.8	R541 L542 L548 A549 L586	R541-A545 WeakPolarHBondContact O-CB 3.46Å; R541-A545 PolarHBondContact O-N 3.02Å; L542-A545 PolarHBondContact O-N 3.31Å; A545-L548 PolarHBondContact O-N 3.11Å; A545-A549 PolarHBondContact O-N 3.07Å; A545-L586 HydrophobicContact CB-CD2 4.44Å
546	N	86.6	Confident	85.6	Confident	116 Å²	116	80.4 Å²	80.4	62%	0.62	44%	0.436	S	S	*	.	H	α-helix	trans	-63.5	-41.7	175.5	-73.9	-23.6	0	0	0	112.3	L542 L544 L548 A549 E550	L542-N546 WeakPolarHBondContact O-CB 3.27Å; L542-N546 PolarHBondContact O-N 2.92Å; L542-N546 PolarHBondContact O-ND2 3.4Å; L544-N546 PolarHBondContact O-N 3.02Å; N546-L548 VanDerWaalsContact C-N 3.35Å; N546-L548 PolarHBondContact O-N 3.36Å; N546-A549 PolarHBondContact O-N 2.85Å; N546-E550 PolarHBondContact O-N 3.28Å
547	K	90.1	Very high	85.2	Confident	117 Å²	117	80.6 Å²	80.6	51%	0.509	44%	0.437	S	S	.	.	H	α-helix	trans	-62.9	-38.7	173.2	-74.5	167.3	-177	171.5	0	112.2	A543 L544 E550 I551	A543-K547 WeakPolarHBondContact O-CD 3.4Å; A543-K547 VanDerWaalsContact O-CG 3.28Å; A543-K547 WeakPolarHBondContact O-CG 3.45Å; A543-K547 PolarHBondContact O-N 3.36Å; A543-K547 VanDerWaalsContact O-N 3.13Å; L544-K547 PolarHBondContact O-N 3.24Å; K547-E550 PolarHBondContact O-N 3.45Å; K547-I551 WeakPolarHBondContact O-CB 3.36Å; K547-I551 VanDerWaalsContact O-CG1 3.25Å; K547-I551 WeakPolarHBondContact O-CG1 3.48Å; K547-I551 PolarHBondContact O-N 2.95Å
548	L	85.9	Confident	84.7	Confident	64 Å²	64	82 Å²	82	34%	0.335	45%	0.445	S	S	.	.	H	α-helix	trans	-65.4	-40.2	173.5	-86.1	165.1	0	0	0	112	L544 A545 N546 I551 N552 V582 L586	L544-L548 PolarHBondContact O-N 2.8Å; A545-L548 PolarHBondContact O-N 3.11Å; N546-L548 VanDerWaalsContact C-N 3.35Å; N546-L548 PolarHBondContact O-N 3.36Å; L548-I551 PolarHBondContact O-N 3.32Å; L548-N552 WeakPolarHBondContact O-CB 3.46Å; L548-N552 PolarHBondContact O-N 2.89Å; L548-N552 PolarHBondContact O-ND2 2.95Å; L548-V582 HydrophobicContact CD2-CG1 4.5Å; L548-L586 HydrophobicContact CB-CD2 4.35Å; L548-L586 HydrophobicContact CD1-CD2 4.2Å
549	A	84.3	Confident	84.1	Confident	53 Å²	53	79.6 Å²	79.6	44%	0.438	44%	0.435	S	S	.	.	H	α-helix	trans	-63.4	-40	173.8	0	0	0	0	0	112.2	A545 N546 N552 S553	A545-A549 PolarHBondContact O-N 3.07Å; N546-A549 PolarHBondContact O-N 2.85Å; A549-N552 PolarHBondContact O-N 3.27Å; A549-S553 VanDerWaalsContact O-CB 3.27Å; A549-S553 WeakPolarHBondContact O-CB 3.31Å; A549-S553 PolarHBondContact O-N 3.41Å
550	E	85.9	Confident	83.3	Confident	128 Å²	128	81.2 Å²	81.2	60%	0.598	44%	0.443	S	S	*	.	H	α-helix	trans	-64.2	-44	173.7	-172.2	-175.6	-165.2	0	0	112.1	N546 K547 S553 T554	N546-E550 PolarHBondContact O-N 3.28Å; K547-E550 PolarHBondContact O-N 3.45Å; E550-S553 PolarHBondContact O-N 3.06Å; E550-T554 WeakPolarHBondContact O-CB 3.41Å; E550-T554 WeakPolarHBondContact O-CG2 3.48Å; E550-T554 PolarHBondContact O-N 3.45Å; E550-T554 PolarHBondContact O-OG1 2.98Å
551	I	85.5	Confident	82.4	Confident	92 Å²	92	82.5 Å²	82.5	47%	0.472	45%	0.453	S	S	.	.	H	α-helix	trans	-62.9	-43.2	175.5	-70.6	165.3	0	0	0	110.7	K547 L548 T554 T555	K547-I551 WeakPolarHBondContact O-CB 3.36Å; K547-I551 VanDerWaalsContact O-CG1 3.25Å; K547-I551 WeakPolarHBondContact O-CG1 3.48Å; K547-I551 PolarHBondContact O-N 2.95Å; L548-I551 PolarHBondContact O-N 3.32Å; I551-T554 WeakPolarHBondContact CA-OG1 3.32Å; I551-T554 PolarHBondContact O-N 3.07Å; I551-T554 PolarHBondContact O-OG1 3.16Å; I551-T554 VanDerWaalsContact O-OG1 3.06Å; I551-T555 VanDerWaalsContact O-CB 3.24Å; I551-T555 WeakPolarHBondContact O-CB 3.2Å; I551-T555 PolarHBondContact O-N 2.82Å; I551-T555 PolarHBondContact O-OG1 3.15Å
552	N	76.7	Confident	81.6	Confident	50 Å²	50	81.5 Å²	81.5	27%	0.267	46%	0.455	S	S	.	.	H	α-helix	trans	-66.1	-40.5	176.6	-69.3	-19.1	0	0	0	111.5	L548 A549 T555 A556 V582	L548-N552 WeakPolarHBondContact O-CB 3.46Å; L548-N552 PolarHBondContact O-N 2.89Å; L548-N552 PolarHBondContact O-ND2 2.95Å; A549-N552 PolarHBondContact O-N 3.27Å; N552-T555 PolarHBondContact O-N 3.28Å; N552-A556 WeakPolarHBondContact O-CB 3.47Å; N552-A556 PolarHBondContact O-N 2.97Å; N552-V582 WeakPolarHBondContact ND2-CG1 3.41Å
553	S	80.8	Confident	80.1	Confident	54 Å²	54	80.6 Å²	80.6	38%	0.378	46%	0.456	S	S	.	.	H	α-helix	trans	-63.1	-46	175.7	-176	0	0	0	0	112.5	A549 E550 A556 K557	A549-S553 VanDerWaalsContact O-CB 3.27Å; A549-S553 WeakPolarHBondContact O-CB 3.31Å; A549-S553 PolarHBondContact O-N 3.41Å; E550-S553 PolarHBondContact O-N 3.06Å; S553-A556 PolarHBondContact O-N 3.45Å; S553-K557 VanDerWaalsContact O-CG 3.31Å; S553-K557 WeakPolarHBondContact O-CG 3.36Å; S553-K557 PolarHBondContact O-N 3.42Å
554	T	84.5	Confident	78.8	Confident	64 Å²	64	84.3 Å²	84.3	39%	0.393	48%	0.476	S	S	.	.	H	α-helix	trans	-69.1	-38.5	177.5	48.7	0	0	0	0	111.8	E550 I551 K557 L558	E550-T554 WeakPolarHBondContact O-CB 3.41Å; E550-T554 WeakPolarHBondContact O-CG2 3.48Å; E550-T554 PolarHBondContact O-N 3.45Å; E550-T554 PolarHBondContact O-OG1 2.98Å; I551-T554 WeakPolarHBondContact CA-OG1 3.32Å; I551-T554 PolarHBondContact O-N 3.07Å; I551-T554 PolarHBondContact O-OG1 3.16Å; I551-T554 VanDerWaalsContact O-OG1 3.06Å; T554-K557 PolarHBondContact O-N 3.35Å; T554-L558 WeakPolarHBondContact O-CG 3.39Å; T554-L558 PolarHBondContact O-N 2.75Å
555	T	76.4	Confident	77.2	Confident	51 Å²	51	85.1 Å²	85.1	31%	0.313	49%	0.486	S	S	.	.	H	α-helix	trans	-62.3	-45.3	172.9	-56.1	0	0	0	0	111.1	I551 N552 K557 L558 L559	I551-T555 VanDerWaalsContact O-CB 3.24Å; I551-T555 WeakPolarHBondContact O-CB 3.2Å; I551-T555 PolarHBondContact O-N 2.82Å; I551-T555 PolarHBondContact O-OG1 3.15Å; N552-T555 PolarHBondContact O-N 3.28Å; T555-K557 VanDerWaalsContact C-N 3.34Å; T555-K557 PolarHBondContact O-N 3.07Å; T555-L558 PolarHBondContact O-N 2.81Å; T555-L558 VanDerWaalsContact O-N 3.17Å; T555-L559 HydrophobicContact CG2-CD1 4.05Å; T555-L559 HydrophobicContact CG2-CG 4.43Å; T555-L559 VanDerWaalsContact O-CG 3.25Å; T555-L559 WeakPolarHBondContact O-CG 3.28Å; T555-L559 PolarHBondContact O-N 2.87Å
556	A	76.6	Confident	75.7	Confident	56 Å²	56	91.7 Å²	91.7	46%	0.463	51%	0.514	S	S	.	.	H	α-helix	trans	-59.3	-42.1	175.1	0	0	0	0	0	112.6	N552 S553 L558 L559 S560	N552-A556 WeakPolarHBondContact O-CB 3.47Å; N552-A556 PolarHBondContact O-N 2.97Å; S553-A556 PolarHBondContact O-N 3.45Å; A556-L558 PolarHBondContact O-N 2.84Å; A556-L559 PolarHBondContact O-N 3.17Å; A556-S560 PolarHBondContact O-N 3.49Å; A556-S560 PolarHBondContact O-OG 3.33Å
557	K	82.1	Confident	74.3	Confident	128 Å²	128	88.2 Å²	88.2	56%	0.557	50%	0.496	S	S	*	.	H	α-helix	trans	-65.3	-33.8	175.1	-71.6	168.5	-176.3	173.2	0	113.3	S553 T554 T555 S560 N561	S553-K557 VanDerWaalsContact O-CG 3.31Å; S553-K557 WeakPolarHBondContact O-CG 3.36Å; S553-K557 PolarHBondContact O-N 3.42Å; T554-K557 PolarHBondContact O-N 3.35Å; T555-K557 VanDerWaalsContact C-N 3.34Å; T555-K557 PolarHBondContact O-N 3.07Å; K557-S560 WeakPolarHBondContact CA-OG 3.33Å; K557-S560 PolarHBondContact O-OG 2.63Å; K557-N561 VanDerWaalsContact O-CG 3.29Å; K557-N561 PolarHBondContact O-ND2 2.91Å
558	L	79.6	Confident	73	Confident	114 Å²	114	85.7 Å²	85.7	60%	0.597	49%	0.492	S	S	*	.	H	α-helix	trans	-69.1	-44.9	172.9	-71.5	169.9	0	0	0	110.7	T554 T555 A556 S560 N561 L562	T554-L558 WeakPolarHBondContact O-CG 3.39Å; T554-L558 PolarHBondContact O-N 2.75Å; T555-L558 PolarHBondContact O-N 2.81Å; T555-L558 VanDerWaalsContact O-N 3.17Å; A556-L558 PolarHBondContact O-N 2.84Å; L558-S560 PolarHBondContact O-N 3.45Å; L558-N561 WeakPolarHBondContact O-CB 3.18Å; L558-N561 PolarHBondContact O-N 2.92Å; L558-N561 VanDerWaalsContact O-N 3.12Å; L558-L562 WeakPolarHBondContact O-CD1 3.5Å
559	L	73.5	Confident	72.1	Confident	60 Å²	60	87.2 Å²	87.2	31%	0.314	51%	0.509	S	S	.	.	H	α-helix	trans	-62.8	-39.9	178.6	-66.6	167	0	0	0	112.7	T555 A556 N561 L562 L575	T555-L559 HydrophobicContact CG2-CD1 4.05Å; T555-L559 HydrophobicContact CG2-CG 4.43Å; T555-L559 VanDerWaalsContact O-CG 3.25Å; T555-L559 WeakPolarHBondContact O-CG 3.28Å; T555-L559 PolarHBondContact O-N 2.87Å; A556-L559 PolarHBondContact O-N 3.17Å; L559-N561 PolarHBondContact O-N 3.4Å; L559-L562 PolarHBondContact O-N 3.18Å; L559-L562 VanDerWaalsContact O-N 3.1Å; L559-L575 HydrophobicContact CD1-CD2 4.01Å; L559-L575 HydrophobicContact CD2-CD1 3.62Å; L559-L575 HydrophobicContact CD2-CD2 4.07Å; L559-L575 HydrophobicContact CD2-CG 4.45Å
560	S	72.1	Confident	71.4	Confident	92 Å²	92	89.2 Å²	89.2	64%	0.643	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-18.1	175.8	58.5	0	0	0	0	113.8	A556 K557 L558	A556-S560 PolarHBondContact O-N 3.49Å; A556-S560 PolarHBondContact O-OG 3.33Å; K557-S560 WeakPolarHBondContact CA-OG 3.33Å; K557-S560 PolarHBondContact O-OG 2.63Å; L558-S560 PolarHBondContact O-N 3.45Å
561	N	69.3	Low	70.7	Confident	130 Å²	130	87.3 Å²	87.3	70%	0.695	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-6.7	176.6	-66	-16.3	0	0	0	113.2	K557 L558 L559	K557-N561 VanDerWaalsContact O-CG 3.29Å; K557-N561 PolarHBondContact O-ND2 2.91Å; L558-N561 WeakPolarHBondContact O-CB 3.18Å; L558-N561 PolarHBondContact O-N 2.92Å; L558-N561 VanDerWaalsContact O-N 3.12Å; L559-N561 PolarHBondContact O-N 3.4Å
562	L	69.4	Low	69.9	Low	83 Å²	83	85.5 Å²	85.5	44%	0.435	50%	0.502	S	S	.	.	S	Bend	trans	-87.2	122.3	172.9	-88.1	74.4	0	0	0	110.1	L558 L559 L567	L558-L562 WeakPolarHBondContact O-CD1 3.5Å; L559-L562 PolarHBondContact O-N 3.18Å; L559-L562 VanDerWaalsContact O-N 3.1Å; L562-L567 HydrophobicContact CD2-CD2 3.71Å; L562-L567 HydrophobicContact CD2-CG 4.34Å
563	C	57.5	Low	69.6	Low	78 Å²	78	87.9 Å²	87.9	53%	0.527	51%	0.512	S	S	.	.			trans	-59.5	138	171.8	-64	0	0	0	0	110.7	T565 Q566	C563-T565 PolarHBondContact O-N 3.15Å; C563-Q566 PolarHBondContact O-N 3.02Å
564	P	61.6	Low	69.1	Low	120 Å²	120	88.1 Å²	88.1	78%	0.779	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-5.2	-177.5	26.2	-35.4	0	0	0	114.2
565	T	57.4	Low	68.6	Low	123 Å²	123	87.1 Å²	87.1	76%	0.755	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-9.2	173.5	50	0	0	0	0	114.4	C563	C563-T565 PolarHBondContact O-N 3.15Å
566	Q	55.2	Low	68.5	Low	153 Å²	153	89.1 Å²	89.1	72%	0.715	51%	0.513	S	S	*	.	S	Bend	trans	-103.6	-8.8	-178.3	-67	-67.4	-15.2	0	0	113.8	C563	C563-Q566 PolarHBondContact O-N 3.02Å
567	L	55.9	Low	68.4	Low	43 Å²	43	93.2 Å²	93.2	23%	0.225	52%	0.517	C	S	.	.			trans	-96.1	120.3	-178	-67.8	169.4	0	0	0	110.3	L562 L571	L562-L567 HydrophobicContact CD2-CD2 3.71Å; L562-L567 HydrophobicContact CD2-CG 4.34Å; L567-L571 HydrophobicContact CD2-CD2 3.69Å
568	S	62.8	Low	68	Low	63 Å²	63	90.6 Å²	90.6	44%	0.441	51%	0.512	S	S	.	.			trans	-67.9	144.9	165.2	65.1	0	0	0	0	109.5	T570 L571 T572	S568-T570 PolarHBondContact O-N 3.43Å; S568-T570 VanDerWaalsContact O-N 3.14Å; S568-T570 PolarHBondContact OG-OG1 3.34Å; S568-L571 PolarHBondContact O-N 3.1Å; S568-L571 PolarHBondContact OG-N 3.19Å; S568-T572 PolarHBondContact O-N 3.32Å; S568-T572 VanDerWaalsContact O-N 3.17Å; S568-T572 PolarHBondContact O-OG1 3.23Å
569	S	68.2	Low	67.7	Low	97 Å²	97	87.9 Å²	87.9	68%	0.678	50%	0.5	S	S	*	.	H	α-helix	trans	-52.5	-38.8	178.4	49.7	0	0	0	0	112.1	L571 T572 E573	S569-L571 VanDerWaalsContact C-N 3.35Å; S569-L571 PolarHBondContact O-N 2.97Å; S569-T572 PolarHBondContact O-N 3.09Å; S569-E573 VanDerWaalsContact O-CB 3.27Å; S569-E573 WeakPolarHBondContact O-CB 3.44Å; S569-E573 PolarHBondContact O-N 3.05Å
570	T	69.2	Low	67.7	Low	94 Å²	94	89.1 Å²	89.1	58%	0.577	51%	0.507	S	S	*	.	H	α-helix	trans	-62.2	-35.5	176.2	53.5	0	0	0	0	113.6	S568 S574	S568-T570 PolarHBondContact O-N 3.43Å; S568-T570 VanDerWaalsContact O-N 3.14Å; S568-T570 PolarHBondContact OG-OG1 3.34Å; T570-S574 VanDerWaalsContact O-CB 3.27Å; T570-S574 WeakPolarHBondContact O-CB 3.45Å; T570-S574 PolarHBondContact O-N 2.99Å
571	L	69.6	Low	67.9	Low	89 Å²	89	87.1 Å²	87.1	47%	0.466	50%	0.496	S	S	.	.	H	α-helix	trans	-73.3	-46.4	177.7	-160	89.9	0	0	0	110.5	L567 S568 S569 E573 S574 L575	L567-L571 HydrophobicContact CD2-CD2 3.69Å; S568-L571 PolarHBondContact O-N 3.1Å; S568-L571 PolarHBondContact OG-N 3.19Å; S569-L571 VanDerWaalsContact C-N 3.35Å; S569-L571 PolarHBondContact O-N 2.97Å; L571-E573 VanDerWaalsContact C-N 3.33Å; L571-E573 PolarHBondContact O-N 3.33Å; L571-S574 WeakPolarHBondContact O-CB 3.28Å; L571-S574 PolarHBondContact O-N 3.05Å; L571-L575 HydrophobicContact CD2-CD1 4.22Å; L571-L575 HydrophobicContact CG-CD1 4.26Å; L571-L575 WeakPolarHBondContact O-CB 3.44Å; L571-L575 PolarHBondContact O-N 3.11Å
572	T	69.4	Low	68.1	Low	54 Å²	54	83 Å²	83	33%	0.331	48%	0.475	S	S	.	.	H	α-helix	trans	-59.5	-44.6	177.4	-47.7	0	0	0	0	111.4	S568 S569 L575 I576	S568-T572 PolarHBondContact O-N 3.32Å; S568-T572 VanDerWaalsContact O-N 3.17Å; S568-T572 PolarHBondContact O-OG1 3.23Å; S569-T572 PolarHBondContact O-N 3.09Å; T572-L575 PolarHBondContact O-N 3.47Å; T572-I576 HydrophobicContact CG2-CD1 4.19Å; T572-I576 WeakPolarHBondContact O-CG1 3.38Å; T572-I576 PolarHBondContact O-N 3.17Å
573	E	70	Confident	68.2	Low	99 Å²	99	84.5 Å²	84.5	46%	0.463	48%	0.48	S	S	.	.	H	α-helix	trans	-68.6	-37.9	178.9	-158	-165	-177.9	0	0	111.9	S569 L571 L575 I576 R577	S569-E573 VanDerWaalsContact O-CB 3.27Å; S569-E573 WeakPolarHBondContact O-CB 3.44Å; S569-E573 PolarHBondContact O-N 3.05Å; L571-E573 VanDerWaalsContact C-N 3.33Å; L571-E573 PolarHBondContact O-N 3.33Å; E573-L575 VanDerWaalsContact C-N 3.34Å; E573-I576 PolarHBondContact O-N 3.45Å; E573-R577 WeakPolarHBondContact O-CG 3.44Å; E573-R577 PolarHBondContact O-N 2.91Å; E573-R577 IonicContact OE1-CZ 3.97Å; E573-R577 IonicContact OE1-NE 3.8Å; E573-R577 IonicContact OE1-NH2 3.62Å; E573-R577 PolarHBondContact OE1-NH2 3.36Å; E573-R577 IonicContact OE2-CZ 2.71Å; E573-R577 IonicContact OE2-NH1 2.75Å; E573-R577 IonicContact OE2-NH2 2.63Å; E573-R577 PolarHBondContact OE2-NH2 3.5Å
574	S	71.4	Confident	69	Low	60 Å²	60	84.5 Å²	84.5	42%	0.42	48%	0.478	S	S	.	.	H	α-helix	trans	-60	-44.8	171.2	-171.6	0	0	0	0	111.6	T570 L571 R577 T578	T570-S574 VanDerWaalsContact O-CB 3.27Å; T570-S574 WeakPolarHBondContact O-CB 3.45Å; T570-S574 PolarHBondContact O-N 2.99Å; L571-S574 WeakPolarHBondContact O-CB 3.28Å; L571-S574 PolarHBondContact O-N 3.05Å; S574-R577 PolarHBondContact O-N 2.77Å; S574-T578 PolarHBondContact O-N 3.42Å; S574-T578 PolarHBondContact O-OG1 3.37Å
575	L	73.3	Confident	69.3	Low	42 Å²	42	83 Å²	83	22%	0.22	46%	0.46	C	S	.	.	H	α-helix	trans	-63.1	-43.4	179.2	-95.6	153	0	0	0	112.6	L559 L571 T572 E573 T578 T579	L559-L575 HydrophobicContact CD1-CD2 4.01Å; L559-L575 HydrophobicContact CD2-CD1 3.62Å; L559-L575 HydrophobicContact CD2-CD2 4.07Å; L559-L575 HydrophobicContact CD2-CG 4.45Å; L571-L575 HydrophobicContact CD2-CD1 4.22Å; L571-L575 HydrophobicContact CG-CD1 4.26Å; L571-L575 WeakPolarHBondContact O-CB 3.44Å; L571-L575 PolarHBondContact O-N 3.11Å; T572-L575 PolarHBondContact O-N 3.47Å; E573-L575 VanDerWaalsContact C-N 3.34Å; L575-T578 WeakPolarHBondContact CA-OG1 3.26Å; L575-T578 PolarHBondContact O-N 3.13Å; L575-T578 PolarHBondContact O-OG1 2.95Å; L575-T579 PolarHBondContact O-N 2.73Å; L575-T579 PolarHBondContact O-OG1 2.76Å; L575-T579 VanDerWaalsContact O-OG1 3.04Å
576	I	74.8	Confident	69.7	Low	93 Å²	93	78.5 Å²	78.5	48%	0.477	43%	0.432	S	S	.	.	H	α-helix	trans	-61.3	-45.9	174.7	-68.2	163.8	0	0	0	110.4	T572 E573 T578 T579 N580	T572-I576 HydrophobicContact CG2-CD1 4.19Å; T572-I576 WeakPolarHBondContact O-CG1 3.38Å; T572-I576 PolarHBondContact O-N 3.17Å; E573-I576 PolarHBondContact O-N 3.45Å; I576-T578 PolarHBondContact O-N 3.02Å; I576-T579 PolarHBondContact O-N 3.37Å; I576-N580 WeakPolarHBondContact O-CB 3.46Å; I576-N580 PolarHBondContact O-N 3.11Å; I576-N580 PolarHBondContact O-OD1 3.1Å
577	R	74	Confident	70.4	Confident	142 Å²	142	73.9 Å²	73.9	54%	0.536	42%	0.419	S	S	.	.	H	α-helix	trans	-60.7	-41.6	176.7	-69.1	179.5	-160.3	134.4	-4.3	112.3	E573 S574 A581	E573-R577 WeakPolarHBondContact O-CG 3.44Å; E573-R577 PolarHBondContact O-N 2.91Å; E573-R577 IonicContact OE1-CZ 3.97Å; E573-R577 IonicContact OE1-NE 3.8Å; E573-R577 IonicContact OE1-NH2 3.62Å; E573-R577 PolarHBondContact OE1-NH2 3.36Å; E573-R577 IonicContact OE2-CZ 2.71Å; E573-R577 IonicContact OE2-NH1 2.75Å; E573-R577 IonicContact OE2-NH2 2.63Å; E573-R577 PolarHBondContact OE2-NH2 3.5Å; S574-R577 PolarHBondContact O-N 2.77Å; R577-A581 WeakPolarHBondContact O-CB 3.25Å; R577-A581 PolarHBondContact O-N 3.17Å
578	T	74.6	Confident	71.2	Confident	74 Å²	74	78.7 Å²	78.7	45%	0.454	43%	0.434	S	S	.	.	H	α-helix	trans	-67.8	-41.1	177.3	46.4	0	0	0	0	112.7	S574 L575 I576 A581 V582	S574-T578 PolarHBondContact O-N 3.42Å; S574-T578 PolarHBondContact O-OG1 3.37Å; L575-T578 WeakPolarHBondContact CA-OG1 3.26Å; L575-T578 PolarHBondContact O-N 3.13Å; L575-T578 PolarHBondContact O-OG1 2.95Å; I576-T578 PolarHBondContact O-N 3.02Å; T578-A581 PolarHBondContact O-N 3.33Å; T578-V582 WeakPolarHBondContact O-CG2 3.41Å; T578-V582 PolarHBondContact O-N 2.91Å
579	T	73.5	Confident	71.2	Confident	57 Å²	57	78.6 Å²	78.6	35%	0.35	43%	0.428	S	S	.	.	H	α-helix	trans	-63.5	-46.3	177.1	-60.8	0	0	0	0	111	L575 I576 A581 V582 Q583	L575-T579 PolarHBondContact O-N 2.73Å; L575-T579 PolarHBondContact O-OG1 2.76Å; L575-T579 VanDerWaalsContact O-OG1 3.04Å; I576-T579 PolarHBondContact O-N 3.37Å; T579-A581 VanDerWaalsContact C-N 3.35Å; T579-A581 PolarHBondContact O-N 3.16Å; T579-V582 PolarHBondContact O-N 3.14Å; T579-Q583 WeakPolarHBondContact O-CG 3.28Å; T579-Q583 PolarHBondContact O-N 2.73Å
580	N	72.7	Confident	71	Confident	86 Å²	86	78.7 Å²	78.7	46%	0.46	42%	0.421	S	S	.	.	H	α-helix	trans	-61.9	-42.6	177.3	-66.7	5.9	0	0	0	111.3	I576 Q583 T584	I576-N580 WeakPolarHBondContact O-CB 3.46Å; I576-N580 PolarHBondContact O-N 3.11Å; I576-N580 PolarHBondContact O-OD1 3.1Å; N580-Q583 PolarHBondContact O-N 2.91Å; N580-T584 WeakPolarHBondContact O-CG2 3.48Å; N580-T584 PolarHBondContact O-N 3.18Å; N580-T584 PolarHBondContact O-OG1 3.23Å
581	A	75.6	Confident	70.8	Confident	49 Å²	49	80.9 Å²	80.9	41%	0.405	42%	0.424	S	S	.	.	H	α-helix	trans	-60.5	-46.7	176.1	0	0	0	0	0	111.9	R577 T578 T579 Q583 T584 E585	R577-A581 WeakPolarHBondContact O-CB 3.25Å; R577-A581 PolarHBondContact O-N 3.17Å; T578-A581 PolarHBondContact O-N 3.33Å; T579-A581 VanDerWaalsContact C-N 3.35Å; T579-A581 PolarHBondContact O-N 3.16Å; A581-Q583 VanDerWaalsContact C-N 3.32Å; A581-Q583 PolarHBondContact O-N 3.17Å; A581-T584 PolarHBondContact O-N 3.16Å; A581-T584 VanDerWaalsContact O-N 3.14Å; A581-T584 PolarHBondContact O-OG1 3.41Å; A581-E585 PolarHBondContact O-N 3.44Å
582	V	73.5	Confident	69.6	Low	44 Å²	44	81.2 Å²	81.2	27%	0.267	43%	0.432	S	S	.	.	H	α-helix	trans	-62.5	-37.3	176.4	171.1	0	0	0	0	111.6	L548 N552 T578 T579 E585 L586	L548-V582 HydrophobicContact CD2-CG1 4.5Å; N552-V582 WeakPolarHBondContact ND2-CG1 3.41Å; T578-V582 WeakPolarHBondContact O-CG2 3.41Å; T578-V582 PolarHBondContact O-N 2.91Å; T579-V582 PolarHBondContact O-N 3.14Å; V582-E585 PolarHBondContact O-N 3.43Å; V582-L586 HydrophobicContact CG1-CD1 4.02Å; V582-L586 HydrophobicContact CG1-CG 4.49Å; V582-L586 WeakPolarHBondContact O-CB 3.49Å; V582-L586 WeakPolarHBondContact O-CG 3.47Å; V582-L586 PolarHBondContact O-N 3.04Å
583	Q	72	Confident	68.1	Low	114 Å²	114	84.2 Å²	84.2	53%	0.533	45%	0.454	S	S	.	.	H	α-helix	trans	-65.5	-39.5	172.8	-74.1	178.8	-55.2	0	0	112.4	T579 N580 A581 L586 A587	T579-Q583 WeakPolarHBondContact O-CG 3.28Å; T579-Q583 PolarHBondContact O-N 2.73Å; N580-Q583 PolarHBondContact O-N 2.91Å; A581-Q583 VanDerWaalsContact C-N 3.32Å; A581-Q583 PolarHBondContact O-N 3.17Å; Q583-L586 PolarHBondContact O-N 3.42Å; Q583-A587 WeakPolarHBondContact O-CB 3.2Å; Q583-A587 PolarHBondContact O-N 3.1Å
584	T	73.8	Confident	66.6	Low	78 Å²	78	85.5 Å²	85.5	48%	0.479	46%	0.462	S	S	.	.	H	α-helix	trans	-69.9	-31.3	176.1	58.3	0	0	0	0	113.7	N580 A581 R588	N580-T584 WeakPolarHBondContact O-CG2 3.48Å; N580-T584 PolarHBondContact O-N 3.18Å; N580-T584 PolarHBondContact O-OG1 3.23Å; A581-T584 PolarHBondContact O-N 3.16Å; A581-T584 VanDerWaalsContact O-N 3.14Å; A581-T584 PolarHBondContact O-OG1 3.41Å; T584-R588 PolarHBondContact O-N 3.39Å; T584-R588 VanDerWaalsContact O-N 3.17Å
585	E	69.1	Low	64.8	Low	89 Å²	89	89.1 Å²	89.1	42%	0.416	48%	0.477	S	S	.	.	H	α-helix	trans	-69.9	-45.3	170	-70.9	-63.2	160.6	0	0	111	A581 V582 A587 R588 I589	A581-E585 PolarHBondContact O-N 3.44Å; V582-E585 PolarHBondContact O-N 3.43Å; E585-A587 VanDerWaalsContact C-N 3.29Å; E585-A587 PolarHBondContact O-N 2.92Å; E585-R588 VanDerWaalsContact CD-NH1 3.3Å; E585-R588 PolarHBondContact O-N 2.92Å; E585-R588 IonicContact OE1-CZ 2.78Å; E585-R588 IonicContact OE1-NH1 2.59Å; E585-R588 PolarHBondContact OE1-NH1 3.03Å; E585-R588 IonicContact OE1-NH2 2.69Å; E585-R588 PolarHBondContact OE1-NH2 3.36Å; E585-R588 IonicContact OE2-CZ 2.75Å; E585-R588 IonicContact OE2-NH1 3.89Å; E585-R588 PolarHBondContact OE2-NH1 3.17Å; E585-R588 IonicContact OE2-NH2 3.01Å; E585-R588 PolarHBondContact OE2-NH2 2.91Å; E585-I589 HydrophobicContact CB-CD1 4.48Å; E585-I589 WeakPolarHBondContact O-CB 3.5Å; E585-I589 WeakPolarHBondContact O-CD1 3.4Å; E585-I589 WeakPolarHBondContact O-CG1 3.48Å; E585-I589 PolarHBondContact O-N 3.47Å
586	L	64.8	Low	63	Low	29 Å²	29	94 Å²	94	15%	0.152	50%	0.503	C	S	.	.	H	α-helix	trans	-59.3	-39.3	176	-77.4	168.5	0	0	0	112.1	A545 L548 V582 Q583 I589 L590	A545-L586 HydrophobicContact CB-CD2 4.44Å; L548-L586 HydrophobicContact CB-CD2 4.35Å; L548-L586 HydrophobicContact CD1-CD2 4.2Å; V582-L586 HydrophobicContact CG1-CD1 4.02Å; V582-L586 HydrophobicContact CG1-CG 4.49Å; V582-L586 WeakPolarHBondContact O-CB 3.49Å; V582-L586 WeakPolarHBondContact O-CG 3.47Å; V582-L586 PolarHBondContact O-N 3.04Å; Q583-L586 PolarHBondContact O-N 3.42Å; L586-I589 PolarHBondContact O-N 3.12Å; L586-L590 VanDerWaalsContact O-CB 3.29Å; L586-L590 WeakPolarHBondContact O-CB 3.33Å; L586-L590 WeakPolarHBondContact O-CD1 3.29Å; L586-L590 VanDerWaalsContact O-CG 3.23Å; L586-L590 WeakPolarHBondContact O-CG 3.5Å; L586-L590 PolarHBondContact O-N 2.9Å
587	A	70.2	Confident	61	Low	55 Å²	55	97.5 Å²	97.5	46%	0.455	52%	0.523	S	S	.	.	H	α-helix	trans	-61.5	-52.2	173.4	0	0	0	0	0	111.9	Q583 E585 I589 L590 E591	Q583-A587 WeakPolarHBondContact O-CB 3.2Å; Q583-A587 PolarHBondContact O-N 3.1Å; E585-A587 VanDerWaalsContact C-N 3.29Å; E585-A587 PolarHBondContact O-N 2.92Å; A587-I589 PolarHBondContact O-N 3.06Å; A587-L590 PolarHBondContact O-N 3.19Å; A587-E591 PolarHBondContact O-N 3.3Å; A587-E591 VanDerWaalsContact O-N 3.11Å
588	R	72.1	Confident	59	Low	145 Å²	145	94 Å²	94	55%	0.547	53%	0.531	S	S	.	.	H	α-helix	trans	-63	-25.4	176.7	-84.2	-168.8	-78.9	103	-2.2	114.1	T584 E585	T584-R588 PolarHBondContact O-N 3.39Å; T584-R588 VanDerWaalsContact O-N 3.17Å; E585-R588 VanDerWaalsContact CD-NH1 3.3Å; E585-R588 PolarHBondContact O-N 2.92Å; E585-R588 IonicContact OE1-CZ 2.78Å; E585-R588 IonicContact OE1-NH1 2.59Å; E585-R588 PolarHBondContact OE1-NH1 3.03Å; E585-R588 IonicContact OE1-NH2 2.69Å; E585-R588 PolarHBondContact OE1-NH2 3.36Å; E585-R588 IonicContact OE2-CZ 2.75Å; E585-R588 IonicContact OE2-NH1 3.89Å; E585-R588 PolarHBondContact OE2-NH1 3.17Å; E585-R588 IonicContact OE2-NH2 3.01Å; E585-R588 PolarHBondContact OE2-NH2 2.91Å
589	I	63.7	Low	57	Low	61 Å²	61	98.3 Å²	98.3	31%	0.313	55%	0.551	S	S	.	*	H	α-helix	trans	-80.9	-29.5	174.8	-69.7	164.7	0	0	0	111.2	R541 E585 L586 A587	R541-I589 HydrophobicContact CG-CG2 3.99Å; R541-I589 PolarHBondContact NH1-O 3.21Å; R541-I589 PolarHBondContact NH2-O 2.95Å; R541-I589 VanDerWaalsContact NH2-O 3.16Å; E585-I589 HydrophobicContact CB-CD1 4.48Å; E585-I589 WeakPolarHBondContact O-CB 3.5Å; E585-I589 WeakPolarHBondContact O-CD1 3.4Å; E585-I589 WeakPolarHBondContact O-CG1 3.48Å; E585-I589 PolarHBondContact O-N 3.47Å; L586-I589 PolarHBondContact O-N 3.12Å; A587-I589 PolarHBondContact O-N 3.06Å
