A0A3Q0KNS6_SCHMA Loading...

Subtilisin-like protease AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KNS6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,650 aa.

						>A0A3Q0KNS6_SCHMA|A0A3Q0KNS6
MNCGNYLHFLLVISLCHTVMNQLYCHQNSCEMPSVEYVVRVDGTFSDAKAVARLHDLKLVDEMIGFKGMYIMHSKVSAFKRRKRRAVVFIRGPGVKWFIKQEFLKRTKRSSVPTVFWDDPLYPDMWYLNRASKGKGYDMNVLEAWELGYTGKGIKITIMDDGIDYTHPDLLVTYDPKASIDINGHDNDPMPNIRNRDNKHGTRCAGQIAAQGNNSVCIVGIAHNAQIGGIRMLDGYITDRVEAETLHFRQDYIDIYSGSWGPEDSGKLYEGPGILAQSAFQQGVVTGRRGFGNIYVWASGNGGSLDDSCACDGYSSSPFTLSVSGVSESNTRPWYLEKCSSTLASTYSSGSPMERMISTTDLGHDCTRMHSGTSACAPMAAGIIALLLEANGRLSWRDVQYITLLTANPKPFKDGNFTKNAVGREYSQLYGYGLMDAGKMVRLGELWRGVPAHHRCTSNVIDVQKNLGGKFNHTLFLHFSGCRPKSGNSDSTNKLNKRSTSENGTPIRYLEHVQVYADIVYERRGLLQLSVISPSGTLSVLLPPRTHDEHSGDIAMLRWPVTTVQFWGENAVGTWQICLDSILGTEISRADPDNIKGFWRSVWIVAYGTDEFPIRLKPPTSERPPPPEWFKSFSKYVVDDRDWHKVYTCHSECAPGGCTGPAADQCLSGCKHFATESRQCVSVCPLGTTAFGALRLGTSLHNYAHSNNNDDHDNNNGRVKPETRTRTSSNYQLDMYDNGNSFINTNSYTHNHQGFKNEMVCQPCWSLCSACIRPHIEYDCTACLNHRFLVPLLTANNEAKTVLFSYTQDNNDHGNTKLINFNLPQIIGTCRTECPIGFFGNKSSSVCEACAENCAQCTGSKSDECLECYSGFRLIHGKCVDGTSADGRCKSGQYLKHSKCVNCHPSCDKTTCITSDQCIWCPIHLPNFFNSTCTKSCPEGWYSGERIQSPFYANSVQNEILPPKQPIQICEACSPGCQKCINFSVCVVCLPDLKLYNGTCILSSDDNNKTDKFSSSNSQIGNRKSNHCGSESCSTCYDGVEKTCLQCSPNYHLLEITLFSSLKNIDFLSGNPNNFTPSSLSSILLSSSPTSSSSSVSKFNETSNTNNSTIISSNIPELTALTATTNSVILNSFNNTTTSNTDRSTLKIPNLFSKIMRNRLALTSRRFVHNNNTNNNEHNSNSIVNIPQPKFICVHTCPNGYYRKSVLINGNEVIMCSKCPPSCSTCTDITHCNLCRPGFYFHKKTNYCLMRTTCRLSEYFDEDQDVCRPCDSNCRTCSGPNPFQCTSCNRKPPAPRCLLTNQRVSKLHRTSKDLAPWTDYSNVEPNSGQCLLCCPYRLALTSRDPRQCMFCVADKPICLSGDEIGAGEGGYIVDVDNNDRSLWESFSKQPYRLILLIGCIIFIILLIIFIVAHFITARRRRHRGSNQMYSCCFKQKYHESNKRTKKIVTSVTKKRKARQMASLTNHHNYYHDQYFNNPTILERNKVEDNESEDEDDDDNPQAEQISLKCKRIKDNNINIGYIDKKINDIELTDDCITTVSNGGSNHFYVPSYKSSNCSNGKLHSGRVYRLSIDDLVDTPPTSITTTTTPTCTFNTANTHNHVRYSQLSSSVLPNDDDDDDVDNDSNSNSNTDPDTNSNNVTESYAVEDNS
					

Structure Viewer

Loading PAE data...

(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	32.8	Very low	49.3	Very low	230 Å²	230	143.4 Å²	143.4	100%	1.133	75%	0.747	S	S	*	*				0	96.3	0	-70.2	158.5	76.1	0	0	105.8
2	N	42.7	Very low	50.3	Low	155 Å²	155	138.9 Å²	138.9	83%	0.829	73%	0.73	S	S	*	*				-157.3	98.4	72.5	-75.2	-25.2	0	0	0	109.8
3	C	35.8	Very low	50.9	Low	139 Å²	139	134.8 Å²	134.8	94%	0.939	71%	0.708	S	S	*	*			trans	-99.6	29.4	176.2	-75.9	0	0	0	0	112.9
4	G	49.8	Very low	51.3	Low	55 Å²	55	130.5 Å²	130.5	57%	0.567	69%	0.694	S	S	*	*	S	Bend	trans	-89.7	-28.3	-172.1	0	0	0	0	0	116.8
5	N	52.6	Low	51.4	Low	148 Å²	148	129.1 Å²	129.1	79%	0.791	69%	0.687	S	S	*	*	S	Bend	trans	-110.7	-5.7	-163.5	-76.8	-1.8	0	0	0	116.7
6	Y	48.8	Very low	51.2	Low	207 Å²	207	126.1 Å²	126.1	81%	0.812	68%	0.677	S	S	*	*	H	α-helix	trans	-84.7	-25.3	177.8	-98.3	-88.2	0	0	0	114.1	H8 F9	Y6-H8 PolarHBondContact O-N 3.36Å; Y6-F9 PolarHBondContact O-N 3.46Å
7	L	53.3	Low	50.9	Low	128 Å²	128	126.4 Å²	126.4	67%	0.67	67%	0.674	S	S	*	*	H	α-helix	trans	-72.2	-31.7	-175.6	-155.9	75.5	0	0	0	112.7	L11	L7-L11 PolarHBondContact O-N 3.32Å
8	H	56.1	Low	50.9	Low	146 Å²	146	124.3 Å²	124.3	68%	0.676	67%	0.666	S	S	*	*	H	α-helix	trans	-70.9	-31.8	178.7	-113.8	-66.2	0	0	0	112.9	Y6 V12	Y6-H8 PolarHBondContact O-N 3.36Å; H8-V12 WeakPolarHBondContact O-CG2 3.42Å; H8-V12 PolarHBondContact O-N 3.38Å
9	F	54.9	Low	50.8	Low	154 Å²	154	123.5 Å²	123.5	68%	0.675	67%	0.666	S	S	*	*	H	α-helix	trans	-72.9	-34.8	179.7	-137.4	-91.6	0	0	0	111.9	Y6 I13	Y6-F9 PolarHBondContact O-N 3.46Å; F9-I13 HydrophobicContact CD1-CD1 4.06Å; F9-I13 HydrophobicContact CE1-CD1 4.45Å; F9-I13 WeakPolarHBondContact O-CG1 3.5Å; F9-I13 PolarHBondContact O-N 3.2Å
10	L	57.6	Low	50.3	Low	116 Å²	116	124.9 Å²	124.9	61%	0.607	67%	0.67	S	S	*	*	H	α-helix	trans	-71.3	-34.4	176.9	-73	169.5	0	0	0	113	I13 S14	L10-I13 PolarHBondContact O-N 2.88Å; L10-S14 PolarHBondContact O-N 2.98Å; L10-S14 VanDerWaalsContact O-N 3.08Å
11	L	58.1	Low	49.7	Very low	99 Å²	99	125.6 Å²	125.6	52%	0.518	67%	0.674	S	S	.	*	H	α-helix	trans	-67.1	-36.5	176.6	-89.9	160.7	0	0	0	112.8	L7 S14 L15	L7-L11 PolarHBondContact O-N 3.32Å; L11-S14 PolarHBondContact O-N 3.39Å; L11-L15 PolarHBondContact O-N 3.41Å; L11-L15 VanDerWaalsContact O-N 3.11Å
12	V	61.6	Low	50.1	Low	90 Å²	90	123 Å²	123	55%	0.545	66%	0.659	S	S	.	*	H	α-helix	trans	-68.6	-39.3	177.1	176.9	0	0	0	0	111.1	H8 S14 L15 C16	H8-V12 WeakPolarHBondContact O-CG2 3.42Å; H8-V12 PolarHBondContact O-N 3.38Å; V12-S14 PolarHBondContact O-N 2.95Å; V12-L15 PolarHBondContact O-N 2.71Å; V12-C16 PolarHBondContact O-N 3.27Å; V12-C16 VanDerWaalsContact O-N 3.11Å
13	I	57.5	Low	49.6	Very low	86 Å²	86	122.8 Å²	122.8	44%	0.441	66%	0.657	S	S	.	*	H	α-helix	trans	-66.9	-38	176.8	-63.8	170.3	0	0	0	111	F9 L10 H17	F9-I13 HydrophobicContact CD1-CD1 4.06Å; F9-I13 HydrophobicContact CE1-CD1 4.45Å; F9-I13 WeakPolarHBondContact O-CG1 3.5Å; F9-I13 PolarHBondContact O-N 3.2Å; L10-I13 PolarHBondContact O-N 2.88Å; I13-H17 PolarHBondContact O-N 3.09Å; I13-H17 VanDerWaalsContact O-N 3.16Å
14	S	56.9	Low	49.5	Very low	74 Å²	74	125.6 Å²	125.6	52%	0.517	65%	0.649	S	S	.	*	H	α-helix	trans	-67.2	-38	177.2	-170.3	0	0	0	0	112.9	L10 L11 V12 H17 T18	L10-S14 PolarHBondContact O-N 2.98Å; L10-S14 VanDerWaalsContact O-N 3.08Å; L11-S14 PolarHBondContact O-N 3.39Å; V12-S14 PolarHBondContact O-N 2.95Å; S14-H17 PolarHBondContact O-N 2.77Å; S14-T18 PolarHBondContact O-N 2.76Å; S14-T18 PolarHBondContact O-OG1 3.01Å
15	L	52.2	Low	48.7	Very low	110 Å²	110	127.6 Å²	127.6	58%	0.576	65%	0.653	S	S	*	*	H	α-helix	trans	-71.6	-36.8	178.8	-92.6	150.4	0	0	0	112.2	L11 V12 H17 T18 V19	L11-L15 PolarHBondContact O-N 3.41Å; L11-L15 VanDerWaalsContact O-N 3.11Å; V12-L15 PolarHBondContact O-N 2.71Å; L15-H17 VanDerWaalsContact C-N 3.32Å; L15-H17 PolarHBondContact O-N 2.98Å; L15-T18 PolarHBondContact O-N 3.18Å; L15-T18 PolarHBondContact O-OG1 2.73Å; L15-V19 PolarHBondContact O-N 2.84Å
16	C	49.1	Very low	47.8	Very low	80 Å²	80	127 Å²	127	54%	0.541	65%	0.646	S	S	.	*	H	α-helix	trans	-64.7	-34.9	172.5	-82.7	0	0	0	0	112.6	V12 M20	V12-C16 PolarHBondContact O-N 3.27Å; V12-C16 VanDerWaalsContact O-N 3.11Å; C16-M20 WeakPolarHBondContact O-CG 3.06Å; C16-M20 PolarHBondContact O-N 3.47Å
17	H	44.8	Very low	47.5	Very low	132 Å²	132	124.9 Å²	124.9	61%	0.611	64%	0.643	S	S	*	*	H	α-helix	trans	-70.2	-30.8	176.5	-106.4	-70.6	0	0	0	113.9	I13 S14 L15	I13-H17 PolarHBondContact O-N 3.09Å; I13-H17 VanDerWaalsContact O-N 3.16Å; S14-H17 PolarHBondContact O-N 2.77Å; L15-H17 VanDerWaalsContact C-N 3.32Å; L15-H17 PolarHBondContact O-N 2.98Å
18	T	52.5	Low	46.9	Very low	89 Å²	89	127.2 Å²	127.2	55%	0.546	66%	0.656	S	S	.	*	H	α-helix	trans	-75.6	-32.4	175.9	42.5	0	0	0	0	113.6	S14 L15	S14-T18 PolarHBondContact O-N 2.76Å; S14-T18 PolarHBondContact O-OG1 3.01Å; L15-T18 PolarHBondContact O-N 3.18Å; L15-T18 PolarHBondContact O-OG1 2.73Å
19	V	48.8	Very low	46	Very low	109 Å²	109	125 Å²	125	66%	0.661	66%	0.657	S	S	*	*	H	α-helix	trans	-78.9	-31.7	179.2	179.5	0	0	0	0	111.7	L15 N21	L15-V19 PolarHBondContact O-N 2.84Å; V19-N21 VanDerWaalsContact C-N 3.29Å; V19-N21 PolarHBondContact O-N 2.78Å
20	M	40.8	Very low	45.4	Very low	150 Å²	150	121.6 Å²	121.6	74%	0.739	65%	0.652	S	S	*	*	H	α-helix	trans	-76.4	-10.9	179.3	-73.5	-67.7	-79.5	0	0	114.5	C16	C16-M20 WeakPolarHBondContact O-CG 3.06Å; C16-M20 PolarHBondContact O-N 3.47Å
21	N	37.4	Very low	44.7	Very low	141 Å²	141	124.1 Å²	124.1	75%	0.754	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	8.2	-179.8	-100.3	-12.6	0	0	0	115.5	V19	V19-N21 VanDerWaalsContact C-N 3.29Å; V19-N21 PolarHBondContact O-N 2.78Å
22	Q	40	Very low	44.2	Very low	175 Å²	175	127 Å²	127	82%	0.818	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.3	9.8	177.6	-84.8	-165.4	-14.4	0	0	116.4
23	L	33.3	Very low	43.8	Very low	151 Å²	151	126.9 Å²	126.9	79%	0.791	67%	0.674	S	S	*	*			trans	-125.3	65.8	-176.8	-125.5	84.9	0	0	0	114.5
24	Y	32.4	Very low	44.2	Very low	198 Å²	198	125 Å²	125	78%	0.776	67%	0.668	S	S	*	*			trans	-140.8	66	160.8	-86.6	-85.2	0	0	0	111.6	H26	Y24-H26 HydrophobicContact CD1-CB 4.38Å; Y24-H26 AromaticContact CD1-CD2 3.57Å; Y24-H26 AromaticContact CE1-CD2 3.49Å; Y24-H26 VanDerWaalsContact CE1-CD2 3.49Å; Y24-H26 WeakPolarHBondContact CE1-CD2 3.37Å
25	C	33	Very low	45	Very low	97 Å²	97	123.4 Å²	123.4	66%	0.655	66%	0.655	S	S	*	*			trans	-95.2	84.3	143.2	-107.6	0	0	0	0	104	Q27 C30	C25-Q27 PolarHBondContact O-N 3.28Å; C25-C30 WeakPolarHBondContact CB-SG 3.49Å; C25-C30 WeakPolarHBondContact SG-CB 3.38Å; C25-C30 CovalentContact SG-SG 2.09Å; C25-C30 PolarHBondContact SG-SG 2.69Å
26	H	35.4	Very low	46.4	Very low	136 Å²	136	121.5 Å²	121.5	63%	0.63	64%	0.644	S	S	*	*			trans	-78	120.3	-178	-138.7	-86.4	0	0	0	109.2	Y24	Y24-H26 HydrophobicContact CD1-CB 4.38Å; Y24-H26 AromaticContact CD1-CD2 3.57Å; Y24-H26 AromaticContact CE1-CD2 3.49Å; Y24-H26 VanDerWaalsContact CE1-CD2 3.49Å; Y24-H26 WeakPolarHBondContact CE1-CD2 3.37Å
27	Q	40.8	Very low	48.3	Very low	162 Å²	162	118.2 Å²	118.2	76%	0.757	62%	0.62	S	S	*	*	S	Bend	trans	59.1	74	170.2	-71.1	173	-25.8	0	0	117.6	C25 S29	C25-Q27 PolarHBondContact O-N 3.28Å; Q27-S29 PolarHBondContact O-N 3.5Å
28	N	41.8	Very low	50.3	Low	177 Å²	177	112.4 Å²	112.4	95%	0.947	59%	0.593	S	S	*	*	S	Bend	trans	56.4	12.6	146.2	-79.4	-8.1	0	0	0	122.7
29	S	37.6	Very low	52	Low	99 Å²	99	108.1 Å²	108.1	69%	0.692	57%	0.567	S	S	*	*			trans	-134.7	73	164.5	63.1	0	0	0	0	112.3	Q27 E31	Q27-S29 PolarHBondContact O-N 3.5Å; S29-E31 PolarHBondContact O-N 2.79Å
30	C	42.5	Very low	53.9	Low	83 Å²	83	107.9 Å²	107.9	56%	0.561	56%	0.555	S	S	*	*			trans	-77.5	79	162.9	-66.3	0	0	0	0	107	C25 M32	C25-C30 WeakPolarHBondContact CB-SG 3.49Å; C25-C30 WeakPolarHBondContact SG-CB 3.38Å; C25-C30 CovalentContact SG-SG 2.09Å; C25-C30 PolarHBondContact SG-SG 2.69Å; C30-M32 PolarHBondContact O-N 2.81Å
31	E	42.7	Very low	56.2	Low	168 Å²	168	101 Å²	101	79%	0.785	52%	0.521	S	S	*	.			trans	-74.9	98	179.2	-155.7	172.1	-145.2	0	0	108.1	S29	S29-E31 PolarHBondContact O-N 2.79Å
32	M	47.9	Very low	58.4	Low	161 Å²	161	98.7 Å²	98.7	79%	0.793	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-70.2	132.3	176.3	-74.5	-164.7	-131.4	0	0	109.6	C30	C30-M32 PolarHBondContact O-N 2.81Å
33	P	53.3	Low	60.4	Low	86 Å²	86	92.1 Å²	92.1	56%	0.558	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-60.7	140.6	-179.8	21.9	-30.6	0	0	0	111.2	V35 F103	P33-V35 PolarHBondContact O-N 3.35Å; P33-F103 HydrophobicContact CB-CZ 4.34Å; P33-F103 HydrophobicContact CG-CE2 4.18Å; P33-F103 HydrophobicContact CG-CZ 4.22Å
34	S	64.6	Low	62.8	Low	47 Å²	47	89 Å²	89	33%	0.329	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-55.8	132.7	172.6	50.4	0	0	0	0	110.5
35	V	74.3	Confident	65.4	Low	40 Å²	40	83.7 Å²	83.7	24%	0.242	46%	0.456	C	S	.	.	P	Polyproline II helix	trans	-78	127	178.4	179.4	0	0	0	0	109.2	P33 Y37 H73 S74 K100	P33-V35 PolarHBondContact O-N 3.35Å; V35-Y37 HydrophobicContact CB-CE2 4.12Å; V35-Y37 HydrophobicContact CG1-CD2 4.46Å; V35-Y37 HydrophobicContact CG1-CE1 4.42Å; V35-Y37 HydrophobicContact CG1-CE2 3.74Å; V35-H73 WeakPolarHBondContact O-CA 3.45Å; V35-S74 PolarHBondContact N-OG 3.43Å; V35-S74 PolarHBondContact O-N 3.06Å; V35-K100 HydrophobicContact CG1-CD 4Å; V35-K100 VanDerWaalsContact CG1-CE 3.47Å; V35-K100 HydrophobicContact CG1-CG 3.69Å
36	E	82.4	Confident	68	Low	71 Å²	71	83 Å²	83	33%	0.332	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	142.7	176.5	-179.5	172.8	104.1	0	0	111.8	I71 M72 H73 Q101	E36-I71 HydrophobicContact CG-CG2 3.77Å; E36-M72 CarbonylContact C-O 3.55Å; E36-H73 IonicContact OE2-CD2 3.08Å; E36-H73 IonicContact OE2-CE1 3.42Å; E36-H73 IonicContact OE2-NE2 2.88Å; E36-H73 PolarHBondContact OE2-NE2 3.21Å; E36-Q101 HydrophobicContact CB-CB 4.07Å; E36-Q101 HydrophobicContact CB-CG 4.18Å; E36-Q101 HydrophobicContact CG-CB 4.3Å; E36-Q101 HydrophobicContact CG-CG 3.85Å; E36-Q101 WeakPolarHBondContact O-CB 3.38Å; E36-Q101 PolarHBondContact O-N 3.18Å
37	Y	87.1	Confident	70.5	Confident	11 Å²	11	80 Å²	80	4%	0.043	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	139.3	175.4	-60.4	-92.1	0	0	0	108.9	V35 L57 I71 M72 I90 F98 I99 K100	V35-Y37 HydrophobicContact CB-CE2 4.12Å; V35-Y37 HydrophobicContact CG1-CD2 4.46Å; V35-Y37 HydrophobicContact CG1-CE1 4.42Å; V35-Y37 HydrophobicContact CG1-CE2 3.74Å; Y37-L57 HydrophobicContact CD2-CD1 4.32Å; Y37-L57 HydrophobicContact CD2-CD2 3.93Å; Y37-L57 HydrophobicContact CE2-CD2 3.91Å; Y37-I71 CarbonylContact O-C 3.41Å; Y37-I71 WeakPolarHBondContact O-CA 2.97Å; Y37-M72 PolarHBondContact N-O 2.91Å; Y37-M72 PolarHBondContact O-N 3.46Å; Y37-I90 HydrophobicContact CD1-CD1 3.53Å; Y37-I90 HydrophobicContact CD2-CD1 4.45Å; Y37-I90 HydrophobicContact CE1-CD1 3.94Å; Y37-I90 HydrophobicContact CG-CD1 3.82Å; Y37-F98 HydrophobicContact CD1-CD2 4.38Å; Y37-I99 WeakPolarHBondContact CA-O 3.39Å; Y37-K100 HydrophobicContact CD1-CB 3.9Å; Y37-K100 HydrophobicContact CD1-CG 4.26Å; Y37-K100 HydrophobicContact CE1-CB 3.74Å; Y37-K100 HydrophobicContact CE1-CD 4.35Å; Y37-K100 HydrophobicContact CE1-CG 3.83Å
38	V	87.6	Confident	72.8	Confident	9 Å²	9	72.3 Å²	72.3	6%	0.055	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	125	164.6	177.8	0	0	0	0	107.1	M63 M69 Y70 F98 I99 Q101	V38-M63 HydrophobicContact CG1-SD 4.13Å; V38-M69 HydrophobicContact CG1-CB 4.47Å; V38-Y70 WeakPolarHBondContact CA-O 3.43Å; V38-F98 CarbonylContact O-C 3.57Å; V38-F98 VanDerWaalsContact O-CA 3.23Å; V38-F98 WeakPolarHBondContact O-CA 3.44Å; V38-I99 HydrophobicContact CB-CG2 3.9Å; V38-I99 PolarHBondContact N-O 3.02Å; V38-I99 PolarHBondContact O-N 2.95Å; V38-Q101 HydrophobicContact CG2-CG 4.12Å
39	V	89.3	Confident	75.1	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	122.9	-171.1	-172.1	0	0	0	0	108.9	V41 V51 Y70 M72 I90 V95 F98	V39-V41 HydrophobicContact CG1-CG2 3.96Å; V39-V51 HydrophobicContact CG1-CG1 4.4Å; V39-Y70 PolarHBondContact N-O 3.34Å; V39-Y70 PolarHBondContact O-N 2.62Å; V39-M72 HydrophobicContact CB-CE 4.04Å; V39-M72 HydrophobicContact CB-SD 4.04Å; V39-M72 HydrophobicContact CG1-CE 4.3Å; V39-M72 HydrophobicContact CG1-SD 4.47Å; V39-M72 HydrophobicContact CG2-CB 4.41Å; V39-M72 HydrophobicContact CG2-CE 4.38Å; V39-M72 HydrophobicContact CG2-CG 4.12Å; V39-M72 HydrophobicContact CG2-SD 3.7Å; V39-I90 HydrophobicContact CG1-CG2 4.1Å; V39-I90 HydrophobicContact CG2-CG2 4.36Å; V39-V95 HydrophobicContact CG1-CG1 3.64Å; V39-V95 HydrophobicContact CG1-CG2 4.18Å; V39-F98 HydrophobicContact CB-CB 4.39Å; V39-F98 HydrophobicContact CG1-CB 4.23Å; V39-F98 HydrophobicContact CG2-CB 4.04Å
40	R	87.3	Confident	77.5	Confident	104 Å²	104	66.6 Å²	66.6	39%	0.392	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	121.7	172.3	-178.1	175.1	179.6	160.7	3	110.1	G68 M69 V95 K96 W97	R40-G68 WeakPolarHBondContact CA-O 3.46Å; R40-M69 HydrophobicContact CB-CG 4.43Å; R40-V95 WeakPolarHBondContact O-CA 3.33Å; R40-K96 HydrophobicContact CG-CB 4.28Å; R40-K96 PolarHBondContact O-N 2.86Å; R40-W97 VanDerWaalsContact CB-CD1 3.45Å; R40-W97 HydrophobicContact CB-CD2 4.37Å; R40-W97 HydrophobicContact CB-CG 4.13Å; R40-W97 VanDerWaalsContact CD-CD1 3.49Å; R40-W97 PolarHBondContact N-O 3.23Å
41	V	88.9	Confident	79.6	Confident	4 Å²	4	63.1 Å²	63.1	2%	0.024	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	127	-179.9	-175.8	0	0	0	0	109.3	V39 G43 D47 A48 V51 G68 Y70 M72 G94	V39-V41 HydrophobicContact CG1-CG2 3.96Å; V41-G43 VanDerWaalsContact C-N 3.32Å; V41-G43 PolarHBondContact O-N 2.73Å; V41-D47 HydrophobicContact CG1-CB 4.18Å; V41-A48 HydrophobicContact CB-CB 4.37Å; V41-A48 HydrophobicContact CG2-CB 4.25Å; V41-V51 HydrophobicContact CG1-CG2 3.92Å; V41-V51 HydrophobicContact CG2-CB 4.27Å; V41-V51 HydrophobicContact CG2-CG1 4.18Å; V41-V51 HydrophobicContact CG2-CG2 4.12Å; V41-G68 PolarHBondContact N-O 3.34Å; V41-Y70 HydrophobicContact CB-CD2 3.97Å; V41-Y70 HydrophobicContact CB-CE2 3.97Å; V41-Y70 HydrophobicContact CG2-CD2 4.02Å; V41-M72 HydrophobicContact CG2-CE 4.33Å; V41-G94 CarbonylContact C-O 3.54Å; V41-G94 VanDerWaalsContact CA-O 3.28Å; V41-G94 WeakPolarHBondContact CA-O 3.25Å
42	D	83.9	Confident	81.7	Confident	93 Å²	93	55.2 Å²	55.2	50%	0.497	31%	0.31	S	S	.	.	S	Bend	trans	-74.7	87.7	170	-76.7	-19.9	0	0	0	108.5	G94 K96	D42-G94 PolarHBondContact N-O 3.19Å; D42-K96 WeakPolarHBondContact OD1-CE 3.22Å; D42-K96 WeakPolarHBondContact OD2-CE 3.34Å; D42-K96 WeakPolarHBondContact OD2-CG 3.48Å; D42-K96 IonicContact OD2-NZ 2.98Å
43	G	81.8	Confident	83.5	Confident	37 Å²	37	55.8 Å²	55.8	38%	0.381	30%	0.303	S	S	.	.	S	Bend	trans	167.6	-170.4	-179.2	0	0	0	0	0	113.3	V41 D47	V41-G43 VanDerWaalsContact C-N 3.32Å; V41-G43 PolarHBondContact O-N 2.73Å; G43-D47 WeakPolarHBondContact CA-OD2 3.37Å
44	T	84.8	Confident	84.9	Confident	85 Å²	85	57.8 Å²	57.8	52%	0.521	31%	0.308	S	S	.	.			trans	-79.9	171.4	173.8	65.4	0	0	0	0	111.2	S46 D47 A48	T44-S46 PolarHBondContact O-N 2.77Å; T44-S46 VanDerWaalsContact O-N 3.08Å; T44-S46 WeakPolarHBondContact OG1-CB 3.18Å; T44-S46 PolarHBondContact OG1-N 3.31Å; T44-D47 PolarHBondContact N-OD2 3.3Å; T44-D47 WeakPolarHBondContact O-CB 3.18Å; T44-D47 PolarHBondContact O-N 3.38Å; T44-D47 PolarHBondContact OG1-OD2 3.44Å; T44-A48 PolarHBondContact O-N 3.34Å; T44-A48 VanDerWaalsContact O-N 3.08Å
45	F	86.4	Confident	85.7	Confident	87 Å²	87	57.2 Å²	57.2	38%	0.382	30%	0.3	S	S	.	.	H	α-helix	trans	-54.4	-28.1	170.2	-164.7	-85.8	0	0	0	112.6	K49 L59 E62 Y70	F45-K49 WeakPolarHBondContact O-CB 3.36Å; F45-K49 PolarHBondContact O-N 3.44Å; F45-L59 HydrophobicContact CD1-CD2 3.86Å; F45-L59 HydrophobicContact CD2-CD2 4.41Å; F45-L59 HydrophobicContact CE1-CD2 3.43Å; F45-L59 VanDerWaalsContact CE1-CD2 3.43Å; F45-L59 HydrophobicContact CE1-CG 4.33Å; F45-L59 HydrophobicContact CE2-CD2 4.02Å; F45-L59 HydrophobicContact CE2-CG 4.46Å; F45-L59 HydrophobicContact CG-CD2 4.33Å; F45-L59 HydrophobicContact CZ-CD2 3.51Å; F45-L59 HydrophobicContact CZ-CG 3.98Å; F45-E62 HydrophobicContact CD2-CB 4.43Å; F45-Y70 HydrophobicContact CB-CE1 4.36Å; F45-Y70 HydrophobicContact CD2-CD1 4.12Å; F45-Y70 AromaticContact CD2-CE1 3.7Å; F45-Y70 HydrophobicContact CD2-CE1 3.7Å; F45-Y70 HydrophobicContact CE2-CD1 4.42Å; F45-Y70 HydrophobicContact CE2-CE1 4.42Å; F45-Y70 HydrophobicContact CG-CE1 4.34Å; F45-Y70 PolarHBondContact N-OH 2.84Å
46	S	87.1	Confident	86.1	Confident	83 Å²	83	60.2 Å²	60.2	58%	0.58	32%	0.315	S	S	*	.	H	α-helix	trans	-66.8	-42.9	174.5	-166.2	0	0	0	0	112	T44 A48 K49 A50	T44-S46 PolarHBondContact O-N 2.77Å; T44-S46 VanDerWaalsContact O-N 3.08Å; T44-S46 WeakPolarHBondContact OG1-CB 3.18Å; T44-S46 PolarHBondContact OG1-N 3.31Å; S46-A48 VanDerWaalsContact C-N 3.35Å; S46-K49 WeakPolarHBondContact O-CB 3.31Å; S46-K49 PolarHBondContact O-N 2.83Å; S46-K49 VanDerWaalsContact O-N 3.17Å; S46-A50 PolarHBondContact O-N 2.97Å
47	D	89.5	Confident	86.3	Confident	73 Å²	73	57.2 Å²	57.2	39%	0.39	30%	0.301	S	S	.	.	H	α-helix	trans	-65.4	-41.4	176.9	-56.7	-57.4	0	0	0	110.5	V41 G43 T44 K49 A50 V51	V41-D47 HydrophobicContact CG1-CB 4.18Å; G43-D47 WeakPolarHBondContact CA-OD2 3.37Å; T44-D47 PolarHBondContact N-OD2 3.3Å; T44-D47 WeakPolarHBondContact O-CB 3.18Å; T44-D47 PolarHBondContact O-N 3.38Å; T44-D47 PolarHBondContact OG1-OD2 3.44Å; D47-K49 VanDerWaalsContact C-N 3.3Å; D47-K49 PolarHBondContact O-N 2.75Å; D47-A50 WeakPolarHBondContact O-CB 3.45Å; D47-A50 PolarHBondContact O-N 3.14Å; D47-A50 VanDerWaalsContact O-N 3.15Å; D47-V51 WeakPolarHBondContact O-CG2 3.45Å; D47-V51 PolarHBondContact O-N 3.35Å
48	A	88.4	Confident	86.3	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-61.4	-37.5	172.9	0	0	0	0	0	112.7	V41 T44 S46 A50 V51 A52 L59 Y70 M72	V41-A48 HydrophobicContact CB-CB 4.37Å; V41-A48 HydrophobicContact CG2-CB 4.25Å; T44-A48 PolarHBondContact O-N 3.34Å; T44-A48 VanDerWaalsContact O-N 3.08Å; S46-A48 VanDerWaalsContact C-N 3.35Å; A48-A50 VanDerWaalsContact C-N 3.35Å; A48-V51 PolarHBondContact O-N 2.8Å; A48-A52 WeakPolarHBondContact O-CB 3.21Å; A48-A52 PolarHBondContact O-N 3.47Å; A48-L59 HydrophobicContact CB-CD1 4.35Å; A48-L59 HydrophobicContact CB-CD2 4.16Å; A48-Y70 HydrophobicContact CB-CD1 3.69Å; A48-Y70 HydrophobicContact CB-CD2 3.35Å; A48-Y70 HydrophobicContact CB-CE1 3.86Å; A48-Y70 HydrophobicContact CB-CE2 3.51Å; A48-Y70 HydrophobicContact CB-CG 3.44Å; A48-Y70 VanDerWaalsContact CB-CG 3.44Å; A48-M72 HydrophobicContact CB-CE 4.21Å; A48-M72 VanDerWaalsContact O-CE 3.3Å; A48-M72 WeakPolarHBondContact O-CE 3.25Å
49	K	89.1	Confident	86.3	Confident	99 Å²	99	64.1 Å²	64.1	43%	0.43	33%	0.332	S	S	.	.	H	α-helix	trans	-67.8	-36	175.4	-167.4	173.7	-174.6	172.5	0	111.5	F45 S46 D47 R53 L59	F45-K49 WeakPolarHBondContact O-CB 3.36Å; F45-K49 PolarHBondContact O-N 3.44Å; S46-K49 WeakPolarHBondContact O-CB 3.31Å; S46-K49 PolarHBondContact O-N 2.83Å; S46-K49 VanDerWaalsContact O-N 3.17Å; D47-K49 VanDerWaalsContact C-N 3.3Å; D47-K49 PolarHBondContact O-N 2.75Å; K49-R53 WeakPolarHBondContact O-CB 3.12Å; K49-R53 VanDerWaalsContact O-CG 3.31Å; K49-R53 WeakPolarHBondContact O-CG 3.49Å; K49-R53 PolarHBondContact O-N 3.23Å; K49-L59 HydrophobicContact CB-CD2 3.85Å; K49-L59 HydrophobicContact CG-CD2 4.44Å
50	A	87.8	Confident	86.2	Confident	57 Å²	57	67.1 Å²	67.1	47%	0.471	35%	0.35	S	S	.	.	H	α-helix	trans	-65.8	-46.1	172.8	0	0	0	0	0	111.4	S46 D47 A48 A52 R53 L54	S46-A50 PolarHBondContact O-N 2.97Å; D47-A50 WeakPolarHBondContact O-CB 3.45Å; D47-A50 PolarHBondContact O-N 3.14Å; D47-A50 VanDerWaalsContact O-N 3.15Å; A48-A50 VanDerWaalsContact C-N 3.35Å; A50-A52 PolarHBondContact O-N 2.8Å; A50-R53 PolarHBondContact O-N 3.01Å; A50-L54 WeakPolarHBondContact O-CB 3.16Å; A50-L54 PolarHBondContact O-N 2.8Å
51	V	86.8	Confident	86.1	Confident	11 Å²	11	66.2 Å²	66.2	7%	0.067	35%	0.353	C	S	.	.	H	α-helix	trans	-57.5	-48.8	173.5	168.7	0	0	0	0	111.1	V39 V41 D47 A48 R53 L54 H55 M72 V95	V39-V51 HydrophobicContact CG1-CG1 4.4Å; V41-V51 HydrophobicContact CG1-CG2 3.92Å; V41-V51 HydrophobicContact CG2-CB 4.27Å; V41-V51 HydrophobicContact CG2-CG1 4.18Å; V41-V51 HydrophobicContact CG2-CG2 4.12Å; D47-V51 WeakPolarHBondContact O-CG2 3.45Å; D47-V51 PolarHBondContact O-N 3.35Å; A48-V51 PolarHBondContact O-N 2.8Å; V51-R53 VanDerWaalsContact C-N 3.32Å; V51-R53 PolarHBondContact O-N 2.93Å; V51-L54 WeakPolarHBondContact O-CB 3.33Å; V51-L54 PolarHBondContact O-N 3.03Å; V51-H55 PolarHBondContact O-CD2 3.3Å; V51-H55 PolarHBondContact O-N 3.3Å; V51-M72 HydrophobicContact CB-CE 4.42Å; V51-M72 HydrophobicContact CG1-CE 4.12Å; V51-V95 HydrophobicContact CB-CG2 4.35Å; V51-V95 HydrophobicContact CG1-CG2 3.38Å; V51-V95 HydrophobicContact CG2-CG2 3.95Å
52	A	87.5	Confident	86	Confident	2 Å²	2	68.8 Å²	68.8	2%	0.017	37%	0.365	C	S	.	.	H	α-helix	trans	-58.8	-44.4	178.7	0	0	0	0	0	111.5	A48 A50 H55 D56 L57 L59 M72	A48-A52 WeakPolarHBondContact O-CB 3.21Å; A48-A52 PolarHBondContact O-N 3.47Å; A50-A52 PolarHBondContact O-N 2.8Å; A52-H55 PolarHBondContact O-N 2.04Å; A52-D56 PolarHBondContact O-N 3.21Å; A52-D56 VanDerWaalsContact O-N 3.15Å; A52-L57 CarbonylContact C-O 2.97Å; A52-L57 HydrophobicContact CB-CB 4.38Å; A52-L57 PolarHBondContact O-N 3.23Å; A52-L57 VanDerWaalsContact O-O 3.05Å; A52-L59 HydrophobicContact CB-CB 3.81Å; A52-M72 HydrophobicContact CB-CE 4.05Å; A52-M72 HydrophobicContact CB-CG 4.43Å; A52-M72 HydrophobicContact CB-SD 3.73Å
53	R	84.9	Confident	85.7	Confident	173 Å²	173	67.5 Å²	67.5	65%	0.653	36%	0.357	S	S	*	.	H	α-helix	trans	-63.3	-42.6	176	-75.6	174.1	176.3	174.8	-3.1	112.5	K49 A50 V51 H55 D56	K49-R53 WeakPolarHBondContact O-CB 3.12Å; K49-R53 VanDerWaalsContact O-CG 3.31Å; K49-R53 WeakPolarHBondContact O-CG 3.49Å; K49-R53 PolarHBondContact O-N 3.23Å; A50-R53 PolarHBondContact O-N 3.01Å; V51-R53 VanDerWaalsContact C-N 3.32Å; V51-R53 PolarHBondContact O-N 2.93Å; R53-H55 VanDerWaalsContact C-N 3.26Å; R53-H55 PolarHBondContact O-N 3.37Å; R53-D56 PolarHBondContact O-N 3.48Å
54	L	83.1	Confident	84.7	Confident	127 Å²	127	73.4 Å²	73.4	67%	0.665	38%	0.378	S	S	*	.	H	α-helix	trans	-60.3	-37.3	178.9	-168.5	80.5	0	0	0	111.9	A50 V51	A50-L54 WeakPolarHBondContact O-CB 3.16Å; A50-L54 PolarHBondContact O-N 2.8Å; V51-L54 WeakPolarHBondContact O-CB 3.33Å; V51-L54 PolarHBondContact O-N 3.03Å
55	H	81.5	Confident	84.1	Confident	35 Å²	35	73 Å²	73	16%	0.162	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	12.4	-177.8	-65.4	-68.2	0	0	0	114	V51 A52 R53 L57 F89	V51-H55 PolarHBondContact O-CD2 3.3Å; V51-H55 PolarHBondContact O-N 3.3Å; A52-H55 PolarHBondContact O-N 2.04Å; R53-H55 VanDerWaalsContact C-N 3.26Å; R53-H55 PolarHBondContact O-N 3.37Å; H55-L57 HydrophobicContact CB-CD1 4.18Å; H55-L57 HydrophobicContact CB-CG 4.19Å; H55-L57 PolarHBondContact O-N 2.94Å; H55-F89 PolarHBondContact CE1-O 3.42Å; H55-F89 PolarHBondContact ND1-O 2.99Å
56	D	83.8	Confident	83.8	Confident	103 Å²	103	74.3 Å²	74.3	55%	0.551	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	28.8	-179.3	-114.9	-23	0	0	0	114.9	A52 R53 K75	A52-D56 PolarHBondContact O-N 3.21Å; A52-D56 VanDerWaalsContact O-N 3.15Å; R53-D56 PolarHBondContact O-N 3.48Å; D56-K75 IonicContact OD1-NZ 3.6Å; D56-K75 PolarHBondContact OD1-NZ 3.22Å
57	L	86	Confident	83.5	Confident	9 Å²	9	79.7 Å²	79.7	5%	0.047	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	159.7	173.6	-56.7	174.5	0	0	0	110.5	Y37 A52 H55 M72 H73 I90	Y37-L57 HydrophobicContact CD2-CD1 4.32Å; Y37-L57 HydrophobicContact CD2-CD2 3.93Å; Y37-L57 HydrophobicContact CE2-CD2 3.91Å; A52-L57 CarbonylContact C-O 2.97Å; A52-L57 HydrophobicContact CB-CB 4.38Å; A52-L57 PolarHBondContact O-N 3.23Å; A52-L57 VanDerWaalsContact O-O 3.05Å; H55-L57 HydrophobicContact CB-CD1 4.18Å; H55-L57 HydrophobicContact CB-CG 4.19Å; H55-L57 PolarHBondContact O-N 2.94Å; L57-M72 HydrophobicContact CB-CB 4.06Å; L57-M72 HydrophobicContact CD1-CB 3.98Å; L57-M72 HydrophobicContact CD1-SD 4.07Å; L57-H73 CarbonylContact C-O 3.57Å; L57-H73 WeakPolarHBondContact CA-O 3.44Å; L57-I90 HydrophobicContact CD1-CD1 3.69Å; L57-I90 HydrophobicContact CD1-CG1 4.31Å
58	K	86.2	Confident	83.3	Confident	138 Å²	138	76.8 Å²	76.8	60%	0.6	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.9	117.7	167.2	-178.2	-176.9	176.1	-172.1	0	107.7	V60 M72 H73	K58-V60 PolarHBondContact O-N 3.3Å; K58-M72 CarbonylContact O-C 3.43Å; K58-M72 VanDerWaalsContact O-CA 3.23Å; K58-M72 WeakPolarHBondContact O-CA 3.36Å; K58-H73 PolarHBondContact N-O 3.46Å; K58-H73 PolarHBondContact O-N 2.78Å
59	L	88.9	Confident	83.4	Confident	26 Å²	26	78 Å²	78	14%	0.136	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	121.3	166.9	178	63	0	0	0	108.2	F45 A48 K49 A52 Y70 M72	F45-L59 HydrophobicContact CD1-CD2 3.86Å; F45-L59 HydrophobicContact CD2-CD2 4.41Å; F45-L59 HydrophobicContact CE1-CD2 3.43Å; F45-L59 VanDerWaalsContact CE1-CD2 3.43Å; F45-L59 HydrophobicContact CE1-CG 4.33Å; F45-L59 HydrophobicContact CE2-CD2 4.02Å; F45-L59 HydrophobicContact CE2-CG 4.46Å; F45-L59 HydrophobicContact CG-CD2 4.33Å; F45-L59 HydrophobicContact CZ-CD2 3.51Å; F45-L59 HydrophobicContact CZ-CG 3.98Å; A48-L59 HydrophobicContact CB-CD1 4.35Å; A48-L59 HydrophobicContact CB-CD2 4.16Å; K49-L59 HydrophobicContact CB-CD2 3.85Å; K49-L59 HydrophobicContact CG-CD2 4.44Å; A52-L59 HydrophobicContact CB-CB 3.81Å; L59-Y70 HydrophobicContact CD1-CD1 4.04Å; L59-Y70 HydrophobicContact CD1-CG 4.15Å; L59-M72 HydrophobicContact CD1-CE 4.09Å; L59-M72 HydrophobicContact CD1-CG 4.1Å
60	V	86.4	Confident	83.4	Confident	63 Å²	63	73.5 Å²	73.5	38%	0.382	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-62.1	178.9	-178.5	0	0	0	0	108.5	K58 I71 H73	K58-V60 PolarHBondContact O-N 3.3Å; V60-I71 WeakPolarHBondContact CA-O 2.78Å; V60-I71 HydrophobicContact CB-CB 4.16Å; V60-I71 HydrophobicContact CB-CG2 4.04Å; V60-I71 WeakPolarHBondContact CB-O 3.28Å; V60-I71 HydrophobicContact CG1-CG2 4.47Å; V60-I71 HydrophobicContact CG2-CG2 4.25Å; V60-I71 PolarHBondContact N-O 3.49Å; V60-H73 HydrophobicContact CG2-CB 4.12Å; V60-H73 VanDerWaalsContact CG2-CG 3.49Å
61	D	85.9	Confident	83.4	Confident	85 Å²	85	72.6 Å²	72.6	46%	0.455	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.5	173.3	-178.3	-148.3	-14.7	0	0	0	112.1	Y70 I71	D61-Y70 CarbonylContact O-C 3.58Å; D61-Y70 WeakPolarHBondContact O-CA 3.38Å; D61-I71 PolarHBondContact N-O 3.2Å; D61-I71 PolarHBondContact O-N 3.36Å
62	E	85.6	Confident	83.5	Confident	59 Å²	59	72 Å²	72	28%	0.276	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	139.5	161.2	-167.3	168	-158.1	0	0	110	F45 I64 K67 G68 M69 Y70	F45-E62 HydrophobicContact CD2-CB 4.43Å; E62-I64 PolarHBondContact O-N 2.78Å; E62-K67 VanDerWaalsContact OE1-CA 3.28Å; E62-K67 WeakPolarHBondContact OE1-CA 3.25Å; E62-G68 PolarHBondContact OE1-N 2.85Å; E62-M69 CarbonylContact C-O 3.53Å; E62-M69 WeakPolarHBondContact CA-O 3.44Å; E62-M69 WeakPolarHBondContact CG-O 3.13Å; E62-Y70 HydrophobicContact CB-CD1 3.89Å; E62-Y70 HydrophobicContact CB-CE1 3.78Å; E62-Y70 HydrophobicContact CG-CD1 4.07Å; E62-Y70 HydrophobicContact CG-CE1 3.74Å
63	M	77.7	Confident	83.3	Confident	66 Å²	66	74.2 Å²	74.2	33%	0.325	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-69.9	121.3	-178.7	-168.4	177.2	-172.4	0	0	109.6	V38 G65 F66 M69 I71	V38-M63 HydrophobicContact CG1-SD 4.13Å; M63-G65 PolarHBondContact O-N 2.79Å; M63-F66 HydrophobicContact CB-CB 4.35Å; M63-F66 HydrophobicContact CE-CD2 4.39Å; M63-F66 HydrophobicContact CE-CE2 4.48Å; M63-F66 HydrophobicContact CG-CD2 4.1Å; M63-F66 PolarHBondContact O-N 3.48Å; M63-F66 HydrophobicContact SD-CD2 4.06Å; M63-M69 HydrophobicContact CB-CB 4.07Å; M63-M69 WeakPolarHBondContact CB-O 2.77Å; M63-M69 PolarHBondContact N-O 3.49Å; M63-M69 HydrophobicContact SD-CE 3.75Å; M63-I71 HydrophobicContact CB-CG1 4.44Å
64	I	62.3	Low	83	Confident	161 Å²	161	67 Å²	67	83%	0.826	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	124.6	-177.8	-59.8	172.4	0	0	0	110.2	E62 F66	E62-I64 PolarHBondContact O-N 2.78Å; I64-F66 VanDerWaalsContact C-N 3.33Å; I64-F66 WeakPolarHBondContact O-CD2 3.17Å
65	G	70.5	Confident	82.4	Confident	77 Å²	77	65.1 Å²	65.1	79%	0.794	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.1	-4.8	-179.7	0	0	0	0	0	115.5	M63	M63-G65 PolarHBondContact O-N 2.79Å
66	F	80.5	Confident	81.4	Confident	113 Å²	113	67.7 Å²	67.7	50%	0.496	36%	0.356	S	S	.	.			trans	-129.5	89	-176	-64.1	-84.2	0	0	0	112.6	M63 I64 G68 M69	M63-F66 HydrophobicContact CB-CB 4.35Å; M63-F66 HydrophobicContact CE-CD2 4.39Å; M63-F66 HydrophobicContact CE-CE2 4.48Å; M63-F66 HydrophobicContact CG-CD2 4.1Å; M63-F66 PolarHBondContact O-N 3.48Å; M63-F66 HydrophobicContact SD-CD2 4.06Å; I64-F66 VanDerWaalsContact C-N 3.33Å; I64-F66 WeakPolarHBondContact O-CD2 3.17Å; F66-G68 PolarHBondContact O-N 3.22Å; F66-M69 HydrophobicContact CB-CB 4.14Å; F66-M69 HydrophobicContact CB-CE 3.19Å; F66-M69 HydrophobicContact CB-CG 4.11Å; F66-M69 HydrophobicContact CB-SD 4.43Å; F66-M69 HydrophobicContact CD1-CE 3.41Å; F66-M69 VanDerWaalsContact CD1-CE 3.41Å; F66-M69 HydrophobicContact CD2-CE 3.95Å; F66-M69 HydrophobicContact CE1-CE 4.2Å; F66-M69 HydrophobicContact CG-CE 3.24Å; F66-M69 PolarHBondContact O-N 3.16Å
67	K	81.3	Confident	79.8	Confident	197 Å²	197	67.7 Å²	67.7	86%	0.857	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	131.5	-179.3	-161.6	174.6	-176.8	177.4	0	112.1	E62	E62-K67 VanDerWaalsContact OE1-CA 3.28Å; E62-K67 WeakPolarHBondContact OE1-CA 3.25Å
68	G	86.2	Confident	78	Confident	11 Å²	11	70.6 Å²	70.6	11%	0.113	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.3	5.3	-178	0	0	0	0	0	115	R40 V41 E62 F66 Y70	R40-G68 WeakPolarHBondContact CA-O 3.46Å; V41-G68 PolarHBondContact N-O 3.34Å; E62-G68 PolarHBondContact OE1-N 2.85Å; F66-G68 PolarHBondContact O-N 3.22Å; G68-Y70 VanDerWaalsContact C-CE2 3.48Å; G68-Y70 WeakPolarHBondContact O-CE2 3.23Å
69	M	89.5	Confident	76.2	Confident	25 Å²	25	72.1 Å²	72.1	12%	0.123	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	127.1	173.9	-60	-147.1	-66.6	0	0	110.3	V38 R40 E62 M63 F66 W97	V38-M69 HydrophobicContact CG1-CB 4.47Å; R40-M69 HydrophobicContact CB-CG 4.43Å; E62-M69 CarbonylContact C-O 3.53Å; E62-M69 WeakPolarHBondContact CA-O 3.44Å; E62-M69 WeakPolarHBondContact CG-O 3.13Å; M63-M69 HydrophobicContact CB-CB 4.07Å; M63-M69 WeakPolarHBondContact CB-O 2.77Å; M63-M69 PolarHBondContact N-O 3.49Å; M63-M69 HydrophobicContact SD-CE 3.75Å; F66-M69 HydrophobicContact CB-CB 4.14Å; F66-M69 HydrophobicContact CB-CE 3.19Å; F66-M69 HydrophobicContact CB-CG 4.11Å; F66-M69 HydrophobicContact CB-SD 4.43Å; F66-M69 HydrophobicContact CD1-CE 3.41Å; F66-M69 VanDerWaalsContact CD1-CE 3.41Å; F66-M69 HydrophobicContact CD2-CE 3.95Å; F66-M69 HydrophobicContact CE1-CE 4.2Å; F66-M69 HydrophobicContact CG-CE 3.24Å; F66-M69 PolarHBondContact O-N 3.16Å; M69-W97 HydrophobicContact SD-CH2 4.29Å; M69-W97 HydrophobicContact SD-CZ2 3.47Å; M69-W97 WeakPolarHBondContact SD-CZ2 3.46Å
70	Y	89.6	Confident	74.1	Confident	6 Å²	6	80.6 Å²	80.6	2%	0.024	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	135.6	-169.6	-61.6	-78.2	0	0	0	111.3	V38 V39 V41 F45 A48 L59 D61 E62 G68	V38-Y70 WeakPolarHBondContact CA-O 3.43Å; V39-Y70 PolarHBondContact N-O 3.34Å; V39-Y70 PolarHBondContact O-N 2.62Å; V41-Y70 HydrophobicContact CB-CD2 3.97Å; V41-Y70 HydrophobicContact CB-CE2 3.97Å; V41-Y70 HydrophobicContact CG2-CD2 4.02Å; F45-Y70 HydrophobicContact CB-CE1 4.36Å; F45-Y70 HydrophobicContact CD2-CD1 4.12Å; F45-Y70 AromaticContact CD2-CE1 3.7Å; F45-Y70 HydrophobicContact CD2-CE1 3.7Å; F45-Y70 HydrophobicContact CE2-CD1 4.42Å; F45-Y70 HydrophobicContact CE2-CE1 4.42Å; F45-Y70 HydrophobicContact CG-CE1 4.34Å; F45-Y70 PolarHBondContact N-OH 2.84Å; A48-Y70 HydrophobicContact CB-CD1 3.69Å; A48-Y70 HydrophobicContact CB-CD2 3.35Å; A48-Y70 HydrophobicContact CB-CE1 3.86Å; A48-Y70 HydrophobicContact CB-CE2 3.51Å; A48-Y70 HydrophobicContact CB-CG 3.44Å; A48-Y70 VanDerWaalsContact CB-CG 3.44Å; L59-Y70 HydrophobicContact CD1-CD1 4.04Å; L59-Y70 HydrophobicContact CD1-CG 4.15Å; D61-Y70 CarbonylContact O-C 3.58Å; D61-Y70 WeakPolarHBondContact O-CA 3.38Å; E62-Y70 HydrophobicContact CB-CD1 3.89Å; E62-Y70 HydrophobicContact CB-CE1 3.78Å; E62-Y70 HydrophobicContact CG-CD1 4.07Å; E62-Y70 HydrophobicContact CG-CE1 3.74Å; G68-Y70 VanDerWaalsContact C-CE2 3.48Å; G68-Y70 WeakPolarHBondContact O-CE2 3.23Å
71	I	88.2	Confident	72	Confident	37 Å²	37	88.9 Å²	88.9	19%	0.19	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	126.8	176	-55.1	170.1	0	0	0	107.7	E36 Y37 V60 D61 M63	E36-I71 HydrophobicContact CG-CG2 3.77Å; Y37-I71 CarbonylContact O-C 3.41Å; Y37-I71 WeakPolarHBondContact O-CA 2.97Å; V60-I71 WeakPolarHBondContact CA-O 2.78Å; V60-I71 HydrophobicContact CB-CB 4.16Å; V60-I71 HydrophobicContact CB-CG2 4.04Å; V60-I71 WeakPolarHBondContact CB-O 3.28Å; V60-I71 HydrophobicContact CG1-CG2 4.47Å; V60-I71 HydrophobicContact CG2-CG2 4.25Å; V60-I71 PolarHBondContact N-O 3.49Å; D61-I71 PolarHBondContact N-O 3.2Å; D61-I71 PolarHBondContact O-N 3.36Å; M63-I71 HydrophobicContact CB-CG1 4.44Å
72	M	88.4	Confident	69.7	Low	0 Å²	0	96.2 Å²	96.2	0%	0	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	137.1	-177.4	-57.7	-173.2	-178.2	0	0	111	E36 Y37 V39 V41 A48 V51 A52 L57 K58 L59	E36-M72 CarbonylContact C-O 3.55Å; Y37-M72 PolarHBondContact N-O 2.91Å; Y37-M72 PolarHBondContact O-N 3.46Å; V39-M72 HydrophobicContact CB-CE 4.04Å; V39-M72 HydrophobicContact CB-SD 4.04Å; V39-M72 HydrophobicContact CG1-CE 4.3Å; V39-M72 HydrophobicContact CG1-SD 4.47Å; V39-M72 HydrophobicContact CG2-CB 4.41Å; V39-M72 HydrophobicContact CG2-CE 4.38Å; V39-M72 HydrophobicContact CG2-CG 4.12Å; V39-M72 HydrophobicContact CG2-SD 3.7Å; V41-M72 HydrophobicContact CG2-CE 4.33Å; A48-M72 HydrophobicContact CB-CE 4.21Å; A48-M72 VanDerWaalsContact O-CE 3.3Å; A48-M72 WeakPolarHBondContact O-CE 3.25Å; V51-M72 HydrophobicContact CB-CE 4.42Å; V51-M72 HydrophobicContact CG1-CE 4.12Å; A52-M72 HydrophobicContact CB-CE 4.05Å; A52-M72 HydrophobicContact CB-CG 4.43Å; A52-M72 HydrophobicContact CB-SD 3.73Å; L57-M72 HydrophobicContact CB-CB 4.06Å; L57-M72 HydrophobicContact CD1-CB 3.98Å; L57-M72 HydrophobicContact CD1-SD 4.07Å; K58-M72 CarbonylContact O-C 3.43Å; K58-M72 VanDerWaalsContact O-CA 3.23Å; K58-M72 WeakPolarHBondContact O-CA 3.36Å; L59-M72 HydrophobicContact CD1-CE 4.09Å; L59-M72 HydrophobicContact CD1-CG 4.1Å
73	H	84	Confident	67.5	Low	47 Å²	47	103.2 Å²	103.2	22%	0.218	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	144.8	-179.6	-71	174.6	0	0	0	112.1	V35 E36 L57 K58 V60 K75	V35-H73 WeakPolarHBondContact O-CA 3.45Å; E36-H73 IonicContact OE2-CD2 3.08Å; E36-H73 IonicContact OE2-CE1 3.42Å; E36-H73 IonicContact OE2-NE2 2.88Å; E36-H73 PolarHBondContact OE2-NE2 3.21Å; L57-H73 CarbonylContact C-O 3.57Å; L57-H73 WeakPolarHBondContact CA-O 3.44Å; K58-H73 PolarHBondContact N-O 3.46Å; K58-H73 PolarHBondContact O-N 2.78Å; V60-H73 HydrophobicContact CG2-CB 4.12Å; V60-H73 VanDerWaalsContact CG2-CG 3.49Å; H73-K75 PolarHBondContact O-N 3.08Å
74	S	77.3	Confident	65.5	Low	22 Å²	22	112 Å²	112	15%	0.154	54%	0.537	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	130.5	168.9	67.8	0	0	0	0	110.7	V35 V76	V35-S74 PolarHBondContact N-OG 3.43Å; V35-S74 PolarHBondContact O-N 3.06Å; S74-V76 PolarHBondContact O-N 2.99Å
75	K	70.2	Confident	64.5	Low	87 Å²	87	115.6 Å²	115.6	38%	0.378	54%	0.54	S	S	.	.			trans	-64.9	118.5	172	-64.3	174.6	-167.3	162.6	0	109.6	D56 H73 S77 A78	D56-K75 IonicContact OD1-NZ 3.6Å; D56-K75 PolarHBondContact OD1-NZ 3.22Å; H73-K75 PolarHBondContact O-N 3.08Å; K75-S77 PolarHBondContact O-N 3.3Å; K75-A78 PolarHBondContact O-N 3.21Å; K75-A78 VanDerWaalsContact O-N 3.11Å
76	V	60.5	Low	63.2	Low	89 Å²	89	115.5 Å²	115.5	54%	0.539	53%	0.532	S	S	.	.	G	3₁₀ helix	trans	-53	-27.9	-176.1	-179.5	0	0	0	0	112.6	S74 A78	S74-V76 PolarHBondContact O-N 2.99Å; V76-A78 VanDerWaalsContact C-N 3.32Å; V76-A78 PolarHBondContact O-N 3.28Å
77	S	51.8	Low	61.6	Low	104 Å²	104	113.9 Å²	113.9	73%	0.727	53%	0.531	S	S	*	.	G	3₁₀ helix	trans	-73.4	-9.5	-178.6	37	0	0	0	0	115.8	K75 F79	K75-S77 PolarHBondContact O-N 3.3Å; S77-F79 PolarHBondContact O-N 3.37Å
78	A	47.9	Very low	60.1	Low	69 Å²	69	109 Å²	109	57%	0.57	52%	0.518	S	S	*	.	G	3₁₀ helix	trans	-79.6	-10.2	-177.1	0	0	0	0	0	115	K75 V76	K75-A78 PolarHBondContact O-N 3.21Å; K75-A78 VanDerWaalsContact O-N 3.11Å; V76-A78 VanDerWaalsContact C-N 3.32Å; V76-A78 PolarHBondContact O-N 3.28Å
79	F	48.6	Very low	58.6	Low	170 Å²	170	115.6 Å²	115.6	75%	0.746	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-87.4	-6.5	-174.7	-97.5	-85.1	0	0	0	115.7	S77 R81	S77-F79 PolarHBondContact O-N 3.37Å; F79-R81 PolarHBondContact O-N 2.97Å
80	K	44.7	Very low	57.1	Low	204 Å²	204	114.4 Å²	114.4	89%	0.887	54%	0.538	S	S	*	.	G	3₁₀ helix	trans	-73.9	-20.3	-175.5	-93.2	-173.9	177.2	178.6	0	115.4
81	R	40.8	Very low	55.6	Low	237 Å²	237	123.4 Å²	123.4	89%	0.894	57%	0.572	S	S	*	*	S	Bend	trans	-156.5	81.7	179	-90	-175.5	166.8	140.7	-5	112.5	F79	F79-R81 PolarHBondContact O-N 2.97Å
82	R	39	Very low	54.6	Low	239 Å²	239	122.7 Å²	122.7	90%	0.902	57%	0.574	S	S	*	*			trans	-176.5	113.3	144.8	-104.7	161	-179.8	172.1	1.2	110.4	R84	R82-R84 PolarHBondContact O-N 2.88Å
83	K	38.4	Very low	53.8	Low	207 Å²	207	128.7 Å²	128.7	90%	0.9	61%	0.612	S	S	*	*			trans	-51.8	124.1	170.1	-83.5	176	171.5	175.7	0	110.2	R85	K83-R85 PolarHBondContact O-N 3.04Å; K83-R85 VanDerWaalsContact O-N 3.15Å
84	R	37	Very low	53.4	Low	250 Å²	250	128 Å²	128	94%	0.943	62%	0.619	S	S	*	*			trans	47.4	44.3	149.2	-68.1	-174.3	173.9	162.8	-2.3	118.3	R82	R82-R84 PolarHBondContact O-N 2.88Å
85	R	39.5	Very low	53.6	Low	236 Å²	236	128 Å²	128	89%	0.891	62%	0.617	S	S	*	*			trans	-96	97.2	145.3	-86.7	-174.8	176.2	163	-0.3	106.9	K83 V87	K83-R85 PolarHBondContact O-N 3.04Å; K83-R85 VanDerWaalsContact O-N 3.15Å; R85-V87 PolarHBondContact O-N 3.21Å
86	A	43.2	Very low	54.2	Low	76 Å²	76	129.9 Å²	129.9	63%	0.628	63%	0.626	S	S	*	*			trans	-47.6	136.5	165.8	0	0	0	0	0	108.2	V88	A86-V88 HydrophobicContact CB-CG2 3.73Å; A86-V88 WeakPolarHBondContact O-CG2 3.44Å; A86-V88 PolarHBondContact O-N 3.45Å
87	V	48.6	Very low	55.3	Low	78 Å²	78	130.6 Å²	130.6	47%	0.473	62%	0.619	S	S	.	*	S	Bend	trans	-63.5	76.9	176.4	-177.6	0	0	0	0	108	R85	R85-V87 PolarHBondContact O-N 3.21Å
88	V	48.3	Very low	57	Low	96 Å²	96	128.5 Å²	128.5	58%	0.582	60%	0.597	S	S	*	*			trans	-97.5	-5.7	-172.9	168.4	0	0	0	0	111.8	A86	A86-V88 HydrophobicContact CB-CG2 3.73Å; A86-V88 WeakPolarHBondContact O-CG2 3.44Å; A86-V88 PolarHBondContact O-N 3.45Å
89	F	54.8	Low	58.6	Low	148 Å²	148	129.2 Å²	129.2	65%	0.649	59%	0.59	S	S	*	*			trans	-121.7	77.6	-176.6	-91.2	-93.5	0	0	0	111.9	H55 R91	H55-F89 PolarHBondContact CE1-O 3.42Å; H55-F89 PolarHBondContact ND1-O 2.99Å; F89-R91 HydrophobicContact CD1-CB 4.33Å
90	I	58.4	Low	60.2	Low	1 Å²	1	126 Å²	126	1%	0.005	58%	0.576	C	S	.	*			trans	-100.4	49.8	147.2	-47.5	175	0	0	0	107.1	Y37 V39 L57 V95 F98	Y37-I90 HydrophobicContact CD1-CD1 3.53Å; Y37-I90 HydrophobicContact CD2-CD1 4.45Å; Y37-I90 HydrophobicContact CE1-CD1 3.94Å; Y37-I90 HydrophobicContact CG-CD1 3.82Å; V39-I90 HydrophobicContact CG1-CG2 4.1Å; V39-I90 HydrophobicContact CG2-CG2 4.36Å; L57-I90 HydrophobicContact CD1-CD1 3.69Å; L57-I90 HydrophobicContact CD1-CG1 4.31Å; I90-V95 HydrophobicContact CG2-CG1 4.16Å; I90-V95 HydrophobicContact CG2-CG2 4.45Å; I90-F98 HydrophobicContact CB-CB 4.29Å; I90-F98 HydrophobicContact CB-CD1 3.64Å; I90-F98 HydrophobicContact CB-CD2 3.87Å; I90-F98 HydrophobicContact CB-CE1 3.81Å; I90-F98 HydrophobicContact CB-CE2 4.02Å; I90-F98 HydrophobicContact CB-CG 3.66Å; I90-F98 HydrophobicContact CB-CZ 3.99Å; I90-F98 HydrophobicContact CD1-CB 4.48Å; I90-F98 HydrophobicContact CD1-CD2 3.69Å; I90-F98 HydrophobicContact CD1-CE2 4.08Å; I90-F98 HydrophobicContact CD1-CG 4.14Å; I90-F98 HydrophobicContact CG1-CD2 4.13Å; I90-F98 HydrophobicContact CG1-CE2 4.17Å; I90-F98 HydrophobicContact CG1-CG 4.39Å; I90-F98 HydrophobicContact CG1-CZ 4.5Å; I90-F98 HydrophobicContact CG2-CB 4.11Å; I90-F98 HydrophobicContact CG2-CD1 4.13Å; I90-F98 HydrophobicContact CG2-CG 4.03Å; I90-F98 WeakPolarHBondContact O-CD1 3.26Å; I90-F98 WeakPolarHBondContact O-CE1 3.4Å
91	R	58.7	Low	61.9	Low	195 Å²	195	119.8 Å²	119.8	74%	0.736	55%	0.55	S	S	*	.			trans	-116	113	169	-73.3	-174.1	176.4	173	-0.8	106	F89 F98	F89-R91 HydrophobicContact CD1-CB 4.33Å; R91-F98 HydrophobicContact CG-CE1 4.25Å
92	G	67.7	Low	63	Low	22 Å²	22	115.2 Å²	115.2	23%	0.227	54%	0.539	C	S	.	.			trans	-158	163	-178.8	0	0	0	0	0	110.2	G94 V95	G92-G94 PolarHBondContact O-N 3.43Å; G92-V95 PolarHBondContact O-N 3.4Å; G92-V95 VanDerWaalsContact O-N 3.08Å
93	P	69.7	Low	63.7	Low	125 Å²	125	112.5 Å²	112.5	81%	0.812	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	129.3	176.5	-20.4	30.6	0	0	0	110.4
94	G	75.4	Confident	64	Low	34 Å²	34	108.7 Å²	108.7	35%	0.351	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.1	-16.5	-178.8	0	0	0	0	0	115.8	V41 D42 G92 K96	V41-G94 CarbonylContact C-O 3.54Å; V41-G94 VanDerWaalsContact CA-O 3.28Å; V41-G94 WeakPolarHBondContact CA-O 3.25Å; D42-G94 PolarHBondContact N-O 3.19Å; G92-G94 PolarHBondContact O-N 3.43Å; G94-K96 PolarHBondContact O-N 3.39Å
95	V	83.5	Confident	64.2	Low	20 Å²	20	106.5 Å²	106.5	12%	0.121	52%	0.52	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	103.7	174.7	-177.6	0	0	0	0	110.1	V39 R40 V51 I90 G92	V39-V95 HydrophobicContact CG1-CG1 3.64Å; V39-V95 HydrophobicContact CG1-CG2 4.18Å; R40-V95 WeakPolarHBondContact O-CA 3.33Å; V51-V95 HydrophobicContact CB-CG2 4.35Å; V51-V95 HydrophobicContact CG1-CG2 3.38Å; V51-V95 HydrophobicContact CG2-CG2 3.95Å; I90-V95 HydrophobicContact CG2-CG1 4.16Å; I90-V95 HydrophobicContact CG2-CG2 4.45Å; G92-V95 PolarHBondContact O-N 3.4Å; G92-V95 VanDerWaalsContact O-N 3.08Å
96	K	81.6	Confident	64.3	Low	128 Å²	128	105.4 Å²	105.4	56%	0.557	52%	0.516	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.8	-43.1	177.2	-80.5	-148.6	178.3	-170.6	0	112.2	R40 D42 G94	R40-K96 HydrophobicContact CG-CB 4.28Å; R40-K96 PolarHBondContact O-N 2.86Å; D42-K96 WeakPolarHBondContact OD1-CE 3.22Å; D42-K96 WeakPolarHBondContact OD2-CE 3.34Å; D42-K96 WeakPolarHBondContact OD2-CG 3.48Å; D42-K96 IonicContact OD2-NZ 2.98Å; G94-K96 PolarHBondContact O-N 3.39Å
97	W	84.7	Confident	63.7	Low	104 Å²	104	107.7 Å²	107.7	39%	0.394	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	161.6	177.4	70.1	-86.9	0	0	0	110	R40 M69 I99	R40-W97 VanDerWaalsContact CB-CD1 3.45Å; R40-W97 HydrophobicContact CB-CD2 4.37Å; R40-W97 HydrophobicContact CB-CG 4.13Å; R40-W97 VanDerWaalsContact CD-CD1 3.49Å; R40-W97 PolarHBondContact N-O 3.23Å; M69-W97 HydrophobicContact SD-CH2 4.29Å; M69-W97 HydrophobicContact SD-CZ2 3.47Å; M69-W97 WeakPolarHBondContact SD-CZ2 3.46Å; W97-I99 HydrophobicContact CE3-CB 4.27Å; W97-I99 HydrophobicContact CE3-CG2 4.21Å; W97-I99 HydrophobicContact CH2-CG2 3.9Å; W97-I99 HydrophobicContact CZ3-CB 3.69Å; W97-I99 HydrophobicContact CZ3-CG2 3.27Å
98	F	87.1	Confident	63.2	Low	60 Å²	60	113.2 Å²	113.2	26%	0.263	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	157.1	172.2	70.8	-81.3	0	0	0	109.7	Y37 V38 V39 I90 R91	Y37-F98 HydrophobicContact CD1-CD2 4.38Å; V38-F98 CarbonylContact O-C 3.57Å; V38-F98 VanDerWaalsContact O-CA 3.23Å; V38-F98 WeakPolarHBondContact O-CA 3.44Å; V39-F98 HydrophobicContact CB-CB 4.39Å; V39-F98 HydrophobicContact CG1-CB 4.23Å; V39-F98 HydrophobicContact CG2-CB 4.04Å; I90-F98 HydrophobicContact CB-CB 4.29Å; I90-F98 HydrophobicContact CB-CD1 3.64Å; I90-F98 HydrophobicContact CB-CD2 3.87Å; I90-F98 HydrophobicContact CB-CE1 3.81Å; I90-F98 HydrophobicContact CB-CE2 4.02Å; I90-F98 HydrophobicContact CB-CG 3.66Å; I90-F98 HydrophobicContact CB-CZ 3.99Å; I90-F98 HydrophobicContact CD1-CB 4.48Å; I90-F98 HydrophobicContact CD1-CD2 3.69Å; I90-F98 HydrophobicContact CD1-CE2 4.08Å; I90-F98 HydrophobicContact CD1-CG 4.14Å; I90-F98 HydrophobicContact CG1-CD2 4.13Å; I90-F98 HydrophobicContact CG1-CE2 4.17Å; I90-F98 HydrophobicContact CG1-CG 4.39Å; I90-F98 HydrophobicContact CG1-CZ 4.5Å; I90-F98 HydrophobicContact CG2-CB 4.11Å; I90-F98 HydrophobicContact CG2-CD1 4.13Å; I90-F98 HydrophobicContact CG2-CG 4.03Å; I90-F98 WeakPolarHBondContact O-CD1 3.26Å; I90-F98 WeakPolarHBondContact O-CE1 3.4Å; R91-F98 HydrophobicContact CG-CE1 4.25Å
99	I	81.8	Confident	62.9	Low	83 Å²	83	120.6 Å²	120.6	43%	0.426	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-138.8	127.7	173.7	-174.5	162.2	0	0	0	109.5	Y37 V38 W97 Q101	Y37-I99 WeakPolarHBondContact CA-O 3.39Å; V38-I99 HydrophobicContact CB-CG2 3.9Å; V38-I99 PolarHBondContact N-O 3.02Å; V38-I99 PolarHBondContact O-N 2.95Å; W97-I99 HydrophobicContact CE3-CB 4.27Å; W97-I99 HydrophobicContact CE3-CG2 4.21Å; W97-I99 HydrophobicContact CH2-CG2 3.9Å; W97-I99 HydrophobicContact CZ3-CB 3.69Å; W97-I99 HydrophobicContact CZ3-CG2 3.27Å; I99-Q101 VanDerWaalsContact CG2-NE2 3.32Å; I99-Q101 PolarHBondContact O-N 3.42Å; I99-Q101 PolarHBondContact O-NE2 2.94Å
100	K	80.7	Confident	62.1	Low	103 Å²	103	117.6 Å²	117.6	45%	0.448	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-70.7	127.6	169.7	-178.9	-176.8	168.1	-165.5	0	108.2	V35 Y37 E102	V35-K100 HydrophobicContact CG1-CD 4Å; V35-K100 VanDerWaalsContact CG1-CE 3.47Å; V35-K100 HydrophobicContact CG1-CG 3.69Å; Y37-K100 HydrophobicContact CD1-CB 3.9Å; Y37-K100 HydrophobicContact CD1-CG 4.26Å; Y37-K100 HydrophobicContact CE1-CB 3.74Å; Y37-K100 HydrophobicContact CE1-CD 4.35Å; Y37-K100 HydrophobicContact CE1-CG 3.83Å; K100-E102 PolarHBondContact O-N 3.21Å
101	Q	80.1	Confident	61.3	Low	74 Å²	74	121.8 Å²	121.8	35%	0.346	58%	0.584	S	S	.	*	P	Polyproline II helix	trans	-77.7	120.6	174.5	-60.1	-52.5	-72.6	0	0	109	E36 V38 I99	E36-Q101 HydrophobicContact CB-CB 4.07Å; E36-Q101 HydrophobicContact CB-CG 4.18Å; E36-Q101 HydrophobicContact CG-CB 4.3Å; E36-Q101 HydrophobicContact CG-CG 3.85Å; E36-Q101 WeakPolarHBondContact O-CB 3.38Å; E36-Q101 PolarHBondContact O-N 3.18Å; V38-Q101 HydrophobicContact CG2-CG 4.12Å; I99-Q101 VanDerWaalsContact CG2-NE2 3.32Å; I99-Q101 PolarHBondContact O-N 3.42Å; I99-Q101 PolarHBondContact O-NE2 2.94Å
102	E	65.1	Low	60.5	Low	141 Å²	141	118.3 Å²	118.3	66%	0.659	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-99.7	142.2	173.3	-62.3	-170.3	160.7	0	0	109	K100 L104	K100-E102 PolarHBondContact O-N 3.21Å; E102-L104 PolarHBondContact O-N 3.28Å
103	F	53.7	Low	59.6	Low	182 Å²	182	120.7 Å²	120.7	80%	0.798	60%	0.595	S	S	*	*			trans	-64.5	102.4	173.8	-71	-80.4	0	0	0	109.1	P33 K105	P33-F103 HydrophobicContact CB-CZ 4.34Å; P33-F103 HydrophobicContact CG-CE2 4.18Å; P33-F103 HydrophobicContact CG-CZ 4.22Å; F103-K105 PolarHBondContact O-N 2.75Å
104	L	45.6	Very low	58.8	Low	126 Å²	126	120 Å²	120	66%	0.66	59%	0.589	S	S	*	*			trans	-75	117.4	173.4	-64.9	175.8	0	0	0	108.6	E102 R106	E102-L104 PolarHBondContact O-N 3.28Å; L104-R106 VanDerWaalsContact C-N 3.35Å; L104-R106 HydrophobicContact CB-CG 4.34Å; L104-R106 PolarHBondContact O-N 2.76Å
105	K	39.7	Very low	58.3	Low	205 Å²	205	119.8 Å²	119.8	89%	0.891	58%	0.581	S	S	*	*			trans	-70.5	93.7	170.5	-166.6	176.9	-176.4	-179.8	0	108.4	F103	F103-K105 PolarHBondContact O-N 2.75Å
106	R	41.1	Very low	57.8	Low	213 Å²	213	126.5 Å²	126.5	80%	0.804	61%	0.609	S	S	*	*			trans	-92.4	111.4	174.2	-65.9	-166.3	179.4	-169.5	1.9	109.4	L104	L104-R106 VanDerWaalsContact C-N 3.35Å; L104-R106 HydrophobicContact CB-CG 4.34Å; L104-R106 PolarHBondContact O-N 2.76Å
107	T	32.5	Very low	58.1	Low	124 Å²	124	121.7 Å²	121.7	76%	0.761	59%	0.587	S	S	*	*			trans	-81.7	136.5	159.7	-21.4	0	0	0	0	107.1	R109	T107-R109 PolarHBondContact O-N 3.43Å
108	K	38.2	Very low	58.5	Low	194 Å²	194	119.8 Å²	119.8	84%	0.843	58%	0.584	S	S	*	*			trans	-51.2	133.4	166	-142	174.9	-175	-177	0	106.3	S110	K108-S110 PolarHBondContact O-N 3.21Å
109	R	40.8	Very low	58.9	Low	251 Å²	251	117 Å²	117	95%	0.947	57%	0.572	S	S	*	*			trans	-65.7	79.9	164.3	-66.9	-177.2	-164.6	170.4	3.7	105.7	T107 S111	T107-R109 PolarHBondContact O-N 3.43Å; R109-S111 PolarHBondContact O-N 2.86Å
110	S	38.1	Very low	59.4	Low	84 Å²	84	116.8 Å²	116.8	59%	0.587	58%	0.576	S	S	*	*			trans	-60.1	123.2	164.1	-171.9	0	0	0	0	103.8	K108 V112	K108-S110 PolarHBondContact O-N 3.21Å; S110-V112 PolarHBondContact O-N 3.45Å
111	S	42	Very low	60.1	Low	90 Å²	90	112.5 Å²	112.5	63%	0.629	56%	0.558	S	S	*	*			trans	-42.5	121.5	146.5	37.3	0	0	0	0	105.3	R109 P113	R109-S111 PolarHBondContact O-N 2.86Å; S111-P113 VanDerWaalsContact O-N 3.11Å
112	V	40.8	Very low	60.8	Low	122 Å²	122	110 Å²	110	74%	0.739	55%	0.546	S	S	*	.			trans	-49.8	124.6	163.4	-179.1	0	0	0	0	103.9	S110 T114	S110-V112 PolarHBondContact O-N 3.45Å; V112-T114 PolarHBondContact O-N 3.19Å
113	P	48.6	Very low	61.9	Low	72 Å²	72	106.9 Å²	106.9	47%	0.468	54%	0.538	S	S	.	.			trans	-51.1	115	179.6	18.3	-28.9	0	0	0	106.4	S111 V115	S111-P113 VanDerWaalsContact O-N 3.11Å; P113-V115 PolarHBondContact O-N 2.02Å; P113-V115 VanDerWaalsContact O-N 3.13Å
114	T	54.4	Low	63.7	Low	110 Å²	110	100.1 Å²	100.1	68%	0.675	51%	0.51	S	S	*	.	S	Bend	trans	-64.8	-17.4	-173.5	40.1	0	0	0	0	110.9	V112	V112-T114 PolarHBondContact O-N 3.19Å
115	V	64.1	Low	66	Low	29 Å²	29	94.1 Å²	94.1	18%	0.176	48%	0.479	C	S	.	.			trans	-112.1	104.8	178.7	-164.2	0	0	0	0	109.6	P113 W117 W145	P113-V115 PolarHBondContact O-N 2.02Å; P113-V115 VanDerWaalsContact O-N 3.13Å; V115-W117 HydrophobicContact CG1-CD2 4.42Å; V115-W117 VanDerWaalsContact CG1-CE2 3.48Å; V115-W117 HydrophobicContact CG1-CZ2 3.65Å; V115-W145 HydrophobicContact CG1-CE3 4.03Å
116	F	74.3	Confident	68.4	Low	162 Å²	162	84.5 Å²	84.5	71%	0.711	44%	0.437	S	S	*	.			trans	-113.9	130.3	169.8	-179.9	-91.9	0	0	0	108.6
117	W	87.1	Confident	71	Confident	26 Å²	26	74.5 Å²	74.5	10%	0.098	40%	0.399	C	S	.	.			trans	-109.3	131.9	179.6	-64	105.2	0	0	0	108.6	V115 D119 Y122 W145 N213 V219 H223	V115-W117 HydrophobicContact CG1-CD2 4.42Å; V115-W117 VanDerWaalsContact CG1-CE2 3.48Å; V115-W117 HydrophobicContact CG1-CZ2 3.65Å; W117-D119 WeakPolarHBondContact CB-OD2 3.33Å; W117-D119 PolarHBondContact O-N 2.67Å; W117-Y122 HydrophobicContact CB-CD1 3.9Å; W117-Y122 HydrophobicContact CB-CD2 4.12Å; W117-Y122 HydrophobicContact CB-CE1 4.31Å; W117-Y122 HydrophobicContact CB-CG 3.79Å; W117-Y122 AromaticContact CD1-CD2 3.79Å; W117-Y122 AromaticContact CD1-CE1 3.95Å; W117-Y122 AromaticContact CD1-CE2 3.43Å; W117-Y122 VanDerWaalsContact CD1-CE2 3.43Å; W117-Y122 AromaticContact CD1-CZ 3.51Å; W117-Y122 HydrophobicContact CG-CD2 4.22Å; W117-Y122 HydrophobicContact CG-CE2 4.28Å; W117-Y122 HydrophobicContact CG-CG 4.36Å; W117-W145 AromaticContact CE2-CZ3 3.83Å; W117-W145 HydrophobicContact CZ2-CD2 4.46Å; W117-W145 HydrophobicContact CZ2-CE3 4.11Å; W117-W145 HydrophobicContact CZ2-CH2 4.36Å; W117-W145 HydrophobicContact CZ2-CZ3 4.1Å; W117-W145 AromaticContact NE1-CE3 3.62Å; W117-W145 AromaticContact NE1-CH2 3.69Å; W117-W145 AromaticContact NE1-CZ3 3.05Å; W117-N213 HydrophobicContact CE3-CB 3.65Å; W117-N213 HydrophobicContact CZ3-CB 3.71Å; W117-V219 HydrophobicContact CB-CG1 4.42Å; W117-V219 HydrophobicContact CD2-CB 3.91Å; W117-V219 HydrophobicContact CD2-CG1 3.89Å; W117-V219 HydrophobicContact CD2-CG2 3.85Å; W117-V219 HydrophobicContact CE3-CB 4.05Å; W117-V219 HydrophobicContact CE3-CG2 3.87Å; W117-V219 HydrophobicContact CG-CB 4.24Å; W117-V219 HydrophobicContact CG-CG1 3.79Å; W117-V219 HydrophobicContact CH2-CG2 3.79Å; W117-V219 HydrophobicContact CZ2-CG2 3.73Å; W117-V219 HydrophobicContact CZ3-CB 4.5Å; W117-V219 HydrophobicContact CZ3-CG2 3.85Å; W117-H223 AromaticContact CH2-CD2 3.85Å; W117-H223 AromaticContact CH2-CE1 3.66Å; W117-H223 AromaticContact CH2-ND1 3.96Å; W117-H223 AromaticContact CH2-NE2 3.61Å; W117-H223 AromaticContact CZ2-CE1 3.78Å
118	D	92.2	Very high	73.9	Confident	64 Å²	64	68.6 Å²	68.6	34%	0.342	36%	0.363	S	S	.	.			trans	-82.1	-1.8	178.8	75.2	-10.2	0	0	0	113.2	N213 N214 S215	D118-N213 WeakPolarHBondContact OD1-CA 3.28Å; D118-N214 PolarHBondContact OD1-N 3.34Å; D118-S215 PolarHBondContact OD1-N 3.09Å; D118-S215 PolarHBondContact OD2-OG 3.5Å
119	D	95.2	Very high	76.2	Confident	2 Å²	2	59.5 Å²	59.5	1%	0.011	32%	0.323	C	S	.	.			trans	-65.2	129.3	-175.9	-50.2	-77.5	0	0	0	111.8	W117 L121 Y122 G212 N213 N214	W117-D119 WeakPolarHBondContact CB-OD2 3.33Å; W117-D119 PolarHBondContact O-N 2.67Å; D119-L121 VanDerWaalsContact C-N 3.28Å; D119-L121 PolarHBondContact O-N 2.86Å; D119-L121 VanDerWaalsContact O-N 3.09Å; D119-Y122 WeakPolarHBondContact O-CB 3.21Å; D119-Y122 PolarHBondContact O-N 3.47Å; D119-G212 WeakPolarHBondContact OD2-CA 3.18Å; D119-N213 VanDerWaalsContact CG-N 3.34Å; D119-N213 PolarHBondContact OD1-N 3.03Å; D119-N213 VanDerWaalsContact OD1-N 3.1Å; D119-N213 PolarHBondContact OD2-N 2.91Å; D119-N214 PolarHBondContact OD1-N 3.33Å; D119-N214 PolarHBondContact OD1-OD1 2.87Å; D119-N214 VanDerWaalsContact OD1-OD1 3.06Å
120	P	94.1	Very high	78.4	Confident	78 Å²	78	48.7 Å²	48.7	51%	0.506	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-31.1	-168.7	-28.9	34.3	0	0	0	116	S215	P120-S215 WeakPolarHBondContact CD-O 3.32Å
121	L	95.2	Very high	80.5	Confident	13 Å²	13	46.9 Å²	46.9	7%	0.068	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-1.4	-178.4	-53.4	-176.1	0	0	0	113.5	D119 P123 D124 M125 C217 I218 C366 R368	D119-L121 VanDerWaalsContact C-N 3.28Å; D119-L121 PolarHBondContact O-N 2.86Å; D119-L121 VanDerWaalsContact O-N 3.09Å; L121-P123 VanDerWaalsContact C-N 3.31Å; L121-D124 WeakPolarHBondContact O-CA 3.42Å; L121-D124 WeakPolarHBondContact O-CB 3.39Å; L121-D124 PolarHBondContact O-N 3.07Å; L121-M125 PolarHBondContact O-N 3.43Å; L121-C217 WeakPolarHBondContact CA-O 3.49Å; L121-C217 WeakPolarHBondContact CB-O 3.48Å; L121-C217 WeakPolarHBondContact CG-O 3.47Å; L121-C217 PolarHBondContact N-O 3.27Å; L121-I218 HydrophobicContact CB-CG2 3.71Å; L121-I218 HydrophobicContact CD1-CG2 4.32Å; L121-C366 HydrophobicContact CD1-CB 3.66Å; L121-R368 HydrophobicContact CD1-CG 4.26Å; L121-R368 HydrophobicContact CD2-CG 4.25Å
122	Y	93.6	Very high	82.2	Confident	22 Å²	22	45.9 Å²	45.9	9%	0.086	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-54.1	-38.4	175.9	178.1	-111.7	0	0	0	114.2	W117 D119 D124 M125 N129 V219	W117-Y122 HydrophobicContact CB-CD1 3.9Å; W117-Y122 HydrophobicContact CB-CD2 4.12Å; W117-Y122 HydrophobicContact CB-CE1 4.31Å; W117-Y122 HydrophobicContact CB-CG 3.79Å; W117-Y122 AromaticContact CD1-CD2 3.79Å; W117-Y122 AromaticContact CD1-CE1 3.95Å; W117-Y122 AromaticContact CD1-CE2 3.43Å; W117-Y122 VanDerWaalsContact CD1-CE2 3.43Å; W117-Y122 AromaticContact CD1-CZ 3.51Å; W117-Y122 HydrophobicContact CG-CD2 4.22Å; W117-Y122 HydrophobicContact CG-CE2 4.28Å; W117-Y122 HydrophobicContact CG-CG 4.36Å; D119-Y122 WeakPolarHBondContact O-CB 3.21Å; D119-Y122 PolarHBondContact O-N 3.47Å; Y122-D124 PolarHBondContact O-N 2.76Å; Y122-M125 HydrophobicContact CD2-SD 3.96Å; Y122-M125 WeakPolarHBondContact O-CB 3.47Å; Y122-M125 PolarHBondContact O-N 2.87Å; Y122-M125 VanDerWaalsContact O-N 3.07Å; Y122-N129 PolarHBondContact O-ND2 2.96Å; Y122-N129 VanDerWaalsContact O-ND2 3.11Å; Y122-V219 HydrophobicContact CD2-CG1 3.79Å; Y122-V219 HydrophobicContact CE2-CG1 4.2Å
123	P	89.1	Confident	84	Confident	76 Å²	76	44.8 Å²	44.8	49%	0.494	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-58.7	-29.1	173.8	-25.9	36.4	0	0	0	113.9	L121 K133	L121-P123 VanDerWaalsContact C-N 3.31Å; P123-K133 PolarHBondContact O-NZ 3.35Å
124	D	91.1	Very high	85.4	Confident	39 Å²	39	44.6 Å²	44.6	21%	0.209	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-84.1	-14.3	179	-62.3	-55.6	0	0	0	112.9	L121 Y122 W126 R368	L121-D124 WeakPolarHBondContact O-CA 3.42Å; L121-D124 WeakPolarHBondContact O-CB 3.39Å; L121-D124 PolarHBondContact O-N 3.07Å; Y122-D124 PolarHBondContact O-N 2.76Å; D124-W126 PolarHBondContact O-N 3.12Å; D124-R368 VanDerWaalsContact CG-NH1 3.29Å; D124-R368 IonicContact OD1-NH1 2.64Å; D124-R368 PolarHBondContact OD1-NH1 2.88Å; D124-R368 IonicContact OD2-CZ 3.84Å; D124-R368 IonicContact OD2-NE 2.94Å; D124-R368 IonicContact OD2-NH1 3.85Å; D124-R368 PolarHBondContact OD2-NH1 2.89Å; D124-R368 IonicContact OD2-NH2 3.7Å; D124-R368 PolarHBondContact OD2-NH2 2.85Å
125	M	93.2	Very high	86.5	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.005	26%	0.264	C	S	.	.			trans	-76	60.8	177.1	-60.3	178.3	80	0	0	112.8	L121 Y122 Y127 L128 N129 I218 V219	L121-M125 PolarHBondContact O-N 3.43Å; Y122-M125 HydrophobicContact CD2-SD 3.96Å; Y122-M125 WeakPolarHBondContact O-CB 3.47Å; Y122-M125 PolarHBondContact O-N 2.87Å; Y122-M125 VanDerWaalsContact O-N 3.07Å; M125-Y127 HydrophobicContact CB-CE1 4.19Å; M125-Y127 HydrophobicContact CE-CE2 4.01Å; M125-Y127 WeakPolarHBondContact CE-OH 3.46Å; M125-Y127 HydrophobicContact CG-CE1 4.45Å; M125-Y127 PolarHBondContact O-N 3.02Å; M125-L128 HydrophobicContact CE-CD1 3.37Å; M125-L128 HydrophobicContact CE-CG 4.29Å; M125-L128 PolarHBondContact O-N 3.28Å; M125-L128 VanDerWaalsContact O-N 3.14Å; M125-L128 HydrophobicContact SD-CD1 4.4Å; M125-N129 VanDerWaalsContact O-CG 3.3Å; M125-N129 PolarHBondContact O-ND2 2.72Å; M125-N129 PolarHBondContact O-OD1 3.2Å; M125-I218 HydrophobicContact CE-CB 4.15Å; M125-I218 HydrophobicContact CE-CD1 4.26Å; M125-I218 HydrophobicContact CE-CG2 4.46Å; M125-I218 HydrophobicContact CG-CG2 4.19Å; M125-I218 HydrophobicContact SD-CB 3.71Å; M125-I218 HydrophobicContact SD-CG2 3.82Å; M125-V219 WeakPolarHBondContact CE-O 3.41Å; M125-V219 HydrophobicContact SD-CG1 4.15Å
126	W	91.8	Very high	87.5	Confident	3 Å²	3	47.6 Å²	47.6	1%	0.011	28%	0.275	C	S	.	.	H	α-helix	trans	-60.5	-28.1	-176.2	57.7	-94.7	0	0	0	113.9	D124 L128 N129 R130 E328 Y347 S348 R355 M356 I357	D124-W126 PolarHBondContact O-N 3.12Å; W126-L128 PolarHBondContact O-N 3.08Å; W126-N129 PolarHBondContact O-N 3.3Å; W126-R130 VanDerWaalsContact CE3-CZ 3.42Å; W126-R130 VanDerWaalsContact CZ3-NH2 3.31Å; W126-R130 WeakPolarHBondContact O-CB 3.49Å; W126-R130 PolarHBondContact O-N 2.79Å; W126-R130 VanDerWaalsContact O-N 3.17Å; W126-E328 VanDerWaalsContact CH2-CA 3.46Å; W126-E328 HydrophobicContact CH2-CB 3.75Å; W126-E328 HydrophobicContact CZ2-CB 3.72Å; W126-E328 HydrophobicContact CZ3-CB 4.21Å; W126-Y347 AromaticContact CH2-CD1 3.45Å; W126-Y347 HydrophobicContact CH2-CD1 3.45Å; W126-Y347 VanDerWaalsContact CH2-CD1 3.45Å; W126-Y347 HydrophobicContact CH2-CE1 4.22Å; W126-Y347 AromaticContact CH2-CG 3.75Å; W126-Y347 HydrophobicContact CH2-CG 3.75Å; W126-Y347 AromaticContact CZ3-CD1 3.3Å; W126-Y347 HydrophobicContact CZ3-CD1 3.3Å; W126-Y347 HydrophobicContact CZ3-CD2 4.09Å; W126-Y347 AromaticContact CZ3-CE1 3.72Å; W126-Y347 HydrophobicContact CZ3-CE1 3.72Å; W126-Y347 HydrophobicContact CZ3-CE2 4.45Å; W126-Y347 AromaticContact CZ3-CG 3.51Å; W126-Y347 HydrophobicContact CZ3-CG 3.51Å; W126-S348 WeakPolarHBondContact CZ2-O 3.03Å; W126-R355 VanDerWaalsContact CD1-CZ 3.44Å; W126-M356 PolarHBondContact NE1-O 2.88Å; W126-I357 HydrophobicContact CZ2-CD1 4.4Å
127	Y	94.2	Very high	88.3	Confident	3 Å²	3	44.5 Å²	44.5	1%	0.012	26%	0.259	C	S	.	.	H	α-helix	trans	-70.3	-9	-179.9	52.4	-92.1	0	0	0	113.4	M125 D138 M139 I357 S358 M379	M125-Y127 HydrophobicContact CB-CE1 4.19Å; M125-Y127 HydrophobicContact CE-CE2 4.01Å; M125-Y127 WeakPolarHBondContact CE-OH 3.46Å; M125-Y127 HydrophobicContact CG-CE1 4.45Å; M125-Y127 PolarHBondContact O-N 3.02Å; Y127-D138 WeakPolarHBondContact O-CB 3.22Å; Y127-M139 HydrophobicContact CD2-CE 3.8Å; Y127-M139 PolarHBondContact O-N 2.77Å; Y127-I357 HydrophobicContact CD1-CD1 3.47Å; Y127-I357 VanDerWaalsContact CD1-CD1 3.47Å; Y127-I357 HydrophobicContact CE1-CB 4.37Å; Y127-I357 HydrophobicContact CE1-CD1 3.71Å; Y127-I357 HydrophobicContact CE1-CG2 3.84Å; Y127-I357 HydrophobicContact CG-CD1 4Å; Y127-S358 PolarHBondContact OH-O 3.37Å; Y127-M379 HydrophobicContact CD2-SD 3.78Å; Y127-M379 HydrophobicContact CE2-SD 3.92Å; Y127-M379 HydrophobicContact CG-SD 4.42Å
128	L	93.3	Very high	88.6	Confident	0 Å²	0	44 Å²	44	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-109.5	-25	175	-55.8	-173.4	0	0	0	114.3	M125 W126 M139 V141 W145 I221	M125-L128 HydrophobicContact CE-CD1 3.37Å; M125-L128 HydrophobicContact CE-CG 4.29Å; M125-L128 PolarHBondContact O-N 3.28Å; M125-L128 VanDerWaalsContact O-N 3.14Å; M125-L128 HydrophobicContact SD-CD1 4.4Å; W126-L128 PolarHBondContact O-N 3.08Å; L128-M139 HydrophobicContact CD2-CE 3.85Å; L128-V141 HydrophobicContact CD2-CB 4.01Å; L128-V141 HydrophobicContact CD2-CG1 4.42Å; L128-V141 HydrophobicContact CD2-CG2 3.73Å; L128-W145 HydrophobicContact CD1-CH2 4.11Å; L128-I221 HydrophobicContact CD2-CD1 4.11Å; L128-I221 HydrophobicContact CD2-CG1 3.88Å
129	N	87.7	Confident	88.8	Confident	3 Å²	3	41 Å²	41	2%	0.016	24%	0.242	C	C	.	.	H	α-helix	trans	-131.7	11.9	-165	66.5	33	0	0	0	115.1	Y122 M125 W126 S132 K133 L142	Y122-N129 PolarHBondContact O-ND2 2.96Å; Y122-N129 VanDerWaalsContact O-ND2 3.11Å; M125-N129 VanDerWaalsContact O-CG 3.3Å; M125-N129 PolarHBondContact O-ND2 2.72Å; M125-N129 PolarHBondContact O-OD1 3.2Å; W126-N129 PolarHBondContact O-N 3.3Å; N129-S132 PolarHBondContact O-OG 2.82Å; N129-S132 VanDerWaalsContact O-OG 3.1Å; N129-K133 PolarHBondContact ND2-NZ 2.81Å; N129-K133 VanDerWaalsContact ND2-NZ 3.13Å; N129-K133 WeakPolarHBondContact O-CB 3.44Å; N129-K133 WeakPolarHBondContact O-CD 3.28Å; N129-K133 VanDerWaalsContact O-CG 3.25Å; N129-K133 WeakPolarHBondContact O-CG 3.34Å; N129-K133 PolarHBondContact O-N 3.32Å; N129-K133 WeakPolarHBondContact OD1-CE 3.48Å; N129-K133 PolarHBondContact OD1-NZ 2.87Å; N129-L142 HydrophobicContact CB-CD1 4.32Å
130	R	87	Confident	88.8	Confident	24 Å²	24	42.6 Å²	42.6	9%	0.091	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-36.6	-178.8	-173.7	-175.9	-64.3	-173	-12.5	112.3	W126 K133 G134 K135 Y137 D138 E328	W126-R130 VanDerWaalsContact CE3-CZ 3.42Å; W126-R130 VanDerWaalsContact CZ3-NH2 3.31Å; W126-R130 WeakPolarHBondContact O-CB 3.49Å; W126-R130 PolarHBondContact O-N 2.79Å; W126-R130 VanDerWaalsContact O-N 3.17Å; R130-K133 PolarHBondContact O-N 3.47Å; R130-G134 PolarHBondContact O-N 2.83Å; R130-K135 WeakPolarHBondContact CD-O 3.1Å; R130-K135 VanDerWaalsContact CG-C 3.44Å; R130-K135 HydrophobicContact CG-CB 3.67Å; R130-K135 WeakPolarHBondContact CG-O 3.49Å; R130-K135 PolarHBondContact O-N 3.46Å; R130-Y137 WeakPolarHBondContact CD-O 2.97Å; R130-D138 HydrophobicContact CB-CB 4.31Å; R130-D138 PolarHBondContact N-OD2 2.84Å; R130-D138 VanDerWaalsContact N-OD2 3.12Å; R130-E328 PolarHBondContact NH1-O 3.09Å; R130-E328 PolarHBondContact NH2-O 3.23Å; R130-E328 IonicContact NH2-OE1 3.46Å; R130-E328 PolarHBondContact NH2-OE1 2.7Å
131	A	82.6	Confident	88.9	Confident	46 Å²	46	38.9 Å²	38.9	38%	0.38	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-43.1	-178.6	0	0	0	0	0	111.9	K133 G134 G136 D138	A131-K133 PolarHBondContact O-N 2.78Å; A131-G134 WeakPolarHBondContact O-CA 3.42Å; A131-G134 PolarHBondContact O-N 3.47Å; A131-G136 VanDerWaalsContact CA-O 3.26Å; A131-G136 WeakPolarHBondContact CA-O 3.03Å; A131-D138 WeakPolarHBondContact CA-OD2 3.34Å; A131-D138 VanDerWaalsContact CB-CG 3.48Å; A131-D138 WeakPolarHBondContact CB-OD2 3.37Å; A131-D138 PolarHBondContact N-OD2 3.31Å
132	S	76.6	Confident	88.8	Confident	69 Å²	69	39.2 Å²	39.2	48%	0.483	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-29.1	174.9	64	0	0	0	0	112.6	N129 G134 L142	N129-S132 PolarHBondContact O-OG 2.82Å; N129-S132 VanDerWaalsContact O-OG 3.1Å; S132-G134 VanDerWaalsContact C-N 3.27Å; S132-G134 PolarHBondContact O-N 3.38Å; S132-L142 WeakPolarHBondContact OG-CD1 3.47Å
133	K	79.2	Confident	88.7	Confident	98 Å²	98	40 Å²	40	43%	0.426	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-1.3	171.5	-67.8	171.6	-175.7	167	0	113.7	P123 N129 R130 A131 K135	P123-K133 PolarHBondContact O-NZ 3.35Å; N129-K133 PolarHBondContact ND2-NZ 2.81Å; N129-K133 VanDerWaalsContact ND2-NZ 3.13Å; N129-K133 WeakPolarHBondContact O-CB 3.44Å; N129-K133 WeakPolarHBondContact O-CD 3.28Å; N129-K133 VanDerWaalsContact O-CG 3.25Å; N129-K133 WeakPolarHBondContact O-CG 3.34Å; N129-K133 PolarHBondContact O-N 3.32Å; N129-K133 WeakPolarHBondContact OD1-CE 3.48Å; N129-K133 PolarHBondContact OD1-NZ 2.87Å; R130-K133 PolarHBondContact O-N 3.47Å; A131-K133 PolarHBondContact O-N 2.78Å; K133-K135 HydrophobicContact CB-CD 4.32Å; K133-K135 HydrophobicContact CB-CG 4.22Å; K133-K135 PolarHBondContact O-N 2.8Å
134	G	77.3	Confident	89	Confident	69 Å²	69	36.3 Å²	36.3	71%	0.711	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	66	23.2	-177.5	0	0	0	0	0	114.1	R130 A131 S132	R130-G134 PolarHBondContact O-N 2.83Å; A131-G134 WeakPolarHBondContact O-CA 3.42Å; A131-G134 PolarHBondContact O-N 3.47Å; S132-G134 VanDerWaalsContact C-N 3.27Å; S132-G134 PolarHBondContact O-N 3.38Å
135	K	78.6	Confident	89.2	Confident	162 Å²	162	35.2 Å²	35.2	70%	0.704	20%	0.202	S	C	*	.	S	Bend	trans	-104.3	9.7	-171.9	-71.7	-174.1	179.1	-174.2	0	114.2	R130 K133	R130-K135 WeakPolarHBondContact CD-O 3.1Å; R130-K135 VanDerWaalsContact CG-C 3.44Å; R130-K135 HydrophobicContact CG-CB 3.67Å; R130-K135 WeakPolarHBondContact CG-O 3.49Å; R130-K135 PolarHBondContact O-N 3.46Å; K133-K135 HydrophobicContact CB-CD 4.32Å; K133-K135 HydrophobicContact CB-CG 4.22Å; K133-K135 PolarHBondContact O-N 2.8Å
136	G	84.6	Confident	89.1	Confident	40 Å²	40	40.6 Å²	40.6	41%	0.412	23%	0.227	S	C	.	.	S	Bend	trans	132.9	-152.2	-179.7	0	0	0	0	0	112.9	A131	A131-G136 VanDerWaalsContact CA-O 3.26Å; A131-G136 WeakPolarHBondContact CA-O 3.03Å
137	Y	90.6	Very high	89.1	Confident	96 Å²	96	41.5 Å²	41.5	38%	0.376	23%	0.232	S	C	.	.			trans	-92.5	150.1	-179.7	-59.3	-84.6	0	0	0	111.6	R130 Y347 K410 P411	R130-Y137 WeakPolarHBondContact CD-O 2.97Å; Y137-Y347 PolarHBondContact O-OH 3.17Å; Y137-K410 HydrophobicContact CE1-CB 4.27Å; Y137-P411 HydrophobicContact CD1-CG 3.98Å; Y137-P411 HydrophobicContact CD2-CB 3.83Å; Y137-P411 HydrophobicContact CD2-CG 4.08Å; Y137-P411 HydrophobicContact CE2-CB 4.46Å; Y137-P411 HydrophobicContact CG-CB 3.92Å; Y137-P411 HydrophobicContact CG-CG 3.71Å
138	D	93.6	Very high	89.1	Confident	16 Å²	16	43.5 Å²	43.5	9%	0.086	25%	0.254	C	S	.	.			trans	-137.5	-176	166.8	56.9	31.2	0	0	0	108.9	Y127 R130 A131 N140	Y127-D138 WeakPolarHBondContact O-CB 3.22Å; R130-D138 HydrophobicContact CB-CB 4.31Å; R130-D138 PolarHBondContact N-OD2 2.84Å; R130-D138 VanDerWaalsContact N-OD2 3.12Å; A131-D138 WeakPolarHBondContact CA-OD2 3.34Å; A131-D138 VanDerWaalsContact CB-CG 3.48Å; A131-D138 WeakPolarHBondContact CB-OD2 3.37Å; A131-D138 PolarHBondContact N-OD2 3.31Å; D138-N140 PolarHBondContact O-N 3.43Å; D138-N140 WeakPolarHBondContact OD1-CA 3.42Å; D138-N140 PolarHBondContact OD1-N 3.4Å
139	M	96.2	Very high	89.2	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	26%	0.258	C	S	.	.			trans	-81.7	10.2	178.4	-64.3	177.5	-59.9	0	0	113.7	Y127 L128 V141 I221 T346 Y347 M379 I383 L434 M435 A437	Y127-M139 HydrophobicContact CD2-CE 3.8Å; Y127-M139 PolarHBondContact O-N 2.77Å; L128-M139 HydrophobicContact CD2-CE 3.85Å; M139-V141 HydrophobicContact CB-CG2 4.17Å; M139-V141 PolarHBondContact O-N 2.79Å; M139-I221 HydrophobicContact CE-CD1 3.97Å; M139-T346 HydrophobicContact SD-CG2 3.86Å; M139-Y347 HydrophobicContact CG-CD2 3.91Å; M139-Y347 HydrophobicContact CG-CE2 4.41Å; M139-Y347 HydrophobicContact SD-CD2 4.46Å; M139-M379 HydrophobicContact CE-CB 4.44Å; M139-M379 HydrophobicContact CE-CG 4.46Å; M139-M379 HydrophobicContact CE-SD 3.66Å; M139-M379 HydrophobicContact SD-SD 4.45Å; M139-I383 HydrophobicContact CB-CD1 4.14Å; M139-I383 HydrophobicContact SD-CD1 4.02Å; M139-L434 HydrophobicContact CG-CD1 4.13Å; M139-L434 HydrophobicContact CG-CD2 4.44Å; M139-L434 HydrophobicContact CG-CG 4.29Å; M139-M435 WeakPolarHBondContact CA-O 3.48Å; M139-A437 PolarHBondContact O-N 3.12Å
140	N	95	Very high	89.7	Confident	37 Å²	37	45.4 Å²	45.4	20%	0.198	26%	0.263	C	S	.	.			trans	54.7	35.4	176.7	-162.4	29.1	0	0	0	114.5	D138 L142 E143 D436 G438	D138-N140 PolarHBondContact O-N 3.43Å; D138-N140 WeakPolarHBondContact OD1-CA 3.42Å; D138-N140 PolarHBondContact OD1-N 3.4Å; N140-L142 VanDerWaalsContact C-N 3.34Å; N140-E143 PolarHBondContact ND2-OE2 3.5Å; N140-E143 WeakPolarHBondContact OD1-CB 3.46Å; N140-D436 WeakPolarHBondContact CB-OD1 3.45Å; N140-D436 PolarHBondContact ND2-OD1 3.46Å; N140-G438 PolarHBondContact O-N 3.4Å; N140-G438 VanDerWaalsContact O-N 3.12Å
141	V	96.4	Very high	90.2	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-68.9	-33.8	179	173.6	0	0	0	0	111.7	L128 M139 E143 A144 W145 I221 I383 L386 A437	L128-V141 HydrophobicContact CD2-CB 4.01Å; L128-V141 HydrophobicContact CD2-CG1 4.42Å; L128-V141 HydrophobicContact CD2-CG2 3.73Å; M139-V141 HydrophobicContact CB-CG2 4.17Å; M139-V141 PolarHBondContact O-N 2.79Å; V141-E143 VanDerWaalsContact C-N 3.28Å; V141-E143 PolarHBondContact O-N 3.42Å; V141-A144 WeakPolarHBondContact O-CB 3.44Å; V141-A144 PolarHBondContact O-N 3.18Å; V141-A144 VanDerWaalsContact O-N 3.09Å; V141-W145 HydrophobicContact CG1-CD2 4.01Å; V141-W145 VanDerWaalsContact CG1-CE2 3.46Å; V141-W145 HydrophobicContact CG1-CG 4.47Å; V141-W145 HydrophobicContact CG1-CH2 4.19Å; V141-W145 HydrophobicContact CG1-CZ2 3.6Å; V141-W145 PolarHBondContact O-N 3.49Å; V141-W145 VanDerWaalsContact O-N 3.09Å; V141-I221 HydrophobicContact CG1-CG2 4.04Å; V141-I221 HydrophobicContact CG2-CD1 4.44Å; V141-I221 HydrophobicContact CG2-CG1 4.41Å; V141-I221 HydrophobicContact CG2-CG2 4.06Å; V141-I383 HydrophobicContact CG2-CG1 4.43Å; V141-L386 HydrophobicContact CG1-CD1 4.21Å; V141-A437 HydrophobicContact CB-CB 4.48Å; V141-A437 HydrophobicContact CG2-CB 3.94Å
142	L	93.5	Very high	90.9	Very high	19 Å²	19	49 Å²	49	10%	0.099	27%	0.271	C	S	.	.	H	α-helix	trans	-57.3	-39.4	177.6	-67.7	174.5	0	0	0	112.4	N129 S132 N140 A144 W145 E146	N129-L142 HydrophobicContact CB-CD1 4.32Å; S132-L142 WeakPolarHBondContact OG-CD1 3.47Å; N140-L142 VanDerWaalsContact C-N 3.34Å; L142-A144 VanDerWaalsContact C-N 3.35Å; L142-A144 PolarHBondContact O-N 3.48Å; L142-W145 HydrophobicContact CD2-CE3 3.69Å; L142-W145 HydrophobicContact CD2-CZ3 3.78Å; L142-W145 PolarHBondContact O-N 2.92Å; L142-E146 WeakPolarHBondContact O-CB 2.91Å; L142-E146 WeakPolarHBondContact O-CG 3.44Å; L142-E146 PolarHBondContact O-N 3.03Å
143	E	91.5	Very high	91.8	Very high	38 Å²	38	47.3 Å²	47.3	18%	0.178	26%	0.264	C	S	.	.	H	α-helix	trans	-64.6	-39.3	177.2	-179.9	172.2	-162.3	0	0	111.8	N140 V141 W145 E146 L147 R442	N140-E143 PolarHBondContact ND2-OE2 3.5Å; N140-E143 WeakPolarHBondContact OD1-CB 3.46Å; V141-E143 VanDerWaalsContact C-N 3.28Å; V141-E143 PolarHBondContact O-N 3.42Å; E143-W145 VanDerWaalsContact C-N 3.34Å; E143-W145 PolarHBondContact O-N 3.43Å; E143-E146 PolarHBondContact O-N 3.35Å; E143-L147 HydrophobicContact CG-CD1 4.32Å; E143-L147 WeakPolarHBondContact O-CG 3.34Å; E143-L147 PolarHBondContact O-N 3.19Å; E143-R442 IonicContact OE1-CZ 3.88Å; E143-R442 IonicContact OE1-NE 2.62Å; E143-R442 PolarHBondContact OE1-NE 3.28Å; E143-R442 IonicContact OE1-NH2 3.88Å; E143-R442 PolarHBondContact OE1-NH2 2.84Å
144	A	95.1	Very high	92.7	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-64.2	-40.2	176	0	0	0	0	0	111.7	V141 L142 L147 G148 Y149 L386 A437 V441	V141-A144 WeakPolarHBondContact O-CB 3.44Å; V141-A144 PolarHBondContact O-N 3.18Å; V141-A144 VanDerWaalsContact O-N 3.09Å; L142-A144 VanDerWaalsContact C-N 3.35Å; L142-A144 PolarHBondContact O-N 3.48Å; A144-L147 PolarHBondContact O-N 3.06Å; A144-G148 PolarHBondContact O-N 2.86Å; A144-Y149 PolarHBondContact O-N 3.08Å; A144-L386 HydrophobicContact CB-CD1 3.78Å; A144-A437 HydrophobicContact CB-CB 4.22Å; A144-V441 HydrophobicContact CB-CG1 4.1Å; A144-V441 HydrophobicContact CB-CG2 4.02Å
145	W	95.3	Very high	93.7	Very high	16 Å²	16	42.2 Å²	42.2	6%	0.061	22%	0.223	C	C	.	.	H	α-helix	trans	-65.5	-40.4	173.7	-66.6	-9.2	0	0	0	112.5	V115 W117 L128 V141 L142 E143 L147 G148 V219 G220 I221 H223	V115-W145 HydrophobicContact CG1-CE3 4.03Å; W117-W145 AromaticContact CE2-CZ3 3.83Å; W117-W145 HydrophobicContact CZ2-CD2 4.46Å; W117-W145 HydrophobicContact CZ2-CE3 4.11Å; W117-W145 HydrophobicContact CZ2-CH2 4.36Å; W117-W145 HydrophobicContact CZ2-CZ3 4.1Å; W117-W145 AromaticContact NE1-CE3 3.62Å; W117-W145 AromaticContact NE1-CH2 3.69Å; W117-W145 AromaticContact NE1-CZ3 3.05Å; L128-W145 HydrophobicContact CD1-CH2 4.11Å; V141-W145 HydrophobicContact CG1-CD2 4.01Å; V141-W145 VanDerWaalsContact CG1-CE2 3.46Å; V141-W145 HydrophobicContact CG1-CG 4.47Å; V141-W145 HydrophobicContact CG1-CH2 4.19Å; V141-W145 HydrophobicContact CG1-CZ2 3.6Å; V141-W145 PolarHBondContact O-N 3.49Å; V141-W145 VanDerWaalsContact O-N 3.09Å; L142-W145 HydrophobicContact CD2-CE3 3.69Å; L142-W145 HydrophobicContact CD2-CZ3 3.78Å; L142-W145 PolarHBondContact O-N 2.92Å; E143-W145 VanDerWaalsContact C-N 3.34Å; E143-W145 PolarHBondContact O-N 3.43Å; W145-L147 PolarHBondContact O-N 3.16Å; W145-G148 WeakPolarHBondContact O-CA 3.36Å; W145-G148 PolarHBondContact O-N 2.87Å; W145-V219 HydrophobicContact CH2-CG1 3.85Å; W145-V219 HydrophobicContact CH2-CG2 4.11Å; W145-V219 HydrophobicContact CZ2-CG2 4.26Å; W145-G220 WeakPolarHBondContact CZ2-O 3.37Å; W145-I221 PolarHBondContact NE1-O 3.35Å; W145-H223 AromaticContact CE2-CE1 3.96Å; W145-H223 AromaticContact CE2-ND1 3.79Å; W145-H223 AromaticContact CZ2-ND1 3.93Å; W145-H223 AromaticContact NE1-CE1 3.8Å; W145-H223 AromaticContact NE1-ND1 3.74Å
146	E	91.5	Very high	94.7	Very high	114 Å²	114	34.5 Å²	34.5	53%	0.533	19%	0.189	S	C	.	.	H	α-helix	trans	-62.7	-29.1	174.9	-75.3	174.3	179.5	0	0	112.4	L142 E143 G148	L142-E146 WeakPolarHBondContact O-CB 2.91Å; L142-E146 WeakPolarHBondContact O-CG 3.44Å; L142-E146 PolarHBondContact O-N 3.03Å; E143-E146 PolarHBondContact O-N 3.35Å; E146-G148 PolarHBondContact O-N 3.17Å
147	L	91.6	Very high	95.4	Very high	22 Å²	22	32.6 Å²	32.6	12%	0.115	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-5.6	171.7	-68.2	168.7	0	0	0	113.5	E143 A144 W145 Y149 V441 R442 R623	E143-L147 HydrophobicContact CG-CD1 4.32Å; E143-L147 WeakPolarHBondContact O-CG 3.34Å; E143-L147 PolarHBondContact O-N 3.19Å; A144-L147 PolarHBondContact O-N 3.06Å; W145-L147 PolarHBondContact O-N 3.16Å; L147-Y149 HydrophobicContact CB-CD2 3.79Å; L147-Y149 HydrophobicContact CB-CE2 3.94Å; L147-V441 HydrophobicContact CD1-CG2 3.69Å; L147-R442 HydrophobicContact CD1-CG 3.92Å; L147-R623 PolarHBondContact O-NH1 2.73Å; L147-R623 PolarHBondContact O-NH2 3.38Å
148	G	93.3	Very high	95.7	Very high	45 Å²	45	28.1 Å²	28.1	46%	0.464	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.9	10	177.8	0	0	0	0	0	114.9	A144 W145 E146	A144-G148 PolarHBondContact O-N 2.86Å; W145-G148 WeakPolarHBondContact O-CA 3.36Å; W145-G148 PolarHBondContact O-N 2.87Å; E146-G148 PolarHBondContact O-N 3.17Å
149	Y	97.2	Very high	95.9	Very high	22 Å²	22	27.3 Å²	27.3	9%	0.086	15%	0.148	C	C	.	.			trans	-88.3	124.2	175.7	-60.5	-60.4	0	0	0	110	A144 L147 E389 A390 V441 E445 R623	A144-Y149 PolarHBondContact O-N 3.08Å; L147-Y149 HydrophobicContact CB-CD2 3.79Å; L147-Y149 HydrophobicContact CB-CE2 3.94Å; Y149-E389 WeakPolarHBondContact CA-OE2 3.33Å; Y149-E389 HydrophobicContact CD1-CB 4.12Å; Y149-E389 HydrophobicContact CD1-CG 3.91Å; Y149-A390 HydrophobicContact CD1-CB 4.01Å; Y149-A390 HydrophobicContact CD2-CB 4.34Å; Y149-A390 HydrophobicContact CE1-CB 3.57Å; Y149-A390 HydrophobicContact CE2-CB 3.89Å; Y149-A390 HydrophobicContact CG-CB 4.37Å; Y149-A390 VanDerWaalsContact CZ-CB 3.46Å; Y149-V441 HydrophobicContact CD2-CB 3.75Å; Y149-V441 HydrophobicContact CD2-CG1 3.96Å; Y149-V441 HydrophobicContact CD2-CG2 3.9Å; Y149-V441 HydrophobicContact CE2-CB 3.99Å; Y149-V441 HydrophobicContact CE2-CG2 4.24Å; Y149-V441 HydrophobicContact CG-CG1 4.29Å; Y149-E445 HydrophobicContact CE2-CG 4.5Å; Y149-E445 VanDerWaalsContact OH-CD 3.3Å; Y149-E445 VanDerWaalsContact OH-CG 3.28Å; Y149-E445 WeakPolarHBondContact OH-CG 3.22Å; Y149-E445 PolarHBondContact OH-OE1 3.02Å; Y149-R623 PolarHBondContact OH-NH1 3.02Å; Y149-R623 VanDerWaalsContact OH-NH1 3.16Å
150	T	96.7	Very high	95.9	Very high	21 Å²	21	27.5 Å²	27.5	13%	0.129	15%	0.149	C	C	.	.	S	Bend	trans	-133.9	4.4	-174.3	57.4	0	0	0	0	113.3	A222 H223 N224 L386 E389	T150-A222 CarbonylContact O-C 3.54Å; T150-A222 VanDerWaalsContact O-CA 3.25Å; T150-A222 WeakPolarHBondContact O-CA 3.43Å; T150-H223 WeakPolarHBondContact CB-NE2 3.41Å; T150-H223 VanDerWaalsContact CG2-CE1 3.45Å; T150-H223 WeakPolarHBondContact CG2-CE1 3.5Å; T150-H223 WeakPolarHBondContact CG2-NE2 3.4Å; T150-H223 PolarHBondContact O-N 3.29Å; T150-N224 WeakPolarHBondContact CB-ND2 3.37Å; T150-N224 PolarHBondContact O-N 3.2Å; T150-N224 WeakPolarHBondContact OG1-CB 3.25Å; T150-N224 PolarHBondContact OG1-ND2 3.09Å; T150-L386 VanDerWaalsContact C-CD2 3.48Å; T150-E389 PolarHBondContact N-OE2 2.88Å
151	G	98.1	Very high	95.9	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.142	C	C	.	.			trans	89.3	9.5	-174.8	0	0	0	0	0	113.6	G153 I154 A225 L386 E389	G151-G153 PolarHBondContact O-N 3.49Å; G151-I154 PolarHBondContact O-N 3.35Å; G151-I154 VanDerWaalsContact O-N 3.11Å; G151-A225 VanDerWaalsContact O-CA 3.22Å; G151-A225 WeakPolarHBondContact O-CA 3.44Å; G151-A225 WeakPolarHBondContact O-CB 3.3Å; G151-L386 VanDerWaalsContact N-CD2 3.35Å; G151-E389 WeakPolarHBondContact CA-OE2 3.35Å; G151-E389 PolarHBondContact N-OE2 2.88Å
152	K	97.8	Very high	95.8	Very high	146 Å²	146	26.1 Å²	26.1	64%	0.635	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	125.4	-167.7	-173.2	178.2	178.1	175.6	0	111.6	I154 N224 E389	K152-I154 VanDerWaalsContact C-N 3.29Å; K152-I154 PolarHBondContact O-N 3Å; K152-N224 WeakPolarHBondContact CA-O 3.05Å; K152-N224 HydrophobicContact CB-CB 4.21Å; K152-E389 WeakPolarHBondContact CB-OE1 3Å; K152-E389 PolarHBondContact N-OE2 3.3Å
153	G	95.1	Very high	96	Very high	33 Å²	33	25.3 Å²	25.3	34%	0.34	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.1	13.7	176.8	0	0	0	0	0	114.3	G151 K155	G151-G153 PolarHBondContact O-N 3.49Å; G153-K155 WeakPolarHBondContact O-CE 2.98Å; G153-K155 PolarHBondContact O-NZ 3.31Å
154	I	98.5	Very high	96.2	Very high	12 Å²	12	23.5 Å²	23.5	6%	0.062	13%	0.129	C	C	.	.			trans	-97.1	136.1	169	-54.5	-52.4	0	0	0	109.3	G151 K152 I156 Q226 D254 I255 A385 L388 E389	G151-I154 PolarHBondContact O-N 3.35Å; G151-I154 VanDerWaalsContact O-N 3.11Å; K152-I154 VanDerWaalsContact C-N 3.29Å; K152-I154 PolarHBondContact O-N 3Å; I154-I156 HydrophobicContact CG2-CG1 4.15Å; I154-Q226 PolarHBondContact O-N 3.37Å; I154-D254 HydrophobicContact CG2-CB 3.89Å; I154-I255 HydrophobicContact CG2-CD1 4.05Å; I154-I255 HydrophobicContact CG2-CG1 4.43Å; I154-A385 HydrophobicContact CB-CB 4.21Å; I154-A385 WeakPolarHBondContact CG1-O 3.06Å; I154-A385 HydrophobicContact CG2-CB 3.95Å; I154-L388 HydrophobicContact CD1-CB 3.61Å; I154-L388 HydrophobicContact CG1-CB 3.99Å; I154-L388 HydrophobicContact CG2-CB 4.47Å; I154-L388 HydrophobicContact CG2-CD1 4.16Å; I154-E389 HydrophobicContact CG1-CB 4.45Å
155	K	98.4	Very high	96.3	Very high	47 Å²	47	26.2 Å²	26.2	20%	0.204	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	123.4	-177.7	-62.5	88.4	-160.9	172.4	0	109.5	G153 Q226 Y252 D254 I255	G153-K155 WeakPolarHBondContact O-CE 2.98Å; G153-K155 PolarHBondContact O-NZ 3.31Å; K155-Q226 HydrophobicContact CG-CB 4.23Å; K155-Y252 HydrophobicContact CB-CE1 4.44Å; K155-Y252 HydrophobicContact CG-CE1 3.95Å; K155-D254 PolarHBondContact N-OD2 3.27Å; K155-D254 WeakPolarHBondContact O-CA 3.48Å; K155-D254 WeakPolarHBondContact O-CB 3.49Å; K155-D254 PolarHBondContact O-N 2.84Å; K155-I255 PolarHBondContact O-N 3Å
156	I	98.7	Very high	96.3	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	140.6	-173	-51.4	165.7	0	0	0	107.5	I154 I208 A225 Q226 I227 G228 I255 A385	I154-I156 HydrophobicContact CG2-CG1 4.15Å; I156-I208 HydrophobicContact CD1-CG2 3.41Å; I156-I208 VanDerWaalsContact CD1-CG2 3.41Å; I156-I208 HydrophobicContact CG2-CD1 4.05Å; I156-I208 HydrophobicContact CG2-CG2 4.47Å; I156-A225 HydrophobicContact CD1-CB 3.72Å; I156-Q226 PolarHBondContact N-O 3.49Å; I156-I227 HydrophobicContact CB-CD1 3.94Å; I156-I227 HydrophobicContact CG2-CD1 3.97Å; I156-I227 CarbonylContact O-C 3.37Å; I156-I227 WeakPolarHBondContact O-CA 3.18Å; I156-G228 PolarHBondContact O-N 3.5Å; I156-I255 CarbonylContact C-O 3.58Å; I156-I255 WeakPolarHBondContact CA-O 3.47Å; I156-I255 HydrophobicContact CD1-CD1 4.49Å; I156-I255 HydrophobicContact CG1-CB 4.22Å; I156-I255 HydrophobicContact CG1-CD1 4.19Å; I156-I255 HydrophobicContact CG1-CG1 4.5Å; I156-I255 HydrophobicContact CG2-CB 4.15Å; I156-I255 HydrophobicContact CG2-CG2 4.42Å; I156-A385 HydrophobicContact CD1-CB 3.57Å; I156-A385 HydrophobicContact CG1-CB 4.46Å