590	L	63.8	Low	55.3	Low	99 Å²	99	103.4 Å²	103.4	52%	0.518	58%	0.576	S	S	.	*	H	α-helix	trans	-91.3	-15.9	-175.8	-73.5	168.4	0	0	0	114.6	L586 A587	L586-L590 VanDerWaalsContact O-CB 3.29Å; L586-L590 WeakPolarHBondContact O-CB 3.33Å; L586-L590 WeakPolarHBondContact O-CD1 3.29Å; L586-L590 VanDerWaalsContact O-CG 3.23Å; L586-L590 WeakPolarHBondContact O-CG 3.5Å; L586-L590 PolarHBondContact O-N 2.9Å; A587-L590 PolarHBondContact O-N 3.19Å
591	E	65.4	Low	53.2	Low	139 Å²	139	106.9 Å²	106.9	65%	0.65	60%	0.595	S	S	*	*	S	Bend	trans	-63.1	129.4	173	-76.9	-170.1	137.7	0	0	111.9	A587	A587-E591 PolarHBondContact O-N 3.3Å; A587-E591 VanDerWaalsContact O-N 3.11Å
592	P	44.6	Very low	51.2	Low	96 Å²	96	110.9 Å²	110.9	62%	0.623	62%	0.615	S	S	*	*			trans	-78	129.4	170.1	30.6	-30.7	0	0	0	109.8	I594	P592-I594 VanDerWaalsContact C-N 3.29Å; P592-I594 HydrophobicContact CB-CG1 4.32Å; P592-I594 HydrophobicContact CG-CD1 4.34Å; P592-I594 HydrophobicContact CG-CG1 4.27Å; P592-I594 PolarHBondContact O-N 2.65Å
593	C	37.6	Very low	49.1	Very low	118 Å²	118	116.4 Å²	116.4	80%	0.797	64%	0.641	S	S	*	*			trans	-75.3	79.7	176.3	-62.6	0	0	0	0	110.6	N595	C593-N595 VanDerWaalsContact C-N 3.33Å; C593-N595 PolarHBondContact O-N 2.97Å
594	I	38.7	Very low	47.3	Very low	125 Å²	125	116.9 Å²	116.9	64%	0.641	65%	0.654	S	S	*	*			trans	-77.9	84.1	176.3	-52	176.8	0	0	0	108.9	P592 N596	P592-I594 VanDerWaalsContact C-N 3.29Å; P592-I594 HydrophobicContact CB-CG1 4.32Å; P592-I594 HydrophobicContact CG-CD1 4.34Å; P592-I594 HydrophobicContact CG-CG1 4.27Å; P592-I594 PolarHBondContact O-N 2.65Å; I594-N596 VanDerWaalsContact C-N 3.27Å; I594-N596 PolarHBondContact O-N 3.02Å
595	N	33.3	Very low	45.2	Very low	137 Å²	137	116.2 Å²	116.2	73%	0.733	66%	0.663	S	S	*	*			trans	-73.3	81.1	172.5	-68.4	1.6	0	0	0	110.1	C593 D597	C593-N595 VanDerWaalsContact C-N 3.33Å; C593-N595 PolarHBondContact O-N 2.97Å; N595-D597 PolarHBondContact O-N 2.97Å
596	N	35.5	Very low	43.6	Very low	143 Å²	143	118.7 Å²	118.7	77%	0.765	68%	0.684	S	S	*	*			trans	-85	96.1	163	-79.7	-30.1	0	0	0	108.5	I594 G598	I594-N596 VanDerWaalsContact C-N 3.27Å; I594-N596 PolarHBondContact O-N 3.02Å; N596-G598 PolarHBondContact O-N 3.34Å; N596-G598 VanDerWaalsContact O-N 3.11Å
597	D	32.1	Very low	42	Very low	168 Å²	168	122.8 Å²	122.8	90%	0.898	71%	0.711	S	S	*	*			trans	-63.9	109.8	170.7	-71	-45.2	0	0	0	109.6	N595	N595-D597 PolarHBondContact O-N 2.97Å
598	G	33.2	Very low	40.1	Very low	68 Å²	68	130 Å²	130	70%	0.701	73%	0.732	S	S	*	*			trans	-153.5	98.7	-177.6	0	0	0	0	0	111.1	N596 N600	N596-G598 PolarHBondContact O-N 3.34Å; N596-G598 VanDerWaalsContact O-N 3.11Å; G598-N600 PolarHBondContact O-N 2.8Å; G598-N600 VanDerWaalsContact O-N 3.1Å
599	D	32.5	Very low	38	Very low	164 Å²	164	127.5 Å²	127.5	88%	0.877	74%	0.737	S	S	*	*			trans	-55.3	110.8	179.5	-72.4	-59.6	0	0	0	112.2
600	N	36.4	Very low	36.6	Very low	164 Å²	164	131.6 Å²	131.6	88%	0.877	76%	0.76	S	S	*	*			trans	-160.4	125.7	156.4	-100.1	-58.9	0	0	0	112.2	G598 T602	G598-N600 PolarHBondContact O-N 2.8Å; G598-N600 VanDerWaalsContact O-N 3.1Å; N600-T602 PolarHBondContact O-N 3.44Å
601	N	28.9	Very low	35.1	Very low	160 Å²	160	132.1 Å²	132.1	86%	0.856	77%	0.767	S	S	*	*			trans	-74.3	116.3	172.8	-72.3	-67.8	0	0	0	111
602	T	33.6	Very low	33.7	Very low	133 Å²	133	132.7 Å²	132.7	82%	0.816	77%	0.774	S	S	*	*			trans	-163.9	133.9	148.9	-77.7	0	0	0	0	110	N600	N600-T602 PolarHBondContact O-N 3.44Å
603	I	29.8	Very low	33.3	Very low	159 Å²	159	135.1 Å²	135.1	82%	0.815	78%	0.781	S	S	*	*			trans	-101.6	124.2	179.1	-60.2	167	0	0	0	109.8
604	P	33.9	Very low	33.1	Very low	124 Å²	124	136.6 Å²	136.6	81%	0.805	78%	0.782	S	S	*	*			trans	-97.1	103.1	161.3	33.4	-25.9	0	0	0	110.2
605	G	30.7	Very low	32.9	Very low	65 Å²	65	133.9 Å²	133.9	67%	0.67	78%	0.784	S	S	*	*			trans	-96.2	138.4	172.6	0	0	0	0	0	112.1
606	T	34.6	Very low	33	Very low	141 Å²	141	131.7 Å²	131.7	87%	0.865	78%	0.78	S	S	*	*			trans	-118.4	96.9	172.6	43.1	0	0	0	0	111.2
607	T	31.6	Very low	32.9	Very low	115 Å²	115	131.2 Å²	131.2	71%	0.706	78%	0.777	S	S	*	*			trans	-77.6	137.3	176.1	-58.5	0	0	0	0	111.2
608	F	30	Very low	32.9	Very low	205 Å²	205	129.6 Å²	129.6	90%	0.899	77%	0.768	S	S	*	*			trans	-120.9	120.9	148.4	-90.1	-74.8	0	0	0	109.8
609	S	28.7	Very low	32.9	Very low	93 Å²	93	133.1 Å²	133.1	65%	0.65	77%	0.771	S	S	*	*			trans	-156.7	129.4	178.5	-66.8	0	0	0	0	108.9
610	N	34.2	Very low	32.9	Very low	148 Å²	148	132.2 Å²	132.2	79%	0.791	77%	0.765	S	S	*	*			trans	-144.1	123.3	158.3	-78.4	-42	0	0	0	104.1
611	T	32.6	Very low	32.7	Very low	110 Å²	110	132.9 Å²	132.9	68%	0.675	76%	0.76	S	S	*	*				60.2	137.9	62.8	72.8	0	0	0	0	111.6
612	L	35.2	Very low	32.9	Very low	150 Å²	150	130.1 Å²	130.1	79%	0.785	75%	0.749	S	S	*	*			cis	-115.9	-174.6	6.8	-68.6	87	0	0	0	110
613	D	36	Very low	33	Very low	147 Å²	147	130.2 Å²	130.2	79%	0.786	75%	0.745	S	S	*	*			cis	-151.8	168.6	13.6	-145.5	-14.5	0	0	0	113.4
614	D	33	Very low	33.1	Very low	150 Å²	150	129.2 Å²	129.2	80%	0.802	74%	0.741	S	S	*	*			trans	-90.8	163.9	-172.9	-154.7	-25.4	0	0	0	113.4
615	G	34.7	Very low	33	Very low	67 Å²	67	129.3 Å²	129.3	69%	0.691	73%	0.734	S	S	*	*			trans	-160	8.2	-168.8	0	0	0	0	0	118.8
616	S	35.6	Very low	33.1	Very low	92 Å²	92	133 Å²	133	64%	0.643	74%	0.738	S	S	*	*			trans	38.4	127.5	157.3	75.2	0	0	0	0	122.9
617	N	33.1	Very low	33.1	Very low	132 Å²	132	133.7 Å²	133.7	71%	0.706	73%	0.734	S	S	*	*			trans	78.1	111.2	131.6	-69.6	-21.4	0	0	0	123.8
618	N	33.1	Very low	33	Very low	134 Å²	134	133.2 Å²	133.2	72%	0.717	74%	0.735	S	S	*	*				87.4	146.9	122.6	-63.3	-24	0	0	0	122.9
619	N	32.9	Very low	33.4	Very low	142 Å²	142	129.1 Å²	129.1	76%	0.759	73%	0.729	S	S	*	*			trans	67.8	123.9	174.7	-61.6	-33.5	0	0	0	115.8
620	I	31.2	Very low	33.6	Very low	146 Å²	146	132 Å²	132	75%	0.749	74%	0.736	S	S	*	*				76.7	124.6	50.1	-62.3	171.5	0	0	0	112.4
621	K	34	Very low	33.4	Very low	177 Å²	177	132 Å²	132	77%	0.77	74%	0.735	S	S	*	*			trans	82.8	105.4	163.6	-92.1	-176.7	174.2	-173.4	0	120.2
622	T	32.3	Very low	33.5	Very low	103 Å²	103	133.2 Å²	133.2	63%	0.632	74%	0.738	S	S	*	*				62.4	140.6	120.3	55.2	0	0	0	0	121.6
623	D	35.5	Very low	33.3	Very low	135 Å²	135	131.7 Å²	131.7	72%	0.722	73%	0.73	S	S	*	*			trans	68.7	105.5	156	-49.1	-23.4	0	0	0	115.2
624	N	32.2	Very low	33.4	Very low	137 Å²	137	131.6 Å²	131.6	73%	0.733	73%	0.725	S	S	*	*				85.9	125.2	72.6	-80.5	10.5	0	0	0	114.1
625	D	31.8	Very low	33.4	Very low	126 Å²	126	129 Å²	129	67%	0.674	72%	0.719	S	S	*	*			trans	86	104.7	136.4	-68.8	-20.5	0	0	0	124.6
626	I	32.1	Very low	33.3	Very low	143 Å²	143	133.2 Å²	133.2	73%	0.733	73%	0.725	S	S	*	*			trans	77.2	158.3	130.4	-45	157.7	0	0	0	118.3
627	I	34.3	Very low	32.9	Very low	156 Å²	156	134 Å²	134	80%	0.8	73%	0.73	S	S	*	*			trans	82.8	132.9	165.6	-45.2	-179.6	0	0	0	115.9
628	S	30.5	Very low	32.8	Very low	104 Å²	104	134.1 Å²	134.1	73%	0.727	74%	0.736	S	S	*	*			cis	-170.3	159.5	-33.7	-97.4	0	0	0	0	109.2
629	P	39.3	Very low	32.6	Very low	119 Å²	119	133.5 Å²	133.5	77%	0.773	74%	0.738	S	S	*	*			trans	-98.8	142.1	-175	36.6	-33.8	0	0	0	115.7
630	I	32.4	Very low	32.7	Very low	154 Å²	154	133.6 Å²	133.6	79%	0.79	74%	0.743	S	S	*	*			trans	-147.7	103.6	169.1	-67.3	-173.6	0	0	0	105.6
631	L	30.1	Very low	32.6	Very low	147 Å²	147	133.9 Å²	133.9	77%	0.77	75%	0.746	S	S	*	*				86.7	144.7	81.5	-85.7	169.9	0	0	0	115.1
632	N	33.3	Very low	32.6	Very low	137 Å²	137	130.8 Å²	130.8	73%	0.733	75%	0.747	S	S	*	*			trans	69.8	152.5	163.8	-68.9	23.5	0	0	0	119.6
633	D	31.8	Very low	32.4	Very low	117 Å²	117	130.7 Å²	130.7	63%	0.626	75%	0.75	S	S	*	*			cis	-170.3	180	-31.9	-158.4	-9.3	0	0	0	109
634	H	37.7	Very low	32.5	Very low	145 Å²	145	129.7 Å²	129.7	67%	0.671	75%	0.754	S	S	*	*			trans	87.3	94	155.1	-53.2	-23.6	0	0	0	120.9
635	S	33	Very low	32.6	Very low	97 Å²	97	132.7 Å²	132.7	68%	0.678	76%	0.76	S	S	*	*				62.9	139.3	110.5	-58.1	0	0	0	0	124.4
636	N	32.2	Very low	32.9	Very low	154 Å²	154	132.7 Å²	132.7	82%	0.824	77%	0.767	S	S	*	*			trans	70.6	115.8	156.2	-56	-23.6	0	0	0	117.2
637	S	28	Very low	33	Very low	108 Å²	108	131 Å²	131	76%	0.755	77%	0.768	S	S	*	*				72.9	110.3	55.9	-171.5	0	0	0	0	114.6
638	T	32	Very low	32.9	Very low	135 Å²	135	129.9 Å²	129.9	83%	0.828	77%	0.769	S	S	*	*			trans	-168.6	138.8	135	-78.2	0	0	0	0	110.7
639	T	28.8	Very low	33	Very low	121 Å²	121	132.3 Å²	132.3	74%	0.742	77%	0.773	S	S	*	*			trans	-82.4	149	175.4	48.5	0	0	0	0	113.6
640	V	34.7	Very low	32.8	Very low	145 Å²	145	132.5 Å²	132.5	88%	0.879	77%	0.774	S	S	*	*			trans	-149	161.2	141.9	-110.7	0	0	0	0	112
641	N	29.5	Very low	32.6	Very low	152 Å²	152	130 Å²	130	81%	0.813	77%	0.77	S	S	*	*			trans	-103.6	179.9	-166.4	-76.5	-51	0	0	0	113.8
642	S	32.9	Very low	32.8	Very low	111 Å²	111	131.4 Å²	131.4	78%	0.776	78%	0.777	S	S	*	*			trans	89.3	150	148.4	84.8	0	0	0	0	117.7
643	S	29.1	Very low	32.5	Very low	101 Å²	101	127.7 Å²	127.7	71%	0.706	77%	0.771	S	S	*	*			cis	-168.3	176.6	-24.8	55.6	0	0	0	0	111.1
644	S	37.8	Very low	32.6	Very low	114 Å²	114	130.5 Å²	130.5	80%	0.797	79%	0.785	S	S	*	*			trans	71.7	165.7	171.2	84	0	0	0	0	116.5
645	K	33.3	Very low	32.3	Very low	200 Å²	200	132.1 Å²	132.1	87%	0.87	79%	0.793	S	S	*	*				-158.2	164	-62.5	-115	-175.8	176.5	-177.5	0	107.4
646	P	38.7	Very low	32.3	Very low	126 Å²	126	135.2 Å²	135.2	82%	0.818	80%	0.801	S	S	*	*			trans	-103.6	167.7	-158.4	39.4	-37.4	0	0	0	116.2
647	S	33.8	Very low	32.2	Very low	109 Å²	109	133.4 Å²	133.4	76%	0.762	80%	0.795	S	S	*	*			trans	-145	113.3	167.7	57.6	0	0	0	0	113.7
648	T	32.1	Very low	32.4	Very low	131 Å²	131	137.3 Å²	137.3	80%	0.804	80%	0.799	S	S	*	*			trans	44.3	111.1	134	-42.9	0	0	0	0	121.6
649	L	33.1	Very low	32.2	Very low	155 Å²	155	136.2 Å²	136.2	81%	0.812	80%	0.796	S	S	*	*				24.6	149.1	121.6	-71	173.2	0	0	0	120.6
650	P	34.1	Very low	32.2	Very low	124 Å²	124	139 Å²	139	81%	0.805	81%	0.806	S	S	*	*			cis	-143.7	177.5	40.8	43.1	-24.2	0	0	0	119.5
651	S	28.5	Very low	32	Very low	100 Å²	100	137 Å²	137	70%	0.699	80%	0.799	S	S	*	*			trans	-45	144.3	169.5	178.5	0	0	0	0	116.7
652	L	33.6	Very low	31.9	Very low	177 Å²	177	136.1 Å²	136.1	93%	0.927	80%	0.799	S	S	*	*			trans	-129	126.4	140.2	-93.8	170.5	0	0	0	108.7
653	G	27.7	Very low	31.7	Very low	59 Å²	59	138.6 Å²	138.6	61%	0.608	80%	0.802	S	S	*	*			trans	-111.9	159.5	166.2	0	0	0	0	0	109.6
654	I	33.8	Very low	31.6	Very low	176 Å²	176	140 Å²	140	90%	0.903	81%	0.807	S	S	*	*			trans	-118.4	127	172	-61.8	177.9	0	0	0	107.1
655	E	31.9	Very low	31.3	Very low	179 Å²	179	141.7 Å²	141.7	84%	0.836	81%	0.806	S	S	*	*			trans	-81.6	155.1	-171.7	-62.2	-173.1	122.2	0	0	113
656	L	33.5	Very low	31.2	Very low	163 Å²	163	139 Å²	139	85%	0.853	80%	0.8	S	S	*	*			trans	-76	137.7	157.3	-62.8	89.3	0	0	0	109.1
657	T	29.6	Very low	30.9	Very low	115 Å²	115	139.7 Å²	139.7	71%	0.706	80%	0.797	S	S	*	*			trans	-161.7	122.5	136.2	38.5	0	0	0	0	111.8
658	K	31.4	Very low	30.8	Very low	190 Å²	190	142.2 Å²	142.2	83%	0.826	80%	0.802	S	S	*	*	S	Bend		171.4	160.2	119.3	-89.9	147.8	-165.6	166.4	0	111.9
659	S	29.4	Very low	30.9	Very low	112 Å²	112	143.5 Å²	143.5	78%	0.783	80%	0.799	S	S	*	*			trans	50.7	64.2	172.1	59.9	0	0	0	0	117.6
660	L	28.9	Very low	30.8	Very low	179 Å²	179	144.3 Å²	144.3	94%	0.937	80%	0.798	S	S	*	*			trans	-137.5	94.7	141.1	-148.6	82.2	0	0	0	109.4
661	S	29.1	Very low	31	Very low	105 Å²	105	143.4 Å²	143.4	73%	0.734	79%	0.792	S	S	*	*			trans	-124.5	147.9	178.9	-61.1	0	0	0	0	109.3
662	T	28.3	Very low	31.1	Very low	132 Å²	132	146 Å²	146	81%	0.81	80%	0.797	S	S	*	*			trans	62.1	94.1	176.6	-10.1	0	0	0	0	113
663	L	27.6	Very low	30.8	Very low	163 Å²	163	144.9 Å²	144.9	85%	0.853	79%	0.792	S	S	*	*				-160.6	130.4	69.4	-90.6	161.6	0	0	0	111.3
664	T	28	Very low	31	Very low	130 Å²	130	147.5 Å²	147.5	80%	0.798	80%	0.801	S	S	*	*			trans	-126.2	128	169.2	45.7	0	0	0	0	109.7
665	I	31.9	Very low	30.8	Very low	151 Å²	151	145.2 Å²	145.2	77%	0.774	80%	0.796	S	S	*	*			trans	-173.3	106.7	160.5	-92	142.4	0	0	0	101.4
666	L	30.5	Very low	30.8	Very low	144 Å²	144	144.3 Å²	144.3	75%	0.754	80%	0.795	S	S	*	*				59.4	132.6	76.3	-56.5	174.9	0	0	0	110.5
667	D	33.1	Very low	30.7	Very low	139 Å²	139	142.8 Å²	142.8	74%	0.743	79%	0.788	S	S	*	*			cis	-124.3	151.5	31.9	-51.4	-54.4	0	0	0	113.6
668	N	31	Very low	30.7	Very low	162 Å²	162	144.3 Å²	144.3	87%	0.866	79%	0.791	S	S	*	*			trans	-135.1	68.2	167.4	-152.9	16.2	0	0	0	108.1	H670	N668-H670 PolarHBondContact O-N 3.34Å
669	E	33.3	Very low	30.7	Very low	159 Å²	159	143.6 Å²	143.6	74%	0.743	79%	0.79	S	S	*	*			trans	-71.9	93.3	-174.3	-89.3	-64.4	133.2	0	0	111.7
670	H	31.3	Very low	31	Very low	171 Å²	171	144.7 Å²	144.7	79%	0.792	78%	0.783	S	S	*	*			trans	-143.9	87.2	165.3	-147.7	-49.2	0	0	0	110.2	N668	N668-H670 PolarHBondContact O-N 3.34Å
671	P	38.1	Very low	31.4	Very low	105 Å²	105	141.4 Å²	141.4	68%	0.682	77%	0.773	S	S	*	*			trans	-62.4	146.5	178	-23.7	35.1	0	0	0	112.7
672	L	31	Very low	31.7	Very low	155 Å²	155	142 Å²	142	81%	0.812	77%	0.768	S	S	*	*			trans	-89.4	174	179.4	-80.8	161.7	0	0	0	112.6	S674	L672-S674 PolarHBondContact O-N 3.45Å
673	D	27.6	Very low	32	Very low	153 Å²	153	144.6 Å²	144.6	82%	0.818	77%	0.768	S	S	*	*			trans	-40.9	131.6	175.7	-67.8	-68.5	0	0	0	114.6
674	S	31.7	Very low	32.3	Very low	114 Å²	114	144.9 Å²	144.9	80%	0.797	76%	0.764	S	S	*	*			trans	-141.1	85.3	159.6	35.2	0	0	0	0	110.7	L672 I676	L672-S674 PolarHBondContact O-N 3.45Å; S674-I676 PolarHBondContact O-N 3.14Å
675	T	29	Very low	32.7	Very low	129 Å²	129	144 Å²	144	79%	0.791	76%	0.759	S	S	*	*			trans	-55.2	113.3	171.2	-56.4	0	0	0	0	111.6
676	I	33.1	Very low	32.8	Very low	160 Å²	160	142.3 Å²	142.3	82%	0.821	75%	0.752	S	S	*	*			trans	-148.6	125.9	157.8	-97.7	143	0	0	0	108.3	S674	S674-I676 PolarHBondContact O-N 3.14Å
677	N	29.9	Very low	32.9	Very low	131 Å²	131	141.5 Å²	141.5	70%	0.701	75%	0.748	S	S	*	*			trans	-72.9	145.7	166.8	-64.1	-60.1	0	0	0	109.1
678	N	30.1	Very low	32.8	Very low	146 Å²	146	141.6 Å²	141.6	78%	0.781	75%	0.748	S	S	*	*				176.2	124.6	118.3	-87.4	-31.9	0	0	0	113.8
679	H	31.1	Very low	32.9	Very low	175 Å²	175	138.3 Å²	138.3	81%	0.81	74%	0.744	S	S	*	*			trans	50.5	103	140.2	-84.3	-71.3	0	0	0	122.2
680	E	36.2	Very low	32.9	Very low	136 Å²	136	138.5 Å²	138.5	64%	0.636	74%	0.744	S	S	*	*				-51.1	155.7	122.4	-119.7	-139.5	98.2	0	0	110.9	N682	E680-N682 PolarHBondContact OE1-N 2.77Å; E680-N682 PolarHBondContact OE1-ND2 2.94Å
681	P	38.1	Very low	33	Very low	110 Å²	110	136.3 Å²	136.3	71%	0.714	74%	0.743	S	S	*	*			cis	-150.1	171.3	47.8	41.6	-20.8	0	0	0	120.2
682	N	35.7	Very low	32.9	Very low	117 Å²	117	134.2 Å²	134.2	63%	0.626	74%	0.74	S	S	*	*			trans	-22.4	143.2	156	-84.8	-87.7	0	0	0	119.7	E680	E680-N682 PolarHBondContact OE1-N 2.77Å; E680-N682 PolarHBondContact OE1-ND2 2.94Å
683	K	33.6	Very low	33	Very low	186 Å²	186	133.6 Å²	133.6	81%	0.809	74%	0.738	S	S	*	*				-173.7	134.8	117.9	-97.4	159.2	-176.9	176	0	109.9
684	H	35.2	Very low	33.2	Very low	169 Å²	169	132.4 Å²	132.4	78%	0.782	73%	0.731	S	S	*	*				53.4	126.7	71.8	-81.7	-31.4	0	0	0	112.3
685	T	34.4	Very low	33.1	Very low	111 Å²	111	133.4 Å²	133.4	68%	0.681	73%	0.728	S	S	*	*			cis	-140.1	-160.6	11.9	47.7	0	0	0	0	107.9
686	N	34.6	Very low	33.2	Very low	117 Å²	117	133.8 Å²	133.8	63%	0.626	73%	0.729	S	S	*	*			cis	-178.2	153.1	28.6	-135.9	-7.2	0	0	0	109.5
687	N	32.9	Very low	33.2	Very low	126 Å²	126	130 Å²	130	67%	0.674	72%	0.723	S	S	*	*			trans	60.9	159	150.7	-59.2	-25.5	0	0	0	118.1
688	N	30.3	Very low	33.4	Very low	141 Å²	141	127.6 Å²	127.6	75%	0.754	72%	0.72	S	S	*	*			cis	-158.6	171	-24.7	-124.5	-27.8	0	0	0	107.2
689	A	34.2	Very low	33.6	Very low	93 Å²	93	127 Å²	127	77%	0.769	72%	0.718	S	S	*	*			trans	66.8	161.5	152.6	0	0	0	0	0	118.2
690	H	32.7	Very low	33.8	Very low	164 Å²	164	125.5 Å²	125.5	76%	0.759	72%	0.715	S	S	*	*			cis	-171.5	124.2	-25	172.9	88.3	0	0	0	111
691	V	32.8	Very low	33.9	Very low	124 Å²	124	125.2 Å²	125.2	75%	0.752	72%	0.718	S	S	*	*			trans	66.4	155.6	150.5	168	0	0	0	0	120.2
692	G	37.1	Very low	33.7	Very low	61 Å²	61	126.3 Å²	126.3	63%	0.629	72%	0.718	S	S	*	*			trans	93.2	95.7	167.3	0	0	0	0	0	113.7
693	N	32.6	Very low	33.6	Very low	143 Å²	143	127 Å²	127	77%	0.765	72%	0.722	S	S	*	*			cis	72.4	129.5	13.2	-148.4	41.5	0	0	0	115.8
694	N	32.7	Very low	33.6	Very low	128 Å²	128	125.1 Å²	125.1	68%	0.684	72%	0.72	S	S	*	*			trans	70.7	149.6	-176.5	-50.9	-40.9	0	0	0	114.6
695	N	29.7	Very low	33.4	Very low	134 Å²	134	122.2 Å²	122.2	72%	0.717	71%	0.711	S	S	*	*			cis	158.1	169.1	-17.3	-91.9	-28.8	0	0	0	104.5
696	V	30.8	Very low	33.6	Very low	137 Å²	137	122 Å²	122	83%	0.83	71%	0.705	S	S	*	*			trans	72.2	112.4	174.1	-165.7	0	0	0	0	111.4
697	A	32	Very low	33.6	Very low	82 Å²	82	123 Å²	123	68%	0.678	70%	0.704	S	S	*	*				74.6	173.3	58.6	0	0	0	0	0	113
698	A	34	Very low	33.8	Very low	79 Å²	79	125.9 Å²	125.9	65%	0.653	71%	0.711	S	S	*	*			trans	69.6	115.7	-133.5	0	0	0	0	0	109.9
699	D	34.6	Very low	33.9	Very low	135 Å²	135	126.2 Å²	126.2	72%	0.722	71%	0.707	S	S	*	*			cis	72.6	151.2	35.5	-44.6	-66.6	0	0	0	112.6
700	D	36.6	Very low	33.8	Very low	142 Å²	142	129.3 Å²	129.3	76%	0.759	71%	0.706	S	S	*	*			trans	67	147.4	171.2	-42.8	-24.3	0	0	0	116.1
701	D	36.8	Very low	33.7	Very low	130 Å²	130	127.3 Å²	127.3	70%	0.695	70%	0.697	S	S	*	*			cis	-160.6	161	-21.2	-119.9	-19.6	0	0	0	111
702	D	35.5	Very low	33.5	Very low	133 Å²	133	129.2 Å²	129.2	71%	0.711	70%	0.696	S	S	*	*			trans	45.4	166.7	145.6	-85.5	-18.4	0	0	0	124.9
703	N	32.2	Very low	33.3	Very low	133 Å²	133	134.2 Å²	134.2	71%	0.711	70%	0.702	S	S	*	*			trans	69.7	128.7	170.7	-63	-79.7	0	0	0	115.5
704	D	34.1	Very low	33.1	Very low	145 Å²	145	132.5 Å²	132.5	78%	0.775	70%	0.702	S	S	*	*				57.3	142.7	57.6	-65.4	-45.5	0	0	0	111.4
705	N	31.6	Very low	33.2	Very low	108 Å²	108	133.9 Å²	133.9	58%	0.578	71%	0.707	S	S	*	*			cis	-165.1	177.6	38	-170.6	12.6	0	0	0	111.2	K707	N705-K707 PolarHBondContact OD1-NZ 2.94Å
706	D	37.2	Very low	33.3	Very low	107 Å²	107	136.5 Å²	136.5	57%	0.572	72%	0.715	S	S	*	*			trans	64.2	99.6	160	-70.6	-45.3	0	0	0	117.7
707	K	35.6	Very low	33.5	Very low	138 Å²	138	138.7 Å²	138.7	60%	0.6	71%	0.714	S	S	*	*				62.2	106.5	66.1	-56.5	-179.5	-147.8	77.8	0	113.7	N705	N705-K707 PolarHBondContact OD1-NZ 2.94Å
708	K	36.2	Very low	33.4	Very low	187 Å²	187	139.2 Å²	139.2	81%	0.813	71%	0.712	S	S	*	*				-167.7	129.6	116.7	-96.2	145.3	-171.3	171.9	0	107.4
709	H	32.5	Very low	33.3	Very low	148 Å²	148	143.2 Å²	143.2	69%	0.685	72%	0.721	S	S	*	*				58.4	127.1	76.9	-64	-18.2	0	0	0	110.4
710	Q	31.8	Very low	33.5	Very low	157 Å²	157	141.8 Å²	141.8	73%	0.734	72%	0.719	S	S	*	*			cis	-160.1	169	26.9	-110.3	145.6	28.9	0	0	108.4
711	Q	30.6	Very low	33.3	Very low	123 Å²	123	144 Å²	144	58%	0.575	73%	0.725	S	S	*	*			cis	172.8	139.4	-19.1	159.3	178.8	-75.6	0	0	109.3
712	F	29.1	Very low	33.1	Very low	164 Å²	164	143.6 Å²	143.6	72%	0.719	73%	0.731	S	S	*	*			trans	64.1	161.9	168.2	-59.3	-25.4	0	0	0	116.4
713	Q	33	Very low	32.9	Very low	166 Å²	166	145 Å²	145	78%	0.776	74%	0.738	S	S	*	*			cis	-141.8	160.5	-0.1	-141	149.7	64	0	0	112.3
714	S	27.9	Very low	33	Very low	107 Å²	107	147.1 Å²	147.1	75%	0.748	75%	0.748	S	S	*	*			trans	-65.8	150	175.3	-37.1	0	0	0	0	112.9
715	I	35	Very low	32.8	Very low	156 Å²	156	144.6 Å²	144.6	80%	0.8	75%	0.747	S	S	*	*			trans	-155.1	120.8	137.4	-97.1	143.9	0	0	0	107.7	K717	I715-K717 HydrophobicContact CG2-CB 4.4Å
716	E	32.1	Very low	32.9	Very low	190 Å²	190	146.1 Å²	146.1	89%	0.888	76%	0.76	S	S	*	*			trans	-82.8	132.9	160.7	-67.3	171.8	100.9	0	0	108.4
717	K	34.9	Very low	32.7	Very low	183 Å²	183	146 Å²	146	80%	0.796	77%	0.768	S	S	*	*			trans	-163.1	88	162.6	-112.6	161.5	-173	-179.7	0	112.8	I715	I715-K717 HydrophobicContact CG2-CB 4.4Å
718	S	31.3	Very low	32.7	Very low	92 Å²	92	146.9 Å²	146.9	64%	0.643	78%	0.778	S	S	*	*				33.4	148.2	123.8	63.9	0	0	0	0	122
719	I	31.6	Very low	32.6	Very low	163 Å²	163	143.5 Å²	143.5	84%	0.836	77%	0.773	S	S	*	*			trans	91.9	139.4	152.7	-74.5	156.7	0	0	0	115.8
720	P	38.5	Very low	32.8	Very low	105 Å²	105	140.8 Å²	140.8	68%	0.682	77%	0.771	S	S	*	*				-131.4	-147.6	-129.7	46	-30.4	0	0	0	114.4
721	E	32.2	Very low	33.1	Very low	188 Å²	188	139.6 Å²	139.6	88%	0.879	77%	0.77	S	S	*	*			trans	-49.6	143.6	178.3	-66.1	157.4	118	0	0	114.3
722	C	32.4	Very low	33.4	Very low	123 Å²	123	140.1 Å²	140.1	83%	0.831	78%	0.776	S	S	*	*			trans	-108.2	97.5	178.8	-70.3	0	0	0	0	111.6
723	D	31.4	Very low	33.7	Very low	162 Å²	162	139.1 Å²	139.1	87%	0.866	77%	0.774	S	S	*	*			trans	-74	145.7	158.9	-83.8	-44.1	0	0	0	110.9
724	I	33.5	Very low	33.9	Very low	178 Å²	178	138.3 Å²	138.3	91%	0.913	77%	0.77	S	S	*	*			trans	-101.6	89.4	176.4	-58.4	177.9	0	0	0	109.5
725	A	29.7	Very low	34.2	Very low	91 Å²	91	140.3 Å²	140.3	75%	0.752	77%	0.768	S	S	*	*			trans	-149.4	104.9	172.4	0	0	0	0	0	112.4
726	V	35.4	Very low	34.2	Very low	141 Å²	141	138 Å²	138	86%	0.855	76%	0.761	S	S	*	*			trans	-148.1	138.2	171.6	-147.7	0	0	0	0	105.8
727	S	32.4	Very low	34.2	Very low	105 Å²	105	135.8 Å²	135.8	73%	0.734	75%	0.754	S	S	*	*			cis	-127.1	-167.6	19	-46.5	0	0	0	0	110.7
728	L	35	Very low	34.3	Very low	155 Å²	155	132.3 Å²	132.3	81%	0.812	75%	0.749	S	S	*	*			cis	-150.1	-163.6	14.6	-134.7	174.8	0	0	0	110.1
729	T	33.7	Very low	34.6	Very low	116 Å²	116	135 Å²	135	71%	0.712	76%	0.761	S	S	*	*			trans	-97.7	162.2	-173.2	56.8	0	0	0	0	111.6
730	S	38.3	Very low	34.7	Very low	91 Å²	91	133.2 Å²	133.2	64%	0.636	76%	0.758	S	S	*	*				-179.4	160.6	55.7	49.2	0	0	0	0	115.7
731	N	37.7	Very low	34.6	Very low	133 Å²	133	137.6 Å²	137.6	71%	0.711	77%	0.766	S	S	*	*			trans	84.2	108.2	150.5	-59	-19.1	0	0	0	123
732	N	36.7	Very low	34.6	Very low	133 Å²	133	138.7 Å²	138.7	71%	0.711	77%	0.768	S	S	*	*				79.9	145.4	129	-62.3	17.6	0	0	0	122.4
733	E	35.2	Very low	34.7	Very low	143 Å²	143	138 Å²	138	67%	0.668	77%	0.765	S	S	*	*			cis	-173.9	159.3	-35.3	-130.3	-177.7	-147.9	0	0	111.1
734	Q	36.5	Very low	35.1	Very low	150 Å²	150	139.6 Å²	139.6	70%	0.701	76%	0.764	S	S	*	*			trans	63.7	154.8	159	-60.7	172.1	23.3	0	0	118.3
735	E	35	Very low	35.2	Very low	149 Å²	149	141.5 Å²	141.5	70%	0.696	76%	0.76	S	S	*	*			cis	-158.5	126.7	-20.2	-110.5	-162.5	122.8	0	0	108.3
736	T	34.3	Very low	35.4	Very low	106 Å²	106	146.1 Å²	146.1	65%	0.65	76%	0.763	S	S	*	*				74	145	96.7	70.1	0	0	0	0	119.4
737	L	33.4	Very low	35.4	Very low	144 Å²	144	147.6 Å²	147.6	75%	0.754	77%	0.766	S	S	*	*			trans	69.1	108.3	151.9	-70.9	158.7	0	0	0	123.2
738	T	36.4	Very low	35.8	Very low	111 Å²	111	151.7 Å²	151.7	68%	0.681	77%	0.771	S	S	*	*				22.6	135.1	129.8	60.1	0	0	0	0	121.7
739	T	37.2	Very low	35.8	Very low	147 Å²	147	153.6 Å²	153.6	90%	0.902	77%	0.773	S	S	*	*				-174.6	163.6	119.4	20.9	0	0	0	0	113.9
740	T	33.7	Very low	36.2	Very low	126 Å²	126	153.9 Å²	153.9	77%	0.773	77%	0.774	S	S	*	*			trans	-94.3	143.6	179.4	51.5	0	0	0	0	114.2
741	K	36.2	Very low	36.3	Very low	197 Å²	197	157.5 Å²	157.5	86%	0.857	79%	0.786	S	S	*	*	S	Bend	trans	35.8	85.4	147.9	-62.8	179.5	178.7	175	0	118.3
742	K	32.6	Very low	37.1	Very low	211 Å²	211	160 Å²	160	92%	0.917	79%	0.791	S	S	*	*				172.9	169	127.2	-97.8	164.2	-177.8	177	0	113.9
743	S	34.7	Very low	38.1	Very low	110 Å²	110	163 Å²	163	77%	0.769	80%	0.798	S	S	*	*			trans	75.6	71.3	159.9	-152.9	0	0	0	0	120.4