157	T	98.4	Very high	96.6	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	139.3	173	-157.9	0	0	0	0	111.6	M159 A178 G228 I230 I253 I255 Y256 S257	T157-M159 HydrophobicContact CG2-CG 4.39Å; T157-A178 PolarHBondContact OG1-O 3.17Å; T157-G228 WeakPolarHBondContact CA-O 3.39Å; T157-G228 PolarHBondContact OG1-O 3.44Å; T157-I230 HydrophobicContact CG2-CD1 3.8Å; T157-I230 HydrophobicContact CG2-CG1 4.3Å; T157-I253 HydrophobicContact CG2-CD1 3.89Å; T157-I253 HydrophobicContact CG2-CG2 3.93Å; T157-I255 PolarHBondContact N-O 3.34Å; T157-Y256 HydrophobicContact CG2-CD1 3.41Å; T157-Y256 VanDerWaalsContact CG2-CD1 3.41Å; T157-Y256 HydrophobicContact CG2-CE1 3.78Å; T157-Y256 HydrophobicContact CG2-CG 4.03Å; T157-S257 PolarHBondContact O-N 3.16Å
158	I	98.4	Very high	96.9	Very high	2 Å²	2	24 Å²	24	1%	0.01	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	118.7	173.7	-61.1	-55.4	0	0	0	108.6	D160 I163 C204 A205 I208 I227 G228 I230	I158-D160 HydrophobicContact CG2-CB 3.62Å; I158-I163 HydrophobicContact CB-CG2 4.28Å; I158-C204 HydrophobicContact CD1-CB 4.07Å; I158-C204 HydrophobicContact CG1-CB 4.43Å; I158-C204 HydrophobicContact CG2-CB 4.08Å; I158-A205 HydrophobicContact CG1-CB 4.16Å; I158-I208 HydrophobicContact CD1-CD1 3.54Å; I158-I227 HydrophobicContact CD1-CD1 4.35Å; I158-I227 HydrophobicContact CG1-CD1 4.01Å; I158-G228 PolarHBondContact N-O 2.94Å; I158-I230 PolarHBondContact O-N 3.37Å
159	M	97	Very high	97.1	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	92.5	177.9	-57.8	174.7	-62.4	0	0	108.8	T157 I230 T245 L246 Y256 S257 W260 W297	T157-M159 HydrophobicContact CG2-CG 4.39Å; M159-I230 HydrophobicContact CG-CD1 4.36Å; M159-T245 HydrophobicContact CB-CG2 3.76Å; M159-T245 HydrophobicContact CG-CG2 3.45Å; M159-T245 VanDerWaalsContact CG-CG2 3.45Å; M159-T245 HydrophobicContact SD-CG2 3.6Å; M159-T245 VanDerWaalsContact SD-CG2 3.6Å; M159-L246 HydrophobicContact CE-CD2 4.38Å; M159-L246 HydrophobicContact SD-CD2 3.88Å; M159-Y256 HydrophobicContact CG-CD1 4.34Å; M159-Y256 HydrophobicContact SD-CD1 3.78Å; M159-Y256 HydrophobicContact SD-CG 4.29Å; M159-S257 PolarHBondContact N-O 3.07Å; M159-W260 PolarHBondContact O-NE1 3.17Å; M159-W297 HydrophobicContact CE-CE3 4.29Å; M159-W297 HydrophobicContact CE-CH2 4Å; M159-W297 HydrophobicContact CE-CZ3 3.55Å
160	D	96.7	Very high	97.1	Very high	4 Å²	4	20.9 Å²	20.9	2%	0.021	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	-150.8	-166.1	-145.9	-62	0	0	0	112.1	I158 G162 H200 I230 M232 L233	I158-D160 HydrophobicContact CG2-CB 3.62Å; D160-G162 PolarHBondContact O-N 2.83Å; D160-H200 VanDerWaalsContact CG-ND1 3.26Å; D160-H200 IonicContact OD1-CG 3.28Å; D160-H200 IonicContact OD1-ND1 3.78Å; D160-H200 PolarHBondContact OD1-ND1 3.05Å; D160-H200 VanDerWaalsContact OD1-ND1 3.08Å; D160-H200 IonicContact OD2-CE1 3.49Å; D160-H200 PolarHBondContact OD2-CE1 2.94Å; D160-H200 IonicContact OD2-CG 3.67Å; D160-H200 IonicContact OD2-ND1 3.99Å; D160-H200 PolarHBondContact OD2-ND1 3.22Å; D160-I230 PolarHBondContact N-O 3.29Å; D160-M232 PolarHBondContact O-N 2.87Å; D160-L233 PolarHBondContact O-N 3.17Å
161	D	94.4	Very high	97.1	Very high	7 Å²	7	24.7 Å²	24.7	4%	0.037	13%	0.131	C	C	.	.	S	Bend	trans	-74.8	0.2	176.3	60.3	12.7	0	0	0	115.2	N198 K199 H200 G201 R231 L233	D161-N198 HydrophobicContact CB-CB 4.18Å; D161-N198 VanDerWaalsContact CG-C 3.49Å; D161-N198 WeakPolarHBondContact OD2-CA 3.34Å; D161-K199 PolarHBondContact OD2-N 2.9Å; D161-K199 VanDerWaalsContact OD2-N 3.11Å; D161-H200 WeakPolarHBondContact OD2-CA 3.38Å; D161-H200 WeakPolarHBondContact OD2-CB 3.43Å; D161-H200 PolarHBondContact OD2-N 3.02Å; D161-G201 WeakPolarHBondContact OD1-CA 3.14Å; D161-G201 PolarHBondContact OD1-N 3.19Å; D161-R231 WeakPolarHBondContact O-CG 3.33Å; D161-L233 HydrophobicContact CB-CB 4.44Å
162	G	95.1	Very high	97	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.01	16%	0.159	C	C	.	.			trans	113.3	177.7	-176.7	0	0	0	0	0	112.6	D160 P189 G201 T202	D160-G162 PolarHBondContact O-N 2.83Å; G162-P189 CarbonylContact C-O 3.57Å; G162-P189 WeakPolarHBondContact CA-O 3.28Å; G162-G201 CarbonylContact O-C 3.58Å; G162-G201 WeakPolarHBondContact O-CA 3.19Å; G162-T202 PolarHBondContact O-N 3.46Å
163	I	96.6	Very high	97	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.005	13%	0.132	C	C	.	.			trans	-129.7	134.1	173.6	64.5	171.5	0	0	0	110.4	I158 Y165 Y174 P189 P191 A205	I158-I163 HydrophobicContact CB-CG2 4.28Å; I163-Y165 PolarHBondContact O-N 3.23Å; I163-Y174 HydrophobicContact CD1-CD2 3.81Å; I163-Y174 HydrophobicContact CD1-CE2 4.02Å; I163-P189 HydrophobicContact CG1-CB 4.4Å; I163-P189 HydrophobicContact CG1-CG 4.15Å; I163-P189 PolarHBondContact N-O 3.23Å; I163-P191 VanDerWaalsContact O-CD 3.27Å; I163-P191 WeakPolarHBondContact O-CD 3.47Å; I163-A205 HydrophobicContact CG2-CB 4Å
164	D	97	Very high	97.1	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.005	12%	0.124	C	C	.	.			trans	-72.5	79.7	167.1	-175.3	-5.1	0	0	0	108.8	T166 H167 M190 T202 L362 G363 H364	D164-T166 PolarHBondContact O-N 2.72Å; D164-T166 PolarHBondContact OD1-N 2.75Å; D164-T166 VanDerWaalsContact OD1-N 3.16Å; D164-T166 PolarHBondContact OD1-OG1 2.8Å; D164-H167 HydrophobicContact CB-CB 4.45Å; D164-H167 WeakPolarHBondContact O-CB 3.47Å; D164-H167 PolarHBondContact O-N 3.15Å; D164-H167 PolarHBondContact OD1-N 2.8Å; D164-M190 HydrophobicContact CB-CE 4.18Å; D164-M190 HydrophobicContact CB-SD 4.44Å; D164-M190 WeakPolarHBondContact OD1-CE 3.48Å; D164-T202 HydrophobicContact CB-CG2 3.84Å; D164-T202 PolarHBondContact N-OG1 3.5Å; D164-L362 HydrophobicContact CB-CD2 4.22Å; D164-G363 PolarHBondContact OD2-N 3.41Å; D164-H364 IonicContact OD2-CD2 3.73Å
165	Y	96.3	Very high	97.1	Very high	56 Å²	56	23.3 Å²	23.3	22%	0.22	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-10.4	178	63.7	-91.6	0	0	0	113	I163 H167 L171 Y174 D188 P189 M190	I163-Y165 PolarHBondContact O-N 3.23Å; Y165-H167 VanDerWaalsContact C-N 3.28Å; Y165-L171 WeakPolarHBondContact O-CA 3.25Å; Y165-Y174 HydrophobicContact CD1-CE2 4.32Å; Y165-Y174 HydrophobicContact CD2-CD1 4.15Å; Y165-Y174 AromaticContact CD2-CE1 3.98Å; Y165-Y174 HydrophobicContact CD2-CE1 3.98Å; Y165-Y174 HydrophobicContact CG-CD1 4.22Å; Y165-Y174 HydrophobicContact CG-CD2 4.2Å; Y165-Y174 HydrophobicContact CG-CE1 4.03Å; Y165-Y174 AromaticContact CG-CE2 3.99Å; Y165-Y174 HydrophobicContact CG-CE2 3.99Å; Y165-Y174 HydrophobicContact CG-CG 4.3Å; Y165-Y174 AromaticContact CG-CZ 3.9Å; Y165-D188 WeakPolarHBondContact CE1-OD1 3.19Å; Y165-D188 VanDerWaalsContact CZ-OD1 3.3Å; Y165-D188 PolarHBondContact OH-OD1 3.46Å; Y165-P189 HydrophobicContact CD1-CG 3.89Å; Y165-P189 HydrophobicContact CE1-CG 4.25Å; Y165-M190 HydrophobicContact CD1-SD 4.28Å; Y165-M190 HydrophobicContact CE1-CB 3.86Å; Y165-M190 HydrophobicContact CE1-SD 4.05Å
166	T	96.5	Very high	97	Very high	54 Å²	54	24.9 Å²	24.9	33%	0.331	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-11.3	173.6	76.6	0	0	0	0	112.3	D164 M190 H364	D164-T166 PolarHBondContact O-N 2.72Å; D164-T166 PolarHBondContact OD1-N 2.75Å; D164-T166 VanDerWaalsContact OD1-N 3.16Å; D164-T166 PolarHBondContact OD1-OG1 2.8Å; T166-M190 HydrophobicContact CG2-SD 4.39Å; T166-H364 PolarHBondContact O-NE2 2.82Å; T166-H364 VanDerWaalsContact O-NE2 3.17Å; T166-H364 PolarHBondContact OG1-NE2 3.12Å
167	H	97.8	Very high	96.9	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.164	C	C	.	.	S	Bend	trans	-55.4	127.1	175.8	-169.7	-72	0	0	0	110.2	D164 Y165 D169 L170 L171 T360 D361 D365	D164-H167 HydrophobicContact CB-CB 4.45Å; D164-H167 WeakPolarHBondContact O-CB 3.47Å; D164-H167 PolarHBondContact O-N 3.15Å; D164-H167 PolarHBondContact OD1-N 2.8Å; Y165-H167 VanDerWaalsContact C-N 3.28Å; H167-D169 VanDerWaalsContact ND1-CB 3.33Å; H167-D169 WeakPolarHBondContact ND1-CB 3.4Å; H167-D169 PolarHBondContact ND1-N 3.49Å; H167-D169 VanDerWaalsContact ND1-N 3.16Å; H167-D169 PolarHBondContact O-N 2.89Å; H167-L170 HydrophobicContact CB-CB 4.3Å; H167-L170 HydrophobicContact CB-CD1 4.34Å; H167-L170 HydrophobicContact CB-CG 4.4Å; H167-L170 PolarHBondContact O-N 2.64Å; H167-L171 WeakPolarHBondContact O-CB 3.45Å; H167-L171 PolarHBondContact O-N 3.14Å; H167-T360 VanDerWaalsContact CE1-CG2 3.4Å; H167-T360 WeakPolarHBondContact CE1-CG2 3.3Å; H167-D361 PolarHBondContact CD2-O 2.8Å; H167-D361 VanDerWaalsContact CD2-O 3.27Å; H167-D365 PolarHBondContact NE2-O 2.95Å; H167-D365 VanDerWaalsContact NE2-O 3.09Å
168	P	96.9	Very high	96.8	Very high	53 Å²	53	30.7 Å²	30.7	34%	0.344	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-32.7	-173.9	-27.5	33.4	0	0	0	114.1	V216 H364	P168-V216 HydrophobicContact CB-CG1 4.35Å; P168-V216 HydrophobicContact CB-CG2 4.28Å; P168-H364 HydrophobicContact CG-CB 4.44Å
169	D	96.8	Very high	96.8	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-15.4	-180	-149.7	9.9	0	0	0	114.8	H167 A210 Q211 N214 V216 I218 T360	H167-D169 VanDerWaalsContact ND1-CB 3.33Å; H167-D169 WeakPolarHBondContact ND1-CB 3.4Å; H167-D169 PolarHBondContact ND1-N 3.49Å; H167-D169 VanDerWaalsContact ND1-N 3.16Å; H167-D169 PolarHBondContact O-N 2.89Å; D169-A210 WeakPolarHBondContact O-CA 2.98Å; D169-A210 VanDerWaalsContact OD2-CB 3.29Å; D169-A210 WeakPolarHBondContact OD2-CB 3.2Å; D169-Q211 PolarHBondContact O-N 3.11Å; D169-Q211 PolarHBondContact OD1-N 3.24Å; D169-Q211 VanDerWaalsContact OD1-N 3.14Å; D169-N214 PolarHBondContact OD1-ND2 3.32Å; D169-V216 HydrophobicContact CB-CB 4.36Å; D169-V216 HydrophobicContact CB-CG1 3.91Å; D169-I218 PolarHBondContact OD2-N 3.39Å; D169-I218 VanDerWaalsContact OD2-O 3.1Å; D169-T360 HydrophobicContact CB-CG2 3.91Å
170	L	97.9	Very high	96.8	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-18.9	177.3	-64.2	177.7	0	0	0	112.8	H167 V172 T173 Y174 T202 A205 I227	H167-L170 HydrophobicContact CB-CB 4.3Å; H167-L170 HydrophobicContact CB-CD1 4.34Å; H167-L170 HydrophobicContact CB-CG 4.4Å; H167-L170 PolarHBondContact O-N 2.64Å; L170-V172 PolarHBondContact O-N 3.25Å; L170-V172 VanDerWaalsContact O-N 3.14Å; L170-T173 PolarHBondContact O-N 2.78Å; L170-T173 VanDerWaalsContact O-N 3.12Å; L170-T173 PolarHBondContact O-OG1 3.4Å; L170-Y174 WeakPolarHBondContact O-CB 3.42Å; L170-Y174 PolarHBondContact O-N 2.88Å; L170-T202 HydrophobicContact CD1-CG2 4.26Å; L170-A205 HydrophobicContact CD1-CB 3.91Å; L170-A205 HydrophobicContact CD2-CB 4.2Å; L170-I227 HydrophobicContact CD2-CG2 4.41Å
171	L	96.3	Very high	96.6	Very high	102 Å²	102	32.2 Å²	32.2	53%	0.534	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-37.6	-173.6	-178	67.7	0	0	0	113.2	Y165 H167	Y165-L171 WeakPolarHBondContact O-CA 3.25Å; H167-L171 WeakPolarHBondContact O-CB 3.45Å; H167-L171 PolarHBondContact O-N 3.14Å
172	V	96.1	Very high	96.2	Very high	95 Å²	95	32.2 Å²	32.2	58%	0.576	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-34.7	-177.9	176.3	0	0	0	0	112.2	L170 Q211	L170-V172 PolarHBondContact O-N 3.25Å; L170-V172 VanDerWaalsContact O-N 3.14Å; V172-Q211 HydrophobicContact CB-CG 4.44Å
173	T	97.2	Very high	95.4	Very high	10 Å²	10	34 Å²	34	6%	0.061	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-13.5	-177.6	52.6	0	0	0	0	112.8	L170 D175 A209 H223 A225 Q226 I227	L170-T173 PolarHBondContact O-N 2.78Å; L170-T173 VanDerWaalsContact O-N 3.12Å; L170-T173 PolarHBondContact O-OG1 3.4Å; T173-D175 PolarHBondContact O-N 3.15Å; T173-A209 WeakPolarHBondContact CB-O 3.26Å; T173-A209 HydrophobicContact CG2-CB 4.48Å; T173-A209 VanDerWaalsContact CG2-O 3.27Å; T173-A209 WeakPolarHBondContact CG2-O 3.41Å; T173-A209 PolarHBondContact OG1-O 3.06Å; T173-H223 WeakPolarHBondContact CG2-O 3.11Å; T173-A225 WeakPolarHBondContact CB-O 3Å; T173-Q226 CarbonylContact O-C 3.06Å; T173-Q226 WeakPolarHBondContact O-CA 3.44Å; T173-I227 PolarHBondContact O-N 2.85Å
174	Y	98.4	Very high	94.6	Very high	47 Å²	47	35.8 Å²	35.8	18%	0.184	20%	0.2	C	C	.	.	B	Isolated β-bridge	trans	-55.9	129.7	179.5	173.5	-116.6	0	0	0	113.1	I163 Y165 L170 P176 S179 P189 I227	I163-Y174 HydrophobicContact CD1-CD2 3.81Å; I163-Y174 HydrophobicContact CD1-CE2 4.02Å; Y165-Y174 HydrophobicContact CD1-CE2 4.32Å; Y165-Y174 HydrophobicContact CD2-CD1 4.15Å; Y165-Y174 AromaticContact CD2-CE1 3.98Å; Y165-Y174 HydrophobicContact CD2-CE1 3.98Å; Y165-Y174 HydrophobicContact CG-CD1 4.22Å; Y165-Y174 HydrophobicContact CG-CD2 4.2Å; Y165-Y174 HydrophobicContact CG-CE1 4.03Å; Y165-Y174 AromaticContact CG-CE2 3.99Å; Y165-Y174 HydrophobicContact CG-CE2 3.99Å; Y165-Y174 HydrophobicContact CG-CG 4.3Å; Y165-Y174 AromaticContact CG-CZ 3.9Å; L170-Y174 WeakPolarHBondContact O-CB 3.42Å; L170-Y174 PolarHBondContact O-N 2.88Å; Y174-P176 HydrophobicContact CE1-CB 3.9Å; Y174-P176 HydrophobicContact CE1-CG 4.36Å; Y174-S179 VanDerWaalsContact CE2-OG 3.24Å; Y174-S179 WeakPolarHBondContact CE2-OG 3.2Å; Y174-P189 HydrophobicContact CE2-CG 4.02Å; Y174-I227 CarbonylContact C-O 3.52Å; Y174-I227 WeakPolarHBondContact CA-O 3.22Å
175	D	98.2	Very high	93.8	Very high	9 Å²	9	42.2 Å²	42.2	5%	0.048	23%	0.23	C	C	.	.			trans	-117.4	105.9	175.4	-171.8	-6.2	0	0	0	111.8	T173 K177 A178 S179 Q226 I227 Y252	T173-D175 PolarHBondContact O-N 3.15Å; D175-K177 PolarHBondContact O-N 3.13Å; D175-K177 WeakPolarHBondContact OD1-CB 3.45Å; D175-K177 PolarHBondContact OD1-N 3.24Å; D175-A178 HydrophobicContact CB-CB 4.13Å; D175-A178 PolarHBondContact O-N 2.94Å; D175-A178 VanDerWaalsContact O-N 3.1Å; D175-S179 PolarHBondContact O-OG 3.08Å; D175-Q226 HydrophobicContact CB-CB 4.01Å; D175-I227 PolarHBondContact N-O 2.81Å; D175-Y252 WeakPolarHBondContact OD2-CE1 3.39Å; D175-Y252 VanDerWaalsContact OD2-CZ 3.23Å; D175-Y252 PolarHBondContact OD2-OH 2.81Å
176	P	97.1	Very high	93.5	Very high	80 Å²	80	43.2 Å²	43.2	52%	0.519	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-65.4	-21.2	177.9	26.4	-34	0	0	0	112.8	Y174 A178 S179	Y174-P176 HydrophobicContact CE1-CB 3.9Å; Y174-P176 HydrophobicContact CE1-CG 4.36Å; P176-A178 VanDerWaalsContact C-N 3.32Å; P176-S179 PolarHBondContact O-N 3.38Å
177	K	94.9	Very high	93.2	Very high	122 Å²	122	46.5 Å²	46.5	53%	0.53	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-78.3	-18.2	176.6	-68.7	-179.4	-178.9	174.2	0	113.1	D175 R249 Y252	D175-K177 PolarHBondContact O-N 3.13Å; D175-K177 WeakPolarHBondContact OD1-CB 3.45Å; D175-K177 PolarHBondContact OD1-N 3.24Å; K177-R249 PolarHBondContact O-NH1 3.39Å; K177-Y252 HydrophobicContact CB-CD1 4.15Å; K177-Y252 HydrophobicContact CB-CE1 3.51Å; K177-Y252 HydrophobicContact CD-CE2 4.31Å
178	A	97.5	Very high	93	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-99.5	14.1	174.3	0	0	0	0	0	112	T157 D175 P176 G228 Y252 I253	T157-A178 PolarHBondContact OG1-O 3.17Å; D175-A178 HydrophobicContact CB-CB 4.13Å; D175-A178 PolarHBondContact O-N 2.94Å; D175-A178 VanDerWaalsContact O-N 3.1Å; P176-A178 VanDerWaalsContact C-N 3.32Å; A178-G228 WeakPolarHBondContact O-CA 3.25Å; A178-Y252 HydrophobicContact CB-CE1 4.24Å; A178-I253 HydrophobicContact CB-CD1 4.16Å; A178-I253 HydrophobicContact CB-CG1 3.99Å
179	S	98.2	Very high	92.9	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.014	26%	0.255	C	S	.	.			trans	-130.7	145.7	-172	-57.4	0	0	0	0	113.1	Y174 D175 P176 G228 G229	Y174-S179 VanDerWaalsContact CE2-OG 3.24Å; Y174-S179 WeakPolarHBondContact CE2-OG 3.2Å; D175-S179 PolarHBondContact O-OG 3.08Å; P176-S179 PolarHBondContact O-N 3.38Å; S179-G228 WeakPolarHBondContact OG-CA 3.46Å; S179-G229 CarbonylContact C-O 3.6Å; S179-G229 WeakPolarHBondContact CA-O 3.34Å; S179-G229 WeakPolarHBondContact CB-O 3.21Å; S179-G229 PolarHBondContact OG-N 3.17Å
180	I	96	Very high	92.9	Very high	33 Å²	33	49 Å²	49	17%	0.169	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.2	149.9	176.9	-172.7	165.7	0	0	0	110.7	I182 D186 G229 I230 R231 F248	I180-I182 HydrophobicContact CG1-CG1 4.38Å; I180-I182 HydrophobicContact CG2-CD1 4.26Å; I180-I182 HydrophobicContact CG2-CG1 3.98Å; I180-D186 VanDerWaalsContact CG1-O 3.29Å; I180-D186 WeakPolarHBondContact CG1-O 3.16Å; I180-G229 PolarHBondContact N-O 2.76Å; I180-I230 HydrophobicContact CG2-CB 4.38Å; I180-I230 HydrophobicContact CG2-CG1 3.95Å; I180-I230 HydrophobicContact CG2-CG2 3.97Å; I180-I230 WeakPolarHBondContact O-CA 3.47Å; I180-R231 PolarHBondContact O-N 3.1Å; I180-F248 HydrophobicContact CB-CD2 4.39Å; I180-F248 HydrophobicContact CB-CE1 4.22Å; I180-F248 HydrophobicContact CB-CE2 3.86Å; I180-F248 HydrophobicContact CB-CZ 3.76Å; I180-F248 HydrophobicContact CD1-CD2 4.02Å; I180-F248 HydrophobicContact CD1-CE2 3.66Å; I180-F248 HydrophobicContact CD1-CZ 4.41Å; I180-F248 HydrophobicContact CG1-CE2 4.35Å; I180-F248 HydrophobicContact CG2-CD1 3.87Å; I180-F248 HydrophobicContact CG2-CD2 3.83Å; I180-F248 HydrophobicContact CG2-CE1 3.82Å; I180-F248 HydrophobicContact CG2-CE2 3.79Å; I180-F248 HydrophobicContact CG2-CG 3.86Å; I180-F248 HydrophobicContact CG2-CZ 3.77Å
181	D	94	Very high	92.6	Very high	4 Å²	4	49.1 Å²	49.1	2%	0.021	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	103.3	165.1	-174.4	-5.3	0	0	0	109.9	N183 G184 H185 D186 D188 R231	D181-N183 PolarHBondContact OD1-N 2.03Å; D181-G184 VanDerWaalsContact CG-N 3.27Å; D181-G184 PolarHBondContact OD1-N 2.83Å; D181-H185 WeakPolarHBondContact O-CA 3.27Å; D181-H185 PolarHBondContact O-N 3.14Å; D181-D186 PolarHBondContact N-O 3.06Å; D181-D186 PolarHBondContact O-N 3.41Å; D181-D186 VanDerWaalsContact O-N 3.09Å; D181-D186 VanDerWaalsContact O-O 3.14Å; D181-D188 WeakPolarHBondContact CB-O 3.37Å; D181-R231 HydrophobicContact CB-CB 4.23Å; D181-R231 IonicContact OD2-CZ 2.67Å; D181-R231 IonicContact OD2-NE 3.52Å; D181-R231 IonicContact OD2-NH1 2.81Å; D181-R231 PolarHBondContact OD2-NH1 3Å
182	I	85.7	Confident	92.2	Very high	6 Å²	6	47.4 Å²	47.4	3%	0.031	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-30.7	-178.5	-69.2	174.5	0	0	0	110.9	I180 H185 I230 R231 V241 E244 T245	I180-I182 HydrophobicContact CG1-CG1 4.38Å; I180-I182 HydrophobicContact CG2-CD1 4.26Å; I180-I182 HydrophobicContact CG2-CG1 3.98Å; I182-H185 PolarHBondContact O-CE1 3.17Å; I182-H185 PolarHBondContact O-ND1 2.97Å; I182-I230 HydrophobicContact CD1-CG2 3.55Å; I182-I230 HydrophobicContact CG1-CG2 4.11Å; I182-R231 PolarHBondContact N-O 3.06Å; I182-R231 VanDerWaalsContact N-O 3.11Å; I182-V241 HydrophobicContact CG2-CB 4.33Å; I182-V241 HydrophobicContact CG2-CG1 3.86Å; I182-V241 HydrophobicContact CG2-CG2 4.2Å; I182-E244 HydrophobicContact CD1-CB 4.12Å; I182-T245 VanDerWaalsContact CD1-OG1 3.23Å; I182-T245 WeakPolarHBondContact CD1-OG1 3.21Å
183	N	77.9	Confident	91.8	Very high	39 Å²	39	47.8 Å²	47.8	21%	0.209	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-40.2	178.2	-72	-20.1	0	0	0	111.9	D181 M232 D234 G235	D181-N183 PolarHBondContact OD1-N 2.03Å; N183-M232 PolarHBondContact ND2-O 3.35Å; N183-M232 PolarHBondContact OD1-O 2.77Å; N183-D234 PolarHBondContact ND2-O 2.88Å; N183-D234 VanDerWaalsContact ND2-O 3.1Å; N183-G235 VanDerWaalsContact ND2-CA 3.34Å; N183-G235 WeakPolarHBondContact ND2-CA 3.4Å; N183-G235 PolarHBondContact ND2-N 3.27Å
184	G	79.8	Confident	91.2	Very high	39 Å²	39	58.3 Å²	58.3	40%	0.402	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-17.7	175.3	0	0	0	0	0	113.9	D181 D186	D181-G184 VanDerWaalsContact CG-N 3.27Å; D181-G184 PolarHBondContact OD1-N 2.83Å; G184-D186 VanDerWaalsContact C-N 3.35Å
185	H	81.2	Confident	90.6	Very high	136 Å²	136	59 Å²	59	63%	0.63	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.9	39.8	-173.5	-57.7	-62.8	0	0	0	113.6	D181 I182	D181-H185 WeakPolarHBondContact O-CA 3.27Å; D181-H185 PolarHBondContact O-N 3.14Å; I182-H185 PolarHBondContact O-CE1 3.17Å; I182-H185 PolarHBondContact O-ND1 2.97Å
186	D	88.5	Confident	89.9	Confident	76 Å²	76	68.4 Å²	68.4	41%	0.406	33%	0.334	S	S	.	.	B	Isolated β-bridge	trans	-139.6	-175.6	175.5	68.5	49.6	0	0	0	111.8	I180 D181 G184 D188	I180-D186 VanDerWaalsContact CG1-O 3.29Å; I180-D186 WeakPolarHBondContact CG1-O 3.16Å; D181-D186 PolarHBondContact N-O 3.06Å; D181-D186 PolarHBondContact O-N 3.41Å; D181-D186 VanDerWaalsContact O-N 3.09Å; D181-D186 VanDerWaalsContact O-O 3.14Å; G184-D186 VanDerWaalsContact C-N 3.35Å; D186-D188 WeakPolarHBondContact OD1-CB 3.46Å; D186-D188 PolarHBondContact OD1-N 2.71Å
187	N	90.2	Very high	89.3	Confident	124 Å²	124	70.2 Å²	70.2	66%	0.663	34%	0.34	S	S	*	.	S	Bend	trans	-96.1	4.9	-175.1	-62.3	-34.2	0	0	0	113.3	P189	N187-P189 VanDerWaalsContact O-CD 3.25Å; N187-P189 WeakPolarHBondContact O-CD 3.19Å
188	D	93.5	Very high	89.1	Confident	68 Å²	68	65 Å²	65	36%	0.364	32%	0.317	S	S	.	.			trans	-97.3	97.8	-172.8	-175	15.2	0	0	0	111.1	Y165 D181 D186 M190	Y165-D188 WeakPolarHBondContact CE1-OD1 3.19Å; Y165-D188 VanDerWaalsContact CZ-OD1 3.3Å; Y165-D188 PolarHBondContact OH-OD1 3.46Å; D181-D188 WeakPolarHBondContact CB-O 3.37Å; D186-D188 WeakPolarHBondContact OD1-CB 3.46Å; D186-D188 PolarHBondContact OD1-N 2.71Å; D188-M190 PolarHBondContact O-N 3.42Å; D188-M190 WeakPolarHBondContact OD1-CB 3.38Å; D188-M190 PolarHBondContact OD1-N 2.78Å
189	P	95.6	Very high	88.9	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	33%	0.33	C	S	.	.			trans	-76.5	11.1	-175.3	39.7	-43.2	0	0	0	113	G162 I163 Y165 Y174 N187 P191 G229	G162-P189 CarbonylContact C-O 3.57Å; G162-P189 WeakPolarHBondContact CA-O 3.28Å; I163-P189 HydrophobicContact CG1-CB 4.4Å; I163-P189 HydrophobicContact CG1-CG 4.15Å; I163-P189 PolarHBondContact N-O 3.23Å; Y165-P189 HydrophobicContact CD1-CG 3.89Å; Y165-P189 HydrophobicContact CE1-CG 4.25Å; Y174-P189 HydrophobicContact CE2-CG 4.02Å; N187-P189 VanDerWaalsContact O-CD 3.25Å; N187-P189 WeakPolarHBondContact O-CD 3.19Å; P189-P191 WeakPolarHBondContact O-CD 2.99Å; P189-G229 WeakPolarHBondContact CB-O 3.34Å
190	M	95.7	Very high	88.8	Confident	37 Å²	37	70.1 Å²	70.1	18%	0.182	34%	0.34	C	S	.	.			trans	-58.3	124.1	-178	-166.6	69.1	-175.1	0	0	109.7	D164 Y165 T166 D188 I193 R231	D164-M190 HydrophobicContact CB-CE 4.18Å; D164-M190 HydrophobicContact CB-SD 4.44Å; D164-M190 WeakPolarHBondContact OD1-CE 3.48Å; Y165-M190 HydrophobicContact CD1-SD 4.28Å; Y165-M190 HydrophobicContact CE1-CB 3.86Å; Y165-M190 HydrophobicContact CE1-SD 4.05Å; T166-M190 HydrophobicContact CG2-SD 4.39Å; D188-M190 PolarHBondContact O-N 3.42Å; D188-M190 WeakPolarHBondContact OD1-CB 3.38Å; D188-M190 PolarHBondContact OD1-N 2.78Å; M190-I193 HydrophobicContact CE-CG2 3.75Å; M190-R231 VanDerWaalsContact O-CD 3.28Å; M190-R231 WeakPolarHBondContact O-CD 3.33Å; M190-R231 PolarHBondContact O-NE 3.43Å; M190-R231 PolarHBondContact O-NH1 3.23Å
191	P	93.6	Very high	88.8	Confident	3 Å²	3	68.5 Å²	68.5	2%	0.019	33%	0.332	C	S	.	.			trans	-65.6	148.8	174.7	25.6	-32.4	0	0	0	109.6	I163 P189 I193 N198 L362	I163-P191 VanDerWaalsContact O-CD 3.27Å; I163-P191 WeakPolarHBondContact O-CD 3.47Å; P189-P191 WeakPolarHBondContact O-CD 2.99Å; P191-I193 VanDerWaalsContact C-N 3.35Å; P191-I193 PolarHBondContact O-N 3.07Å; P191-N198 HydrophobicContact CB-CB 3.96Å; P191-N198 VanDerWaalsContact CB-O 3.3Å; P191-N198 WeakPolarHBondContact CB-O 3.23Å; P191-L362 HydrophobicContact CB-CD2 4.19Å; P191-L362 HydrophobicContact CG-CD2 3.4Å
192	N	87.8	Confident	89	Confident	66 Å²	66	68.3 Å²	68.3	35%	0.353	33%	0.331	S	S	.	.			trans	-67.2	94.3	171.8	175.4	12.5	0	0	0	110.7	R194 N195 N198 D234	N192-R194 PolarHBondContact O-N 2.99Å; N192-R194 WeakPolarHBondContact OD1-CB 3.13Å; N192-R194 PolarHBondContact OD1-N 3.13Å; N192-N195 PolarHBondContact O-N 3.04Å; N192-N198 PolarHBondContact O-ND2 3.4Å; N192-D234 VanDerWaalsContact CB-OD2 3.24Å; N192-D234 WeakPolarHBondContact CB-OD2 3.45Å; N192-D234 PolarHBondContact N-OD2 3.19Å; N192-D234 VanDerWaalsContact N-OD2 3.14Å
193	I	86.7	Confident	89.6	Confident	103 Å²	103	69.5 Å²	69.5	53%	0.528	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-14.7	-178	62.5	170.6	0	0	0	114.6	M190 P191 N195	M190-I193 HydrophobicContact CE-CG2 3.75Å; P191-I193 VanDerWaalsContact C-N 3.35Å; P191-I193 PolarHBondContact O-N 3.07Å; I193-N195 VanDerWaalsContact C-N 3.27Å
194	R	84.9	Confident	90.5	Very high	231 Å²	231	67.7 Å²	67.7	87%	0.872	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-27.2	173.9	-61	-177.3	174.9	-176	-0.3	111.6	N192	N192-R194 PolarHBondContact O-N 2.99Å; N192-R194 WeakPolarHBondContact OD1-CB 3.13Å; N192-R194 PolarHBondContact OD1-N 3.13Å
195	N	85.1	Confident	91.4	Very high	60 Å²	60	65.8 Å²	65.8	32%	0.321	31%	0.306	S	S	.	.	S	Bend	trans	-94.6	104.9	171.7	-177	6	0	0	0	109.1	N192 I193 D197 N198	N192-N195 PolarHBondContact O-N 3.04Å; I193-N195 VanDerWaalsContact C-N 3.27Å; N195-D197 PolarHBondContact O-N 2.7Å; N195-D197 VanDerWaalsContact O-N 3.1Å; N195-D197 WeakPolarHBondContact OD1-CB 3.4Å; N195-D197 PolarHBondContact OD1-N 3.45Å; N195-D197 VanDerWaalsContact OD1-N 3.1Å; N195-N198 PolarHBondContact ND2-OD1 2.86Å; N195-N198 WeakPolarHBondContact O-CB 3.18Å; N195-N198 PolarHBondContact O-N 2.89Å; N195-N198 VanDerWaalsContact O-N 3.08Å
196	R	83.2	Confident	92.2	Very high	208 Å²	208	59.3 Å²	59.3	79%	0.785	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-6.3	-179.5	-70.1	-168.5	175.7	-149.9	-2.7	113.8	N198 K199	R196-N198 VanDerWaalsContact C-N 3.35Å; R196-K199 VanDerWaalsContact O-CD 3.29Å; R196-K199 WeakPolarHBondContact O-CD 3.03Å; R196-K199 PolarHBondContact O-NZ 2.8Å
197	D	85.1	Confident	92.7	Very high	118 Å²	118	55.9 Å²	55.9	63%	0.631	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-21	173.4	-62.3	-30.5	0	0	0	111.9	N195 K199	N195-D197 PolarHBondContact O-N 2.7Å; N195-D197 VanDerWaalsContact O-N 3.1Å; N195-D197 WeakPolarHBondContact OD1-CB 3.4Å; N195-D197 PolarHBondContact OD1-N 3.45Å; N195-D197 VanDerWaalsContact OD1-N 3.1Å; D197-K199 PolarHBondContact O-N 3.07Å
198	N	91.8	Very high	93.1	Very high	11 Å²	11	50 Å²	50	6%	0.059	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	36.9	-179.3	-66.1	-14.9	0	0	0	114	D161 P191 N192 N195 R196 D234 L362	D161-N198 HydrophobicContact CB-CB 4.18Å; D161-N198 VanDerWaalsContact CG-C 3.49Å; D161-N198 WeakPolarHBondContact OD2-CA 3.34Å; P191-N198 HydrophobicContact CB-CB 3.96Å; P191-N198 VanDerWaalsContact CB-O 3.3Å; P191-N198 WeakPolarHBondContact CB-O 3.23Å; N192-N198 PolarHBondContact O-ND2 3.4Å; N195-N198 PolarHBondContact ND2-OD1 2.86Å; N195-N198 WeakPolarHBondContact O-CB 3.18Å; N195-N198 PolarHBondContact O-N 2.89Å; N195-N198 VanDerWaalsContact O-N 3.08Å; R196-N198 VanDerWaalsContact C-N 3.35Å; N198-D234 PolarHBondContact ND2-OD1 2.9Å; N198-D234 PolarHBondContact ND2-OD2 3.47Å; N198-L362 WeakPolarHBondContact O-CD1 3.24Å; N198-L362 WeakPolarHBondContact O-CD2 3.47Å
199	K	93.4	Very high	93.3	Very high	61 Å²	61	46.7 Å²	46.7	27%	0.265	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-6.6	-177.7	66	-166.3	170.2	-148.5	0	113.9	D161 R196 D197 R203 D361 L362	D161-K199 PolarHBondContact OD2-N 2.9Å; D161-K199 VanDerWaalsContact OD2-N 3.11Å; R196-K199 VanDerWaalsContact O-CD 3.29Å; R196-K199 WeakPolarHBondContact O-CD 3.03Å; R196-K199 PolarHBondContact O-NZ 2.8Å; D197-K199 PolarHBondContact O-N 3.07Å; K199-R203 VanDerWaalsContact CD-CZ 3.48Å; K199-R203 WeakPolarHBondContact O-CD 3.46Å; K199-R203 VanDerWaalsContact O-CG 3.28Å; K199-R203 WeakPolarHBondContact O-CG 3.3Å; K199-R203 PolarHBondContact O-N 3.42Å; K199-D361 WeakPolarHBondContact CB-OD1 3.45Å; K199-L362 HydrophobicContact CB-CB 4.45Å; K199-L362 HydrophobicContact CB-CD1 3.71Å; K199-L362 HydrophobicContact CB-CG 3.59Å
200	H	94.3	Very high	93.5	Very high	49 Å²	49	46.7 Å²	46.7	23%	0.227	21%	0.208	C	C	.	.	H	α-helix	trans	-70.4	-48.6	-164.7	-171.4	-103.1	0	0	0	111.7	D160 D161 T202 R203 C204 S259 S374	D160-H200 VanDerWaalsContact CG-ND1 3.26Å; D160-H200 IonicContact OD1-CG 3.28Å; D160-H200 IonicContact OD1-ND1 3.78Å; D160-H200 PolarHBondContact OD1-ND1 3.05Å; D160-H200 VanDerWaalsContact OD1-ND1 3.08Å; D160-H200 IonicContact OD2-CE1 3.49Å; D160-H200 PolarHBondContact OD2-CE1 2.94Å; D160-H200 IonicContact OD2-CG 3.67Å; D160-H200 IonicContact OD2-ND1 3.99Å; D160-H200 PolarHBondContact OD2-ND1 3.22Å; D161-H200 WeakPolarHBondContact OD2-CA 3.38Å; D161-H200 WeakPolarHBondContact OD2-CB 3.43Å; D161-H200 PolarHBondContact OD2-N 3.02Å; H200-T202 PolarHBondContact O-N 2.87Å; H200-R203 WeakPolarHBondContact O-CB 3.31Å; H200-R203 PolarHBondContact O-N 3.17Å; H200-C204 PolarHBondContact O-N 3.24Å; H200-C204 PolarHBondContact O-SG 2.77Å; H200-S259 PolarHBondContact CE1-O 3.06Å; H200-S374 PolarHBondContact CE1-OG 2.8Å; H200-S374 WeakPolarHBondContact NE2-CB 3.23Å; H200-S374 PolarHBondContact NE2-OG 3.18Å
201	G	96.6	Very high	93.4	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64	-38.8	177.8	0	0	0	0	0	112.9	D161 G162 R203 C204 A205	D161-G201 WeakPolarHBondContact OD1-CA 3.14Å; D161-G201 PolarHBondContact OD1-N 3.19Å; G162-G201 CarbonylContact O-C 3.58Å; G162-G201 WeakPolarHBondContact O-CA 3.19Å; G201-R203 PolarHBondContact O-N 3.26Å; G201-C204 WeakPolarHBondContact O-CB 3.41Å; G201-C204 PolarHBondContact O-N 2.87Å; G201-A205 PolarHBondContact O-N 3.48Å
202	T	98.2	Very high	93.3	Very high	0 Å²	0	48 Å²	48	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.6	-42	175.2	-58.9	0	0	0	0	111.8	G162 D164 L170 H200 A205 G206 T360	G162-T202 PolarHBondContact O-N 3.46Å; D164-T202 HydrophobicContact CB-CG2 3.84Å; D164-T202 PolarHBondContact N-OG1 3.5Å; L170-T202 HydrophobicContact CD1-CG2 4.26Å; H200-T202 PolarHBondContact O-N 2.87Å; T202-A205 PolarHBondContact O-N 2.83Å; T202-G206 PolarHBondContact O-N 3.35Å; T202-T360 PolarHBondContact O-OG1 2.8Å
203	R	97.8	Very high	93.4	Very high	31 Å²	31	49.5 Å²	49.5	12%	0.117	22%	0.223	C	C	.	.	H	α-helix	trans	-66.1	-37.4	175.3	-71.9	165.2	175.7	-151	-8.3	112.2	K199 H200 G201 Q207 T359 T360 D361 T367	K199-R203 VanDerWaalsContact CD-CZ 3.48Å; K199-R203 WeakPolarHBondContact O-CD 3.46Å; K199-R203 VanDerWaalsContact O-CG 3.28Å; K199-R203 WeakPolarHBondContact O-CG 3.3Å; K199-R203 PolarHBondContact O-N 3.42Å; H200-R203 WeakPolarHBondContact O-CB 3.31Å; H200-R203 PolarHBondContact O-N 3.17Å; G201-R203 PolarHBondContact O-N 3.26Å; R203-Q207 PolarHBondContact O-NE2 3.33Å; R203-T359 HydrophobicContact CB-CG2 3.68Å; R203-T359 HydrophobicContact CG-CG2 3.92Å; R203-T359 WeakPolarHBondContact O-CG2 3.39Å; R203-T359 PolarHBondContact O-OG1 3.43Å; R203-T360 WeakPolarHBondContact CA-O 3.3Å; R203-T360 WeakPolarHBondContact CG-O 3.49Å; R203-D361 IonicContact CZ-OD1 3.47Å; R203-D361 IonicContact CZ-OD2 2.77Å; R203-D361 VanDerWaalsContact NE-CG 3.33Å; R203-D361 IonicContact NE-OD1 2.8Å; R203-D361 PolarHBondContact NE-OD1 3.12Å; R203-D361 IonicContact NE-OD2 3.47Å; R203-D361 PolarHBondContact NE-OD2 3.33Å; R203-D361 IonicContact NH2-OD1 2.73Å; R203-D361 PolarHBondContact NH2-OD1 3.14Å; R203-D361 IonicContact NH2-OD2 2.6Å; R203-D361 PolarHBondContact NH2-OD2 3.17Å; R203-T367 HydrophobicContact CG-CG2 4.14Å
204	C	98.1	Very high	93.8	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.5	-46.3	174.2	-67.7	0	0	0	0	111.4	I158 H200 G201 G206 Q207 P378	I158-C204 HydrophobicContact CD1-CB 4.07Å; I158-C204 HydrophobicContact CG1-CB 4.43Å; I158-C204 HydrophobicContact CG2-CB 4.08Å; H200-C204 PolarHBondContact O-N 3.24Å; H200-C204 PolarHBondContact O-SG 2.77Å; G201-C204 WeakPolarHBondContact O-CB 3.41Å; G201-C204 PolarHBondContact O-N 2.87Å; C204-G206 PolarHBondContact O-N 2.87Å; C204-Q207 PolarHBondContact O-N 2.84Å; C204-P378 HydrophobicContact CB-CB 4.16Å; C204-P378 HydrophobicContact CB-CG 3.55Å; C204-P378 WeakPolarHBondContact O-CB 3.38Å
205	A	98.5	Very high	94.3	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.1	-43.8	179.3	0	0	0	0	0	112.8	I158 I163 L170 G201 T202 Q207 I208 A209 I227	I158-A205 HydrophobicContact CG1-CB 4.16Å; I163-A205 HydrophobicContact CG2-CB 4Å; L170-A205 HydrophobicContact CD1-CB 3.91Å; L170-A205 HydrophobicContact CD2-CB 4.2Å; G201-A205 PolarHBondContact O-N 3.48Å; T202-A205 PolarHBondContact O-N 2.83Å; A205-Q207 VanDerWaalsContact C-N 3.34Å; A205-Q207 PolarHBondContact O-N 3.44Å; A205-I208 PolarHBondContact O-N 2.95Å; A205-I208 VanDerWaalsContact O-N 3.08Å; A205-A209 PolarHBondContact O-N 2.85Å; A205-I227 HydrophobicContact CB-CG1 3.94Å
206	G	98.3	Very high	94.7	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-58.4	-40.4	179.1	0	0	0	0	0	114	T202 C204 I208 A210 I218 T359 T360	T202-G206 PolarHBondContact O-N 3.35Å; C204-G206 PolarHBondContact O-N 2.87Å; G206-I208 PolarHBondContact O-N 3.47Å; G206-A210 WeakPolarHBondContact O-CB 3.02Å; G206-A210 PolarHBondContact O-N 2.64Å; G206-A210 VanDerWaalsContact O-N 3.16Å; G206-I218 WeakPolarHBondContact O-CD1 3.3Å; G206-T359 WeakPolarHBondContact CA-OG1 3.37Å; G206-T360 VanDerWaalsContact CA-OG1 3.29Å; G206-T360 WeakPolarHBondContact CA-OG1 3.37Å
207	Q	98.2	Very high	95.4	Very high	3 Å²	3	28.1 Å²	28.1	1%	0.014	15%	0.15	C	C	.	.	H	α-helix	trans	-61.6	-28.1	178.3	-69.5	166.7	90.3	0	0	112.7	R203 C204 A205 I221 I357 T359 H370 A375 P378 M379	R203-Q207 PolarHBondContact O-NE2 3.33Å; C204-Q207 PolarHBondContact O-N 2.84Å; A205-Q207 VanDerWaalsContact C-N 3.34Å; A205-Q207 PolarHBondContact O-N 3.44Å; Q207-I221 PolarHBondContact O-N 3Å; Q207-I357 HydrophobicContact CG-CG2 4.02Å; Q207-T359 HydrophobicContact CG-CG2 4.45Å; Q207-T359 PolarHBondContact N-OG1 3.44Å; Q207-H370 PolarHBondContact NE2-CD2 3.44Å; Q207-H370 PolarHBondContact NE2-NE2 2.81Å; Q207-A375 PolarHBondContact OE1-O 3.24Å; Q207-P378 HydrophobicContact CB-CB 4.34Å; Q207-M379 HydrophobicContact CB-CG 4.33Å
208	I	98.6	Very high	96	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-88.1	-58.4	-178.9	-60.5	174.5	0	0	0	110.2	I156 I158 A205 G206 G220 I221 A222 I227 P378 A381	I156-I208 HydrophobicContact CD1-CG2 3.41Å; I156-I208 VanDerWaalsContact CD1-CG2 3.41Å; I156-I208 HydrophobicContact CG2-CD1 4.05Å; I156-I208 HydrophobicContact CG2-CG2 4.47Å; I158-I208 HydrophobicContact CD1-CD1 3.54Å; A205-I208 PolarHBondContact O-N 2.95Å; A205-I208 VanDerWaalsContact O-N 3.08Å; G206-I208 PolarHBondContact O-N 3.47Å; I208-G220 CarbonylContact O-C 3.58Å; I208-G220 WeakPolarHBondContact O-CA 3.39Å; I208-I221 PolarHBondContact O-N 3.36Å; I208-A222 HydrophobicContact CG2-CB 4.4Å; I208-A222 CarbonylContact O-C 3.56Å; I208-A222 VanDerWaalsContact O-CA 3.27Å; I208-A222 WeakPolarHBondContact O-CA 3.34Å; I208-A222 PolarHBondContact O-N 3.01Å; I208-I227 HydrophobicContact CB-CD1 4.43Å; I208-I227 HydrophobicContact CD1-CD1 4.22Å; I208-I227 HydrophobicContact CG2-CD1 4.3Å; I208-P378 HydrophobicContact CD1-CB 3.92Å; I208-P378 HydrophobicContact CG1-CB 3.89Å; I208-P378 WeakPolarHBondContact CG1-O 3.15Å; I208-A381 HydrophobicContact CD1-CB 4Å
209	A	98.3	Very high	96.2	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-134	25.3	-159.1	0	0	0	0	0	113.9	T173 A205 Q211 I227	T173-A209 WeakPolarHBondContact CB-O 3.26Å; T173-A209 HydrophobicContact CG2-CB 4.48Å; T173-A209 VanDerWaalsContact CG2-O 3.27Å; T173-A209 WeakPolarHBondContact CG2-O 3.41Å; T173-A209 PolarHBondContact OG1-O 3.06Å; A205-A209 PolarHBondContact O-N 2.85Å; A209-Q211 PolarHBondContact O-N 2.99Å; A209-I227 HydrophobicContact CB-CB 3.73Å; A209-I227 HydrophobicContact CB-CG1 4.3Å; A209-I227 HydrophobicContact CB-CG2 3.93Å
210	A	98.1	Very high	96.4	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.104	C	C	.	.			trans	-56.9	129.8	163.1	0	0	0	0	0	109.7	D169 G206 G212 I218 G220 H223	D169-A210 WeakPolarHBondContact O-CA 2.98Å; D169-A210 VanDerWaalsContact OD2-CB 3.29Å; D169-A210 WeakPolarHBondContact OD2-CB 3.2Å; G206-A210 WeakPolarHBondContact O-CB 3.02Å; G206-A210 PolarHBondContact O-N 2.64Å; G206-A210 VanDerWaalsContact O-N 3.16Å; A210-G212 VanDerWaalsContact C-N 3.26Å; A210-G212 PolarHBondContact O-N 2.69Å; A210-I218 HydrophobicContact CB-CD1 4.02Å; A210-I218 HydrophobicContact CB-CG1 3.83Å; A210-G220 PolarHBondContact O-N 3.48Å; A210-H223 WeakPolarHBondContact O-CA 3.37Å; A210-H223 WeakPolarHBondContact O-CB 3.24Å
211	Q	93.8	Very high	96.6	Very high	61 Å²	61	16.8 Å²	16.8	29%	0.285	9%	0.094	S	C	.	.	B	Isolated β-bridge	trans	-59.1	-36.4	-167.3	-178.7	-176.5	7.3	0	0	112.8	D169 V172 A209 N214	D169-Q211 PolarHBondContact O-N 3.11Å; D169-Q211 PolarHBondContact OD1-N 3.24Å; D169-Q211 VanDerWaalsContact OD1-N 3.14Å; V172-Q211 HydrophobicContact CB-CG 4.44Å; A209-Q211 PolarHBondContact O-N 2.99Å; Q211-N214 PolarHBondContact OE1-ND2 2.68Å
212	G	91.7	Very high	96.7	Very high	5 Å²	5	16.8 Å²	16.8	5%	0.052	9%	0.094	C	C	.	.			trans	65	160.1	-173.9	0	0	0	0	0	113.7	D119 A210 N214	D119-G212 WeakPolarHBondContact OD2-CA 3.18Å; A210-G212 VanDerWaalsContact C-N 3.26Å; A210-G212 PolarHBondContact O-N 2.69Å; G212-N214 PolarHBondContact O-N 3.28Å
213	N	91.5	Very high	96.6	Very high	98 Å²	98	17.5 Å²	17.5	52%	0.524	10%	0.097	S	C	.	.	S	Bend	trans	53.8	33.9	-179.5	-162.9	67.5	0	0	0	112.7	W117 D118 D119	W117-N213 HydrophobicContact CE3-CB 3.65Å; W117-N213 HydrophobicContact CZ3-CB 3.71Å; D118-N213 WeakPolarHBondContact OD1-CA 3.28Å; D119-N213 VanDerWaalsContact CG-N 3.34Å; D119-N213 PolarHBondContact OD1-N 3.03Å; D119-N213 VanDerWaalsContact OD1-N 3.1Å; D119-N213 PolarHBondContact OD2-N 2.91Å
214	N	93.7	Very high	96.6	Very high	41 Å²	41	19.7 Å²	19.7	22%	0.219	11%	0.111	C	C	.	.	S	Bend	trans	-121.1	10.3	177.7	66.4	3.8	0	0	0	111.4	D118 D119 D169 Q211 G212 V216	D118-N214 PolarHBondContact OD1-N 3.34Å; D119-N214 PolarHBondContact OD1-N 3.33Å; D119-N214 PolarHBondContact OD1-OD1 2.87Å; D119-N214 VanDerWaalsContact OD1-OD1 3.06Å; D169-N214 PolarHBondContact OD1-ND2 3.32Å; Q211-N214 PolarHBondContact OE1-ND2 2.68Å; G212-N214 PolarHBondContact O-N 3.28Å; N214-V216 PolarHBondContact O-N 3.04Å; N214-V216 WeakPolarHBondContact OD1-CB 3.26Å; N214-V216 PolarHBondContact OD1-N 3.29Å; N214-V216 PolarHBondContact OD1-O 3.31Å
215	S	95	Very high	96.6	Very high	74 Å²	74	19.8 Å²	19.8	52%	0.517	11%	0.112	S	C	.	.	S	Bend	trans	58	22.6	-174.6	-63.5	0	0	0	0	114.5	D118 P120	D118-S215 PolarHBondContact OD1-N 3.09Å; D118-S215 PolarHBondContact OD2-OG 3.5Å; P120-S215 WeakPolarHBondContact CD-O 3.32Å
216	V	95.2	Very high	96.6	Very high	38 Å²	38	23.3 Å²	23.3	23%	0.23	13%	0.128	C	C	.	.	S	Bend	trans	-118.2	136.6	179.6	-176.7	0	0	0	0	109.5	P168 D169 N214 I218	P168-V216 HydrophobicContact CB-CG1 4.35Å; P168-V216 HydrophobicContact CB-CG2 4.28Å; D169-V216 HydrophobicContact CB-CB 4.36Å; D169-V216 HydrophobicContact CB-CG1 3.91Å; N214-V216 PolarHBondContact O-N 3.04Å; N214-V216 WeakPolarHBondContact OD1-CB 3.26Å; N214-V216 PolarHBondContact OD1-N 3.29Å; N214-V216 PolarHBondContact OD1-O 3.31Å; V216-I218 PolarHBondContact O-N 2.7Å
217	C	96.8	Very high	96.6	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.007	13%	0.128	C	C	.	.	S	Bend	trans	37.7	-94.1	174.2	-56.4	0	0	0	0	116.4	L121 T360 C366	L121-C217 WeakPolarHBondContact CA-O 3.49Å; L121-C217 WeakPolarHBondContact CB-O 3.48Å; L121-C217 WeakPolarHBondContact CG-O 3.47Å; L121-C217 PolarHBondContact N-O 3.27Å; C217-T360 HydrophobicContact CB-CG2 4.35Å; C217-C366 WeakPolarHBondContact CA-SG 3.38Å; C217-C366 HydrophobicContact CB-CB 3.8Å; C217-C366 WeakPolarHBondContact CB-SG 3.49Å; C217-C366 WeakPolarHBondContact SG-CB 3.41Å; C217-C366 CovalentContact SG-SG 2.03Å; C217-C366 PolarHBondContact SG-SG 3.22Å
218	I	97.1	Very high	96.6	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.127	C	C	.	.			trans	-141.4	176.5	-167.2	57.3	146.9	0	0	0	111.8	L121 M125 D169 G206 A210 V216	L121-I218 HydrophobicContact CB-CG2 3.71Å; L121-I218 HydrophobicContact CD1-CG2 4.32Å; M125-I218 HydrophobicContact CE-CB 4.15Å; M125-I218 HydrophobicContact CE-CD1 4.26Å; M125-I218 HydrophobicContact CE-CG2 4.46Å; M125-I218 HydrophobicContact CG-CG2 4.19Å; M125-I218 HydrophobicContact SD-CB 3.71Å; M125-I218 HydrophobicContact SD-CG2 3.82Å; D169-I218 PolarHBondContact OD2-N 3.39Å; D169-I218 VanDerWaalsContact OD2-O 3.1Å; G206-I218 WeakPolarHBondContact O-CD1 3.3Å; A210-I218 HydrophobicContact CB-CD1 4.02Å; A210-I218 HydrophobicContact CB-CG1 3.83Å; V216-I218 PolarHBondContact O-N 2.7Å
219	V	97	Very high	96.6	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.127	C	C	.	.	B	Isolated β-bridge	trans	-108.5	134.3	164	56	0	0	0	0	110	W117 Y122 M125 W145 H223	W117-V219 HydrophobicContact CB-CG1 4.42Å; W117-V219 HydrophobicContact CD2-CB 3.91Å; W117-V219 HydrophobicContact CD2-CG1 3.89Å; W117-V219 HydrophobicContact CD2-CG2 3.85Å; W117-V219 HydrophobicContact CE3-CB 4.05Å; W117-V219 HydrophobicContact CE3-CG2 3.87Å; W117-V219 HydrophobicContact CG-CB 4.24Å; W117-V219 HydrophobicContact CG-CG1 3.79Å; W117-V219 HydrophobicContact CH2-CG2 3.79Å; W117-V219 HydrophobicContact CZ2-CG2 3.73Å; W117-V219 HydrophobicContact CZ3-CB 4.5Å; W117-V219 HydrophobicContact CZ3-CG2 3.85Å; Y122-V219 HydrophobicContact CD2-CG1 3.79Å; Y122-V219 HydrophobicContact CE2-CG1 4.2Å; M125-V219 WeakPolarHBondContact CE-O 3.41Å; M125-V219 HydrophobicContact SD-CG1 4.15Å; W145-V219 HydrophobicContact CH2-CG1 3.85Å; W145-V219 HydrophobicContact CH2-CG2 4.11Å; W145-V219 HydrophobicContact CZ2-CG2 4.26Å; V219-H223 HydrophobicContact CG2-CB 3.73Å
220	G	97.8	Very high	96.5	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.127	C	C	.	.			trans	-74.3	152.5	175.9	0	0	0	0	0	112.1	W145 I208 A210 A222 H223	W145-G220 WeakPolarHBondContact CZ2-O 3.37Å; I208-G220 CarbonylContact O-C 3.58Å; I208-G220 WeakPolarHBondContact O-CA 3.39Å; A210-G220 PolarHBondContact O-N 3.48Å; G220-A222 PolarHBondContact O-N 2.83Å; G220-H223 WeakPolarHBondContact O-CB 3.21Å; G220-H223 PolarHBondContact O-N 3.47Å
221	I	98.3	Very high	96.3	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.005	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-40.9	176.5	-69.5	-179.9	0	0	0	111.2	L128 M139 V141 W145 Q207 I208 M379 I383 L386	L128-I221 HydrophobicContact CD2-CD1 4.11Å; L128-I221 HydrophobicContact CD2-CG1 3.88Å; M139-I221 HydrophobicContact CE-CD1 3.97Å; V141-I221 HydrophobicContact CG1-CG2 4.04Å; V141-I221 HydrophobicContact CG2-CD1 4.44Å; V141-I221 HydrophobicContact CG2-CG1 4.41Å; V141-I221 HydrophobicContact CG2-CG2 4.06Å; W145-I221 PolarHBondContact NE1-O 3.35Å; Q207-I221 PolarHBondContact O-N 3Å; I208-I221 PolarHBondContact O-N 3.36Å; I221-M379 HydrophobicContact CD1-CB 3.79Å; I221-M379 HydrophobicContact CD1-CG 3.77Å; I221-I383 HydrophobicContact CD1-CG1 4.33Å; I221-I383 HydrophobicContact CG2-CG1 3.99Å; I221-L386 HydrophobicContact CG2-CD1 3.86Å; I221-L386 HydrophobicContact CG2-CG 4.37Å
222	A	98.3	Very high	96.2	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.4	57.5	176.9	0	0	0	0	0	109.9	T150 I208 G220 N224 A225 A385 L386	T150-A222 CarbonylContact O-C 3.54Å; T150-A222 VanDerWaalsContact O-CA 3.25Å; T150-A222 WeakPolarHBondContact O-CA 3.43Å; I208-A222 HydrophobicContact CG2-CB 4.4Å; I208-A222 CarbonylContact O-C 3.56Å; I208-A222 VanDerWaalsContact O-CA 3.27Å; I208-A222 WeakPolarHBondContact O-CA 3.34Å; I208-A222 PolarHBondContact O-N 3.01Å; G220-A222 PolarHBondContact O-N 2.83Å; A222-N224 PolarHBondContact O-N 3.06Å; A222-A225 HydrophobicContact CB-CB 3.94Å; A222-A225 WeakPolarHBondContact O-CB 3.35Å; A222-A225 PolarHBondContact O-N 3.48Å; A222-A385 HydrophobicContact CB-CB 3.78Å; A222-L386 HydrophobicContact CB-CD2 4.23Å
223	H	97.1	Very high	96	Very high	14 Å²	14	24.9 Å²	24.9	7%	0.065	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-15.2	-173.1	58.8	-91.1	0	0	0	116.3	W117 W145 T150 T173 A210 V219 G220	W117-H223 AromaticContact CH2-CD2 3.85Å; W117-H223 AromaticContact CH2-CE1 3.66Å; W117-H223 AromaticContact CH2-ND1 3.96Å; W117-H223 AromaticContact CH2-NE2 3.61Å; W117-H223 AromaticContact CZ2-CE1 3.78Å; W145-H223 AromaticContact CE2-CE1 3.96Å; W145-H223 AromaticContact CE2-ND1 3.79Å; W145-H223 AromaticContact CZ2-ND1 3.93Å; W145-H223 AromaticContact NE1-CE1 3.8Å; W145-H223 AromaticContact NE1-ND1 3.74Å; T150-H223 WeakPolarHBondContact CB-NE2 3.41Å; T150-H223 VanDerWaalsContact CG2-CE1 3.45Å; T150-H223 WeakPolarHBondContact CG2-CE1 3.5Å; T150-H223 WeakPolarHBondContact CG2-NE2 3.4Å; T150-H223 PolarHBondContact O-N 3.29Å; T173-H223 WeakPolarHBondContact CG2-O 3.11Å; A210-H223 WeakPolarHBondContact O-CA 3.37Å; A210-H223 WeakPolarHBondContact O-CB 3.24Å; V219-H223 HydrophobicContact CG2-CB 3.73Å; G220-H223 WeakPolarHBondContact O-CB 3.21Å; G220-H223 PolarHBondContact O-N 3.47Å
224	N	97.4	Very high	95.6	Very high	78 Å²	78	21.5 Å²	21.5	42%	0.417	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.4	7.9	173	-73.3	-36	0	0	0	113.8	T150 K152 A222	T150-N224 WeakPolarHBondContact CB-ND2 3.37Å; T150-N224 PolarHBondContact O-N 3.2Å; T150-N224 WeakPolarHBondContact OG1-CB 3.25Å; T150-N224 PolarHBondContact OG1-ND2 3.09Å; K152-N224 WeakPolarHBondContact CA-O 3.05Å; K152-N224 HydrophobicContact CB-CB 4.21Å; A222-N224 PolarHBondContact O-N 3.06Å
225	A	98.5	Very high	94.8	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.008	13%	0.128	C	C	.	.	S	Bend	trans	-71.6	159.9	171.3	0	0	0	0	0	111.5	G151 I156 T173 A222	G151-A225 VanDerWaalsContact O-CA 3.22Å; G151-A225 WeakPolarHBondContact O-CA 3.44Å; G151-A225 WeakPolarHBondContact O-CB 3.3Å; I156-A225 HydrophobicContact CD1-CB 3.72Å; T173-A225 WeakPolarHBondContact CB-O 3Å; A222-A225 HydrophobicContact CB-CB 3.94Å; A222-A225 WeakPolarHBondContact O-CB 3.35Å; A222-A225 PolarHBondContact O-N 3.48Å
226	Q	98.6	Very high	93.8	Very high	74 Å²	74	27.8 Å²	27.8	35%	0.346	14%	0.141	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	122.2	174	-77.2	173.8	-29.9	0	0	108.8	I154 K155 I156 T173 D175	I154-Q226 PolarHBondContact O-N 3.37Å; K155-Q226 HydrophobicContact CG-CB 4.23Å; I156-Q226 PolarHBondContact N-O 3.49Å; T173-Q226 CarbonylContact O-C 3.06Å; T173-Q226 WeakPolarHBondContact O-CA 3.44Å; D175-Q226 HydrophobicContact CB-CB 4.01Å
227	I	98.5	Very high	93	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	125.4	-173.4	-165.9	65.2	0	0	0	111.2	I156 I158 L170 T173 Y174 D175 A205 I208 A209	I156-I227 HydrophobicContact CB-CD1 3.94Å; I156-I227 HydrophobicContact CG2-CD1 3.97Å; I156-I227 CarbonylContact O-C 3.37Å; I156-I227 WeakPolarHBondContact O-CA 3.18Å; I158-I227 HydrophobicContact CD1-CD1 4.35Å; I158-I227 HydrophobicContact CG1-CD1 4.01Å; L170-I227 HydrophobicContact CD2-CG2 4.41Å; T173-I227 PolarHBondContact O-N 2.85Å; Y174-I227 CarbonylContact C-O 3.52Å; Y174-I227 WeakPolarHBondContact CA-O 3.22Å; D175-I227 PolarHBondContact N-O 2.81Å; A205-I227 HydrophobicContact CB-CG1 3.94Å; I208-I227 HydrophobicContact CB-CD1 4.43Å; I208-I227 HydrophobicContact CD1-CD1 4.22Å; I208-I227 HydrophobicContact CG2-CD1 4.3Å; A209-I227 HydrophobicContact CB-CB 3.73Å; A209-I227 HydrophobicContact CB-CG1 4.3Å; A209-I227 HydrophobicContact CB-CG2 3.93Å
228	G	98.1	Very high	92	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	168.9	170.5	0	0	0	0	0	112.2	I156 T157 I158 A178 S179	I156-G228 PolarHBondContact O-N 3.5Å; T157-G228 WeakPolarHBondContact CA-O 3.39Å; T157-G228 PolarHBondContact OG1-O 3.44Å; I158-G228 PolarHBondContact N-O 2.94Å; A178-G228 WeakPolarHBondContact O-CA 3.25Å; S179-G228 WeakPolarHBondContact OG-CA 3.46Å
229	G	97.6	Very high	91.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	134	173.4	0	0	0	0	0	110.9	S179 I180 P189	S179-G229 CarbonylContact C-O 3.6Å; S179-G229 WeakPolarHBondContact CA-O 3.34Å; S179-G229 WeakPolarHBondContact CB-O 3.21Å; S179-G229 PolarHBondContact OG-N 3.17Å; I180-G229 PolarHBondContact N-O 2.76Å; P189-G229 WeakPolarHBondContact CB-O 3.34Å
230	I	97.2	Very high	90.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	108.4	168.2	-59.3	174.8	0	0	0	106.9	T157 I158 M159 D160 I180 I182 M232 T245 F248 Y256	T157-I230 HydrophobicContact CG2-CD1 3.8Å; T157-I230 HydrophobicContact CG2-CG1 4.3Å; I158-I230 PolarHBondContact O-N 3.37Å; M159-I230 HydrophobicContact CG-CD1 4.36Å; D160-I230 PolarHBondContact N-O 3.29Å; I180-I230 HydrophobicContact CG2-CB 4.38Å; I180-I230 HydrophobicContact CG2-CG1 3.95Å; I180-I230 HydrophobicContact CG2-CG2 3.97Å; I180-I230 WeakPolarHBondContact O-CA 3.47Å; I182-I230 HydrophobicContact CD1-CG2 3.55Å; I182-I230 HydrophobicContact CG1-CG2 4.11Å; I230-M232 HydrophobicContact CG2-CB 4.48Å; I230-M232 PolarHBondContact O-N 2.98Å; I230-T245 HydrophobicContact CB-CG2 4.26Å; I230-T245 HydrophobicContact CD1-CG2 3.94Å; I230-T245 HydrophobicContact CG2-CG2 3.81Å; I230-F248 HydrophobicContact CD1-CB 4.08Å; I230-F248 HydrophobicContact CD1-CD1 3.86Å; I230-F248 HydrophobicContact CD1-CG 4.33Å; I230-F248 HydrophobicContact CG1-CD1 4.25Å; I230-Y256 HydrophobicContact CD1-CE1 4.47Å
231	R	94.1	Very high	89.4	Confident	45 Å²	45	39.5 Å²	39.5	17%	0.17	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	101.6	176.2	179.7	166.2	173.1	-132.3	-8.7	108.5	D161 I180 D181 I182 M190 D234	D161-R231 WeakPolarHBondContact O-CG 3.33Å; I180-R231 PolarHBondContact O-N 3.1Å; D181-R231 HydrophobicContact CB-CB 4.23Å; D181-R231 IonicContact OD2-CZ 2.67Å; D181-R231 IonicContact OD2-NE 3.52Å; D181-R231 IonicContact OD2-NH1 2.81Å; D181-R231 PolarHBondContact OD2-NH1 3Å; I182-R231 PolarHBondContact N-O 3.06Å; I182-R231 VanDerWaalsContact N-O 3.11Å; M190-R231 VanDerWaalsContact O-CD 3.28Å; M190-R231 WeakPolarHBondContact O-CD 3.33Å; M190-R231 PolarHBondContact O-NE 3.43Å; M190-R231 PolarHBondContact O-NH1 3.23Å; R231-D234 HydrophobicContact CG-CB 4.03Å; R231-D234 IonicContact CZ-OD2 2.7Å; R231-D234 IonicContact NE-OD2 3.53Å; R231-D234 PolarHBondContact NE-OD2 2.8Å; R231-D234 IonicContact NH2-OD2 2.83Å; R231-D234 PolarHBondContact NH2-OD2 2.98Å
232	M	90.6	Very high	88.8	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.2	C	C	.	.			trans	-127.2	-27.1	177.8	70.5	158	-71.1	0	0	113.3	D160 N183 I230 I237 V241 E242 T245 W260	D160-M232 PolarHBondContact O-N 2.87Å; N183-M232 PolarHBondContact ND2-O 3.35Å; N183-M232 PolarHBondContact OD1-O 2.77Å; I230-M232 HydrophobicContact CG2-CB 4.48Å; I230-M232 PolarHBondContact O-N 2.98Å; M232-I237 HydrophobicContact CE-CD1 3.9Å; M232-I237 HydrophobicContact CE-CG2 3.83Å; M232-I237 WeakPolarHBondContact O-CD1 3.41Å; M232-V241 HydrophobicContact CB-CG1 3.95Å; M232-V241 HydrophobicContact CE-CG1 4.12Å; M232-E242 HydrophobicContact CE-CG 3.97Å; M232-T245 HydrophobicContact SD-CG2 3.73Å; M232-T245 PolarHBondContact SD-OG1 3.36Å; M232-T245 VanDerWaalsContact SD-OG1 3.39Å; M232-W260 HydrophobicContact CE-CH2 4.35Å; M232-W260 HydrophobicContact CE-CZ2 4.06Å; M232-W260 HydrophobicContact SD-CZ2 3.84Å
233	L	87.4	Confident	88	Confident	57 Å²	57	41 Å²	41	30%	0.298	21%	0.206	S	C	.	.	S	Bend	trans	-86	-8.6	-178	-60.7	-177.7	0	0	0	114.5	D160 D161 G235 I237 W260	D160-L233 PolarHBondContact O-N 3.17Å; D161-L233 HydrophobicContact CB-CB 4.44Å; L233-G235 VanDerWaalsContact C-N 3.26Å; L233-G235 PolarHBondContact O-N 3.22Å; L233-I237 HydrophobicContact CD2-CD1 3.98Å; L233-I237 HydrophobicContact CD2-CG1 4.33Å; L233-W260 HydrophobicContact CD1-CB 3.82Å; L233-W260 HydrophobicContact CD1-CG 3.84Å; L233-W260 HydrophobicContact CD2-CD2 4.45Å; L233-W260 HydrophobicContact CD2-CG 4.3Å
234	D	82.8	Confident	87.4	Confident	27 Å²	27	44.2 Å²	44.2	14%	0.144	22%	0.221	C	C	.	.	S	Bend	trans	-90.1	57.7	175.1	-170.2	12.9	0	0	0	110.6	N183 N192 N198 R231	N183-D234 PolarHBondContact ND2-O 2.88Å; N183-D234 VanDerWaalsContact ND2-O 3.1Å; N192-D234 VanDerWaalsContact CB-OD2 3.24Å; N192-D234 WeakPolarHBondContact CB-OD2 3.45Å; N192-D234 PolarHBondContact N-OD2 3.19Å; N192-D234 VanDerWaalsContact N-OD2 3.14Å; N198-D234 PolarHBondContact ND2-OD1 2.9Å; N198-D234 PolarHBondContact ND2-OD2 3.47Å; R231-D234 HydrophobicContact CG-CB 4.03Å; R231-D234 IonicContact CZ-OD2 2.7Å; R231-D234 IonicContact NE-OD2 3.53Å; R231-D234 PolarHBondContact NE-OD2 2.8Å; R231-D234 IonicContact NH2-OD2 2.83Å; R231-D234 PolarHBondContact NH2-OD2 2.98Å
235	G	76.6	Confident	87.1	Confident	46 Å²	46	40.5 Å²	40.5	47%	0.474	20%	0.201	S	C	.	.	S	Bend	trans	162.6	-170.1	-174	0	0	0	0	0	114.1	N183 L233	N183-G235 VanDerWaalsContact ND2-CA 3.34Å; N183-G235 WeakPolarHBondContact ND2-CA 3.4Å; N183-G235 PolarHBondContact ND2-N 3.27Å; L233-G235 VanDerWaalsContact C-N 3.26Å; L233-G235 PolarHBondContact O-N 3.22Å
236	Y	75.4	Confident	86.7	Confident	202 Å²	202	40.5 Å²	40.5	79%	0.792	20%	0.201	S	C	*	.			trans	-77.7	128.8	178.9	-69.7	-75.2	0	0	0	111.8
237	I	78	Confident	86.2	Confident	68 Å²	68	41 Å²	41	35%	0.349	20%	0.203	S	C	.	.			trans	-95.1	139.5	179.2	-44.2	-55	0	0	0	110.9	M232 L233 E242	M232-I237 HydrophobicContact CE-CD1 3.9Å; M232-I237 HydrophobicContact CE-CG2 3.83Å; M232-I237 WeakPolarHBondContact O-CD1 3.41Å; L233-I237 HydrophobicContact CD2-CD1 3.98Å; L233-I237 HydrophobicContact CD2-CG1 4.33Å; I237-E242 HydrophobicContact CG2-CG 3.78Å
238	T	76.7	Confident	85.9	Confident	70 Å²	70	42.8 Å²	42.8	43%	0.429	21%	0.211	S	C	.	.			trans	-144.8	161.2	173.4	61.1	0	0	0	0	108.9	R240 V241 E242	T238-R240 PolarHBondContact O-N 2.72Å; T238-V241 WeakPolarHBondContact O-CA 3.32Å; T238-V241 WeakPolarHBondContact O-CB 3.49Å; T238-V241 PolarHBondContact O-N 2.76Å; T238-V241 PolarHBondContact OG1-N 2.8Å; T238-E242 PolarHBondContact O-N 3.38Å
239	D	78.5	Confident	85.5	Confident	42 Å²	42	46.6 Å²	46.6	23%	0.225	23%	0.225	C	C	.	.	H	α-helix	trans	-53	-31.8	175.2	-175.7	31.7	0	0	0	112.5	A243 G273 I274 L275 A276	D239-A243 WeakPolarHBondContact O-CB 3.46Å; D239-A243 PolarHBondContact O-N 3.31Å; D239-G273 VanDerWaalsContact CG-CA 3.43Å; D239-G273 WeakPolarHBondContact OD1-CA 3.4Å; D239-G273 PolarHBondContact OD1-N 2.96Å; D239-I274 PolarHBondContact OD2-N 2.69Å; D239-I274 VanDerWaalsContact OD2-N 3.16Å; D239-L275 PolarHBondContact OD1-N 3.28Å; D239-L275 WeakPolarHBondContact OD2-CB 3.4Å; D239-L275 PolarHBondContact OD2-N 2.85Å; D239-A276 WeakPolarHBondContact OD1-CB 3.17Å; D239-A276 PolarHBondContact OD1-N 2.96Å
240	R	79.2	Confident	85	Confident	102 Å²	102	47 Å²	47	39%	0.385	23%	0.227	S	C	.	.	H	α-helix	trans	-63.1	-47.7	172.7	-178.3	-170.9	69.5	85.1	5.1	111.9	T238 A243 E244	T238-R240 PolarHBondContact O-N 2.72Å; R240-A243 PolarHBondContact O-N 2.86Å; R240-E244 HydrophobicContact CG-CG 4.45Å; R240-E244 WeakPolarHBondContact CG-OE1 3.33Å; R240-E244 IonicContact CZ-OE1 2.93Å; R240-E244 IonicContact CZ-OE2 3.3Å; R240-E244 IonicContact NH1-OE1 3.73Å; R240-E244 PolarHBondContact NH1-OE1 3.18Å; R240-E244 IonicContact NH1-OE2 2.84Å; R240-E244 PolarHBondContact NH1-OE2 3.02Å; R240-E244 WeakPolarHBondContact O-CB 3.38Å; R240-E244 WeakPolarHBondContact O-CG 3.4Å; R240-E244 PolarHBondContact O-N 3.33Å
241	V	78.6	Confident	84.4	Confident	3 Å²	3	52 Å²	52	2%	0.018	25%	0.254	C	S	.	.	H	α-helix	trans	-64.2	-46	-178.3	169.6	0	0	0	0	109.7	I182 M232 T238 A243 E244 T245	I182-V241 HydrophobicContact CG2-CB 4.33Å; I182-V241 HydrophobicContact CG2-CG1 3.86Å; I182-V241 HydrophobicContact CG2-CG2 4.2Å; M232-V241 HydrophobicContact CB-CG1 3.95Å; M232-V241 HydrophobicContact CE-CG1 4.12Å; T238-V241 WeakPolarHBondContact O-CA 3.32Å; T238-V241 WeakPolarHBondContact O-CB 3.49Å; T238-V241 PolarHBondContact O-N 2.76Å; T238-V241 PolarHBondContact OG1-N 2.8Å; V241-A243 PolarHBondContact O-N 3.4Å; V241-E244 PolarHBondContact O-N 3.35Å; V241-T245 WeakPolarHBondContact O-CB 3.16Å; V241-T245 PolarHBondContact O-N 3.26Å; V241-T245 PolarHBondContact O-OG1 3.2Å
242	E	86.1	Confident	84.3	Confident	17 Å²	17	52.2 Å²	52.2	8%	0.079	26%	0.255	C	S	.	.	H	α-helix	trans	-60.7	-45.3	175.9	-67.7	170.2	160.5	0	0	112	M232 I237 T238 T245 L246 W260 A276 Y314	M232-E242 HydrophobicContact CE-CG 3.97Å; I237-E242 HydrophobicContact CG2-CG 3.78Å; T238-E242 PolarHBondContact O-N 3.38Å; E242-T245 WeakPolarHBondContact O-CB 3.49Å; E242-T245 PolarHBondContact O-N 3.09Å; E242-L246 WeakPolarHBondContact O-CB 3.48Å; E242-L246 VanDerWaalsContact O-CG 3.26Å; E242-L246 WeakPolarHBondContact O-CG 3.36Å; E242-L246 PolarHBondContact O-N 3.38Å; E242-W260 HydrophobicContact CG-CH2 4.08Å; E242-A276 HydrophobicContact CB-CB 4.04Å; E242-Y314 PolarHBondContact OE1-OH 2.86Å; E242-Y314 PolarHBondContact OE2-OH 3.06Å
243	A	80.9	Confident	84.6	Confident	14 Å²	14	52.2 Å²	52.2	12%	0.116	26%	0.255	C	S	.	.	H	α-helix	trans	-64.3	-43.9	178	0	0	0	0	0	112.7	D239 R240 V241 T245 L246 H247 L275 A279	D239-A243 WeakPolarHBondContact O-CB 3.46Å; D239-A243 PolarHBondContact O-N 3.31Å; R240-A243 PolarHBondContact O-N 2.86Å; V241-A243 PolarHBondContact O-N 3.4Å; A243-T245 VanDerWaalsContact C-N 3.31Å; A243-T245 PolarHBondContact O-N 3.42Å; A243-L246 PolarHBondContact O-N 2.78Å; A243-H247 WeakPolarHBondContact O-CB 3.22Å; A243-H247 PolarHBondContact O-N 3.06Å; A243-L275 VanDerWaalsContact CB-C 3.49Å; A243-L275 HydrophobicContact CB-CB 3.48Å; A243-L275 VanDerWaalsContact CB-CB 3.48Å; A243-A279 HydrophobicContact CB-CB 4.42Å
244	E	84.9	Confident	85.2	Confident	82 Å²	82	50.7 Å²	50.7	38%	0.383	25%	0.247	S	C	.	.	H	α-helix	trans	-61	-41.4	175.1	-77.3	175	-166	0	0	110.9	I182 R240 V241 H247 F248	I182-E244 HydrophobicContact CD1-CB 4.12Å; R240-E244 HydrophobicContact CG-CG 4.45Å; R240-E244 WeakPolarHBondContact CG-OE1 3.33Å; R240-E244 IonicContact CZ-OE1 2.93Å; R240-E244 IonicContact CZ-OE2 3.3Å; R240-E244 IonicContact NH1-OE1 3.73Å; R240-E244 PolarHBondContact NH1-OE1 3.18Å; R240-E244 IonicContact NH1-OE2 2.84Å; R240-E244 PolarHBondContact NH1-OE2 3.02Å; R240-E244 WeakPolarHBondContact O-CB 3.38Å; R240-E244 WeakPolarHBondContact O-CG 3.4Å; R240-E244 PolarHBondContact O-N 3.33Å; V241-E244 PolarHBondContact O-N 3.35Å; E244-H247 PolarHBondContact O-N 3.29Å; E244-F248 WeakPolarHBondContact O-CB 3.36Å; E244-F248 PolarHBondContact O-N 2.87Å
245	T	91.4	Very high	85.9	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-60.2	-53.2	174.3	-64.8	0	0	0	0	111.9	M159 I182 I230 M232 V241 E242 A243 H247 F248	M159-T245 HydrophobicContact CB-CG2 3.76Å; M159-T245 HydrophobicContact CG-CG2 3.45Å; M159-T245 VanDerWaalsContact CG-CG2 3.45Å; M159-T245 HydrophobicContact SD-CG2 3.6Å; M159-T245 VanDerWaalsContact SD-CG2 3.6Å; I182-T245 VanDerWaalsContact CD1-OG1 3.23Å; I182-T245 WeakPolarHBondContact CD1-OG1 3.21Å; I230-T245 HydrophobicContact CB-CG2 4.26Å; I230-T245 HydrophobicContact CD1-CG2 3.94Å; I230-T245 HydrophobicContact CG2-CG2 3.81Å; M232-T245 HydrophobicContact SD-CG2 3.73Å; M232-T245 PolarHBondContact SD-OG1 3.36Å; M232-T245 VanDerWaalsContact SD-OG1 3.39Å; V241-T245 WeakPolarHBondContact O-CB 3.16Å; V241-T245 PolarHBondContact O-N 3.26Å; V241-T245 PolarHBondContact O-OG1 3.2Å; E242-T245 WeakPolarHBondContact O-CB 3.49Å; E242-T245 PolarHBondContact O-N 3.09Å; A243-T245 VanDerWaalsContact C-N 3.31Å; A243-T245 PolarHBondContact O-N 3.42Å; T245-H247 PolarHBondContact O-N 3.23Å; T245-F248 PolarHBondContact O-N 3.33Å
246	L	90.1	Very high	87	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-68.5	-23.2	-176.7	-68.5	167.9	0	0	0	113	M159 E242 A243 Q250 A276 A279 F280 Y295 W297	M159-L246 HydrophobicContact CE-CD2 4.38Å; M159-L246 HydrophobicContact SD-CD2 3.88Å; E242-L246 WeakPolarHBondContact O-CB 3.48Å; E242-L246 VanDerWaalsContact O-CG 3.26Å; E242-L246 WeakPolarHBondContact O-CG 3.36Å; E242-L246 PolarHBondContact O-N 3.38Å; A243-L246 PolarHBondContact O-N 2.78Å; L246-Q250 PolarHBondContact O-NE2 3.3Å; L246-A276 HydrophobicContact CD1-CB 3.98Å; L246-A279 HydrophobicContact CB-CB 3.66Å; L246-A279 HydrophobicContact CD1-CB 4.45Å; L246-F280 HydrophobicContact CD1-CD2 3.97Å; L246-F280 HydrophobicContact CD1-CE1 4.25Å; L246-F280 HydrophobicContact CD1-CE2 3.64Å; L246-F280 HydrophobicContact CD1-CG 4.41Å; L246-F280 HydrophobicContact CD1-CZ 3.79Å; L246-F280 HydrophobicContact CD2-CD1 4.28Å; L246-F280 HydrophobicContact CD2-CE1 3.65Å; L246-F280 HydrophobicContact CD2-CE2 4.45Å; L246-F280 HydrophobicContact CD2-CZ 3.76Å; L246-F280 HydrophobicContact CG-CZ 4.45Å; L246-Y295 HydrophobicContact CB-CE1 4.44Å; L246-Y295 HydrophobicContact CD2-CD1 3.84Å; L246-Y295 HydrophobicContact CD2-CE1 3.6Å; L246-Y295 PolarHBondContact O-OH 2.69Å; L246-W297 HydrophobicContact CD2-CH2 4.31Å; L246-W297 HydrophobicContact CD2-CZ3 4.07Å
247	H	87.6	Confident	88.1	Confident	85 Å²	85	37.7 Å²	37.7	39%	0.394	18%	0.18	S	C	.	.	H	α-helix	trans	-94.9	-15.3	178.2	-172.1	64.2	0	0	0	114.2	A243 E244 T245 R249 Q250 A279 Q282	A243-H247 WeakPolarHBondContact O-CB 3.22Å; A243-H247 PolarHBondContact O-N 3.06Å; E244-H247 PolarHBondContact O-N 3.29Å; T245-H247 PolarHBondContact O-N 3.23Å; H247-R249 PolarHBondContact O-N 2.64Å; H247-Q250 PolarHBondContact CE1-OE1 3.38Å; H247-Q250 VanDerWaalsContact ND1-CD 3.32Å; H247-Q250 PolarHBondContact ND1-OE1 2.89Å; H247-Q250 WeakPolarHBondContact O-CG 3.33Å; H247-A279 HydrophobicContact CB-CB 4.31Å; H247-Q282 PolarHBondContact CE1-NE2 3.41Å
248	F	92.8	Very high	88.9	Confident	38 Å²	38	34.4 Å²	34.4	17%	0.167	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	113.1	-175.1	178.2	-106.1	0	0	0	111.4	I180 I230 E244 T245 Q250 I253 Y256	I180-F248 HydrophobicContact CB-CD2 4.39Å; I180-F248 HydrophobicContact CB-CE1 4.22Å; I180-F248 HydrophobicContact CB-CE2 3.86Å; I180-F248 HydrophobicContact CB-CZ 3.76Å; I180-F248 HydrophobicContact CD1-CD2 4.02Å; I180-F248 HydrophobicContact CD1-CE2 3.66Å; I180-F248 HydrophobicContact CD1-CZ 4.41Å; I180-F248 HydrophobicContact CG1-CE2 4.35Å; I180-F248 HydrophobicContact CG2-CD1 3.87Å; I180-F248 HydrophobicContact CG2-CD2 3.83Å; I180-F248 HydrophobicContact CG2-CE1 3.82Å; I180-F248 HydrophobicContact CG2-CE2 3.79Å; I180-F248 HydrophobicContact CG2-CG 3.86Å; I180-F248 HydrophobicContact CG2-CZ 3.77Å; I230-F248 HydrophobicContact CD1-CB 4.08Å; I230-F248 HydrophobicContact CD1-CD1 3.86Å; I230-F248 HydrophobicContact CD1-CG 4.33Å; I230-F248 HydrophobicContact CG1-CD1 4.25Å; E244-F248 WeakPolarHBondContact O-CB 3.36Å; E244-F248 PolarHBondContact O-N 2.87Å; T245-F248 PolarHBondContact O-N 3.33Å; F248-Q250 PolarHBondContact O-N 3.11Å; F248-I253 HydrophobicContact CD1-CD1 3.83Å; F248-I253 HydrophobicContact CE1-CD1 4.2Å; F248-I253 WeakPolarHBondContact O-CD1 3.29Å; F248-Y256 PolarHBondContact O-OH 2.94Å
249	R	89.4	Confident	89.8	Confident	80 Å²	80	31.5 Å²	31.5	30%	0.302	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	41.8	171.8	-61.3	-65.5	-58.7	-63.9	-8.6	114.5	K177 H247 D251 Y252 I253	K177-R249 PolarHBondContact O-NH1 3.39Å; H247-R249 PolarHBondContact O-N 2.64Å; R249-D251 IonicContact NE-OD1 2.75Å; R249-D251 PolarHBondContact O-N 3.28Å; R249-D251 VanDerWaalsContact O-N 3.07Å; R249-Y252 VanDerWaalsContact NH2-CB 3.25Å; R249-Y252 PolarHBondContact O-N 3.05Å; R249-I253 HydrophobicContact CB-CD1 4.08Å; R249-I253 HydrophobicContact CB-CG1 4.18Å; R249-I253 PolarHBondContact O-N 3.49Å
250	Q	87.2	Confident	90.5	Very high	8 Å²	8	31.1 Å²	31.1	4%	0.037	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-26.7	175.7	-74.1	179.6	-22.6	0	0	114.3	L246 H247 F248 Y252 Y256 A279 G287 R288 N293 Y295	L246-Q250 PolarHBondContact O-NE2 3.3Å; H247-Q250 PolarHBondContact CE1-OE1 3.38Å; H247-Q250 VanDerWaalsContact ND1-CD 3.32Å; H247-Q250 PolarHBondContact ND1-OE1 2.89Å; H247-Q250 WeakPolarHBondContact O-CG 3.33Å; F248-Q250 PolarHBondContact O-N 3.11Å; Q250-Y252 VanDerWaalsContact C-N 3.33Å; Q250-Y256 WeakPolarHBondContact CA-OH 3.44Å; Q250-Y256 PolarHBondContact N-OH 3.39Å; Q250-A279 PolarHBondContact NE2-O 2.84Å; Q250-A279 VanDerWaalsContact NE2-O 3.09Å; Q250-G287 WeakPolarHBondContact O-CA 3.37Å; Q250-R288 PolarHBondContact O-N 2.79Å; Q250-N293 VanDerWaalsContact CB-OD1 3.23Å; Q250-N293 WeakPolarHBondContact CB-OD1 3.32Å; Q250-N293 VanDerWaalsContact CG-OD1 3.25Å; Q250-N293 WeakPolarHBondContact CG-OD1 3.47Å; Q250-N293 PolarHBondContact O-ND2 3.46Å; Q250-Y295 PolarHBondContact NE2-OH 3.2Å
251	D	83.5	Confident	91.1	Very high	104 Å²	104	28 Å²	28	56%	0.556	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-23.5	176.4	67.4	-59	0	0	0	113.7	R249	R249-D251 IonicContact NE-OD1 2.75Å; R249-D251 PolarHBondContact O-N 3.28Å; R249-D251 VanDerWaalsContact O-N 3.07Å
252	Y	93.5	Very high	91.4	Very high	51 Å²	51	28.6 Å²	28.6	20%	0.2	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	-41.8	-170.1	-179.3	-102.2	0	0	0	113.4	K155 D175 K177 A178 R249 Q250	K155-Y252 HydrophobicContact CB-CE1 4.44Å; K155-Y252 HydrophobicContact CG-CE1 3.95Å; D175-Y252 WeakPolarHBondContact OD2-CE1 3.39Å; D175-Y252 VanDerWaalsContact OD2-CZ 3.23Å; D175-Y252 PolarHBondContact OD2-OH 2.81Å; K177-Y252 HydrophobicContact CB-CD1 4.15Å; K177-Y252 HydrophobicContact CB-CE1 3.51Å; K177-Y252 HydrophobicContact CD-CE2 4.31Å; A178-Y252 HydrophobicContact CB-CE1 4.24Å; R249-Y252 VanDerWaalsContact NH2-CB 3.25Å; R249-Y252 PolarHBondContact O-N 3.05Å; Q250-Y252 VanDerWaalsContact C-N 3.33Å
253	I	97.1	Very high	91	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.174	C	C	.	.			trans	-81.1	131.9	-179.7	-60.2	175.3	0	0	0	109	T157 A178 F248 R249 I255 Y256 N293	T157-I253 HydrophobicContact CG2-CD1 3.89Å; T157-I253 HydrophobicContact CG2-CG2 3.93Å; A178-I253 HydrophobicContact CB-CD1 4.16Å; A178-I253 HydrophobicContact CB-CG1 3.99Å; F248-I253 HydrophobicContact CD1-CD1 3.83Å; F248-I253 HydrophobicContact CE1-CD1 4.2Å; F248-I253 WeakPolarHBondContact O-CD1 3.29Å; R249-I253 HydrophobicContact CB-CD1 4.08Å; R249-I253 HydrophobicContact CB-CG1 4.18Å; R249-I253 PolarHBondContact O-N 3.49Å; I253-I255 WeakPolarHBondContact CG2-O 3.42Å; I253-Y256 HydrophobicContact CB-CE2 3.86Å; I253-Y256 HydrophobicContact CD1-CE1 4.11Å; I253-Y256 HydrophobicContact CG2-CD1 4.5Å; I253-Y256 HydrophobicContact CG2-CD2 3.93Å; I253-Y256 HydrophobicContact CG2-CE1 4.2Å; I253-Y256 HydrophobicContact CG2-CE2 3.56Å; I253-Y256 HydrophobicContact CG2-CG 4.37Å; I253-N293 PolarHBondContact O-ND2 2.85Å
254	D	98.2	Very high	91.2	Very high	25 Å²	25	36.5 Å²	36.5	13%	0.134	18%	0.181	C	C	.	.			trans	-87.3	-47.2	178.7	-63.4	-70.2	0	0	0	111.7	I154 K155 R288 I294 L388	I154-D254 HydrophobicContact CG2-CB 3.89Å; K155-D254 PolarHBondContact N-OD2 3.27Å; K155-D254 WeakPolarHBondContact O-CA 3.48Å; K155-D254 WeakPolarHBondContact O-CB 3.49Å; K155-D254 PolarHBondContact O-N 2.84Å; D254-R288 HydrophobicContact CB-CG 4.36Å; D254-R288 WeakPolarHBondContact O-CD 3.41Å; D254-R288 IonicContact OD1-NE 3.55Å; D254-R288 PolarHBondContact OD1-NE 2.77Å; D254-I294 PolarHBondContact O-N 3.36Å; D254-I294 VanDerWaalsContact O-N 3.07Å; D254-L388 HydrophobicContact CB-CD1 4Å
255	I	98.8	Very high	90.9	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	130.9	-171.5	-49.8	173.2	0	0	0	110.1	I154 K155 I156 T157 I253 I294 V296 A381 I384 A385 L388	I154-I255 HydrophobicContact CG2-CD1 4.05Å; I154-I255 HydrophobicContact CG2-CG1 4.43Å; K155-I255 PolarHBondContact O-N 3Å; I156-I255 CarbonylContact C-O 3.58Å; I156-I255 WeakPolarHBondContact CA-O 3.47Å; I156-I255 HydrophobicContact CD1-CD1 4.49Å; I156-I255 HydrophobicContact CG1-CB 4.22Å; I156-I255 HydrophobicContact CG1-CD1 4.19Å; I156-I255 HydrophobicContact CG1-CG1 4.5Å; I156-I255 HydrophobicContact CG2-CB 4.15Å; I156-I255 HydrophobicContact CG2-CG2 4.42Å; T157-I255 PolarHBondContact N-O 3.34Å; I253-I255 WeakPolarHBondContact CG2-O 3.42Å; I255-I294 CarbonylContact C-O 3.57Å; I255-I294 WeakPolarHBondContact CA-O 3.21Å; I255-I294 HydrophobicContact CG1-CB 4.4Å; I255-I294 HydrophobicContact CG1-CD1 4.44Å; I255-I294 HydrophobicContact CG2-CB 4.5Å; I255-V296 HydrophobicContact CG2-CG2 3.84Å; I255-A381 HydrophobicContact CG2-CB 3.94Å; I255-I384 HydrophobicContact CD1-CB 4.02Å; I255-I384 HydrophobicContact CD1-CG2 3.63Å; I255-I384 HydrophobicContact CG1-CG2 4.29Å; I255-A385 HydrophobicContact CD1-CB 4.01Å; I255-L388 HydrophobicContact CD1-CD1 4.1Å; I255-L388 HydrophobicContact CG1-CD1 4.03Å
256	Y	98.6	Very high	90.6	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	123.8	172	-66.8	-104.4	0	0	0	108.1	T157 M159 I230 F248 Q250 I253 N293 I294 Y295 V296	T157-Y256 HydrophobicContact CG2-CD1 3.41Å; T157-Y256 VanDerWaalsContact CG2-CD1 3.41Å; T157-Y256 HydrophobicContact CG2-CE1 3.78Å; T157-Y256 HydrophobicContact CG2-CG 4.03Å; M159-Y256 HydrophobicContact CG-CD1 4.34Å; M159-Y256 HydrophobicContact SD-CD1 3.78Å; M159-Y256 HydrophobicContact SD-CG 4.29Å; I230-Y256 HydrophobicContact CD1-CE1 4.47Å; F248-Y256 PolarHBondContact O-OH 2.94Å; Q250-Y256 WeakPolarHBondContact CA-OH 3.44Å; Q250-Y256 PolarHBondContact N-OH 3.39Å; I253-Y256 HydrophobicContact CB-CE2 3.86Å; I253-Y256 HydrophobicContact CD1-CE1 4.11Å; I253-Y256 HydrophobicContact CG2-CD1 4.5Å; I253-Y256 HydrophobicContact CG2-CD2 3.93Å; I253-Y256 HydrophobicContact CG2-CE1 4.2Å; I253-Y256 HydrophobicContact CG2-CE2 3.56Å; I253-Y256 HydrophobicContact CG2-CG 4.37Å; Y256-N293 HydrophobicContact CD2-CB 3.97Å; Y256-N293 HydrophobicContact CE2-CB 3.79Å; Y256-I294 PolarHBondContact N-O 3.39Å; Y256-Y295 HydrophobicContact CD1-CE1 4.3Å; Y256-Y295 HydrophobicContact CD2-CD1 4.27Å; Y256-Y295 AromaticContact CD2-CE1 3.86Å; Y256-Y295 HydrophobicContact CD2-CE1 3.86Å; Y256-Y295 HydrophobicContact CE2-CE1 4.48Å; Y256-Y295 HydrophobicContact CG-CD1 4.03Å; Y256-Y295 AromaticContact CG-CE1 3.77Å; Y256-Y295 HydrophobicContact CG-CE1 3.77Å; Y256-Y295 WeakPolarHBondContact O-CA 3.42Å; Y256-V296 PolarHBondContact O-N 2.98Å
257	S	98.5	Very high	90.1	Very high	1 Å²	1	39 Å²	39	1%	0.007	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	117.8	178.4	-172.7	0	0	0	0	110	T157 M159	T157-S257 PolarHBondContact O-N 3.16Å; M159-S257 PolarHBondContact N-O 3.07Å
258	G	96.3	Very high	89.7	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	117.3	176.4	0	0	0	0	0	111	V296 W297 A298	G258-V296 PolarHBondContact N-O 2.92Å; G258-W297 WeakPolarHBondContact O-CA 3.46Å; G258-A298 PolarHBondContact O-N 3.48Å
259	S	95.3	Very high	89	Confident	8 Å²	8	38 Å²	38	6%	0.056	19%	0.19	C	C	.	.			trans	-109.8	35.3	179.9	-71	0	0	0	0	111.9	H200 S374 P378	H200-S259 PolarHBondContact CE1-O 3.06Å; S259-S374 PolarHBondContact O-OG 3.44Å; S259-S374 PolarHBondContact OG-O 3.45Å; S259-P378 WeakPolarHBondContact OG-CD 3.34Å
260	W	92.9	Very high	88.5	Confident	35 Å²	35	38.2 Å²	38.2	13%	0.133	19%	0.194	C	C	.	.			trans	-142	164.2	-176.5	56.2	-95	0	0	0	110.3	M159 M232 L233 E242 W297 Y314	M159-W260 PolarHBondContact O-NE1 3.17Å; M232-W260 HydrophobicContact CE-CH2 4.35Å; M232-W260 HydrophobicContact CE-CZ2 4.06Å; M232-W260 HydrophobicContact SD-CZ2 3.84Å; L233-W260 HydrophobicContact CD1-CB 3.82Å; L233-W260 HydrophobicContact CD1-CG 3.84Å; L233-W260 HydrophobicContact CD2-CD2 4.45Å; L233-W260 HydrophobicContact CD2-CG 4.3Å; E242-W260 HydrophobicContact CG-CH2 4.08Å; W260-W297 AromaticContact CD2-CZ2 3.94Å; W260-W297 HydrophobicContact CD2-CZ2 3.94Å; W260-W297 AromaticContact CE2-CH2 3.98Å; W260-W297 AromaticContact CE2-CZ2 3.68Å; W260-W297 HydrophobicContact CE3-CZ2 4.01Å; W260-W297 AromaticContact CH2-CH2 3.82Å; W260-W297 HydrophobicContact CH2-CH2 3.82Å; W260-W297 AromaticContact CH2-CZ2 3.63Å; W260-W297 HydrophobicContact CH2-CZ2 3.63Å; W260-W297 AromaticContact CZ2-CH2 3.52Å; W260-W297 HydrophobicContact CZ2-CH2 3.52Å; W260-W297 AromaticContact CZ2-CZ2 3.54Å; W260-W297 HydrophobicContact CZ2-CZ2 3.54Å; W260-W297 AromaticContact CZ3-CZ2 3.86Å; W260-W297 HydrophobicContact CZ3-CZ2 3.86Å; W260-W297 PolarHBondContact O-NE1 3.07Å; W260-Y314 HydrophobicContact CH2-CD1 4.3Å; W260-Y314 AromaticContact CH2-CE1 3.91Å; W260-Y314 HydrophobicContact CH2-CE1 3.91Å; W260-Y314 HydrophobicContact CZ3-CD1 4.36Å; W260-Y314 HydrophobicContact CZ3-CD2 4.33Å; W260-Y314 HydrophobicContact CZ3-CE1 4.03Å; W260-Y314 AromaticContact CZ3-CE2 3.98Å; W260-Y314 HydrophobicContact CZ3-CE2 3.98Å; W260-Y314 AromaticContact CZ3-CZ 3.82Å
261	G	91.3	Very high	88.4	Confident	35 Å²	35	38.9 Å²	38.9	36%	0.361	20%	0.203	S	C	.	.			trans	-167.4	-167.5	177.4	0	0	0	0	0	109.7
262	P	84.3	Confident	88.3	Confident	16 Å²	16	34.6 Å²	34.6	10%	0.104	18%	0.181	C	C	.	.	S	Bend	trans	-55.5	167.1	170.1	-24.4	36.1	0	0	0	112.8	D264 L268 E270 D312	P262-D264 PolarHBondContact O-N 3Å; P262-L268 HydrophobicContact CB-CD2 3.87Å; P262-L268 HydrophobicContact CB-CG 4.4Å; P262-E270 HydrophobicContact CB-CB 3.89Å; P262-E270 HydrophobicContact CG-CB 3.7Å; P262-E270 HydrophobicContact CG-CG 4.19Å; P262-E270 WeakPolarHBondContact CG-O 3.01Å; P262-D312 WeakPolarHBondContact CD-OD1 3.48Å; P262-D312 HydrophobicContact CG-CB 4.26Å
263	E	77.6	Confident	87.2	Confident	148 Å²	148	33.2 Å²	33.2	69%	0.692	18%	0.183	S	C	*	.			trans	-63.9	118.8	171.6	-170.7	-178	-179.7	0	0	111.3	S265 L268	E263-S265 PolarHBondContact O-N 2.82Å; E263-S265 PolarHBondContact O-OG 3.47Å; E263-L268 HydrophobicContact CB-CD2 3.91Å
264	D	85.1	Confident	85.6	Confident	49 Å²	49	38 Å²	38	26%	0.262	21%	0.207	S	C	.	.			trans	-68.8	45.5	178.5	-70.5	-20.7	0	0	0	113.3	P262 G266 N301 G302 L305 D307	P262-D264 PolarHBondContact O-N 3Å; D264-G266 VanDerWaalsContact C-N 3.31Å; D264-G266 PolarHBondContact O-N 3.42Å; D264-N301 WeakPolarHBondContact OD2-CA 3.34Å; D264-N301 WeakPolarHBondContact OD2-CB 3.45Å; D264-N301 PolarHBondContact OD2-N 3.29Å; D264-G302 PolarHBondContact OD2-N 3.28Å; D264-L305 WeakPolarHBondContact O-CD1 3.24Å; D264-D307 VanDerWaalsContact C-OD2 3.23Å; D264-D307 WeakPolarHBondContact CA-OD2 3.41Å
265	S	79.7	Confident	84	Confident	26 Å²	26	41.1 Å²	41.1	18%	0.182	22%	0.223	C	C	.	.	S	Bend	trans	-79.5	-8.1	-171.8	58	0	0	0	0	114.3	E263 K267 L268 D307	E263-S265 PolarHBondContact O-N 2.82Å; E263-S265 PolarHBondContact O-OG 3.47Å; S265-K267 PolarHBondContact O-N 2.96Å; S265-K267 PolarHBondContact OG-N 2.93Å; S265-L268 PolarHBondContact OG-N 3.38Å; S265-D307 PolarHBondContact N-OD2 2.93Å
266	G	84.5	Confident	83	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.223	C	C	.	.	S	Bend	trans	71.1	6.9	-167.6	0	0	0	0	0	113.8	D264 D307 R545 D548	D264-G266 VanDerWaalsContact C-N 3.31Å; D264-G266 PolarHBondContact O-N 3.42Å; G266-D307 VanDerWaalsContact CA-OD2 3.31Å; G266-D307 WeakPolarHBondContact CA-OD2 3.42Å; G266-D307 PolarHBondContact N-OD2 3.42Å; G266-R545 PolarHBondContact O-NE 2.88Å; G266-D548 WeakPolarHBondContact O-CB 3.36Å; G266-D548 PolarHBondContact O-N 3.46Å
267	K	80.7	Confident	81.8	Confident	109 Å²	109	45.6 Å²	45.6	47%	0.474	24%	0.244	S	C	.	.	S	Bend	trans	-127	-37.2	-175.5	-57.7	179.8	-172.9	178.9	0	114.2	S265 H547	S265-K267 PolarHBondContact O-N 2.96Å; S265-K267 PolarHBondContact OG-N 2.93Å; K267-H547 WeakPolarHBondContact CE-O 3.11Å; K267-H547 VanDerWaalsContact CG-O 3.27Å; K267-H547 WeakPolarHBondContact CG-O 3.36Å
268	L	77.4	Confident	80.5	Confident	62 Å²	62	48.2 Å²	48.2	33%	0.325	26%	0.263	S	S	.	.			trans	-74.4	145.8	-171.6	-173.4	60.9	0	0	0	111.6	P262 E263 S265 E270 R545	P262-L268 HydrophobicContact CB-CD2 3.87Å; P262-L268 HydrophobicContact CB-CG 4.4Å; E263-L268 HydrophobicContact CB-CD2 3.91Å; S265-L268 PolarHBondContact OG-N 3.38Å; L268-E270 HydrophobicContact CD2-CB 4.43Å; L268-E270 HydrophobicContact CG-CB 4.25Å; L268-R545 PolarHBondContact O-NH1 2.81Å; L268-R545 PolarHBondContact O-NH2 2.73Å
269	Y	78.2	Confident	79.7	Confident	40 Å²	40	48.5 Å²	48.5	16%	0.157	27%	0.265	C	S	.	.			trans	-126.9	117	164.7	-72.3	-110	0	0	0	106.6	C311 L542 R545 W559	Y269-C311 WeakPolarHBondContact CA-O 3.2Å; Y269-C311 HydrophobicContact CD1-CB 3.56Å; Y269-C311 HydrophobicContact CD2-CB 4.44Å; Y269-C311 HydrophobicContact CE1-CB 3.69Å; Y269-C311 WeakPolarHBondContact CE1-SG 3.28Å; Y269-C311 HydrophobicContact CG-CB 3.97Å; Y269-L542 WeakPolarHBondContact OH-CD2 3.48Å; Y269-R545 VanDerWaalsContact CD2-NH1 3.31Å; Y269-W559 HydrophobicContact CD1-CD2 4.17Å; Y269-W559 AromaticContact CD1-CE2 3.91Å; Y269-W559 HydrophobicContact CD1-CG 4.38Å; Y269-W559 HydrophobicContact CD1-CZ2 4.35Å; Y269-W559 AromaticContact CD1-NE1 3.92Å
270	E	80.7	Confident	79.1	Confident	85 Å²	85	48.2 Å²	48.2	40%	0.397	26%	0.262	S	S	.	.	B	Isolated β-bridge	trans	-149	146.5	-179.1	175.6	176.8	-176.5	0	0	109.4	P262 L268 C311 G313 W559	P262-E270 HydrophobicContact CB-CB 3.89Å; P262-E270 HydrophobicContact CG-CB 3.7Å; P262-E270 HydrophobicContact CG-CG 4.19Å; P262-E270 WeakPolarHBondContact CG-O 3.01Å; L268-E270 HydrophobicContact CD2-CB 4.43Å; L268-E270 HydrophobicContact CG-CB 4.25Å; E270-C311 PolarHBondContact N-O 2.91Å; E270-G313 PolarHBondContact O-N 2.95Å; E270-W559 WeakPolarHBondContact O-CH2 3.34Å
271	G	84.5	Confident	78.4	Confident	22 Å²	22	50.2 Å²	50.2	23%	0.227	27%	0.273	C	S	.	.			trans	-150.2	177.3	-179.7	0	0	0	0	0	110.4	G273	G271-G273 PolarHBondContact O-N 3.31Å
272	P	80.5	Confident	77.6	Confident	14 Å²	14	51 Å²	51	9%	0.091	27%	0.268	C	S	.	.			trans	-55.4	137.1	-178.3	21.7	-32.5	0	0	0	111.2	A276 Q277 F280 G313 Y314	P272-A276 HydrophobicContact CB-CB 3.62Å; P272-Q277 HydrophobicContact CB-CG 3.89Å; P272-Q277 HydrophobicContact CG-CG 3.71Å; P272-Q277 PolarHBondContact O-NE2 3.17Å; P272-F280 HydrophobicContact CB-CD2 4.4Å; P272-F280 HydrophobicContact CB-CE2 4.15Å; P272-F280 HydrophobicContact CG-CD2 4.38Å; P272-F280 HydrophobicContact CG-CE2 4.18Å; P272-G313 VanDerWaalsContact CD-C 3.49Å; P272-Y314 WeakPolarHBondContact CA-OH 3.5Å; P272-Y314 HydrophobicContact CB-CD1 4.17Å; P272-Y314 HydrophobicContact CB-CE1 3.62Å; P272-Y314 HydrophobicContact CG-CD1 4.33Å; P272-Y314 HydrophobicContact CG-CE1 4.23Å
273	G	71.9	Confident	77.7	Confident	23 Å²	23	50.3 Å²	50.3	24%	0.237	26%	0.263	C	S	.	.			trans	-66.1	180	168.4	0	0	0	0	0	112	D239 G271 L275 A276 Q277	D239-G273 VanDerWaalsContact CG-CA 3.43Å; D239-G273 WeakPolarHBondContact OD1-CA 3.4Å; D239-G273 PolarHBondContact OD1-N 2.96Å; G271-G273 PolarHBondContact O-N 3.31Å; G273-L275 VanDerWaalsContact C-N 3.27Å; G273-L275 PolarHBondContact O-N 3.22Å; G273-A276 PolarHBondContact O-N 2.92Å; G273-Q277 WeakPolarHBondContact O-CB 3.36Å; G273-Q277 VanDerWaalsContact O-CG 3.26Å; G273-Q277 WeakPolarHBondContact O-CG 3.5Å; G273-Q277 PolarHBondContact O-N 3.19Å
274	I	63.8	Low	78	Confident	99 Å²	99	43.6 Å²	43.6	51%	0.508	23%	0.232	S	C	.	.	H	α-helix	trans	-65.3	-33.1	-173.2	59.7	169.9	0	0	0	112.1	D239 S278	D239-I274 PolarHBondContact OD2-N 2.69Å; D239-I274 VanDerWaalsContact OD2-N 3.16Å; I274-S278 WeakPolarHBondContact O-CB 3.49Å; I274-S278 PolarHBondContact O-N 3.14Å; I274-S278 VanDerWaalsContact O-N 3.1Å
275	L	64.5	Low	77.6	Confident	91 Å²	91	42.3 Å²	42.3	48%	0.476	23%	0.226	S	C	.	.	H	α-helix	trans	-73.8	-44.7	178.8	-59.9	178.1	0	0	0	109.9	D239 A243 G273 S278 A279	D239-L275 PolarHBondContact OD1-N 3.28Å; D239-L275 WeakPolarHBondContact OD2-CB 3.4Å; D239-L275 PolarHBondContact OD2-N 2.85Å; A243-L275 VanDerWaalsContact CB-C 3.49Å; A243-L275 HydrophobicContact CB-CB 3.48Å; A243-L275 VanDerWaalsContact CB-CB 3.48Å; G273-L275 VanDerWaalsContact C-N 3.27Å; G273-L275 PolarHBondContact O-N 3.22Å; L275-S278 WeakPolarHBondContact O-CB 3.27Å; L275-S278 PolarHBondContact O-N 3.41Å; L275-A279 PolarHBondContact O-N 2.86Å
276	A	77.4	Confident	77.4	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-63.8	-40	176.3	0	0	0	0	0	112.3	D239 E242 L246 P272 G273 S278 A279 F280	D239-A276 WeakPolarHBondContact OD1-CB 3.17Å; D239-A276 PolarHBondContact OD1-N 2.96Å; E242-A276 HydrophobicContact CB-CB 4.04Å; L246-A276 HydrophobicContact CD1-CB 3.98Å; P272-A276 HydrophobicContact CB-CB 3.62Å; G273-A276 PolarHBondContact O-N 2.92Å; A276-S278 VanDerWaalsContact C-N 3.35Å; A276-S278 PolarHBondContact O-N 2.85Å; A276-A279 WeakPolarHBondContact O-CB 3.16Å; A276-A279 PolarHBondContact O-N 3.07Å; A276-F280 WeakPolarHBondContact O-CD2 3.23Å; A276-F280 PolarHBondContact O-N 3.03Å
277	Q	73.9	Confident	77.3	Confident	95 Å²	95	42.8 Å²	42.8	44%	0.444	23%	0.228	S	C	.	.	H	α-helix	trans	-59.6	-44.6	172.6	-75.8	176.7	40.8	0	0	111.8	P272 G273 A279 F280 Q281	P272-Q277 HydrophobicContact CB-CG 3.89Å; P272-Q277 HydrophobicContact CG-CG 3.71Å; P272-Q277 PolarHBondContact O-NE2 3.17Å; G273-Q277 WeakPolarHBondContact O-CB 3.36Å; G273-Q277 VanDerWaalsContact O-CG 3.26Å; G273-Q277 WeakPolarHBondContact O-CG 3.5Å; G273-Q277 PolarHBondContact O-N 3.19Å; Q277-A279 VanDerWaalsContact C-N 3.32Å; Q277-F280 PolarHBondContact O-N 2.56Å; Q277-Q281 WeakPolarHBondContact O-CG 3.38Å; Q277-Q281 PolarHBondContact O-N 2.03Å; Q277-Q281 VanDerWaalsContact O-N 3.09Å
278	S	70.4	Confident	77.7	Confident	56 Å²	56	38.1 Å²	38.1	39%	0.392	21%	0.207	S	C	.	.	H	α-helix	trans	-62.4	-40.9	175.5	-172.6	0	0	0	0	111.4	I274 L275 A276 F280 Q281 Q282	I274-S278 WeakPolarHBondContact O-CB 3.49Å; I274-S278 PolarHBondContact O-N 3.14Å; I274-S278 VanDerWaalsContact O-N 3.1Å; L275-S278 WeakPolarHBondContact O-CB 3.27Å; L275-S278 PolarHBondContact O-N 3.41Å; A276-S278 VanDerWaalsContact C-N 3.35Å; A276-S278 PolarHBondContact O-N 2.85Å; S278-F280 PolarHBondContact O-N 3.43Å; S278-Q281 PolarHBondContact O-N 3.14Å; S278-Q282 WeakPolarHBondContact O-CB 3.46Å; S278-Q282 PolarHBondContact O-N 3.16Å
279	A	79.3	Confident	77.8	Confident	5 Å²	5	45.4 Å²	45.4	4%	0.041	23%	0.23	C	C	.	.	H	α-helix	trans	-62.2	-42.7	177.5	0	0	0	0	0	112.2	A243 L246 H247 Q250 L275 A276 Q277 Q282 G283	A243-A279 HydrophobicContact CB-CB 4.42Å; L246-A279 HydrophobicContact CB-CB 3.66Å; L246-A279 HydrophobicContact CD1-CB 4.45Å; H247-A279 HydrophobicContact CB-CB 4.31Å; Q250-A279 PolarHBondContact NE2-O 2.84Å; Q250-A279 VanDerWaalsContact NE2-O 3.09Å; L275-A279 PolarHBondContact O-N 2.86Å; A276-A279 WeakPolarHBondContact O-CB 3.16Å; A276-A279 PolarHBondContact O-N 3.07Å; Q277-A279 VanDerWaalsContact C-N 3.32Å; A279-Q282 PolarHBondContact O-N 3.22Å; A279-G283 PolarHBondContact O-N 3.46Å