744	K	39	Very low	39.5	Very low	194 Å²	194	160.1 Å²	160.1	84%	0.843	79%	0.786	S	S	*	*				14.7	124	117.7	-162.3	179.5	-171.3	172.5	0	117.2
745	R	36.4	Very low	41.1	Very low	218 Å²	218	157 Å²	157	82%	0.823	78%	0.778	S	S	*	*			trans	115.4	120.5	159.4	-68	175.7	123.2	178.1	-0	115
746	K	34.5	Very low	43.4	Very low	188 Å²	188	153.4 Å²	153.4	82%	0.817	77%	0.773	S	S	*	*			trans	51.6	97.4	150.9	-60.7	-178.6	176.9	-175.6	0	117.2
747	N	35	Very low	45.7	Very low	173 Å²	173	152.8 Å²	152.8	93%	0.925	77%	0.766	S	S	*	*				-137.7	144	118.7	-107.9	-26.4	0	0	0	110.8
748	K	39.7	Very low	48.3	Very low	191 Å²	191	150.3 Å²	150.3	83%	0.83	75%	0.751	S	S	*	*			trans	-145.2	142.4	-174.2	170.9	-179.9	176.2	178	0	106.5
749	K	35.4	Very low	50.7	Low	195 Å²	195	148.9 Å²	148.9	85%	0.848	74%	0.741	S	S	*	*			trans	81.8	142.3	-158.8	-49.5	158.3	-178.4	-177	0	110.4
750	T	42.3	Very low	53.1	Low	121 Å²	121	149.4 Å²	149.4	74%	0.742	73%	0.727	S	S	*	*			cis	-119.8	101.9	0.8	45.1	0	0	0	0	112.1	K752	T750-K752 VanDerWaalsContact C-N 3.28Å; T750-K752 PolarHBondContact O-N 3.03Å
751	N	40.5	Very low	55.7	Low	167 Å²	167	148.8 Å²	148.8	89%	0.893	72%	0.715	S	S	*	*			trans	-69.6	93.7	152.2	-80.7	-4.3	0	0	0	107.4	K753	N751-K753 PolarHBondContact O-N 3.4Å
752	K	55.1	Low	58.3	Low	187 Å²	187	143.7 Å²	143.7	81%	0.813	70%	0.697	S	S	*	*			trans	-61.6	100.9	147.9	-79.4	-174	176.5	-178	0	105	T750 L754	T750-K752 VanDerWaalsContact C-N 3.28Å; T750-K752 PolarHBondContact O-N 3.03Å; K752-L754 PolarHBondContact O-N 3.19Å; K752-L754 VanDerWaalsContact O-N 3.11Å
753	K	56.5	Low	61.1	Low	196 Å²	196	136.6 Å²	136.6	85%	0.852	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-57.3	116.8	160.1	-101.7	-173.6	169.3	-172.5	0	104.6	N751 T755	N751-K753 PolarHBondContact O-N 3.4Å; K753-T755 PolarHBondContact O-N 2.87Å
754	L	65.3	Low	63.9	Low	81 Å²	81	139.5 Å²	139.5	42%	0.424	67%	0.672	S	S	.	*	P	Polyproline II helix	trans	-51.5	136.5	164.4	-80.2	74.2	0	0	0	106.9	K752 E758 V759 L762	K752-L754 PolarHBondContact O-N 3.19Å; K752-L754 VanDerWaalsContact O-N 3.11Å; L754-E758 VanDerWaalsContact CA-OE2 3.22Å; L754-E758 WeakPolarHBondContact CA-OE2 3.44Å; L754-E758 HydrophobicContact CB-CB 4.3Å; L754-E758 HydrophobicContact CB-CG 4.2Å; L754-E758 HydrophobicContact CD2-CG 4.07Å; L754-E758 HydrophobicContact CG-CG 4.12Å; L754-V759 HydrophobicContact CB-CG2 3.55Å; L754-V759 HydrophobicContact CD2-CG2 4.36Å; L754-L762 HydrophobicContact CD2-CD1 3.45Å; L754-L762 VanDerWaalsContact CD2-CD1 3.45Å
755	T	70.7	Confident	66.4	Low	86 Å²	86	133.5 Å²	133.5	53%	0.528	65%	0.647	S	S	.	*	P	Polyproline II helix	trans	-61.8	153.7	177.3	50.9	0	0	0	0	109.5	K753 D757 E758 V759	K753-T755 PolarHBondContact O-N 2.87Å; T755-D757 PolarHBondContact O-N 3.47Å; T755-E758 PolarHBondContact N-OE2 3.47Å; T755-E758 WeakPolarHBondContact O-CB 3.48Å; T755-E758 PolarHBondContact O-N 3.3Å; T755-E758 VanDerWaalsContact OG1-CB 3.24Å; T755-E758 WeakPolarHBondContact OG1-CB 3.21Å; T755-E758 PolarHBondContact OG1-OE2 3.34Å; T755-V759 PolarHBondContact O-N 2.96Å
756	A	81.9	Confident	68.9	Low	72 Å²	72	126.8 Å²	126.8	60%	0.595	63%	0.633	S	S	*	*	H	α-helix	trans	-56.9	-30.9	-175.3	0	0	0	0	0	111.8	R760	A756-R760 WeakPolarHBondContact O-CB 3.33Å; A756-R760 PolarHBondContact O-N 2.95Å
757	D	83.8	Confident	71.6	Confident	94 Å²	94	120.5 Å²	120.5	50%	0.503	61%	0.607	S	S	.	*	H	α-helix	trans	-79.2	-31.8	177.3	-55.7	-64.9	0	0	0	113.7	T755 R760 Q761	T755-D757 PolarHBondContact O-N 3.47Å; D757-R760 CarbonylContact O-C 3.58Å; D757-R760 WeakPolarHBondContact O-CB 3.39Å; D757-R760 PolarHBondContact O-N 3Å; D757-R760 IonicContact OD1-CZ 2.79Å; D757-R760 IonicContact OD1-NE 2.69Å; D757-R760 PolarHBondContact OD1-NE 3.43Å; D757-R760 IonicContact OD1-NH2 3.55Å; D757-R760 PolarHBondContact OD1-NH2 2.82Å; D757-Q761 WeakPolarHBondContact O-CB 3.25Å; D757-Q761 PolarHBondContact O-N 2.9Å
758	E	87.8	Confident	74.4	Confident	92 Å²	92	117.5 Å²	117.5	43%	0.43	59%	0.586	S	S	.	*	H	α-helix	trans	-69.7	-37.7	173.1	-170.7	-179	-167.2	0	0	111.1	L754 T755 Q761 L762	L754-E758 VanDerWaalsContact CA-OE2 3.22Å; L754-E758 WeakPolarHBondContact CA-OE2 3.44Å; L754-E758 HydrophobicContact CB-CB 4.3Å; L754-E758 HydrophobicContact CB-CG 4.2Å; L754-E758 HydrophobicContact CD2-CG 4.07Å; L754-E758 HydrophobicContact CG-CG 4.12Å; T755-E758 PolarHBondContact N-OE2 3.47Å; T755-E758 WeakPolarHBondContact O-CB 3.48Å; T755-E758 PolarHBondContact O-N 3.3Å; T755-E758 VanDerWaalsContact OG1-CB 3.24Å; T755-E758 WeakPolarHBondContact OG1-CB 3.21Å; T755-E758 PolarHBondContact OG1-OE2 3.34Å; E758-Q761 PolarHBondContact O-N 3.34Å; E758-L762 WeakPolarHBondContact O-CG 3.31Å; E758-L762 PolarHBondContact O-N 3.06Å
759	V	87	Confident	76.9	Confident	80 Å²	80	113.1 Å²	113.1	49%	0.485	57%	0.571	S	S	.	*	H	α-helix	trans	-66.1	-40.3	168.7	-179.6	0	0	0	0	111.2	L754 T755 Q761 A763	L754-V759 HydrophobicContact CB-CG2 3.55Å; L754-V759 HydrophobicContact CD2-CG2 4.36Å; T755-V759 PolarHBondContact O-N 2.96Å; V759-Q761 VanDerWaalsContact C-N 3.34Å; V759-A763 WeakPolarHBondContact O-CB 3.45Å; V759-A763 PolarHBondContact O-N 3.49Å
760	R	87.5	Confident	79.7	Confident	159 Å²	159	110.6 Å²	110.6	60%	0.6	56%	0.556	S	S	*	*	H	α-helix	trans	-62.5	-40.8	176.1	-167.3	-160.6	-48.4	-78.5	3.4	111.4	A756 D757 W764	A756-R760 WeakPolarHBondContact O-CB 3.33Å; A756-R760 PolarHBondContact O-N 2.95Å; D757-R760 CarbonylContact O-C 3.58Å; D757-R760 WeakPolarHBondContact O-CB 3.39Å; D757-R760 PolarHBondContact O-N 3Å; D757-R760 IonicContact OD1-CZ 2.79Å; D757-R760 IonicContact OD1-NE 2.69Å; D757-R760 PolarHBondContact OD1-NE 3.43Å; D757-R760 IonicContact OD1-NH2 3.55Å; D757-R760 PolarHBondContact OD1-NH2 2.82Å; R760-W764 WeakPolarHBondContact O-CB 3.41Å; R760-W764 PolarHBondContact O-N 3.47Å
761	Q	89	Confident	81.9	Confident	112 Å²	112	112.5 Å²	112.5	52%	0.523	55%	0.55	S	S	.	.	H	α-helix	trans	-69	-49	178.7	-179.3	173.4	-17.6	0	0	111.5	D757 E758 V759 A763 W764 E765	D757-Q761 WeakPolarHBondContact O-CB 3.25Å; D757-Q761 PolarHBondContact O-N 2.9Å; E758-Q761 PolarHBondContact O-N 3.34Å; V759-Q761 VanDerWaalsContact C-N 3.34Å; Q761-A763 PolarHBondContact O-N 2.85Å; Q761-W764 CarbonylContact O-C 3.57Å; Q761-W764 WeakPolarHBondContact O-CA 3.36Å; Q761-W764 WeakPolarHBondContact O-CB 3.17Å; Q761-W764 PolarHBondContact O-N 2.92Å; Q761-E765 HydrophobicContact CG-CG 4.39Å; Q761-E765 VanDerWaalsContact CG-OE1 3.26Å; Q761-E765 WeakPolarHBondContact CG-OE1 3.28Å; Q761-E765 PolarHBondContact NE2-OE1 3.47Å; Q761-E765 WeakPolarHBondContact O-CG 3.38Å; Q761-E765 PolarHBondContact O-N 2.95Å
762	L	90.2	Very high	84.5	Confident	91 Å²	91	111.2 Å²	111.2	48%	0.476	54%	0.536	S	S	.	.	H	α-helix	trans	-59.9	-35.2	174.9	-73.9	172.3	0	0	0	112.5	L754 E758 S766	L754-L762 HydrophobicContact CD2-CD1 3.45Å; L754-L762 VanDerWaalsContact CD2-CD1 3.45Å; E758-L762 WeakPolarHBondContact O-CG 3.31Å; E758-L762 PolarHBondContact O-N 3.06Å; L762-S766 VanDerWaalsContact O-CB 3.24Å; L762-S766 WeakPolarHBondContact O-CB 3.41Å; L762-S766 PolarHBondContact O-N 2.88Å
763	A	91.1	Very high	86.3	Confident	61 Å²	61	105 Å²	105	50%	0.504	52%	0.52	S	S	.	.	H	α-helix	trans	-66.1	-38.9	172.6	0	0	0	0	0	112.2	V759 Q761 E767	V759-A763 WeakPolarHBondContact O-CB 3.45Å; V759-A763 PolarHBondContact O-N 3.49Å; Q761-A763 PolarHBondContact O-N 2.85Å; A763-E767 VanDerWaalsContact O-CB 3.26Å; A763-E767 WeakPolarHBondContact O-CB 3.31Å; A763-E767 PolarHBondContact O-N 3.35Å
764	W	93.4	Very high	88	Confident	171 Å²	171	98.1 Å²	98.1	65%	0.648	50%	0.499	S	S	*	.	H	α-helix	trans	-69.3	-40.5	175.9	-174	88.9	0	0	0	112.6	R760 Q761 E767 F768	R760-W764 WeakPolarHBondContact O-CB 3.41Å; R760-W764 PolarHBondContact O-N 3.47Å; Q761-W764 CarbonylContact O-C 3.57Å; Q761-W764 WeakPolarHBondContact O-CA 3.36Å; Q761-W764 WeakPolarHBondContact O-CB 3.17Å; Q761-W764 PolarHBondContact O-N 2.92Å; W764-E767 WeakPolarHBondContact O-CB 3.25Å; W764-E767 PolarHBondContact O-N 2.88Å; W764-F768 WeakPolarHBondContact O-CB 3.41Å; W764-F768 PolarHBondContact O-N 3Å
765	E	90.7	Very high	89.2	Confident	69 Å²	69	97.9 Å²	97.9	32%	0.322	51%	0.505	S	S	.	.	H	α-helix	trans	-66.8	-38.9	174.9	-70.1	170	-173.2	0	0	111.5	Q761 F768 N769	Q761-E765 HydrophobicContact CG-CG 4.39Å; Q761-E765 VanDerWaalsContact CG-OE1 3.26Å; Q761-E765 WeakPolarHBondContact CG-OE1 3.28Å; Q761-E765 PolarHBondContact NE2-OE1 3.47Å; Q761-E765 WeakPolarHBondContact O-CG 3.38Å; Q761-E765 PolarHBondContact O-N 2.95Å; E765-F768 PolarHBondContact O-N 3.36Å; E765-N769 WeakPolarHBondContact O-CB 3.49Å; E765-N769 PolarHBondContact O-N 3.32Å; E765-N769 PolarHBondContact O-ND2 3.45Å
766	S	90.6	Very high	90.3	Very high	77 Å²	77	99 Å²	99	54%	0.538	51%	0.507	S	S	.	.	H	α-helix	trans	-65.7	-41.8	172.5	-173.2	0	0	0	0	112.1	L762 R770	L762-S766 VanDerWaalsContact O-CB 3.24Å; L762-S766 WeakPolarHBondContact O-CB 3.41Å; L762-S766 PolarHBondContact O-N 2.88Å; S766-R770 WeakPolarHBondContact O-CB 3.36Å; S766-R770 PolarHBondContact O-N 3.45Å
767	E	89.4	Confident	90.6	Very high	55 Å²	55	102.3 Å²	102.3	26%	0.257	51%	0.51	S	S	.	.	H	α-helix	trans	-61.3	-45.5	173.1	178.6	67.2	-153.8	0	0	111.7	A763 W764 R770 R771	A763-E767 VanDerWaalsContact O-CB 3.26Å; A763-E767 WeakPolarHBondContact O-CB 3.31Å; A763-E767 PolarHBondContact O-N 3.35Å; W764-E767 WeakPolarHBondContact O-CB 3.25Å; W764-E767 PolarHBondContact O-N 2.88Å; E767-R770 PolarHBondContact O-N 3.18Å; E767-R770 IonicContact OE1-CZ 3.22Å; E767-R770 IonicContact OE1-NH2 2.68Å; E767-R770 PolarHBondContact OE1-NH2 3.01Å; E767-R770 IonicContact OE2-CZ 3.43Å; E767-R770 IonicContact OE2-NH1 3.93Å; E767-R770 PolarHBondContact OE2-NH1 3.15Å; E767-R770 IonicContact OE2-NH2 2.73Å; E767-R770 PolarHBondContact OE2-NH2 3.36Å; E767-R771 WeakPolarHBondContact O-CG 3.34Å; E767-R771 PolarHBondContact O-N 2.79Å; E767-R771 IonicContact OE1-CZ 3.86Å; E767-R771 IonicContact OE1-NE 2.92Å; E767-R771 PolarHBondContact OE1-NE 2.9Å; E767-R771 IonicContact OE1-NH2 2.59Å; E767-R771 PolarHBondContact OE1-NH2 3.44Å
768	F	94.4	Very high	90.9	Very high	111 Å²	111	104.1 Å²	104.1	49%	0.487	52%	0.516	S	S	.	.	H	α-helix	trans	-63.2	-46.9	177.4	-177.5	-95.2	0	0	0	111.7	W764 E765 R770 R771 K772	W764-F768 WeakPolarHBondContact O-CB 3.41Å; W764-F768 PolarHBondContact O-N 3Å; E765-F768 PolarHBondContact O-N 3.36Å; F768-R770 VanDerWaalsContact C-N 3.33Å; F768-R770 PolarHBondContact O-N 3.43Å; F768-R771 PolarHBondContact O-N 3.01Å; F768-K772 PolarHBondContact O-N 3.04Å
769	N	93	Very high	90.9	Very high	98 Å²	98	103.2 Å²	103.2	52%	0.524	52%	0.52	S	S	.	.	H	α-helix	trans	-63.2	-37.9	176.1	-76.2	-40.6	0	0	0	112	E765 K772 A773	E765-N769 WeakPolarHBondContact O-CB 3.49Å; E765-N769 PolarHBondContact O-N 3.32Å; E765-N769 PolarHBondContact O-ND2 3.45Å; N769-K772 PolarHBondContact O-N 3.14Å; N769-A773 WeakPolarHBondContact O-CB 3.49Å; N769-A773 PolarHBondContact O-N 2.9Å
770	R	92.9	Very high	91.1	Very high	142 Å²	142	104 Å²	104	54%	0.536	52%	0.52	S	S	.	.	H	α-helix	trans	-64.7	-39	173.8	-163.6	-179.2	75.7	-101.3	-4.6	112.1	S766 E767 F768 A773 A774	S766-R770 WeakPolarHBondContact O-CB 3.36Å; S766-R770 PolarHBondContact O-N 3.45Å; E767-R770 PolarHBondContact O-N 3.18Å; E767-R770 IonicContact OE1-CZ 3.22Å; E767-R770 IonicContact OE1-NH2 2.68Å; E767-R770 PolarHBondContact OE1-NH2 3.01Å; E767-R770 IonicContact OE2-CZ 3.43Å; E767-R770 IonicContact OE2-NH1 3.93Å; E767-R770 PolarHBondContact OE2-NH1 3.15Å; E767-R770 IonicContact OE2-NH2 2.73Å; E767-R770 PolarHBondContact OE2-NH2 3.36Å; F768-R770 VanDerWaalsContact C-N 3.33Å; F768-R770 PolarHBondContact O-N 3.43Å; R770-A773 PolarHBondContact O-N 2.88Å; R770-A774 WeakPolarHBondContact O-CB 3.44Å; R770-A774 PolarHBondContact O-N 3.42Å
771	R	89.7	Confident	91.2	Very high	161 Å²	161	98.7 Å²	98.7	61%	0.608	51%	0.511	S	S	*	.	H	α-helix	trans	-66.3	-42.2	174.3	-70.7	172.8	-170	-162.5	2.7	112	E767 F768 A774 S775	E767-R771 WeakPolarHBondContact O-CG 3.34Å; E767-R771 PolarHBondContact O-N 2.79Å; E767-R771 IonicContact OE1-CZ 3.86Å; E767-R771 IonicContact OE1-NE 2.92Å; E767-R771 PolarHBondContact OE1-NE 2.9Å; E767-R771 IonicContact OE1-NH2 2.59Å; E767-R771 PolarHBondContact OE1-NH2 3.44Å; F768-R771 PolarHBondContact O-N 3.01Å; R771-A774 PolarHBondContact O-N 3.22Å; R771-S775 WeakPolarHBondContact O-CB 3.25Å; R771-S775 PolarHBondContact O-N 3.42Å
772	K	94.4	Very high	91.1	Very high	140 Å²	140	98.7 Å²	98.7	61%	0.609	51%	0.511	S	S	*	.	H	α-helix	trans	-62.4	-42.1	175.7	-168.9	177	-179.3	-178.3	0	111.6	F768 N769 L776	F768-K772 PolarHBondContact O-N 3.04Å; N769-K772 PolarHBondContact O-N 3.14Å; K772-L776 PolarHBondContact O-N 3.39Å; K772-L776 VanDerWaalsContact O-N 3.13Å
773	A	92.5	Very high	91	Very high	58 Å²	58	100.3 Å²	100.3	48%	0.479	52%	0.516	S	S	.	.	H	α-helix	trans	-64.2	-48.5	174.5	0	0	0	0	0	112.2	N769 R770 S775 L776 E777	N769-A773 WeakPolarHBondContact O-CB 3.49Å; N769-A773 PolarHBondContact O-N 2.9Å; R770-A773 PolarHBondContact O-N 2.88Å; A773-S775 VanDerWaalsContact C-N 3.31Å; A773-S775 PolarHBondContact O-N 3.45Å; A773-L776 WeakPolarHBondContact O-CB 3.42Å; A773-L776 PolarHBondContact O-N 2.91Å; A773-L776 VanDerWaalsContact O-N 3.11Å; A773-E777 PolarHBondContact O-N 3.3Å
774	A	93.4	Very high	90.8	Very high	50 Å²	50	102.6 Å²	102.6	41%	0.413	52%	0.516	S	S	.	.	H	α-helix	trans	-62.9	-35.5	178.3	0	0	0	0	0	112.8	R770 R771 L776 Q778	R770-A774 WeakPolarHBondContact O-CB 3.44Å; R770-A774 PolarHBondContact O-N 3.42Å; R771-A774 PolarHBondContact O-N 3.22Å; A774-L776 VanDerWaalsContact C-N 3.34Å; A774-Q778 WeakPolarHBondContact O-CB 3.21Å; A774-Q778 PolarHBondContact O-N 3.31Å
775	S	89.5	Confident	90.7	Very high	77 Å²	77	103.4 Å²	103.4	54%	0.538	52%	0.519	S	S	.	.	H	α-helix	trans	-67.8	-33.3	174.2	-170.1	0	0	0	0	112.7	R771 A773 S779	R771-S775 WeakPolarHBondContact O-CB 3.25Å; R771-S775 PolarHBondContact O-N 3.42Å; A773-S775 VanDerWaalsContact C-N 3.31Å; A773-S775 PolarHBondContact O-N 3.45Å; S775-S779 PolarHBondContact O-N 3.45Å; S775-S779 VanDerWaalsContact O-N 3.12Å
776	L	94.1	Very high	90.6	Very high	109 Å²	109	105.3 Å²	105.3	57%	0.571	53%	0.531	S	S	*	.	H	α-helix	trans	-72.7	-43.9	175.3	-172.5	157.7	0	0	0	110.7	K772 A773 A774 Q778 S779 L780	K772-L776 PolarHBondContact O-N 3.39Å; K772-L776 VanDerWaalsContact O-N 3.13Å; A773-L776 WeakPolarHBondContact O-CB 3.42Å; A773-L776 PolarHBondContact O-N 2.91Å; A773-L776 VanDerWaalsContact O-N 3.11Å; A774-L776 VanDerWaalsContact C-N 3.34Å; L776-Q778 VanDerWaalsContact C-N 3.34Å; L776-Q778 PolarHBondContact O-N 2.96Å; L776-S779 WeakPolarHBondContact O-CB 3.43Å; L776-S779 PolarHBondContact O-N 2.97Å; L776-L780 HydrophobicContact CD2-CD1 3.63Å; L776-L780 HydrophobicContact CD2-CG 4.18Å; L776-L780 PolarHBondContact O-N 3.08Å
777	E	89.5	Confident	90.7	Very high	142 Å²	142	108.7 Å²	108.7	66%	0.664	54%	0.536	S	S	*	.	H	α-helix	trans	-60.1	-42.6	174.2	-173.2	176.7	-175.8	0	0	111.7	A773 S779 L780 A781	A773-E777 PolarHBondContact O-N 3.3Å; E777-S779 PolarHBondContact O-N 2.87Å; E777-L780 PolarHBondContact O-N 3.4Å; E777-A781 WeakPolarHBondContact O-CB 3.39Å; E777-A781 PolarHBondContact O-N 3.28Å
778	Q	88.1	Confident	90.8	Very high	132 Å²	132	111.6 Å²	111.6	62%	0.617	55%	0.547	S	S	*	.	H	α-helix	trans	-60.6	-44.3	173.2	-177.7	176.7	-19.2	0	0	111.9	A774 L776 L780 A781 E782	A774-Q778 WeakPolarHBondContact O-CB 3.21Å; A774-Q778 PolarHBondContact O-N 3.31Å; L776-Q778 VanDerWaalsContact C-N 3.34Å; L776-Q778 PolarHBondContact O-N 2.96Å; Q778-L780 PolarHBondContact O-N 3.16Å; Q778-A781 PolarHBondContact O-N 3.28Å; Q778-E782 WeakPolarHBondContact O-CB 3.43Å; Q778-E782 PolarHBondContact O-N 2.69Å
779	S	89.2	Confident	90.5	Very high	73 Å²	73	111.2 Å²	111.2	51%	0.51	55%	0.55	S	S	.	*	H	α-helix	trans	-62	-42.8	178.4	-167.5	0	0	0	0	112.3	S775 L776 E777 E782 E783	S775-S779 PolarHBondContact O-N 3.45Å; S775-S779 VanDerWaalsContact O-N 3.12Å; L776-S779 WeakPolarHBondContact O-CB 3.43Å; L776-S779 PolarHBondContact O-N 2.97Å; E777-S779 PolarHBondContact O-N 2.87Å; S779-E782 PolarHBondContact O-N 3.45Å; S779-E783 PolarHBondContact O-N 3.4Å
780	L	91.1	Very high	90.4	Very high	96 Å²	96	109.2 Å²	109.2	50%	0.503	55%	0.547	S	S	.	.	H	α-helix	trans	-68.6	-37.6	176.9	-68.9	177.2	0	0	0	112.1	L776 E777 Q778 E782 E783 E784	L776-L780 HydrophobicContact CD2-CD1 3.63Å; L776-L780 HydrophobicContact CD2-CG 4.18Å; L776-L780 PolarHBondContact O-N 3.08Å; E777-L780 PolarHBondContact O-N 3.4Å; Q778-L780 PolarHBondContact O-N 3.16Å; L780-E782 VanDerWaalsContact C-N 3.31Å; L780-E782 PolarHBondContact O-N 2.88Å; L780-E783 PolarHBondContact O-N 3.17Å; L780-E784 PolarHBondContact O-N 3.5Å
781	A	89.8	Confident	90.2	Very high	48 Å²	48	108 Å²	108	40%	0.397	55%	0.547	S	S	.	.	H	α-helix	trans	-69.5	-28.4	176.7	0	0	0	0	0	112.9	E777 Q778 R785	E777-A781 WeakPolarHBondContact O-CB 3.39Å; E777-A781 PolarHBondContact O-N 3.28Å; Q778-A781 PolarHBondContact O-N 3.28Å; A781-R785 VanDerWaalsContact O-CG 3.32Å; A781-R785 WeakPolarHBondContact O-CG 3.45Å; A781-R785 PolarHBondContact O-N 3.28Å
782	E	87.1	Confident	90.1	Very high	112 Å²	112	106.6 Å²	106.6	52%	0.523	55%	0.548	S	S	.	.	H	α-helix	trans	-74	-42.8	171.9	-170.9	160.1	-172.5	0	0	111.4	Q778 S779 L780 E784 R785 L786	Q778-E782 WeakPolarHBondContact O-CB 3.43Å; Q778-E782 PolarHBondContact O-N 2.69Å; S779-E782 PolarHBondContact O-N 3.45Å; L780-E782 VanDerWaalsContact C-N 3.31Å; L780-E782 PolarHBondContact O-N 2.88Å; E782-E784 PolarHBondContact O-N 3.33Å; E782-R785 WeakPolarHBondContact O-CB 3.3Å; E782-R785 PolarHBondContact O-N 2.82Å; E782-L786 HydrophobicContact CG-CD1 4.47Å; E782-L786 WeakPolarHBondContact O-CG 3.27Å; E782-L786 PolarHBondContact O-N 3.33Å
783	E	86.8	Confident	89.8	Confident	124 Å²	124	105.9 Å²	105.9	58%	0.579	55%	0.547	S	S	*	.	H	α-helix	trans	-59.2	-45.2	172.2	-168	-171.5	153.6	0	0	112.1	S779 L780 R785 L786 K787	S779-E783 PolarHBondContact O-N 3.4Å; L780-E783 PolarHBondContact O-N 3.17Å; E783-R785 VanDerWaalsContact C-N 3.28Å; E783-R785 PolarHBondContact O-N 2.87Å; E783-L786 PolarHBondContact O-N 2.86Å; E783-K787 WeakPolarHBondContact O-CB 3.42Å; E783-K787 PolarHBondContact O-N 2.94Å
784	E	88.2	Confident	89.6	Confident	109 Å²	109	105.9 Å²	105.9	51%	0.509	55%	0.547	S	S	.	.	H	α-helix	trans	-63.3	-33.7	177.4	-158.9	-161	158.5	0	0	112.2	L780 E782 K788	L780-E784 PolarHBondContact O-N 3.5Å; E782-E784 PolarHBondContact O-N 3.33Å; E784-K788 WeakPolarHBondContact O-CG 3.5Å; E784-K788 PolarHBondContact O-N 3.06Å; E784-K788 VanDerWaalsContact O-N 3.1Å; E784-K788 WeakPolarHBondContact OE1-CE 3.35Å; E784-K788 IonicContact OE1-NZ 2.72Å; E784-K788 PolarHBondContact OE1-NZ 3.31Å
785	R	90.6	Very high	89.4	Confident	188 Å²	188	109.1 Å²	109.1	71%	0.709	56%	0.555	S	S	*	*	H	α-helix	trans	-70.1	-45.6	174.5	-81.2	175.4	168	-168.1	-3	112.3	A781 E782 E783 K787 K788 L789	A781-R785 VanDerWaalsContact O-CG 3.32Å; A781-R785 WeakPolarHBondContact O-CG 3.45Å; A781-R785 PolarHBondContact O-N 3.28Å; E782-R785 WeakPolarHBondContact O-CB 3.3Å; E782-R785 PolarHBondContact O-N 2.82Å; E783-R785 VanDerWaalsContact C-N 3.28Å; E783-R785 PolarHBondContact O-N 2.87Å; R785-K787 VanDerWaalsContact C-N 3.3Å; R785-K787 PolarHBondContact O-N 3.5Å; R785-K788 PolarHBondContact O-N 3.37Å; R785-L789 PolarHBondContact O-N 2.93Å
786	L	88.3	Confident	89.4	Confident	110 Å²	110	108.2 Å²	108.2	58%	0.576	55%	0.552	S	S	*	*	H	α-helix	trans	-61.4	-41.3	175.9	-70.4	170.8	0	0	0	111.1	E782 E783 K788 L789 A790	E782-L786 HydrophobicContact CG-CD1 4.47Å; E782-L786 WeakPolarHBondContact O-CG 3.27Å; E782-L786 PolarHBondContact O-N 3.33Å; E783-L786 PolarHBondContact O-N 2.86Å; L786-K788 PolarHBondContact O-N 3.48Å; L786-L789 PolarHBondContact O-N 3.04Å; L786-A790 WeakPolarHBondContact O-CB 3.48Å; L786-A790 PolarHBondContact O-N 3.21Å
787	K	92.3	Very high	89.3	Confident	147 Å²	147	106 Å²	106	64%	0.639	54%	0.54	S	S	*	.	H	α-helix	trans	-61.2	-41.8	175.1	-174.8	170	-177.6	172.9	0	112.9	E783 R785 A790 E791	E783-K787 WeakPolarHBondContact O-CB 3.42Å; E783-K787 PolarHBondContact O-N 2.94Å; R785-K787 VanDerWaalsContact C-N 3.3Å; R785-K787 PolarHBondContact O-N 3.5Å; K787-A790 PolarHBondContact O-N 3.24Å; K787-E791 WeakPolarHBondContact O-CB 3.27Å; K787-E791 PolarHBondContact O-N 3.47Å
788	K	91.1	Very high	89.3	Confident	116 Å²	116	102.1 Å²	102.1	50%	0.504	53%	0.532	S	S	.	.	H	α-helix	trans	-66.4	-40.4	176.2	-77.1	170.9	-177.1	168.8	0	112.7	E784 R785 L786 E791 E792	E784-K788 WeakPolarHBondContact O-CG 3.5Å; E784-K788 PolarHBondContact O-N 3.06Å; E784-K788 VanDerWaalsContact O-N 3.1Å; E784-K788 WeakPolarHBondContact OE1-CE 3.35Å; E784-K788 IonicContact OE1-NZ 2.72Å; E784-K788 PolarHBondContact OE1-NZ 3.31Å; R785-K788 PolarHBondContact O-N 3.37Å; L786-K788 PolarHBondContact O-N 3.48Å; K788-E791 PolarHBondContact O-N 3.27Å; K788-E792 WeakPolarHBondContact O-CB 3.35Å; K788-E792 PolarHBondContact O-N 3.03Å
789	L	89.4	Confident	89.4	Confident	104 Å²	104	98.4 Å²	98.4	55%	0.545	52%	0.524	S	S	.	.	H	α-helix	trans	-63.5	-42.3	174.3	-71.9	170.7	0	0	0	111.6	R785 L786 E791 E792 E793	R785-L789 PolarHBondContact O-N 2.93Å; L786-L789 PolarHBondContact O-N 3.04Å; L789-E791 VanDerWaalsContact C-N 3.35Å; L789-E791 PolarHBondContact O-N 3.23Å; L789-E792 PolarHBondContact O-N 2.98Å; L789-E793 WeakPolarHBondContact O-CB 3.25Å; L789-E793 PolarHBondContact O-N 2.96Å
790	A	90.4	Very high	89.3	Confident	55 Å²	55	100.1 Å²	100.1	46%	0.455	52%	0.524	S	S	.	.	H	α-helix	trans	-65.8	-34.2	176	0	0	0	0	0	113	L786 K787 A794	L786-A790 WeakPolarHBondContact O-CB 3.48Å; L786-A790 PolarHBondContact O-N 3.21Å; K787-A790 PolarHBondContact O-N 3.24Å; A790-A794 VanDerWaalsContact O-CB 3.25Å; A790-A794 WeakPolarHBondContact O-CB 3.24Å; A790-A794 PolarHBondContact O-N 3.47Å
791	E	89.7	Confident	89.5	Confident	117 Å²	117	101.3 Å²	101.3	55%	0.547	53%	0.525	S	S	.	.	H	α-helix	trans	-70.5	-40	174.3	-164.3	179.3	160.1	0	0	111.8	K787 K788 L789 A794 M795	K787-E791 WeakPolarHBondContact O-CB 3.27Å; K787-E791 PolarHBondContact O-N 3.47Å; K788-E791 PolarHBondContact O-N 3.27Å; L789-E791 VanDerWaalsContact C-N 3.35Å; L789-E791 PolarHBondContact O-N 3.23Å; E791-A794 PolarHBondContact O-N 3.1Å; E791-M795 HydrophobicContact CG-CE 4.34Å; E791-M795 WeakPolarHBondContact O-CG 3.43Å; E791-M795 PolarHBondContact O-N 2.59Å
792	E	87.3	Confident	89.5	Confident	131 Å²	131	102 Å²	102	61%	0.612	53%	0.53	S	S	*	.	H	α-helix	trans	-64.8	-44.1	174.1	-172.4	170.8	-174.9	0	0	111.9	K788 L789 M795 A796	K788-E792 WeakPolarHBondContact O-CB 3.35Å; K788-E792 PolarHBondContact O-N 3.03Å; L789-E792 PolarHBondContact O-N 2.98Å; E792-M795 PolarHBondContact O-N 3.34Å; E792-A796 PolarHBondContact O-N 3Å
793	E	87.2	Confident	89.7	Confident	126 Å²	126	101.8 Å²	101.8	59%	0.589	53%	0.532	S	S	*	.	H	α-helix	trans	-62.9	-44	174.5	-174.4	177.7	-178.8	0	0	111.8	L789 M795 A796 I797	L789-E793 WeakPolarHBondContact O-CB 3.25Å; L789-E793 PolarHBondContact O-N 2.96Å; E793-M795 VanDerWaalsContact C-N 3.31Å; E793-M795 PolarHBondContact O-N 3.41Å; E793-A796 PolarHBondContact O-N 3.33Å; E793-I797 HydrophobicContact CG-CD1 3.92Å; E793-I797 WeakPolarHBondContact O-CB 3.42Å; E793-I797 WeakPolarHBondContact O-CG1 3.25Å; E793-I797 PolarHBondContact O-N 2.91Å
794	A	88.4	Confident	89.9	Confident	58 Å²	58	98.7 Å²	98.7	48%	0.479	53%	0.528	S	S	.	.	H	α-helix	trans	-61.4	-38.5	175.5	0	0	0	0	0	112.4	A790 E791 A798	A790-A794 VanDerWaalsContact O-CB 3.25Å; A790-A794 WeakPolarHBondContact O-CB 3.24Å; A790-A794 PolarHBondContact O-N 3.47Å; E791-A794 PolarHBondContact O-N 3.1Å; A794-A798 WeakPolarHBondContact O-CB 3.49Å; A794-A798 PolarHBondContact O-N 2.94Å