280	F	83.3	Confident	77.7	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.009	23%	0.23	C	C	.	.	H	α-helix	trans	-58.6	-51.7	171.9	-81.2	-60.8	0	0	0	111.9	L246 P272 A276 Q277 S278 Q282 G283 V284 Y295 W297 Y314 F319 T320	L246-F280 HydrophobicContact CD1-CD2 3.97Å; L246-F280 HydrophobicContact CD1-CE1 4.25Å; L246-F280 HydrophobicContact CD1-CE2 3.64Å; L246-F280 HydrophobicContact CD1-CG 4.41Å; L246-F280 HydrophobicContact CD1-CZ 3.79Å; L246-F280 HydrophobicContact CD2-CD1 4.28Å; L246-F280 HydrophobicContact CD2-CE1 3.65Å; L246-F280 HydrophobicContact CD2-CE2 4.45Å; L246-F280 HydrophobicContact CD2-CZ 3.76Å; L246-F280 HydrophobicContact CG-CZ 4.45Å; P272-F280 HydrophobicContact CB-CD2 4.4Å; P272-F280 HydrophobicContact CB-CE2 4.15Å; P272-F280 HydrophobicContact CG-CD2 4.38Å; P272-F280 HydrophobicContact CG-CE2 4.18Å; A276-F280 WeakPolarHBondContact O-CD2 3.23Å; A276-F280 PolarHBondContact O-N 3.03Å; Q277-F280 PolarHBondContact O-N 2.56Å; S278-F280 PolarHBondContact O-N 3.43Å; F280-Q282 VanDerWaalsContact C-N 3.32Å; F280-Q282 PolarHBondContact O-N 2.79Å; F280-G283 PolarHBondContact O-N 2.93Å; F280-V284 WeakPolarHBondContact O-CG2 3.5Å; F280-V284 PolarHBondContact O-N 2.9Å; F280-Y295 HydrophobicContact CD1-CD1 4.03Å; F280-Y295 AromaticContact CD1-CD2 3.74Å; F280-Y295 HydrophobicContact CD1-CD2 3.74Å; F280-Y295 HydrophobicContact CD1-CE1 4.2Å; F280-Y295 AromaticContact CD1-CE2 3.9Å; F280-Y295 HydrophobicContact CD1-CE2 3.9Å; F280-Y295 AromaticContact CD1-CG 3.81Å; F280-Y295 HydrophobicContact CD1-CG 3.81Å; F280-Y295 AromaticContact CE1-CD1 3.72Å; F280-Y295 HydrophobicContact CE1-CD1 3.72Å; F280-Y295 HydrophobicContact CE1-CD2 4.11Å; F280-Y295 HydrophobicContact CE1-CE1 4.2Å; F280-Y295 AromaticContact CE1-CG 3.67Å; F280-Y295 HydrophobicContact CE1-CG 3.67Å; F280-W297 HydrophobicContact CE1-CZ3 4.06Å; F280-W297 HydrophobicContact CZ-CE3 4.33Å; F280-W297 HydrophobicContact CZ-CH2 4.12Å; F280-W297 AromaticContact CZ-CZ3 3.74Å; F280-W297 HydrophobicContact CZ-CZ3 3.74Å; F280-Y314 AromaticContact CE2-CD1 3.88Å; F280-Y314 HydrophobicContact CE2-CD1 3.88Å; F280-Y314 HydrophobicContact CE2-CE1 4.35Å; F280-Y314 HydrophobicContact CZ-CD1 4.06Å; F280-F319 HydrophobicContact CB-CB 4.45Å; F280-F319 HydrophobicContact CB-CD2 4.18Å; F280-T320 HydrophobicContact CD1-CG2 4.24Å; F280-T320 HydrophobicContact CE1-CG2 3.57Å; F280-T320 HydrophobicContact CZ-CG2 3.91Å
281	Q	77.1	Confident	77.9	Confident	78 Å²	78	42.6 Å²	42.6	36%	0.364	22%	0.222	S	C	.	.	H	α-helix	trans	-59.3	-44.5	-179	-72.4	176.7	-4	0	0	111.5	Q277 S278 V284 V285 F319	Q277-Q281 WeakPolarHBondContact O-CG 3.38Å; Q277-Q281 PolarHBondContact O-N 2.03Å; Q277-Q281 VanDerWaalsContact O-N 3.09Å; S278-Q281 PolarHBondContact O-N 3.14Å; Q281-V284 WeakPolarHBondContact O-CG2 3.36Å; Q281-V285 WeakPolarHBondContact O-CB 3.48Å; Q281-V285 WeakPolarHBondContact O-CG2 3.2Å; Q281-V285 PolarHBondContact O-N 2.87Å; Q281-F319 HydrophobicContact CG-CD2 4.41Å; Q281-F319 HydrophobicContact CG-CE2 3.66Å; Q281-F319 HydrophobicContact CG-CZ 4.07Å
282	Q	75.7	Confident	78	Confident	52 Å²	52	41.6 Å²	41.6	24%	0.243	21%	0.211	C	C	.	.	H	α-helix	trans	-67.3	-38.6	177.1	-172.2	174.3	-5.8	0	0	111.9	H247 S278 A279 F280 V285 T286	H247-Q282 PolarHBondContact CE1-NE2 3.41Å; S278-Q282 WeakPolarHBondContact O-CB 3.46Å; S278-Q282 PolarHBondContact O-N 3.16Å; A279-Q282 PolarHBondContact O-N 3.22Å; F280-Q282 VanDerWaalsContact C-N 3.32Å; F280-Q282 PolarHBondContact O-N 2.79Å; Q282-V285 PolarHBondContact O-N 3.4Å; Q282-T286 HydrophobicContact CG-CG2 3.93Å; Q282-T286 WeakPolarHBondContact O-CB 3.4Å; Q282-T286 PolarHBondContact O-N 3.13Å; Q282-T286 PolarHBondContact O-OG1 3.35Å
283	G	84.8	Confident	78.8	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-66.2	-44	179.7	0	0	0	0	0	113	A279 F280 V285 G287 G292 N293	A279-G283 PolarHBondContact O-N 3.46Å; F280-G283 PolarHBondContact O-N 2.93Å; G283-V285 PolarHBondContact O-N 2.94Å; G283-G287 WeakPolarHBondContact O-CA 3.12Å; G283-G287 PolarHBondContact O-N 3.45Å; G283-G292 CarbonylContact O-C 3.53Å; G283-G292 WeakPolarHBondContact O-CA 3.33Å; G283-N293 WeakPolarHBondContact CA-OD1 3.39Å; G283-N293 PolarHBondContact O-N 2.85Å; G283-N293 PolarHBondContact O-OD1 2.93Å
284	V	85.6	Confident	80	Confident	8 Å²	8	40.1 Å²	40.1	5%	0.048	20%	0.197	C	C	.	.	H	α-helix	trans	-72.7	-16	177.6	-60.5	0	0	0	0	113.9	F280 Q281 G292 Y295 F319 W396	F280-V284 WeakPolarHBondContact O-CG2 3.5Å; F280-V284 PolarHBondContact O-N 2.9Å; Q281-V284 WeakPolarHBondContact O-CG2 3.36Å; V284-G292 VanDerWaalsContact O-CA 3.24Å; V284-G292 WeakPolarHBondContact O-CA 3.32Å; V284-Y295 HydrophobicContact CG1-CD2 4.08Å; V284-Y295 HydrophobicContact CG1-CE2 4.05Å; V284-F319 HydrophobicContact CB-CD1 4.43Å; V284-F319 HydrophobicContact CG1-CB 3.76Å; V284-F319 HydrophobicContact CG1-CD1 4.22Å; V284-F319 HydrophobicContact CG1-CG 4.22Å; V284-F319 HydrophobicContact CG2-CD1 3.7Å; V284-F319 HydrophobicContact CG2-CE1 4.05Å; V284-F319 HydrophobicContact CG2-CG 4.16Å; V284-W396 HydrophobicContact CB-CD2 4.27Å; V284-W396 HydrophobicContact CB-CG 4.24Å; V284-W396 HydrophobicContact CB-CZ2 4.49Å; V284-W396 HydrophobicContact CG1-CD2 4.31Å; V284-W396 HydrophobicContact CG1-CG 4.37Å; V284-W396 VanDerWaalsContact O-CD1 3.25Å; V284-W396 PolarHBondContact O-NE1 3.44Å
285	V	76.6	Confident	81.7	Confident	21 Å²	21	35.5 Å²	35.5	13%	0.127	17%	0.173	C	C	.	.	H	α-helix	trans	-95	-56.6	177.8	172.3	0	0	0	0	111.3	Q281 Q282 G283 G290 D664 Q679	Q281-V285 WeakPolarHBondContact O-CB 3.48Å; Q281-V285 WeakPolarHBondContact O-CG2 3.2Å; Q281-V285 PolarHBondContact O-N 2.87Å; Q282-V285 PolarHBondContact O-N 3.4Å; G283-V285 PolarHBondContact O-N 2.94Å; V285-G290 WeakPolarHBondContact O-CA 3.47Å; V285-D664 HydrophobicContact CG1-CB 4.13Å; V285-D664 WeakPolarHBondContact CG1-OD1 3.4Å; V285-Q679 HydrophobicContact CG1-CG 4.2Å
286	T	74.4	Confident	83.3	Confident	36 Å²	36	31.1 Å²	31.1	22%	0.221	15%	0.15	C	C	.	.	H	α-helix	trans	-93.8	-24.1	-169.7	70.4	0	0	0	0	112.9	Q282 G290 D664	Q282-T286 HydrophobicContact CG-CG2 3.93Å; Q282-T286 WeakPolarHBondContact O-CB 3.4Å; Q282-T286 PolarHBondContact O-N 3.13Å; Q282-T286 PolarHBondContact O-OG1 3.35Å; T286-G290 PolarHBondContact O-N 3.13Å; T286-D664 WeakPolarHBondContact CG2-OD2 3.44Å
287	G	83.6	Confident	84.3	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-58.9	153.4	-176	0	0	0	0	0	113.4	Q250 G283 R289 G290 F291 G292 N293	Q250-G287 WeakPolarHBondContact O-CA 3.37Å; G283-G287 WeakPolarHBondContact O-CA 3.12Å; G283-G287 PolarHBondContact O-N 3.45Å; G287-R289 PolarHBondContact O-N 2.95Å; G287-R289 VanDerWaalsContact O-N 3.1Å; G287-G290 PolarHBondContact O-N 2.9Å; G287-F291 PolarHBondContact O-N 2.94Å; G287-G292 WeakPolarHBondContact O-CA 3.31Å; G287-G292 PolarHBondContact O-N 2.55Å; G287-N293 WeakPolarHBondContact CA-OD1 3.28Å
288	R	88.5	Confident	85.3	Confident	12 Å²	12	26.9 Å²	26.9	5%	0.045	13%	0.131	C	C	.	.	H	α-helix	trans	49.1	41.2	-179.7	-64	173	60.7	-132.9	-4.6	112.5	Q250 D254 G290 F291 G292 L388 G392 L394	Q250-R288 PolarHBondContact O-N 2.79Å; D254-R288 HydrophobicContact CB-CG 4.36Å; D254-R288 WeakPolarHBondContact O-CD 3.41Å; D254-R288 IonicContact OD1-NE 3.55Å; D254-R288 PolarHBondContact OD1-NE 2.77Å; R288-G290 VanDerWaalsContact C-N 3.29Å; R288-G290 PolarHBondContact O-N 2.93Å; R288-F291 HydrophobicContact CB-CB 4.18Å; R288-F291 WeakPolarHBondContact O-CD2 3.49Å; R288-F291 PolarHBondContact O-N 2.85Å; R288-G292 WeakPolarHBondContact CD-O 3.31Å; R288-G292 PolarHBondContact NH1-O 3.29Å; R288-L388 VanDerWaalsContact NH2-CD2 3.31Å; R288-G392 PolarHBondContact NH2-O 2.9Å; R288-L394 PolarHBondContact NH1-O 3Å; R288-L394 PolarHBondContact NH2-O 2.97Å
289	R	80.2	Confident	86.4	Confident	214 Å²	214	24.2 Å²	24.2	81%	0.808	11%	0.113	S	C	*	.	H	α-helix	trans	59.5	36.2	179.6	-45.7	173.1	-160.5	173.6	5.9	113.2	G287 Q665	G287-R289 PolarHBondContact O-N 2.95Å; G287-R289 VanDerWaalsContact O-N 3.1Å; R289-Q665 PolarHBondContact O-NE2 3.29Å
290	G	76.2	Confident	87	Confident	14 Å²	14	24.4 Å²	24.4	14%	0.144	12%	0.115	C	C	.	.	H	α-helix	trans	96.4	-1.4	177.9	0	0	0	0	0	115.7	V285 T286 G287 R288 G292	V285-G290 WeakPolarHBondContact O-CA 3.47Å; T286-G290 PolarHBondContact O-N 3.13Å; G287-G290 PolarHBondContact O-N 2.9Å; R288-G290 VanDerWaalsContact C-N 3.29Å; R288-G290 PolarHBondContact O-N 2.93Å; G290-G292 VanDerWaalsContact C-N 3.3Å
291	F	82.8	Confident	87.4	Confident	53 Å²	53	26.4 Å²	26.4	23%	0.232	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-16.1	169.7	-68.7	-68.3	0	0	0	112.3	G287 R288 R393 S395 W396	G287-F291 PolarHBondContact O-N 2.94Å; R288-F291 HydrophobicContact CB-CB 4.18Å; R288-F291 WeakPolarHBondContact O-CD2 3.49Å; R288-F291 PolarHBondContact O-N 2.85Å; F291-R393 WeakPolarHBondContact CD1-O 3.18Å; F291-R393 HydrophobicContact CE1-CB 3.86Å; F291-R393 WeakPolarHBondContact CE1-O 3.5Å; F291-R393 HydrophobicContact CE2-CB 4.38Å; F291-R393 HydrophobicContact CE2-CG 4.3Å; F291-R393 HydrophobicContact CZ-CB 3.7Å; F291-R393 HydrophobicContact CZ-CG 3.85Å; F291-S395 CarbonylContact O-C 3.57Å; F291-S395 WeakPolarHBondContact O-CA 3.49Å; F291-S395 WeakPolarHBondContact O-CB 3.45Å; F291-W396 PolarHBondContact O-N 2.97Å
292	G	88.5	Confident	88.1	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.11	C	C	.	.			trans	81.6	133.9	-178.3	0	0	0	0	0	112.8	G283 V284 G287 R288 G290	G283-G292 CarbonylContact O-C 3.53Å; G283-G292 WeakPolarHBondContact O-CA 3.33Å; V284-G292 VanDerWaalsContact O-CA 3.24Å; V284-G292 WeakPolarHBondContact O-CA 3.32Å; G287-G292 WeakPolarHBondContact O-CA 3.31Å; G287-G292 PolarHBondContact O-N 2.55Å; R288-G292 WeakPolarHBondContact CD-O 3.31Å; R288-G292 PolarHBondContact NH1-O 3.29Å; G290-G292 VanDerWaalsContact C-N 3.3Å
293	N	95.4	Very high	88.8	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.102	C	C	.	.			trans	-59.5	148.9	171.1	-59.1	114.7	0	0	0	110.3	Q250 I253 Y256 G283 G287 Y295	Q250-N293 VanDerWaalsContact CB-OD1 3.23Å; Q250-N293 WeakPolarHBondContact CB-OD1 3.32Å; Q250-N293 VanDerWaalsContact CG-OD1 3.25Å; Q250-N293 WeakPolarHBondContact CG-OD1 3.47Å; Q250-N293 PolarHBondContact O-ND2 3.46Å; I253-N293 PolarHBondContact O-ND2 2.85Å; Y256-N293 HydrophobicContact CD2-CB 3.97Å; Y256-N293 HydrophobicContact CE2-CB 3.79Å; G283-N293 WeakPolarHBondContact CA-OD1 3.39Å; G283-N293 PolarHBondContact O-N 2.85Å; G283-N293 PolarHBondContact O-OD1 2.93Å; G287-N293 WeakPolarHBondContact CA-OD1 3.28Å; N293-Y295 HydrophobicContact CB-CE2 3.94Å
294	I	98.5	Very high	88.9	Confident	6 Å²	6	23.9 Å²	23.9	3%	0.031	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	116.7	177.2	-56.3	172.1	0	0	0	108.1	D254 I255 Y256 V296 I384 L388 W396 V399	D254-I294 PolarHBondContact O-N 3.36Å; D254-I294 VanDerWaalsContact O-N 3.07Å; I255-I294 CarbonylContact C-O 3.57Å; I255-I294 WeakPolarHBondContact CA-O 3.21Å; I255-I294 HydrophobicContact CG1-CB 4.4Å; I255-I294 HydrophobicContact CG1-CD1 4.44Å; I255-I294 HydrophobicContact CG2-CB 4.5Å; Y256-I294 PolarHBondContact N-O 3.39Å; I294-V296 HydrophobicContact CG2-CG2 4.06Å; I294-I384 HydrophobicContact CD1-CG2 3.66Å; I294-I384 HydrophobicContact CG2-CD1 4.36Å; I294-I384 HydrophobicContact CG2-CG2 4.33Å; I294-L388 HydrophobicContact CD1-CD1 3.79Å; I294-L388 HydrophobicContact CD1-CD2 4.11Å; I294-L388 HydrophobicContact CD1-CG 4.19Å; I294-W396 HydrophobicContact CG1-CB 4.33Å; I294-V399 HydrophobicContact CD1-CB 4.18Å; I294-V399 HydrophobicContact CD1-CG1 4.23Å; I294-V399 HydrophobicContact CD1-CG2 3.66Å
295	Y	98.5	Very high	89	Confident	2 Å²	2	26.5 Å²	26.5	1%	0.008	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	114.2	175.4	-62.2	-80.7	0	0	0	109	L246 Q250 Y256 F280 V284 N293 T320 L321	L246-Y295 HydrophobicContact CB-CE1 4.44Å; L246-Y295 HydrophobicContact CD2-CD1 3.84Å; L246-Y295 HydrophobicContact CD2-CE1 3.6Å; L246-Y295 PolarHBondContact O-OH 2.69Å; Q250-Y295 PolarHBondContact NE2-OH 3.2Å; Y256-Y295 HydrophobicContact CD1-CE1 4.3Å; Y256-Y295 HydrophobicContact CD2-CD1 4.27Å; Y256-Y295 AromaticContact CD2-CE1 3.86Å; Y256-Y295 HydrophobicContact CD2-CE1 3.86Å; Y256-Y295 HydrophobicContact CE2-CE1 4.48Å; Y256-Y295 HydrophobicContact CG-CD1 4.03Å; Y256-Y295 AromaticContact CG-CE1 3.77Å; Y256-Y295 HydrophobicContact CG-CE1 3.77Å; Y256-Y295 WeakPolarHBondContact O-CA 3.42Å; F280-Y295 HydrophobicContact CD1-CD1 4.03Å; F280-Y295 AromaticContact CD1-CD2 3.74Å; F280-Y295 HydrophobicContact CD1-CD2 3.74Å; F280-Y295 HydrophobicContact CD1-CE1 4.2Å; F280-Y295 AromaticContact CD1-CE2 3.9Å; F280-Y295 HydrophobicContact CD1-CE2 3.9Å; F280-Y295 AromaticContact CD1-CG 3.81Å; F280-Y295 HydrophobicContact CD1-CG 3.81Å; F280-Y295 AromaticContact CE1-CD1 3.72Å; F280-Y295 HydrophobicContact CE1-CD1 3.72Å; F280-Y295 HydrophobicContact CE1-CD2 4.11Å; F280-Y295 HydrophobicContact CE1-CE1 4.2Å; F280-Y295 AromaticContact CE1-CG 3.67Å; F280-Y295 HydrophobicContact CE1-CG 3.67Å; V284-Y295 HydrophobicContact CG1-CD2 4.08Å; V284-Y295 HydrophobicContact CG1-CE2 4.05Å; N293-Y295 HydrophobicContact CB-CE2 3.94Å; Y295-T320 CarbonylContact O-C 3.59Å; Y295-T320 WeakPolarHBondContact O-CA 3.42Å; Y295-L321 PolarHBondContact O-N 3.17Å
296	V	98.6	Very high	89.5	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	127.4	176.6	-171.7	0	0	0	0	108	I255 Y256 G258 I294 V323 A377 A380 A381 I384	I255-V296 HydrophobicContact CG2-CG2 3.84Å; Y256-V296 PolarHBondContact O-N 2.98Å; G258-V296 PolarHBondContact N-O 2.92Å; I294-V296 HydrophobicContact CG2-CG2 4.06Å; V296-V323 HydrophobicContact CG1-CG2 3.72Å; V296-A377 HydrophobicContact CG1-CB 4.1Å; V296-A377 WeakPolarHBondContact CG1-O 3.21Å; V296-A380 HydrophobicContact CG1-CB 3.89Å; V296-A381 HydrophobicContact CB-CB 4.47Å; V296-A381 HydrophobicContact CG2-CB 4.24Å; V296-I384 HydrophobicContact CG2-CD1 3.6Å
297	W	97.9	Very high	90.3	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	140.3	-171.4	-138	-86.3	0	0	0	111.9	M159 L246 G258 W260 F280 Y314 T320 L321 S322 V323	M159-W297 HydrophobicContact CE-CE3 4.29Å; M159-W297 HydrophobicContact CE-CH2 4Å; M159-W297 HydrophobicContact CE-CZ3 3.55Å; L246-W297 HydrophobicContact CD2-CH2 4.31Å; L246-W297 HydrophobicContact CD2-CZ3 4.07Å; G258-W297 WeakPolarHBondContact O-CA 3.46Å; W260-W297 AromaticContact CD2-CZ2 3.94Å; W260-W297 HydrophobicContact CD2-CZ2 3.94Å; W260-W297 AromaticContact CE2-CH2 3.98Å; W260-W297 AromaticContact CE2-CZ2 3.68Å; W260-W297 HydrophobicContact CE3-CZ2 4.01Å; W260-W297 AromaticContact CH2-CH2 3.82Å; W260-W297 HydrophobicContact CH2-CH2 3.82Å; W260-W297 AromaticContact CH2-CZ2 3.63Å; W260-W297 HydrophobicContact CH2-CZ2 3.63Å; W260-W297 AromaticContact CZ2-CH2 3.52Å; W260-W297 HydrophobicContact CZ2-CH2 3.52Å; W260-W297 AromaticContact CZ2-CZ2 3.54Å; W260-W297 HydrophobicContact CZ2-CZ2 3.54Å; W260-W297 AromaticContact CZ3-CZ2 3.86Å; W260-W297 HydrophobicContact CZ3-CZ2 3.86Å; W260-W297 PolarHBondContact O-NE1 3.07Å; F280-W297 HydrophobicContact CE1-CZ3 4.06Å; F280-W297 HydrophobicContact CZ-CE3 4.33Å; F280-W297 HydrophobicContact CZ-CH2 4.12Å; F280-W297 AromaticContact CZ-CZ3 3.74Å; F280-W297 HydrophobicContact CZ-CZ3 3.74Å; W297-Y314 VanDerWaalsContact CE2-CB 3.44Å; W297-Y314 AromaticContact CH2-CD1 3.94Å; W297-Y314 HydrophobicContact CH2-CD1 3.94Å; W297-Y314 HydrophobicContact CH2-CG 4.48Å; W297-Y314 AromaticContact CZ2-CD1 3.68Å; W297-Y314 HydrophobicContact CZ2-CD1 3.68Å; W297-Y314 AromaticContact CZ2-CG 3.8Å; W297-Y314 HydrophobicContact CZ2-CG 3.8Å; W297-T320 HydrophobicContact CE3-CG2 4.19Å; W297-L321 PolarHBondContact N-O 3.5Å; W297-S322 WeakPolarHBondContact O-CA 3.36Å; W297-V323 PolarHBondContact O-N 2.89Å
298	A	96.3	Very high	90.8	Very high	5 Å²	5	27.8 Å²	27.8	4%	0.041	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	142.2	172.1	0	0	0	0	0	110.4	G258 G300 A377	G258-A298 PolarHBondContact O-N 3.48Å; A298-G300 VanDerWaalsContact C-N 3.31Å; A298-G300 PolarHBondContact O-N 2.86Å; A298-A377 HydrophobicContact CB-CB 4.2Å
299	S	93	Very high	91	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.14	C	C	.	.			trans	-83.7	9.3	-176.7	73.8	0	0	0	0	115.6	C309 S322 V323 S324	S299-C309 WeakPolarHBondContact O-CB 3.45Å; S299-S322 WeakPolarHBondContact CB-OG 3.25Å; S299-V323 WeakPolarHBondContact CB-O 3.47Å; S299-V323 PolarHBondContact N-O 2.85Å; S299-V323 VanDerWaalsContact N-O 3.12Å; S299-V323 PolarHBondContact OG-O 3.41Å; S299-S324 WeakPolarHBondContact OG-CA 3.32Å
300	G	91.8	Very high	91.6	Very high	9 Å²	9	17.1 Å²	17.1	9%	0.093	10%	0.102	C	C	.	.			trans	92.7	162	-177.4	0	0	0	0	0	115.4	A298 E337 T373	A298-G300 VanDerWaalsContact C-N 3.31Å; A298-G300 PolarHBondContact O-N 2.86Å; G300-E337 VanDerWaalsContact C-OE1 3.25Å; G300-E337 WeakPolarHBondContact CA-OE1 3.03Å; G300-T373 PolarHBondContact N-OG1 2.88Å; G300-T373 WeakPolarHBondContact O-CG2 3.41Å; G300-T373 PolarHBondContact O-OG1 3.36Å; G300-T373 VanDerWaalsContact O-OG1 3.06Å
301	N	91.9	Very high	92.3	Very high	45 Å²	45	16.7 Å²	16.7	24%	0.241	10%	0.097	C	C	.	.	S	Bend	trans	-128.3	15.4	-176.3	-61.5	-65.4	0	0	0	113.8	D264 G303 Y335 E337 G372 T373	D264-N301 WeakPolarHBondContact OD2-CA 3.34Å; D264-N301 WeakPolarHBondContact OD2-CB 3.45Å; D264-N301 PolarHBondContact OD2-N 3.29Å; N301-G303 VanDerWaalsContact C-N 3.29Å; N301-G303 PolarHBondContact O-N 2.98Å; N301-Y335 CarbonylContact C-O 3.6Å; N301-Y335 WeakPolarHBondContact CA-O 3.41Å; N301-Y335 HydrophobicContact CB-CD2 4.36Å; N301-Y335 WeakPolarHBondContact O-CB 3.49Å; N301-Y335 VanDerWaalsContact O-O 3.06Å; N301-Y335 VanDerWaalsContact OD1-CD2 3.25Å; N301-Y335 WeakPolarHBondContact OD1-CD2 3.33Å; N301-E337 PolarHBondContact N-OE1 2.66Å; N301-G372 WeakPolarHBondContact OD1-CA 3.07Å; N301-T373 PolarHBondContact ND2-OG1 2.97Å; N301-T373 PolarHBondContact OD1-N 2.87Å; N301-T373 PolarHBondContact OD1-OG1 3.14Å; N301-T373 VanDerWaalsContact OD1-OG1 3.05Å
302	G	91	Very high	92.7	Very high	2 Å²	2	14.7 Å²	14.7	2%	0.021	9%	0.089	C	C	.	.			trans	-83.1	12.9	-178.8	0	0	0	0	0	115.8	D264 S304 L305 D306 D307 E337	D264-G302 PolarHBondContact OD2-N 3.28Å; G302-S304 PolarHBondContact O-N 3.31Å; G302-S304 VanDerWaalsContact O-N 3.12Å; G302-L305 CarbonylContact O-C 3.42Å; G302-L305 WeakPolarHBondContact O-CA 3.05Å; G302-L305 PolarHBondContact O-N 3.32Å; G302-D306 PolarHBondContact O-N 2.8Å; G302-D307 VanDerWaalsContact O-CB 3.24Å; G302-D307 WeakPolarHBondContact O-CB 3.45Å; G302-D307 PolarHBondContact O-N 3.2Å; G302-E337 WeakPolarHBondContact CA-OE1 3.15Å; G302-E337 PolarHBondContact N-OE1 3.49Å
303	G	90.1	Very high	92.8	Very high	8 Å²	8	15.2 Å²	15.2	8%	0.082	9%	0.094	C	C	.	.	G	3₁₀ helix	trans	-58.2	-28.9	-174.2	0	0	0	0	0	115.2	N301 L305 D306 W334 Y335 L336	N301-G303 VanDerWaalsContact C-N 3.29Å; N301-G303 PolarHBondContact O-N 2.98Å; G303-L305 VanDerWaalsContact C-N 3.28Å; G303-L305 PolarHBondContact O-N 3.17Å; G303-D306 PolarHBondContact O-N 3.18Å; G303-W334 CarbonylContact C-O 3.57Å; G303-Y335 WeakPolarHBondContact CA-O 3.36Å; G303-Y335 PolarHBondContact N-O 3.19Å; G303-L336 WeakPolarHBondContact CA-O 3.45Å
304	S	88	Confident	92.7	Very high	66 Å²	66	15.3 Å²	15.3	46%	0.462	10%	0.095	S	C	.	.	G	3₁₀ helix	trans	-74.8	-16.2	174.6	49.4	0	0	0	0	114.3	G302 W334	G302-S304 PolarHBondContact O-N 3.31Å; G302-S304 VanDerWaalsContact O-N 3.12Å; S304-W334 PolarHBondContact N-O 3.04Å
305	L	86.4	Confident	92.4	Very high	64 Å²	64	15 Å²	15	34%	0.335	9%	0.093	S	C	.	.	G	3₁₀ helix	trans	-102.8	17	176.2	-61.8	177.2	0	0	0	111.4	D264 G302 G303 D307 H547	D264-L305 WeakPolarHBondContact O-CD1 3.24Å; G302-L305 CarbonylContact O-C 3.42Å; G302-L305 WeakPolarHBondContact O-CA 3.05Å; G302-L305 PolarHBondContact O-N 3.32Å; G303-L305 VanDerWaalsContact C-N 3.28Å; G303-L305 PolarHBondContact O-N 3.17Å; L305-D307 PolarHBondContact O-N 3.17Å; L305-H547 PolarHBondContact O-ND1 2.81Å
306	D	87.1	Confident	92.1	Very high	73 Å²	73	15 Å²	15	39%	0.39	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	36	-172.2	-64.9	-46.4	0	0	0	112.4	G302 G303 R545 T546	G302-D306 PolarHBondContact O-N 2.8Å; G303-D306 PolarHBondContact O-N 3.18Å; D306-R545 WeakPolarHBondContact O-CA 3.45Å; D306-R545 WeakPolarHBondContact O-CG 3.26Å; D306-T546 HydrophobicContact CB-CG2 4.46Å; D306-T546 VanDerWaalsContact OD2-CG2 3.31Å; D306-T546 WeakPolarHBondContact OD2-CG2 3.38Å; D306-T546 PolarHBondContact OD2-OG1 3.29Å
307	D	92	Very high	91.8	Very high	10 Å²	10	15.9 Å²	15.9	5%	0.053	10%	0.099	C	C	.	.			trans	-77.7	165.2	177.4	-146.4	-12.5	0	0	0	113	D264 S265 G266 G302 L305 E337 R545	D264-D307 VanDerWaalsContact C-OD2 3.23Å; D264-D307 WeakPolarHBondContact CA-OD2 3.41Å; S265-D307 PolarHBondContact N-OD2 2.93Å; G266-D307 VanDerWaalsContact CA-OD2 3.31Å; G266-D307 WeakPolarHBondContact CA-OD2 3.42Å; G266-D307 PolarHBondContact N-OD2 3.42Å; G302-D307 VanDerWaalsContact O-CB 3.24Å; G302-D307 WeakPolarHBondContact O-CB 3.45Å; G302-D307 PolarHBondContact O-N 3.2Å; L305-D307 PolarHBondContact O-N 3.17Å; D307-E337 HydrophobicContact CB-CG 4.3Å; D307-R545 VanDerWaalsContact CG-NH2 3.35Å; D307-R545 IonicContact OD1-CZ 3.79Å; D307-R545 IonicContact OD1-NE 3.52Å; D307-R545 PolarHBondContact OD1-NE 2.92Å; D307-R545 IonicContact OD1-NH1 3.6Å; D307-R545 IonicContact OD1-NH2 2.79Å; D307-R545 PolarHBondContact OD1-NH2 2.63Å; D307-R545 IonicContact OD2-NH2 2.76Å; D307-R545 PolarHBondContact OD2-NH2 3.15Å
308	S	93.4	Very high	91.5	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.007	10%	0.101	C	C	.	.			trans	-144.8	129.3	179.4	-174.4	0	0	0	0	112.7	A310 C311 E337 K338 P543	S308-A310 PolarHBondContact O-N 3.18Å; S308-A310 WeakPolarHBondContact OG-CB 3.45Å; S308-A310 PolarHBondContact OG-N 2.89Å; S308-C311 WeakPolarHBondContact O-CB 3.37Å; S308-C311 PolarHBondContact O-N 3.34Å; S308-C311 PolarHBondContact O-SG 3.45Å; S308-E337 WeakPolarHBondContact CA-OE2 3.37Å; S308-K338 WeakPolarHBondContact CB-O 3.41Å; S308-K338 PolarHBondContact OG-O 2.84Å; S308-P543 WeakPolarHBondContact OG-CD 3.41Å
309	C	93.4	Very high	91.4	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	11%	0.107	C	C	.	.	G	3₁₀ helix	trans	-61	-11	174.9	108.3	0	0	0	0	113.9	S299 C311 D312 S315 E337 C339 S341	S299-C309 WeakPolarHBondContact O-CB 3.45Å; C309-C311 PolarHBondContact O-N 3.39Å; C309-C311 VanDerWaalsContact O-N 3.1Å; C309-D312 PolarHBondContact O-N 2.73Å; C309-S315 WeakPolarHBondContact CB-OG 3.36Å; C309-S315 PolarHBondContact O-OG 3.12Å; C309-E337 WeakPolarHBondContact CA-OE2 3.29Å; C309-E337 PolarHBondContact N-OE2 3.3Å; C309-C339 VanDerWaalsContact CA-SG 3.58Å; C309-C339 HydrophobicContact CB-CB 3.72Å; C309-C339 WeakPolarHBondContact CB-SG 3.31Å; C309-C339 WeakPolarHBondContact SG-CB 3.41Å; C309-C339 CovalentContact SG-SG 2.03Å; C309-C339 PolarHBondContact SG-SG 3.16Å; C309-S341 PolarHBondContact SG-OG 2.99Å
310	A	93.1	Very high	91.5	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.008	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-59.3	-17.5	167.6	0	0	0	0	0	112.7	S308 C339 L541 L542 W559 V561	S308-A310 PolarHBondContact O-N 3.18Å; S308-A310 WeakPolarHBondContact OG-CB 3.45Å; S308-A310 PolarHBondContact OG-N 2.89Å; A310-C339 PolarHBondContact N-SG 3Å; A310-L541 WeakPolarHBondContact CB-O 3.24Å; A310-L542 HydrophobicContact CB-CD1 4.04Å; A310-W559 PolarHBondContact O-NE1 2.9Å; A310-V561 HydrophobicContact CB-CG1 4Å
311	C	89.8	Confident	91.8	Very high	5 Å²	5	17.6 Å²	17.6	3%	0.034	11%	0.105	C	C	.	.	G	3₁₀ helix	trans	-103	0.5	179.6	-49.6	0	0	0	0	113	Y269 E270 S308 C309 L542 R545 W559	Y269-C311 WeakPolarHBondContact CA-O 3.2Å; Y269-C311 HydrophobicContact CD1-CB 3.56Å; Y269-C311 HydrophobicContact CD2-CB 4.44Å; Y269-C311 HydrophobicContact CE1-CB 3.69Å; Y269-C311 WeakPolarHBondContact CE1-SG 3.28Å; Y269-C311 HydrophobicContact CG-CB 3.97Å; E270-C311 PolarHBondContact N-O 2.91Å; S308-C311 WeakPolarHBondContact O-CB 3.37Å; S308-C311 PolarHBondContact O-N 3.34Å; S308-C311 PolarHBondContact O-SG 3.45Å; C309-C311 PolarHBondContact O-N 3.39Å; C309-C311 VanDerWaalsContact O-N 3.1Å; C311-L542 WeakPolarHBondContact SG-CD1 3.41Å; C311-R545 PolarHBondContact SG-NH1 2.62Å; C311-W559 WeakPolarHBondContact O-CZ2 3.47Å
312	D	92.6	Very high	92	Very high	11 Å²	11	15.5 Å²	15.5	6%	0.059	9%	0.094	C	C	.	.	B	Isolated β-bridge	trans	-103.7	108.3	171.3	167.1	11.4	0	0	0	108.7	P262 C309 Y314 S315 S316	P262-D312 WeakPolarHBondContact CD-OD1 3.48Å; P262-D312 HydrophobicContact CG-CB 4.26Å; C309-D312 PolarHBondContact O-N 2.73Å; D312-Y314 PolarHBondContact O-N 2.95Å; D312-Y314 WeakPolarHBondContact OD1-CA 3.23Å; D312-Y314 VanDerWaalsContact OD1-CB 3.3Å; D312-Y314 WeakPolarHBondContact OD1-CB 3.32Å; D312-Y314 VanDerWaalsContact OD1-CD2 3.3Å; D312-Y314 WeakPolarHBondContact OD1-CD2 3.15Å; D312-Y314 PolarHBondContact OD1-N 3.14Å; D312-S315 WeakPolarHBondContact CB-OG 3.49Å; D312-S315 PolarHBondContact OD1-N 2.86Å; D312-S315 WeakPolarHBondContact OD2-CB 3.46Å; D312-S315 PolarHBondContact OD2-N 3.48Å; D312-S315 PolarHBondContact OD2-OG 2.9Å; D312-S316 VanDerWaalsContact O-CB 3.24Å; D312-S316 WeakPolarHBondContact O-CB 3.5Å; D312-S316 PolarHBondContact O-N 2.83Å; D312-S316 PolarHBondContact O-OG 2.92Å
313	G	90.1	Very high	92.4	Very high	11 Å²	11	15.4 Å²	15.4	11%	0.113	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-15.8	-178.6	0	0	0	0	0	114.4	E270 P272 S316 S317	E270-G313 PolarHBondContact O-N 2.95Å; P272-G313 VanDerWaalsContact CD-C 3.49Å; G313-S316 WeakPolarHBondContact CA-OG 3.36Å; G313-S317 PolarHBondContact O-N 3.41Å
314	Y	93.6	Very high	92.7	Very high	2 Å²	2	15 Å²	15	1%	0.008	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-53.4	176.5	-58.5	-85.6	0	0	0	110.9	E242 W260 P272 F280 W297 D312 S316 S317 T320	E242-Y314 PolarHBondContact OE1-OH 2.86Å; E242-Y314 PolarHBondContact OE2-OH 3.06Å; W260-Y314 HydrophobicContact CH2-CD1 4.3Å; W260-Y314 AromaticContact CH2-CE1 3.91Å; W260-Y314 HydrophobicContact CH2-CE1 3.91Å; W260-Y314 HydrophobicContact CZ3-CD1 4.36Å; W260-Y314 HydrophobicContact CZ3-CD2 4.33Å; W260-Y314 HydrophobicContact CZ3-CE1 4.03Å; W260-Y314 AromaticContact CZ3-CE2 3.98Å; W260-Y314 HydrophobicContact CZ3-CE2 3.98Å; W260-Y314 AromaticContact CZ3-CZ 3.82Å; P272-Y314 WeakPolarHBondContact CA-OH 3.5Å; P272-Y314 HydrophobicContact CB-CD1 4.17Å; P272-Y314 HydrophobicContact CB-CE1 3.62Å; P272-Y314 HydrophobicContact CG-CD1 4.33Å; P272-Y314 HydrophobicContact CG-CE1 4.23Å; F280-Y314 AromaticContact CE2-CD1 3.88Å; F280-Y314 HydrophobicContact CE2-CD1 3.88Å; F280-Y314 HydrophobicContact CE2-CE1 4.35Å; F280-Y314 HydrophobicContact CZ-CD1 4.06Å; W297-Y314 VanDerWaalsContact CE2-CB 3.44Å; W297-Y314 AromaticContact CH2-CD1 3.94Å; W297-Y314 HydrophobicContact CH2-CD1 3.94Å; W297-Y314 HydrophobicContact CH2-CG 4.48Å; W297-Y314 AromaticContact CZ2-CD1 3.68Å; W297-Y314 HydrophobicContact CZ2-CD1 3.68Å; W297-Y314 AromaticContact CZ2-CG 3.8Å; W297-Y314 HydrophobicContact CZ2-CG 3.8Å; D312-Y314 PolarHBondContact O-N 2.95Å; D312-Y314 WeakPolarHBondContact OD1-CA 3.23Å; D312-Y314 VanDerWaalsContact OD1-CB 3.3Å; D312-Y314 WeakPolarHBondContact OD1-CB 3.32Å; D312-Y314 VanDerWaalsContact OD1-CD2 3.3Å; D312-Y314 WeakPolarHBondContact OD1-CD2 3.15Å; D312-Y314 PolarHBondContact OD1-N 3.14Å; Y314-S316 VanDerWaalsContact C-N 3.34Å; Y314-S316 PolarHBondContact O-N 2.81Å; Y314-S317 WeakPolarHBondContact O-CB 3.45Å; Y314-S317 PolarHBondContact O-N 3.07Å; Y314-T320 WeakPolarHBondContact O-CB 3.45Å; Y314-T320 VanDerWaalsContact O-CG2 3.28Å; Y314-T320 WeakPolarHBondContact O-CG2 3.2Å; Y314-T320 PolarHBondContact O-OG1 3.19Å
315	S	92.3	Very high	93	Very high	1 Å²	1	11.9 Å²	11.9	1%	0.007	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-21.6	178.2	63.5	0	0	0	0	113.8	C309 D312 S322 S341	C309-S315 WeakPolarHBondContact CB-OG 3.36Å; C309-S315 PolarHBondContact O-OG 3.12Å; D312-S315 WeakPolarHBondContact CB-OG 3.49Å; D312-S315 PolarHBondContact OD1-N 2.86Å; D312-S315 WeakPolarHBondContact OD2-CB 3.46Å; D312-S315 PolarHBondContact OD2-N 3.48Å; D312-S315 PolarHBondContact OD2-OG 2.9Å; S315-S322 VanDerWaalsContact O-CB 3.29Å; S315-S322 WeakPolarHBondContact O-CB 3.22Å; S315-S341 PolarHBondContact O-OG 3.41Å
316	S	91.6	Very high	93.4	Very high	2 Å²	2	8.9 Å²	8.9	1%	0.014	5%	0.051	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-0	172.9	67.1	0	0	0	0	114.3	D312 G313 Y314 T562	D312-S316 VanDerWaalsContact O-CB 3.24Å; D312-S316 WeakPolarHBondContact O-CB 3.5Å; D312-S316 PolarHBondContact O-N 2.83Å; D312-S316 PolarHBondContact O-OG 2.92Å; G313-S316 WeakPolarHBondContact CA-OG 3.36Å; Y314-S316 VanDerWaalsContact C-N 3.34Å; Y314-S316 PolarHBondContact O-N 2.81Å; S316-T562 WeakPolarHBondContact O-CB 3.19Å; S316-T562 WeakPolarHBondContact O-CG2 3.34Å; S316-T562 PolarHBondContact O-OG1 3.18Å
317	S	93.2	Very high	93.8	Very high	17 Å²	17	5.4 Å²	5.4	12%	0.119	3%	0.032	C	C	.	.			trans	-66.9	136.2	176.1	178.4	0	0	0	0	111.4	G313 Y314 F319 T320	G313-S317 PolarHBondContact O-N 3.41Å; Y314-S317 WeakPolarHBondContact O-CB 3.45Å; Y314-S317 PolarHBondContact O-N 3.07Å; S317-F319 PolarHBondContact O-N 3.19Å; S317-F319 VanDerWaalsContact O-N 3.11Å; S317-F319 PolarHBondContact OG-N 2.75Å; S317-T320 PolarHBondContact O-N 3.46Å; S317-T320 PolarHBondContact O-OG1 2.85Å
318	P	91.6	Very high	93.8	Very high	6 Å²	6	6.8 Å²	6.8	4%	0.039	4%	0.038	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-13.2	173.5	28.7	-35.2	0	0	0	112.9	W396 Q400 H512	P318-W396 VanDerWaalsContact O-CZ3 3.29Å; P318-W396 WeakPolarHBondContact O-CZ3 3.14Å; P318-Q400 PolarHBondContact O-NE2 3.27Å; P318-H512 HydrophobicContact CB-CB 4.08Å; P318-H512 PolarHBondContact O-NE2 3.15Å
319	F	92.8	Very high	93.6	Very high	36 Å²	36	8.5 Å²	8.5	16%	0.158	5%	0.051	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-6.7	-179.4	-54.7	-47.7	0	0	0	113.3	F280 Q281 V284 S317 W396	F280-F319 HydrophobicContact CB-CB 4.45Å; F280-F319 HydrophobicContact CB-CD2 4.18Å; Q281-F319 HydrophobicContact CG-CD2 4.41Å; Q281-F319 HydrophobicContact CG-CE2 3.66Å; Q281-F319 HydrophobicContact CG-CZ 4.07Å; V284-F319 HydrophobicContact CB-CD1 4.43Å; V284-F319 HydrophobicContact CG1-CB 3.76Å; V284-F319 HydrophobicContact CG1-CD1 4.22Å; V284-F319 HydrophobicContact CG1-CG 4.22Å; V284-F319 HydrophobicContact CG2-CD1 3.7Å; V284-F319 HydrophobicContact CG2-CE1 4.05Å; V284-F319 HydrophobicContact CG2-CG 4.16Å; S317-F319 PolarHBondContact O-N 3.19Å; S317-F319 VanDerWaalsContact O-N 3.11Å; S317-F319 PolarHBondContact OG-N 2.75Å; F319-W396 HydrophobicContact CD1-CH2 4.08Å; F319-W396 HydrophobicContact CD1-CZ2 4.26Å
320	T	95.7	Very high	93.6	Very high	6 Å²	6	9.3 Å²	9.3	4%	0.037	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	153.4	178.3	61	0	0	0	0	110.5	F280 Y295 W297 Y314 S317 Q400	F280-T320 HydrophobicContact CD1-CG2 4.24Å; F280-T320 HydrophobicContact CE1-CG2 3.57Å; F280-T320 HydrophobicContact CZ-CG2 3.91Å; Y295-T320 CarbonylContact O-C 3.59Å; Y295-T320 WeakPolarHBondContact O-CA 3.42Å; W297-T320 HydrophobicContact CE3-CG2 4.19Å; Y314-T320 WeakPolarHBondContact O-CB 3.45Å; Y314-T320 VanDerWaalsContact O-CG2 3.28Å; Y314-T320 WeakPolarHBondContact O-CG2 3.2Å; Y314-T320 PolarHBondContact O-OG1 3.19Å; S317-T320 PolarHBondContact O-N 3.46Å; S317-T320 PolarHBondContact O-OG1 2.85Å; T320-Q400 PolarHBondContact O-NE2 3.2Å
321	L	97.8	Very high	93.6	Very high	3 Å²	3	11.2 Å²	11.2	2%	0.016	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	96.6	170.9	-166.3	159.5	0	0	0	106.9	Y295 W297 V323 L343 I384 V399 Q400 T403	Y295-L321 PolarHBondContact O-N 3.17Å; W297-L321 PolarHBondContact N-O 3.5Å; L321-V323 HydrophobicContact CD2-CG2 3.42Å; L321-V323 VanDerWaalsContact CD2-CG2 3.42Å; L321-L343 HydrophobicContact CD1-CD2 3.92Å; L321-L343 HydrophobicContact CD2-CD2 4.32Å; L321-L343 HydrophobicContact CG-CB 4.48Å; L321-L343 HydrophobicContact CG-CD2 3.7Å; L321-I384 HydrophobicContact CD1-CD1 3.94Å; L321-V399 HydrophobicContact CD1-CG1 4.24Å; L321-Q400 HydrophobicContact CD1-CG 4.21Å; L321-T403 HydrophobicContact CD1-CG2 4.44Å
322	S	97.1	Very high	93.7	Very high	1 Å²	1	15.4 Å²	15.4	1%	0.007	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	128.1	178.2	177.1	0	0	0	0	111.4	W297 S299 S315 L343	W297-S322 WeakPolarHBondContact O-CA 3.36Å; S299-S322 WeakPolarHBondContact CB-OG 3.25Å; S315-S322 VanDerWaalsContact O-CB 3.29Å; S315-S322 WeakPolarHBondContact O-CB 3.22Å; S322-L343 PolarHBondContact O-N 2.83Å
323	V	98.2	Very high	93.7	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	125.1	-173.3	-170.6	0	0	0	0	110.8	V296 W297 S299 L321 A344 T346 C376 A380	V296-V323 HydrophobicContact CG1-CG2 3.72Å; W297-V323 PolarHBondContact O-N 2.89Å; S299-V323 WeakPolarHBondContact CB-O 3.47Å; S299-V323 PolarHBondContact N-O 2.85Å; S299-V323 VanDerWaalsContact N-O 3.12Å; S299-V323 PolarHBondContact OG-O 3.41Å; L321-V323 HydrophobicContact CD2-CG2 3.42Å; L321-V323 VanDerWaalsContact CD2-CG2 3.42Å; V323-A344 WeakPolarHBondContact CA-O 3.27Å; V323-T346 HydrophobicContact CG1-CG2 3.99Å; V323-C376 HydrophobicContact CB-CB 4.46Å; V323-C376 HydrophobicContact CG1-CB 3.87Å; V323-A380 HydrophobicContact CB-CB 4.33Å; V323-A380 HydrophobicContact CG1-CB 3.94Å; V323-A380 HydrophobicContact CG2-CB 3.58Å
324	S	96.9	Very high	93.6	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	174.7	178.1	176.5	0	0	0	0	112.3	S299 L336 A344 S345 T346 C376 L429	S299-S324 WeakPolarHBondContact OG-CA 3.32Å; S324-L336 VanDerWaalsContact OG-CD1 3.25Å; S324-L336 WeakPolarHBondContact OG-CD1 3.47Å; S324-L336 WeakPolarHBondContact OG-CD2 3.5Å; S324-A344 PolarHBondContact N-O 2.96Å; S324-S345 VanDerWaalsContact O-CA 3.26Å; S324-S345 WeakPolarHBondContact O-CA 3.43Å; S324-T346 PolarHBondContact O-N 3.18Å; S324-C376 WeakPolarHBondContact O-CB 3.31Å; S324-C376 PolarHBondContact O-SG 3.21Å; S324-C376 VanDerWaalsContact O-SG 3.33Å; S324-L429 WeakPolarHBondContact CB-O 3.49Å; S324-L429 PolarHBondContact OG-O 3.33Å
325	G	94.8	Very high	93.5	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	148.2	-174	0	0	0	0	0	114.2	P333 L336 T346 C376 Y430	G325-P333 WeakPolarHBondContact O-CD 3.38Å; G325-L336 VanDerWaalsContact N-CD1 3.32Å; G325-L336 WeakPolarHBondContact O-CD2 3.35Å; G325-T346 WeakPolarHBondContact CA-O 3.42Å; G325-C376 WeakPolarHBondContact CA-SG 3.44Å; G325-Y430 WeakPolarHBondContact O-CE1 3.38Å
326	V	95.4	Very high	93.5	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	141.8	170.7	55.4	0	0	0	0	111.5	N330 T346 Y347 S348 F412 Y430 L434	V326-N330 HydrophobicContact CG2-CB 4.47Å; V326-T346 WeakPolarHBondContact CG1-O 3.32Å; V326-T346 PolarHBondContact N-O 3Å; V326-Y347 HydrophobicContact CG1-CD1 3.61Å; V326-Y347 HydrophobicContact CG1-CE1 3.78Å; V326-Y347 HydrophobicContact CG1-CG 4.28Å; V326-Y347 HydrophobicContact CG2-CE1 4.48Å; V326-Y347 CarbonylContact O-C 3.38Å; V326-Y347 WeakPolarHBondContact O-CA 3.02Å; V326-S348 PolarHBondContact O-N 2.92Å; V326-F412 HydrophobicContact CB-CD1 4.06Å; V326-F412 HydrophobicContact CB-CE1 3.7Å; V326-F412 HydrophobicContact CG1-CD1 4.48Å; V326-F412 HydrophobicContact CG1-CE1 3.78Å; V326-F412 HydrophobicContact CG2-CD1 3.77Å; V326-F412 HydrophobicContact CG2-CE1 3.9Å; V326-Y430 HydrophobicContact CB-CE1 4.07Å; V326-Y430 HydrophobicContact CG2-CE1 4.4Å; V326-L434 HydrophobicContact CG1-CD1 3.92Å
327	S	94	Very high	93.6	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	10%	0.102	C	C	.	.			trans	-72.2	169.3	-179	74.4	0	0	0	0	113	S329 N330 T331 E354	S327-S329 PolarHBondContact O-N 3.48Å; S327-S329 PolarHBondContact OG-N 2.81Å; S327-S329 PolarHBondContact OG-OG 2.68Å; S327-N330 PolarHBondContact O-N 3.45Å; S327-T331 WeakPolarHBondContact CB-O 3.45Å; S327-T331 PolarHBondContact N-O 3.18Å; S327-T331 PolarHBondContact OG-N 2.93Å; S327-T331 PolarHBondContact OG-O 3.28Å; S327-T331 PolarHBondContact OG-OG1 3.45Å; S327-E354 WeakPolarHBondContact CB-OE2 3.39Å; S327-E354 PolarHBondContact OG-OE1 3.45Å
328	E	91.6	Very high	93.5	Very high	39 Å²	39	25.5 Å²	25.5	18%	0.182	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-35.9	172	148.1	155.8	-105.8	0	0	112.8	W126 R130 N330 E354 R355	W126-E328 VanDerWaalsContact CH2-CA 3.46Å; W126-E328 HydrophobicContact CH2-CB 3.75Å; W126-E328 HydrophobicContact CZ2-CB 3.72Å; W126-E328 HydrophobicContact CZ3-CB 4.21Å; R130-E328 PolarHBondContact NH1-O 3.09Å; R130-E328 PolarHBondContact NH2-O 3.23Å; R130-E328 IonicContact NH2-OE1 3.46Å; R130-E328 PolarHBondContact NH2-OE1 2.7Å; E328-N330 PolarHBondContact O-N 3.46Å; E328-E354 HydrophobicContact CB-CB 4.29Å; E328-E354 HydrophobicContact CB-CG 4.44Å; E328-R355 IonicContact OE1-CZ 3.93Å; E328-R355 IonicContact OE1-NE 3.84Å; E328-R355 PolarHBondContact OE1-NE 3.32Å; E328-R355 IonicContact OE1-NH2 3.67Å; E328-R355 PolarHBondContact OE1-NH2 3.19Å; E328-R355 VanDerWaalsContact OE2-CB 3.31Å; E328-R355 WeakPolarHBondContact OE2-CB 3.19Å; E328-R355 WeakPolarHBondContact OE2-CG 3.39Å; E328-R355 PolarHBondContact OE2-N 2.94Å; E328-R355 IonicContact OE2-NE 3.22Å; E328-R355 PolarHBondContact OE2-NE 3.04Å
329	S	90.3	Very high	93.5	Very high	38 Å²	38	25.2 Å²	25.2	27%	0.266	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	6.5	178.4	64.4	0	0	0	0	114.4	S327 T331 E354 K413	S327-S329 PolarHBondContact O-N 3.48Å; S327-S329 PolarHBondContact OG-N 2.81Å; S327-S329 PolarHBondContact OG-OG 2.68Å; S329-T331 PolarHBondContact OG-OG1 3.47Å; S329-E354 WeakPolarHBondContact CB-OE1 3.41Å; S329-E354 PolarHBondContact N-OE1 3.48Å; S329-E354 PolarHBondContact OG-OE1 2.94Å; S329-K413 WeakPolarHBondContact O-CD 3.25Å; S329-K413 VanDerWaalsContact O-CE 3.23Å; S329-K413 WeakPolarHBondContact O-CE 3.23Å; S329-K413 PolarHBondContact O-NZ 2.83Å
330	N	93.2	Very high	93.7	Very high	17 Å²	17	23.5 Å²	23.5	9%	0.091	11%	0.106	C	C	.	.	S	Bend	trans	59.2	42.6	-173.1	-51.8	-33.2	0	0	0	113.1	V326 S327 E328 Y347 P411 K413	V326-N330 HydrophobicContact CG2-CB 4.47Å; S327-N330 PolarHBondContact O-N 3.45Å; E328-N330 PolarHBondContact O-N 3.46Å; N330-Y347 WeakPolarHBondContact OD1-CE1 3.32Å; N330-Y347 PolarHBondContact OD1-OH 3.25Å; N330-P411 WeakPolarHBondContact CB-O 3.33Å; N330-P411 PolarHBondContact ND2-O 3.33Å; N330-K413 PolarHBondContact O-N 3.31Å
331	T	93.1	Very high	93.7	Very high	41 Å²	41	23.6 Å²	23.6	25%	0.252	11%	0.107	S	C	.	.	S	Bend	trans	-126.7	170.6	176.5	59	0	0	0	0	110.4	S327 S329 P333 K413 D414	S327-T331 WeakPolarHBondContact CB-O 3.45Å; S327-T331 PolarHBondContact N-O 3.18Å; S327-T331 PolarHBondContact OG-N 2.93Å; S327-T331 PolarHBondContact OG-O 3.28Å; S327-T331 PolarHBondContact OG-OG1 3.45Å; S329-T331 PolarHBondContact OG-OG1 3.47Å; T331-P333 WeakPolarHBondContact O-CD 3.49Å; T331-K413 HydrophobicContact CG2-CB 4.22Å; T331-K413 HydrophobicContact CG2-CD 4.14Å; T331-D414 WeakPolarHBondContact CA-OD1 3.45Å
332	R	92	Very high	93.6	Very high	93 Å²	93	23.5 Å²	23.5	35%	0.351	11%	0.107	S	C	.	.			trans	-70.3	123	-178.1	-178.8	175.1	70.4	144.5	1.9	109.9	L336 D414 L429 Y430	R332-L336 HydrophobicContact CG-CB 3.76Å; R332-L336 HydrophobicContact CG-CD2 3.83Å; R332-L336 HydrophobicContact CG-CG 4.44Å; R332-D414 WeakPolarHBondContact CB-OD2 3.23Å; R332-D414 PolarHBondContact N-OD1 3.08Å; R332-D414 PolarHBondContact N-OD2 3.24Å; R332-L429 HydrophobicContact CB-CD1 4.49Å; R332-L429 HydrophobicContact CG-CD1 4.46Å; R332-L429 HydrophobicContact CG-CD2 4.4Å; R332-Y430 WeakPolarHBondContact CA-OH 3.28Å; R332-Y430 WeakPolarHBondContact CB-OH 3.4Å; R332-Y430 PolarHBondContact N-OH 2.72Å
333	P	91.7	Very high	93.7	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.006	11%	0.107	C	C	.	.			trans	-60.6	142.9	166.4	-20	33.2	0	0	0	110.5	G325 T331 Y335 L336 S349	G325-P333 WeakPolarHBondContact O-CD 3.38Å; T331-P333 WeakPolarHBondContact O-CD 3.49Å; P333-Y335 HydrophobicContact CB-CD1 4.06Å; P333-Y335 HydrophobicContact CB-CD2 4.13Å; P333-Y335 HydrophobicContact CB-CE1 3.59Å; P333-Y335 HydrophobicContact CB-CE2 3.65Å; P333-Y335 HydrophobicContact CB-CG 4.31Å; P333-Y335 HydrophobicContact CG-CE2 4.24Å; P333-Y335 PolarHBondContact O-N 3.05Å; P333-Y335 VanDerWaalsContact O-N 3.1Å; P333-L336 HydrophobicContact CB-CB 4.48Å; P333-L336 VanDerWaalsContact O-CB 3.28Å; P333-L336 WeakPolarHBondContact O-CB 3.26Å; P333-L336 PolarHBondContact O-N 2.89Å; P333-S349 WeakPolarHBondContact CB-O 3.41Å; P333-S349 WeakPolarHBondContact CG-O 3.21Å
334	W	88.5	Confident	93.7	Very high	151 Å²	151	23.7 Å²	23.7	57%	0.572	11%	0.107	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-26.5	-174.5	59.1	-90.5	0	0	0	114	G303 S304	G303-W334 CarbonylContact C-O 3.57Å; S304-W334 PolarHBondContact N-O 3.04Å
335	Y	91.2	Very high	93.7	Very high	6 Å²	6	23.7 Å²	23.7	2%	0.024	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-6.1	177.3	54.3	-103.7	0	0	0	113.7	N301 G303 P333 E337 S348 S349 G372	N301-Y335 CarbonylContact C-O 3.6Å; N301-Y335 WeakPolarHBondContact CA-O 3.41Å; N301-Y335 HydrophobicContact CB-CD2 4.36Å; N301-Y335 WeakPolarHBondContact O-CB 3.49Å; N301-Y335 VanDerWaalsContact O-O 3.06Å; N301-Y335 VanDerWaalsContact OD1-CD2 3.25Å; N301-Y335 WeakPolarHBondContact OD1-CD2 3.33Å; G303-Y335 WeakPolarHBondContact CA-O 3.36Å; G303-Y335 PolarHBondContact N-O 3.19Å; P333-Y335 HydrophobicContact CB-CD1 4.06Å; P333-Y335 HydrophobicContact CB-CD2 4.13Å; P333-Y335 HydrophobicContact CB-CE1 3.59Å; P333-Y335 HydrophobicContact CB-CE2 3.65Å; P333-Y335 HydrophobicContact CB-CG 4.31Å; P333-Y335 HydrophobicContact CG-CE2 4.24Å; P333-Y335 PolarHBondContact O-N 3.05Å; P333-Y335 VanDerWaalsContact O-N 3.1Å; Y335-E337 PolarHBondContact O-N 2.04Å; Y335-S348 PolarHBondContact OH-OG 2.94Å; Y335-S349 PolarHBondContact OH-N 3.49Å; Y335-S349 PolarHBondContact OH-O 3.4Å; Y335-S349 VanDerWaalsContact OH-O 3.1Å; Y335-S349 PolarHBondContact OH-OG 2.86Å; Y335-G372 PolarHBondContact OH-N 3.1Å