795	M	89.5	Confident	90.1	Very high	118 Å²	118	97.6 Å²	97.6	58%	0.581	53%	0.529	S	S	*	.	H	α-helix	trans	-68.3	-39	173.5	-75.8	-170	-72.5	0	0	112.6	E791 E792 E793 A798 A799	E791-M795 HydrophobicContact CG-CE 4.34Å; E791-M795 WeakPolarHBondContact O-CG 3.43Å; E791-M795 PolarHBondContact O-N 2.59Å; E792-M795 PolarHBondContact O-N 3.34Å; E793-M795 VanDerWaalsContact C-N 3.31Å; E793-M795 PolarHBondContact O-N 3.41Å; M795-A798 PolarHBondContact O-N 2.77Å; M795-A799 WeakPolarHBondContact O-CB 3.44Å; M795-A799 PolarHBondContact O-N 2.8Å
796	A	90	Very high	90.1	Very high	58 Å²	58	95 Å²	95	48%	0.479	52%	0.524	S	S	.	.	H	α-helix	trans	-62.3	-48.1	175.2	0	0	0	0	0	111.6	E792 E793 A798 A799 E800	E792-A796 PolarHBondContact O-N 3Å; E793-A796 PolarHBondContact O-N 3.33Å; A796-A798 VanDerWaalsContact C-N 3.28Å; A796-A798 PolarHBondContact O-N 2.83Å; A796-A799 PolarHBondContact O-N 2.76Å; A796-A799 VanDerWaalsContact O-N 3.17Å; A796-E800 PolarHBondContact O-N 3.5Å
797	I	90.4	Very high	90.1	Very high	63 Å²	63	95.4 Å²	95.4	32%	0.323	52%	0.523	S	S	.	.	H	α-helix	trans	-61.8	-35.8	176.4	-69.2	168.8	0	0	0	111.4	E793 K801	E793-I797 HydrophobicContact CG-CD1 3.92Å; E793-I797 WeakPolarHBondContact O-CB 3.42Å; E793-I797 WeakPolarHBondContact O-CG1 3.25Å; E793-I797 PolarHBondContact O-N 2.91Å; I797-K801 HydrophobicContact CG2-CD 4.02Å; I797-K801 VanDerWaalsContact CG2-CE 3.49Å; I797-K801 WeakPolarHBondContact O-CB 3.48Å; I797-K801 WeakPolarHBondContact O-CD 3.34Å; I797-K801 VanDerWaalsContact O-CG 3.25Å; I797-K801 WeakPolarHBondContact O-CG 3.31Å; I797-K801 PolarHBondContact O-N 3.35Å; I797-K801 VanDerWaalsContact O-N 3.13Å
798	A	89.6	Confident	90.1	Very high	59 Å²	59	95.8 Å²	95.8	49%	0.488	53%	0.525	S	S	.	.	H	α-helix	trans	-68.5	-40.8	174.9	0	0	0	0	0	112.3	A794 M795 A796 K801 A802	A794-A798 WeakPolarHBondContact O-CB 3.49Å; A794-A798 PolarHBondContact O-N 2.94Å; M795-A798 PolarHBondContact O-N 2.77Å; A796-A798 VanDerWaalsContact C-N 3.28Å; A796-A798 PolarHBondContact O-N 2.83Å; A798-K801 PolarHBondContact O-N 2.79Å; A798-A802 PolarHBondContact O-N 2.69Å; A798-A802 VanDerWaalsContact O-N 3.09Å
799	A	91.3	Very high	90.1	Very high	54 Å²	54	94.4 Å²	94.4	45%	0.446	52%	0.523	S	S	.	.	H	α-helix	trans	-66.5	-42.2	176.5	0	0	0	0	0	112.2	M795 A796 A802 L803	M795-A799 WeakPolarHBondContact O-CB 3.44Å; M795-A799 PolarHBondContact O-N 2.8Å; A796-A799 PolarHBondContact O-N 2.76Å; A796-A799 VanDerWaalsContact O-N 3.17Å; A799-A802 WeakPolarHBondContact O-CB 3.45Å; A799-A802 PolarHBondContact O-N 3.23Å; A799-L803 WeakPolarHBondContact O-CG 3.48Å; A799-L803 PolarHBondContact O-N 3.43Å
800	E	87.7	Confident	90	Very high	110 Å²	110	97.1 Å²	97.1	51%	0.514	53%	0.526	S	S	.	.	H	α-helix	trans	-60.5	-46.4	174.9	-174.6	-179.2	-168.7	0	0	111.6	A796 A802 L803 A804	A796-E800 PolarHBondContact O-N 3.5Å; E800-A802 VanDerWaalsContact C-N 3.27Å; E800-A802 PolarHBondContact O-N 2.91Å; E800-L803 PolarHBondContact O-N 2.87Å; E800-L803 VanDerWaalsContact O-N 3.15Å; E800-A804 WeakPolarHBondContact O-CB 3.36Å; E800-A804 PolarHBondContact O-N 2.99Å
801	K	93.9	Very high	90	Very high	120 Å²	120	97.6 Å²	97.6	52%	0.522	52%	0.524	S	S	.	.	H	α-helix	trans	-60.5	-35.9	176	-74.2	166.9	-176.9	167.9	0	112.4	I797 A798 V805	I797-K801 HydrophobicContact CG2-CD 4.02Å; I797-K801 VanDerWaalsContact CG2-CE 3.49Å; I797-K801 WeakPolarHBondContact O-CB 3.48Å; I797-K801 WeakPolarHBondContact O-CD 3.34Å; I797-K801 VanDerWaalsContact O-CG 3.25Å; I797-K801 WeakPolarHBondContact O-CG 3.31Å; I797-K801 PolarHBondContact O-N 3.35Å; I797-K801 VanDerWaalsContact O-N 3.13Å; A798-K801 PolarHBondContact O-N 2.79Å; K801-V805 WeakPolarHBondContact O-CG2 3.5Å; K801-V805 PolarHBondContact O-N 3.05Å
802	A	90	Very high	90.1	Very high	62 Å²	62	95.7 Å²	95.7	51%	0.512	52%	0.517	S	S	.	.	H	α-helix	trans	-66.8	-42.7	174.4	0	0	0	0	0	112.3	A798 A799 E800 V805 Q806	A798-A802 PolarHBondContact O-N 2.69Å; A798-A802 VanDerWaalsContact O-N 3.09Å; A799-A802 WeakPolarHBondContact O-CB 3.45Å; A799-A802 PolarHBondContact O-N 3.23Å; E800-A802 VanDerWaalsContact C-N 3.27Å; E800-A802 PolarHBondContact O-N 2.91Å; A802-V805 PolarHBondContact O-N 3.23Å; A802-Q806 PolarHBondContact O-N 3.34Å; A802-Q806 VanDerWaalsContact O-N 3.07Å
803	L	92.2	Very high	90.2	Very high	109 Å²	109	94.1 Å²	94.1	57%	0.571	51%	0.511	S	S	*	.	H	α-helix	trans	-64.9	-42.3	175.4	-70	172.8	0	0	0	112.1	A799 E800 V805 Q806 E807	A799-L803 WeakPolarHBondContact O-CG 3.48Å; A799-L803 PolarHBondContact O-N 3.43Å; E800-L803 PolarHBondContact O-N 2.87Å; E800-L803 VanDerWaalsContact O-N 3.15Å; L803-V805 VanDerWaalsContact C-N 3.3Å; L803-V805 PolarHBondContact O-N 2.79Å; L803-Q806 WeakPolarHBondContact O-CA 3.49Å; L803-Q806 WeakPolarHBondContact O-CB 3.32Å; L803-Q806 PolarHBondContact O-N 3.33Å; L803-E807 PolarHBondContact O-N 3.42Å
804	A	91.2	Very high	90.5	Very high	59 Å²	59	91.7 Å²	91.7	49%	0.488	50%	0.5	S	S	.	.	H	α-helix	trans	-61.1	-37	176.7	0	0	0	0	0	112.5	E800 K808	E800-A804 WeakPolarHBondContact O-CB 3.36Å; E800-A804 PolarHBondContact O-N 2.99Å; A804-K808 WeakPolarHBondContact O-CB 3.2Å; A804-K808 PolarHBondContact O-N 3.48Å
805	V	92.2	Very high	90.8	Very high	86 Å²	86	95 Å²	95	52%	0.521	51%	0.505	S	S	.	.	H	α-helix	trans	-67.4	-40.4	172.2	170.2	0	0	0	0	111.4	K801 A802 L803 K808 N809	K801-V805 WeakPolarHBondContact O-CG2 3.5Å; K801-V805 PolarHBondContact O-N 3.05Å; A802-V805 PolarHBondContact O-N 3.23Å; L803-V805 VanDerWaalsContact C-N 3.3Å; L803-V805 PolarHBondContact O-N 2.79Å; V805-K808 PolarHBondContact O-N 2.97Å; V805-N809 PolarHBondContact O-N 3.37Å; V805-N809 PolarHBondContact O-ND2 2.95Å
806	Q	90.3	Very high	90.8	Very high	132 Å²	132	96.8 Å²	96.8	62%	0.617	51%	0.506	S	S	*	.	H	α-helix	trans	-63.3	-43	175.6	-168.6	-179.1	17.7	0	0	111.8	A802 L803 N809 R810	A802-Q806 PolarHBondContact O-N 3.34Å; A802-Q806 VanDerWaalsContact O-N 3.07Å; L803-Q806 WeakPolarHBondContact O-CA 3.49Å; L803-Q806 WeakPolarHBondContact O-CB 3.32Å; L803-Q806 PolarHBondContact O-N 3.33Å; Q806-N809 PolarHBondContact O-N 3.04Å; Q806-R810 PolarHBondContact O-N 3.32Å
807	E	89	Confident	91	Very high	119 Å²	119	101 Å²	101	56%	0.556	51%	0.514	S	S	*	.	H	α-helix	trans	-69.4	-36.9	177.9	-175.8	157.7	-132.2	0	0	112.5	L803 N809 R810 T811	L803-E807 PolarHBondContact O-N 3.42Å; E807-N809 VanDerWaalsContact C-N 3.29Å; E807-N809 PolarHBondContact O-N 2.93Å; E807-R810 PolarHBondContact O-N 2.92Å; E807-T811 HydrophobicContact CG-CG2 4.4Å; E807-T811 WeakPolarHBondContact O-CB 3.33Å; E807-T811 WeakPolarHBondContact O-CG2 3.5Å; E807-T811 PolarHBondContact O-N 3.49Å; E807-T811 PolarHBondContact O-OG1 3.39Å
808	K	91.5	Very high	91	Very high	155 Å²	155	105.3 Å²	105.3	67%	0.674	53%	0.526	S	S	*	.	H	α-helix	trans	-60.8	-37.9	171	-173.9	172.1	-179	175.4	0	112.2	A804 V805 T811 L812	A804-K808 WeakPolarHBondContact O-CB 3.2Å; A804-K808 PolarHBondContact O-N 3.48Å; V805-K808 PolarHBondContact O-N 2.97Å; K808-T811 WeakPolarHBondContact CA-OG1 3.17Å; K808-T811 PolarHBondContact O-OG1 3.5Å; K808-T811 VanDerWaalsContact O-OG1 3.11Å; K808-L812 WeakPolarHBondContact O-CB 2.95Å; K808-L812 PolarHBondContact O-N 3.31Å; K808-L812 VanDerWaalsContact O-N 3.11Å
809	N	90.3	Very high	90.9	Very high	87 Å²	87	107.1 Å²	107.1	47%	0.465	52%	0.524	S	S	.	.	H	α-helix	trans	-70.8	-42.6	174.9	-71.6	-26.1	0	0	0	111.9	V805 Q806 E807 L812 I813	V805-N809 PolarHBondContact O-N 3.37Å; V805-N809 PolarHBondContact O-ND2 2.95Å; Q806-N809 PolarHBondContact O-N 3.04Å; E807-N809 VanDerWaalsContact C-N 3.29Å; E807-N809 PolarHBondContact O-N 2.93Å; N809-L812 PolarHBondContact O-N 3.44Å; N809-I813 VanDerWaalsContact O-CG1 3.32Å; N809-I813 WeakPolarHBondContact O-CG1 3.48Å; N809-I813 PolarHBondContact O-N 2.86Å
810	R	89.1	Confident	90.9	Very high	161 Å²	161	107.8 Å²	107.8	61%	0.608	52%	0.519	S	S	*	.	H	α-helix	trans	-58.4	-49	174.6	179.3	-176.9	170.8	-172.1	-2	111.9	Q806 E807 L812 I813 E814	Q806-R810 PolarHBondContact O-N 3.32Å; E807-R810 PolarHBondContact O-N 2.92Å; R810-L812 PolarHBondContact O-N 2.86Å; R810-I813 PolarHBondContact O-N 3.24Å; R810-E814 PolarHBondContact O-N 3.26Å
811	T	89.9	Confident	90.9	Very high	66 Å²	66	106 Å²	106	41%	0.405	52%	0.519	S	S	.	.	H	α-helix	trans	-65.6	-37	-179.7	47.4	0	0	0	0	112.1	E807 K808 E814 Q815	E807-T811 HydrophobicContact CG-CG2 4.4Å; E807-T811 WeakPolarHBondContact O-CB 3.33Å; E807-T811 WeakPolarHBondContact O-CG2 3.5Å; E807-T811 PolarHBondContact O-N 3.49Å; E807-T811 PolarHBondContact O-OG1 3.39Å; K808-T811 WeakPolarHBondContact CA-OG1 3.17Å; K808-T811 PolarHBondContact O-OG1 3.5Å; K808-T811 VanDerWaalsContact O-OG1 3.11Å; T811-E814 PolarHBondContact O-N 2.9Å; T811-Q815 WeakPolarHBondContact O-CB 3.4Å; T811-Q815 WeakPolarHBondContact O-CG 3.36Å; T811-Q815 PolarHBondContact O-N 3.37Å
812	L	91.7	Very high	90.7	Very high	77 Å²	77	106.4 Å²	106.4	40%	0.403	52%	0.517	S	S	.	.	H	α-helix	trans	-61.9	-43.7	172.5	-174.9	71.6	0	0	0	112.7	K808 N809 R810 E814 Q815 R816	K808-L812 WeakPolarHBondContact O-CB 2.95Å; K808-L812 PolarHBondContact O-N 3.31Å; K808-L812 VanDerWaalsContact O-N 3.11Å; N809-L812 PolarHBondContact O-N 3.44Å; R810-L812 PolarHBondContact O-N 2.86Å; L812-E814 VanDerWaalsContact C-N 3.35Å; L812-Q815 PolarHBondContact O-N 2.91Å; L812-R816 WeakPolarHBondContact O-CG 3.37Å; L812-R816 PolarHBondContact O-N 2.93Å
813	I	90.1	Very high	90.6	Very high	97 Å²	97	108.1 Å²	108.1	50%	0.497	52%	0.517	S	S	.	.	H	α-helix	trans	-63.3	-43	176	-67.6	164	0	0	0	110.2	N809 R810 R816 K817	N809-I813 VanDerWaalsContact O-CG1 3.32Å; N809-I813 WeakPolarHBondContact O-CG1 3.48Å; N809-I813 PolarHBondContact O-N 2.86Å; R810-I813 PolarHBondContact O-N 3.24Å; I813-R816 PolarHBondContact O-N 3.44Å; I813-K817 WeakPolarHBondContact O-CB 3.26Å; I813-K817 PolarHBondContact O-N 3.29Å
814	E	92.4	Very high	90.6	Very high	75 Å²	75	109.3 Å²	109.3	35%	0.35	52%	0.518	S	S	.	.	H	α-helix	trans	-68.1	-33.7	179.2	-146.2	-173.6	106.7	0	0	112.8	R810 T811 L812 R818	R810-E814 PolarHBondContact O-N 3.26Å; T811-E814 PolarHBondContact O-N 2.9Å; L812-E814 VanDerWaalsContact C-N 3.35Å; E814-R818 WeakPolarHBondContact O-CG 3.33Å; E814-R818 PolarHBondContact O-N 2.93Å; E814-R818 VanDerWaalsContact O-N 3.07Å; E814-R818 IonicContact OE1-CZ 3.86Å; E814-R818 IonicContact OE1-NH1 2.87Å; E814-R818 PolarHBondContact OE1-NH1 3.25Å; E814-R818 IonicContact OE1-NH2 3.76Å; E814-R818 PolarHBondContact OE1-NH2 3.34Å
815	Q	94.3	Very high	90.5	Very high	127 Å²	127	108.7 Å²	108.7	59%	0.593	51%	0.512	S	S	*	.	H	α-helix	trans	-65.7	-49.2	171.2	-77.5	-179.9	-4.1	0	0	111.7	T811 L812 K817 R818 E819	T811-Q815 WeakPolarHBondContact O-CB 3.4Å; T811-Q815 WeakPolarHBondContact O-CG 3.36Å; T811-Q815 PolarHBondContact O-N 3.37Å; L812-Q815 PolarHBondContact O-N 2.91Å; Q815-K817 VanDerWaalsContact C-N 3.26Å; Q815-K817 PolarHBondContact O-N 3.42Å; Q815-R818 WeakPolarHBondContact O-CB 3.34Å; Q815-R818 PolarHBondContact O-N 2.95Å; Q815-R818 VanDerWaalsContact O-N 3.09Å; Q815-E819 PolarHBondContact O-N 3.13Å
816	R	90.7	Very high	90.2	Very high	156 Å²	156	108.3 Å²	108.3	59%	0.589	51%	0.507	S	S	*	.	H	α-helix	trans	-56.7	-40.9	174.9	-74.2	178.2	175.2	179.3	-1.3	111.9	L812 I813 E819 I820	L812-R816 WeakPolarHBondContact O-CG 3.37Å; L812-R816 PolarHBondContact O-N 2.93Å; I813-R816 PolarHBondContact O-N 3.44Å; R816-E819 PolarHBondContact O-N 3.2Å; R816-I820 WeakPolarHBondContact O-CG1 3.42Å; R816-I820 PolarHBondContact O-N 3.48Å
817	K	93.9	Very high	90	Very high	148 Å²	148	104.9 Å²	104.9	64%	0.643	50%	0.498	S	S	*	.	H	α-helix	trans	-63.5	-39.7	176.1	-170	174.1	-176.9	174.9	0	112.6	I813 Q815 S821	I813-K817 WeakPolarHBondContact O-CB 3.26Å; I813-K817 PolarHBondContact O-N 3.29Å; Q815-K817 VanDerWaalsContact C-N 3.26Å; Q815-K817 PolarHBondContact O-N 3.42Å; K817-S821 WeakPolarHBondContact O-CB 3.48Å; K817-S821 PolarHBondContact O-N 2.92Å; K817-S821 VanDerWaalsContact O-N 3.13Å; K817-S821 PolarHBondContact O-OG 3.39Å
818	R	89.8	Confident	89.8	Confident	152 Å²	152	103.8 Å²	103.8	57%	0.574	49%	0.493	S	S	*	.	H	α-helix	trans	-63.9	-43.2	172.4	-75.2	-178.9	178.9	86.5	2.1	111.9	E814 Q815 S821 R822	E814-R818 WeakPolarHBondContact O-CG 3.33Å; E814-R818 PolarHBondContact O-N 2.93Å; E814-R818 VanDerWaalsContact O-N 3.07Å; E814-R818 IonicContact OE1-CZ 3.86Å; E814-R818 IonicContact OE1-NH1 2.87Å; E814-R818 PolarHBondContact OE1-NH1 3.25Å; E814-R818 IonicContact OE1-NH2 3.76Å; E814-R818 PolarHBondContact OE1-NH2 3.34Å; Q815-R818 WeakPolarHBondContact O-CB 3.34Å; Q815-R818 PolarHBondContact O-N 2.95Å; Q815-R818 VanDerWaalsContact O-N 3.09Å; R818-S821 WeakPolarHBondContact O-CB 3.35Å; R818-S821 PolarHBondContact O-N 3.49Å; R818-R822 PolarHBondContact O-N 3.42Å
819	E	88.5	Confident	89.3	Confident	98 Å²	98	101.9 Å²	101.9	46%	0.458	49%	0.49	S	S	.	.	H	α-helix	trans	-65.5	-46.3	-179.9	179.3	148.5	-119	0	0	112.7	Q815 R816 S821 R822 L823	Q815-E819 PolarHBondContact O-N 3.13Å; R816-E819 PolarHBondContact O-N 3.2Å; E819-S821 PolarHBondContact O-N 2.89Å; E819-R822 PolarHBondContact O-N 3.02Å; E819-R822 VanDerWaalsContact O-N 3.11Å; E819-R822 IonicContact OE1-CZ 3.16Å; E819-R822 IonicContact OE1-NH1 2.71Å; E819-R822 IonicContact OE1-NH2 2.76Å; E819-R822 PolarHBondContact OE1-NH2 2.96Å; E819-L823 HydrophobicContact CG-CD1 4.05Å; E819-L823 HydrophobicContact CG-CG 4.4Å; E819-L823 WeakPolarHBondContact O-CG 3.34Å; E819-L823 PolarHBondContact O-N 2.88Å
820	I	89.5	Confident	88.6	Confident	67 Å²	67	100.7 Å²	100.7	34%	0.344	49%	0.492	S	S	.	.	H	α-helix	trans	-57.8	-39.1	173.4	-66.7	165.7	0	0	0	110.7	R816 K824 M880	R816-I820 WeakPolarHBondContact O-CG1 3.42Å; R816-I820 PolarHBondContact O-N 3.48Å; I820-K824 WeakPolarHBondContact O-CB 3.44Å; I820-K824 PolarHBondContact O-N 3.08Å; I820-M880 HydrophobicContact CD1-CE 4.12Å; I820-M880 HydrophobicContact CG1-CE 4.11Å; I820-M880 HydrophobicContact CG2-CE 3.98Å
821	S	89.1	Confident	87.7	Confident	72 Å²	72	98.6 Å²	98.6	50%	0.503	49%	0.489	S	S	.	.	H	α-helix	trans	-66.8	-38.7	176.9	-55.1	0	0	0	0	112.6	K817 R818 E819 A825	K817-S821 WeakPolarHBondContact O-CB 3.48Å; K817-S821 PolarHBondContact O-N 2.92Å; K817-S821 VanDerWaalsContact O-N 3.13Å; K817-S821 PolarHBondContact O-OG 3.39Å; R818-S821 WeakPolarHBondContact O-CB 3.35Å; R818-S821 PolarHBondContact O-N 3.49Å; E819-S821 PolarHBondContact O-N 2.89Å; S821-A825 PolarHBondContact O-N 2.98Å; S821-A825 VanDerWaalsContact O-N 3.13Å
822	R	89.4	Confident	86.6	Confident	130 Å²	130	102.1 Å²	102.1	49%	0.491	51%	0.505	S	S	.	.	H	α-helix	trans	-64.6	-51.2	174.1	-169.1	-167.2	67.9	-137.2	-14.2	110.9	R818 E819 K824 A825 D826	R818-R822 PolarHBondContact O-N 3.42Å; E819-R822 PolarHBondContact O-N 3.02Å; E819-R822 VanDerWaalsContact O-N 3.11Å; E819-R822 IonicContact OE1-CZ 3.16Å; E819-R822 IonicContact OE1-NH1 2.71Å; E819-R822 IonicContact OE1-NH2 2.76Å; E819-R822 PolarHBondContact OE1-NH2 2.96Å; R822-K824 PolarHBondContact O-N 2.68Å; R822-A825 PolarHBondContact O-N 3.27Å; R822-D826 IonicContact NE-OD2 2.76Å; R822-D826 VanDerWaalsContact O-CG 3.26Å; R822-D826 PolarHBondContact O-N 2.89Å
823	L	87.9	Confident	85.1	Confident	98 Å²	98	106.8 Å²	106.8	51%	0.513	52%	0.522	S	S	.	.	H	α-helix	trans	-59.1	-34.1	179.4	-68.2	172.1	0	0	0	112.4	E819 S827	E819-L823 HydrophobicContact CG-CD1 4.05Å; E819-L823 HydrophobicContact CG-CG 4.4Å; E819-L823 WeakPolarHBondContact O-CG 3.34Å; E819-L823 PolarHBondContact O-N 2.88Å; L823-S827 WeakPolarHBondContact O-CB 3.37Å; L823-S827 PolarHBondContact O-N 3.36Å
824	K	92.6	Very high	83.8	Confident	134 Å²	134	108.8 Å²	108.8	58%	0.583	53%	0.533	S	S	*	.	H	α-helix	trans	-65.2	-48.2	171.1	178.9	165.6	176.4	167.5	0	112.2	I820 R822 D826 S827 E828	I820-K824 WeakPolarHBondContact O-CB 3.44Å; I820-K824 PolarHBondContact O-N 3.08Å; R822-K824 PolarHBondContact O-N 2.68Å; K824-D826 VanDerWaalsContact C-N 3.34Å; K824-D826 PolarHBondContact O-N 2.98Å; K824-S827 WeakPolarHBondContact O-CB 3.36Å; K824-S827 PolarHBondContact O-N 2.82Å; K824-E828 WeakPolarHBondContact CE-OE1 3.49Å; K824-E828 IonicContact NZ-OE1 3.36Å; K824-E828 WeakPolarHBondContact O-CG 3.27Å; K824-E828 PolarHBondContact O-N 3.14Å
825	A	88.3	Confident	82.3	Confident	45 Å²	45	109.3 Å²	109.3	37%	0.372	54%	0.543	S	S	.	.	H	α-helix	trans	-62.9	-39.3	177.2	0	0	0	0	0	112.5	S821 R822 S827 E828 L829	S821-A825 PolarHBondContact O-N 2.98Å; S821-A825 VanDerWaalsContact O-N 3.13Å; R822-A825 PolarHBondContact O-N 3.27Å; A825-S827 VanDerWaalsContact C-N 3.32Å; A825-S827 PolarHBondContact O-N 3.49Å; A825-E828 PolarHBondContact O-N 2.8Å; A825-L829 WeakPolarHBondContact O-CB 3.4Å; A825-L829 WeakPolarHBondContact O-CG 3.28Å; A825-L829 PolarHBondContact O-N 2.7Å
826	D	86.2	Confident	80.6	Confident	78 Å²	78	109.9 Å²	109.9	42%	0.417	55%	0.545	S	S	.	.	H	α-helix	trans	-62.2	-39.3	174.7	-64.9	-32.5	0	0	0	111.3	R822 K824 A830	R822-D826 IonicContact NE-OD2 2.76Å; R822-D826 VanDerWaalsContact O-CG 3.26Å; R822-D826 PolarHBondContact O-N 2.89Å; K824-D826 VanDerWaalsContact C-N 3.34Å; K824-D826 PolarHBondContact O-N 2.98Å; D826-A830 WeakPolarHBondContact O-CB 3.41Å; D826-A830 PolarHBondContact O-N 3.48Å
827	S	85.7	Confident	79	Confident	60 Å²	60	107.2 Å²	107.2	42%	0.42	55%	0.55	S	S	.	*	H	α-helix	trans	-68.2	-39.3	174.6	-176.7	0	0	0	0	112.9	L823 K824 A825 A830 Q831	L823-S827 WeakPolarHBondContact O-CB 3.37Å; L823-S827 PolarHBondContact O-N 3.36Å; K824-S827 WeakPolarHBondContact O-CB 3.36Å; K824-S827 PolarHBondContact O-N 2.82Å; A825-S827 VanDerWaalsContact C-N 3.32Å; A825-S827 PolarHBondContact O-N 3.49Å; S827-A830 PolarHBondContact O-N 3.03Å; S827-Q831 WeakPolarHBondContact O-CG 3.36Å; S827-Q831 PolarHBondContact O-N 3.06Å; S827-Q831 PolarHBondContact O-NE2 2.76Å
828	E	84.9	Confident	77.2	Confident	97 Å²	97	102.3 Å²	102.3	45%	0.453	54%	0.537	S	S	.	.	H	α-helix	trans	-67.1	-40.2	175	-72.5	174.1	-173.6	0	0	111.4	K824 A825 A830 Q831 L832	K824-E828 WeakPolarHBondContact CE-OE1 3.49Å; K824-E828 IonicContact NZ-OE1 3.36Å; K824-E828 WeakPolarHBondContact O-CG 3.27Å; K824-E828 PolarHBondContact O-N 3.14Å; A825-E828 PolarHBondContact O-N 2.8Å; E828-A830 VanDerWaalsContact C-N 3.34Å; E828-A830 PolarHBondContact O-N 3.14Å; E828-Q831 PolarHBondContact O-N 3.48Å; E828-L832 PolarHBondContact O-N 2.8Å; E828-L832 VanDerWaalsContact O-N 3.12Å
829	L	81	Confident	75.5	Confident	115 Å²	115	102.1 Å²	102.1	60%	0.602	54%	0.537	S	S	*	.	H	α-helix	trans	-64.5	-35.8	171.2	-73.7	171.9	0	0	0	112.7	A825 Q831 L832 K833	A825-L829 WeakPolarHBondContact O-CB 3.4Å; A825-L829 WeakPolarHBondContact O-CG 3.28Å; A825-L829 PolarHBondContact O-N 2.7Å; L829-Q831 VanDerWaalsContact C-N 3.35Å; L829-L832 PolarHBondContact O-N 3.43Å; L829-K833 PolarHBondContact O-N 3.34Å
830	A	76.7	Confident	73.8	Confident	62 Å²	62	107.9 Å²	107.9	51%	0.512	55%	0.554	S	S	.	*	H	α-helix	trans	-66.8	-34.7	173.9	0	0	0	0	0	112.4	D826 S827 E828 K833	D826-A830 WeakPolarHBondContact O-CB 3.41Å; D826-A830 PolarHBondContact O-N 3.48Å; S827-A830 PolarHBondContact O-N 3.03Å; E828-A830 VanDerWaalsContact C-N 3.34Å; E828-A830 PolarHBondContact O-N 3.14Å; A830-K833 VanDerWaalsContact O-CB 3.23Å; A830-K833 WeakPolarHBondContact O-CB 3.34Å; A830-K833 PolarHBondContact O-N 2.9Å
831	Q	69.9	Low	72.1	Confident	116 Å²	116	109 Å²	109	54%	0.542	57%	0.573	S	S	.	*	H	α-helix	trans	-71.7	-28.5	175.1	-72.2	174.1	66.3	0	0	113.3	S827 E828 L829 K833	S827-Q831 WeakPolarHBondContact O-CG 3.36Å; S827-Q831 PolarHBondContact O-N 3.06Å; S827-Q831 PolarHBondContact O-NE2 2.76Å; E828-Q831 PolarHBondContact O-N 3.48Å; L829-Q831 VanDerWaalsContact C-N 3.35Å; Q831-K833 VanDerWaalsContact C-N 3.26Å
832	L	67.1	Low	70.4	Confident	141 Å²	141	107.5 Å²	107.5	74%	0.738	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	-8.5	170.9	-68.6	173.8	0	0	0	113.4	E828 L829 L834	E828-L832 PolarHBondContact O-N 2.8Å; E828-L832 VanDerWaalsContact O-N 3.12Å; L829-L832 PolarHBondContact O-N 3.43Å; L832-L834 PolarHBondContact O-N 2.88Å
833	K	59.8	Low	68.6	Low	175 Å²	175	105 Å²	105	76%	0.761	57%	0.573	S	S	*	*	S	Bend	trans	-75.7	110.7	178.9	-157	165.9	-173.3	171.4	0	109.3	L829 A830 Q831	L829-K833 PolarHBondContact O-N 3.34Å; A830-K833 VanDerWaalsContact O-CB 3.23Å; A830-K833 WeakPolarHBondContact O-CB 3.34Å; A830-K833 PolarHBondContact O-N 2.9Å; Q831-K833 VanDerWaalsContact C-N 3.26Å
834	L	62.5	Low	66.8	Low	139 Å²	139	104.6 Å²	104.6	73%	0.728	58%	0.583	S	S	*	*			trans	-47.7	142.5	-177.7	-72.1	166.2	0	0	0	112	L832 A838	L832-L834 PolarHBondContact O-N 2.88Å; L834-A838 HydrophobicContact CB-CB 3.99Å
835	P	61.3	Low	64.8	Low	86 Å²	86	104.2 Å²	104.2	56%	0.558	59%	0.593	S	S	*	*			trans	-50.1	148.5	178	-28.3	35	0	0	0	112.4	S837 A838	P835-S837 PolarHBondContact O-N 3.1Å; P835-S837 VanDerWaalsContact O-N 3.08Å; P835-A838 WeakPolarHBondContact O-CB 3.44Å; P835-A838 PolarHBondContact O-N 2.81Å
836	E	58	Low	62.9	Low	138 Å²	138	106.6 Å²	106.6	65%	0.645	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-63.2	-24.1	-174.8	-160.9	163.8	-154	0	0	113.2	A838 R839	E836-A838 PolarHBondContact O-N 3.24Å; E836-R839 VanDerWaalsContact CG-CD 3.44Å; E836-R839 HydrophobicContact CG-CG 4.23Å; E836-R839 VanDerWaalsContact O-CB 3.27Å; E836-R839 WeakPolarHBondContact O-CB 3.39Å; E836-R839 VanDerWaalsContact O-CG 3.31Å; E836-R839 WeakPolarHBondContact O-CG 3.27Å; E836-R839 PolarHBondContact O-N 2.8Å; E836-R839 IonicContact OE1-CZ 3.45Å; E836-R839 IonicContact OE1-NH1 3.41Å; E836-R839 PolarHBondContact OE1-NH1 3.11Å
837	S	57.7	Low	60.9	Low	100 Å²	100	110.4 Å²	110.4	70%	0.699	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-64.1	-10.8	169.2	52.6	0	0	0	0	115.1	P835 R839 W840	P835-S837 PolarHBondContact O-N 3.1Å; P835-S837 VanDerWaalsContact O-N 3.08Å; S837-R839 VanDerWaalsContact C-N 3.31Å; S837-W840 PolarHBondContact O-NE1 3.38Å
838	A	55.5	Low	59.2	Low	45 Å²	45	114.3 Å²	114.3	37%	0.372	64%	0.642	S	S	.	*	G	3₁₀ helix	trans	-81.8	-6.1	170.7	0	0	0	0	0	113.2	L834 P835 E836 W840	L834-A838 HydrophobicContact CB-CB 3.99Å; P835-A838 WeakPolarHBondContact O-CB 3.44Å; P835-A838 PolarHBondContact O-N 2.81Å; E836-A838 PolarHBondContact O-N 3.24Å; A838-W840 PolarHBondContact O-N 3.36Å
839	R	54.7	Low	57.3	Low	148 Å²	148	117 Å²	117	56%	0.558	66%	0.659	S	S	*	*			trans	-73.9	40.5	-179.5	-66	179.3	66.7	-170.2	-3.8	114.3	E836 S837 A841 A842	E836-R839 VanDerWaalsContact CG-CD 3.44Å; E836-R839 HydrophobicContact CG-CG 4.23Å; E836-R839 VanDerWaalsContact O-CB 3.27Å; E836-R839 WeakPolarHBondContact O-CB 3.39Å; E836-R839 VanDerWaalsContact O-CG 3.31Å; E836-R839 WeakPolarHBondContact O-CG 3.27Å; E836-R839 PolarHBondContact O-N 2.8Å; E836-R839 IonicContact OE1-CZ 3.45Å; E836-R839 IonicContact OE1-NH1 3.41Å; E836-R839 PolarHBondContact OE1-NH1 3.11Å; S837-R839 VanDerWaalsContact C-N 3.31Å; R839-A841 PolarHBondContact O-N 3.31Å; R839-A841 VanDerWaalsContact O-N 3.13Å; R839-A842 HydrophobicContact CB-CB 4.02Å; R839-A842 WeakPolarHBondContact O-CB 3.46Å; R839-A842 PolarHBondContact O-N 3.37Å
840	W	51.7	Low	55.5	Low	219 Å²	219	119.7 Å²	119.7	83%	0.83	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-52.3	-35.3	173	-65.8	93.1	0	0	0	112.4	S837 A838 A842 A843	S837-W840 PolarHBondContact O-NE1 3.38Å; A838-W840 PolarHBondContact O-N 3.36Å; W840-A842 VanDerWaalsContact C-N 3.26Å; W840-A842 PolarHBondContact O-N 2.98Å; W840-A843 PolarHBondContact O-N 2.97Å
841	A	53.5	Low	53.9	Low	90 Å²	90	122.7 Å²	122.7	74%	0.744	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-68.4	-15	176.2	0	0	0	0	0	115	R839	R839-A841 PolarHBondContact O-N 3.31Å; R839-A841 VanDerWaalsContact O-N 3.13Å