336	L	92.2	Very high	93.9	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.107	C	C	.	.	P	Polyproline II helix	trans	-75.6	126	-171.3	-164.2	79.4	0	0	0	113.1	G303 S324 G325 R332 P333 T373 L429 Y430	G303-L336 WeakPolarHBondContact CA-O 3.45Å; S324-L336 VanDerWaalsContact OG-CD1 3.25Å; S324-L336 WeakPolarHBondContact OG-CD1 3.47Å; S324-L336 WeakPolarHBondContact OG-CD2 3.5Å; G325-L336 VanDerWaalsContact N-CD1 3.32Å; G325-L336 WeakPolarHBondContact O-CD2 3.35Å; R332-L336 HydrophobicContact CG-CB 3.76Å; R332-L336 HydrophobicContact CG-CD2 3.83Å; R332-L336 HydrophobicContact CG-CG 4.44Å; P333-L336 HydrophobicContact CB-CB 4.48Å; P333-L336 VanDerWaalsContact O-CB 3.28Å; P333-L336 WeakPolarHBondContact O-CB 3.26Å; P333-L336 PolarHBondContact O-N 2.89Å; L336-T373 HydrophobicContact CD1-CG2 3.89Å; L336-L429 HydrophobicContact CD2-CB 4.27Å; L336-L429 HydrophobicContact CD2-CD2 4.38Å; L336-Y430 HydrophobicContact CD2-CD1 4.25Å; L336-Y430 HydrophobicContact CD2-CE1 3.84Å
337	E	93.5	Very high	93.9	Very high	4 Å²	4	23.7 Å²	23.7	2%	0.019	11%	0.107	C	C	.	.	P	Polyproline II helix	trans	-79.9	155.3	178	-65.5	179.3	-155	0	0	113.6	G300 N301 G302 D307 S308 C309 Y335	G300-E337 VanDerWaalsContact C-OE1 3.25Å; G300-E337 WeakPolarHBondContact CA-OE1 3.03Å; N301-E337 PolarHBondContact N-OE1 2.66Å; G302-E337 WeakPolarHBondContact CA-OE1 3.15Å; G302-E337 PolarHBondContact N-OE1 3.49Å; D307-E337 HydrophobicContact CB-CG 4.3Å; S308-E337 WeakPolarHBondContact CA-OE2 3.37Å; C309-E337 WeakPolarHBondContact CA-OE2 3.29Å; C309-E337 PolarHBondContact N-OE2 3.3Å; Y335-E337 PolarHBondContact O-N 2.04Å
338	K	92.2	Very high	93.9	Very high	93 Å²	93	23.7 Å²	23.7	40%	0.404	11%	0.107	S	C	.	.	P	Polyproline II helix	trans	-94.3	126.4	172.9	-74.6	171.2	-174.1	168.1	0	109	S308 Q428 L429 P543	S308-K338 WeakPolarHBondContact CB-O 3.41Å; S308-K338 PolarHBondContact OG-O 2.84Å; K338-Q428 WeakPolarHBondContact CA-O 3.33Å; K338-Q428 HydrophobicContact CB-CG 3.93Å; K338-Q428 HydrophobicContact CG-CG 4.39Å; K338-L429 HydrophobicContact CG-CD2 3.51Å; K338-L429 HydrophobicContact CG-CG 4.46Å; K338-P543 HydrophobicContact CB-CG 4.2Å
339	C	92.3	Very high	93.7	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	10%	0.099	C	C	.	.			trans	-155.1	138.1	-174.8	-159.3	0	0	0	0	113.5	C309 A310 S341 Q428	C309-C339 VanDerWaalsContact CA-SG 3.58Å; C309-C339 HydrophobicContact CB-CB 3.72Å; C309-C339 WeakPolarHBondContact CB-SG 3.31Å; C309-C339 WeakPolarHBondContact SG-CB 3.41Å; C309-C339 CovalentContact SG-SG 2.03Å; C309-C339 PolarHBondContact SG-SG 3.16Å; A310-C339 PolarHBondContact N-SG 3Å; C339-S341 PolarHBondContact SG-OG 2.84Å; C339-Q428 PolarHBondContact N-O 3.02Å
340	S	95.6	Very high	93.2	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.007	9%	0.088	C	C	.	.	S	Bend	trans	-87.5	-12.2	-179.4	62.4	0	0	0	0	113.8	V540 T562 T563 V564	S340-V540 WeakPolarHBondContact CB-O 3.48Å; S340-T562 PolarHBondContact OG-O 2.78Å; S340-T563 WeakPolarHBondContact O-CA 3.29Å; S340-V564 WeakPolarHBondContact O-CG2 3.48Å; S340-V564 PolarHBondContact O-N 3.32Å
341	S	95.9	Very high	92.2	Very high	7 Å²	7	21.9 Å²	21.9	5%	0.049	10%	0.101	C	C	.	.	S	Bend	trans	-87.6	-13.8	173.6	63.2	0	0	0	0	114	C309 S315 C339 L343 T562	C309-S341 PolarHBondContact SG-OG 2.99Å; S315-S341 PolarHBondContact O-OG 3.41Å; C339-S341 PolarHBondContact SG-OG 2.84Å; S341-L343 PolarHBondContact O-N 3.03Å; S341-T562 PolarHBondContact N-O 3.35Å
342	T	97	Very high	91.1	Very high	2 Å²	2	25.4 Å²	25.4	1%	0.012	13%	0.125	C	C	.	.			trans	-58.5	119.9	175.1	-63	0	0	0	0	110.5	G431	T342-G431 VanDerWaalsContact O-CA 3.24Å; T342-G431 WeakPolarHBondContact O-CA 3.35Å
343	L	97.9	Very high	90.5	Very high	4 Å²	4	29.7 Å²	29.7	2%	0.021	15%	0.151	C	C	.	.			trans	-85.4	-45.4	-178.1	-169.1	71.4	0	0	0	111.8	L321 S322 S341 Q400 T403 L404 Y432 V564 W567	L321-L343 HydrophobicContact CD1-CD2 3.92Å; L321-L343 HydrophobicContact CD2-CD2 4.32Å; L321-L343 HydrophobicContact CG-CB 4.48Å; L321-L343 HydrophobicContact CG-CD2 3.7Å; S322-L343 PolarHBondContact O-N 2.83Å; S341-L343 PolarHBondContact O-N 3.03Å; L343-Q400 HydrophobicContact CD2-CB 3.86Å; L343-Q400 HydrophobicContact CD2-CG 3.96Å; L343-T403 HydrophobicContact CD2-CG2 4.01Å; L343-T403 HydrophobicContact CG-CG2 4.49Å; L343-L404 HydrophobicContact CD1-CB 4.13Å; L343-L404 HydrophobicContact CD1-CD2 4.14Å; L343-L404 HydrophobicContact CG-CB 4.48Å; L343-Y432 HydrophobicContact CD1-CD2 4.13Å; L343-Y432 HydrophobicContact CD1-CE2 4.23Å; L343-Y432 WeakPolarHBondContact O-CD2 3.29Å; L343-Y432 PolarHBondContact O-N 3.45Å; L343-V564 HydrophobicContact CD1-CB 4.27Å; L343-V564 HydrophobicContact CD1-CG1 4.36Å; L343-V564 HydrophobicContact CD1-CG2 4.18Å; L343-W567 HydrophobicContact CD1-CE3 4.33Å; L343-W567 HydrophobicContact CD1-CZ3 4.07Å
344	A	98.1	Very high	90.2	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	177.9	-176.4	0	0	0	0	0	111.2	V323 S324 T403 M435	V323-A344 WeakPolarHBondContact CA-O 3.27Å; S324-A344 PolarHBondContact N-O 2.96Å; A344-T403 HydrophobicContact CB-CG2 3.65Å; A344-M435 HydrophobicContact CB-CG 3.76Å; A344-M435 HydrophobicContact CB-SD 4.47Å
345	S	98.1	Very high	90.2	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	153.7	177.4	-54.1	0	0	0	0	112	S324 Y430 G433 L434 M435	S324-S345 VanDerWaalsContact O-CA 3.26Å; S324-S345 WeakPolarHBondContact O-CA 3.43Å; S345-Y430 VanDerWaalsContact OG-C 3.3Å; S345-Y430 WeakPolarHBondContact OG-CA 3.46Å; S345-Y430 WeakPolarHBondContact OG-CB 3.36Å; S345-Y430 PolarHBondContact OG-O 3.48Å; S345-G433 PolarHBondContact N-O 2.84Å; S345-L434 CarbonylContact O-C 3.52Å; S345-L434 WeakPolarHBondContact O-CA 3.38Å; S345-M435 PolarHBondContact O-N 3.12Å
346	T	97.9	Very high	90.3	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	173.3	164.1	58	0	0	0	0	109.5	M139 V323 S324 G325 V326 C376 M379 A380 M435	M139-T346 HydrophobicContact SD-CG2 3.86Å; V323-T346 HydrophobicContact CG1-CG2 3.99Å; S324-T346 PolarHBondContact O-N 3.18Å; G325-T346 WeakPolarHBondContact CA-O 3.42Å; V326-T346 WeakPolarHBondContact CG1-O 3.32Å; V326-T346 PolarHBondContact N-O 3Å; T346-C376 WeakPolarHBondContact OG1-CA 3.26Å; T346-C376 WeakPolarHBondContact OG1-CB 2.98Å; T346-C376 PolarHBondContact OG1-O 2.79Å; T346-M379 HydrophobicContact CG2-CB 4.22Å; T346-A380 HydrophobicContact CG2-CB 4.05Å; T346-M435 HydrophobicContact CG2-CB 4.35Å; T346-M435 HydrophobicContact CG2-CG 4.27Å; T346-M435 HydrophobicContact CG2-SD 3.83Å
347	Y	96.8	Very high	90.5	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	158.3	171	-78.5	-66.7	0	0	0	111.7	W126 Y137 M139 V326 N330 M379 L434	W126-Y347 AromaticContact CH2-CD1 3.45Å; W126-Y347 HydrophobicContact CH2-CD1 3.45Å; W126-Y347 VanDerWaalsContact CH2-CD1 3.45Å; W126-Y347 HydrophobicContact CH2-CE1 4.22Å; W126-Y347 AromaticContact CH2-CG 3.75Å; W126-Y347 HydrophobicContact CH2-CG 3.75Å; W126-Y347 AromaticContact CZ3-CD1 3.3Å; W126-Y347 HydrophobicContact CZ3-CD1 3.3Å; W126-Y347 HydrophobicContact CZ3-CD2 4.09Å; W126-Y347 AromaticContact CZ3-CE1 3.72Å; W126-Y347 HydrophobicContact CZ3-CE1 3.72Å; W126-Y347 HydrophobicContact CZ3-CE2 4.45Å; W126-Y347 AromaticContact CZ3-CG 3.51Å; W126-Y347 HydrophobicContact CZ3-CG 3.51Å; Y137-Y347 PolarHBondContact O-OH 3.17Å; M139-Y347 HydrophobicContact CG-CD2 3.91Å; M139-Y347 HydrophobicContact CG-CE2 4.41Å; M139-Y347 HydrophobicContact SD-CD2 4.46Å; V326-Y347 HydrophobicContact CG1-CD1 3.61Å; V326-Y347 HydrophobicContact CG1-CE1 3.78Å; V326-Y347 HydrophobicContact CG1-CG 4.28Å; V326-Y347 HydrophobicContact CG2-CE1 4.48Å; V326-Y347 CarbonylContact O-C 3.38Å; V326-Y347 WeakPolarHBondContact O-CA 3.02Å; N330-Y347 WeakPolarHBondContact OD1-CE1 3.32Å; N330-Y347 PolarHBondContact OD1-OH 3.25Å; Y347-M379 WeakPolarHBondContact O-CE 3.27Å; Y347-L434 HydrophobicContact CD2-CD1 3.99Å; Y347-L434 HydrophobicContact CD2-CD2 4.29Å; Y347-L434 HydrophobicContact CE2-CD1 3.92Å; Y347-L434 HydrophobicContact CE2-CD2 3.48Å; Y347-L434 VanDerWaalsContact CE2-CD2 3.48Å; Y347-L434 HydrophobicContact CE2-CG 4.35Å; Y347-L434 HydrophobicContact CG-CD1 4.43Å
348	S	94.1	Very high	90.7	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.158	C	C	.	.			trans	-154.1	-152.5	171.2	-173.8	0	0	0	0	107.9	W126 V326 Y335 G372	W126-S348 WeakPolarHBondContact CZ2-O 3.03Å; V326-S348 PolarHBondContact O-N 2.92Å; Y335-S348 PolarHBondContact OH-OG 2.94Å; S348-G372 PolarHBondContact OG-N 2.88Å; S348-G372 PolarHBondContact OG-O 3.4Å
349	S	86.9	Confident	90.9	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.139	C	C	.	.			trans	-88.9	178.5	169.8	65.2	0	0	0	0	112.4	P333 Y335 S371	P333-S349 WeakPolarHBondContact CB-O 3.41Å; P333-S349 WeakPolarHBondContact CG-O 3.21Å; Y335-S349 PolarHBondContact OH-N 3.49Å; Y335-S349 PolarHBondContact OH-O 3.4Å; Y335-S349 VanDerWaalsContact OH-O 3.1Å; Y335-S349 PolarHBondContact OH-OG 2.86Å; S349-S371 WeakPolarHBondContact CB-OG 3.49Å; S349-S371 WeakPolarHBondContact OG-CA 3.32Å; S349-S371 VanDerWaalsContact OG-CB 3.23Å; S349-S371 WeakPolarHBondContact OG-CB 2.99Å; S349-S371 PolarHBondContact OG-OG 2.86Å
350	G	79.8	Confident	91.2	Very high	4 Å²	4	26.1 Å²	26.1	4%	0.041	14%	0.139	C	C	.	.			trans	-145.1	-119.4	168.8	0	0	0	0	0	111.7	E354	G350-E354 WeakPolarHBondContact CA-OE2 3.44Å
351	S	72.5	Confident	91.2	Very high	52 Å²	52	27.1 Å²	27.1	36%	0.364	14%	0.144	S	C	.	.	S	Bend	trans	-60.3	156.3	174.6	70.9	0	0	0	0	111.4	M353 E354	S351-M353 PolarHBondContact O-N 3.47Å; S351-E354 PolarHBondContact N-OE2 2.57Å; S351-E354 PolarHBondContact O-N 2.52Å; S351-E354 WeakPolarHBondContact OG-CG 3.48Å; S351-E354 PolarHBondContact OG-OE2 2.96Å
352	P	69.7	Low	91.1	Very high	116 Å²	116	27.8 Å²	27.8	75%	0.753	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57	-18.9	179.2	-26.4	34.7	0	0	0	115.2
353	M	77.6	Confident	90.8	Very high	183 Å²	183	30.1 Å²	30.1	90%	0.901	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-11.9	178.3	-59.2	-164.1	79.1	0	0	113.6	S351	S351-M353 PolarHBondContact O-N 3.47Å
354	E	86.5	Confident	90.6	Very high	28 Å²	28	34.5 Å²	34.5	13%	0.131	19%	0.191	C	C	.	.	S	Bend	trans	-84.5	148.9	177.8	-76	174.5	130.2	0	0	111	S327 E328 S329 G350 S351 M356	S327-E354 WeakPolarHBondContact CB-OE2 3.39Å; S327-E354 PolarHBondContact OG-OE1 3.45Å; E328-E354 HydrophobicContact CB-CB 4.29Å; E328-E354 HydrophobicContact CB-CG 4.44Å; S329-E354 WeakPolarHBondContact CB-OE1 3.41Å; S329-E354 PolarHBondContact N-OE1 3.48Å; S329-E354 PolarHBondContact OG-OE1 2.94Å; G350-E354 WeakPolarHBondContact CA-OE2 3.44Å; S351-E354 PolarHBondContact N-OE2 2.57Å; S351-E354 PolarHBondContact O-N 2.52Å; S351-E354 WeakPolarHBondContact OG-CG 3.48Å; S351-E354 PolarHBondContact OG-OE2 2.96Å; E354-M356 PolarHBondContact O-N 3.41Å
355	R	89.4	Confident	90.5	Very high	102 Å²	102	39.6 Å²	39.6	39%	0.385	22%	0.218	S	C	.	.			trans	-68.1	137.1	176	-64	-176.3	-65	153.4	-2.4	109.9	W126 E328	W126-R355 VanDerWaalsContact CD1-CZ 3.44Å; E328-R355 IonicContact OE1-CZ 3.93Å; E328-R355 IonicContact OE1-NE 3.84Å; E328-R355 PolarHBondContact OE1-NE 3.32Å; E328-R355 IonicContact OE1-NH2 3.67Å; E328-R355 PolarHBondContact OE1-NH2 3.19Å; E328-R355 VanDerWaalsContact OE2-CB 3.31Å; E328-R355 WeakPolarHBondContact OE2-CB 3.19Å; E328-R355 WeakPolarHBondContact OE2-CG 3.39Å; E328-R355 PolarHBondContact OE2-N 2.94Å; E328-R355 IonicContact OE2-NE 3.22Å; E328-R355 PolarHBondContact OE2-NE 3.04Å
356	M	93.2	Very high	90.4	Very high	47 Å²	47	42.4 Å²	42.4	23%	0.232	24%	0.237	C	C	.	.			trans	-96.3	-164.4	177.4	-44.9	-174.6	175.9	0	0	110.1	W126 E354 R368 M369 H370	W126-M356 PolarHBondContact NE1-O 2.88Å; E354-M356 PolarHBondContact O-N 3.41Å; M356-R368 WeakPolarHBondContact CB-O 3.43Å; M356-M369 HydrophobicContact SD-CB 4.01Å; M356-H370 WeakPolarHBondContact CB-O 3.3Å
357	I	95.9	Very high	90.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	128.3	-178.9	-54	-56.1	0	0	0	109.9	W126 Y127 Q207 R368 H370 A375 M379	W126-I357 HydrophobicContact CZ2-CD1 4.4Å; Y127-I357 HydrophobicContact CD1-CD1 3.47Å; Y127-I357 VanDerWaalsContact CD1-CD1 3.47Å; Y127-I357 HydrophobicContact CE1-CB 4.37Å; Y127-I357 HydrophobicContact CE1-CD1 3.71Å; Y127-I357 HydrophobicContact CE1-CG2 3.84Å; Y127-I357 HydrophobicContact CG-CD1 4Å; Q207-I357 HydrophobicContact CG-CG2 4.02Å; I357-R368 CarbonylContact O-C 3.58Å; I357-H370 HydrophobicContact CB-CB 4.36Å; I357-H370 WeakPolarHBondContact CB-O 3.25Å; I357-H370 PolarHBondContact N-O 2.62Å; I357-H370 WeakPolarHBondContact O-CB 3.49Å; I357-H370 PolarHBondContact O-N 3.21Å; I357-H370 VanDerWaalsContact O-N 3.09Å; I357-A375 HydrophobicContact CB-CB 4.31Å; I357-A375 HydrophobicContact CG1-CB 3.85Å; I357-M379 HydrophobicContact CD1-CE 3.84Å; I357-M379 HydrophobicContact CD1-SD 4.4Å; I357-M379 HydrophobicContact CG1-CE 3.88Å; I357-M379 HydrophobicContact CG2-CE 4.35Å
358	S	96.8	Very high	90.3	Very high	3 Å²	3	49 Å²	49	2%	0.021	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	133.6	173.5	-59.2	0	0	0	0	110.1	Y127 T367	Y127-S358 PolarHBondContact OH-O 3.37Å; S358-T367 CarbonylContact C-O 3.55Å; S358-T367 WeakPolarHBondContact CA-O 3.23Å
359	T	97.7	Very high	90.1	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163	-179.9	-177.6	-170.4	0	0	0	0	112	R203 G206 Q207 T367 H370	R203-T359 HydrophobicContact CB-CG2 3.68Å; R203-T359 HydrophobicContact CG-CG2 3.92Å; R203-T359 WeakPolarHBondContact O-CG2 3.39Å; R203-T359 PolarHBondContact O-OG1 3.43Å; G206-T359 WeakPolarHBondContact CA-OG1 3.37Å; Q207-T359 HydrophobicContact CG-CG2 4.45Å; Q207-T359 PolarHBondContact N-OG1 3.44Å; T359-T367 HydrophobicContact CG2-CG2 3.74Å; T359-T367 PolarHBondContact N-O 3.43Å; T359-T367 PolarHBondContact O-N 2.86Å; T359-H370 HydrophobicContact CG2-CB 3.83Å
360	T	97.6	Very high	90.4	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	158.6	172.4	53.2	0	0	0	0	111.9	H167 D169 T202 R203 G206 C217	H167-T360 VanDerWaalsContact CE1-CG2 3.4Å; H167-T360 WeakPolarHBondContact CE1-CG2 3.3Å; D169-T360 HydrophobicContact CB-CG2 3.91Å; T202-T360 PolarHBondContact O-OG1 2.8Å; R203-T360 WeakPolarHBondContact CA-O 3.3Å; R203-T360 WeakPolarHBondContact CG-O 3.49Å; G206-T360 VanDerWaalsContact CA-OG1 3.29Å; G206-T360 WeakPolarHBondContact CA-OG1 3.37Å; C217-T360 HydrophobicContact CB-CG2 4.35Å
361	D	96.3	Very high	91	Very high	22 Å²	22	57.4 Å²	57.4	12%	0.118	31%	0.308	C	S	.	.			trans	-141.2	172.2	178.8	-146.5	-10.7	0	0	0	110.5	H167 K199 R203 D365 T367	H167-D361 PolarHBondContact CD2-O 2.8Å; H167-D361 VanDerWaalsContact CD2-O 3.27Å; K199-D361 WeakPolarHBondContact CB-OD1 3.45Å; R203-D361 IonicContact CZ-OD1 3.47Å; R203-D361 IonicContact CZ-OD2 2.77Å; R203-D361 VanDerWaalsContact NE-CG 3.33Å; R203-D361 IonicContact NE-OD1 2.8Å; R203-D361 PolarHBondContact NE-OD1 3.12Å; R203-D361 IonicContact NE-OD2 3.47Å; R203-D361 PolarHBondContact NE-OD2 3.33Å; R203-D361 IonicContact NH2-OD1 2.73Å; R203-D361 PolarHBondContact NH2-OD1 3.14Å; R203-D361 IonicContact NH2-OD2 2.6Å; R203-D361 PolarHBondContact NH2-OD2 3.17Å; D361-D365 WeakPolarHBondContact CA-O 3.48Å; D361-D365 HydrophobicContact CB-CB 4.03Å; D361-D365 WeakPolarHBondContact CB-O 3.31Å; D361-D365 PolarHBondContact N-O 3.1Å; D361-T367 HydrophobicContact CB-CG2 4.4Å
362	L	93.2	Very high	92	Very high	21 Å²	21	55.3 Å²	55.3	11%	0.11	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-61.8	147.4	-179.5	-74	179.2	0	0	0	113.3	D164 P191 N198 K199 H364	D164-L362 HydrophobicContact CB-CD2 4.22Å; P191-L362 HydrophobicContact CB-CD2 4.19Å; P191-L362 HydrophobicContact CG-CD2 3.4Å; N198-L362 WeakPolarHBondContact O-CD1 3.24Å; N198-L362 WeakPolarHBondContact O-CD2 3.47Å; K199-L362 HydrophobicContact CB-CB 4.45Å; K199-L362 HydrophobicContact CB-CD1 3.71Å; K199-L362 HydrophobicContact CB-CG 3.59Å; L362-H364 VanDerWaalsContact C-N 3.34Å
363	G	90.6	Very high	93.1	Very high	50 Å²	50	49.8 Å²	49.8	52%	0.515	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	72.7	31.9	169.6	0	0	0	0	0	112.6	D164 D365	D164-G363 PolarHBondContact OD2-N 3.41Å; G363-D365 PolarHBondContact O-N 3.29Å
364	H	93.8	Very high	93.9	Very high	96 Å²	96	41.6 Å²	41.6	44%	0.444	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	68.4	17.2	179.8	-47.8	173.3	0	0	0	114.2	D164 T166 P168 L362	D164-H364 IonicContact OD2-CD2 3.73Å; T166-H364 PolarHBondContact O-NE2 2.82Å; T166-H364 VanDerWaalsContact O-NE2 3.17Å; T166-H364 PolarHBondContact OG1-NE2 3.12Å; P168-H364 HydrophobicContact CG-CB 4.44Å; L362-H364 VanDerWaalsContact C-N 3.34Å
365	D	95.6	Very high	94.3	Very high	107 Å²	107	40.3 Å²	40.3	57%	0.572	21%	0.213	S	C	*	.			trans	-84	163.8	175.8	-84.3	-28.7	0	0	0	112.2	H167 D361 G363	H167-D365 PolarHBondContact NE2-O 2.95Å; H167-D365 VanDerWaalsContact NE2-O 3.09Å; D361-D365 WeakPolarHBondContact CA-O 3.48Å; D361-D365 HydrophobicContact CB-CB 4.03Å; D361-D365 WeakPolarHBondContact CB-O 3.31Å; D361-D365 PolarHBondContact N-O 3.1Å; G363-D365 PolarHBondContact O-N 3.29Å
366	C	97.3	Very high	94.7	Very high	59 Å²	59	35.4 Å²	35.4	40%	0.399	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	152.1	170.8	-40.5	0	0	0	0	110.3	L121 C217	L121-C366 HydrophobicContact CD1-CB 3.66Å; C217-C366 WeakPolarHBondContact CA-SG 3.38Å; C217-C366 HydrophobicContact CB-CB 3.8Å; C217-C366 WeakPolarHBondContact CB-SG 3.49Å; C217-C366 WeakPolarHBondContact SG-CB 3.41Å; C217-C366 CovalentContact SG-SG 2.03Å; C217-C366 PolarHBondContact SG-SG 3.22Å
367	T	96	Very high	94.9	Very high	9 Å²	9	33.2 Å²	33.2	6%	0.055	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	151.7	176.1	-169.9	0	0	0	0	112.6	R203 S358 T359 D361 M369 H370	R203-T367 HydrophobicContact CG-CG2 4.14Å; S358-T367 CarbonylContact C-O 3.55Å; S358-T367 WeakPolarHBondContact CA-O 3.23Å; T359-T367 HydrophobicContact CG2-CG2 3.74Å; T359-T367 PolarHBondContact N-O 3.43Å; T359-T367 PolarHBondContact O-N 2.86Å; D361-T367 HydrophobicContact CB-CG2 4.4Å; T367-M369 PolarHBondContact OG1-N 2.8Å; T367-H370 HydrophobicContact CG2-CB 4.42Å
368	R	94.6	Very high	95	Very high	131 Å²	131	33.2 Å²	33.2	49%	0.494	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	4.6	170.9	-58.9	176.3	-176.4	-134.9	-11.1	112.3	L121 D124 M356 I357	L121-R368 HydrophobicContact CD1-CG 4.26Å; L121-R368 HydrophobicContact CD2-CG 4.25Å; D124-R368 VanDerWaalsContact CG-NH1 3.29Å; D124-R368 IonicContact OD1-NH1 2.64Å; D124-R368 PolarHBondContact OD1-NH1 2.88Å; D124-R368 IonicContact OD2-CZ 3.84Å; D124-R368 IonicContact OD2-NE 2.94Å; D124-R368 IonicContact OD2-NH1 3.85Å; D124-R368 PolarHBondContact OD2-NH1 2.89Å; D124-R368 IonicContact OD2-NH2 3.7Å; D124-R368 PolarHBondContact OD2-NH2 2.85Å; M356-R368 WeakPolarHBondContact CB-O 3.43Å; I357-R368 CarbonylContact O-C 3.58Å
369	M	90.7	Very high	95.1	Very high	131 Å²	131	33 Å²	33	65%	0.645	18%	0.183	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-122.2	31.5	-164.6	-57.6	-170.4	-57.4	0	0	112.5	M356 T367	M356-M369 HydrophobicContact SD-CB 4.01Å; T367-M369 PolarHBondContact OG1-N 2.8Å
370	H	93.8	Very high	95.1	Very high	5 Å²	5	33 Å²	33	2%	0.023	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	133.3	173.1	-173.1	51.6	0	0	0	110.6	Q207 M356 I357 T359 T367 A375	Q207-H370 PolarHBondContact NE2-CD2 3.44Å; Q207-H370 PolarHBondContact NE2-NE2 2.81Å; M356-H370 WeakPolarHBondContact CB-O 3.3Å; I357-H370 HydrophobicContact CB-CB 4.36Å; I357-H370 WeakPolarHBondContact CB-O 3.25Å; I357-H370 PolarHBondContact N-O 2.62Å; I357-H370 WeakPolarHBondContact O-CB 3.49Å; I357-H370 PolarHBondContact O-N 3.21Å; I357-H370 VanDerWaalsContact O-N 3.09Å; T359-H370 HydrophobicContact CG2-CB 3.83Å; T367-H370 HydrophobicContact CG2-CB 4.42Å; H370-A375 WeakPolarHBondContact NE2-CA 3.31Å
371	S	92.2	Very high	95.2	Very high	44 Å²	44	33 Å²	33	31%	0.308	18%	0.183	S	C	.	.			trans	-147.2	170.8	-159.5	172.5	0	0	0	0	109.7	S349	S349-S371 WeakPolarHBondContact CB-OG 3.49Å; S349-S371 WeakPolarHBondContact OG-CA 3.32Å; S349-S371 VanDerWaalsContact OG-CB 3.23Å; S349-S371 WeakPolarHBondContact OG-CB 2.99Å; S349-S371 PolarHBondContact OG-OG 2.86Å
372	G	92.4	Very high	95.3	Very high	7 Å²	7	32 Å²	32	7%	0.072	18%	0.177	C	C	.	.	S	Bend	trans	87.1	172.5	-179.4	0	0	0	0	0	113.7	N301 Y335 S348 S374 A375	N301-G372 WeakPolarHBondContact OD1-CA 3.07Å; Y335-G372 PolarHBondContact OH-N 3.1Å; S348-G372 PolarHBondContact OG-N 2.88Å; S348-G372 PolarHBondContact OG-O 3.4Å; G372-S374 PolarHBondContact O-N 2.76Å; G372-A375 PolarHBondContact O-N 3.21Å; G372-A375 VanDerWaalsContact O-N 3.15Å
373	T	93.8	Very high	95.6	Very high	1 Å²	1	31 Å²	31	1%	0.006	17%	0.172	C	C	.	.	H	α-helix	trans	-64.1	-15	168.4	50.1	0	0	0	0	112.2	G300 N301 L336 A375 C376 A377	G300-T373 PolarHBondContact N-OG1 2.88Å; G300-T373 WeakPolarHBondContact O-CG2 3.41Å; G300-T373 PolarHBondContact O-OG1 3.36Å; G300-T373 VanDerWaalsContact O-OG1 3.06Å; N301-T373 PolarHBondContact ND2-OG1 2.97Å; N301-T373 PolarHBondContact OD1-N 2.87Å; N301-T373 PolarHBondContact OD1-OG1 3.14Å; N301-T373 VanDerWaalsContact OD1-OG1 3.05Å; L336-T373 HydrophobicContact CD1-CG2 3.89Å; T373-A375 PolarHBondContact O-N 3.24Å; T373-C376 WeakPolarHBondContact O-CA 3.49Å; T373-C376 VanDerWaalsContact O-CB 3.24Å; T373-C376 WeakPolarHBondContact O-CB 3.39Å; T373-C376 PolarHBondContact O-N 2.86Å; T373-A377 PolarHBondContact O-N 2.79Å
374	S	93.3	Very high	96	Very high	11 Å²	11	28.6 Å²	28.6	8%	0.077	15%	0.147	C	C	.	.	H	α-helix	trans	-60.8	-25.8	169	-53.5	0	0	0	0	114.8	H200 S259 G372 P378	H200-S374 PolarHBondContact CE1-OG 2.8Å; H200-S374 WeakPolarHBondContact NE2-CB 3.23Å; H200-S374 PolarHBondContact NE2-OG 3.18Å; S259-S374 PolarHBondContact O-OG 3.44Å; S259-S374 PolarHBondContact OG-O 3.45Å; G372-S374 PolarHBondContact O-N 2.76Å; S374-P378 WeakPolarHBondContact O-CD 3.42Å; S374-P378 WeakPolarHBondContact O-CG 3.35Å
375	A	95.9	Very high	96.2	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-78.9	-26.1	169.8	0	0	0	0	0	111.5	Q207 I357 H370 G372 T373 M379	Q207-A375 PolarHBondContact OE1-O 3.24Å; I357-A375 HydrophobicContact CB-CB 4.31Å; I357-A375 HydrophobicContact CG1-CB 3.85Å; H370-A375 WeakPolarHBondContact NE2-CA 3.31Å; G372-A375 PolarHBondContact O-N 3.21Å; G372-A375 VanDerWaalsContact O-N 3.15Å; T373-A375 PolarHBondContact O-N 3.24Å; A375-M379 HydrophobicContact CB-CE 3.96Å; A375-M379 WeakPolarHBondContact O-CE 3.12Å; A375-M379 WeakPolarHBondContact O-CG 3.36Å; A375-M379 PolarHBondContact O-N 2.77Å
376	C	97.7	Very high	96.4	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-74.7	-50.7	-172.9	-58.6	0	0	0	0	113.7	V323 S324 G325 T346 T373 M379 A380	V323-C376 HydrophobicContact CB-CB 4.46Å; V323-C376 HydrophobicContact CG1-CB 3.87Å; S324-C376 WeakPolarHBondContact O-CB 3.31Å; S324-C376 PolarHBondContact O-SG 3.21Å; S324-C376 VanDerWaalsContact O-SG 3.33Å; G325-C376 WeakPolarHBondContact CA-SG 3.44Å; T346-C376 WeakPolarHBondContact OG1-CA 3.26Å; T346-C376 WeakPolarHBondContact OG1-CB 2.98Å; T346-C376 PolarHBondContact OG1-O 2.79Å; T373-C376 WeakPolarHBondContact O-CA 3.49Å; T373-C376 VanDerWaalsContact O-CB 3.24Å; T373-C376 WeakPolarHBondContact O-CB 3.39Å; T373-C376 PolarHBondContact O-N 2.86Å; C376-M379 PolarHBondContact O-N 3.24Å; C376-A380 PolarHBondContact O-N 3.25Å
377	A	97.8	Very high	96.5	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-58.4	-44.1	-178.2	0	0	0	0	0	112.8	V296 A298 T373 M379 A380 A381	V296-A377 HydrophobicContact CG1-CB 4.1Å; V296-A377 WeakPolarHBondContact CG1-O 3.21Å; A298-A377 HydrophobicContact CB-CB 4.2Å; T373-A377 PolarHBondContact O-N 2.79Å; A377-M379 PolarHBondContact O-N 3.27Å; A377-A380 PolarHBondContact O-N 2.99Å; A377-A381 WeakPolarHBondContact O-CB 3.42Å; A377-A381 PolarHBondContact O-N 3.15Å
378	P	98.4	Very high	96.6	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-62.7	-42.7	173.9	-23.9	34.9	0	0	0	112.8	C204 Q207 I208 S259 S374 A380 A381 G382	C204-P378 HydrophobicContact CB-CB 4.16Å; C204-P378 HydrophobicContact CB-CG 3.55Å; C204-P378 WeakPolarHBondContact O-CB 3.38Å; Q207-P378 HydrophobicContact CB-CB 4.34Å; I208-P378 HydrophobicContact CD1-CB 3.92Å; I208-P378 HydrophobicContact CG1-CB 3.89Å; I208-P378 WeakPolarHBondContact CG1-O 3.15Å; S259-P378 WeakPolarHBondContact OG-CD 3.34Å; S374-P378 WeakPolarHBondContact O-CD 3.42Å; S374-P378 WeakPolarHBondContact O-CG 3.35Å; P378-A380 VanDerWaalsContact C-N 3.31Å; P378-A380 PolarHBondContact O-N 2.88Å; P378-A381 WeakPolarHBondContact O-CB 3.32Å; P378-A381 PolarHBondContact O-N 2.94Å; P378-A381 VanDerWaalsContact O-N 3.16Å; P378-G382 PolarHBondContact O-N 2.92Å
379	M	98.3	Very high	96.7	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-61.5	-41.5	177	-77.3	-172.3	-84.4	0	0	112.1	Y127 M139 Q207 I221 T346 Y347 I357 A375 C376 A377 G382 I383	Y127-M379 HydrophobicContact CD2-SD 3.78Å; Y127-M379 HydrophobicContact CE2-SD 3.92Å; Y127-M379 HydrophobicContact CG-SD 4.42Å; M139-M379 HydrophobicContact CE-CB 4.44Å; M139-M379 HydrophobicContact CE-CG 4.46Å; M139-M379 HydrophobicContact CE-SD 3.66Å; M139-M379 HydrophobicContact SD-SD 4.45Å; Q207-M379 HydrophobicContact CB-CG 4.33Å; I221-M379 HydrophobicContact CD1-CB 3.79Å; I221-M379 HydrophobicContact CD1-CG 3.77Å; T346-M379 HydrophobicContact CG2-CB 4.22Å; Y347-M379 WeakPolarHBondContact O-CE 3.27Å; I357-M379 HydrophobicContact CD1-CE 3.84Å; I357-M379 HydrophobicContact CD1-SD 4.4Å; I357-M379 HydrophobicContact CG1-CE 3.88Å; I357-M379 HydrophobicContact CG2-CE 4.35Å; A375-M379 HydrophobicContact CB-CE 3.96Å; A375-M379 WeakPolarHBondContact O-CE 3.12Å; A375-M379 WeakPolarHBondContact O-CG 3.36Å; A375-M379 PolarHBondContact O-N 2.77Å; C376-M379 PolarHBondContact O-N 3.24Å; A377-M379 PolarHBondContact O-N 3.27Å; M379-G382 PolarHBondContact O-N 3.32Å; M379-I383 WeakPolarHBondContact O-CG1 3.49Å; M379-I383 PolarHBondContact O-N 3.18Å
380	A	98.8	Very high	97	Very high	0 Å²	0	6.7 Å²	6.7	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-62.9	-42.3	173.4	0	0	0	0	0	112.2	V296 V323 T346 C376 A377 P378 G382 I383 I384 M435	V296-A380 HydrophobicContact CG1-CB 3.89Å; V323-A380 HydrophobicContact CB-CB 4.33Å; V323-A380 HydrophobicContact CG1-CB 3.94Å; V323-A380 HydrophobicContact CG2-CB 3.58Å; T346-A380 HydrophobicContact CG2-CB 4.05Å; C376-A380 PolarHBondContact O-N 3.25Å; A377-A380 PolarHBondContact O-N 2.99Å; P378-A380 VanDerWaalsContact C-N 3.31Å; P378-A380 PolarHBondContact O-N 2.88Å; A380-G382 VanDerWaalsContact C-N 3.3Å; A380-G382 PolarHBondContact O-N 2.58Å; A380-I383 PolarHBondContact O-N 3Å; A380-I384 WeakPolarHBondContact O-CB 3.47Å; A380-I384 WeakPolarHBondContact O-CD1 3.42Å; A380-I384 VanDerWaalsContact O-CG1 3.23Å; A380-I384 WeakPolarHBondContact O-CG1 3.47Å; A380-I384 PolarHBondContact O-N 2.88Å; A380-M435 HydrophobicContact CB-CE 4.08Å; A380-M435 HydrophobicContact CB-SD 3.43Å; A380-M435 WeakPolarHBondContact CB-SD 3.46Å
381	A	98.8	Very high	97	Very high	0 Å²	0	7.6 Å²	7.6	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-59.2	-40.8	174.3	0	0	0	0	0	111.9	I208 I255 V296 A377 P378 I384 A385	I208-A381 HydrophobicContact CD1-CB 4Å; I255-A381 HydrophobicContact CG2-CB 3.94Å; V296-A381 HydrophobicContact CB-CB 4.47Å; V296-A381 HydrophobicContact CG2-CB 4.24Å; A377-A381 WeakPolarHBondContact O-CB 3.42Å; A377-A381 PolarHBondContact O-N 3.15Å; P378-A381 WeakPolarHBondContact O-CB 3.32Å; P378-A381 PolarHBondContact O-N 2.94Å; P378-A381 VanDerWaalsContact O-N 3.16Å; A381-I384 PolarHBondContact O-N 3.01Å; A381-A385 PolarHBondContact O-N 3.41Å
382	G	98.7	Very high	96.9	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-60.6	-46.6	172.5	0	0	0	0	0	112.6	P378 M379 A380 I384 A385 L386	P378-G382 PolarHBondContact O-N 2.92Å; M379-G382 PolarHBondContact O-N 3.32Å; A380-G382 VanDerWaalsContact C-N 3.3Å; A380-G382 PolarHBondContact O-N 2.58Å; G382-I384 VanDerWaalsContact C-N 3.34Å; G382-I384 PolarHBondContact O-N 2.93Å; G382-A385 WeakPolarHBondContact O-CB 3.43Å; G382-A385 PolarHBondContact O-N 3.29Å; G382-L386 PolarHBondContact O-N 3.12Å
383	I	98.9	Very high	96.6	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-63.4	-40.8	177	-65.1	172.6	0	0	0	111.2	M139 V141 I221 M379 A380 A385 L386 L387 M435 A437 M440	M139-I383 HydrophobicContact CB-CD1 4.14Å; M139-I383 HydrophobicContact SD-CD1 4.02Å; V141-I383 HydrophobicContact CG2-CG1 4.43Å; I221-I383 HydrophobicContact CD1-CG1 4.33Å; I221-I383 HydrophobicContact CG2-CG1 3.99Å; M379-I383 WeakPolarHBondContact O-CG1 3.49Å; M379-I383 PolarHBondContact O-N 3.18Å; A380-I383 PolarHBondContact O-N 3Å; I383-A385 VanDerWaalsContact C-N 3.27Å; I383-A385 PolarHBondContact O-N 3.37Å; I383-L386 WeakPolarHBondContact O-CB 3.33Å; I383-L386 PolarHBondContact O-N 2.76Å; I383-L387 PolarHBondContact O-N 3.17Å; I383-M435 HydrophobicContact CB-CE 4.12Å; I383-M435 HydrophobicContact CD1-CB 3.83Å; I383-M435 HydrophobicContact CG2-CE 3.97Å; I383-A437 HydrophobicContact CG1-CB 4.16Å; I383-A437 HydrophobicContact CG2-CB 3.82Å; I383-M440 HydrophobicContact CG2-CE 4.14Å; I383-M440 HydrophobicContact CG2-SD 3.49Å; I383-M440 WeakPolarHBondContact CG2-SD 3.4Å
384	I	98.9	Very high	96.6	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-65.3	-33.5	176.8	-67.2	161.9	0	0	0	110.8	I255 I294 V296 L321 A380 A381 G382 L387 L388 V399 M435 M440	I255-I384 HydrophobicContact CD1-CB 4.02Å; I255-I384 HydrophobicContact CD1-CG2 3.63Å; I255-I384 HydrophobicContact CG1-CG2 4.29Å; I294-I384 HydrophobicContact CD1-CG2 3.66Å; I294-I384 HydrophobicContact CG2-CD1 4.36Å; I294-I384 HydrophobicContact CG2-CG2 4.33Å; V296-I384 HydrophobicContact CG2-CD1 3.6Å; L321-I384 HydrophobicContact CD1-CD1 3.94Å; A380-I384 WeakPolarHBondContact O-CB 3.47Å; A380-I384 WeakPolarHBondContact O-CD1 3.42Å; A380-I384 VanDerWaalsContact O-CG1 3.23Å; A380-I384 WeakPolarHBondContact O-CG1 3.47Å; A380-I384 PolarHBondContact O-N 2.88Å; A381-I384 PolarHBondContact O-N 3.01Å; G382-I384 VanDerWaalsContact C-N 3.34Å; G382-I384 PolarHBondContact O-N 2.93Å; I384-L387 WeakPolarHBondContact O-CB 3.44Å; I384-L387 PolarHBondContact O-N 3.44Å; I384-L388 HydrophobicContact CG2-CG 4.31Å; I384-L388 WeakPolarHBondContact O-CG 3.42Å; I384-L388 PolarHBondContact O-N 3.43Å; I384-V399 HydrophobicContact CD1-CG1 4.12Å; I384-V399 HydrophobicContact CG1-CG1 3.91Å; I384-V399 HydrophobicContact CG2-CG1 3.79Å; I384-M435 HydrophobicContact CG1-CE 4.22Å; I384-M440 HydrophobicContact CG1-CE 4.43Å
385	A	98.9	Very high	96.5	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-64.7	-39.1	173.8	0	0	0	0	0	112.4	I154 I156 A222 I255 A381 G382 I383 L387 L388 E389	I154-A385 HydrophobicContact CB-CB 4.21Å; I154-A385 WeakPolarHBondContact CG1-O 3.06Å; I154-A385 HydrophobicContact CG2-CB 3.95Å; I156-A385 HydrophobicContact CD1-CB 3.57Å; I156-A385 HydrophobicContact CG1-CB 4.46Å; A222-A385 HydrophobicContact CB-CB 3.78Å; I255-A385 HydrophobicContact CD1-CB 4.01Å; A381-A385 PolarHBondContact O-N 3.41Å; G382-A385 WeakPolarHBondContact O-CB 3.43Å; G382-A385 PolarHBondContact O-N 3.29Å; I383-A385 VanDerWaalsContact C-N 3.27Å; I383-A385 PolarHBondContact O-N 3.37Å; A385-L387 VanDerWaalsContact C-N 3.31Å; A385-L387 PolarHBondContact O-N 3.29Å; A385-L388 PolarHBondContact O-N 3.34Å; A385-E389 PolarHBondContact O-N 3.1Å
386	L	98.8	Very high	96.5	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-60.8	-42.7	171.3	-55.6	-177.6	0	0	0	111.2	V141 A144 T150 G151 I221 A222 G382 I383 E389 A390 A437 V441	V141-L386 HydrophobicContact CG1-CD1 4.21Å; A144-L386 HydrophobicContact CB-CD1 3.78Å; T150-L386 VanDerWaalsContact C-CD2 3.48Å; G151-L386 VanDerWaalsContact N-CD2 3.35Å; I221-L386 HydrophobicContact CG2-CD1 3.86Å; I221-L386 HydrophobicContact CG2-CG 4.37Å; A222-L386 HydrophobicContact CB-CD2 4.23Å; G382-L386 PolarHBondContact O-N 3.12Å; I383-L386 WeakPolarHBondContact O-CB 3.33Å; I383-L386 PolarHBondContact O-N 2.76Å; L386-E389 PolarHBondContact O-N 3.47Å; L386-A390 PolarHBondContact O-N 3.36Å; L386-A390 VanDerWaalsContact O-N 3.17Å; L386-A437 HydrophobicContact CD1-CB 4.32Å; L386-V441 HydrophobicContact CB-CG1 3.98Å
387	L	98.7	Very high	96.4	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-61.9	-44.5	176.2	172.4	62.9	0	0	0	112.4	I383 I384 A385 E389 A390 N391 L394 V399 I402 M440	I383-L387 PolarHBondContact O-N 3.17Å; I384-L387 WeakPolarHBondContact O-CB 3.44Å; I384-L387 PolarHBondContact O-N 3.44Å; A385-L387 VanDerWaalsContact C-N 3.31Å; A385-L387 PolarHBondContact O-N 3.29Å; L387-E389 VanDerWaalsContact C-N 3.33Å; L387-A390 WeakPolarHBondContact O-CB 3.16Å; L387-A390 PolarHBondContact O-N 3.09Å; L387-N391 PolarHBondContact O-N 3.41Å; L387-L394 HydrophobicContact CD1-CD1 3.57Å; L387-L394 HydrophobicContact CD2-CD1 4.08Å; L387-L394 HydrophobicContact CG-CD1 3.59Å; L387-V399 HydrophobicContact CD2-CB 4.43Å; L387-V399 HydrophobicContact CD2-CG1 4.2Å; L387-V399 HydrophobicContact CD2-CG2 4.02Å; L387-I402 HydrophobicContact CD1-CD1 4.07Å; L387-I402 HydrophobicContact CD1-CG2 4.1Å; L387-I402 HydrophobicContact CD2-CB 4.25Å; L387-I402 HydrophobicContact CD2-CD1 4.25Å; L387-I402 HydrophobicContact CD2-CG2 3.93Å; L387-M440 WeakPolarHBondContact CD1-O 3.47Å; L387-M440 HydrophobicContact CD2-CE 3.75Å
388	L	98.4	Very high	96.3	Very high	2 Å²	2	18 Å²	18	1%	0.01	9%	0.093	C	C	.	.	H	α-helix	trans	-69.8	-29.9	179.4	-72.6	-170.6	0	0	0	112.7	I154 D254 I255 R288 I294 I384 A385 A390 N391 G392 L394 V399	I154-L388 HydrophobicContact CD1-CB 3.61Å; I154-L388 HydrophobicContact CG1-CB 3.99Å; I154-L388 HydrophobicContact CG2-CB 4.47Å; I154-L388 HydrophobicContact CG2-CD1 4.16Å; D254-L388 HydrophobicContact CB-CD1 4Å; I255-L388 HydrophobicContact CD1-CD1 4.1Å; I255-L388 HydrophobicContact CG1-CD1 4.03Å; R288-L388 VanDerWaalsContact NH2-CD2 3.31Å; I294-L388 HydrophobicContact CD1-CD1 3.79Å; I294-L388 HydrophobicContact CD1-CD2 4.11Å; I294-L388 HydrophobicContact CD1-CG 4.19Å; I384-L388 HydrophobicContact CG2-CG 4.31Å; I384-L388 WeakPolarHBondContact O-CG 3.42Å; I384-L388 PolarHBondContact O-N 3.43Å; A385-L388 PolarHBondContact O-N 3.34Å; L388-A390 VanDerWaalsContact C-N 3.32Å; L388-N391 CarbonylContact O-C 3.59Å; L388-N391 PolarHBondContact O-N 3.04Å; L388-G392 WeakPolarHBondContact O-CA 3.49Å; L388-G392 PolarHBondContact O-N 3.32Å; L388-L394 HydrophobicContact CD2-CB 4.06Å; L388-V399 HydrophobicContact CD2-CG2 4.16Å
389	E	98.2	Very high	96.3	Very high	52 Å²	52	18 Å²	18	24%	0.243	9%	0.093	C	C	.	.	H	α-helix	trans	-64.8	-40.2	170.1	-173.7	-177.8	-179.5	0	0	110.9	Y149 T150 G151 K152 I154 A385 L386 L387 N391	Y149-E389 WeakPolarHBondContact CA-OE2 3.33Å; Y149-E389 HydrophobicContact CD1-CB 4.12Å; Y149-E389 HydrophobicContact CD1-CG 3.91Å; T150-E389 PolarHBondContact N-OE2 2.88Å; G151-E389 WeakPolarHBondContact CA-OE2 3.35Å; G151-E389 PolarHBondContact N-OE2 2.88Å; K152-E389 WeakPolarHBondContact CB-OE1 3Å; K152-E389 PolarHBondContact N-OE2 3.3Å; I154-E389 HydrophobicContact CG1-CB 4.45Å; A385-E389 PolarHBondContact O-N 3.1Å; L386-E389 PolarHBondContact O-N 3.47Å; L387-E389 VanDerWaalsContact C-N 3.33Å; E389-N391 VanDerWaalsContact C-N 3.29Å; E389-N391 PolarHBondContact O-N 2.93Å
390	A	95.8	Very high	96.3	Very high	19 Å²	19	18.2 Å²	18.2	16%	0.157	9%	0.094	C	C	.	.	H	α-helix	trans	-62.6	-36.7	174.6	0	0	0	0	0	112.6	Y149 L386 L387 L388 V441 E445	Y149-A390 HydrophobicContact CD1-CB 4.01Å; Y149-A390 HydrophobicContact CD2-CB 4.34Å; Y149-A390 HydrophobicContact CE1-CB 3.57Å; Y149-A390 HydrophobicContact CE2-CB 3.89Å; Y149-A390 HydrophobicContact CG-CB 4.37Å; Y149-A390 VanDerWaalsContact CZ-CB 3.46Å; L386-A390 PolarHBondContact O-N 3.36Å; L386-A390 VanDerWaalsContact O-N 3.17Å; L387-A390 WeakPolarHBondContact O-CB 3.16Å; L387-A390 PolarHBondContact O-N 3.09Å; L388-A390 VanDerWaalsContact C-N 3.32Å; A390-V441 HydrophobicContact CB-CB 4.13Å; A390-V441 HydrophobicContact CB-CG1 4.38Å; A390-E445 HydrophobicContact CB-CG 4.28Å
391	N	93.8	Very high	96.2	Very high	24 Å²	24	18.2 Å²	18.2	13%	0.128	9%	0.094	C	C	.	.			trans	-152.6	96.7	176	-174.2	-9.4	0	0	0	112	L387 L388 E389 R393 L394 G444	L387-N391 PolarHBondContact O-N 3.41Å; L388-N391 CarbonylContact O-C 3.59Å; L388-N391 PolarHBondContact O-N 3.04Å; E389-N391 VanDerWaalsContact C-N 3.29Å; E389-N391 PolarHBondContact O-N 2.93Å; N391-R393 PolarHBondContact O-N 2.85Å; N391-R393 VanDerWaalsContact O-N 3.07Å; N391-R393 PolarHBondContact OD1-N 2.85Å; N391-R393 VanDerWaalsContact OD1-N 3.16Å; N391-L394 HydrophobicContact CB-CD1 3.94Å; N391-L394 HydrophobicContact CB-CD2 4.31Å; N391-L394 HydrophobicContact CB-CG 3.83Å; N391-L394 VanDerWaalsContact O-CG 3.24Å; N391-L394 WeakPolarHBondContact O-CG 3.25Å; N391-L394 PolarHBondContact O-N 3.32Å; N391-G444 WeakPolarHBondContact CB-O 3.24Å; N391-G444 PolarHBondContact ND2-O 3.27Å
392	G	90.3	Very high	96.2	Very high	45 Å²	45	18.2 Å²	18.2	46%	0.464	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-7.5	-178.5	0	0	0	0	0	115	R288 L388	R288-G392 PolarHBondContact NH2-O 2.9Å; L388-G392 WeakPolarHBondContact O-CA 3.49Å; L388-G392 PolarHBondContact O-N 3.32Å
393	R	86.7	Confident	96.2	Very high	169 Å²	169	18.2 Å²	18.2	64%	0.638	9%	0.094	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97	10.6	-179.9	-62.5	-175.4	177.5	173	0	113.3	F291 N391 S395	F291-R393 WeakPolarHBondContact CD1-O 3.18Å; F291-R393 HydrophobicContact CE1-CB 3.86Å; F291-R393 WeakPolarHBondContact CE1-O 3.5Å; F291-R393 HydrophobicContact CE2-CB 4.38Å; F291-R393 HydrophobicContact CE2-CG 4.3Å; F291-R393 HydrophobicContact CZ-CB 3.7Å; F291-R393 HydrophobicContact CZ-CG 3.85Å; N391-R393 PolarHBondContact O-N 2.85Å; N391-R393 VanDerWaalsContact O-N 3.07Å; N391-R393 PolarHBondContact OD1-N 2.85Å; N391-R393 VanDerWaalsContact OD1-N 3.16Å; R393-S395 PolarHBondContact O-N 2.88Å
394	L	93	Very high	96.1	Very high	1 Å²	1	18.6 Å²	18.6	1%	0.005	10%	0.096	C	C	.	.			trans	-72.1	126.5	173.1	-62.8	173.1	0	0	0	109.9	R288 L387 L388 N391 D398 V399 I402 W447	R288-L394 PolarHBondContact NH1-O 3Å; R288-L394 PolarHBondContact NH2-O 2.97Å; L387-L394 HydrophobicContact CD1-CD1 3.57Å; L387-L394 HydrophobicContact CD2-CD1 4.08Å; L387-L394 HydrophobicContact CG-CD1 3.59Å; L388-L394 HydrophobicContact CD2-CB 4.06Å; N391-L394 HydrophobicContact CB-CD1 3.94Å; N391-L394 HydrophobicContact CB-CD2 4.31Å; N391-L394 HydrophobicContact CB-CG 3.83Å; N391-L394 VanDerWaalsContact O-CG 3.24Å; N391-L394 WeakPolarHBondContact O-CG 3.25Å; N391-L394 PolarHBondContact O-N 3.32Å; L394-D398 HydrophobicContact CB-CB 4.07Å; L394-D398 HydrophobicContact CD2-CB 3.93Å; L394-V399 HydrophobicContact CB-CG2 4.1Å; L394-I402 HydrophobicContact CD1-CD1 3.85Å; L394-I402 HydrophobicContact CD2-CD1 3.9Å; L394-W447 HydrophobicContact CD2-CB 3.87Å; L394-W447 HydrophobicContact CD2-CG 3.92Å
395	S	91.8	Very high	96	Very high	18 Å²	18	20.2 Å²	20.2	13%	0.126	11%	0.105	C	C	.	.			trans	-71.6	163.8	169.1	69	0	0	0	0	111.6	F291 R393 R397 D398 V399	F291-S395 CarbonylContact O-C 3.57Å; F291-S395 WeakPolarHBondContact O-CA 3.49Å; F291-S395 WeakPolarHBondContact O-CB 3.45Å; R393-S395 PolarHBondContact O-N 2.88Å; S395-R397 PolarHBondContact O-N 3.34Å; S395-D398 VanDerWaalsContact CB-OD2 3.31Å; S395-D398 WeakPolarHBondContact CB-OD2 3.48Å; S395-D398 PolarHBondContact N-OD2 2.88Å; S395-D398 WeakPolarHBondContact O-CB 3.5Å; S395-D398 PolarHBondContact O-N 3.11Å; S395-D398 PolarHBondContact OG-N 2.94Å; S395-D398 PolarHBondContact OG-OD2 3.28Å; S395-V399 PolarHBondContact O-N 3.48Å; S395-V399 VanDerWaalsContact O-N 3.09Å
396	W	95.9	Very high	95.9	Very high	21 Å²	21	20.3 Å²	20.3	8%	0.08	11%	0.106	C	C	.	.	H	α-helix	trans	-55.2	-36.2	175.1	69.4	-89.2	0	0	0	112.6	V284 F291 I294 P318 F319 V399 Q400	V284-W396 HydrophobicContact CB-CD2 4.27Å; V284-W396 HydrophobicContact CB-CG 4.24Å; V284-W396 HydrophobicContact CB-CZ2 4.49Å; V284-W396 HydrophobicContact CG1-CD2 4.31Å; V284-W396 HydrophobicContact CG1-CG 4.37Å; V284-W396 VanDerWaalsContact O-CD1 3.25Å; V284-W396 PolarHBondContact O-NE1 3.44Å; F291-W396 PolarHBondContact O-N 2.97Å; I294-W396 HydrophobicContact CG1-CB 4.33Å; P318-W396 VanDerWaalsContact O-CZ3 3.29Å; P318-W396 WeakPolarHBondContact O-CZ3 3.14Å; F319-W396 HydrophobicContact CD1-CH2 4.08Å; F319-W396 HydrophobicContact CD1-CZ2 4.26Å; W396-V399 PolarHBondContact O-N 2.99Å; W396-Q400 PolarHBondContact O-N 2.77Å
397	R	95.2	Very high	95.8	Very high	23 Å²	23	21 Å²	21	9%	0.087	11%	0.111	C	C	.	.	H	α-helix	trans	-69	-40.4	174.7	-68.1	-171	-63	135.7	1.2	112.6	S395 V399 Q400 Y401 V450 P451 E511	S395-R397 PolarHBondContact O-N 3.34Å; R397-V399 PolarHBondContact O-N 3.39Å; R397-Q400 PolarHBondContact O-N 2.86Å; R397-Y401 WeakPolarHBondContact O-CD2 3.4Å; R397-Y401 PolarHBondContact O-N 3.27Å; R397-V450 HydrophobicContact CB-CG2 3.99Å; R397-V450 VanDerWaalsContact CZ-CG2 3.41Å; R397-P451 PolarHBondContact NH1-O 2.93Å; R397-P451 VanDerWaalsContact NH1-O 3.07Å; R397-P451 PolarHBondContact NH2-O 3.42Å; R397-E511 WeakPolarHBondContact CD-OE2 3.39Å; R397-E511 IonicContact NH1-OE1 3.38Å; R397-E511 PolarHBondContact NH1-OE1 3.03Å; R397-E511 IonicContact NH1-OE2 3.47Å