842	A	53.9	Low	53.1	Low	42 Å²	42	125.2 Å²	125.2	35%	0.347	70%	0.702	S	S	.	*	G	3₁₀ helix	trans	-87.5	-22.5	179.8	0	0	0	0	0	113.3	R839 W840 A844	R839-A842 HydrophobicContact CB-CB 4.02Å; R839-A842 WeakPolarHBondContact O-CB 3.46Å; R839-A842 PolarHBondContact O-N 3.37Å; W840-A842 VanDerWaalsContact C-N 3.26Å; W840-A842 PolarHBondContact O-N 2.98Å; A842-A844 VanDerWaalsContact C-N 3.3Å; A842-A844 PolarHBondContact O-N 2.88Å
843	A	51.4	Low	51.9	Low	76 Å²	76	128.6 Å²	128.6	63%	0.628	71%	0.711	S	S	*	*	G	3₁₀ helix	trans	-77.8	-13	-178.7	0	0	0	0	0	113.6	W840 T845	W840-A843 PolarHBondContact O-N 2.97Å; A843-T845 VanDerWaalsContact C-N 3.31Å; A843-T845 PolarHBondContact O-N 3.12Å
844	A	50.1	Low	51.5	Low	90 Å²	90	125 Å²	125	74%	0.744	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-77.2	-11.9	-175.8	0	0	0	0	0	114.6	A842	A842-A844 VanDerWaalsContact C-N 3.3Å; A842-A844 PolarHBondContact O-N 2.88Å
845	T	51.9	Low	51.4	Low	127 Å²	127	122.6 Å²	122.6	78%	0.779	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-116	1.5	-169.3	-23.1	0	0	0	0	113.9	A843	A843-T845 VanDerWaalsContact C-N 3.31Å; A843-T845 PolarHBondContact O-N 3.12Å
846	S	47.5	Very low	51.2	Low	94 Å²	94	124.7 Å²	124.7	66%	0.657	73%	0.727	S	S	*	*			trans	-116.7	79.4	178.7	60	0	0	0	0	110.7
847	N	44.7	Very low	51.3	Low	158 Å²	158	124.4 Å²	124.4	85%	0.845	73%	0.729	S	S	*	*			trans	-81.7	162.2	170	-154.4	-9.1	0	0	0	110.1
848	I	49.6	Very low	52	Low	143 Å²	143	124.3 Å²	124.3	73%	0.733	72%	0.72	S	S	*	*	S	Bend	trans	88	130	-179.4	-54.3	166.3	0	0	0	115.7
849	N	45.9	Very low	52.9	Low	154 Å²	154	127.7 Å²	127.7	82%	0.824	73%	0.731	S	S	*	*			trans	70.8	72.8	168.8	-64.9	-8.6	0	0	0	119.5
850	I	43.1	Very low	54.1	Low	170 Å²	170	130 Å²	130	87%	0.872	74%	0.74	S	S	*	*			trans	-82.8	110.8	158.1	-59.6	167.1	0	0	0	110
851	T	42.3	Very low	55.2	Low	125 Å²	125	122.3 Å²	122.3	77%	0.767	72%	0.72	S	S	*	*			trans	-164.7	104.1	144.8	41.5	0	0	0	0	110.9
852	N	52.2	Low	56.2	Low	169 Å²	169	121.6 Å²	121.6	90%	0.904	70%	0.703	S	S	*	*			trans	-178.9	147.3	135.6	-95.3	-33.3	0	0	0	110.8
853	K	43.5	Very low	57.6	Low	213 Å²	213	125 Å²	125	93%	0.926	71%	0.712	S	S	*	*			trans	-81.8	125.2	179.9	-67.7	174.8	178	174.9	0	110.4
854	A	50.5	Low	58.9	Low	100 Å²	100	124.4 Å²	124.4	83%	0.826	71%	0.706	S	S	*	*			trans	-106.1	140.1	162.7	0	0	0	0	0	109.6
855	A	60.6	Low	60.3	Low	87 Å²	87	123 Å²	123	72%	0.719	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-75.8	156.2	-177.3	0	0	0	0	0	112.2	I857	A855-I857 PolarHBondContact O-N 3.28Å
856	P	57.2	Low	61.7	Low	130 Å²	130	123 Å²	123	84%	0.844	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-60.9	134.6	171.8	26.6	-34.7	0	0	0	110.9	D858	P856-D858 PolarHBondContact O-N 2.9Å
857	I	60.6	Low	63.3	Low	133 Å²	133	121.3 Å²	121.3	68%	0.682	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-70.8	121.8	-177.7	-60.7	168.2	0	0	0	109.1	A855 L859 S861 I862	A855-I857 PolarHBondContact O-N 3.28Å; I857-L859 PolarHBondContact O-N 3.29Å; I857-S861 WeakPolarHBondContact CG2-OG 3.44Å; I857-I862 HydrophobicContact CG2-CD1 3.97Å; I857-I862 HydrophobicContact CG2-CG1 3.82Å
858	D	72.6	Confident	64.9	Low	98 Å²	98	116.2 Å²	116.2	52%	0.524	66%	0.658	S	S	.	*	P	Polyproline II helix	trans	-64.5	130.5	178.9	176.9	13.5	0	0	0	110.9	P856 R860 S861 I862	P856-D858 PolarHBondContact O-N 2.9Å; D858-R860 PolarHBondContact O-N 3.42Å; D858-R860 PolarHBondContact OD1-N 3.4Å; D858-R860 VanDerWaalsContact OD1-N 3.13Å; D858-S861 WeakPolarHBondContact O-CB 3.22Å; D858-S861 PolarHBondContact O-N 2.71Å; D858-S861 PolarHBondContact O-OG 3.4Å; D858-I862 PolarHBondContact O-N 3.21Å
859	L	73.9	Confident	66.2	Low	116 Å²	116	114.2 Å²	114.2	61%	0.607	65%	0.645	S	S	*	*	H	α-helix	trans	-55	-33.7	179.2	-174.5	64.1	0	0	0	112.5	I857 S861 I862 Q863	I857-L859 PolarHBondContact O-N 3.29Å; L859-S861 VanDerWaalsContact C-N 3.32Å; L859-S861 PolarHBondContact O-N 3.29Å; L859-I862 PolarHBondContact O-N 3.25Å; L859-Q863 PolarHBondContact O-N 3.42Å; L859-Q863 VanDerWaalsContact O-N 3.17Å
860	R	79.9	Confident	67.6	Low	195 Å²	195	111.9 Å²	111.9	74%	0.736	63%	0.629	S	S	*	*	H	α-helix	trans	-64.5	-34.5	174.9	-77.3	178.5	161.9	172.3	-4.7	112.9	D858 I862 Q863 A864	D858-R860 PolarHBondContact O-N 3.42Å; D858-R860 PolarHBondContact OD1-N 3.4Å; D858-R860 VanDerWaalsContact OD1-N 3.13Å; R860-I862 VanDerWaalsContact C-N 3.33Å; R860-Q863 PolarHBondContact O-N 3.27Å; R860-A864 VanDerWaalsContact O-CB 3.32Å; R860-A864 WeakPolarHBondContact O-CB 3.3Å; R860-A864 PolarHBondContact O-N 2.72Å
861	S	75	Confident	69.5	Low	58 Å²	58	106.6 Å²	106.6	41%	0.406	61%	0.611	S	S	.	*	H	α-helix	trans	-66.8	-36.8	178.6	73.3	0	0	0	0	111.8	I857 D858 L859 A865	I857-S861 WeakPolarHBondContact CG2-OG 3.44Å; D858-S861 WeakPolarHBondContact O-CB 3.22Å; D858-S861 PolarHBondContact O-N 2.71Å; D858-S861 PolarHBondContact O-OG 3.4Å; L859-S861 VanDerWaalsContact C-N 3.32Å; L859-S861 PolarHBondContact O-N 3.29Å; S861-A865 WeakPolarHBondContact O-CB 3.4Å; S861-A865 PolarHBondContact O-N 3.46Å
862	I	74.2	Confident	71.3	Confident	76 Å²	76	107.9 Å²	107.9	39%	0.39	61%	0.606	S	S	.	*	H	α-helix	trans	-67.4	-46.8	176.4	-57.4	175.8	0	0	0	110.3	I857 D858 L859 R860 A864 A865 Q866	I857-I862 HydrophobicContact CG2-CD1 3.97Å; I857-I862 HydrophobicContact CG2-CG1 3.82Å; D858-I862 PolarHBondContact O-N 3.21Å; L859-I862 PolarHBondContact O-N 3.25Å; R860-I862 VanDerWaalsContact C-N 3.33Å; I862-A864 PolarHBondContact O-N 2.96Å; I862-A865 PolarHBondContact O-N 3.14Å; I862-Q866 WeakPolarHBondContact O-CG 3.38Å; I862-Q866 PolarHBondContact O-N 2.93Å
863	Q	82.4	Confident	72.5	Confident	114 Å²	114	105.4 Å²	105.4	53%	0.533	58%	0.583	S	S	.	*	H	α-helix	trans	-62.7	-40.9	176.8	-70.8	-179.4	-21.2	0	0	112.3	L859 R860 Q866 A867	L859-Q863 PolarHBondContact O-N 3.42Å; L859-Q863 VanDerWaalsContact O-N 3.17Å; R860-Q863 PolarHBondContact O-N 3.27Å; Q863-Q866 PolarHBondContact O-N 3.28Å; Q863-A867 WeakPolarHBondContact O-CB 3.29Å; Q863-A867 PolarHBondContact O-N 3.44Å
864	A	79.2	Confident	74.4	Confident	62 Å²	62	101.2 Å²	101.2	51%	0.512	57%	0.565	S	S	.	*	H	α-helix	trans	-64.8	-40.6	175.7	0	0	0	0	0	112.2	R860 I862 A868	R860-A864 VanDerWaalsContact O-CB 3.32Å; R860-A864 WeakPolarHBondContact O-CB 3.3Å; R860-A864 PolarHBondContact O-N 2.72Å; I862-A864 PolarHBondContact O-N 2.96Å; A864-A868 VanDerWaalsContact O-CB 3.29Å; A864-A868 WeakPolarHBondContact O-CB 3.22Å; A864-A868 PolarHBondContact O-N 2.91Å
865	A	79.2	Confident	76	Confident	60 Å²	60	104.7 Å²	104.7	50%	0.496	56%	0.558	S	S	.	*	H	α-helix	trans	-63.7	-44.5	175.1	0	0	0	0	0	112	S861 I862 A868 E869	S861-A865 WeakPolarHBondContact O-CB 3.4Å; S861-A865 PolarHBondContact O-N 3.46Å; I862-A865 PolarHBondContact O-N 3.14Å; A865-A868 PolarHBondContact O-N 3.29Å; A865-E869 PolarHBondContact O-N 2.91Å
866	Q	81.1	Confident	77.1	Confident	128 Å²	128	105.7 Å²	105.7	60%	0.598	55%	0.548	S	S	*	.	H	α-helix	trans	-60.7	-47.1	176.2	-73.5	176.7	-42.3	0	0	112	I862 Q863 A868 E869 E870	I862-Q866 WeakPolarHBondContact O-CG 3.38Å; I862-Q866 PolarHBondContact O-N 2.93Å; Q863-Q866 PolarHBondContact O-N 3.28Å; Q866-A868 VanDerWaalsContact C-N 3.35Å; Q866-A868 PolarHBondContact O-N 2.92Å; Q866-E869 PolarHBondContact O-N 2.78Å; Q866-E870 WeakPolarHBondContact O-CB 3.35Å; Q866-E870 PolarHBondContact O-N 3.45Å
867	A	80.6	Confident	78	Confident	59 Å²	59	104.3 Å²	104.3	49%	0.488	53%	0.534	S	S	.	.	H	α-helix	trans	-63.2	-39.1	177	0	0	0	0	0	112.5	Q863 A871	Q863-A867 WeakPolarHBondContact O-CB 3.29Å; Q863-A867 PolarHBondContact O-N 3.44Å; A867-A871 WeakPolarHBondContact O-CB 3.24Å; A867-A871 PolarHBondContact O-N 3.38Å
868	A	80.1	Confident	79	Confident	51 Å²	51	100.7 Å²	100.7	42%	0.421	52%	0.523	S	S	.	.	H	α-helix	trans	-68.2	-33.3	176.4	0	0	0	0	0	112.9	A864 A865 Q866 K872	A864-A868 VanDerWaalsContact O-CB 3.29Å; A864-A868 WeakPolarHBondContact O-CB 3.22Å; A864-A868 PolarHBondContact O-N 2.91Å; A865-A868 PolarHBondContact O-N 3.29Å; Q866-A868 VanDerWaalsContact C-N 3.35Å; Q866-A868 PolarHBondContact O-N 2.92Å; A868-K872 WeakPolarHBondContact O-CG 3.44Å; A868-K872 PolarHBondContact O-N 2.95Å
869	E	75.7	Confident	79.7	Confident	101 Å²	101	99.4 Å²	99.4	47%	0.472	52%	0.516	S	S	.	.	H	α-helix	trans	-76.9	-38.9	175.2	-160.7	179	138.8	0	0	112.3	A865 Q866 A871 K872 R873	A865-E869 PolarHBondContact O-N 2.91Å; Q866-E869 PolarHBondContact O-N 2.78Å; E869-A871 VanDerWaalsContact C-N 3.3Å; E869-A871 PolarHBondContact O-N 3.39Å; E869-K872 WeakPolarHBondContact O-CB 3.37Å; E869-K872 PolarHBondContact O-N 3.28Å; E869-K872 VanDerWaalsContact O-N 3.17Å; E869-R873 WeakPolarHBondContact O-CG 3.1Å; E869-R873 PolarHBondContact O-N 3.44Å; E869-R873 IonicContact OE1-CZ 3.44Å; E869-R873 IonicContact OE1-NE 3.5Å; E869-R873 PolarHBondContact OE1-NE 3.3Å; E869-R873 IonicContact OE1-NH2 2.69Å; E869-R873 PolarHBondContact OE1-NH2 2.84Å
870	E	76.6	Confident	79.7	Confident	105 Å²	105	95.9 Å²	95.9	49%	0.491	50%	0.497	S	S	.	.	H	α-helix	trans	-61.4	-39	172.8	-163.1	-168.8	158.1	0	0	111.4	Q866 R873 K874	Q866-E870 WeakPolarHBondContact O-CB 3.35Å; Q866-E870 PolarHBondContact O-N 3.45Å; E870-R873 PolarHBondContact O-N 2.93Å; E870-K874 WeakPolarHBondContact O-CG 3.48Å; E870-K874 PolarHBondContact O-N 2.91Å; E870-K874 WeakPolarHBondContact OE1-CE 3.17Å; E870-K874 IonicContact OE1-NZ 2.6Å; E870-K874 PolarHBondContact OE1-NZ 3.19Å
871	A	81.2	Confident	79.5	Confident	58 Å²	58	90.4 Å²	90.4	48%	0.479	49%	0.488	S	S	.	.	H	α-helix	trans	-61.9	-41.7	173.2	0	0	0	0	0	112.5	A867 E869 K874 Y875	A867-A871 WeakPolarHBondContact O-CB 3.24Å; A867-A871 PolarHBondContact O-N 3.38Å; E869-A871 VanDerWaalsContact C-N 3.3Å; E869-A871 PolarHBondContact O-N 3.39Å; A871-K874 PolarHBondContact O-N 3.41Å; A871-Y875 PolarHBondContact O-N 3.5Å
872	K	80.7	Confident	79.6	Confident	153 Å²	153	93.5 Å²	93.5	67%	0.665	50%	0.497	S	S	*	.	H	α-helix	trans	-63.7	-41.6	174.6	-73.4	170.9	-177.4	178.2	0	112.2	A868 E869 Y875 H876	A868-K872 WeakPolarHBondContact O-CG 3.44Å; A868-K872 PolarHBondContact O-N 2.95Å; E869-K872 WeakPolarHBondContact O-CB 3.37Å; E869-K872 PolarHBondContact O-N 3.28Å; E869-K872 VanDerWaalsContact O-N 3.17Å; K872-Y875 PolarHBondContact O-N 3.32Å; K872-H876 PolarHBondContact O-N 3.5Å
873	R	76.7	Confident	79.6	Confident	116 Å²	116	94.6 Å²	94.6	44%	0.438	50%	0.5	S	S	.	.	H	α-helix	trans	-62.7	-47.2	175.6	-67.6	178.7	-168.9	-164	3.9	111.1	E869 E870 Y875 H876 D877	E869-R873 WeakPolarHBondContact O-CG 3.1Å; E869-R873 PolarHBondContact O-N 3.44Å; E869-R873 IonicContact OE1-CZ 3.44Å; E869-R873 IonicContact OE1-NE 3.5Å; E869-R873 PolarHBondContact OE1-NE 3.3Å; E869-R873 IonicContact OE1-NH2 2.69Å; E869-R873 PolarHBondContact OE1-NH2 2.84Å; E870-R873 PolarHBondContact O-N 2.93Å; R873-Y875 VanDerWaalsContact C-N 3.32Å; R873-Y875 PolarHBondContact O-N 3.47Å; R873-H876 PolarHBondContact O-N 2.88Å; R873-D877 PolarHBondContact O-N 3.27Å
874	K	83.9	Confident	79.3	Confident	125 Å²	125	92.3 Å²	92.3	54%	0.543	49%	0.494	S	S	.	.	H	α-helix	trans	-60.2	-37.4	175.7	-73.2	173.8	-176.1	168.6	0	113.3	E870 A871 A878	E870-K874 WeakPolarHBondContact O-CG 3.48Å; E870-K874 PolarHBondContact O-N 2.91Å; E870-K874 WeakPolarHBondContact OE1-CE 3.17Å; E870-K874 IonicContact OE1-NZ 2.6Å; E870-K874 PolarHBondContact OE1-NZ 3.19Å; A871-K874 PolarHBondContact O-N 3.41Å; K874-A878 VanDerWaalsContact O-CB 3.26Å; K874-A878 WeakPolarHBondContact O-CB 3.32Å; K874-A878 PolarHBondContact O-N 3.12Å
875	Y	83.6	Confident	78.9	Confident	173 Å²	173	92 Å²	92	68%	0.678	49%	0.491	S	S	*	.	H	α-helix	trans	-66.8	-43.2	174.6	-174.8	-95.5	0	0	0	112.2	A871 K872 R873 A878 L879	A871-Y875 PolarHBondContact O-N 3.5Å; K872-Y875 PolarHBondContact O-N 3.32Å; R873-Y875 VanDerWaalsContact C-N 3.32Å; R873-Y875 PolarHBondContact O-N 3.47Å; Y875-A878 PolarHBondContact O-N 2.95Å; Y875-L879 PolarHBondContact O-N 2.9Å
876	H	84.4	Confident	78.5	Confident	108 Å²	108	93.7 Å²	93.7	50%	0.5	50%	0.495	S	S	.	.	H	α-helix	trans	-63.4	-45.3	175.3	179.3	-84.1	0	0	0	112.2	K872 R873 A878 L879 M880	K872-H876 PolarHBondContact O-N 3.5Å; R873-H876 PolarHBondContact O-N 2.88Å; H876-A878 VanDerWaalsContact C-N 3.33Å; H876-A878 PolarHBondContact O-N 2.99Å; H876-L879 WeakPolarHBondContact O-CB 3.12Å; H876-L879 PolarHBondContact O-N 3.41Å; H876-M880 WeakPolarHBondContact O-CG 3.46Å; H876-M880 PolarHBondContact O-N 3.07Å
877	D	77	Confident	77.8	Confident	102 Å²	102	92 Å²	92	55%	0.545	49%	0.49	S	S	.	.	H	α-helix	trans	-67.9	-33.7	179.2	-67.8	-16.3	0	0	0	111.9	R873 S881	R873-D877 PolarHBondContact O-N 3.27Å; D877-S881 VanDerWaalsContact O-CB 3.28Å; D877-S881 WeakPolarHBondContact O-CB 3.45Å; D877-S881 PolarHBondContact O-N 3.01Å
878	A	81.8	Confident	77.1	Confident	56 Å²	56	94.3 Å²	94.3	46%	0.463	49%	0.492	S	S	.	.	H	α-helix	trans	-63.9	-47.1	170.6	0	0	0	0	0	111.8	K874 Y875 H876 M880 S881 E882	K874-A878 VanDerWaalsContact O-CB 3.26Å; K874-A878 WeakPolarHBondContact O-CB 3.32Å; K874-A878 PolarHBondContact O-N 3.12Å; Y875-A878 PolarHBondContact O-N 2.95Å; H876-A878 VanDerWaalsContact C-N 3.33Å; H876-A878 PolarHBondContact O-N 2.99Å; A878-M880 VanDerWaalsContact C-N 3.33Å; A878-M880 PolarHBondContact O-N 3.15Å; A878-S881 PolarHBondContact O-N 3.43Å; A878-E882 WeakPolarHBondContact O-CB 3.48Å; A878-E882 PolarHBondContact O-N 3.48Å
879	L	85.7	Confident	76	Confident	71 Å²	71	95 Å²	95	37%	0.372	50%	0.499	S	S	.	.	H	α-helix	trans	-59.6	-42.2	176.4	-170.1	80.7	0	0	0	111.8	Y875 H876 E882 Q883	Y875-L879 PolarHBondContact O-N 2.9Å; H876-L879 WeakPolarHBondContact O-CB 3.12Å; H876-L879 PolarHBondContact O-N 3.41Å; L879-E882 PolarHBondContact O-N 3.25Å; L879-Q883 WeakPolarHBondContact O-CG 3.34Å; L879-Q883 PolarHBondContact O-N 2.93Å
880	M	73.9	Confident	75	Confident	43 Å²	43	93.6 Å²	93.6	21%	0.212	50%	0.504	C	S	.	.	H	α-helix	trans	-68.8	-38.2	175.9	-71.1	-54	-52.1	0	0	112.2	I820 H876 A878 E882 Q883 V884	I820-M880 HydrophobicContact CD1-CE 4.12Å; I820-M880 HydrophobicContact CG1-CE 4.11Å; I820-M880 HydrophobicContact CG2-CE 3.98Å; H876-M880 WeakPolarHBondContact O-CG 3.46Å; H876-M880 PolarHBondContact O-N 3.07Å; A878-M880 VanDerWaalsContact C-N 3.33Å; A878-M880 PolarHBondContact O-N 3.15Å; M880-E882 VanDerWaalsContact C-N 3.31Å; M880-E882 PolarHBondContact O-N 2.91Å; M880-Q883 PolarHBondContact O-N 2.84Å; M880-V884 WeakPolarHBondContact O-CB 3.41Å; M880-V884 WeakPolarHBondContact O-CG2 3.48Å; M880-V884 PolarHBondContact O-N 3.08Å
881	S	76.8	Confident	73.8	Confident	79 Å²	79	97.1 Å²	97.1	55%	0.552	52%	0.521	S	S	*	.	H	α-helix	trans	-65.2	-34.4	173.8	-171	0	0	0	0	112.1	D877 A878 A885	D877-S881 VanDerWaalsContact O-CB 3.28Å; D877-S881 WeakPolarHBondContact O-CB 3.45Å; D877-S881 PolarHBondContact O-N 3.01Å; A878-S881 PolarHBondContact O-N 3.43Å; S881-A885 VanDerWaalsContact O-CB 3.28Å; S881-A885 WeakPolarHBondContact O-CB 2.87Å; S881-A885 PolarHBondContact O-N 2.6Å
882	E	76.1	Confident	72.2	Confident	124 Å²	124	97.3 Å²	97.3	58%	0.579	52%	0.522	S	S	*	.	H	α-helix	trans	-68	-46.8	174.7	-173.6	175.1	-171.6	0	0	111.1	A878 L879 M880 V884 A885 V886	A878-E882 WeakPolarHBondContact O-CB 3.48Å; A878-E882 PolarHBondContact O-N 3.48Å; L879-E882 PolarHBondContact O-N 3.25Å; M880-E882 VanDerWaalsContact C-N 3.31Å; M880-E882 PolarHBondContact O-N 2.91Å; E882-V884 VanDerWaalsContact C-N 3.32Å; E882-V884 PolarHBondContact O-N 3.14Å; E882-A885 PolarHBondContact O-N 3.06Å; E882-A885 VanDerWaalsContact O-N 3.14Å; E882-V886 WeakPolarHBondContact O-CG2 3.45Å; E882-V886 PolarHBondContact O-N 2.84Å
883	Q	75.1	Confident	70.2	Confident	98 Å²	98	93.7 Å²	93.7	46%	0.458	52%	0.521	S	S	.	.	H	α-helix	trans	-60.7	-39.2	174.9	-70.4	-180	32.8	0	0	112.6	L879 M880 V886 L887	L879-Q883 WeakPolarHBondContact O-CG 3.34Å; L879-Q883 PolarHBondContact O-N 2.93Å; M880-Q883 PolarHBondContact O-N 2.84Å; Q883-V886 PolarHBondContact O-N 3.29Å; Q883-L887 PolarHBondContact O-N 3.17Å; Q883-L887 VanDerWaalsContact O-N 3.08Å
884	V	75.2	Confident	68.5	Low	67 Å²	67	93 Å²	93	41%	0.406	53%	0.531	S	S	.	.	H	α-helix	trans	-67.7	-39.8	174	169.8	0	0	0	0	111.3	M880 E882 L887 I888	M880-V884 WeakPolarHBondContact O-CB 3.41Å; M880-V884 WeakPolarHBondContact O-CG2 3.48Å; M880-V884 PolarHBondContact O-N 3.08Å; E882-V884 VanDerWaalsContact C-N 3.32Å; E882-V884 PolarHBondContact O-N 3.14Å; V884-L887 PolarHBondContact O-N 3.39Å; V884-I888 HydrophobicContact CG1-CD1 3.77Å; V884-I888 HydrophobicContact CG1-CG1 4.43Å; V884-I888 WeakPolarHBondContact O-CG1 3.47Å; V884-I888 PolarHBondContact O-N 2.95Å
885	A	72.4	Confident	66.1	Low	55 Å²	55	95.8 Å²	95.8	46%	0.455	55%	0.551	S	S	.	*	H	α-helix	trans	-64.5	-38.2	175.3	0	0	0	0	0	112.4	S881 E882 I888 A889	S881-A885 VanDerWaalsContact O-CB 3.28Å; S881-A885 WeakPolarHBondContact O-CB 2.87Å; S881-A885 PolarHBondContact O-N 2.6Å; E882-A885 PolarHBondContact O-N 3.06Å; E882-A885 VanDerWaalsContact O-N 3.14Å; A885-I888 PolarHBondContact O-N 3.35Å; A885-A889 VanDerWaalsContact O-CB 3.27Å; A885-A889 WeakPolarHBondContact O-CB 3.36Å; A885-A889 PolarHBondContact O-N 3.16Å
886	V	70.9	Confident	63.7	Low	95 Å²	95	91.5 Å²	91.5	58%	0.576	55%	0.546	S	S	*	.	H	α-helix	trans	-64.5	-42.1	174.2	170	0	0	0	0	111.4	E882 Q883 A889 A890	E882-V886 WeakPolarHBondContact O-CG2 3.45Å; E882-V886 PolarHBondContact O-N 2.84Å; Q883-V886 PolarHBondContact O-N 3.29Å; V886-A889 PolarHBondContact O-N 2.88Å; V886-A890 WeakPolarHBondContact O-CB 3.5Å; V886-A890 PolarHBondContact O-N 3.3Å
887	L	66.4	Low	61.6	Low	93 Å²	93	93.2 Å²	93.2	49%	0.487	56%	0.564	S	S	.	*	H	α-helix	trans	-64.8	-43.8	175	-75.9	167.4	0	0	0	112.1	Q883 V884 A889 A890 E891	Q883-L887 PolarHBondContact O-N 3.17Å; Q883-L887 VanDerWaalsContact O-N 3.08Å; V884-L887 PolarHBondContact O-N 3.39Å; L887-A889 VanDerWaalsContact C-N 3.34Å; L887-A889 PolarHBondContact O-N 2.85Å; L887-A890 PolarHBondContact O-N 3.25Å; L887-E891 PolarHBondContact O-N 3.23Å
888	I	64.3	Low	59.5	Low	107 Å²	107	97.8 Å²	97.8	55%	0.549	58%	0.579	S	S	.	*	H	α-helix	trans	-64.5	-38.9	175.8	-68.3	169.5	0	0	0	110.8	V884 A885 A890 E891 A892	V884-I888 HydrophobicContact CG1-CD1 3.77Å; V884-I888 HydrophobicContact CG1-CG1 4.43Å; V884-I888 WeakPolarHBondContact O-CG1 3.47Å; V884-I888 PolarHBondContact O-N 2.95Å; A885-I888 PolarHBondContact O-N 3.35Å; I888-A890 VanDerWaalsContact C-N 3.33Å; I888-A890 PolarHBondContact O-N 2.92Å; I888-E891 PolarHBondContact O-N 2.83Å; I888-A892 WeakPolarHBondContact O-CB 3.27Å; I888-A892 PolarHBondContact O-N 3.37Å
889	A	58.2	Low	57.4	Low	67 Å²	67	101.9 Å²	101.9	55%	0.554	60%	0.599	S	S	*	*	H	α-helix	trans	-67.5	-31.3	175.9	0	0	0	0	0	113.1	A885 V886 L887	A885-A889 VanDerWaalsContact O-CB 3.27Å; A885-A889 WeakPolarHBondContact O-CB 3.36Å; A885-A889 PolarHBondContact O-N 3.16Å; V886-A889 PolarHBondContact O-N 2.88Å; L887-A889 VanDerWaalsContact C-N 3.34Å; L887-A889 PolarHBondContact O-N 2.85Å
890	A	55.1	Low	54.8	Low	70 Å²	70	103.9 Å²	103.9	58%	0.579	62%	0.619	S	S	*	*	H	α-helix	trans	-73.3	-39.7	174.6	0	0	0	0	0	112.5	V886 L887 I888 A893	V886-A890 WeakPolarHBondContact O-CB 3.5Å; V886-A890 PolarHBondContact O-N 3.3Å; L887-A890 PolarHBondContact O-N 3.25Å; I888-A890 VanDerWaalsContact C-N 3.33Å; I888-A890 PolarHBondContact O-N 2.92Å; A890-A893 WeakPolarHBondContact O-CB 3.45Å
891	E	49.6	Very low	53	Low	180 Å²	180	110.1 Å²	110.1	84%	0.841	65%	0.652	S	S	*	*	H	α-helix	trans	-83.4	-25.7	-179.9	-165.7	164.6	-175.1	0	0	112.9	L887 I888 A893	L887-E891 PolarHBondContact O-N 3.23Å; I888-E891 PolarHBondContact O-N 2.83Å; E891-A893 VanDerWaalsContact C-N 3.3Å; E891-A893 PolarHBondContact O-N 2.86Å
892	A	47.6	Very low	50.8	Low	62 Å²	62	109.9 Å²	109.9	51%	0.512	65%	0.651	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.3	13.4	173.6	0	0	0	0	0	113.9	I888 P894	I888-A892 WeakPolarHBondContact O-CB 3.27Å; I888-A892 PolarHBondContact O-N 3.37Å; A892-P894 WeakPolarHBondContact O-CD 3.3Å; A892-P894 VanDerWaalsContact O-CG 3.28Å; A892-P894 WeakPolarHBondContact O-CG 3.49Å; A892-P894 VanDerWaalsContact O-N 3.11Å
893	A	39.6	Very low	48.6	Very low	77 Å²	77	115 Å²	115	64%	0.636	67%	0.665	S	S	*	*			trans	-61.9	105.1	-179.1	0	0	0	0	0	111.8	A890 E891	A890-A893 WeakPolarHBondContact O-CB 3.45Å; E891-A893 VanDerWaalsContact C-N 3.3Å; E891-A893 PolarHBondContact O-N 2.86Å
894	P	41.4	Very low	46.6	Very low	101 Å²	101	115.7 Å²	115.7	66%	0.656	68%	0.68	S	S	*	*			trans	-92.8	156.2	-170.2	7.7	11.9	0	0	0	112.6	A892 S896	A892-P894 WeakPolarHBondContact O-CD 3.3Å; A892-P894 VanDerWaalsContact O-CG 3.28Å; A892-P894 WeakPolarHBondContact O-CG 3.49Å; A892-P894 VanDerWaalsContact O-N 3.11Å; P894-S896 VanDerWaalsContact C-N 3.31Å; P894-S896 PolarHBondContact O-N 2.99Å
895	L	33.4	Very low	44.7	Very low	184 Å²	184	119.3 Å²	119.3	96%	0.963	69%	0.693	S	S	*	*	S	Bend	trans	-65.5	76.5	171.9	-174.2	75.7	0	0	0	111.9
896	S	33	Very low	43	Very low	82 Å²	82	124.2 Å²	124.2	57%	0.573	71%	0.71	S	S	*	*			trans	-149.1	59.4	-173.9	71.6	0	0	0	0	118.2	P894	P894-S896 VanDerWaalsContact C-N 3.31Å; P894-S896 PolarHBondContact O-N 2.99Å
897	T	39.2	Very low	41.1	Very low	144 Å²	144	123.4 Å²	123.4	88%	0.883	71%	0.713	S	S	*	*			trans	-125.1	59.2	161.9	49.3	0	0	0	0	114.1
898	K	33.9	Very low	39.5	Very low	198 Å²	198	128.2 Å²	128.2	86%	0.861	73%	0.73	S	S	*	*			trans	37.4	96.3	140.8	-58	174.4	-176.9	173.9	0	117.8
899	T	37.4	Very low	38.1	Very low	143 Å²	143	128.7 Å²	128.7	88%	0.877	74%	0.743	S	S	*	*			trans	-124.1	132.1	134.5	47.9	0	0	0	0	108.7
900	S	30.7	Very low	36.9	Very low	113 Å²	113	132.9 Å²	132.9	79%	0.79	76%	0.756	S	S	*	*			trans	-102.1	123.8	-176.3	54.7	0	0	0	0	111.1
901	L	36.3	Very low	36	Very low	174 Å²	174	135.1 Å²	135.1	91%	0.911	76%	0.763	S	S	*	*			trans	-122.3	117.4	148.8	-82.8	95.1	0	0	0	108.6
902	S	31.4	Very low	35.4	Very low	74 Å²	74	133.8 Å²	133.8	52%	0.517	76%	0.76	S	S	.	*			trans	-88	147.4	174.6	179.1	0	0	0	0	110.1
903	W	30.7	Very low	34.7	Very low	230 Å²	230	135.6 Å²	135.6	87%	0.871	77%	0.769	S	S	*	*			trans	-150.5	28.4	148.4	-100.6	110.5	0	0	0	112.5	Q905	W903-Q905 VanDerWaalsContact CE3-O 3.3Å; W903-Q905 WeakPolarHBondContact CZ3-O 3.27Å; W903-Q905 PolarHBondContact O-N 3Å
904	S	31.6	Very low	34.4	Very low	113 Å²	113	139.2 Å²	139.2	79%	0.79	78%	0.777	S	S	*	*			trans	-89	40.6	178	61.2	0	0	0	0	113.4
905	Q	35.5	Very low	34	Very low	143 Å²	143	140.1 Å²	140.1	67%	0.668	78%	0.781	S	S	*	*			trans	-145.3	124.8	166.6	-73.3	169.8	-70.4	0	0	103.6	W903	W903-Q905 VanDerWaalsContact CE3-O 3.3Å; W903-Q905 WeakPolarHBondContact CZ3-O 3.27Å; W903-Q905 PolarHBondContact O-N 3Å
906	I	37.7	Very low	33.8	Very low	159 Å²	159	136.8 Å²	136.8	82%	0.815	77%	0.772	S	S	*	*				-136.2	155.2	50.8	-73.9	151.1	0	0	0	110.6
907	A	30.9	Very low	33.7	Very low	78 Å²	78	140.1 Å²	140.1	65%	0.645	78%	0.782	S	S	*	*			trans	-104.9	157	171.6	0	0	0	0	0	111.6
908	K	32.6	Very low	33.4	Very low	194 Å²	194	140.4 Å²	140.4	84%	0.843	78%	0.778	S	S	*	*			trans	86.8	165.8	171.7	-49.6	165.8	-174.6	178.3	0	115.7
909	S	34.5	Very low	33.5	Very low	117 Å²	117	136.6 Å²	136.6	82%	0.818	77%	0.774	S	S	*	*			trans	64.7	112.5	-173.4	38.1	0	0	0	0	115.9
910	D	32.6	Very low	32.9	Very low	154 Å²	154	134.3 Å²	134.3	82%	0.824	76%	0.763	S	S	*	*			trans	-77	-169.7	177.1	-40.1	-95.5	0	0	0	112.4
911	T	35.6	Very low	32.8	Very low	118 Å²	118	136.4 Å²	136.4	72%	0.724	76%	0.764	S	S	*	*			trans	107.5	83.5	152	-40.4	0	0	0	0	118.4
912	I	37.1	Very low	32.5	Very low	151 Å²	151	132.8 Å²	132.8	77%	0.774	75%	0.752	S	S	*	*				68	157.2	126.3	-63.6	172.4	0	0	0	120.3
913	S	34.1	Very low	32.6	Very low	100 Å²	100	135.2 Å²	135.2	70%	0.699	75%	0.754	S	S	*	*			trans	76.8	95.9	166.3	57.4	0	0	0	0	118
914	L	32	Very low	32.8	Very low	154 Å²	154	129.1 Å²	129.1	81%	0.806	74%	0.738	S	S	*	*				83	120.1	78.2	-77.2	164.5	0	0	0	115.4
915	T	32.8	Very low	32.8	Very low	120 Å²	120	129.8 Å²	129.8	74%	0.736	73%	0.733	S	S	*	*			trans	61.5	102.3	142.6	56.5	0	0	0	0	122.2
916	S	29.7	Very low	32.7	Very low	113 Å²	113	130.3 Å²	130.3	79%	0.79	73%	0.733	S	S	*	*				81.6	167.4	108.1	-154.2	0	0	0	0	121
917	I	31.1	Very low	32.4	Very low	153 Å²	153	128.2 Å²	128.2	79%	0.785	73%	0.728	S	S	*	*			trans	77.8	118.3	168.7	-37.2	-174.3	0	0	0	117
918	N	33.1	Very low	32.4	Very low	149 Å²	149	129.7 Å²	129.7	80%	0.797	73%	0.729	S	S	*	*			trans	-45.9	153.8	162.3	-68.9	-52.5	0	0	0	112.2
919	P	35.5	Very low	32.2	Very low	118 Å²	118	127.1 Å²	127.1	77%	0.766	72%	0.72	S	S	*	*				-159.4	-169.2	64.7	45.2	-22.9	0	0	0	118.7
920	C	24.7	Very low	32	Very low	96 Å²	96	130.8 Å²	130.8	65%	0.649	72%	0.716	S	S	*	*			trans	-25.7	136.8	172.7	59	0	0	0	0	120.6
921	I	29	Very low	32.2	Very low	157 Å²	157	128.1 Å²	128.1	81%	0.805	71%	0.709	S	S	*	*				39.5	96.5	118.1	-46	161.4	0	0	0	116.1
922	S	30.7	Very low	32	Very low	97 Å²	97	131.1 Å²	131.1	68%	0.678	71%	0.712	S	S	*	*				173.5	137.6	119	-88.2	0	0	0	0	117.1
923	K	33.9	Very low	31.6	Very low	125 Å²	125	129.7 Å²	129.7	54%	0.543	71%	0.714	S	S	.	*			trans	75.1	117	131.4	-74.3	-174	163.6	-174.5	0	122.4
924	D	33.9	Very low	31.4	Very low	103 Å²	103	128.8 Å²	128.8	55%	0.551	71%	0.713	S	S	*	*				80.5	140.7	119.8	-51.6	-15.9	0	0	0	119.2	K56	K56-D924 IonicContact NZ-OD1 2.72Å; K56-D924 PolarHBondContact NZ-OD1 2.89Å; K56-D924 IonicContact NZ-OD2 3.4Å
925	D	31.9	Very low	31.3	Very low	127 Å²	127	127.5 Å²	127.5	68%	0.679	71%	0.711	S	S	*	*			trans	63.8	144.4	162.9	-77.9	9.1	0	0	0	120
926	K	33.6	Very low	31.5	Very low	154 Å²	154	127.9 Å²	127.9	67%	0.67	71%	0.713	S	S	*	*			cis	-163.5	134.3	-17.7	-128.5	175.4	-160.9	127	0	111.3
927	T	30.7	Very low	31.6	Very low	114 Å²	114	128.9 Å²	128.9	70%	0.699	71%	0.708	S	S	*	*			trans	52.7	163.2	141.6	53.9	0	0	0	0	122.6
928	T	31	Very low	31.8	Very low	109 Å²	109	126.8 Å²	126.8	67%	0.669	71%	0.707	S	S	*	*			trans	90.9	115.7	147.5	-46	0	0	0	0	117.7
929	E	29.5	Very low	31.9	Very low	141 Å²	141	124.7 Å²	124.7	66%	0.659	70%	0.704	S	S	*	*			trans	70.9	152.1	146.7	-79.4	-169.6	149.8	0	0	120.7
930	R	30.6	Very low	32	Very low	194 Å²	194	126.1 Å²	126.1	73%	0.732	71%	0.705	S	S	*	*			cis	-165.4	165.2	-20.7	-145.4	178.2	-173.7	149.9	2.1	108
931	S	36.6	Very low	32.5	Very low	98 Å²	98	124.3 Å²	124.3	69%	0.685	69%	0.694	S	S	*	*			trans	64.7	162.9	147.2	-71.2	0	0	0	0	118.5
932	K	31.4	Very low	33	Very low	181 Å²	181	123.6 Å²	123.6	79%	0.787	69%	0.692	S	S	*	*			cis	-179.9	157.1	-40.4	-122.2	-179.6	178.9	-177.1	0	106.2
933	C	27	Very low	33.3	Very low	121 Å²	121	124.8 Å²	124.8	82%	0.818	69%	0.69	S	S	*	*			trans	66.5	147.2	156.3	-64.8	0	0	0	0	116.8
934	A	31.3	Very low	33.6	Very low	81 Å²	81	126.7 Å²	126.7	67%	0.669	71%	0.706	S	S	*	*			cis	177.6	149.6	6.4	0	0	0	0	0	111.8
935	V	29	Very low	33.7	Very low	126 Å²	126	124.9 Å²	124.9	76%	0.764	71%	0.713	S	S	*	*			trans	77.1	160.7	134.3	173.7	0	0	0	0	120.1
936	V	36.7	Very low	34.1	Very low	128 Å²	128	124.1 Å²	124.1	78%	0.776	72%	0.715	S	S	*	*			trans	80	138.4	179	-163.8	0	0	0	0	115.6
937	I	32.9	Very low	34.2	Very low	134 Å²	134	123.8 Å²	123.8	69%	0.687	72%	0.718	S	S	*	*			cis	173.8	151.9	-45.4	-96.1	163.8	0	0	0	107.6
938	S	34.8	Very low	34.7	Very low	110 Å²	110	125.1 Å²	125.1	77%	0.769	72%	0.717	S	S	*	*			trans	66.8	158.9	167.6	-74.3	0	0	0	0	117.9
939	S	36.3	Very low	34.7	Very low	105 Å²	105	128.1 Å²	128.1	73%	0.734	72%	0.72	S	S	*	*			cis	-166.6	176	-26.9	58.4	0	0	0	0	106.2
940	N	36.4	Very low	34.9	Very low	147 Å²	147	125.6 Å²	125.6	79%	0.786	72%	0.719	S	S	*	*			cis	-154.8	166.2	22.1	-166.6	20.8	0	0	0	113
941	S	35.7	Very low	35	Very low	59 Å²	59	122.1 Å²	122.1	41%	0.413	72%	0.719	S	S	.	*			trans	-79.9	155.4	-179.4	163.5	0	0	0	0	114.8	N943	S941-N943 PolarHBondContact OG-ND2 3.41Å
942	N	38.5	Very low	34.9	Very low	142 Å²	142	121 Å²	121	76%	0.759	72%	0.723	S	S	*	*				177.1	123.1	117.1	-82.2	-18.6	0	0	0	110.7
943	N	38.5	Very low	35.1	Very low	121 Å²	121	120.4 Å²	120.4	65%	0.647	72%	0.723	S	S	*	*				84.6	104.1	52	-75.5	-19.7	0	0	0	114.3	S941	S941-N943 PolarHBondContact OG-ND2 3.41Å
944	N	40.1	Very low	35.2	Very low	165 Å²	165	119.2 Å²	119.2	88%	0.882	72%	0.716	S	S	*	*				-178.5	148.3	105	-87	-29.8	0	0	0	112.6
945	G	35.8	Very low	35.4	Very low	66 Å²	66	120 Å²	120	68%	0.68	72%	0.716	S	S	*	*			trans	-104.7	-134.3	166.4	0	0	0	0	0	110.7
946	P	40.6	Very low	35.4	Very low	111 Å²	111	121.3 Å²	121.3	72%	0.721	72%	0.719	S	S	*	*			cis	-151	162.6	-2.2	45.1	-26.5	0	0	0	118.3
947	I	34.5	Very low	35.2	Very low	146 Å²	146	119 Å²	119	75%	0.749	71%	0.708	S	S	*	*			trans	70.5	154.4	132	-75	172.4	0	0	0	122.6
948	Q	40.7	Very low	35.1	Very low	143 Å²	143	118.7 Å²	118.7	67%	0.668	71%	0.708	S	S	*	*			trans	87.6	114.1	163.6	-86.1	169.4	129.5	0	0	118.1
949	K	31.9	Very low	34.9	Very low	171 Å²	171	119.9 Å²	119.9	74%	0.743	71%	0.706	S	S	*	*				96.4	148.5	70.2	-90.1	-169.9	-152.8	153.9	0	110.8
950	S	34.1	Very low	34.5	Very low	89 Å²	89	120.8 Å²	120.8	62%	0.622	71%	0.707	S	S	*	*			cis	-176.5	165.7	-12.5	48.5	0	0	0	0	111.4
951	T	32.2	Very low	34.2	Very low	120 Å²	120	118.8 Å²	118.8	74%	0.736	71%	0.705	S	S	*	*			trans	78.6	136.5	155.2	-48	0	0	0	0	117.9
952	G	34.5	Very low	34	Very low	74 Å²	74	121.1 Å²	121.1	76%	0.763	72%	0.721	S	S	*	*			trans	169.5	68.6	178.3	0	0	0	0	0	115.9
953	H	34.8	Very low	33.6	Very low	170 Å²	170	122.1 Å²	122.1	79%	0.787	73%	0.725	S	S	*	*			trans	-41.3	166.8	172	-57.8	-78.2	0	0	0	116.9
954	S	30.2	Very low	33.6	Very low	96 Å²	96	122.1 Å²	122.1	67%	0.671	73%	0.73	S	S	*	*			cis	173.4	168.8	-17.7	175.8	0	0	0	0	107.9
955	S	36.1	Very low	33.3	Very low	98 Å²	98	122 Å²	122	69%	0.685	72%	0.724	S	S	*	*			trans	77.4	128.8	158.6	-41.1	0	0	0	0	115.4
956	N	28.2	Very low	33.3	Very low	152 Å²	152	123.9 Å²	123.9	81%	0.813	72%	0.718	S	S	*	*				63.9	135.9	63.3	-82.6	17.6	0	0	0	113.7
957	S	31.9	Very low	32.9	Very low	79 Å²	79	124.5 Å²	124.5	55%	0.552	72%	0.715	S	S	*	*			cis	-177.3	171.9	-4.5	46.5	0	0	0	0	111.5
958	N	31.6	Very low	33.1	Very low	129 Å²	129	126 Å²	126	69%	0.69	71%	0.713	S	S	*	*			trans	77.5	106.6	150.8	-62	-14.4	0	0	0	119.9
959	N	29.9	Very low	32.9	Very low	134 Å²	134	126 Å²	126	72%	0.717	72%	0.716	S	S	*	*				92.5	144.6	113.8	-67.3	-3.8	0	0	0	122.9
960	T	28.8	Very low	32.7	Very low	124 Å²	124	126.4 Å²	126.4	76%	0.761	72%	0.718	S	S	*	*			trans	76.3	103.8	145	39.7	0	0	0	0	121.2
961	S	29.6	Very low	32.8	Very low	105 Å²	105	129.1 Å²	129.1	73%	0.734	72%	0.724	S	S	*	*				84.5	163	116.2	77.3	0	0	0	0	120.7
962	S	32	Very low	32.7	Very low	108 Å²	108	128.4 Å²	128.4	76%	0.755	72%	0.72	S	S	*	*			trans	61.3	124.6	-163.9	63.1	0	0	0	0	114.3
963	L	29.6	Very low	32.5	Very low	163 Å²	163	129.4 Å²	129.4	85%	0.853	72%	0.715	S	S	*	*			cis	72.1	93.1	32.9	-166.2	81.5	0	0	0	113.7
964	T	39.3	Very low	32.2	Very low	121 Å²	121	126.6 Å²	126.6	74%	0.742	72%	0.715	S	S	*	*			trans	-175.6	138.6	146.8	12.9	0	0	0	0	111.5
965	Q	34.1	Very low	32.5	Very low	164 Å²	164	128.2 Å²	128.2	77%	0.766	73%	0.726	S	S	*	*			trans	53.8	144.4	137.8	-69.9	-173.5	-38.5	0	0	121.5
966	L	34.7	Very low	32.2	Very low	104 Å²	104	133 Å²	133	55%	0.545	73%	0.734	S	S	.	*			cis	-148.6	142.3	-5.9	-91.8	145.8	0	0	0	106	Y968	L966-Y968 HydrophobicContact CD2-CE2 4.03Å
967	D	31.5	Very low	32.5	Very low	124 Å²	124	132.1 Å²	132.1	66%	0.663	74%	0.735	S	S	*	*				46.5	133.5	87.9	-64.1	-51	0	0	0	115
968	Y	38.6	Very low	32.4	Very low	179 Å²	179	133.5 Å²	133.5	70%	0.702	74%	0.744	S	S	*	*			cis	-158.2	150.7	42.1	-83.1	-75.6	0	0	0	115.2	L966	L966-Y968 HydrophobicContact CD2-CE2 4.03Å
969	L	36.6	Very low	32.7	Very low	142 Å²	142	134.6 Å²	134.6	74%	0.743	75%	0.749	S	S	*	*			trans	54.8	135.1	143.7	-57.7	167.3	0	0	0	120.6
970	K	29.6	Very low	32.9	Very low	180 Å²	180	134.7 Å²	134.7	78%	0.783	75%	0.75	S	S	*	*			cis	73.3	84.6	11	-160.5	-170.4	177.2	-178.2	0	118.5
971	I	34.6	Very low	33.1	Very low	145 Å²	145	135.1 Å²	135.1	74%	0.744	75%	0.748	S	S	*	*			trans	-147.9	109.5	153.1	-51.4	179.1	0	0	0	105.5
972	T	29.8	Very low	33.3	Very low	105 Å²	105	137.6 Å²	137.6	64%	0.644	75%	0.752	S	S	*	*				69.4	144.7	58.4	66.1	0	0	0	0	117.3
973	S	30.9	Very low	33.4	Very low	96 Å²	96	140 Å²	140	67%	0.671	76%	0.755	S	S	*	*			trans	63	97.5	158.2	48.2	0	0	0	0	120.8
974	S	29.8	Very low	33.7	Very low	111 Å²	111	138.3 Å²	138.3	78%	0.776	75%	0.752	S	S	*	*				52.3	130.4	124.3	64.4	0	0	0	0	122.8
975	S	34.9	Very low	33.5	Very low	129 Å²	129	137.7 Å²	137.7	90%	0.902	75%	0.753	S	S	*	*				-161.3	163.2	122.5	-88.3	0	0	0	0	112.8
976	K	31.2	Very low	33.7	Very low	199 Å²	199	137.3 Å²	137.3	87%	0.865	75%	0.754	S	S	*	*			trans	-109.8	145.6	-178.8	-57.2	173.9	-178.7	178	0	111.1
977	T	33.1	Very low	33.6	Very low	133 Å²	133	138.1 Å²	138.1	82%	0.816	77%	0.769	S	S	*	*			trans	-178.9	130.4	146.5	14.9	0	0	0	0	106
978	S	30.4	Very low	33.8	Very low	108 Å²	108	137.7 Å²	137.7	76%	0.755	78%	0.775	S	S	*	*			cis	76.4	146.9	36	-160.7	0	0	0	0	113.8
979	L	37.9	Very low	33.5	Very low	153 Å²	153	134.8 Å²	134.8	80%	0.801	78%	0.781	S	S	*	*			trans	85.9	135.6	-166.4	-56.2	173.9	0	0	0	115.5
980	N	34.9	Very low	33.4	Very low	135 Å²	135	134.4 Å²	134.4	72%	0.722	79%	0.785	S	S	*	*			cis	-156.2	165.1	-28.1	-154.4	0.8	0	0	0	110.3
981	N	31.7	Very low	33.6	Very low	134 Å²	134	131.5 Å²	131.5	72%	0.717	79%	0.787	S	S	*	*			trans	-68.3	149.5	165	-62.6	-30.4	0	0	0	110.6
982	N	33.8	Very low	33.8	Very low	156 Å²	156	132.1 Å²	132.1	83%	0.834	79%	0.79	S	S	*	*				-173	150.2	112.3	-93.2	-15.4	0	0	0	113.5
983	I	34.7	Very low	33.8	Very low	158 Å²	158	132.7 Å²	132.7	81%	0.81	80%	0.799	S	S	*	*			trans	-87.1	139.4	172.8	-64.1	160.5	0	0	0	108.5
984	T	35.3	Very low	34	Very low	129 Å²	129	133.9 Å²	133.9	79%	0.791	81%	0.806	S	S	*	*			trans	-157.7	120.4	148.3	-10.4	0	0	0	0	111
985	S	35.3	Very low	34.2	Very low	108 Å²	108	134.9 Å²	134.9	76%	0.755	81%	0.807	S	S	*	*			trans	-88.2	134.4	168	43.9	0	0	0	0	109.7
986	I	37.7	Very low	34.7	Very low	156 Å²	156	134 Å²	134	80%	0.8	80%	0.799	S	S	*	*			trans	-132.8	124	166.9	-48.6	179.3	0	0	0	107.7
987	S	32.5	Very low	34.9	Very low	121 Å²	121	133.3 Å²	133.3	85%	0.846	80%	0.796	S	S	*	*			trans	-94.9	132.7	174.7	-60	0	0	0	0	109.8
988	S	36.6	Very low	35.2	Very low	115 Å²	115	132.3 Å²	132.3	80%	0.804	79%	0.789	S	S	*	*			trans	-150.5	124	160.8	50.9	0	0	0	0	109.6
989	S	31.6	Very low	35.5	Very low	117 Å²	117	133.9 Å²	133.9	82%	0.818	79%	0.789	S	S	*	*			trans	-83.6	143	-176.9	48.2	0	0	0	0	112
990	T	35.4	Very low	35.1	Very low	134 Å²	134	133.1 Å²	133.1	82%	0.822	79%	0.786	S	S	*	*			trans	-149.6	126	150.2	-32.9	0	0	0	0	109.9
991	S	32.8	Very low	35.2	Very low	120 Å²	120	132.8 Å²	132.8	84%	0.839	79%	0.789	S	S	*	*			trans	-88.2	125.1	179.2	38.1	0	0	0	0	110.9
992	I	38.7	Very low	35.5	Very low	157 Å²	157	133.4 Å²	133.4	81%	0.805	79%	0.791	S	S	*	*			trans	-135	130.6	165.3	-55.3	-179	0	0	0	108.1
993	S	31.5	Very low	35.7	Very low	117 Å²	117	132 Å²	132	82%	0.818	78%	0.781	S	S	*	*			trans	-102.5	140.6	177.7	57.4	0	0	0	0	111.4
994	C	33.9	Very low	35.8	Very low	121 Å²	121	130.8 Å²	130.8	82%	0.818	78%	0.777	S	S	*	*			trans	-153.8	103.4	167.4	45.6	0	0	0	0	112.1
995	T	34.8	Very low	35.7	Very low	132 Å²	132	129.2 Å²	129.2	81%	0.81	77%	0.771	S	S	*	*			trans	-101.1	146	163.2	57.8	0	0	0	0	110.1
996	P	45.3	Very low	35.8	Very low	112 Å²	112	129.9 Å²	129.9	73%	0.727	77%	0.771	S	S	*	*				-125.6	150.4	126	40.4	-33.4	0	0	0	109.6
997	K	35.3	Very low	35.5	Very low	184 Å²	184	128.1 Å²	128.1	80%	0.8	77%	0.767	S	S	*	*				57.3	133.2	54.9	-69.1	179.2	176.2	175.3	0	110.6
998	V	39	Very low	35.5	Very low	111 Å²	111	128.3 Å²	128.3	67%	0.673	76%	0.763	S	S	*	*			cis	-151.5	166.7	12.2	-115	0	0	0	0	107
999	N	35.9	Very low	35.4	Very low	142 Å²	142	128.4 Å²	128.4	76%	0.759	76%	0.759	S	S	*	*			cis	-138.4	152	24.3	-65.5	-77.9	0	0	0	109.5
1000	N	31.2	Very low	35.5	Very low	136 Å²	136	128.7 Å²	128.7	73%	0.727	76%	0.756	S	S	*	*			cis	81.9	144.8	43	-94.2	23.8	0	0	0	116.4
1001	T	36.1	Very low	35.5	Very low	129 Å²	129	128.1 Å²	128.1	79%	0.791	75%	0.753	S	S	*	*			trans	87.1	122.5	-179.3	-41.8	0	0	0	0	112.5
1002	I	37.8	Very low	35.9	Very low	147 Å²	147	129.9 Å²	129.9	75%	0.754	75%	0.753	S	S	*	*			cis	-166.5	160.7	-0.7	-118.1	-177.2	0	0	0	106.7
1003	I	38.3	Very low	36	Very low	125 Å²	125	129 Å²	129	64%	0.641	76%	0.755	S	S	*	*			cis	-164	159.9	-16.2	-149.3	177.3	0	0	0	109.3
1004	N	36.3	Very low	36.3	Very low	133 Å²	133	129.1 Å²	129.1	71%	0.711	75%	0.753	S	S	*	*			trans	57.4	140.8	168.5	-61.4	-4.1	0	0	0	118.7
1005	S	33.7	Very low	36.4	Very low	96 Å²	96	126.2 Å²	126.2	67%	0.671	73%	0.734	S	S	*	*			cis	105.5	138.5	8.4	80.9	0	0	0	0	117.2
1006	V	37.8	Very low	36.6	Very low	123 Å²	123	127.3 Å²	127.3	75%	0.745	73%	0.733	S	S	*	*			trans	85.1	87.1	163.8	-169.9	0	0	0	0	118.8
1007	T	31.9	Very low	36.3	Very low	119 Å²	119	127.5 Å²	127.5	73%	0.73	72%	0.719	S	S	*	*			trans	49.1	151.1	135.3	62.1	0	0	0	0	125.2
1008	T	31.4	Very low	36.6	Very low	124 Å²	124	124 Å²	124	76%	0.761	71%	0.71	S	S	*	*			trans	83.4	129.9	154.1	40	0	0	0	0	122.1
1009	T	35.3	Very low	36.6	Very low	117 Å²	117	126.1 Å²	126.1	72%	0.718	72%	0.716	S	S	*	*			trans	66.1	95.4	150.6	48.1	0	0	0	0	122.4
1010	T	32.8	Very low	36.8	Very low	123 Å²	123	124.8 Å²	124.8	76%	0.755	72%	0.715	S	S	*	*				68.9	144.4	126.3	56.9	0	0	0	0	123.4
1011	T	36.7	Very low	37	Very low	123 Å²	123	124.6 Å²	124.6	76%	0.755	72%	0.719	S	S	*	*			trans	105.6	97.8	157.8	67.9	0	0	0	0	120.2
1012	N	40.9	Very low	37	Very low	156 Å²	156	124.6 Å²	124.6	83%	0.834	72%	0.719	S	S	*	*			trans	50.9	100.9	132.8	-56.3	-1.9	0	0	0	121.8
1013	T	41.2	Very low	37	Very low	139 Å²	139	124.3 Å²	124.3	85%	0.853	72%	0.719	S	S	*	*			trans	-133.5	127.8	138.2	52.9	0	0	0	0	108.6
1014	P	36.8	Very low	36.7	Very low	120 Å²	120	125.4 Å²	125.4	78%	0.779	73%	0.726	S	S	*	*			trans	-84.5	132.3	-156.7	31.2	-35.9	0	0	0	114.9
1015	S	35.8	Very low	36.8	Very low	59 Å²	59	125.5 Å²	125.5	41%	0.413	73%	0.726	S	S	.	*			trans	-66.9	138.1	150.2	159.2	0	0	0	0	109	W1017 D1018	S1015-W1017 PolarHBondContact O-N 3.07Å; S1015-W1017 PolarHBondContact OG-N 3.4Å; S1015-D1018 WeakPolarHBondContact CB-OD2 3.47Å; S1015-D1018 PolarHBondContact O-N 3.33Å; S1015-D1018 PolarHBondContact OG-OD2 2.96Å
1016	I	38.5	Very low	37	Very low	155 Å²	155	127.2 Å²	127.2	80%	0.795	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	-1.5	-174.7	-162	169.2	0	0	0	113.9
1017	W	40.5	Very low	36.7	Very low	116 Å²	116	127.4 Å²	127.4	44%	0.439	72%	0.724	S	S	.	*	T	Hydrogen-bonded Turn	trans	-116.5	-7.5	176.8	-65.2	94.2	0	0	0	114.3	S1015 Q1085 R1119	S1015-W1017 PolarHBondContact O-N 3.07Å; S1015-W1017 PolarHBondContact OG-N 3.4Å; W1017-Q1085 VanDerWaalsContact CE3-NE2 3.28Å; W1017-R1119 VanDerWaalsContact CD1-NH1 3.32Å; W1017-R1119 VanDerWaalsContact CE2-CZ 3.43Å
1018	D	41.7	Very low	37.1	Very low	112 Å²	112	127 Å²	127	60%	0.599	72%	0.722	S	S	*	*			trans	-111.6	97.6	-171.6	-60	-60.3	0	0	0	111.5	S1015	S1015-D1018 WeakPolarHBondContact CB-OD2 3.47Å; S1015-D1018 PolarHBondContact O-N 3.33Å; S1015-D1018 PolarHBondContact OG-OD2 2.96Å
1019	L	38.3	Very low	37.4	Very low	154 Å²	154	128.1 Å²	128.1	81%	0.806	72%	0.723	S	S	*	*			trans	-132.1	123.2	175.1	-84.6	162.7	0	0	0	109.5
1020	P	39.3	Very low	37.4	Very low	115 Å²	115	128.8 Å²	128.8	75%	0.747	73%	0.732	S	S	*	*			trans	-77.1	144.6	-166.5	29.9	-35.9	0	0	0	113.7
1021	V	37.1	Very low	37.6	Very low	132 Å²	132	126 Å²	126	80%	0.8	73%	0.728	S	S	*	*			trans	-93	115.2	167.3	176.8	0	0	0	0	109.1
1022	T	35	Very low	37.7	Very low	128 Å²	128	127.5 Å²	127.5	79%	0.785	74%	0.737	S	S	*	*			trans	-141.9	154.8	165.4	47.9	0	0	0	0	110.2
1023	N	37	Very low	37.6	Very low	141 Å²	141	123.9 Å²	123.9	75%	0.754	74%	0.737	S	S	*	*			trans	-111.6	163.2	-169.5	-62.7	-46.7	0	0	0	112.4
1024	N	33.2	Very low	37.7	Very low	149 Å²	149	127.3 Å²	127.3	80%	0.797	74%	0.74	S	S	*	*			trans	66.9	157.3	165.7	-71.5	-12.1	0	0	0	117.5
1025	L	38	Very low	37.7	Very low	135 Å²	135	131.8 Å²	131.8	71%	0.707	75%	0.747	S	S	*	*			cis	-162.6	179.1	-36.6	-157.4	62.9	0	0	0	107.2
1026	D	36.9	Very low	37.7	Very low	131 Å²	131	132.4 Å²	132.4	70%	0.701	76%	0.763	S	S	*	*			trans	71.2	149.2	163.2	-67	-42.9	0	0	0	118.6
1027	N	33.4	Very low	37.6	Very low	127 Å²	127	130.9 Å²	130.9	68%	0.679	77%	0.766	S	S	*	*			cis	-161.1	179.4	-35.4	-146.2	-42.4	0	0	0	110.1
1028	T	39.7	Very low	37.4	Very low	111 Å²	111	131.3 Å²	131.3	68%	0.681	79%	0.787	S	S	*	*			trans	74.9	89.2	161.7	57.3	0	0	0	0	121.3
1029	N	36.3	Very low	37.3	Very low	148 Å²	148	135.7 Å²	135.7	79%	0.791	80%	0.8	S	S	*	*				72.7	136.1	117.3	-70.3	-13.5	0	0	0	125.2
1030	S	36.8	Very low	37.5	Very low	130 Å²	130	138.4 Å²	138.4	91%	0.909	81%	0.806	S	S	*	*			trans	72.6	129.2	160.1	72.6	0	0	0	0	118.1
1031	G	37.1	Very low	37.8	Very low	64 Å²	64	143 Å²	143	66%	0.66	81%	0.814	S	S	*	*			cis	-171.4	167.1	-6.2	0	0	0	0	0	115.1
1032	T	39	Very low	38.3	Very low	156 Å²	156	146.1 Å²	146.1	96%	0.957	82%	0.817	S	S	*	*			trans	53.4	100.4	165.7	55.8	0	0	0	0	119.4
1033	G	38.5	Very low	39	Very low	80 Å²	80	148.3 Å²	148.3	83%	0.825	82%	0.815	S	S	*	*			trans	-164.8	147	166.1	0	0	0	0	0	112.2
1034	K	41.8	Very low	39.5	Very low	210 Å²	210	148.2 Å²	148.2	91%	0.913	82%	0.815	S	S	*	*			trans	-98.9	157	-173	-80.1	176.9	176.9	171.7	0	114.1
1035	K	36.8	Very low	40.3	Very low	214 Å²	214	148.2 Å²	148.2	93%	0.93	80%	0.804	S	S	*	*			trans	-2.1	141.7	159.8	-56.4	-177.8	177.4	-173.3	0	118.1
1036	G	37.4	Very low	40.7	Very low	72 Å²	72	148.1 Å²	148.1	74%	0.742	80%	0.8	S	S	*	*			cis	160.5	148.8	-4.5	0	0	0	0	0	114.6
1037	S	36	Very low	41.5	Very low	123 Å²	123	146.9 Å²	146.9	86%	0.86	80%	0.796	S	S	*	*			trans	40.6	107.9	164.3	-160.9	0	0	0	0	120.8
1038	S	36.2	Very low	42.4	Very low	125 Å²	125	144.4 Å²	144.4	87%	0.874	79%	0.789	S	S	*	*			trans	-137.9	76.5	165.9	53.3	0	0	0	0	112.1
1039	K	39.2	Very low	43.3	Very low	204 Å²	204	142.8 Å²	142.8	89%	0.887	78%	0.776	S	S	*	*			trans	-138.5	60.4	-170	-153	172.1	-171.7	176.2	0	115.1
1040	K	43.4	Very low	44.6	Very low	212 Å²	212	141.3 Å²	141.3	92%	0.922	77%	0.767	S	S	*	*			trans	-135.5	12.4	-178.7	-140.6	171.3	-175.9	176.3	0	116.8
1041	K	45.4	Very low	46.4	Very low	210 Å²	210	138.1 Å²	138.1	91%	0.913	74%	0.744	S	S	*	*			trans	-99.4	4.7	-170.2	-153	176.7	177.1	-179.5	0	116.8
1042	K	47.3	Very low	48.4	Very low	199 Å²	199	136.2 Å²	136.2	87%	0.865	72%	0.722	S	S	*	*	S	Bend	trans	-91	-17.3	-172.3	-151.9	175.5	-179.4	-174.6	0	116
1043	K	50	Low	50.5	Low	173 Å²	173	132 Å²	132	75%	0.752	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-84.4	-15.3	-170.9	-68	-161.1	171.3	-160.3	0	116.8	R1045	K1043-R1045 VanDerWaalsContact C-N 3.34Å; K1043-R1045 PolarHBondContact O-N 3.04Å
1044	N	47.6	Very low	52.7	Low	140 Å²	140	132.6 Å²	132.6	75%	0.749	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-82.2	-5.1	-179.5	-83.4	31	0	0	0	114.5
1045	R	48.6	Very low	54.8	Low	148 Å²	148	128.5 Å²	128.5	56%	0.558	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-83.9	-21	-175.5	-149.5	176	94.9	131.1	-0.1	113.9	K1043 S1048 L1049	K1043-R1045 VanDerWaalsContact C-N 3.34Å; K1043-R1045 PolarHBondContact O-N 3.04Å; R1045-S1048 WeakPolarHBondContact CA-OG 3.29Å; R1045-S1048 PolarHBondContact O-N 3.12Å; R1045-S1048 PolarHBondContact O-OG 3.5Å; R1045-L1049 WeakPolarHBondContact O-CD1 3.3Å; R1045-L1049 VanDerWaalsContact O-CG 3.31Å; R1045-L1049 WeakPolarHBondContact O-CG 3.23Å; R1045-L1049 PolarHBondContact O-N 2.91Å
1046	E	47.4	Very low	57.4	Low	134 Å²	134	118.8 Å²	118.8	63%	0.626	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	-41	175.9	-72	159.8	138.4	0	0	110.9	S1048 L1049 L1050	E1046-S1048 PolarHBondContact O-N 3.38Å; E1046-L1049 PolarHBondContact O-N 3.4Å; E1046-L1050 PolarHBondContact O-N 2.94Å
1047	V	53.1	Low	59.9	Low	104 Å²	104	116.2 Å²	116.2	63%	0.63	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.3	-35	176.4	-172.1	0	0	0	0	112.4
1048	S	52	Low	62.4	Low	75 Å²	75	115.9 Å²	115.9	52%	0.524	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.2	-11	175.2	50.1	0	0	0	0	115	R1045 E1046	R1045-S1048 WeakPolarHBondContact CA-OG 3.29Å; R1045-S1048 PolarHBondContact O-N 3.12Å; R1045-S1048 PolarHBondContact O-OG 3.5Å; E1046-S1048 PolarHBondContact O-N 3.38Å
1049	L	59.6	Low	65	Low	78 Å²	78	111.9 Å²	111.9	41%	0.408	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-20.4	-179.5	-75.8	164.2	0	0	0	112.9	R1045 E1046 A1052 K1053	R1045-L1049 WeakPolarHBondContact O-CD1 3.3Å; R1045-L1049 VanDerWaalsContact O-CG 3.31Å; R1045-L1049 WeakPolarHBondContact O-CG 3.23Å; R1045-L1049 PolarHBondContact O-N 2.91Å; E1046-L1049 PolarHBondContact O-N 3.4Å; L1049-A1052 PolarHBondContact O-N 2.9Å; L1049-K1053 PolarHBondContact O-N 3.11Å
1050	L	63.5	Low	67.5	Low	116 Å²	116	102.1 Å²	102.1	61%	0.607	49%	0.493	S	S	*	.	H	α-helix	trans	-54.1	-55.6	178.3	-72.4	166	0	0	0	114.1	E1046 A1052 K1053 E1054	E1046-L1050 PolarHBondContact O-N 2.94Å; L1050-A1052 PolarHBondContact O-N 3.13Å; L1050-K1053 WeakPolarHBondContact O-CB 3.4Å; L1050-K1053 PolarHBondContact O-N 2.75Å; L1050-E1054 PolarHBondContact O-N 3.34Å
1051	P	75.2	Confident	69.7	Low	63 Å²	63	94.8 Å²	94.8	41%	0.409	46%	0.462	S	S	.	.	H	α-helix	trans	-64.2	-28.9	-178.8	25	-34.8	0	0	0	112.8	E1054 E1055	P1051-E1054 PolarHBondContact O-N 2.8Å; P1051-E1055 PolarHBondContact O-N 3.12Å
1052	A	79	Confident	71.7	Confident	24 Å²	24	88.1 Å²	88.1	20%	0.198	44%	0.442	C	S	.	.	H	α-helix	trans	-72.9	-29.8	174.3	0	0	0	0	0	112.8	L1049 L1050 L1056 F1118	L1049-A1052 PolarHBondContact O-N 2.9Å; L1050-A1052 PolarHBondContact O-N 3.13Å; A1052-L1056 VanDerWaalsContact O-CB 3.27Å; A1052-L1056 WeakPolarHBondContact O-CB 3.2Å; A1052-L1056 PolarHBondContact O-N 2.74Å; A1052-F1118 HydrophobicContact CB-CB 4.39Å; A1052-F1118 HydrophobicContact CB-CD1 4.21Å
1053	K	82.7	Confident	73.7	Confident	68 Å²	68	82 Å²	82	30%	0.296	42%	0.417	S	S	.	.	H	α-helix	trans	-69.1	-43.1	167.7	-162.8	-162.2	-176.1	-164.9	0	110.2	L1049 L1050 L1056 A1057 D1079 C1082 E1083	L1049-K1053 PolarHBondContact O-N 3.11Å; L1050-K1053 WeakPolarHBondContact O-CB 3.4Å; L1050-K1053 PolarHBondContact O-N 2.75Å; K1053-L1056 PolarHBondContact O-N 3.15Å; K1053-A1057 VanDerWaalsContact O-CB 3.25Å; K1053-A1057 WeakPolarHBondContact O-CB 3.37Å; K1053-A1057 PolarHBondContact O-N 3.34Å; K1053-D1079 IonicContact NZ-OD1 3.46Å; K1053-D1079 PolarHBondContact NZ-OD1 3.11Å; K1053-C1082 HydrophobicContact CD-CB 4.37Å; K1053-C1082 HydrophobicContact CG-CB 4.06Å; K1053-E1083 IonicContact NZ-OE1 3.75Å
1054	E	84.2	Confident	75.3	Confident	93 Å²	93	73.8 Å²	73.8	44%	0.435	38%	0.381	S	S	.	.	H	α-helix	trans	-61	-50.5	-179.4	-165.4	-179.7	175.6	0	0	112	L1050 P1051 L1056 A1057 H1058	L1050-E1054 PolarHBondContact O-N 3.34Å; P1051-E1054 PolarHBondContact O-N 2.8Å; E1054-L1056 PolarHBondContact O-N 3.08Å; E1054-A1057 PolarHBondContact O-N 3.11Å; E1054-H1058 PolarHBondContact O-N 3.49Å
1055	E	87.1	Confident	77	Confident	124 Å²	124	71.2 Å²	71.2	58%	0.579	37%	0.374	S	S	*	.	H	α-helix	trans	-65.7	-34.9	176.1	-74	-172.8	-145.1	0	0	113.3	P1051 W1059 F1118	P1051-E1055 PolarHBondContact O-N 3.12Å; E1055-W1059 WeakPolarHBondContact O-CB 3.29Å; E1055-W1059 PolarHBondContact O-N 3.33Å; E1055-W1059 VanDerWaalsContact O-N 3.15Å; E1055-F1118 HydrophobicContact CB-CE1 3.7Å; E1055-F1118 HydrophobicContact CB-CZ 3.57Å; E1055-F1118 WeakPolarHBondContact OE2-CE1 3.22Å