398	D	96.1	Very high	95.6	Very high	4 Å²	4	21.9 Å²	21.9	2%	0.021	12%	0.116	C	C	.	.	H	α-helix	trans	-58.4	-41.5	176.1	-63.4	-48	0	0	0	110.7	L394 S395 Y401 I402 W447 G449 V450	L394-D398 HydrophobicContact CB-CB 4.07Å; L394-D398 HydrophobicContact CD2-CB 3.93Å; S395-D398 VanDerWaalsContact CB-OD2 3.31Å; S395-D398 WeakPolarHBondContact CB-OD2 3.48Å; S395-D398 PolarHBondContact N-OD2 2.88Å; S395-D398 WeakPolarHBondContact O-CB 3.5Å; S395-D398 PolarHBondContact O-N 3.11Å; S395-D398 PolarHBondContact OG-N 2.94Å; S395-D398 PolarHBondContact OG-OD2 3.28Å; D398-Y401 PolarHBondContact O-N 3.01Å; D398-I402 WeakPolarHBondContact O-CB 3.26Å; D398-I402 VanDerWaalsContact O-CG1 3.28Å; D398-I402 WeakPolarHBondContact O-CG1 3.47Å; D398-I402 PolarHBondContact O-N 3.21Å; D398-W447 VanDerWaalsContact CG-NE1 3.32Å; D398-W447 PolarHBondContact OD1-NE1 2.95Å; D398-G449 VanDerWaalsContact OD1-CA 3.3Å; D398-G449 WeakPolarHBondContact OD1-CA 3.33Å; D398-V450 WeakPolarHBondContact OD1-CG1 3.29Å; D398-V450 WeakPolarHBondContact OD1-CG2 3.17Å; D398-V450 PolarHBondContact OD1-N 2.96Å
399	V	98.4	Very high	95.5	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-63.1	-42.3	177	172.5	0	0	0	0	111.8	I294 L321 I384 L387 L388 L394 S395 W396 R397 I402 T403	I294-V399 HydrophobicContact CD1-CB 4.18Å; I294-V399 HydrophobicContact CD1-CG1 4.23Å; I294-V399 HydrophobicContact CD1-CG2 3.66Å; L321-V399 HydrophobicContact CD1-CG1 4.24Å; I384-V399 HydrophobicContact CD1-CG1 4.12Å; I384-V399 HydrophobicContact CG1-CG1 3.91Å; I384-V399 HydrophobicContact CG2-CG1 3.79Å; L387-V399 HydrophobicContact CD2-CB 4.43Å; L387-V399 HydrophobicContact CD2-CG1 4.2Å; L387-V399 HydrophobicContact CD2-CG2 4.02Å; L388-V399 HydrophobicContact CD2-CG2 4.16Å; L394-V399 HydrophobicContact CB-CG2 4.1Å; S395-V399 PolarHBondContact O-N 3.48Å; S395-V399 VanDerWaalsContact O-N 3.09Å; W396-V399 PolarHBondContact O-N 2.99Å; R397-V399 PolarHBondContact O-N 3.39Å; V399-I402 PolarHBondContact O-N 2.94Å; V399-T403 VanDerWaalsContact O-CB 3.29Å; V399-T403 WeakPolarHBondContact O-CB 3.28Å; V399-T403 PolarHBondContact O-N 3.11Å; V399-T403 PolarHBondContact O-OG1 3.11Å
400	Q	98.1	Very high	95.2	Very high	5 Å²	5	28 Å²	28	2%	0.023	14%	0.144	C	C	.	.	H	α-helix	trans	-63.2	-45.1	174.6	-70.6	178.9	-16.8	0	0	112	P318 T320 L321 L343 W396 R397 I402 T403 L404 H512 W567	P318-Q400 PolarHBondContact O-NE2 3.27Å; T320-Q400 PolarHBondContact O-NE2 3.2Å; L321-Q400 HydrophobicContact CD1-CG 4.21Å; L343-Q400 HydrophobicContact CD2-CB 3.86Å; L343-Q400 HydrophobicContact CD2-CG 3.96Å; W396-Q400 PolarHBondContact O-N 2.77Å; R397-Q400 PolarHBondContact O-N 2.86Å; Q400-I402 PolarHBondContact O-N 2.68Å; Q400-T403 PolarHBondContact O-N 3.01Å; Q400-L404 PolarHBondContact O-N 2.79Å; Q400-H512 PolarHBondContact OE1-CE1 2.91Å; Q400-H512 PolarHBondContact OE1-NE2 3.1Å; Q400-W567 HydrophobicContact CB-CH2 3.83Å; Q400-W567 HydrophobicContact CB-CZ2 4.35Å
401	Y	97.5	Very high	95.1	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-59	-47.4	175.2	-96.2	-84.7	0	0	0	112.4	R397 D398 T403 L404 L405 W447 V450 E511 W567 P613	R397-Y401 WeakPolarHBondContact O-CD2 3.4Å; R397-Y401 PolarHBondContact O-N 3.27Å; D398-Y401 PolarHBondContact O-N 3.01Å; Y401-T403 VanDerWaalsContact C-N 3.29Å; Y401-T403 PolarHBondContact O-N 3.2Å; Y401-L404 WeakPolarHBondContact O-CG 3.34Å; Y401-L405 HydrophobicContact CD1-CD1 4.37Å; Y401-L405 VanDerWaalsContact O-CB 3.28Å; Y401-L405 WeakPolarHBondContact O-CB 3.43Å; Y401-L405 WeakPolarHBondContact O-CD1 3.49Å; Y401-L405 WeakPolarHBondContact O-CG 3.4Å; Y401-L405 PolarHBondContact O-N 3.09Å; Y401-W447 HydrophobicContact CD1-CH2 4.25Å; Y401-W447 HydrophobicContact CD1-CZ2 4.44Å; Y401-W447 HydrophobicContact CG-CH2 4.21Å; Y401-W447 HydrophobicContact CG-CZ2 4.04Å; Y401-V450 HydrophobicContact CD2-CG1 3.7Å; Y401-V450 HydrophobicContact CE2-CG1 3.81Å; Y401-V450 HydrophobicContact CG-CG1 4.24Å; Y401-E511 HydrophobicContact CE2-CG 3.75Å; Y401-E511 WeakPolarHBondContact CE2-OE1 3.43Å; Y401-E511 WeakPolarHBondContact OH-CG 3.49Å; Y401-E511 PolarHBondContact OH-OE1 3.44Å; Y401-W567 AromaticContact CD1-NE1 3.44Å; Y401-W567 AromaticContact CD2-CZ2 3.7Å; Y401-W567 HydrophobicContact CD2-CZ2 3.7Å; Y401-W567 AromaticContact CD2-NE1 3.95Å; Y401-W567 AromaticContact CE1-CD1 3.76Å; Y401-W567 AromaticContact CE1-NE1 3Å; Y401-W567 AromaticContact CE2-CE2 3.94Å; Y401-W567 AromaticContact CE2-CZ2 3.69Å; Y401-W567 HydrophobicContact CE2-CZ2 3.69Å; Y401-W567 AromaticContact CE2-NE1 3.57Å; Y401-W567 HydrophobicContact CG-CZ2 4.16Å; Y401-W567 AromaticContact CG-NE1 3.89Å; Y401-W567 AromaticContact CZ-CE2 3.88Å; Y401-W567 AromaticContact CZ-NE1 3.06Å; Y401-W567 PolarHBondContact OH-NE1 3.04Å; Y401-P613 HydrophobicContact CE1-CB 3.85Å; Y401-P613 HydrophobicContact CE1-CG 3.68Å; Y401-P613 HydrophobicContact CE2-CB 4.26Å; Y401-P613 WeakPolarHBondContact OH-CB 3.49Å; Y401-P613 VanDerWaalsContact OH-CG 3.24Å; Y401-P613 WeakPolarHBondContact OH-CG 3.33Å
402	I	98.1	Very high	95.1	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-63.6	-41.9	179.9	-69.2	166.1	0	0	0	109.8	L387 L394 D398 V399 Q400 L405 T406 M440 L443 W447	L387-I402 HydrophobicContact CD1-CD1 4.07Å; L387-I402 HydrophobicContact CD1-CG2 4.1Å; L387-I402 HydrophobicContact CD2-CB 4.25Å; L387-I402 HydrophobicContact CD2-CD1 4.25Å; L387-I402 HydrophobicContact CD2-CG2 3.93Å; L394-I402 HydrophobicContact CD1-CD1 3.85Å; L394-I402 HydrophobicContact CD2-CD1 3.9Å; D398-I402 WeakPolarHBondContact O-CB 3.26Å; D398-I402 VanDerWaalsContact O-CG1 3.28Å; D398-I402 WeakPolarHBondContact O-CG1 3.47Å; D398-I402 PolarHBondContact O-N 3.21Å; V399-I402 PolarHBondContact O-N 2.94Å; Q400-I402 PolarHBondContact O-N 2.68Å; I402-L405 PolarHBondContact O-N 3.21Å; I402-T406 HydrophobicContact CG2-CG2 4.34Å; I402-T406 WeakPolarHBondContact O-CB 3.33Å; I402-T406 WeakPolarHBondContact O-CG2 3.39Å; I402-T406 PolarHBondContact O-N 3.26Å; I402-T406 VanDerWaalsContact O-N 3.11Å; I402-T406 PolarHBondContact O-OG1 2.93Å; I402-M440 HydrophobicContact CG2-CB 4.1Å; I402-M440 HydrophobicContact CG2-CE 4.47Å; I402-M440 HydrophobicContact CG2-CG 4.08Å; I402-L443 HydrophobicContact CG1-CD2 4.35Å; I402-L443 HydrophobicContact CG1-CG 4.45Å; I402-L443 HydrophobicContact CG2-CB 4.45Å; I402-L443 HydrophobicContact CG2-CD2 4.34Å; I402-W447 HydrophobicContact CD1-CB 3.99Å; I402-W447 HydrophobicContact CD1-CD2 3.85Å; I402-W447 HydrophobicContact CD1-CE3 4.2Å; I402-W447 HydrophobicContact CD1-CG 3.76Å; I402-W447 HydrophobicContact CG1-CD2 3.73Å; I402-W447 HydrophobicContact CG1-CE3 3.67Å; I402-W447 HydrophobicContact CG1-CG 4.2Å; I402-W447 HydrophobicContact CG1-CH2 4.44Å; I402-W447 HydrophobicContact CG1-CZ2 4.5Å; I402-W447 HydrophobicContact CG1-CZ3 4.04Å
403	T	98.5	Very high	95.2	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-57.9	-53.1	179.2	-60.4	0	0	0	0	111.3	L321 L343 A344 V399 Q400 Y401 L405 T406 A407 M435 M440	L321-T403 HydrophobicContact CD1-CG2 4.44Å; L343-T403 HydrophobicContact CD2-CG2 4.01Å; L343-T403 HydrophobicContact CG-CG2 4.49Å; A344-T403 HydrophobicContact CB-CG2 3.65Å; V399-T403 VanDerWaalsContact O-CB 3.29Å; V399-T403 WeakPolarHBondContact O-CB 3.28Å; V399-T403 PolarHBondContact O-N 3.11Å; V399-T403 PolarHBondContact O-OG1 3.11Å; Q400-T403 PolarHBondContact O-N 3.01Å; Y401-T403 VanDerWaalsContact C-N 3.29Å; Y401-T403 PolarHBondContact O-N 3.2Å; T403-L405 PolarHBondContact O-N 3.44Å; T403-T406 PolarHBondContact O-N 2.88Å; T403-T406 PolarHBondContact O-OG1 3.5Å; T403-A407 WeakPolarHBondContact O-CB 3.15Å; T403-A407 PolarHBondContact O-N 2.86Å; T403-M435 HydrophobicContact CG2-CE 4.05Å; T403-M435 HydrophobicContact CG2-CG 4.28Å; T403-M435 HydrophobicContact CG2-SD 4.44Å; T403-M440 VanDerWaalsContact OG1-CE 3.31Å; T403-M440 WeakPolarHBondContact OG1-CE 3.4Å
404	L	97.1	Very high	95.4	Very high	7 Å²	7	27.2 Å²	27.2	4%	0.037	13%	0.131	C	C	.	.	H	α-helix	trans	-70.5	-31.1	-178	73.8	91.6	0	0	0	113.4	L343 Q400 Y401 T406 Y432 W567	L343-L404 HydrophobicContact CD1-CB 4.13Å; L343-L404 HydrophobicContact CD1-CD2 4.14Å; L343-L404 HydrophobicContact CG-CB 4.48Å; Q400-L404 PolarHBondContact O-N 2.79Å; Y401-L404 WeakPolarHBondContact O-CG 3.34Å; L404-T406 VanDerWaalsContact C-N 3.32Å; L404-Y432 HydrophobicContact CB-CD1 4.34Å; L404-Y432 HydrophobicContact CB-CD2 3.48Å; L404-Y432 VanDerWaalsContact CB-CD2 3.48Å; L404-Y432 HydrophobicContact CB-CE2 3.98Å; L404-Y432 HydrophobicContact CB-CG 3.68Å; L404-Y432 HydrophobicContact CD2-CE2 4.45Å; L404-W567 HydrophobicContact CD1-CG 4.5Å; L404-W567 HydrophobicContact CD2-CB 4.4Å; L404-W567 HydrophobicContact CD2-CD2 3.28Å; L404-W567 HydrophobicContact CD2-CE3 3.73Å; L404-W567 HydrophobicContact CD2-CG 3.6Å; L404-W567 HydrophobicContact CD2-CH2 4.21Å; L404-W567 HydrophobicContact CD2-CZ2 3.81Å; L404-W567 HydrophobicContact CD2-CZ3 4.17Å
405	L	96	Very high	95.1	Very high	34 Å²	34	27.3 Å²	27.3	18%	0.178	13%	0.133	C	C	.	.	H	α-helix	trans	-76.2	-21.1	-179	-71.4	172.5	0	0	0	113.1	Y401 I402 T403 L443 W447 I614 F633	Y401-L405 HydrophobicContact CD1-CD1 4.37Å; Y401-L405 VanDerWaalsContact O-CB 3.28Å; Y401-L405 WeakPolarHBondContact O-CB 3.43Å; Y401-L405 WeakPolarHBondContact O-CD1 3.49Å; Y401-L405 WeakPolarHBondContact O-CG 3.4Å; Y401-L405 PolarHBondContact O-N 3.09Å; I402-L405 PolarHBondContact O-N 3.21Å; T403-L405 PolarHBondContact O-N 3.44Å; L405-L443 HydrophobicContact CB-CD2 4.12Å; L405-L443 HydrophobicContact CD1-CD2 4.44Å; L405-W447 HydrophobicContact CD1-CH2 3.66Å; L405-W447 HydrophobicContact CD1-CZ3 3.74Å; L405-I614 HydrophobicContact CD1-CD1 3.77Å; L405-I614 HydrophobicContact CD1-CG1 4.2Å; L405-I614 HydrophobicContact CD2-CD1 4.1Å; L405-F633 HydrophobicContact CB-CE1 4.24Å; L405-F633 HydrophobicContact CB-CZ 4.27Å; L405-F633 HydrophobicContact CD1-CE1 4.39Å
406	T	96.5	Very high	94.9	Very high	3 Å²	3	33.4 Å²	33.4	2%	0.018	16%	0.164	C	C	.	.	H	α-helix	trans	-107.4	-14.5	-176.6	57.6	0	0	0	0	113.1	I402 T403 L404 K439 M440 L443	I402-T406 HydrophobicContact CG2-CG2 4.34Å; I402-T406 WeakPolarHBondContact O-CB 3.33Å; I402-T406 WeakPolarHBondContact O-CG2 3.39Å; I402-T406 PolarHBondContact O-N 3.26Å; I402-T406 VanDerWaalsContact O-N 3.11Å; I402-T406 PolarHBondContact O-OG1 2.93Å; T403-T406 PolarHBondContact O-N 2.88Å; T403-T406 PolarHBondContact O-OG1 3.5Å; L404-T406 VanDerWaalsContact C-N 3.32Å; T406-K439 HydrophobicContact CG2-CB 3.89Å; T406-M440 HydrophobicContact CG2-CG 4.39Å; T406-M440 WeakPolarHBondContact OG1-CG 3.38Å; T406-L443 HydrophobicContact CG2-CB 4.05Å; T406-L443 HydrophobicContact CG2-CD2 3.6Å; T406-L443 HydrophobicContact CG2-CG 4.48Å
407	A	97.3	Very high	94.9	Very high	14 Å²	14	34.7 Å²	34.7	12%	0.116	17%	0.17	C	C	.	.			trans	-51.6	138.6	175.7	0	0	0	0	0	112.2	T403 P409 Y432 L434	T403-A407 WeakPolarHBondContact O-CB 3.15Å; T403-A407 PolarHBondContact O-N 2.86Å; A407-P409 WeakPolarHBondContact O-CD 3.47Å; A407-Y432 WeakPolarHBondContact CB-O 3.22Å; A407-L434 CarbonylContact C-O 3.48Å; A407-L434 WeakPolarHBondContact CA-O 3.45Å
408	N	95.6	Very high	94.8	Very high	19 Å²	19	36.4 Å²	36.4	10%	0.102	18%	0.184	C	C	.	.	B	Isolated β-bridge	trans	-104.5	107.1	-175.9	-177.4	10.7	0	0	0	110.4	K410 P411 F412 L434	N408-K410 VanDerWaalsContact C-N 3.32Å; N408-K410 PolarHBondContact O-N 3.41Å; N408-K410 WeakPolarHBondContact OD1-CB 3.41Å; N408-K410 WeakPolarHBondContact OD1-CG 3.4Å; N408-K410 PolarHBondContact OD1-N 3.41Å; N408-P411 WeakPolarHBondContact O-CD 3.43Å; N408-F412 WeakPolarHBondContact O-CE2 3.38Å; N408-L434 HydrophobicContact CB-CB 4.49Å; N408-L434 PolarHBondContact N-O 3.41Å; N408-L434 PolarHBondContact O-N 3.36Å
409	P	95.4	Very high	94.8	Very high	26 Å²	26	42.7 Å²	42.7	17%	0.169	21%	0.211	C	C	.	.			trans	-81.3	-8.8	179.9	32	-35.9	0	0	0	113.6	A407 P411 F412 F417 E425	A407-P409 WeakPolarHBondContact O-CD 3.47Å; P409-P411 VanDerWaalsContact C-CD 3.43Å; P409-F412 WeakPolarHBondContact O-CD2 3.41Å; P409-F417 HydrophobicContact CB-CD1 3.71Å; P409-F417 HydrophobicContact CB-CD2 4.23Å; P409-F417 HydrophobicContact CB-CE1 3.56Å; P409-F417 HydrophobicContact CB-CE2 4.1Å; P409-F417 HydrophobicContact CB-CG 4.06Å; P409-F417 HydrophobicContact CB-CZ 3.77Å; P409-E425 HydrophobicContact CB-CB 4.33Å; P409-E425 HydrophobicContact CG-CB 4.28Å; P409-E425 VanDerWaalsContact CG-OE2 3.23Å; P409-E425 WeakPolarHBondContact CG-OE2 3.34Å
410	K	92.8	Very high	94.6	Very high	157 Å²	157	42.9 Å²	42.9	68%	0.683	21%	0.212	S	C	*	.	S	Bend	trans	-67	-32.4	-174.5	-61.4	-180	179.5	179.4	0	116.6	Y137 N408 F412	Y137-K410 HydrophobicContact CE1-CB 4.27Å; N408-K410 VanDerWaalsContact C-N 3.32Å; N408-K410 PolarHBondContact O-N 3.41Å; N408-K410 WeakPolarHBondContact OD1-CB 3.41Å; N408-K410 WeakPolarHBondContact OD1-CG 3.4Å; N408-K410 PolarHBondContact OD1-N 3.41Å; K410-F412 VanDerWaalsContact C-N 3.34Å; K410-F412 PolarHBondContact O-N 3.49Å
411	P	92.2	Very high	94.5	Very high	5 Å²	5	45.1 Å²	45.1	3%	0.032	23%	0.231	C	C	.	.	S	Bend	trans	-65.6	-34.4	-172.3	-24.5	35.1	0	0	0	114.1	Y137 N330 N408 P409 L434	Y137-P411 HydrophobicContact CD1-CG 3.98Å; Y137-P411 HydrophobicContact CD2-CB 3.83Å; Y137-P411 HydrophobicContact CD2-CG 4.08Å; Y137-P411 HydrophobicContact CE2-CB 4.46Å; Y137-P411 HydrophobicContact CG-CB 3.92Å; Y137-P411 HydrophobicContact CG-CG 3.71Å; N330-P411 WeakPolarHBondContact CB-O 3.33Å; N330-P411 PolarHBondContact ND2-O 3.33Å; N408-P411 WeakPolarHBondContact O-CD 3.43Å; P409-P411 VanDerWaalsContact C-CD 3.43Å; P411-L434 HydrophobicContact CG-CB 4.26Å; P411-L434 HydrophobicContact CG-CD2 3.98Å
412	F	94.3	Very high	94.3	Very high	18 Å²	18	48.5 Å²	48.5	8%	0.079	25%	0.252	C	S	.	.			trans	-75.3	126	-165.1	-48.3	-88.5	0	0	0	112.9	V326 N408 P409 K410 F417 Y430 L434	V326-F412 HydrophobicContact CB-CD1 4.06Å; V326-F412 HydrophobicContact CB-CE1 3.7Å; V326-F412 HydrophobicContact CG1-CD1 4.48Å; V326-F412 HydrophobicContact CG1-CE1 3.78Å; V326-F412 HydrophobicContact CG2-CD1 3.77Å; V326-F412 HydrophobicContact CG2-CE1 3.9Å; N408-F412 WeakPolarHBondContact O-CE2 3.38Å; P409-F412 WeakPolarHBondContact O-CD2 3.41Å; K410-F412 VanDerWaalsContact C-N 3.34Å; K410-F412 PolarHBondContact O-N 3.49Å; F412-F417 HydrophobicContact CB-CE2 3.95Å; F412-F417 AromaticContact CD2-CE2 3.43Å; F412-F417 HydrophobicContact CD2-CE2 3.43Å; F412-F417 VanDerWaalsContact CD2-CE2 3.43Å; F412-F417 AromaticContact CD2-CZ 3.46Å; F412-F417 HydrophobicContact CD2-CZ 3.46Å; F412-F417 VanDerWaalsContact CD2-CZ 3.46Å; F412-F417 HydrophobicContact CE2-CE2 4.2Å; F412-F417 AromaticContact CE2-CZ 3.74Å; F412-F417 HydrophobicContact CE2-CZ 3.74Å; F412-F417 AromaticContact CG-CE2 3.93Å; F412-F417 HydrophobicContact CG-CE2 3.93Å; F412-F417 HydrophobicContact CG-CZ 4.22Å; F412-Y430 HydrophobicContact CB-CD2 3.98Å; F412-Y430 HydrophobicContact CB-CE2 3.86Å; F412-Y430 AromaticContact CD1-CD1 3.58Å; F412-Y430 HydrophobicContact CD1-CD1 3.58Å; F412-Y430 AromaticContact CD1-CD2 3.41Å; F412-Y430 HydrophobicContact CD1-CD2 3.41Å; F412-Y430 VanDerWaalsContact CD1-CD2 3.41Å; F412-Y430 AromaticContact CD1-CE1 3.69Å; F412-Y430 HydrophobicContact CD1-CE1 3.69Å; F412-Y430 AromaticContact CD1-CE2 3.53Å; F412-Y430 HydrophobicContact CD1-CE2 3.53Å; F412-Y430 AromaticContact CD1-CG 3.42Å; F412-Y430 HydrophobicContact CD1-CG 3.42Å; F412-Y430 VanDerWaalsContact CD1-CG 3.42Å; F412-Y430 AromaticContact CD1-CZ 3.64Å; F412-Y430 HydrophobicContact CD2-CD2 4.4Å; F412-Y430 AromaticContact CE1-CD1 3.39Å; F412-Y430 HydrophobicContact CE1-CD1 3.39Å; F412-Y430 AromaticContact CE1-CD2 3.93Å; F412-Y430 HydrophobicContact CE1-CD2 3.93Å; F412-Y430 AromaticContact CE1-CE1 3.86Å; F412-Y430 HydrophobicContact CE1-CE1 3.86Å; F412-Y430 HydrophobicContact CE1-CE2 4.34Å; F412-Y430 AromaticContact CE1-CG 3.41Å; F412-Y430 HydrophobicContact CE1-CG 3.41Å; F412-Y430 VanDerWaalsContact CE1-CG 3.41Å; F412-Y430 AromaticContact CG-CD2 3.68Å; F412-Y430 HydrophobicContact CG-CD2 3.68Å; F412-Y430 AromaticContact CG-CE2 3.92Å; F412-Y430 HydrophobicContact CG-CE2 3.92Å; F412-Y430 HydrophobicContact CG-CG 4.02Å; F412-Y430 HydrophobicContact CZ-CD1 4.29Å; F412-Y430 HydrophobicContact CZ-CG 4.03Å; F412-L434 HydrophobicContact CE2-CB 4.11Å; F412-L434 HydrophobicContact CZ-CB 3.81Å; F412-L434 VanDerWaalsContact CZ-N 3.34Å
413	K	92.2	Very high	94	Very high	153 Å²	153	50.8 Å²	50.8	67%	0.665	28%	0.275	S	S	*	.	S	Bend	trans	-80.7	-29	178.7	-67	174.5	-179	160.7	0	113.1	S329 N330 T331	S329-K413 WeakPolarHBondContact O-CD 3.25Å; S329-K413 VanDerWaalsContact O-CE 3.23Å; S329-K413 WeakPolarHBondContact O-CE 3.23Å; S329-K413 PolarHBondContact O-NZ 2.83Å; N330-K413 PolarHBondContact O-N 3.31Å; T331-K413 HydrophobicContact CG2-CB 4.22Å; T331-K413 HydrophobicContact CG2-CD 4.14Å
414	D	92.1	Very high	93.8	Very high	63 Å²	63	52.9 Å²	52.9	34%	0.337	28%	0.283	S	S	.	.	S	Bend	trans	-118.6	20.4	-175.5	61.9	-9.5	0	0	0	112.6	T331 R332 N416 Y430	T331-D414 WeakPolarHBondContact CA-OD1 3.45Å; R332-D414 WeakPolarHBondContact CB-OD2 3.23Å; R332-D414 PolarHBondContact N-OD1 3.08Å; R332-D414 PolarHBondContact N-OD2 3.24Å; D414-N416 VanDerWaalsContact C-N 3.34Å; D414-N416 PolarHBondContact O-N 3.29Å; D414-Y430 WeakPolarHBondContact OD1-CE2 3.37Å; D414-Y430 PolarHBondContact OD1-OH 2.98Å
415	G	86.5	Confident	93.7	Very high	4 Å²	4	56.3 Å²	56.3	4%	0.041	30%	0.298	C	S	.	.			trans	-70.5	-23.6	-174.3	0	0	0	0	0	115.7	F417 S427	G415-F417 PolarHBondContact O-N 3.03Å; G415-S427 VanDerWaalsContact O-CB 3.27Å; G415-S427 WeakPolarHBondContact O-CB 3.37Å; G415-S427 PolarHBondContact O-OG 3.14Å
416	N	88.3	Confident	93.7	Very high	146 Å²	146	55.3 Å²	55.3	78%	0.781	29%	0.292	S	S	*	.			trans	41.4	52	-176	-164.6	26.1	0	0	0	112.5	D414 T418	D414-N416 VanDerWaalsContact C-N 3.34Å; D414-N416 PolarHBondContact O-N 3.29Å; N416-T418 PolarHBondContact O-N 2.74Å
417	F	94.4	Very high	93.7	Very high	47 Å²	47	55.3 Å²	55.3	21%	0.206	29%	0.293	C	S	.	.			trans	-64.6	131.5	-175.9	-77.5	-94.7	0	0	0	110.7	P409 F412 G415 E425 Y426 Y430	P409-F417 HydrophobicContact CB-CD1 3.71Å; P409-F417 HydrophobicContact CB-CD2 4.23Å; P409-F417 HydrophobicContact CB-CE1 3.56Å; P409-F417 HydrophobicContact CB-CE2 4.1Å; P409-F417 HydrophobicContact CB-CG 4.06Å; P409-F417 HydrophobicContact CB-CZ 3.77Å; F412-F417 HydrophobicContact CB-CE2 3.95Å; F412-F417 AromaticContact CD2-CE2 3.43Å; F412-F417 HydrophobicContact CD2-CE2 3.43Å; F412-F417 VanDerWaalsContact CD2-CE2 3.43Å; F412-F417 AromaticContact CD2-CZ 3.46Å; F412-F417 HydrophobicContact CD2-CZ 3.46Å; F412-F417 VanDerWaalsContact CD2-CZ 3.46Å; F412-F417 HydrophobicContact CE2-CE2 4.2Å; F412-F417 AromaticContact CE2-CZ 3.74Å; F412-F417 HydrophobicContact CE2-CZ 3.74Å; F412-F417 AromaticContact CG-CE2 3.93Å; F412-F417 HydrophobicContact CG-CE2 3.93Å; F412-F417 HydrophobicContact CG-CZ 4.22Å; G415-F417 PolarHBondContact O-N 3.03Å; F417-E425 HydrophobicContact CB-CB 4.31Å; F417-E425 HydrophobicContact CD1-CB 4.06Å; F417-Y426 CarbonylContact C-O 3.54Å; F417-Y426 VanDerWaalsContact CA-O 3.31Å; F417-Y426 WeakPolarHBondContact CA-O 3.05Å; F417-Y430 HydrophobicContact CE2-CD2 4.4Å; F417-Y430 HydrophobicContact CZ-CD2 4.46Å
418	T	93.5	Very high	93.5	Very high	60 Å²	60	56.5 Å²	56.5	37%	0.368	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	154	173.6	55.2	0	0	0	0	109.2	N416 E425 Y426	N416-T418 PolarHBondContact O-N 2.74Å; T418-E425 CarbonylContact O-C 3.52Å; T418-E425 VanDerWaalsContact O-CA 3.31Å; T418-E425 WeakPolarHBondContact O-CA 3.33Å; T418-Y426 PolarHBondContact N-O 2.83Å; T418-Y426 VanDerWaalsContact O-CD1 3.25Å; T418-Y426 WeakPolarHBondContact O-CD1 3.47Å; T418-Y426 PolarHBondContact O-N 3.01Å; T418-Y426 WeakPolarHBondContact OG1-CE1 3.41Å; T418-Y426 VanDerWaalsContact OG1-CE2 3.28Å; T418-Y426 WeakPolarHBondContact OG1-CE2 3.24Å; T418-Y426 PolarHBondContact OG1-OH 3.09Å
419	K	95.6	Very high	93.4	Very high	135 Å²	135	56.5 Å²	56.5	59%	0.587	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.6	128.8	178.3	-74	-179.2	-179	175.9	0	109.9	R424 E425	K419-R424 WeakPolarHBondContact CA-O 3.04Å; K419-E425 HydrophobicContact CD-CG 4.17Å; K419-E425 WeakPolarHBondContact CE-OE1 3.18Å; K419-E425 HydrophobicContact CG-CG 3.62Å; K419-E425 IonicContact NZ-OE1 3.67Å
420	N	95.8	Very high	93.5	Very high	5 Å²	5	55.2 Å²	55.2	3%	0.027	29%	0.288	C	S	.	.			trans	-73.9	174.6	170.3	81	-3.3	0	0	0	110.5	V422 G423 R424 Y426 T537 Q565 W567 E569	N420-V422 PolarHBondContact O-N 2.74Å; N420-V422 VanDerWaalsContact O-N 3.14Å; N420-V422 WeakPolarHBondContact OD1-CG2 3.41Å; N420-V422 PolarHBondContact OD1-N 2.03Å; N420-G423 WeakPolarHBondContact O-CA 2.97Å; N420-G423 PolarHBondContact O-N 2.79Å; N420-G423 PolarHBondContact OD1-N 3.45Å; N420-R424 PolarHBondContact N-O 3.22Å; N420-R424 WeakPolarHBondContact OD1-CB 3.35Å; N420-R424 PolarHBondContact OD1-N 3.33Å; N420-Y426 HydrophobicContact CB-CD1 4Å; N420-Y426 HydrophobicContact CB-CE1 3.73Å; N420-T537 WeakPolarHBondContact CA-OG1 3.17Å; N420-T537 HydrophobicContact CB-CG2 3.73Å; N420-Q565 WeakPolarHBondContact CB-O 3.46Å; N420-Q565 PolarHBondContact ND2-O 3.15Å; N420-W567 PolarHBondContact ND2-O 2.83Å; N420-E569 VanDerWaalsContact CB-OE1 3.3Å; N420-E569 WeakPolarHBondContact CB-OE1 3.17Å
421	A	94.4	Very high	93.7	Very high	52 Å²	52	47.9 Å²	47.9	43%	0.43	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-17.9	-171.5	0	0	0	0	0	113.7	G423 T537 E569	A421-G423 VanDerWaalsContact C-N 3.34Å; A421-T537 PolarHBondContact N-OG1 2.91Å; A421-E569 HydrophobicContact CB-CG 4.09Å; A421-E569 PolarHBondContact N-OE1 2.81Å
422	V	93.3	Very high	94	Very high	71 Å²	71	48 Å²	48	43%	0.43	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	6.6	171.6	-62.5	0	0	0	0	113.2	N420 R424 W567 E569	N420-V422 PolarHBondContact O-N 2.74Å; N420-V422 VanDerWaalsContact O-N 3.14Å; N420-V422 WeakPolarHBondContact OD1-CG2 3.41Å; N420-V422 PolarHBondContact OD1-N 2.03Å; V422-R424 HydrophobicContact CG2-CG 4.18Å; V422-W567 WeakPolarHBondContact CG2-O 3.38Å; V422-E569 HydrophobicContact CG1-CG 4.11Å; V422-E569 HydrophobicContact CG2-CG 4.47Å
423	G	92.7	Very high	94.1	Very high	47 Å²	47	47.1 Å²	47.1	49%	0.485	25%	0.253	S	S	.	.	S	Bend	trans	84.6	12.9	172.8	0	0	0	0	0	115.3	N420 A421	N420-G423 WeakPolarHBondContact O-CA 2.97Å; N420-G423 PolarHBondContact O-N 2.79Å; N420-G423 PolarHBondContact OD1-N 3.45Å; A421-G423 VanDerWaalsContact C-N 3.34Å
424	R	93.8	Very high	94.4	Very high	45 Å²	45	39.9 Å²	39.9	17%	0.17	22%	0.221	C	C	.	.			trans	-84.7	132.7	177.2	-64.6	-179.4	176.3	119.2	3.4	110.7	K419 N420 V422 Y432 W567	K419-R424 WeakPolarHBondContact CA-O 3.04Å; N420-R424 PolarHBondContact N-O 3.22Å; N420-R424 WeakPolarHBondContact OD1-CB 3.35Å; N420-R424 PolarHBondContact OD1-N 3.33Å; V422-R424 HydrophobicContact CG2-CG 4.18Å; R424-Y432 HydrophobicContact CB-CD1 4.29Å; R424-Y432 HydrophobicContact CB-CE1 3.78Å; R424-W567 VanDerWaalsContact NH1-C 3.28Å; R424-W567 PolarHBondContact NH1-O 3.49Å
425	E	95.6	Very high	94.7	Very high	78 Å²	78	36.9 Å²	36.9	36%	0.364	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	129.2	176.9	-68.8	177.4	143.8	0	0	110.1	P409 F417 T418 K419 Y432	P409-E425 HydrophobicContact CB-CB 4.33Å; P409-E425 HydrophobicContact CG-CB 4.28Å; P409-E425 VanDerWaalsContact CG-OE2 3.23Å; P409-E425 WeakPolarHBondContact CG-OE2 3.34Å; F417-E425 HydrophobicContact CB-CB 4.31Å; F417-E425 HydrophobicContact CD1-CB 4.06Å; T418-E425 CarbonylContact O-C 3.52Å; T418-E425 VanDerWaalsContact O-CA 3.31Å; T418-E425 WeakPolarHBondContact O-CA 3.33Å; K419-E425 HydrophobicContact CD-CG 4.17Å; K419-E425 WeakPolarHBondContact CE-OE1 3.18Å; K419-E425 HydrophobicContact CG-CG 3.62Å; K419-E425 IonicContact NZ-OE1 3.67Å; E425-Y432 VanDerWaalsContact O-CD1 3.25Å; E425-Y432 WeakPolarHBondContact O-CD1 3.17Å
426	Y	96.2	Very high	95.2	Very high	13 Å²	13	37.2 Å²	37.2	5%	0.051	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	157.9	175.6	69.8	-85.7	0	0	0	111.3	F417 T418 N420 G431 T537 L538 Q565	F417-Y426 CarbonylContact C-O 3.54Å; F417-Y426 VanDerWaalsContact CA-O 3.31Å; F417-Y426 WeakPolarHBondContact CA-O 3.05Å; T418-Y426 PolarHBondContact N-O 2.83Å; T418-Y426 VanDerWaalsContact O-CD1 3.25Å; T418-Y426 WeakPolarHBondContact O-CD1 3.47Å; T418-Y426 PolarHBondContact O-N 3.01Å; T418-Y426 WeakPolarHBondContact OG1-CE1 3.41Å; T418-Y426 VanDerWaalsContact OG1-CE2 3.28Å; T418-Y426 WeakPolarHBondContact OG1-CE2 3.24Å; T418-Y426 PolarHBondContact OG1-OH 3.09Å; N420-Y426 HydrophobicContact CB-CD1 4Å; N420-Y426 HydrophobicContact CB-CE1 3.73Å; Y426-G431 CarbonylContact C-O 3.51Å; Y426-G431 WeakPolarHBondContact CA-O 3.31Å; Y426-T537 HydrophobicContact CE1-CG2 4Å; Y426-T537 VanDerWaalsContact OH-CG2 3.31Å; Y426-T537 WeakPolarHBondContact OH-CG2 3.43Å; Y426-L538 PolarHBondContact OH-O 2.79Å; Y426-Q565 HydrophobicContact CD2-CB 3.79Å; Y426-Q565 HydrophobicContact CD2-CG 3.46Å; Y426-Q565 VanDerWaalsContact CD2-CG 3.46Å; Y426-Q565 HydrophobicContact CE2-CB 3.82Å; Y426-Q565 HydrophobicContact CE2-CG 3.78Å; Y426-Q565 HydrophobicContact CG-CB 4.16Å; Y426-Q565 HydrophobicContact CG-CG 4.1Å
427	S	95.9	Very high	95.7	Very high	4 Å²	4	30.3 Å²	30.3	3%	0.028	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-132.8	143.6	178.5	175.4	0	0	0	0	110.2	G415 L429 Y430 G431	G415-S427 VanDerWaalsContact O-CB 3.27Å; G415-S427 WeakPolarHBondContact O-CB 3.37Å; G415-S427 PolarHBondContact O-OG 3.14Å; S427-L429 PolarHBondContact O-N 2.81Å; S427-L429 PolarHBondContact OG-N 3.47Å; S427-L429 VanDerWaalsContact OG-N 3.13Å; S427-Y430 PolarHBondContact OG-N 3.24Å; S427-G431 PolarHBondContact N-O 2.83Å; S427-G431 WeakPolarHBondContact O-CA 3.25Å; S427-G431 PolarHBondContact O-N 3.32Å; S427-G431 VanDerWaalsContact O-N 3.08Å
428	Q	92.8	Very high	95.7	Very high	38 Å²	38	28 Å²	28	18%	0.178	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-17.6	171.8	-163.4	68.3	20.3	0	0	112.7	K338 C339 V540	K338-Q428 WeakPolarHBondContact CA-O 3.33Å; K338-Q428 HydrophobicContact CB-CG 3.93Å; K338-Q428 HydrophobicContact CG-CG 4.39Å; C339-Q428 PolarHBondContact N-O 3.02Å; Q428-V540 PolarHBondContact NE2-O 3.42Å; Q428-V540 PolarHBondContact OE1-O 3.27Å
429	L	94.5	Very high	95.8	Very high	19 Å²	19	27.5 Å²	27.5	10%	0.099	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-43.3	179.4	-66.4	170.5	0	0	0	111.5	S324 R332 L336 K338 S427	S324-L429 WeakPolarHBondContact CB-O 3.49Å; S324-L429 PolarHBondContact OG-O 3.33Å; R332-L429 HydrophobicContact CB-CD1 4.49Å; R332-L429 HydrophobicContact CG-CD1 4.46Å; R332-L429 HydrophobicContact CG-CD2 4.4Å; L336-L429 HydrophobicContact CD2-CB 4.27Å; L336-L429 HydrophobicContact CD2-CD2 4.38Å; K338-L429 HydrophobicContact CG-CD2 3.51Å; K338-L429 HydrophobicContact CG-CG 4.46Å; S427-L429 PolarHBondContact O-N 2.81Å; S427-L429 PolarHBondContact OG-N 3.47Å; S427-L429 VanDerWaalsContact OG-N 3.13Å
430	Y	96.8	Very high	95.9	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.7	5.6	-164.3	-55.5	-60.2	0	0	0	115	G325 V326 R332 L336 S345 F412 D414 F417 S427 Y432 G433	G325-Y430 WeakPolarHBondContact O-CE1 3.38Å; V326-Y430 HydrophobicContact CB-CE1 4.07Å; V326-Y430 HydrophobicContact CG2-CE1 4.4Å; R332-Y430 WeakPolarHBondContact CA-OH 3.28Å; R332-Y430 WeakPolarHBondContact CB-OH 3.4Å; R332-Y430 PolarHBondContact N-OH 2.72Å; L336-Y430 HydrophobicContact CD2-CD1 4.25Å; L336-Y430 HydrophobicContact CD2-CE1 3.84Å; S345-Y430 VanDerWaalsContact OG-C 3.3Å; S345-Y430 WeakPolarHBondContact OG-CA 3.46Å; S345-Y430 WeakPolarHBondContact OG-CB 3.36Å; S345-Y430 PolarHBondContact OG-O 3.48Å; F412-Y430 HydrophobicContact CB-CD2 3.98Å; F412-Y430 HydrophobicContact CB-CE2 3.86Å; F412-Y430 AromaticContact CD1-CD1 3.58Å; F412-Y430 HydrophobicContact CD1-CD1 3.58Å; F412-Y430 AromaticContact CD1-CD2 3.41Å; F412-Y430 HydrophobicContact CD1-CD2 3.41Å; F412-Y430 VanDerWaalsContact CD1-CD2 3.41Å; F412-Y430 AromaticContact CD1-CE1 3.69Å; F412-Y430 HydrophobicContact CD1-CE1 3.69Å; F412-Y430 AromaticContact CD1-CE2 3.53Å; F412-Y430 HydrophobicContact CD1-CE2 3.53Å; F412-Y430 AromaticContact CD1-CG 3.42Å; F412-Y430 HydrophobicContact CD1-CG 3.42Å; F412-Y430 VanDerWaalsContact CD1-CG 3.42Å; F412-Y430 AromaticContact CD1-CZ 3.64Å; F412-Y430 HydrophobicContact CD2-CD2 4.4Å; F412-Y430 AromaticContact CE1-CD1 3.39Å; F412-Y430 HydrophobicContact CE1-CD1 3.39Å; F412-Y430 AromaticContact CE1-CD2 3.93Å; F412-Y430 HydrophobicContact CE1-CD2 3.93Å; F412-Y430 AromaticContact CE1-CE1 3.86Å; F412-Y430 HydrophobicContact CE1-CE1 3.86Å; F412-Y430 HydrophobicContact CE1-CE2 4.34Å; F412-Y430 AromaticContact CE1-CG 3.41Å; F412-Y430 HydrophobicContact CE1-CG 3.41Å; F412-Y430 VanDerWaalsContact CE1-CG 3.41Å; F412-Y430 AromaticContact CG-CD2 3.68Å; F412-Y430 HydrophobicContact CG-CD2 3.68Å; F412-Y430 AromaticContact CG-CE2 3.92Å; F412-Y430 HydrophobicContact CG-CE2 3.92Å; F412-Y430 HydrophobicContact CG-CG 4.02Å; F412-Y430 HydrophobicContact CZ-CD1 4.29Å; F412-Y430 HydrophobicContact CZ-CG 4.03Å; D414-Y430 WeakPolarHBondContact OD1-CE2 3.37Å; D414-Y430 PolarHBondContact OD1-OH 2.98Å; F417-Y430 HydrophobicContact CE2-CD2 4.4Å; F417-Y430 HydrophobicContact CZ-CD2 4.46Å; S427-Y430 PolarHBondContact OG-N 3.24Å; Y430-Y432 PolarHBondContact O-N 2.73Å; Y430-G433 PolarHBondContact O-N 2.86Å; Y430-G433 VanDerWaalsContact O-N 3.11Å
431	G	96.9	Very high	96	Very high	3 Å²	3	20.9 Å²	20.9	3%	0.031	12%	0.123	C	C	.	.	B	Isolated β-bridge	trans	59.4	-134.4	-172.8	0	0	0	0	0	110.8	T342 Y426 S427 G433	T342-G431 VanDerWaalsContact O-CA 3.24Å; T342-G431 WeakPolarHBondContact O-CA 3.35Å; Y426-G431 CarbonylContact C-O 3.51Å; Y426-G431 WeakPolarHBondContact CA-O 3.31Å; S427-G431 PolarHBondContact N-O 2.83Å; S427-G431 WeakPolarHBondContact O-CA 3.25Å; S427-G431 PolarHBondContact O-N 3.32Å; S427-G431 VanDerWaalsContact O-N 3.08Å; G431-G433 VanDerWaalsContact C-N 3.26Å; G431-G433 PolarHBondContact O-N 2.88Å
432	Y	97.9	Very high	96.1	Very high	7 Å²	7	20 Å²	20	3%	0.027	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-5.3	176.5	-72.7	-81.9	0	0	0	114.1	L343 L404 A407 R424 E425 Y430 V564 Q565 W567	L343-Y432 HydrophobicContact CD1-CD2 4.13Å; L343-Y432 HydrophobicContact CD1-CE2 4.23Å; L343-Y432 WeakPolarHBondContact O-CD2 3.29Å; L343-Y432 PolarHBondContact O-N 3.45Å; L404-Y432 HydrophobicContact CB-CD1 4.34Å; L404-Y432 HydrophobicContact CB-CD2 3.48Å; L404-Y432 VanDerWaalsContact CB-CD2 3.48Å; L404-Y432 HydrophobicContact CB-CE2 3.98Å; L404-Y432 HydrophobicContact CB-CG 3.68Å; L404-Y432 HydrophobicContact CD2-CE2 4.45Å; A407-Y432 WeakPolarHBondContact CB-O 3.22Å; R424-Y432 HydrophobicContact CB-CD1 4.29Å; R424-Y432 HydrophobicContact CB-CE1 3.78Å; E425-Y432 VanDerWaalsContact O-CD1 3.25Å; E425-Y432 WeakPolarHBondContact O-CD1 3.17Å; Y430-Y432 PolarHBondContact O-N 2.73Å; Y432-V564 HydrophobicContact CE2-CG2 4.25Å; Y432-V564 PolarHBondContact OH-O 2.61Å; Y432-Q565 PolarHBondContact OH-O 3.16Å; Y432-W567 WeakPolarHBondContact OH-CB 3.36Å
433	G	97.6	Very high	96.2	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.088	C	C	.	.			trans	123.4	-164	175	0	0	0	0	0	114.2	S345 Y430 G431	S345-G433 PolarHBondContact N-O 2.84Å; Y430-G433 PolarHBondContact O-N 2.86Å; Y430-G433 VanDerWaalsContact O-N 3.11Å; G431-G433 VanDerWaalsContact C-N 3.26Å; G431-G433 PolarHBondContact O-N 2.88Å
434	L	97.9	Very high	96.3	Very high	1 Å²	1	14.4 Å²	14.4	1%	0.005	7%	0.065	C	C	.	.	B	Isolated β-bridge	trans	-76.3	129.2	-175.1	-175.6	74.9	0	0	0	110.3	M139 V326 S345 Y347 A407 N408 P411 F412 D436	M139-L434 HydrophobicContact CG-CD1 4.13Å; M139-L434 HydrophobicContact CG-CD2 4.44Å; M139-L434 HydrophobicContact CG-CG 4.29Å; V326-L434 HydrophobicContact CG1-CD1 3.92Å; S345-L434 CarbonylContact O-C 3.52Å; S345-L434 WeakPolarHBondContact O-CA 3.38Å; Y347-L434 HydrophobicContact CD2-CD1 3.99Å; Y347-L434 HydrophobicContact CD2-CD2 4.29Å; Y347-L434 HydrophobicContact CE2-CD1 3.92Å; Y347-L434 HydrophobicContact CE2-CD2 3.48Å; Y347-L434 VanDerWaalsContact CE2-CD2 3.48Å; Y347-L434 HydrophobicContact CE2-CG 4.35Å; Y347-L434 HydrophobicContact CG-CD1 4.43Å; A407-L434 CarbonylContact C-O 3.48Å; A407-L434 WeakPolarHBondContact CA-O 3.45Å; N408-L434 HydrophobicContact CB-CB 4.49Å; N408-L434 PolarHBondContact N-O 3.41Å; N408-L434 PolarHBondContact O-N 3.36Å; P411-L434 HydrophobicContact CG-CB 4.26Å; P411-L434 HydrophobicContact CG-CD2 3.98Å; F412-L434 HydrophobicContact CE2-CB 4.11Å; F412-L434 HydrophobicContact CZ-CB 3.81Å; F412-L434 VanDerWaalsContact CZ-N 3.34Å; L434-D436 PolarHBondContact O-N 3.1Å
435	M	98.5	Very high	96.3	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.065	C	C	.	.			trans	-59.7	135.3	175.8	-66.6	-177.1	73	0	0	111.4	M139 A344 S345 T346 A380 I383 I384 T403 M440	M139-M435 WeakPolarHBondContact CA-O 3.48Å; A344-M435 HydrophobicContact CB-CG 3.76Å; A344-M435 HydrophobicContact CB-SD 4.47Å; S345-M435 PolarHBondContact O-N 3.12Å; T346-M435 HydrophobicContact CG2-CB 4.35Å; T346-M435 HydrophobicContact CG2-CG 4.27Å; T346-M435 HydrophobicContact CG2-SD 3.83Å; A380-M435 HydrophobicContact CB-CE 4.08Å; A380-M435 HydrophobicContact CB-SD 3.43Å; A380-M435 WeakPolarHBondContact CB-SD 3.46Å; I383-M435 HydrophobicContact CB-CE 4.12Å; I383-M435 HydrophobicContact CD1-CB 3.83Å; I383-M435 HydrophobicContact CG2-CE 3.97Å; I384-M435 HydrophobicContact CG1-CE 4.22Å; T403-M435 HydrophobicContact CG2-CE 4.05Å; T403-M435 HydrophobicContact CG2-CG 4.28Å; T403-M435 HydrophobicContact CG2-SD 4.44Å; M435-M440 HydrophobicContact CB-SD 4.49Å; M435-M440 HydrophobicContact CE-CE 3.77Å; M435-M440 HydrophobicContact CE-SD 3.65Å
436	D	97.5	Very high	96.1	Very high	11 Å²	11	10.9 Å²	10.9	6%	0.059	5%	0.051	C	C	.	.			trans	-122.5	97.5	-176.6	-174.1	-43.2	0	0	0	109	N140 L434 G438 K439 M440	N140-D436 WeakPolarHBondContact CB-OD1 3.45Å; N140-D436 PolarHBondContact ND2-OD1 3.46Å; L434-D436 PolarHBondContact O-N 3.1Å; D436-G438 PolarHBondContact O-N 3.25Å; D436-G438 PolarHBondContact OD1-N 2.95Å; D436-K439 HydrophobicContact CB-CB 4.11Å; D436-K439 HydrophobicContact CB-CD 4.09Å; D436-K439 HydrophobicContact CB-CG 4.34Å; D436-K439 PolarHBondContact O-N 2.85Å; D436-K439 WeakPolarHBondContact OD1-CG 3.31Å; D436-K439 PolarHBondContact OD1-N 2.97Å; D436-K439 VanDerWaalsContact OD2-CD 3.27Å; D436-K439 WeakPolarHBondContact OD2-CD 3.23Å; D436-K439 WeakPolarHBondContact OD2-CE 3.42Å; D436-K439 IonicContact OD2-NZ 3.72Å; D436-K439 PolarHBondContact OD2-NZ 3.45Å; D436-M440 WeakPolarHBondContact O-CB 3.37Å; D436-M440 VanDerWaalsContact O-CG 3.26Å; D436-M440 WeakPolarHBondContact O-CG 3.34Å; D436-M440 PolarHBondContact O-N 2.85Å
437	A	98.1	Very high	95.9	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-60.3	-44.3	-172.4	0	0	0	0	0	112.5	M139 V141 A144 I383 L386 K439 M440 V441	M139-A437 PolarHBondContact O-N 3.12Å; V141-A437 HydrophobicContact CB-CB 4.48Å; V141-A437 HydrophobicContact CG2-CB 3.94Å; A144-A437 HydrophobicContact CB-CB 4.22Å; I383-A437 HydrophobicContact CG1-CB 4.16Å; I383-A437 HydrophobicContact CG2-CB 3.82Å; L386-A437 HydrophobicContact CD1-CB 4.32Å; A437-K439 PolarHBondContact O-N 3.04Å; A437-M440 PolarHBondContact O-N 2.7Å; A437-V441 WeakPolarHBondContact O-CG2 3.48Å; A437-V441 PolarHBondContact O-N 2.93Å
438	G	95.4	Very high	95.3	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-58.4	-45.4	176.7	0	0	0	0	0	113	N140 D436 V441 R442	N140-G438 PolarHBondContact O-N 3.4Å; N140-G438 VanDerWaalsContact O-N 3.12Å; D436-G438 PolarHBondContact O-N 3.25Å; D436-G438 PolarHBondContact OD1-N 2.95Å; G438-V441 VanDerWaalsContact O-CG2 3.29Å; G438-V441 WeakPolarHBondContact O-CG2 3.48Å; G438-R442 VanDerWaalsContact O-CG 3.3Å; G438-R442 WeakPolarHBondContact O-CG 3.34Å; G438-R442 PolarHBondContact O-N 2.81Å
439	K	95.6	Very high	94.8	Very high	49 Å²	49	12.3 Å²	12.3	21%	0.213	6%	0.064	C	C	.	.	H	α-helix	trans	-67.6	-38.9	174.7	-71.7	178.6	-169.9	135.2	0	112.5	T406 D436 A437 R442 L443 W629	T406-K439 HydrophobicContact CG2-CB 3.89Å; D436-K439 HydrophobicContact CB-CB 4.11Å; D436-K439 HydrophobicContact CB-CD 4.09Å; D436-K439 HydrophobicContact CB-CG 4.34Å; D436-K439 PolarHBondContact O-N 2.85Å; D436-K439 WeakPolarHBondContact OD1-CG 3.31Å; D436-K439 PolarHBondContact OD1-N 2.97Å; D436-K439 VanDerWaalsContact OD2-CD 3.27Å; D436-K439 WeakPolarHBondContact OD2-CD 3.23Å; D436-K439 WeakPolarHBondContact OD2-CE 3.42Å; D436-K439 IonicContact OD2-NZ 3.72Å; D436-K439 PolarHBondContact OD2-NZ 3.45Å; A437-K439 PolarHBondContact O-N 3.04Å; K439-R442 PolarHBondContact O-N 2.9Å; K439-L443 WeakPolarHBondContact O-CB 3.25Å; K439-L443 PolarHBondContact O-N 2.82Å; K439-W629 HydrophobicContact CB-CZ2 4.06Å; K439-W629 HydrophobicContact CG-CZ2 4.22Å
440	M	97.9	Very high	94.5	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-59.8	-51.7	178.8	-74.7	-179.2	71.1	0	0	110.9	I383 I384 L387 I402 T403 T406 M435 D436 A437 R442 L443 G444	I383-M440 HydrophobicContact CG2-CE 4.14Å; I383-M440 HydrophobicContact CG2-SD 3.49Å; I383-M440 WeakPolarHBondContact CG2-SD 3.4Å; I384-M440 HydrophobicContact CG1-CE 4.43Å; L387-M440 WeakPolarHBondContact CD1-O 3.47Å; L387-M440 HydrophobicContact CD2-CE 3.75Å; I402-M440 HydrophobicContact CG2-CB 4.1Å; I402-M440 HydrophobicContact CG2-CE 4.47Å; I402-M440 HydrophobicContact CG2-CG 4.08Å; T403-M440 VanDerWaalsContact OG1-CE 3.31Å; T403-M440 WeakPolarHBondContact OG1-CE 3.4Å; T406-M440 HydrophobicContact CG2-CG 4.39Å; T406-M440 WeakPolarHBondContact OG1-CG 3.38Å; M435-M440 HydrophobicContact CB-SD 4.49Å; M435-M440 HydrophobicContact CE-CE 3.77Å; M435-M440 HydrophobicContact CE-SD 3.65Å; D436-M440 WeakPolarHBondContact O-CB 3.37Å; D436-M440 VanDerWaalsContact O-CG 3.26Å; D436-M440 WeakPolarHBondContact O-CG 3.34Å; D436-M440 PolarHBondContact O-N 2.85Å; A437-M440 PolarHBondContact O-N 2.7Å; M440-R442 PolarHBondContact O-N 2.99Å; M440-L443 PolarHBondContact O-N 3.04Å; M440-G444 PolarHBondContact O-N 3.22Å
441	V	97.4	Very high	93.7	Very high	1 Å²	1	12.6 Å²	12.6	1%	0.006	7%	0.067	C	C	.	.	H	α-helix	trans	-63.6	-41.9	-179.7	-61.9	0	0	0	0	112.1	A144 L147 Y149 L386 A390 A437 G438 L443 G444 E445	A144-V441 HydrophobicContact CB-CG1 4.1Å; A144-V441 HydrophobicContact CB-CG2 4.02Å; L147-V441 HydrophobicContact CD1-CG2 3.69Å; Y149-V441 HydrophobicContact CD2-CB 3.75Å; Y149-V441 HydrophobicContact CD2-CG1 3.96Å; Y149-V441 HydrophobicContact CD2-CG2 3.9Å; Y149-V441 HydrophobicContact CE2-CB 3.99Å; Y149-V441 HydrophobicContact CE2-CG2 4.24Å; Y149-V441 HydrophobicContact CG-CG1 4.29Å; L386-V441 HydrophobicContact CB-CG1 3.98Å; A390-V441 HydrophobicContact CB-CB 4.13Å; A390-V441 HydrophobicContact CB-CG1 4.38Å; A437-V441 WeakPolarHBondContact O-CG2 3.48Å; A437-V441 PolarHBondContact O-N 2.93Å; G438-V441 VanDerWaalsContact O-CG2 3.29Å; G438-V441 WeakPolarHBondContact O-CG2 3.48Å; V441-L443 PolarHBondContact O-N 3.49Å; V441-G444 PolarHBondContact O-N 2.89Å; V441-E445 PolarHBondContact O-N 2.87Å
442	R	95	Very high	92.8	Very high	33 Å²	33	13.7 Å²	13.7	13%	0.125	8%	0.076	C	C	.	.	H	α-helix	trans	-62.4	-42.6	177.2	-74.2	-177.5	-178.1	-73.7	1.5	112.7	E143 L147 G438 K439 M440 G444 P624 W629	E143-R442 IonicContact OE1-CZ 3.88Å; E143-R442 IonicContact OE1-NE 2.62Å; E143-R442 PolarHBondContact OE1-NE 3.28Å; E143-R442 IonicContact OE1-NH2 3.88Å; E143-R442 PolarHBondContact OE1-NH2 2.84Å; L147-R442 HydrophobicContact CD1-CG 3.92Å; G438-R442 VanDerWaalsContact O-CG 3.3Å; G438-R442 WeakPolarHBondContact O-CG 3.34Å; G438-R442 PolarHBondContact O-N 2.81Å; K439-R442 PolarHBondContact O-N 2.9Å; M440-R442 PolarHBondContact O-N 2.99Å; R442-G444 VanDerWaalsContact C-N 3.35Å; R442-P624 PolarHBondContact NH1-O 3.06Å; R442-W629 HydrophobicContact CB-CH2 3.92Å; R442-W629 HydrophobicContact CB-CZ3 3.99Å
443	L	95.5	Very high	92.1	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-70	-37.4	176.3	-173.2	59.6	0	0	0	110.7	I402 L405 T406 K439 M440 V441 L446 W447 L616 W629 F633	I402-L443 HydrophobicContact CG1-CD2 4.35Å; I402-L443 HydrophobicContact CG1-CG 4.45Å; I402-L443 HydrophobicContact CG2-CB 4.45Å; I402-L443 HydrophobicContact CG2-CD2 4.34Å; L405-L443 HydrophobicContact CB-CD2 4.12Å; L405-L443 HydrophobicContact CD1-CD2 4.44Å; T406-L443 HydrophobicContact CG2-CB 4.05Å; T406-L443 HydrophobicContact CG2-CD2 3.6Å; T406-L443 HydrophobicContact CG2-CG 4.48Å; K439-L443 WeakPolarHBondContact O-CB 3.25Å; K439-L443 PolarHBondContact O-N 2.82Å; M440-L443 PolarHBondContact O-N 3.04Å; V441-L443 PolarHBondContact O-N 3.49Å; L443-L446 PolarHBondContact O-N 3.16Å; L443-W447 HydrophobicContact CD1-CE3 4.23Å; L443-W447 HydrophobicContact CD1-CZ3 4.44Å; L443-W447 HydrophobicContact CD2-CE3 4.25Å; L443-W447 HydrophobicContact CD2-CZ3 4.05Å; L443-W447 HydrophobicContact CG-CE3 3.94Å; L443-W447 HydrophobicContact CG-CZ3 4.22Å; L443-W447 PolarHBondContact O-N 2.83Å; L443-L616 HydrophobicContact CD1-CD1 4.09Å; L443-L616 HydrophobicContact CD1-CD2 3.78Å; L443-W629 HydrophobicContact CB-CH2 4.05Å; L443-W629 HydrophobicContact CB-CZ2 4.31Å; L443-F633 HydrophobicContact CD1-CD1 3.91Å; L443-F633 HydrophobicContact CD1-CE1 4.05Å; L443-F633 HydrophobicContact CD1-CG 4.29Å; L443-F633 HydrophobicContact CD2-CE1 3.92Å; L443-F633 HydrophobicContact CD2-CZ 4.11Å