1056	L	89.8	Confident	78.4	Confident	10 Å²	10	67 Å²	67	5%	0.052	37%	0.367	C	S	.	.	H	α-helix	trans	-67.9	-43	174.1	-179.2	59.7	0	0	0	111	A1052 K1053 E1054 W1059 C1060 F1111 K1114 R1115 F1118	A1052-L1056 VanDerWaalsContact O-CB 3.27Å; A1052-L1056 WeakPolarHBondContact O-CB 3.2Å; A1052-L1056 PolarHBondContact O-N 2.74Å; K1053-L1056 PolarHBondContact O-N 3.15Å; E1054-L1056 PolarHBondContact O-N 3.08Å; L1056-W1059 HydrophobicContact CD1-CE3 4.43Å; L1056-W1059 PolarHBondContact O-N 3.06Å; L1056-C1060 PolarHBondContact O-N 3.23Å; L1056-C1060 PolarHBondContact O-SG 3.27Å; L1056-F1111 HydrophobicContact CD1-CD2 3.88Å; L1056-F1111 HydrophobicContact CD1-CE2 3.7Å; L1056-F1111 HydrophobicContact CD2-CE2 3.91Å; L1056-F1111 HydrophobicContact CD2-CZ 4.43Å; L1056-F1111 HydrophobicContact CG-CE2 3.87Å; L1056-K1114 HydrophobicContact CD1-CB 3.89Å; L1056-R1115 HydrophobicContact CD1-CB 4.48Å; L1056-R1115 HydrophobicContact CD2-CB 4Å; L1056-R1115 HydrophobicContact CD2-CG 4.02Å; L1056-F1118 HydrophobicContact CB-CD2 3.9Å; L1056-F1118 HydrophobicContact CB-CE2 4.03Å; L1056-F1118 HydrophobicContact CD1-CD2 4Å; L1056-F1118 HydrophobicContact CD1-CE2 4.2Å; L1056-F1118 HydrophobicContact CG-CD2 4.42Å
1057	A	90.4	Very high	79.9	Confident	18 Å²	18	61.7 Å²	61.7	15%	0.149	34%	0.343	C	S	.	.	H	α-helix	trans	-61.3	-53.8	178.6	0	0	0	0	0	111.2	K1053 E1054 W1059 C1060 E1061 V1078	K1053-A1057 VanDerWaalsContact O-CB 3.25Å; K1053-A1057 WeakPolarHBondContact O-CB 3.37Å; K1053-A1057 PolarHBondContact O-N 3.34Å; E1054-A1057 PolarHBondContact O-N 3.11Å; A1057-W1059 VanDerWaalsContact C-N 3.26Å; A1057-W1059 PolarHBondContact O-N 2.89Å; A1057-C1060 CarbonylContact O-C 3.51Å; A1057-C1060 WeakPolarHBondContact O-CA 3.47Å; A1057-C1060 WeakPolarHBondContact O-CB 3.47Å; A1057-C1060 PolarHBondContact O-N 2.97Å; A1057-E1061 WeakPolarHBondContact O-CG 3.23Å; A1057-E1061 PolarHBondContact O-N 2.8Å; A1057-V1078 HydrophobicContact CB-CG1 3.63Å
1058	H	88.2	Confident	80.7	Confident	115 Å²	115	62.6 Å²	62.6	53%	0.532	35%	0.35	S	S	.	.	H	α-helix	trans	-58.8	-34.2	176.4	-82.2	-29.5	0	0	0	113.3	E1054 E1061 S1062	E1054-H1058 PolarHBondContact O-N 3.49Å; H1058-E1061 IonicContact CE1-OE2 2.7Å; H1058-E1061 IonicContact CG-OE2 3.4Å; H1058-E1061 IonicContact ND1-OE2 3.48Å; H1058-E1061 PolarHBondContact ND1-OE2 3.09Å; H1058-S1062 VanDerWaalsContact O-CB 3.28Å; H1058-S1062 WeakPolarHBondContact O-CB 3.31Å; H1058-S1062 PolarHBondContact O-N 3.1Å
1059	W	91.6	Very high	81.6	Confident	41 Å²	41	61 Å²	61	16%	0.155	34%	0.336	C	S	.	.	H	α-helix	trans	-67.4	-39.8	172.4	178.5	77	0	0	0	112.2	E1055 L1056 A1057 S1062 Q1063 F1107 D1110 F1111 K1114	E1055-W1059 WeakPolarHBondContact O-CB 3.29Å; E1055-W1059 PolarHBondContact O-N 3.33Å; E1055-W1059 VanDerWaalsContact O-N 3.15Å; L1056-W1059 HydrophobicContact CD1-CE3 4.43Å; L1056-W1059 PolarHBondContact O-N 3.06Å; A1057-W1059 VanDerWaalsContact C-N 3.26Å; A1057-W1059 PolarHBondContact O-N 2.89Å; W1059-S1062 PolarHBondContact O-N 3.49Å; W1059-Q1063 HydrophobicContact CD2-CG 4.14Å; W1059-Q1063 HydrophobicContact CH2-CG 3.88Å; W1059-Q1063 HydrophobicContact CZ2-CG 3.44Å; W1059-Q1063 VanDerWaalsContact CZ2-CG 3.44Å; W1059-Q1063 HydrophobicContact CZ3-CG 4.38Å; W1059-Q1063 WeakPolarHBondContact O-CG 3.41Å; W1059-Q1063 PolarHBondContact O-N 3.34Å; W1059-F1107 HydrophobicContact CH2-CD2 4.05Å; W1059-F1107 HydrophobicContact CH2-CE2 4.01Å; W1059-F1107 HydrophobicContact CZ3-CD2 4.32Å; W1059-F1107 AromaticContact CZ3-CE2 3.81Å; W1059-F1107 HydrophobicContact CZ3-CE2 3.81Å; W1059-D1110 HydrophobicContact CH2-CB 3.71Å; W1059-D1110 HydrophobicContact CZ2-CB 3.86Å; W1059-F1111 HydrophobicContact CH2-CB 4.29Å; W1059-F1111 HydrophobicContact CZ3-CB 3.87Å; W1059-F1111 HydrophobicContact CZ3-CD2 4.03Å; W1059-F1111 HydrophobicContact CZ3-CG 4.47Å; W1059-K1114 VanDerWaalsContact CD1-CE 3.46Å; W1059-K1114 HydrophobicContact CD2-CD 3.75Å; W1059-K1114 HydrophobicContact CD2-CG 3.8Å; W1059-K1114 HydrophobicContact CE3-CB 4.23Å; W1059-K1114 HydrophobicContact CE3-CD 4.23Å; W1059-K1114 HydrophobicContact CE3-CG 3.93Å; W1059-K1114 HydrophobicContact CG-CD 3.86Å; W1059-K1114 HydrophobicContact CG-CG 4.44Å; W1059-K1114 HydrophobicContact CH2-CG 4.19Å; W1059-K1114 HydrophobicContact CZ2-CG 4.04Å; W1059-K1114 HydrophobicContact CZ3-CB 4.35Å; W1059-K1114 HydrophobicContact CZ3-CG 4.15Å
1060	C	90.9	Very high	81.8	Confident	0 Å²	0	63 Å²	63	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-64.8	-47.2	175.5	-62.3	0	0	0	0	111.5	L1056 A1057 S1062 Q1063 L1064 V1078 F1111	L1056-C1060 PolarHBondContact O-N 3.23Å; L1056-C1060 PolarHBondContact O-SG 3.27Å; A1057-C1060 CarbonylContact O-C 3.51Å; A1057-C1060 WeakPolarHBondContact O-CA 3.47Å; A1057-C1060 WeakPolarHBondContact O-CB 3.47Å; A1057-C1060 PolarHBondContact O-N 2.97Å; C1060-S1062 VanDerWaalsContact C-N 3.3Å; C1060-S1062 PolarHBondContact O-N 3.35Å; C1060-Q1063 PolarHBondContact O-N 3.37Å; C1060-L1064 HydrophobicContact CB-CD1 4.45Å; C1060-L1064 VanDerWaalsContact O-CB 3.26Å; C1060-L1064 WeakPolarHBondContact O-CB 3.49Å; C1060-L1064 VanDerWaalsContact O-CG 3.28Å; C1060-L1064 WeakPolarHBondContact O-CG 3.38Å; C1060-L1064 PolarHBondContact O-N 3.16Å; C1060-V1078 HydrophobicContact CB-CB 4.45Å; C1060-V1078 HydrophobicContact CB-CG1 3.97Å; C1060-V1078 HydrophobicContact CB-CG2 3.71Å; C1060-F1111 WeakPolarHBondContact SG-CD2 3.42Å; C1060-F1111 WeakPolarHBondContact SG-CE2 3.33Å
1061	E	90	Very high	82.2	Confident	58 Å²	58	61.3 Å²	61.3	27%	0.271	37%	0.367	S	S	.	.	H	α-helix	trans	-53.5	-48.1	173.4	-68.4	177.7	146	0	0	111.2	A1057 H1058 Q1063 L1064 S1065 L1074 V1078	A1057-E1061 WeakPolarHBondContact O-CG 3.23Å; A1057-E1061 PolarHBondContact O-N 2.8Å; H1058-E1061 IonicContact CE1-OE2 2.7Å; H1058-E1061 IonicContact CG-OE2 3.4Å; H1058-E1061 IonicContact ND1-OE2 3.48Å; H1058-E1061 PolarHBondContact ND1-OE2 3.09Å; E1061-Q1063 PolarHBondContact O-N 2.88Å; E1061-L1064 PolarHBondContact O-N 3.15Å; E1061-S1065 WeakPolarHBondContact O-CB 3.47Å; E1061-S1065 PolarHBondContact O-N 2.82Å; E1061-S1065 PolarHBondContact O-OG 3.14Å; E1061-L1074 HydrophobicContact CB-CD2 4.27Å; E1061-L1074 HydrophobicContact CG-CD2 4.47Å; E1061-L1074 HydrophobicContact CG-CG 4.36Å; E1061-V1078 HydrophobicContact CG-CG1 4.43Å; E1061-V1078 HydrophobicContact CG-CG2 4.04Å
1062	S	88.6	Confident	82.2	Confident	69 Å²	69	61.1 Å²	61.1	48%	0.483	36%	0.364	S	S	.	.	H	α-helix	trans	-57.7	-47.3	177.6	177.8	0	0	0	0	112.5	H1058 W1059 C1060 S1065	H1058-S1062 VanDerWaalsContact O-CB 3.28Å; H1058-S1062 WeakPolarHBondContact O-CB 3.31Å; H1058-S1062 PolarHBondContact O-N 3.1Å; W1059-S1062 PolarHBondContact O-N 3.49Å; C1060-S1062 VanDerWaalsContact C-N 3.3Å; C1060-S1062 PolarHBondContact O-N 3.35Å; S1062-S1065 PolarHBondContact O-OG 3.38Å
1063	Q	87.8	Confident	82.4	Confident	72 Å²	72	64.8 Å²	64.8	34%	0.336	38%	0.381	S	S	.	.	H	α-helix	trans	-69.8	-45.2	178.8	-63.9	-48	-74.4	0	0	112.8	W1059 C1060 E1061 S1066 F1107	W1059-Q1063 HydrophobicContact CD2-CG 4.14Å; W1059-Q1063 HydrophobicContact CH2-CG 3.88Å; W1059-Q1063 HydrophobicContact CZ2-CG 3.44Å; W1059-Q1063 VanDerWaalsContact CZ2-CG 3.44Å; W1059-Q1063 HydrophobicContact CZ3-CG 4.38Å; W1059-Q1063 WeakPolarHBondContact O-CG 3.41Å; W1059-Q1063 PolarHBondContact O-N 3.34Å; C1060-Q1063 PolarHBondContact O-N 3.37Å; E1061-Q1063 PolarHBondContact O-N 2.88Å; Q1063-S1066 WeakPolarHBondContact O-CB 3.49Å; Q1063-S1066 PolarHBondContact O-N 2.97Å; Q1063-S1066 PolarHBondContact O-OG 3.36Å; Q1063-F1107 HydrophobicContact CB-CD2 3.67Å; Q1063-F1107 HydrophobicContact CB-CE2 3.83Å; Q1063-F1107 HydrophobicContact CG-CD2 4.19Å; Q1063-F1107 HydrophobicContact CG-CE2 4.38Å
1064	L	84.8	Confident	82.5	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-75	-26.6	-173.9	-67.3	174.6	0	0	0	112.8	C1060 E1061 S1066 I1067 L1074 L1077 V1078 L1081 L1098 F1107	C1060-L1064 HydrophobicContact CB-CD1 4.45Å; C1060-L1064 VanDerWaalsContact O-CB 3.26Å; C1060-L1064 WeakPolarHBondContact O-CB 3.49Å; C1060-L1064 VanDerWaalsContact O-CG 3.28Å; C1060-L1064 WeakPolarHBondContact O-CG 3.38Å; C1060-L1064 PolarHBondContact O-N 3.16Å; E1061-L1064 PolarHBondContact O-N 3.15Å; L1064-S1066 PolarHBondContact O-N 3.28Å; L1064-I1067 HydrophobicContact CD2-CD1 4.18Å; L1064-I1067 WeakPolarHBondContact O-CB 3.4Å; L1064-I1067 PolarHBondContact O-N 3.11Å; L1064-I1067 VanDerWaalsContact O-O 3.08Å; L1064-L1074 HydrophobicContact CB-CD1 3.45Å; L1064-L1074 VanDerWaalsContact CB-CD1 3.45Å; L1064-L1074 HydrophobicContact CD1-CD1 3.9Å; L1064-L1074 HydrophobicContact CG-CD1 4.33Å; L1064-L1077 HydrophobicContact CD1-CD2 3.93Å; L1064-L1077 HydrophobicContact CD1-CG 4.49Å; L1064-V1078 HydrophobicContact CD1-CG2 4.03Å; L1064-L1081 HydrophobicContact CD1-CD1 4.22Å; L1064-L1098 HydrophobicContact CD2-CD1 3.53Å; L1064-F1107 HydrophobicContact CD1-CE1 4.27Å; L1064-F1107 HydrophobicContact CD1-CE2 4.41Å; L1064-F1107 HydrophobicContact CD1-CZ 3.78Å; L1064-F1107 HydrophobicContact CD2-CD1 3.97Å; L1064-F1107 HydrophobicContact CD2-CD2 4.31Å; L1064-F1107 HydrophobicContact CD2-CE1 3.67Å; L1064-F1107 HydrophobicContact CD2-CE2 4.03Å; L1064-F1107 HydrophobicContact CD2-CG 4.29Å; L1064-F1107 HydrophobicContact CD2-CZ 3.71Å; L1064-F1107 HydrophobicContact CG-CE1 4.18Å; L1064-F1107 HydrophobicContact CG-CE2 3.91Å; L1064-F1107 HydrophobicContact CG-CZ 3.69Å
1065	S	82.3	Confident	82.6	Confident	86 Å²	86	62.4 Å²	62.4	60%	0.601	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-22.5	170.6	70.2	0	0	0	0	113.5	E1061 S1062 I1067	E1061-S1065 WeakPolarHBondContact O-CB 3.47Å; E1061-S1065 PolarHBondContact O-N 2.82Å; E1061-S1065 PolarHBondContact O-OG 3.14Å; S1062-S1065 PolarHBondContact O-OG 3.38Å; S1065-I1067 VanDerWaalsContact C-N 3.32Å
1066	S	78.8	Confident	82.7	Confident	58 Å²	58	61 Å²	61	41%	0.406	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-4.8	175.5	81.1	0	0	0	0	114.3	Q1063 L1064 R1103	Q1063-S1066 WeakPolarHBondContact O-CB 3.49Å; Q1063-S1066 PolarHBondContact O-N 2.97Å; Q1063-S1066 PolarHBondContact O-OG 3.36Å; L1064-S1066 PolarHBondContact O-N 3.28Å; S1066-R1103 PolarHBondContact O-NH1 3Å
1067	I	77.6	Confident	82.7	Confident	24 Å²	24	60.7 Å²	60.7	12%	0.123	38%	0.376	C	S	.	.	S	Bend	trans	-113.7	127.3	-177.4	-57.8	-177	0	0	0	108.3	L1064 S1065 L1069 R1103 I1104	L1064-I1067 HydrophobicContact CD2-CD1 4.18Å; L1064-I1067 WeakPolarHBondContact O-CB 3.4Å; L1064-I1067 PolarHBondContact O-N 3.11Å; L1064-I1067 VanDerWaalsContact O-O 3.08Å; S1065-I1067 VanDerWaalsContact C-N 3.32Å; I1067-L1069 HydrophobicContact CG2-CD2 4.47Å; I1067-L1069 PolarHBondContact O-N 3.06Å; I1067-R1103 HydrophobicContact CD1-CG 4.29Å; I1067-I1104 HydrophobicContact CD1-CG1 4.31Å
1068	P	71.4	Confident	82.8	Confident	122 Å²	122	60 Å²	60	79%	0.792	37%	0.37	S	S	*	.			trans	-69.9	99.6	178.6	28.2	-33.6	0	0	0	110.6	S1070	P1068-S1070 PolarHBondContact O-N 3.3Å
1069	L	70.2	Confident	82.8	Confident	43 Å²	43	58.1 Å²	58.1	23%	0.225	36%	0.364	C	S	.	.			trans	-73.5	108.1	175.1	-55.5	-172.7	0	0	0	109.9	I1067 G1071 L1074 L1077 L1098	I1067-L1069 HydrophobicContact CG2-CD2 4.47Å; I1067-L1069 PolarHBondContact O-N 3.06Å; L1069-G1071 PolarHBondContact O-N 3.28Å; L1069-L1074 HydrophobicContact CD1-CB 3.83Å; L1069-L1074 HydrophobicContact CD1-CD1 3.93Å; L1069-L1074 HydrophobicContact CD1-CG 4.44Å; L1069-L1077 HydrophobicContact CD1-CD2 4.06Å; L1069-L1077 HydrophobicContact CD2-CD2 4.2Å; L1069-L1098 HydrophobicContact CD2-CD2 3.31Å
1070	S	64.9	Low	82.7	Confident	119 Å²	119	59.6 Å²	59.6	83%	0.832	38%	0.375	S	S	*	.	S	Bend	trans	-80.9	83.7	178.2	55.4	0	0	0	0	111.3	P1068	P1068-S1070 PolarHBondContact O-N 3.3Å
1071	G	70.3	Confident	82.7	Confident	81 Å²	81	59.6 Å²	59.6	84%	0.835	38%	0.375	S	S	*	.	S	Bend	trans	85.3	18.1	170.6	0	0	0	0	0	116.1	L1069	L1069-G1071 PolarHBondContact O-N 3.28Å
1072	V	76.3	Confident	82.6	Confident	58 Å²	58	57.7 Å²	57.7	35%	0.352	37%	0.368	S	S	.	.			trans	-117.2	123.2	172.2	-173.7	0	0	0	0	108.9	L1074 L1077	V1072-L1074 PolarHBondContact O-N 3.4Å; V1072-L1077 HydrophobicContact CG1-CB 4.02Å; V1072-L1077 HydrophobicContact CG1-CD1 4.28Å
1073	D	81.8	Confident	82.6	Confident	102 Å²	102	60.6 Å²	60.6	55%	0.545	37%	0.374	S	S	.	.			trans	-67.2	127.6	178.4	-74.2	-44.9	0	0	0	111.4	T1076 L1077	D1073-T1076 PolarHBondContact O-N 3.09Å; D1073-L1077 PolarHBondContact O-N 2.72Å
1074	L	85.9	Confident	82.6	Confident	39 Å²	39	59.1 Å²	59.1	20%	0.204	37%	0.368	C	S	.	.	H	α-helix	trans	-58.4	-46.6	-174.5	175.6	59.7	0	0	0	113.4	E1061 L1064 L1069 V1072 T1076 L1077 V1078	E1061-L1074 HydrophobicContact CB-CD2 4.27Å; E1061-L1074 HydrophobicContact CG-CD2 4.47Å; E1061-L1074 HydrophobicContact CG-CG 4.36Å; L1064-L1074 HydrophobicContact CB-CD1 3.45Å; L1064-L1074 VanDerWaalsContact CB-CD1 3.45Å; L1064-L1074 HydrophobicContact CD1-CD1 3.9Å; L1064-L1074 HydrophobicContact CG-CD1 4.33Å; L1069-L1074 HydrophobicContact CD1-CB 3.83Å; L1069-L1074 HydrophobicContact CD1-CD1 3.93Å; L1069-L1074 HydrophobicContact CD1-CG 4.44Å; V1072-L1074 PolarHBondContact O-N 3.4Å; L1074-T1076 PolarHBondContact O-N 3.08Å; L1074-L1077 PolarHBondContact O-N 3.46Å; L1074-V1078 HydrophobicContact CD1-CG2 3.81Å; L1074-V1078 HydrophobicContact CG-CG2 4.45Å; L1074-V1078 WeakPolarHBondContact O-CB 3.32Å; L1074-V1078 VanDerWaalsContact O-CG2 3.29Å; L1074-V1078 WeakPolarHBondContact O-CG2 3.36Å; L1074-V1078 PolarHBondContact O-N 3.29Å
1075	P	87	Confident	82.3	Confident	72 Å²	72	63.4 Å²	63.4	47%	0.468	39%	0.388	S	S	.	.	H	α-helix	trans	-61.5	-43.8	178.2	-23.9	35.7	0	0	0	112.2	L1077 V1078 D1079	P1075-L1077 VanDerWaalsContact C-N 3.35Å; P1075-L1077 PolarHBondContact O-N 2.87Å; P1075-V1078 PolarHBondContact O-N 2.93Å; P1075-V1078 VanDerWaalsContact O-N 3.15Å; P1075-D1079 PolarHBondContact O-N 2.89Å
1076	T	89.1	Confident	82.4	Confident	95 Å²	95	61.3 Å²	61.3	58%	0.583	38%	0.375	S	S	*	.	H	α-helix	trans	-62.8	-40.1	179.1	-47.7	0	0	0	0	112.1	D1073 L1074 L1080	D1073-T1076 PolarHBondContact O-N 3.09Å; L1074-T1076 PolarHBondContact O-N 3.08Å; T1076-L1080 PolarHBondContact O-N 3.47Å; T1076-L1080 VanDerWaalsContact O-N 3.16Å
1077	L	89.4	Confident	82.8	Confident	2 Å²	2	62.2 Å²	62.2	1%	0.01	38%	0.379	C	S	.	.	H	α-helix	trans	-63	-44.6	173.4	-179.7	68.2	0	0	0	111.3	L1064 L1069 V1072 D1073 L1074 P1075 L1081 F1093 L1098	L1064-L1077 HydrophobicContact CD1-CD2 3.93Å; L1064-L1077 HydrophobicContact CD1-CG 4.49Å; L1069-L1077 HydrophobicContact CD1-CD2 4.06Å; L1069-L1077 HydrophobicContact CD2-CD2 4.2Å; V1072-L1077 HydrophobicContact CG1-CB 4.02Å; V1072-L1077 HydrophobicContact CG1-CD1 4.28Å; D1073-L1077 PolarHBondContact O-N 2.72Å; L1074-L1077 PolarHBondContact O-N 3.46Å; P1075-L1077 VanDerWaalsContact C-N 3.35Å; P1075-L1077 PolarHBondContact O-N 2.87Å; L1077-L1081 HydrophobicContact CD1-CD1 4.39Å; L1077-L1081 HydrophobicContact CG-CD1 4.06Å; L1077-L1081 WeakPolarHBondContact O-CB 3.47Å; L1077-L1081 WeakPolarHBondContact O-CG 3.47Å; L1077-L1081 PolarHBondContact O-N 3.25Å; L1077-F1093 HydrophobicContact CD1-CE1 3.59Å; L1077-F1093 HydrophobicContact CD1-CZ 3.79Å; L1077-L1098 HydrophobicContact CD2-CD2 3.88Å
1078	V	91.2	Very high	83.3	Confident	3 Å²	3	66.4 Å²	66.4	2%	0.018	40%	0.402	C	S	.	.	H	α-helix	trans	-68.1	-40.8	-179.6	169	0	0	0	0	112.2	A1057 C1060 E1061 L1064 L1074 P1075 L1081 C1082	A1057-V1078 HydrophobicContact CB-CG1 3.63Å; C1060-V1078 HydrophobicContact CB-CB 4.45Å; C1060-V1078 HydrophobicContact CB-CG1 3.97Å; C1060-V1078 HydrophobicContact CB-CG2 3.71Å; E1061-V1078 HydrophobicContact CG-CG1 4.43Å; E1061-V1078 HydrophobicContact CG-CG2 4.04Å; L1064-V1078 HydrophobicContact CD1-CG2 4.03Å; L1074-V1078 HydrophobicContact CD1-CG2 3.81Å; L1074-V1078 HydrophobicContact CG-CG2 4.45Å; L1074-V1078 WeakPolarHBondContact O-CB 3.32Å; L1074-V1078 VanDerWaalsContact O-CG2 3.29Å; L1074-V1078 WeakPolarHBondContact O-CG2 3.36Å; L1074-V1078 PolarHBondContact O-N 3.29Å; P1075-V1078 PolarHBondContact O-N 2.93Å; P1075-V1078 VanDerWaalsContact O-N 3.15Å; V1078-L1081 PolarHBondContact O-N 3.06Å; V1078-C1082 WeakPolarHBondContact O-CB 3.37Å; V1078-C1082 PolarHBondContact O-N 2.75Å; V1078-C1082 PolarHBondContact O-SG 3.39Å; V1078-C1082 VanDerWaalsContact O-SG 3.35Å
1079	D	88.6	Confident	84.2	Confident	76 Å²	76	65.1 Å²	65.1	41%	0.406	39%	0.385	S	S	.	.	H	α-helix	trans	-62.9	-47.3	175.9	-99.4	-39.6	0	0	0	111.3	K1053 P1075 L1081 C1082 E1083	K1053-D1079 IonicContact NZ-OD1 3.46Å; K1053-D1079 PolarHBondContact NZ-OD1 3.11Å; P1075-D1079 PolarHBondContact O-N 2.89Å; D1079-L1081 VanDerWaalsContact C-N 3.34Å; D1079-L1081 PolarHBondContact O-N 3.34Å; D1079-C1082 CarbonylContact O-C 3.6Å; D1079-C1082 PolarHBondContact O-N 3Å; D1079-C1082 VanDerWaalsContact O-N 3.1Å; D1079-E1083 WeakPolarHBondContact O-CG 3.48Å; D1079-E1083 PolarHBondContact O-N 3.01Å
1080	L	90.6	Very high	85.2	Confident	73 Å²	73	63.2 Å²	63.2	38%	0.382	38%	0.375	S	S	.	.	H	α-helix	trans	-63.6	-40.2	177.5	-155.3	82.5	0	0	0	111.5	T1076 C1082 E1083 L1084 F1093	T1076-L1080 PolarHBondContact O-N 3.47Å; T1076-L1080 VanDerWaalsContact O-N 3.16Å; L1080-C1082 VanDerWaalsContact C-N 3.26Å; L1080-C1082 PolarHBondContact O-N 2.95Å; L1080-E1083 PolarHBondContact O-N 3.24Å; L1080-E1083 VanDerWaalsContact O-N 3.12Å; L1080-L1084 HydrophobicContact CD2-CD1 4.48Å; L1080-L1084 HydrophobicContact CG-CG 4.36Å; L1080-L1084 WeakPolarHBondContact O-CG 3.4Å; L1080-L1084 PolarHBondContact O-N 2.99Å; L1080-F1093 HydrophobicContact CB-CE1 4.16Å; L1080-F1093 HydrophobicContact CB-CZ 4.4Å; L1080-F1093 HydrophobicContact CD2-CD1 4.21Å; L1080-F1093 HydrophobicContact CD2-CD2 4.18Å; L1080-F1093 HydrophobicContact CD2-CE1 3.67Å; L1080-F1093 HydrophobicContact CD2-CE2 3.66Å; L1080-F1093 HydrophobicContact CD2-CG 4.45Å; L1080-F1093 HydrophobicContact CD2-CZ 3.38Å; L1080-F1093 HydrophobicContact CG-CE1 4.4Å; L1080-F1093 HydrophobicContact CG-CZ 4.46Å
1081	L	90.5	Very high	86.4	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-61.1	-34.4	174.1	-75.2	170.7	0	0	0	112.8	L1064 L1077 V1078 D1079 I1090 F1093 I1094 F1111 R1115	L1064-L1081 HydrophobicContact CD1-CD1 4.22Å; L1077-L1081 HydrophobicContact CD1-CD1 4.39Å; L1077-L1081 HydrophobicContact CG-CD1 4.06Å; L1077-L1081 WeakPolarHBondContact O-CB 3.47Å; L1077-L1081 WeakPolarHBondContact O-CG 3.47Å; L1077-L1081 PolarHBondContact O-N 3.25Å; V1078-L1081 PolarHBondContact O-N 3.06Å; D1079-L1081 VanDerWaalsContact C-N 3.34Å; D1079-L1081 PolarHBondContact O-N 3.34Å; L1081-I1090 HydrophobicContact CD2-CG2 4.43Å; L1081-F1093 HydrophobicContact CD2-CD1 3.73Å; L1081-F1093 HydrophobicContact CD2-CE1 4.21Å; L1081-F1093 HydrophobicContact CG-CD1 4.19Å; L1081-F1093 HydrophobicContact CG-CE1 4.17Å; L1081-I1094 HydrophobicContact CD1-CG1 4.45Å; L1081-I1094 HydrophobicContact CD2-CD1 3.88Å; L1081-I1094 HydrophobicContact CD2-CG1 3.38Å; L1081-F1111 HydrophobicContact CB-CE1 4.28Å; L1081-F1111 HydrophobicContact CB-CZ 4.02Å; L1081-F1111 HydrophobicContact CD2-CE1 4.49Å; L1081-F1111 VanDerWaalsContact O-CZ 3.31Å; L1081-F1111 WeakPolarHBondContact O-CZ 3.34Å; L1081-R1115 PolarHBondContact O-NH1 3.2Å
1082	C	87.5	Confident	87.3	Confident	18 Å²	18	63 Å²	63	12%	0.122	34%	0.341	C	S	.	.	H	α-helix	trans	-76.5	-25.1	174.7	-74.1	0	0	0	0	113.3	K1053 V1078 D1079 L1080 R1115	K1053-C1082 HydrophobicContact CD-CB 4.37Å; K1053-C1082 HydrophobicContact CG-CB 4.06Å; V1078-C1082 WeakPolarHBondContact O-CB 3.37Å; V1078-C1082 PolarHBondContact O-N 2.75Å; V1078-C1082 PolarHBondContact O-SG 3.39Å; V1078-C1082 VanDerWaalsContact O-SG 3.35Å; D1079-C1082 CarbonylContact O-C 3.6Å; D1079-C1082 PolarHBondContact O-N 3Å; D1079-C1082 VanDerWaalsContact O-N 3.1Å; L1080-C1082 VanDerWaalsContact C-N 3.26Å; L1080-C1082 PolarHBondContact O-N 2.95Å; C1082-R1115 PolarHBondContact O-NH1 3.07Å
1083	E	88.3	Confident	87.9	Confident	130 Å²	130	63 Å²	63	61%	0.607	34%	0.336	S	S	*	.	H	α-helix	trans	-88.3	-41.2	179.6	-73.5	-174.2	177.3	0	0	114.4	K1053 D1079 L1080 Q1085	K1053-E1083 IonicContact NZ-OE1 3.75Å; D1079-E1083 WeakPolarHBondContact O-CG 3.48Å; D1079-E1083 PolarHBondContact O-N 3.01Å; L1080-E1083 PolarHBondContact O-N 3.24Å; L1080-E1083 VanDerWaalsContact O-N 3.12Å; E1083-Q1085 PolarHBondContact O-N 2.78Å
1084	L	88.5	Confident	88.3	Confident	40 Å²	40	58.1 Å²	58.1	21%	0.209	31%	0.31	C	S	.	.			trans	-50.7	130.2	175.1	-73.4	173.6	0	0	0	110	L1080 E1089 I1090 F1093 R1115	L1080-L1084 HydrophobicContact CD2-CD1 4.48Å; L1080-L1084 HydrophobicContact CG-CG 4.36Å; L1080-L1084 WeakPolarHBondContact O-CG 3.4Å; L1080-L1084 PolarHBondContact O-N 2.99Å; L1084-E1089 HydrophobicContact CD2-CB 4.33Å; L1084-I1090 HydrophobicContact CB-CG1 3.86Å; L1084-F1093 HydrophobicContact CD1-CB 3.6Å; L1084-F1093 HydrophobicContact CD1-CD1 3.62Å; L1084-F1093 HydrophobicContact CD1-CG 3.72Å; L1084-R1115 PolarHBondContact O-NH1 3.28Å; L1084-R1115 PolarHBondContact O-NH2 3.01Å
1085	Q	79.2	Confident	88.4	Confident	91 Å²	91	59 Å²	59	43%	0.425	31%	0.313	S	S	.	.			trans	-103.4	-34.5	-162.8	173.8	67.2	-16	0	0	113.3	W1017 E1083 E1089 R1119	W1017-Q1085 VanDerWaalsContact CE3-NE2 3.28Å; E1083-Q1085 PolarHBondContact O-N 2.78Å; Q1085-E1089 PolarHBondContact N-OE2 2.69Å; Q1085-R1119 VanDerWaalsContact CD-NH2 3.31Å; Q1085-R1119 VanDerWaalsContact NE2-NH2 3.18Å
1086	A	84.4	Confident	88.4	Confident	41 Å²	41	60.5 Å²	60.5	34%	0.339	32%	0.321	S	S	.	.	S	Bend	trans	-83	148	177	0	0	0	0	0	111.5	D1088 E1089 I1090	A1086-D1088 PolarHBondContact O-N 2.87Å; A1086-E1089 HydrophobicContact CB-CB 4.21Å; A1086-E1089 HydrophobicContact CB-CG 3.83Å; A1086-E1089 WeakPolarHBondContact CB-OE2 3.48Å; A1086-E1089 PolarHBondContact N-OE2 3.35Å; A1086-I1090 VanDerWaalsContact O-CD1 3.31Å; A1086-I1090 WeakPolarHBondContact O-CD1 3.49Å; A1086-I1090 VanDerWaalsContact O-CG1 3.26Å; A1086-I1090 WeakPolarHBondContact O-CG1 3.36Å; A1086-I1090 PolarHBondContact O-N 2.96Å
1087	T	86.7	Confident	88.1	Confident	78 Å²	78	57.5 Å²	57.5	48%	0.479	30%	0.304	S	S	.	.	H	α-helix	trans	-59.3	-34.8	174.7	45.4	0	0	0	0	112.2	I1090 L1091 L1112	T1087-I1090 WeakPolarHBondContact O-CB 3.4Å; T1087-I1090 PolarHBondContact O-N 2.91Å; T1087-L1091 WeakPolarHBondContact O-CG 3.5Å; T1087-L1091 PolarHBondContact O-N 3.35Å; T1087-L1091 VanDerWaalsContact O-N 3.09Å; T1087-L1112 HydrophobicContact CG2-CD2 4.15Å
1088	D	88.5	Confident	87.9	Confident	112 Å²	112	59 Å²	59	60%	0.599	31%	0.312	S	S	*	.	H	α-helix	trans	-84.6	-37.4	-167.6	-54.5	-3.6	0	0	0	110.2	A1086 I1090 L1091 E1092	A1086-D1088 PolarHBondContact O-N 2.87Å; D1088-I1090 VanDerWaalsContact C-N 3.31Å; D1088-I1090 PolarHBondContact O-N 3.37Å; D1088-L1091 PolarHBondContact O-N 3.19Å; D1088-E1092 WeakPolarHBondContact O-CB 3.44Å; D1088-E1092 PolarHBondContact O-N 3.44Å
1089	E	89.7	Confident	87.6	Confident	95 Å²	95	60.2 Å²	60.2	44%	0.444	33%	0.325	S	S	.	.	H	α-helix	trans	-55.4	-44.5	166.5	-68.6	168.7	165.5	0	0	111.5	L1084 Q1085 A1086 F1093	L1084-E1089 HydrophobicContact CD2-CB 4.33Å; Q1085-E1089 PolarHBondContact N-OE2 2.69Å; A1086-E1089 HydrophobicContact CB-CB 4.21Å; A1086-E1089 HydrophobicContact CB-CG 3.83Å; A1086-E1089 WeakPolarHBondContact CB-OE2 3.48Å; A1086-E1089 PolarHBondContact N-OE2 3.35Å; E1089-F1093 WeakPolarHBondContact O-CB 3.5Å; E1089-F1093 PolarHBondContact O-N 2.92Å
1090	I	90.4	Very high	87.4	Confident	2 Å²	2	65.7 Å²	65.7	1%	0.01	34%	0.34	C	S	.	.	H	α-helix	trans	-61.5	-47.4	176.8	-70	162.9	0	0	0	110.4	L1081 L1084 A1086 T1087 D1088 I1094 F1111 L1112	L1081-I1090 HydrophobicContact CD2-CG2 4.43Å; L1084-I1090 HydrophobicContact CB-CG1 3.86Å; A1086-I1090 VanDerWaalsContact O-CD1 3.31Å; A1086-I1090 WeakPolarHBondContact O-CD1 3.49Å; A1086-I1090 VanDerWaalsContact O-CG1 3.26Å; A1086-I1090 WeakPolarHBondContact O-CG1 3.36Å; A1086-I1090 PolarHBondContact O-N 2.96Å; T1087-I1090 WeakPolarHBondContact O-CB 3.4Å; T1087-I1090 PolarHBondContact O-N 2.91Å; D1088-I1090 VanDerWaalsContact C-N 3.31Å; D1088-I1090 PolarHBondContact O-N 3.37Å; I1090-I1094 HydrophobicContact CG2-CD1 3.75Å; I1090-I1094 HydrophobicContact CG2-CG1 4.49Å; I1090-I1094 WeakPolarHBondContact O-CB 3.48Å; I1090-I1094 WeakPolarHBondContact O-CG1 3.42Å; I1090-I1094 PolarHBondContact O-N 3.13Å; I1090-F1111 HydrophobicContact CD1-CE1 4.22Å; I1090-F1111 HydrophobicContact CG1-CE1 4.42Å; I1090-F1111 HydrophobicContact CG2-CD1 3.62Å; I1090-F1111 HydrophobicContact CG2-CE1 3.53Å; I1090-L1112 HydrophobicContact CB-CD2 4.42Å; I1090-L1112 HydrophobicContact CD1-CD2 4.02Å; I1090-L1112 HydrophobicContact CG2-CD2 3.99Å
1091	L	90.2	Very high	87.3	Confident	64 Å²	64	65.2 Å²	65.2	34%	0.335	34%	0.343	S	S	.	.	H	α-helix	trans	-64.6	-46.2	179.9	-69.3	177.8	0	0	0	111.9	T1087 D1088 I1094 E1095 L1112	T1087-L1091 WeakPolarHBondContact O-CG 3.5Å; T1087-L1091 PolarHBondContact O-N 3.35Å; T1087-L1091 VanDerWaalsContact O-N 3.09Å; D1088-L1091 PolarHBondContact O-N 3.19Å; L1091-I1094 PolarHBondContact O-N 2.89Å; L1091-E1095 WeakPolarHBondContact O-CG 3.34Å; L1091-E1095 PolarHBondContact O-N 2.9Å; L1091-L1112 HydrophobicContact CD1-CD1 4.27Å; L1091-L1112 HydrophobicContact CD2-CD1 3.84Å; L1091-L1112 HydrophobicContact CG-CD1 4.04Å
1092	E	89	Confident	87.2	Confident	133 Å²	133	74.4 Å²	74.4	62%	0.621	38%	0.383	S	S	*	.	H	α-helix	trans	-63.7	-42.4	178.1	-177	167.3	-156.1	0	0	111.6	D1088 E1095 T1096	D1088-E1092 WeakPolarHBondContact O-CB 3.44Å; D1088-E1092 PolarHBondContact O-N 3.44Å; E1092-E1095 PolarHBondContact O-N 2.92Å; E1092-T1096 WeakPolarHBondContact O-CB 3.26Å; E1092-T1096 PolarHBondContact O-N 3.45Å; E1092-T1096 PolarHBondContact O-OG1 3.2Å
1093	F	89.6	Confident	87.2	Confident	57 Å²	57	80.3 Å²	80.3	25%	0.25	40%	0.402	C	S	.	.	H	α-helix	trans	-67.1	-39.7	177.2	-178.6	-112.9	0	0	0	112.5	L1077 L1080 L1081 L1084 E1089 T1096 S1097	L1077-F1093 HydrophobicContact CD1-CE1 3.59Å; L1077-F1093 HydrophobicContact CD1-CZ 3.79Å; L1080-F1093 HydrophobicContact CB-CE1 4.16Å; L1080-F1093 HydrophobicContact CB-CZ 4.4Å; L1080-F1093 HydrophobicContact CD2-CD1 4.21Å; L1080-F1093 HydrophobicContact CD2-CD2 4.18Å; L1080-F1093 HydrophobicContact CD2-CE1 3.67Å; L1080-F1093 HydrophobicContact CD2-CE2 3.66Å; L1080-F1093 HydrophobicContact CD2-CG 4.45Å; L1080-F1093 HydrophobicContact CD2-CZ 3.38Å; L1080-F1093 HydrophobicContact CG-CE1 4.4Å; L1080-F1093 HydrophobicContact CG-CZ 4.46Å; L1081-F1093 HydrophobicContact CD2-CD1 3.73Å; L1081-F1093 HydrophobicContact CD2-CE1 4.21Å; L1081-F1093 HydrophobicContact CG-CD1 4.19Å; L1081-F1093 HydrophobicContact CG-CE1 4.17Å; L1084-F1093 HydrophobicContact CD1-CB 3.6Å; L1084-F1093 HydrophobicContact CD1-CD1 3.62Å; L1084-F1093 HydrophobicContact CD1-CG 3.72Å; E1089-F1093 WeakPolarHBondContact O-CB 3.5Å; E1089-F1093 PolarHBondContact O-N 2.92Å; F1093-T1096 PolarHBondContact O-N 2.99Å; F1093-S1097 VanDerWaalsContact O-CB 3.28Å; F1093-S1097 WeakPolarHBondContact O-CB 3.45Å; F1093-S1097 PolarHBondContact O-N 3.12Å; F1093-S1097 PolarHBondContact O-OG 3.16Å
1094	I	89.2	Confident	87.3	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-63.9	-47.8	173.8	-67.3	168	0	0	0	110.8	L1081 I1090 L1091 T1096 S1097 L1098 I1104 F1107 S1108 F1111	L1081-I1094 HydrophobicContact CD1-CG1 4.45Å; L1081-I1094 HydrophobicContact CD2-CD1 3.88Å; L1081-I1094 HydrophobicContact CD2-CG1 3.38Å; I1090-I1094 HydrophobicContact CG2-CD1 3.75Å; I1090-I1094 HydrophobicContact CG2-CG1 4.49Å; I1090-I1094 WeakPolarHBondContact O-CB 3.48Å; I1090-I1094 WeakPolarHBondContact O-CG1 3.42Å; I1090-I1094 PolarHBondContact O-N 3.13Å; L1091-I1094 PolarHBondContact O-N 2.89Å; I1094-T1096 PolarHBondContact O-N 3.37Å; I1094-S1097 PolarHBondContact O-N 3.01Å; I1094-S1097 PolarHBondContact O-OG 2.59Å; I1094-L1098 HydrophobicContact CG2-CD1 4.12Å; I1094-L1098 WeakPolarHBondContact O-CB 3.46Å; I1094-L1098 PolarHBondContact O-N 2.97Å; I1094-I1104 HydrophobicContact CG2-CG2 3.39Å; I1094-F1107 HydrophobicContact CD1-CD1 4.38Å; I1094-F1107 HydrophobicContact CD1-CE1 3.99Å; I1094-F1107 HydrophobicContact CG1-CE1 4.4Å; I1094-F1107 HydrophobicContact CG2-CD1 4.27Å; I1094-F1107 HydrophobicContact CG2-CE1 4.49Å; I1094-S1108 VanDerWaalsContact CG2-OG 3.29Å; I1094-S1108 WeakPolarHBondContact CG2-OG 3.44Å; I1094-F1111 HydrophobicContact CD1-CD1 4.22Å
1095	E	88.1	Confident	87.3	Confident	56 Å²	56	75.3 Å²	75.3	26%	0.262	38%	0.382	S	S	.	.	H	α-helix	trans	-66.1	-26	178.9	-72.5	-160.5	153.5	0	0	113.2	L1091 E1092 G1099 R1100	L1091-E1095 WeakPolarHBondContact O-CG 3.34Å; L1091-E1095 PolarHBondContact O-N 2.9Å; E1092-E1095 PolarHBondContact O-N 2.92Å; E1095-G1099 CarbonylContact O-C 3.4Å; E1095-G1099 WeakPolarHBondContact O-CA 3.19Å; E1095-G1099 PolarHBondContact O-N 3Å; E1095-G1099 VanDerWaalsContact O-N 3.14Å; E1095-R1100 HydrophobicContact CB-CG 4.2Å; E1095-R1100 HydrophobicContact CG-CG 4.18Å; E1095-R1100 IonicContact OE1-NE 3.74Å; E1095-R1100 IonicContact OE2-CZ 3.76Å; E1095-R1100 IonicContact OE2-NE 2.68Å; E1095-R1100 PolarHBondContact OE2-NE 2.89Å; E1095-R1100 IonicContact OE2-NH2 3.79Å; E1095-R1100 PolarHBondContact OE2-NH2 2.81Å
1096	T	86.8	Confident	87.9	Confident	105 Å²	105	75.5 Å²	75.5	64%	0.644	38%	0.383	S	S	*	.	H	α-helix	trans	-83.7	-41	178	-58.3	0	0	0	0	112.3	E1092 F1093 I1094	E1092-T1096 WeakPolarHBondContact O-CB 3.26Å; E1092-T1096 PolarHBondContact O-N 3.45Å; E1092-T1096 PolarHBondContact O-OG1 3.2Å; F1093-T1096 PolarHBondContact O-N 2.99Å; I1094-T1096 PolarHBondContact O-N 3.37Å
1097	S	84.2	Confident	88.3	Confident	31 Å²	31	74 Å²	74	22%	0.217	37%	0.369	C	S	.	.	H	α-helix	trans	-80.9	-32.8	-177.7	57.4	0	0	0	0	113.8	F1093 I1094	F1093-S1097 VanDerWaalsContact O-CB 3.28Å; F1093-S1097 WeakPolarHBondContact O-CB 3.45Å; F1093-S1097 PolarHBondContact O-N 3.12Å; F1093-S1097 PolarHBondContact O-OG 3.16Å; I1094-S1097 PolarHBondContact O-N 3.01Å; I1094-S1097 PolarHBondContact O-OG 2.59Å
1098	L	85.2	Confident	88.5	Confident	33 Å²	33	70.4 Å²	70.4	17%	0.173	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	-16.3	-178.9	-53.9	-175	0	0	0	113.5	L1064 L1069 L1077 I1094 I1104	L1064-L1098 HydrophobicContact CD2-CD1 3.53Å; L1069-L1098 HydrophobicContact CD2-CD2 3.31Å; L1077-L1098 HydrophobicContact CD2-CD2 3.88Å; I1094-L1098 HydrophobicContact CG2-CD1 4.12Å; I1094-L1098 WeakPolarHBondContact O-CB 3.46Å; I1094-L1098 PolarHBondContact O-N 2.97Å; L1098-I1104 HydrophobicContact CB-CD1 3.57Å; L1098-I1104 HydrophobicContact CB-CG1 4.08Å; L1098-I1104 HydrophobicContact CB-CG2 4.02Å; L1098-I1104 HydrophobicContact CD1-CG1 4.48Å; L1098-I1104 HydrophobicContact CD1-CG2 4.28Å; L1098-I1104 WeakPolarHBondContact O-CD1 3.35Å
1099	G	85.2	Confident	88.7	Confident	29 Å²	29	71.1 Å²	71.1	30%	0.299	35%	0.345	S	S	.	.			trans	85.2	173.9	-173.4	0	0	0	0	0	114	E1095 S1101 I1104	E1095-G1099 CarbonylContact O-C 3.4Å; E1095-G1099 WeakPolarHBondContact O-CA 3.19Å; E1095-G1099 PolarHBondContact O-N 3Å; E1095-G1099 VanDerWaalsContact O-N 3.14Å; G1099-S1101 PolarHBondContact O-N 3.21Å; G1099-I1104 WeakPolarHBondContact O-CD1 3.33Å; G1099-I1104 WeakPolarHBondContact O-CG2 3.46Å
1100	R	84.5	Confident	88.8	Confident	192 Å²	192	68.8 Å²	68.8	73%	0.725	34%	0.335	S	S	*	.	S	Bend	trans	-90.3	101.8	-179.2	-68.7	-178	171.8	98.7	17.9	111.6	E1095	E1095-R1100 HydrophobicContact CB-CG 4.2Å; E1095-R1100 HydrophobicContact CG-CG 4.18Å; E1095-R1100 IonicContact OE1-NE 3.74Å; E1095-R1100 IonicContact OE2-CZ 3.76Å; E1095-R1100 IonicContact OE2-NE 2.68Å; E1095-R1100 PolarHBondContact OE2-NE 2.89Å; E1095-R1100 IonicContact OE2-NH2 3.79Å; E1095-R1100 PolarHBondContact OE2-NH2 2.81Å
1101	S	86.7	Confident	89	Confident	63 Å²	63	68.7 Å²	68.7	44%	0.441	34%	0.335	S	S	.	.			trans	-138.8	150.1	174	-178.9	0	0	0	0	111.6	G1099 R1103 I1104 T1105	G1099-S1101 PolarHBondContact O-N 3.21Å; S1101-R1103 PolarHBondContact O-N 2.96Å; S1101-R1103 VanDerWaalsContact O-N 3.16Å; S1101-I1104 CarbonylContact O-C 3.58Å; S1101-I1104 WeakPolarHBondContact O-CA 3.48Å; S1101-I1104 WeakPolarHBondContact O-CB 3.4Å; S1101-I1104 PolarHBondContact O-N 2.96Å; S1101-T1105 PolarHBondContact O-N 3.05Å; S1101-T1105 PolarHBondContact O-OG1 3.21Å
1102	K	89.1	Confident	89	Confident	193 Å²	193	67.7 Å²	67.7	84%	0.839	33%	0.33	S	S	*	.	H	α-helix	trans	-53.8	-37.4	178.6	-68.5	-176.7	179.6	178.7	0	113.1	I1104 Q1106	K1102-I1104 VanDerWaalsContact C-N 3.35Å; K1102-Q1106 WeakPolarHBondContact O-CB 3.26Å; K1102-Q1106 PolarHBondContact O-N 3.46Å
1103	R	87.9	Confident	89.1	Confident	141 Å²	141	67 Å²	67	53%	0.532	33%	0.326	S	S	.	.	H	α-helix	trans	-65.5	-38.9	175.4	-176.1	-173	-105.5	-169.1	-10.7	111.5	S1066 I1067 S1101 Q1106 F1107	S1066-R1103 PolarHBondContact O-NH1 3Å; I1067-R1103 HydrophobicContact CD1-CG 4.29Å; S1101-R1103 PolarHBondContact O-N 2.96Å; S1101-R1103 VanDerWaalsContact O-N 3.16Å; R1103-Q1106 PolarHBondContact O-N 2.82Å; R1103-F1107 WeakPolarHBondContact O-CB 3.5Å; R1103-F1107 PolarHBondContact O-N 2.93Å
1104	I	89.8	Confident	89.1	Confident	10 Å²	10	67.4 Å²	67.4	5%	0.051	33%	0.328	C	S	.	.	H	α-helix	trans	-73.6	-42.7	-178.9	-62.9	166.3	0	0	0	110.3	I1067 I1094 L1098 G1099 S1101 K1102 Q1106 F1107 S1108	I1067-I1104 HydrophobicContact CD1-CG1 4.31Å; I1094-I1104 HydrophobicContact CG2-CG2 3.39Å; L1098-I1104 HydrophobicContact CB-CD1 3.57Å; L1098-I1104 HydrophobicContact CB-CG1 4.08Å; L1098-I1104 HydrophobicContact CB-CG2 4.02Å; L1098-I1104 HydrophobicContact CD1-CG1 4.48Å; L1098-I1104 HydrophobicContact CD1-CG2 4.28Å; L1098-I1104 WeakPolarHBondContact O-CD1 3.35Å; G1099-I1104 WeakPolarHBondContact O-CD1 3.33Å; G1099-I1104 WeakPolarHBondContact O-CG2 3.46Å; S1101-I1104 CarbonylContact O-C 3.58Å; S1101-I1104 WeakPolarHBondContact O-CA 3.48Å; S1101-I1104 WeakPolarHBondContact O-CB 3.4Å; S1101-I1104 PolarHBondContact O-N 2.96Å; K1102-I1104 VanDerWaalsContact C-N 3.35Å; I1104-Q1106 VanDerWaalsContact C-N 3.26Å; I1104-Q1106 PolarHBondContact O-N 3.01Å; I1104-F1107 PolarHBondContact O-N 3.05Å; I1104-S1108 WeakPolarHBondContact O-CB 3.33Å; I1104-S1108 PolarHBondContact O-N 2.9Å; I1104-S1108 PolarHBondContact O-OG 2.92Å
1105	T	89.8	Confident	89	Confident	55 Å²	55	68.6 Å²	68.6	34%	0.337	33%	0.333	S	S	.	.	H	α-helix	trans	-62.9	-32	172.6	-45.9	0	0	0	0	112.1	S1101 K1109	S1101-T1105 PolarHBondContact O-N 3.05Å; S1101-T1105 PolarHBondContact O-OG1 3.21Å; T1105-K1109 WeakPolarHBondContact O-CG 3.35Å; T1105-K1109 PolarHBondContact O-N 2.91Å
1106	Q	90.8	Very high	88.8	Confident	95 Å²	95	68.5 Å²	68.5	44%	0.444	34%	0.338	S	S	.	.	H	α-helix	trans	-71.6	-51.8	172.5	-171.7	59.3	42.7	0	0	111.2	K1102 R1103 I1104 S1108 K1109 D1110	K1102-Q1106 WeakPolarHBondContact O-CB 3.26Å; K1102-Q1106 PolarHBondContact O-N 3.46Å; R1103-Q1106 PolarHBondContact O-N 2.82Å; I1104-Q1106 VanDerWaalsContact C-N 3.26Å; I1104-Q1106 PolarHBondContact O-N 3.01Å; Q1106-S1108 PolarHBondContact O-N 2.82Å; Q1106-K1109 WeakPolarHBondContact O-CB 3.46Å; Q1106-K1109 PolarHBondContact O-N 3.09Å; Q1106-D1110 PolarHBondContact NE2-OD1 3.42Å; Q1106-D1110 PolarHBondContact NE2-OD2 3.01Å; Q1106-D1110 VanDerWaalsContact O-CG 3.24Å; Q1106-D1110 PolarHBondContact O-N 2.99Å
1107	F	92.5	Very high	88.7	Confident	9 Å²	9	68.1 Å²	68.1	4%	0.039	33%	0.332	C	S	.	.	H	α-helix	trans	-51.2	-41.7	173.5	166.5	-101.1	0	0	0	112.3	W1059 Q1063 L1064 I1094 R1103 I1104 K1109 D1110 F1111	W1059-F1107 HydrophobicContact CH2-CD2 4.05Å; W1059-F1107 HydrophobicContact CH2-CE2 4.01Å; W1059-F1107 HydrophobicContact CZ3-CD2 4.32Å; W1059-F1107 AromaticContact CZ3-CE2 3.81Å; W1059-F1107 HydrophobicContact CZ3-CE2 3.81Å; Q1063-F1107 HydrophobicContact CB-CD2 3.67Å; Q1063-F1107 HydrophobicContact CB-CE2 3.83Å; Q1063-F1107 HydrophobicContact CG-CD2 4.19Å; Q1063-F1107 HydrophobicContact CG-CE2 4.38Å; L1064-F1107 HydrophobicContact CD1-CE1 4.27Å; L1064-F1107 HydrophobicContact CD1-CE2 4.41Å; L1064-F1107 HydrophobicContact CD1-CZ 3.78Å; L1064-F1107 HydrophobicContact CD2-CD1 3.97Å; L1064-F1107 HydrophobicContact CD2-CD2 4.31Å; L1064-F1107 HydrophobicContact CD2-CE1 3.67Å; L1064-F1107 HydrophobicContact CD2-CE2 4.03Å; L1064-F1107 HydrophobicContact CD2-CG 4.29Å; L1064-F1107 HydrophobicContact CD2-CZ 3.71Å; L1064-F1107 HydrophobicContact CG-CE1 4.18Å; L1064-F1107 HydrophobicContact CG-CE2 3.91Å; L1064-F1107 HydrophobicContact CG-CZ 3.69Å; I1094-F1107 HydrophobicContact CD1-CD1 4.38Å; I1094-F1107 HydrophobicContact CD1-CE1 3.99Å; I1094-F1107 HydrophobicContact CG1-CE1 4.4Å; I1094-F1107 HydrophobicContact CG2-CD1 4.27Å; I1094-F1107 HydrophobicContact CG2-CE1 4.49Å; R1103-F1107 WeakPolarHBondContact O-CB 3.5Å; R1103-F1107 PolarHBondContact O-N 2.93Å; I1104-F1107 PolarHBondContact O-N 3.05Å; F1107-K1109 PolarHBondContact O-N 3.19Å; F1107-D1110 PolarHBondContact O-N 3.41Å; F1107-F1111 HydrophobicContact CE2-CB 4.49Å; F1107-F1111 HydrophobicContact CZ-CB 4.31Å; F1107-F1111 VanDerWaalsContact O-CB 3.26Å; F1107-F1111 WeakPolarHBondContact O-CB 3.24Å; F1107-F1111 PolarHBondContact O-N 2.68Å
1108	S	92.2	Very high	88.4	Confident	4 Å²	4	69.3 Å²	69.3	3%	0.028	33%	0.333	C	S	.	.	H	α-helix	trans	-60.2	-43.2	177.9	-57.3	0	0	0	0	112.4	I1094 I1104 Q1106 L1112	I1094-S1108 VanDerWaalsContact CG2-OG 3.29Å; I1094-S1108 WeakPolarHBondContact CG2-OG 3.44Å; I1104-S1108 WeakPolarHBondContact O-CB 3.33Å; I1104-S1108 PolarHBondContact O-N 2.9Å; I1104-S1108 PolarHBondContact O-OG 2.92Å; Q1106-S1108 PolarHBondContact O-N 2.82Å; S1108-L1112 WeakPolarHBondContact O-CG 3.5Å; S1108-L1112 PolarHBondContact O-N 3.02Å
1109	K	92	Very high	87.7	Confident	126 Å²	126	72.6 Å²	72.6	55%	0.548	34%	0.343	S	S	.	.	H	α-helix	trans	-68.5	-44.7	176	-69.9	170.8	-178.8	-179.8	0	111.3	T1105 Q1106 F1107 F1111 L1112 Q1113	T1105-K1109 WeakPolarHBondContact O-CG 3.35Å; T1105-K1109 PolarHBondContact O-N 2.91Å; Q1106-K1109 WeakPolarHBondContact O-CB 3.46Å; Q1106-K1109 PolarHBondContact O-N 3.09Å; F1107-K1109 PolarHBondContact O-N 3.19Å; K1109-F1111 VanDerWaalsContact C-N 3.29Å; K1109-F1111 PolarHBondContact O-N 2.92Å; K1109-L1112 PolarHBondContact O-N 3.47Å; K1109-Q1113 WeakPolarHBondContact O-CB 3.35Å; K1109-Q1113 PolarHBondContact O-N 2.8Å
1110	D	92.7	Very high	86.5	Confident	46 Å²	46	81.2 Å²	81.2	25%	0.246	38%	0.376	C	S	.	.	H	α-helix	trans	-65.1	-36	-179.7	-60.6	-18	0	0	0	110.9	W1059 Q1106 F1107 Q1113 K1114	W1059-D1110 HydrophobicContact CH2-CB 3.71Å; W1059-D1110 HydrophobicContact CZ2-CB 3.86Å; Q1106-D1110 PolarHBondContact NE2-OD1 3.42Å; Q1106-D1110 PolarHBondContact NE2-OD2 3.01Å; Q1106-D1110 VanDerWaalsContact O-CG 3.24Å; Q1106-D1110 PolarHBondContact O-N 2.99Å; F1107-D1110 PolarHBondContact O-N 3.41Å; D1110-Q1113 PolarHBondContact O-N 3.28Å; D1110-K1114 VanDerWaalsContact O-CB 3.26Å; D1110-K1114 WeakPolarHBondContact O-CB 3.44Å; D1110-K1114 VanDerWaalsContact O-CG 3.3Å; D1110-K1114 WeakPolarHBondContact O-CG 3.45Å; D1110-K1114 PolarHBondContact O-N 3Å
1111	F	92.6	Very high	86.6	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-66.2	-49	173.3	177	-117.8	0	0	0	111.9	L1056 W1059 C1060 L1081 I1090 I1094 F1107 K1109 Q1113 K1114 R1115	L1056-F1111 HydrophobicContact CD1-CD2 3.88Å; L1056-F1111 HydrophobicContact CD1-CE2 3.7Å; L1056-F1111 HydrophobicContact CD2-CE2 3.91Å; L1056-F1111 HydrophobicContact CD2-CZ 4.43Å; L1056-F1111 HydrophobicContact CG-CE2 3.87Å; W1059-F1111 HydrophobicContact CH2-CB 4.29Å; W1059-F1111 HydrophobicContact CZ3-CB 3.87Å; W1059-F1111 HydrophobicContact CZ3-CD2 4.03Å; W1059-F1111 HydrophobicContact CZ3-CG 4.47Å; C1060-F1111 WeakPolarHBondContact SG-CD2 3.42Å; C1060-F1111 WeakPolarHBondContact SG-CE2 3.33Å; L1081-F1111 HydrophobicContact CB-CE1 4.28Å; L1081-F1111 HydrophobicContact CB-CZ 4.02Å; L1081-F1111 HydrophobicContact CD2-CE1 4.49Å; L1081-F1111 VanDerWaalsContact O-CZ 3.31Å; L1081-F1111 WeakPolarHBondContact O-CZ 3.34Å; I1090-F1111 HydrophobicContact CD1-CE1 4.22Å; I1090-F1111 HydrophobicContact CG1-CE1 4.42Å; I1090-F1111 HydrophobicContact CG2-CD1 3.62Å; I1090-F1111 HydrophobicContact CG2-CE1 3.53Å; I1094-F1111 HydrophobicContact CD1-CD1 4.22Å; F1107-F1111 HydrophobicContact CE2-CB 4.49Å; F1107-F1111 HydrophobicContact CZ-CB 4.31Å; F1107-F1111 VanDerWaalsContact O-CB 3.26Å; F1107-F1111 WeakPolarHBondContact O-CB 3.24Å; F1107-F1111 PolarHBondContact O-N 2.68Å; K1109-F1111 VanDerWaalsContact C-N 3.29Å; K1109-F1111 PolarHBondContact O-N 2.92Å; F1111-Q1113 VanDerWaalsContact C-N 3.29Å; F1111-Q1113 PolarHBondContact O-N 3.06Å; F1111-K1114 PolarHBondContact O-N 3.02Å; F1111-R1115 WeakPolarHBondContact O-CB 3.45Å; F1111-R1115 PolarHBondContact O-N 2.79Å
1112	L	92	Very high	86.6	Confident	43 Å²	43	76.3 Å²	76.3	23%	0.225	35%	0.354	C	S	.	.	H	α-helix	trans	-61.8	-38.3	175.5	-70.7	179.8	0	0	0	111.6	T1087 I1090 L1091 S1108 K1109 S1116	T1087-L1112 HydrophobicContact CG2-CD2 4.15Å; I1090-L1112 HydrophobicContact CB-CD2 4.42Å; I1090-L1112 HydrophobicContact CD1-CD2 4.02Å; I1090-L1112 HydrophobicContact CG2-CD2 3.99Å; L1091-L1112 HydrophobicContact CD1-CD1 4.27Å; L1091-L1112 HydrophobicContact CD2-CD1 3.84Å; L1091-L1112 HydrophobicContact CG-CD1 4.04Å; S1108-L1112 WeakPolarHBondContact O-CG 3.5Å; S1108-L1112 PolarHBondContact O-N 3.02Å; K1109-L1112 PolarHBondContact O-N 3.47Å; L1112-S1116 VanDerWaalsContact O-CB 3.32Å; L1112-S1116 WeakPolarHBondContact O-CB 3.33Å; L1112-S1116 PolarHBondContact O-N 3.27Å
1113	Q	91	Very high	86.4	Confident	118 Å²	118	69.8 Å²	69.8	55%	0.551	33%	0.327	S	S	*	.	H	α-helix	trans	-63.6	-51.8	173.7	-174.9	175.5	-6	0	0	111.3	K1109 D1110 F1111 R1115 S1116 L1117	K1109-Q1113 WeakPolarHBondContact O-CB 3.35Å; K1109-Q1113 PolarHBondContact O-N 2.8Å; D1110-Q1113 PolarHBondContact O-N 3.28Å; F1111-Q1113 VanDerWaalsContact C-N 3.29Å; F1111-Q1113 PolarHBondContact O-N 3.06Å; Q1113-R1115 PolarHBondContact O-N 3.43Å; Q1113-S1116 PolarHBondContact O-N 2.85Å; Q1113-S1116 VanDerWaalsContact O-N 3.11Å; Q1113-S1116 PolarHBondContact O-OG 3.11Å; Q1113-L1117 HydrophobicContact CG-CD1 4.35Å; Q1113-L1117 WeakPolarHBondContact O-CG 3.26Å; Q1113-L1117 PolarHBondContact O-N 3.02Å
1114	K	89	Confident	86.3	Confident	67 Å²	67	65.6 Å²	65.6	29%	0.291	32%	0.315	S	S	.	.	H	α-helix	trans	-53.9	-50	174.6	-84.9	-94.9	179.4	164.7	0	112.1	L1056 W1059 D1110 F1111 S1116 L1117 F1118	L1056-K1114 HydrophobicContact CD1-CB 3.89Å; W1059-K1114 VanDerWaalsContact CD1-CE 3.46Å; W1059-K1114 HydrophobicContact CD2-CD 3.75Å; W1059-K1114 HydrophobicContact CD2-CG 3.8Å; W1059-K1114 HydrophobicContact CE3-CB 4.23Å; W1059-K1114 HydrophobicContact CE3-CD 4.23Å; W1059-K1114 HydrophobicContact CE3-CG 3.93Å; W1059-K1114 HydrophobicContact CG-CD 3.86Å; W1059-K1114 HydrophobicContact CG-CG 4.44Å; W1059-K1114 HydrophobicContact CH2-CG 4.19Å; W1059-K1114 HydrophobicContact CZ2-CG 4.04Å; W1059-K1114 HydrophobicContact CZ3-CB 4.35Å; W1059-K1114 HydrophobicContact CZ3-CG 4.15Å; D1110-K1114 VanDerWaalsContact O-CB 3.26Å; D1110-K1114 WeakPolarHBondContact O-CB 3.44Å; D1110-K1114 VanDerWaalsContact O-CG 3.3Å; D1110-K1114 WeakPolarHBondContact O-CG 3.45Å; D1110-K1114 PolarHBondContact O-N 3Å; F1111-K1114 PolarHBondContact O-N 3.02Å; K1114-S1116 VanDerWaalsContact C-N 3.28Å; K1114-S1116 PolarHBondContact O-N 3.35Å; K1114-L1117 WeakPolarHBondContact O-CB 3.48Å; K1114-L1117 PolarHBondContact O-N 3Å; K1114-L1117 VanDerWaalsContact O-N 3.08Å; K1114-F1118 HydrophobicContact CD-CE2 3.98Å; K1114-F1118 WeakPolarHBondContact O-CD2 3.24Å; K1114-F1118 PolarHBondContact O-N 3.11Å
1115	R	86.9	Confident	86.1	Confident	24 Å²	24	69.1 Å²	69.1	9%	0.091	33%	0.331	C	S	.	.	H	α-helix	trans	-64.8	-28.8	178	-174.8	172.7	172.7	151.6	-1.7	112.9	L1056 L1081 C1082 L1084 F1111 Q1113 R1119	L1056-R1115 HydrophobicContact CD1-CB 4.48Å; L1056-R1115 HydrophobicContact CD2-CB 4Å; L1056-R1115 HydrophobicContact CD2-CG 4.02Å; L1081-R1115 PolarHBondContact O-NH1 3.2Å; C1082-R1115 PolarHBondContact O-NH1 3.07Å; L1084-R1115 PolarHBondContact O-NH1 3.28Å; L1084-R1115 PolarHBondContact O-NH2 3.01Å; F1111-R1115 WeakPolarHBondContact O-CB 3.45Å; F1111-R1115 PolarHBondContact O-N 2.79Å; Q1113-R1115 PolarHBondContact O-N 3.43Å; R1115-R1119 WeakPolarHBondContact O-CB 3.43Å; R1115-R1119 WeakPolarHBondContact O-CG 3.01Å; R1115-R1119 PolarHBondContact O-N 3.36Å
1116	S	85.1	Confident	85.9	Confident	54 Å²	54	70.1 Å²	70.1	38%	0.378	33%	0.331	S	S	.	.	H	α-helix	trans	-74.4	-30.6	171.5	80.2	0	0	0	0	113.1	L1112 Q1113 K1114 Q1120	L1112-S1116 VanDerWaalsContact O-CB 3.32Å; L1112-S1116 WeakPolarHBondContact O-CB 3.33Å; L1112-S1116 PolarHBondContact O-N 3.27Å; Q1113-S1116 PolarHBondContact O-N 2.85Å; Q1113-S1116 VanDerWaalsContact O-N 3.11Å; Q1113-S1116 PolarHBondContact O-OG 3.11Å; K1114-S1116 VanDerWaalsContact C-N 3.28Å; K1114-S1116 PolarHBondContact O-N 3.35Å; S1116-Q1120 PolarHBondContact O-NE2 3.1Å
1117	L	83.4	Confident	85.5	Confident	98 Å²	98	68.3 Å²	68.3	51%	0.513	32%	0.323	S	S	.	.	H	α-helix	trans	-74.2	-44.6	175.4	-69.5	167.4	0	0	0	111.1	Q1113 K1114 R1119 Q1120	Q1113-L1117 HydrophobicContact CG-CD1 4.35Å; Q1113-L1117 WeakPolarHBondContact O-CG 3.26Å; Q1113-L1117 PolarHBondContact O-N 3.02Å; K1114-L1117 WeakPolarHBondContact O-CB 3.48Å; K1114-L1117 PolarHBondContact O-N 3Å; K1114-L1117 VanDerWaalsContact O-N 3.08Å; L1117-R1119 PolarHBondContact O-N 3.41Å; L1117-R1119 VanDerWaalsContact O-N 3.1Å; L1117-Q1120 PolarHBondContact O-N 3.1Å; L1117-Q1120 VanDerWaalsContact O-N 3.17Å
1118	F	77.9	Confident	85	Confident	55 Å²	55	72.8 Å²	72.8	24%	0.241	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-2	173.6	-72.4	-63.3	0	0	0	114.6	A1052 E1055 L1056 K1114	A1052-F1118 HydrophobicContact CB-CB 4.39Å; A1052-F1118 HydrophobicContact CB-CD1 4.21Å; E1055-F1118 HydrophobicContact CB-CE1 3.7Å; E1055-F1118 HydrophobicContact CB-CZ 3.57Å; E1055-F1118 WeakPolarHBondContact OE2-CE1 3.22Å; L1056-F1118 HydrophobicContact CB-CD2 3.9Å; L1056-F1118 HydrophobicContact CB-CE2 4.03Å; L1056-F1118 HydrophobicContact CD1-CD2 4Å; L1056-F1118 HydrophobicContact CD1-CE2 4.2Å; L1056-F1118 HydrophobicContact CG-CD2 4.42Å; K1114-F1118 HydrophobicContact CD-CE2 3.98Å; K1114-F1118 WeakPolarHBondContact O-CD2 3.24Å; K1114-F1118 PolarHBondContact O-N 3.11Å
1119	R	70.8	Confident	84.4	Confident	103 Å²	103	78.6 Å²	78.6	39%	0.389	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-8.1	174.1	-92.1	-177.4	160.5	-167.1	-2.7	114	W1017 Q1085 R1115 L1117	W1017-R1119 VanDerWaalsContact CD1-NH1 3.32Å; W1017-R1119 VanDerWaalsContact CE2-CZ 3.43Å; Q1085-R1119 VanDerWaalsContact CD-NH2 3.31Å; Q1085-R1119 VanDerWaalsContact NE2-NH2 3.18Å; R1115-R1119 WeakPolarHBondContact O-CB 3.43Å; R1115-R1119 WeakPolarHBondContact O-CG 3.01Å; R1115-R1119 PolarHBondContact O-N 3.36Å; L1117-R1119 PolarHBondContact O-N 3.41Å; L1117-R1119 VanDerWaalsContact O-N 3.1Å
1120	Q	59.3	Low	83.7	Confident	209 Å²	209	74.3 Å²	74.3	98%	0.977	36%	0.355	S	S	*	.			trans	-97.3	0	179.6	-75.8	168.7	79.8	0	0	110.8	S1116 L1117	S1116-Q1120 PolarHBondContact O-NE2 3.1Å; L1117-Q1120 PolarHBondContact O-N 3.1Å; L1117-Q1120 VanDerWaalsContact O-N 3.17Å

Retrieved 1,120 of 1,120 residues in 126.1 ms (Link to these results)

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