444	G	95.3	Very high	91.5	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-62.7	-39.8	178.7	0	0	0	0	0	114.6	N391 M440 V441 R442 L446 W447	N391-G444 WeakPolarHBondContact CB-O 3.24Å; N391-G444 PolarHBondContact ND2-O 3.27Å; M440-G444 PolarHBondContact O-N 3.22Å; V441-G444 PolarHBondContact O-N 2.89Å; R442-G444 VanDerWaalsContact C-N 3.35Å; G444-L446 PolarHBondContact O-N 3.43Å; G444-W447 PolarHBondContact O-N 2.76Å
445	E	93.2	Very high	91	Very high	39 Å²	39	22.4 Å²	22.4	18%	0.182	11%	0.112	C	C	.	.	H	α-helix	trans	-55	-39.2	173.6	-77.1	178.6	137.4	0	0	111.3	Y149 A390 V441 R623	Y149-E445 HydrophobicContact CE2-CG 4.5Å; Y149-E445 VanDerWaalsContact OH-CD 3.3Å; Y149-E445 VanDerWaalsContact OH-CG 3.28Å; Y149-E445 WeakPolarHBondContact OH-CG 3.22Å; Y149-E445 PolarHBondContact OH-OE1 3.02Å; A390-E445 HydrophobicContact CB-CG 4.28Å; V441-E445 PolarHBondContact O-N 2.87Å; E445-R623 WeakPolarHBondContact OE1-CD 3.37Å; E445-R623 IonicContact OE1-NH1 3.79Å; E445-R623 PolarHBondContact OE1-NH1 2.73Å
446	L	91.9	Very high	90.5	Very high	11 Å²	11	22.4 Å²	22.4	6%	0.058	11%	0.112	C	C	.	.	H	α-helix	trans	-89.7	-14.6	-176.5	-53.8	179.8	0	0	0	113.2	L443 G444 L616 K617 P619 P625 F630	L443-L446 PolarHBondContact O-N 3.16Å; G444-L446 PolarHBondContact O-N 3.43Å; L446-L616 HydrophobicContact CB-CB 4.47Å; L446-L616 HydrophobicContact CB-CD2 4.34Å; L446-L616 CarbonylContact O-C 3.54Å; L446-L616 WeakPolarHBondContact O-CA 3.43Å; L446-K617 PolarHBondContact O-N 2.89Å; L446-P619 HydrophobicContact CD1-CG 4.32Å; L446-P619 HydrophobicContact CD2-CB 4.41Å; L446-P625 HydrophobicContact CD1-CG 4.38Å; L446-F630 HydrophobicContact CD1-CD2 4.16Å; L446-F630 HydrophobicContact CD1-CE2 3.42Å; L446-F630 VanDerWaalsContact CD1-CE2 3.42Å; L446-F630 HydrophobicContact CD1-CZ 4.03Å
447	W	92.4	Very high	90.1	Very high	3 Å²	3	23.1 Å²	23.1	1%	0.011	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	135.4	-169	-164.1	-96.3	0	0	0	112.6	L394 D398 Y401 I402 L405 L443 G444 V450 I614 L616	L394-W447 HydrophobicContact CD2-CB 3.87Å; L394-W447 HydrophobicContact CD2-CG 3.92Å; D398-W447 VanDerWaalsContact CG-NE1 3.32Å; D398-W447 PolarHBondContact OD1-NE1 2.95Å; Y401-W447 HydrophobicContact CD1-CH2 4.25Å; Y401-W447 HydrophobicContact CD1-CZ2 4.44Å; Y401-W447 HydrophobicContact CG-CH2 4.21Å; Y401-W447 HydrophobicContact CG-CZ2 4.04Å; I402-W447 HydrophobicContact CD1-CB 3.99Å; I402-W447 HydrophobicContact CD1-CD2 3.85Å; I402-W447 HydrophobicContact CD1-CE3 4.2Å; I402-W447 HydrophobicContact CD1-CG 3.76Å; I402-W447 HydrophobicContact CG1-CD2 3.73Å; I402-W447 HydrophobicContact CG1-CE3 3.67Å; I402-W447 HydrophobicContact CG1-CG 4.2Å; I402-W447 HydrophobicContact CG1-CH2 4.44Å; I402-W447 HydrophobicContact CG1-CZ2 4.5Å; I402-W447 HydrophobicContact CG1-CZ3 4.04Å; L405-W447 HydrophobicContact CD1-CH2 3.66Å; L405-W447 HydrophobicContact CD1-CZ3 3.74Å; L443-W447 HydrophobicContact CD1-CE3 4.23Å; L443-W447 HydrophobicContact CD1-CZ3 4.44Å; L443-W447 HydrophobicContact CD2-CE3 4.25Å; L443-W447 HydrophobicContact CD2-CZ3 4.05Å; L443-W447 HydrophobicContact CG-CE3 3.94Å; L443-W447 HydrophobicContact CG-CZ3 4.22Å; L443-W447 PolarHBondContact O-N 2.83Å; G444-W447 PolarHBondContact O-N 2.76Å; W447-V450 HydrophobicContact CZ2-CG1 3.93Å; W447-I614 HydrophobicContact CH2-CG1 4.21Å; W447-I614 HydrophobicContact CH2-CG2 4.17Å; W447-I614 HydrophobicContact CZ3-CG2 4.06Å; W447-L616 HydrophobicContact CE3-CD2 3.78Å; W447-L616 HydrophobicContact CZ3-CD2 4.32Å
448	R	84	Confident	89.6	Confident	46 Å²	46	23.4 Å²	23.4	17%	0.174	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	136	164.3	-62.6	-178.9	165.9	-125.5	-3.5	108.2	R615 K617 D640	R448-R615 HydrophobicContact CB-CB 4Å; R448-R615 WeakPolarHBondContact CB-O 3.4Å; R448-R615 PolarHBondContact N-O 3.06Å; R448-K617 HydrophobicContact CG-CG 3.81Å; R448-D640 IonicContact CZ-OD1 3.48Å; R448-D640 IonicContact NH2-OD1 3.89Å; R448-D640 PolarHBondContact NH2-OD1 3.23Å
449	G	81.9	Confident	89.2	Confident	35 Å²	35	26.8 Å²	26.8	36%	0.361	14%	0.137	S	C	.	.	P	Polyproline II helix	trans	-50.7	144.3	-175.2	0	0	0	0	0	112.5	D398 R615	D398-G449 VanDerWaalsContact OD1-CA 3.3Å; D398-G449 WeakPolarHBondContact OD1-CA 3.33Å; G449-R615 PolarHBondContact O-NH2 2.85Å
450	V	87.1	Confident	88.4	Confident	15 Å²	15	28.8 Å²	28.8	9%	0.091	15%	0.153	C	C	.	.	P	Polyproline II helix	trans	-66.1	157.2	178.7	-68.1	0	0	0	0	112.3	R397 D398 Y401 W447 P613	R397-V450 HydrophobicContact CB-CG2 3.99Å; R397-V450 VanDerWaalsContact CZ-CG2 3.41Å; D398-V450 WeakPolarHBondContact OD1-CG1 3.29Å; D398-V450 WeakPolarHBondContact OD1-CG2 3.17Å; D398-V450 PolarHBondContact OD1-N 2.96Å; Y401-V450 HydrophobicContact CD2-CG1 3.7Å; Y401-V450 HydrophobicContact CE2-CG1 3.81Å; Y401-V450 HydrophobicContact CG-CG1 4.24Å; W447-V450 HydrophobicContact CZ2-CG1 3.93Å; V450-P613 HydrophobicContact CG1-CB 4.14Å
451	P	81.6	Confident	87.7	Confident	11 Å²	11	31.1 Å²	31.1	7%	0.071	17%	0.165	C	C	.	.	P	Polyproline II helix	trans	-58.7	172.7	173.6	-23.4	33.9	0	0	0	113.8	R397 H453 T609 E611	R397-P451 PolarHBondContact NH1-O 2.93Å; R397-P451 VanDerWaalsContact NH1-O 3.07Å; R397-P451 PolarHBondContact NH2-O 3.42Å; P451-H453 PolarHBondContact O-N 3.49Å; P451-T609 HydrophobicContact CB-CG2 4.07Å; P451-T609 HydrophobicContact CG-CG2 4.43Å; P451-E611 HydrophobicContact CB-CB 4.14Å; P451-E611 HydrophobicContact CG-CB 3.93Å
452	A	76.9	Confident	87	Confident	25 Å²	25	36.2 Å²	36.2	21%	0.207	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-52.5	135	179.9	0	0	0	0	0	112.1	H454	A452-H454 PolarHBondContact O-N 3.16Å
453	H	83.5	Confident	86.6	Confident	49 Å²	49	36 Å²	36	23%	0.227	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-72.4	123.2	179.2	-171.5	-157.9	0	0	0	109.8	P451 E511 Y607	P451-H453 PolarHBondContact O-N 3.49Å; H453-E511 IonicContact CD2-OE2 3.17Å; H453-E511 IonicContact NE2-OE2 2.72Å; H453-Y607 AromaticContact CE1-CD1 3.77Å; H453-Y607 WeakPolarHBondContact NE2-CB 3.41Å; H453-Y607 AromaticContact NE2-CD1 3.6Å
454	H	85.8	Confident	86	Confident	31 Å²	31	40.7 Å²	40.7	14%	0.144	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	143.3	179.2	-76	-171.6	0	0	0	110.2	A452 T505 P506 I507 Y607 G608	A452-H454 PolarHBondContact O-N 3.16Å; H454-T505 WeakPolarHBondContact CA-OG1 3.45Å; H454-T505 WeakPolarHBondContact CB-OG1 3.16Å; H454-T505 VanDerWaalsContact CG-OG1 3.26Å; H454-P506 PolarHBondContact ND1-O 3.28Å; H454-I507 HydrophobicContact CB-CD1 4.49Å; H454-I507 HydrophobicContact CB-CG1 3.78Å; H454-I507 WeakPolarHBondContact O-CD1 3.26Å; H454-Y607 CarbonylContact O-C 3.5Å; H454-Y607 WeakPolarHBondContact O-CA 3.4Å; H454-G608 PolarHBondContact N-O 3.43Å; H454-G608 PolarHBondContact O-N 2.95Å
455	R	86.6	Confident	85.5	Confident	112 Å²	112	44.6 Å²	44.6	42%	0.423	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	132	175.7	-179.9	-179	173.4	-82.3	-2.1	109	T457 G504 T505 V605 A606 Y607	R455-T457 PolarHBondContact NH1-OG1 3.09Å; R455-T457 PolarHBondContact NH2-OG1 3.05Å; R455-G504 CarbonylContact O-C 3.59Å; R455-G504 WeakPolarHBondContact O-CA 3.38Å; R455-T505 PolarHBondContact N-OG1 3.41Å; R455-T505 VanDerWaalsContact N-OG1 3.13Å; R455-T505 PolarHBondContact O-N 3.06Å; R455-T505 PolarHBondContact O-OG1 3.24Å; R455-V605 HydrophobicContact CG-CG1 4.03Å; R455-A606 WeakPolarHBondContact CA-O 3.29Å; R455-Y607 HydrophobicContact CB-CD1 4.2Å; R455-Y607 HydrophobicContact CB-CE1 4.3Å; R455-Y607 HydrophobicContact CG-CD1 4.06Å; R455-Y607 HydrophobicContact CG-CE1 3.76Å
456	C	88.7	Confident	85.1	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	130.8	176.5	-178.5	0	0	0	0	110.4	F479 G481 C482 I507 V605 A606	C456-F479 HydrophobicContact CB-CE2 4.45Å; C456-F479 HydrophobicContact CB-CZ 3.85Å; C456-F479 VanDerWaalsContact SG-CE2 3.5Å; C456-F479 WeakPolarHBondContact SG-CZ 3.14Å; C456-G481 VanDerWaalsContact SG-C 3.51Å; C456-C482 HydrophobicContact CB-CB 3.84Å; C456-C482 WeakPolarHBondContact CB-SG 3.37Å; C456-C482 WeakPolarHBondContact SG-CB 3.39Å; C456-C482 PolarHBondContact SG-N 2.99Å; C456-C482 CovalentContact SG-SG 2.03Å; C456-C482 PolarHBondContact SG-SG 2.98Å; C456-I507 HydrophobicContact CB-CD1 3.76Å; C456-I507 HydrophobicContact CB-CG1 4.2Å; C456-V605 WeakPolarHBondContact O-CA 3.1Å; C456-A606 PolarHBondContact N-O 2.8Å; C456-A606 PolarHBondContact O-N 3.02Å
457	T	87.3	Confident	84.8	Confident	25 Å²	25	48.8 Å²	48.8	15%	0.153	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	126.3	177.5	-57.1	0	0	0	0	109.5	R455 E502 N503 V605	R455-T457 PolarHBondContact NH1-OG1 3.09Å; R455-T457 PolarHBondContact NH2-OG1 3.05Å; T457-E502 WeakPolarHBondContact O-CB 3.17Å; T457-N503 PolarHBondContact N-O 3.49Å; T457-N503 PolarHBondContact O-N 3.06Å; T457-V605 HydrophobicContact CG2-CG2 3.99Å
458	S	89.3	Confident	83.9	Confident	7 Å²	7	51 Å²	51	5%	0.049	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-66.6	167.2	175.5	77.8	0	0	0	0	111.2	W603 I604	S458-W603 WeakPolarHBondContact OG-CB 3.41Å; S458-I604 PolarHBondContact N-O 3.21Å; S458-I604 PolarHBondContact OG-N 3.45Å; S458-I604 PolarHBondContact OG-O 3.45Å
459	N	85.4	Confident	83.4	Confident	70 Å²	70	49 Å²	49	37%	0.374	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-62.9	148.4	164	-59.1	-56	0	0	0	110	I461 S501	N459-I461 PolarHBondContact O-N 3.5Å; N459-S501 PolarHBondContact ND2-OG 3.4Å; N459-S501 VanDerWaalsContact OD1-C 3.26Å; N459-S501 WeakPolarHBondContact OD1-CB 3.09Å; N459-S501 PolarHBondContact OD1-O 2.89Å; N459-S501 VanDerWaalsContact OD1-O 3.07Å
460	V	80.4	Confident	83	Confident	91 Å²	91	53.4 Å²	53.4	55%	0.552	28%	0.284	S	S	*	.	P	Polyproline II helix	trans	-75.7	121.3	170.6	-178.9	0	0	0	0	108.5	W603	V460-W603 HydrophobicContact CG1-CE3 4Å; V460-W603 HydrophobicContact CG2-CB 4.23Å; V460-W603 HydrophobicContact CG2-CD2 4.07Å; V460-W603 HydrophobicContact CG2-CE3 4.08Å; V460-W603 HydrophobicContact CG2-CG 4.18Å
461	I	83.1	Confident	82.9	Confident	49 Å²	49	53.7 Å²	53.7	25%	0.251	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	122.9	172.7	-61	-178.3	0	0	0	107.8	N459 V463 L475 L477 S601 V602	N459-I461 PolarHBondContact O-N 3.5Å; I461-V463 HydrophobicContact CG2-CG2 4.18Å; I461-V463 PolarHBondContact O-N 3.41Å; I461-L475 HydrophobicContact CB-CD2 4.49Å; I461-L475 HydrophobicContact CD1-CD2 3.86Å; I461-L475 HydrophobicContact CG2-CD1 4.28Å; I461-L475 HydrophobicContact CG2-CD2 4.25Å; I461-L477 HydrophobicContact CD1-CB 3.79Å; I461-L477 HydrophobicContact CD1-CD1 3.8Å; I461-L477 HydrophobicContact CD1-CG 3.66Å; I461-L477 HydrophobicContact CG1-CD1 4.33Å; I461-S601 CarbonylContact O-C 3.5Å; I461-S601 WeakPolarHBondContact O-CA 3.44Å; I461-S601 WeakPolarHBondContact O-CB 3.01Å; I461-V602 HydrophobicContact CB-CG1 4.17Å; I461-V602 PolarHBondContact N-O 3.44Å; I461-V602 PolarHBondContact O-N 2.98Å
462	D	82.9	Confident	83.3	Confident	108 Å²	108	58.2 Å²	58.2	58%	0.578	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.2	109.6	170.7	-162.1	17.6	0	0	0	109.1	Q464 R600	D462-Q464 VanDerWaalsContact OD1-CG 3.3Å; D462-Q464 WeakPolarHBondContact OD1-CG 3.37Å; D462-Q464 PolarHBondContact OD1-NE2 2.89Å; D462-R600 VanDerWaalsContact OD1-O 3.11Å
463	V	85.5	Confident	84	Confident	28 Å²	28	58.8 Å²	58.8	17%	0.17	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	-39.7	-172	-178	0	0	0	0	111.3	I461 K465 L475 W599 R600 V602	I461-V463 HydrophobicContact CG2-CG2 4.18Å; I461-V463 PolarHBondContact O-N 3.41Å; V463-K465 VanDerWaalsContact C-N 3.3Å; V463-K465 HydrophobicContact CG1-CB 3.83Å; V463-K465 PolarHBondContact O-N 3.08Å; V463-L475 HydrophobicContact CG1-CD1 4.3Å; V463-L475 HydrophobicContact CG2-CD1 3.9Å; V463-W599 HydrophobicContact CB-CD2 4.33Å; V463-W599 HydrophobicContact CB-CG 4.24Å; V463-W599 HydrophobicContact CG1-CB 4.39Å; V463-W599 HydrophobicContact CG1-CD2 3.76Å; V463-W599 HydrophobicContact CG1-CE3 3.99Å; V463-W599 HydrophobicContact CG1-CG 3.95Å; V463-W599 HydrophobicContact CG2-CD2 4.38Å; V463-W599 HydrophobicContact CG2-CZ2 4.35Å; V463-R600 PolarHBondContact N-O 3.18Å; V463-V602 HydrophobicContact CG2-CG1 3.67Å
464	Q	83.1	Confident	84.5	Confident	100 Å²	100	59.3 Å²	59.3	47%	0.467	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	43.3	46.6	178	-59.1	-67.1	-52.8	0	0	114.8	D462 F598 W599 R600	D462-Q464 VanDerWaalsContact OD1-CG 3.3Å; D462-Q464 WeakPolarHBondContact OD1-CG 3.37Å; D462-Q464 PolarHBondContact OD1-NE2 2.89Å; Q464-F598 HydrophobicContact CB-CZ 4.13Å; Q464-W599 PolarHBondContact N-O 3.18Å; Q464-R600 PolarHBondContact N-O 3.09Å; Q464-R600 VanDerWaalsContact N-O 3.13Å
465	K	85.2	Confident	84.8	Confident	81 Å²	81	59.4 Å²	59.4	35%	0.352	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	124.3	-172.4	-166.9	169.8	-165.4	178.9	0	112.4	V463 H473 F598 W599	V463-K465 VanDerWaalsContact C-N 3.3Å; V463-K465 HydrophobicContact CG1-CB 3.83Å; V463-K465 PolarHBondContact O-N 3.08Å; K465-H473 VanDerWaalsContact CE-CE1 3.42Å; K465-H473 WeakPolarHBondContact CE-CE1 3.29Å; K465-H473 WeakPolarHBondContact CE-NE2 3.48Å; K465-H473 PolarHBondContact NZ-CE1 3.37Å; K465-H473 PolarHBondContact NZ-ND1 3.36Å; K465-H473 PolarHBondContact NZ-NE2 3.27Å; K465-F598 CarbonylContact O-C 3.39Å; K465-F598 WeakPolarHBondContact O-CA 3.34Å; K465-F598 WeakPolarHBondContact O-CD2 3.44Å; K465-W599 HydrophobicContact CB-CB 4.47Å; K465-W599 PolarHBondContact N-O 2.85Å; K465-W599 PolarHBondContact O-N 2.92Å
466	N	85.1	Confident	85.2	Confident	132 Å²	132	60.2 Å²	60.2	71%	0.706	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.8	131.9	169.4	-67.8	-30.5	0	0	0	110.1	F598	N466-F598 VanDerWaalsContact OD1-CD2 3.28Å; N466-F598 WeakPolarHBondContact OD1-CD2 3.4Å
467	L	84.1	Confident	85.4	Confident	6 Å²	6	60.4 Å²	60.4	3%	0.031	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	128.2	176.4	-54.1	177.1	0	0	0	107.9	F471 I519 Y521 L579 K596 G597 W599	L467-F471 HydrophobicContact CB-CD1 4.35Å; L467-F471 HydrophobicContact CB-CE1 3.9Å; L467-F471 HydrophobicContact CB-CZ 4.26Å; L467-F471 HydrophobicContact CD1-CE1 4.36Å; L467-F471 HydrophobicContact CD1-CZ 3.92Å; L467-F471 HydrophobicContact CD2-CD2 4.3Å; L467-F471 HydrophobicContact CD2-CE1 4.27Å; L467-F471 HydrophobicContact CD2-CE2 3.98Å; L467-F471 HydrophobicContact CD2-CZ 3.96Å; L467-F471 HydrophobicContact CG-CE1 4.4Å; L467-F471 HydrophobicContact CG-CZ 4.27Å; L467-I519 HydrophobicContact CD1-CG2 3.95Å; L467-Y521 HydrophobicContact CB-CD2 3.96Å; L467-Y521 HydrophobicContact CB-CE2 4.07Å; L467-Y521 HydrophobicContact CD1-CD2 4.14Å; L467-L579 HydrophobicContact CD1-CD2 3.97Å; L467-L579 HydrophobicContact CD2-CD2 4.44Å; L467-K596 CarbonylContact O-C 3.52Å; L467-G597 PolarHBondContact N-O 3.18Å; L467-G597 PolarHBondContact O-N 3.27Å; L467-W599 HydrophobicContact CD1-CB 4.17Å; L467-W599 HydrophobicContact CD2-CB 4.34Å; L467-W599 HydrophobicContact CG-CB 4.38Å
468	G	74.9	Confident	85.6	Confident	49 Å²	49	65.4 Å²	65.4	51%	0.505	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	130.7	179	0	0	0	0	0	109.9	I595	G468-I595 WeakPolarHBondContact CA-O 3.3Å
469	G	72.5	Confident	85.8	Confident	5 Å²	5	65.1 Å²	65.1	5%	0.052	34%	0.341	C	S	.	.	S	Bend	trans	50.6	-137	178.1	0	0	0	0	0	115.1	F471 Y521 S581 P592 I595	G469-F471 WeakPolarHBondContact O-CD1 3.14Å; G469-Y521 PolarHBondContact O-OH 3.04Å; G469-S581 PolarHBondContact O-OG 3Å; G469-P592 WeakPolarHBondContact CA-O 3.06Å; G469-I595 PolarHBondContact N-O 3.45Å
470	K	74.2	Confident	86	Confident	128 Å²	128	63 Å²	63	56%	0.557	33%	0.332	S	S	*	.	S	Bend	trans	-82.5	121.6	179.9	-169.4	173.5	-176.7	172.6	0	111.6	S581	K470-S581 VanDerWaalsContact CA-OG 3.28Å; K470-S581 WeakPolarHBondContact CA-OG 3.31Å
471	F	85.7	Confident	86.4	Confident	21 Å²	21	58.7 Å²	58.7	9%	0.092	31%	0.306	C	S	.	.			trans	-139	163	178	65.4	-93.1	0	0	0	113.2	L467 G469 H473 Y521 L527 L579 S581	L467-F471 HydrophobicContact CB-CD1 4.35Å; L467-F471 HydrophobicContact CB-CE1 3.9Å; L467-F471 HydrophobicContact CB-CZ 4.26Å; L467-F471 HydrophobicContact CD1-CE1 4.36Å; L467-F471 HydrophobicContact CD1-CZ 3.92Å; L467-F471 HydrophobicContact CD2-CD2 4.3Å; L467-F471 HydrophobicContact CD2-CE1 4.27Å; L467-F471 HydrophobicContact CD2-CE2 3.98Å; L467-F471 HydrophobicContact CD2-CZ 3.96Å; L467-F471 HydrophobicContact CG-CE1 4.4Å; L467-F471 HydrophobicContact CG-CZ 4.27Å; G469-F471 WeakPolarHBondContact O-CD1 3.14Å; F471-H473 AromaticContact CD2-CD2 3.53Å; F471-H473 AromaticContact CD2-NE2 3.99Å; F471-Y521 HydrophobicContact CE1-CD2 4.27Å; F471-Y521 AromaticContact CE1-CE2 3.64Å; F471-Y521 HydrophobicContact CE1-CE2 3.64Å; F471-Y521 AromaticContact CE1-CZ 3.9Å; F471-Y521 HydrophobicContact CZ-CE2 4.45Å; F471-L527 HydrophobicContact CE1-CD2 4.27Å; F471-L527 HydrophobicContact CZ-CD2 3.58Å; F471-L579 HydrophobicContact CE2-CB 4.36Å; F471-L579 HydrophobicContact CE2-CD2 3.86Å; F471-L579 HydrophobicContact CE2-CG 3.79Å; F471-L579 WeakPolarHBondContact CE2-O 3.43Å; F471-L579 HydrophobicContact CZ-CD2 4.14Å; F471-L579 HydrophobicContact CZ-CG 4.26Å; F471-S581 PolarHBondContact N-OG 3.11Å; F471-S581 PolarHBondContact O-N 2.63Å; F471-S581 VanDerWaalsContact O-N 3.09Å; F471-S581 PolarHBondContact O-OG 3.38Å
472	N	88.5	Confident	86.7	Confident	106 Å²	106	56.6 Å²	56.6	57%	0.567	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.4	119	168	177.2	-42	0	0	0	107.2	D580	N472-D580 VanDerWaalsContact CA-OD1 3.31Å; N472-D580 WeakPolarHBondContact CA-OD1 3.47Å; N472-D580 WeakPolarHBondContact CB-OD1 3.46Å; N472-D580 PolarHBondContact ND2-OD1 3.22Å; N472-D580 PolarHBondContact OD1-OD1 3.06Å
473	H	91.6	Very high	86.8	Confident	37 Å²	37	55.2 Å²	55.2	17%	0.171	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	122.6	-176.1	-70.2	-24.5	0	0	0	111.2	K465 F471 C578 L579 W599	K465-H473 VanDerWaalsContact CE-CE1 3.42Å; K465-H473 WeakPolarHBondContact CE-CE1 3.29Å; K465-H473 WeakPolarHBondContact CE-NE2 3.48Å; K465-H473 PolarHBondContact NZ-CE1 3.37Å; K465-H473 PolarHBondContact NZ-ND1 3.36Å; K465-H473 PolarHBondContact NZ-NE2 3.27Å; F471-H473 AromaticContact CD2-CD2 3.53Å; F471-H473 AromaticContact CD2-NE2 3.99Å; H473-C578 CarbonylContact O-C 3.35Å; H473-C578 VanDerWaalsContact O-CA 3.31Å; H473-C578 WeakPolarHBondContact O-CA 3.32Å; H473-L579 PolarHBondContact N-O 3.41Å; H473-L579 PolarHBondContact O-N 3.27Å; H473-W599 HydrophobicContact CB-CZ3 4.19Å
474	T	93.6	Very high	86.2	Confident	60 Å²	60	58.3 Å²	58.3	37%	0.368	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	127.5	171.9	-52.8	0	0	0	0	110.2	F476 Q576 I577	T474-F476 HydrophobicContact CG2-CE2 4.18Å; T474-F476 HydrophobicContact CG2-CZ 4.08Å; T474-Q576 HydrophobicContact CG2-CB 3.9Å; T474-I577 CarbonylContact C-O 3.53Å; T474-I577 WeakPolarHBondContact CA-O 3.23Å
475	L	93.6	Very high	85.3	Confident	32 Å²	32	61.3 Å²	61.3	17%	0.168	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	133	173.1	-173.9	108.5	0	0	0	109.9	I461 V463 Q576 I577 W599 V602	I461-L475 HydrophobicContact CB-CD2 4.49Å; I461-L475 HydrophobicContact CD1-CD2 3.86Å; I461-L475 HydrophobicContact CG2-CD1 4.28Å; I461-L475 HydrophobicContact CG2-CD2 4.25Å; V463-L475 HydrophobicContact CG1-CD1 4.3Å; V463-L475 HydrophobicContact CG2-CD1 3.9Å; L475-Q576 CarbonylContact O-C 3.41Å; L475-Q576 WeakPolarHBondContact O-CA 3.39Å; L475-I577 PolarHBondContact N-O 2.77Å; L475-I577 PolarHBondContact O-N 3.49Å; L475-W599 HydrophobicContact CB-CH2 3.93Å; L475-V602 HydrophobicContact CD2-CG1 3.42Å; L475-V602 VanDerWaalsContact CD2-CG1 3.42Å
476	F	94.6	Very high	84.2	Confident	130 Å²	130	63.6 Å²	63.6	57%	0.57	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96	116.2	176.6	-63.4	-87.6	0	0	0	110.1	T474 T574 W575 Q576	T474-F476 HydrophobicContact CG2-CE2 4.18Å; T474-F476 HydrophobicContact CG2-CZ 4.08Å; F476-T574 HydrophobicContact CB-CG2 3.85Å; F476-T574 HydrophobicContact CD1-CG2 3.88Å; F476-T574 HydrophobicContact CG-CG2 4.36Å; F476-W575 CarbonylContact C-O 3.4Å; F476-W575 WeakPolarHBondContact CA-O 3.3Å; F476-Q576 HydrophobicContact CD1-CG 3.88Å; F476-Q576 HydrophobicContact CE1-CB 4.44Å; F476-Q576 HydrophobicContact CE1-CG 3.72Å
477	L	92.9	Very high	82.5	Confident	3 Å²	3	59 Å²	59	2%	0.016	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	114	177.5	-176.8	155.1	0	0	0	109.1	I461 F479 W575 I577 I604	I461-L477 HydrophobicContact CD1-CB 3.79Å; I461-L477 HydrophobicContact CD1-CD1 3.8Å; I461-L477 HydrophobicContact CD1-CG 3.66Å; I461-L477 HydrophobicContact CG1-CD1 4.33Å; L477-F479 HydrophobicContact CD2-CB 3.78Å; L477-F479 PolarHBondContact O-N 3.19Å; L477-W575 HydrophobicContact CB-CB 4.42Å; L477-W575 PolarHBondContact N-O 3.13Å; L477-W575 PolarHBondContact O-N 3.07Å; L477-I577 HydrophobicContact CB-CD1 4.4Å; L477-I577 HydrophobicContact CD1-CD1 4.1Å; L477-I604 HydrophobicContact CD1-CD1 4.4Å; L477-I604 HydrophobicContact CD1-CG1 4.17Å; L477-I604 HydrophobicContact CD2-CD1 4.15Å
478	H	92	Very high	80.6	Confident	131 Å²	131	66.2 Å²	66.2	61%	0.606	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	114	173.6	-179.9	-79.8	0	0	0	110
479	F	93	Very high	79	Confident	0 Å²	0	69 Å²	69	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	118	-179.2	-169.7	-137.5	0	0	0	110.3	C456 L477 G481 E502 A571 V572 G573 W575 A606	C456-F479 HydrophobicContact CB-CE2 4.45Å; C456-F479 HydrophobicContact CB-CZ 3.85Å; C456-F479 VanDerWaalsContact SG-CE2 3.5Å; C456-F479 WeakPolarHBondContact SG-CZ 3.14Å; L477-F479 HydrophobicContact CD2-CB 3.78Å; L477-F479 PolarHBondContact O-N 3.19Å; F479-G481 PolarHBondContact O-N 2.79Å; F479-E502 WeakPolarHBondContact CA-OE1 3.19Å; F479-E502 VanDerWaalsContact CD2-OE1 3.29Å; F479-E502 WeakPolarHBondContact CD2-OE1 3.44Å; F479-A571 HydrophobicContact CD1-CB 4.18Å; F479-A571 WeakPolarHBondContact CD1-O 3.1Å; F479-A571 HydrophobicContact CE1-CB 3.97Å; F479-V572 WeakPolarHBondContact O-CA 3.45Å; F479-G573 PolarHBondContact N-O 3.49Å; F479-G573 PolarHBondContact O-N 2.83Å; F479-W575 AromaticContact CD1-NE1 3.69Å; F479-A606 HydrophobicContact CE1-CB 3.63Å; F479-A606 HydrophobicContact CZ-CB 3.9Å
480	S	89.6	Confident	77.7	Confident	27 Å²	27	75.2 Å²	75.2	19%	0.189	41%	0.406	C	S	.	.			trans	-79.1	-9.3	178.6	83.4	0	0	0	0	113.1	C482 R483 E502 V572	S480-C482 PolarHBondContact O-N 3.29Å; S480-C482 PolarHBondContact OG-N 3.06Å; S480-R483 WeakPolarHBondContact O-CB 3.23Å; S480-R483 PolarHBondContact O-N 3.16Å; S480-R483 VanDerWaalsContact O-N 3.17Å; S480-E502 WeakPolarHBondContact CB-OE2 3.46Å; S480-E502 PolarHBondContact N-OE1 3.49Å; S480-E502 PolarHBondContact N-OE2 3.41Å; S480-E502 PolarHBondContact OG-OE2 2.94Å; S480-V572 WeakPolarHBondContact O-CG2 3.44Å
481	G	88.5	Confident	76	Confident	0 Å²	0	74 Å²	74	0%	0	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.5	33	-174.6	0	0	0	0	0	111.7	C456 F479 R483 E502 P506 I507	C456-G481 VanDerWaalsContact SG-C 3.51Å; F479-G481 PolarHBondContact O-N 2.79Å; G481-R483 PolarHBondContact O-N 3.48Å; G481-R483 VanDerWaalsContact O-N 3.07Å; G481-E502 PolarHBondContact N-OE2 2.92Å; G481-E502 VanDerWaalsContact N-OE2 3.16Å; G481-P506 CarbonylContact O-C 3.51Å; G481-P506 VanDerWaalsContact O-CA 3.25Å; G481-P506 WeakPolarHBondContact O-CA 3.37Å; G481-I507 PolarHBondContact O-N 3.31Å
482	C	89.6	Confident	73.7	Confident	5 Å²	5	78.9 Å²	78.9	3%	0.034	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	54	24.3	-175.5	-64.5	0	0	0	0	114.1	C456 S480 E502 P506	C456-C482 HydrophobicContact CB-CB 3.84Å; C456-C482 WeakPolarHBondContact CB-SG 3.37Å; C456-C482 WeakPolarHBondContact SG-CB 3.39Å; C456-C482 PolarHBondContact SG-N 2.99Å; C456-C482 CovalentContact SG-SG 2.03Å; C456-C482 PolarHBondContact SG-SG 2.98Å; S480-C482 PolarHBondContact O-N 3.29Å; S480-C482 PolarHBondContact OG-N 3.06Å; C482-E502 PolarHBondContact N-OE2 2.91Å; C482-P506 WeakPolarHBondContact O-CG 3.39Å
483	R	84.1	Confident	71.4	Confident	78 Å²	78	81.5 Å²	81.5	29%	0.294	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-70.8	131.5	176.3	-78.2	-168.6	173.8	159.7	-4.1	110.8	S480 G481 K485 T500 V572	S480-R483 WeakPolarHBondContact O-CB 3.23Å; S480-R483 PolarHBondContact O-N 3.16Å; S480-R483 VanDerWaalsContact O-N 3.17Å; G481-R483 PolarHBondContact O-N 3.48Å; G481-R483 VanDerWaalsContact O-N 3.07Å; R483-K485 PolarHBondContact O-N 3.39Å; R483-T500 WeakPolarHBondContact O-CG2 3.17Å; R483-V572 HydrophobicContact CG-CG2 4.15Å
484	P	73.9	Confident	69	Low	94 Å²	94	90 Å²	90	61%	0.61	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-62.7	134.9	174.8	24.2	-30.9	0	0	0	110.3	S486	P484-S486 PolarHBondContact O-N 3.22Å; P484-S486 VanDerWaalsContact O-N 3.17Å
485	K	65.1	Low	66.4	Low	163 Å²	163	94.9 Å²	94.9	71%	0.709	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-62.7	117.8	176.3	-69.3	-175.1	178.3	-179.5	0	109.5	R483 G487	R483-K485 PolarHBondContact O-N 3.39Å; K485-G487 PolarHBondContact O-N 3.14Å; K485-G487 VanDerWaalsContact O-N 3.08Å
486	S	60.7	Low	63.6	Low	129 Å²	129	100.3 Å²	100.3	90%	0.902	55%	0.548	S	S	*	.			trans	-64.3	107.5	169.1	-157.9	0	0	0	0	107.5	P484	P484-S486 PolarHBondContact O-N 3.22Å; P484-S486 VanDerWaalsContact O-N 3.17Å
487	G	49.8	Very low	61.2	Low	35 Å²	35	103.5 Å²	103.5	36%	0.361	56%	0.562	S	S	.	*			trans	-96.7	133	176.4	0	0	0	0	0	109.5	K485 S489	K485-G487 PolarHBondContact O-N 3.14Å; K485-G487 VanDerWaalsContact O-N 3.08Å; G487-S489 PolarHBondContact O-N 3.35Å
488	N	44.8	Very low	58.7	Low	158 Å²	158	111 Å²	111	85%	0.845	59%	0.59	S	S	*	*			trans	-42.1	135.5	168.1	-83.8	-11.5	0	0	0	110.8	D490	N488-D490 PolarHBondContact O-N 3.2Å; N488-D490 VanDerWaalsContact O-N 3.14Å
489	S	40.5	Very low	56.5	Low	106 Å²	106	110 Å²	110	74%	0.741	60%	0.598	S	S	*	*	S	Bend	trans	-45.9	114.9	162.8	-169.4	0	0	0	0	108.7	G487	G487-S489 PolarHBondContact O-N 3.35Å
490	D	44.3	Very low	54.6	Low	136 Å²	136	111.1 Å²	111.1	73%	0.727	61%	0.605	S	S	*	*				169.5	133.3	124	-83.5	-7.8	0	0	0	110.6	N488	N488-D490 PolarHBondContact O-N 3.2Å; N488-D490 VanDerWaalsContact O-N 3.14Å
491	S	40	Very low	53.5	Low	103 Å²	103	114.4 Å²	114.4	72%	0.72	63%	0.628	S	S	*	*			trans	74	98.5	153.2	-53.2	0	0	0	0	118.5
492	T	37.1	Very low	53.2	Low	124 Å²	124	114.9 Å²	114.9	76%	0.761	63%	0.63	S	S	*	*			trans	52.6	92.2	133.9	60.8	0	0	0	0	118.2
493	N	40.8	Very low	52.4	Low	160 Å²	160	118.6 Å²	118.6	86%	0.856	65%	0.649	S	S	*	*				-178.1	94.7	127.9	-92.7	-28.6	0	0	0	110.2	L495	N493-L495 VanDerWaalsContact C-N 3.27Å; N493-L495 PolarHBondContact O-N 2.83Å
494	K	40.5	Very low	52.2	Low	217 Å²	217	116.6 Å²	116.6	94%	0.943	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	77.9	170.2	-79.5	178.6	174.6	174.2	0	109.9
495	L	38.7	Very low	52.6	Low	161 Å²	161	113.6 Å²	113.6	84%	0.843	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-157.7	9.9	154.5	-141.7	80.8	0	0	0	116.1	N493	N493-L495 VanDerWaalsContact C-N 3.27Å; N493-L495 PolarHBondContact O-N 2.83Å
496	N	35.6	Very low	53.7	Low	147 Å²	147	107.3 Å²	107.3	79%	0.786	61%	0.609	S	S	*	*			trans	-119.1	91.3	171.3	-74.7	-22.3	0	0	0	108.9	R498	N496-R498 VanDerWaalsContact C-N 3.33Å; N496-R498 PolarHBondContact O-N 3.32Å
497	K	43.1	Very low	55.1	Low	197 Å²	197	101.2 Å²	101.2	86%	0.857	57%	0.566	S	S	*	*			trans	-54.3	105.5	160.3	-85.8	179.4	176.4	174.5	0	106	S499	K497-S499 VanDerWaalsContact C-N 3.35Å; K497-S499 PolarHBondContact O-N 3.48Å
498	R	41.7	Very low	57	Low	160 Å²	160	104.3 Å²	104.3	60%	0.604	57%	0.567	S	S	*	*			trans	-55.8	92.9	-174	-73.6	173.4	172.6	160.3	-4.7	109.4	N496 T500	N496-R498 VanDerWaalsContact C-N 3.33Å; N496-R498 PolarHBondContact O-N 3.32Å; R498-T500 PolarHBondContact O-N 2.95Å
499	S	44.8	Very low	59.4	Low	111 Å²	111	99.5 Å²	99.5	78%	0.776	54%	0.537	S	S	*	.			trans	-62	121.9	179.5	-166.5	0	0	0	0	109.3	K497	K497-S499 VanDerWaalsContact C-N 3.35Å; K497-S499 PolarHBondContact O-N 3.48Å
500	T	54.2	Low	62.1	Low	23 Å²	23	94.5 Å²	94.5	14%	0.141	50%	0.502	C	S	.	.			trans	-59.7	151.6	152.2	48.1	0	0	0	0	107.8	R483 R498 E502	R483-T500 WeakPolarHBondContact O-CG2 3.17Å; R498-T500 PolarHBondContact O-N 2.95Å; T500-E502 PolarHBondContact OG1-O 3.41Å
501	S	66	Low	64.6	Low	96 Å²	96	88 Å²	88	67%	0.671	47%	0.467	S	S	*	.	S	Bend	trans	-69.4	-27.2	169	45.6	0	0	0	0	111.2	N459	N459-S501 PolarHBondContact ND2-OG 3.4Å; N459-S501 VanDerWaalsContact OD1-C 3.26Å; N459-S501 WeakPolarHBondContact OD1-CB 3.09Å; N459-S501 PolarHBondContact OD1-O 2.89Å; N459-S501 VanDerWaalsContact OD1-O 3.07Å
502	E	81.5	Confident	67.3	Low	9 Å²	9	83.3 Å²	83.3	4%	0.042	43%	0.434	C	S	.	.	S	Bend	trans	-71.8	146.7	173.4	-60.3	176.3	177.7	0	0	111.8	T457 F479 S480 G481 C482 T500	T457-E502 WeakPolarHBondContact O-CB 3.17Å; F479-E502 WeakPolarHBondContact CA-OE1 3.19Å; F479-E502 VanDerWaalsContact CD2-OE1 3.29Å; F479-E502 WeakPolarHBondContact CD2-OE1 3.44Å; S480-E502 WeakPolarHBondContact CB-OE2 3.46Å; S480-E502 PolarHBondContact N-OE1 3.49Å; S480-E502 PolarHBondContact N-OE2 3.41Å; S480-E502 PolarHBondContact OG-OE2 2.94Å; G481-E502 PolarHBondContact N-OE2 2.92Å; G481-E502 VanDerWaalsContact N-OE2 3.16Å; C482-E502 PolarHBondContact N-OE2 2.91Å; T500-E502 PolarHBondContact OG1-O 3.41Å
503	N	72.3	Confident	70.1	Confident	84 Å²	84	77.5 Å²	77.5	45%	0.449	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	125.8	-177.1	-174.7	12.2	0	0	0	110.8	T457	T457-N503 PolarHBondContact N-O 3.49Å; T457-N503 PolarHBondContact O-N 3.06Å
504	G	80.7	Confident	72.7	Confident	35 Å²	35	70.3 Å²	70.3	36%	0.361	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	136.8	-158.3	174.2	0	0	0	0	0	114	R455	R455-G504 CarbonylContact O-C 3.59Å; R455-G504 WeakPolarHBondContact O-CA 3.38Å
505	T	82.9	Confident	75.2	Confident	32 Å²	32	60 Å²	60	20%	0.196	32%	0.315	C	S	.	.			trans	-108	148.4	-178.3	49.7	0	0	0	0	111	H454 R455 I507	H454-T505 WeakPolarHBondContact CA-OG1 3.45Å; H454-T505 WeakPolarHBondContact CB-OG1 3.16Å; H454-T505 VanDerWaalsContact CG-OG1 3.26Å; R455-T505 PolarHBondContact N-OG1 3.41Å; R455-T505 VanDerWaalsContact N-OG1 3.13Å; R455-T505 PolarHBondContact O-N 3.06Å; R455-T505 PolarHBondContact O-OG1 3.24Å; T505-I507 PolarHBondContact O-N 3.18Å
506	P	87.8	Confident	77.6	Confident	31 Å²	31	54.2 Å²	54.2	20%	0.201	28%	0.282	C	S	.	.			trans	-56.4	134.4	-176.4	-22.3	29.7	0	0	0	113.4	H454 G481 C482 D610	H454-P506 PolarHBondContact ND1-O 3.28Å; G481-P506 CarbonylContact O-C 3.51Å; G481-P506 VanDerWaalsContact O-CA 3.25Å; G481-P506 WeakPolarHBondContact O-CA 3.37Å; C482-P506 WeakPolarHBondContact O-CG 3.39Å; P506-D610 HydrophobicContact CB-CB 4.48Å
507	I	90	Very high	79.8	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.245	C	C	.	.			trans	-120.3	126	175.1	-62.1	173.9	0	0	0	109.5	H454 C456 G481 T505 L510 A571 A606	H454-I507 HydrophobicContact CB-CD1 4.49Å; H454-I507 HydrophobicContact CB-CG1 3.78Å; H454-I507 WeakPolarHBondContact O-CD1 3.26Å; C456-I507 HydrophobicContact CB-CD1 3.76Å; C456-I507 HydrophobicContact CB-CG1 4.2Å; G481-I507 PolarHBondContact O-N 3.31Å; T505-I507 PolarHBondContact O-N 3.18Å; I507-L510 HydrophobicContact CG2-CD2 4.15Å; I507-A571 HydrophobicContact CB-CB 4.38Å; I507-A571 HydrophobicContact CG2-CB 4.13Å; I507-A606 VanDerWaalsContact CD1-C 3.4Å; I507-A606 HydrophobicContact CD1-CB 3.91Å; I507-A606 WeakPolarHBondContact CD1-O 3.45Å
508	R	90.2	Very high	81.7	Confident	101 Å²	101	38.6 Å²	38.6	38%	0.381	21%	0.208	S	C	.	.	S	Bend	trans	-112.9	-30.6	176.9	-176.3	177.5	-48.6	-156.2	4.5	112.9	N570 T609 D610	R508-N570 VanDerWaalsContact O-CA 3.3Å; R508-N570 WeakPolarHBondContact O-CA 3.43Å; R508-T609 PolarHBondContact N-O 3.28Å; R508-D610 WeakPolarHBondContact CB-O 3.36Å; R508-D610 WeakPolarHBondContact CD-O 3.49Å; R508-D610 IonicContact CZ-OD1 3.12Å; R508-D610 PolarHBondContact NE-O 2.9Å; R508-D610 IonicContact NE-OD1 2.86Å; R508-D610 PolarHBondContact NE-OD1 2.89Å; R508-D610 IonicContact NH2-OD1 2.65Å; R508-D610 PolarHBondContact NH2-OD1 3.36Å
509	Y	94.2	Very high	83.7	Confident	57 Å²	57	31.1 Å²	31.1	22%	0.224	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	112.5	178.4	-54.5	-82.7	0	0	0	108.6	E569 G608 T609 E611 F612	Y509-E569 WeakPolarHBondContact CA-O 3.46Å; Y509-G608 CarbonylContact O-C 3.55Å; Y509-G608 WeakPolarHBondContact O-CA 3.07Å; Y509-T609 PolarHBondContact N-O 2.76Å; Y509-T609 PolarHBondContact O-N 2.94Å; Y509-E611 WeakPolarHBondContact CD2-O 3.19Å; Y509-F612 HydrophobicContact CD1-CD2 4.23Å; Y509-F612 AromaticContact CE1-CD2 3.69Å; Y509-F612 HydrophobicContact CE1-CD2 3.69Å; Y509-F612 HydrophobicContact CE1-CE2 4.44Å; Y509-F612 VanDerWaalsContact CE2-CA 3.4Å; Y509-F612 HydrophobicContact CE2-CB 4.01Å; Y509-F612 HydrophobicContact CE2-CD2 4.48Å; Y509-F612 VanDerWaalsContact CE2-N 3.28Å; Y509-F612 AromaticContact CZ-CD2 3.83Å
510	L	97.2	Very high	85.4	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	145.7	-178.6	-71.4	169.9	0	0	0	112.2	I507 V513 F566 W567 G568 E569 A571 W575 A606	I507-L510 HydrophobicContact CG2-CD2 4.15Å; L510-V513 HydrophobicContact CD1-CG2 4.09Å; L510-V513 HydrophobicContact CD2-CG2 3.78Å; L510-V513 HydrophobicContact CG-CG2 4.43Å; L510-F566 HydrophobicContact CD1-CB 3.85Å; L510-W567 CarbonylContact O-C 3.51Å; L510-W567 WeakPolarHBondContact O-CA 3.39Å; L510-G568 PolarHBondContact O-N 3.18Å; L510-E569 HydrophobicContact CD1-CB 4.24Å; L510-E569 WeakPolarHBondContact CG-O 2.96Å; L510-E569 PolarHBondContact N-O 2.76Å; L510-A571 HydrophobicContact CD1-CB 4.36Å; L510-A571 HydrophobicContact CD2-CB 3.63Å; L510-A571 HydrophobicContact CG-CB 3.96Å; L510-W575 HydrophobicContact CD1-CH2 3.77Å; L510-W575 HydrophobicContact CD1-CZ2 3.82Å; L510-A606 HydrophobicContact CD2-CB 3.74Å
511	E	96.8	Very high	86.6	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	-63.7	166.8	-69.4	169.3	-173.9	0	0	108.2	R397 Y401 H453 W567 Y607	R397-E511 WeakPolarHBondContact CD-OE2 3.39Å; R397-E511 IonicContact NH1-OE1 3.38Å; R397-E511 PolarHBondContact NH1-OE1 3.03Å; R397-E511 IonicContact NH1-OE2 3.47Å; Y401-E511 HydrophobicContact CE2-CG 3.75Å; Y401-E511 WeakPolarHBondContact CE2-OE1 3.43Å; Y401-E511 WeakPolarHBondContact OH-CG 3.49Å; Y401-E511 PolarHBondContact OH-OE1 3.44Å; H453-E511 IonicContact CD2-OE2 3.17Å; H453-E511 IonicContact NE2-OE2 2.72Å; E511-W567 HydrophobicContact CB-CD2 4.34Å; E511-W567 HydrophobicContact CB-CE3 4.48Å; E511-W567 HydrophobicContact CB-CH2 3.99Å; E511-W567 HydrophobicContact CB-CZ2 3.83Å; E511-W567 HydrophobicContact CB-CZ3 4.31Å; E511-W567 HydrophobicContact CG-CH2 4.4Å; E511-W567 HydrophobicContact CG-CZ2 3.76Å; E511-W567 WeakPolarHBondContact O-CZ3 3.45Å; E511-Y607 PolarHBondContact N-O 3.18Å
512	H	96.7	Very high	87.1	Confident	4 Å²	4	28.1 Å²	28.1	2%	0.019	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	145.8	178.9	-51.6	82.5	0	0	0	110.9	P318 Q400 W567 Y607	P318-H512 HydrophobicContact CB-CB 4.08Å; P318-H512 PolarHBondContact O-NE2 3.15Å; Q400-H512 PolarHBondContact OE1-CE1 2.91Å; Q400-H512 PolarHBondContact OE1-NE2 3.1Å; H512-W567 AromaticContact CE1-CH2 3.57Å; H512-W567 AromaticContact CE1-CZ3 3.68Å; H512-W567 AromaticContact NE2-CH2 3.88Å; H512-W567 AromaticContact NE2-CZ3 3.6Å; H512-Y607 HydrophobicContact CB-CD2 3.88Å; H512-Y607 HydrophobicContact CB-CG 4.29Å; H512-Y607 PolarHBondContact N-O 3.25Å; H512-Y607 PolarHBondContact O-N 2.76Å
513	V	97	Very high	87	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.006	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	124.7	171.5	179.5	0	0	0	0	108.6	L510 T562 T563 F566 W575 I604	L510-V513 HydrophobicContact CD1-CG2 4.09Å; L510-V513 HydrophobicContact CD2-CG2 3.78Å; L510-V513 HydrophobicContact CG-CG2 4.43Å; V513-T562 CarbonylContact O-C 3.58Å; V513-T562 WeakPolarHBondContact O-CA 3.02Å; V513-T563 HydrophobicContact CB-CG2 3.96Å; V513-T563 PolarHBondContact N-O 3.33Å; V513-T563 PolarHBondContact O-N 2.04Å; V513-F566 HydrophobicContact CB-CD2 4.2Å; V513-F566 HydrophobicContact CG2-CD2 3.99Å; V513-W575 HydrophobicContact CG2-CH2 4.17Å; V513-I604 HydrophobicContact CG1-CG2 3.62Å
514	Q	94.8	Very high	87.5	Confident	10 Å²	10	26.6 Å²	26.6	5%	0.047	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	126.3	172	-60.4	-172.6	-60.3	0	0	109.2	Y516 P560 V561 T562 I604 V605 Y607	Q514-Y516 HydrophobicContact CB-CD2 4.42Å; Q514-Y516 HydrophobicContact CB-CE2 3.8Å; Q514-Y516 PolarHBondContact OE1-OH 3.34Å; Q514-P560 HydrophobicContact CB-CB 4.4Å; Q514-V561 WeakPolarHBondContact CA-O 3.01Å; Q514-T562 HydrophobicContact CG-CG2 4.11Å; Q514-T562 WeakPolarHBondContact CG-OG1 3.14Å; Q514-T562 PolarHBondContact NE2-OG1 3.47Å; Q514-T562 VanDerWaalsContact NE2-OG1 3.14Å; Q514-I604 WeakPolarHBondContact O-CA 3.27Å; Q514-V605 HydrophobicContact CB-CB 4.38Å; Q514-V605 PolarHBondContact N-O 2.95Å; Q514-V605 PolarHBondContact O-N 2.88Å; Q514-Y607 HydrophobicContact CG-CE2 3.98Å; Q514-Y607 PolarHBondContact OE1-OH 2.86Å
515	V	93.1	Very high	87.7	Confident	0 Å²	0	25 Å²	25	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	127.1	170.6	-177.3	0	0	0	0	108.5	L529 L541 V561 I577 V602 I604	V515-L529 HydrophobicContact CG1-CD2 4.44Å; V515-L541 HydrophobicContact CB-CD1 3.63Å; V515-L541 HydrophobicContact CG1-CD1 4.3Å; V515-L541 HydrophobicContact CG2-CD1 3.37Å; V515-V561 PolarHBondContact N-O 3.48Å; V515-V561 PolarHBondContact O-N 2.98Å; V515-I577 HydrophobicContact CG1-CD1 4.32Å; V515-V602 HydrophobicContact CG1-CG2 4.06Å; V515-I604 HydrophobicContact CG2-CG1 4.26Å
516	Y	88	Confident	87.7	Confident	39 Å²	39	24.2 Å²	24.2	15%	0.153	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	125.8	172.3	-66	-103.7	0	0	0	107.3	Q514 R558 P560 V602 W603 V605	Q514-Y516 HydrophobicContact CB-CD2 4.42Å; Q514-Y516 HydrophobicContact CB-CE2 3.8Å; Q514-Y516 PolarHBondContact OE1-OH 3.34Å; Y516-R558 WeakPolarHBondContact CD1-O 3.24Å; Y516-P560 HydrophobicContact CD1-CB 4.37Å; Y516-P560 HydrophobicContact CE1-CB 3.74Å; Y516-P560 HydrophobicContact CE1-CG 4.33Å; Y516-P560 HydrophobicContact CE2-CB 4.21Å; Y516-V602 CarbonylContact O-C 3.05Å; Y516-V602 VanDerWaalsContact O-CA 3.23Å; Y516-V602 WeakPolarHBondContact O-CA 2.86Å; Y516-V602 VanDerWaalsContact O-CG2 3.32Å; Y516-V602 WeakPolarHBondContact O-CG2 3.08Å; Y516-W603 AromaticContact CD1-CE2 3.98Å; Y516-W603 HydrophobicContact CD1-CH2 4.18Å; Y516-W603 AromaticContact CD1-CZ2 3.47Å; Y516-W603 HydrophobicContact CD1-CZ2 3.47Å; Y516-W603 VanDerWaalsContact CD1-CZ2 3.47Å; Y516-W603 AromaticContact CD2-CD1 3.91Å; Y516-W603 AromaticContact CD2-CE2 3.79Å; Y516-W603 HydrophobicContact CD2-CZ2 4.16Å; Y516-W603 AromaticContact CD2-NE1 3.3Å; Y516-W603 VanDerWaalsContact CD2-NE1 3.3Å; Y516-W603 HydrophobicContact CE1-CZ2 4.33Å; Y516-W603 AromaticContact CE2-NE1 3.97Å; Y516-W603 HydrophobicContact CG-CD2 4.22Å; Y516-W603 AromaticContact CG-CE2 3.4Å; Y516-W603 HydrophobicContact CG-CH2 4.12Å; Y516-W603 AromaticContact CG-CZ2 3.35Å; Y516-W603 HydrophobicContact CG-CZ2 3.35Å; Y516-W603 AromaticContact CG-NE1 3.44Å; Y516-W603 PolarHBondContact N-O 3.35Å; Y516-W603 PolarHBondContact O-N 2.91Å; Y516-V605 HydrophobicContact CD2-CG2 4.01Å; Y516-V605 HydrophobicContact CE2-CB 4.11Å; Y516-V605 HydrophobicContact CE2-CG2 3.5Å
517	A	83.6	Confident	87.7	Confident	2 Å²	2	23 Å²	23	2%	0.017	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	123	177.1	0	0	0	0	0	109.4	I519 L529 S601 V602	A517-I519 HydrophobicContact CB-CD1 3.67Å; A517-I519 HydrophobicContact CB-CG1 4.03Å; A517-I519 PolarHBondContact O-N 3.24Å; A517-L529 HydrophobicContact CB-CD2 4.48Å; A517-S601 WeakPolarHBondContact CA-O 3.35Å; A517-V602 HydrophobicContact CB-CG2 4.16Å
518	D	82.6	Confident	87.8	Confident	14 Å²	14	24.8 Å²	24.8	8%	0.075	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	96.9	176.5	-71.1	-22.9	0	0	0	109.2	M556 L557 R558 R600 S601	D518-M556 CarbonylContact C-O 3.36Å; D518-M556 VanDerWaalsContact CA-O 3.23Å; D518-M556 WeakPolarHBondContact CA-O 3.43Å; D518-L557 HydrophobicContact CB-CD2 4.19Å; D518-R558 PolarHBondContact OD1-N 3.12Å; D518-R600 HydrophobicContact CB-CB 3.92Å; D518-R600 PolarHBondContact O-N 2.87Å; D518-S601 PolarHBondContact N-O 2.95Å; D518-S601 PolarHBondContact OD2-OG 2.95Å
519	I	83.6	Confident	88	Confident	3 Å²	3	20 Å²	20	2%	0.015	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	121	-173.9	-55.9	162.9	0	0	0	110.3	L467 A517 L527 A555 M556 L579 W599	L467-I519 HydrophobicContact CD1-CG2 3.95Å; A517-I519 HydrophobicContact CB-CD1 3.67Å; A517-I519 HydrophobicContact CB-CG1 4.03Å; A517-I519 PolarHBondContact O-N 3.24Å; I519-L527 HydrophobicContact CG2-CD1 3.77Å; I519-A555 WeakPolarHBondContact O-CB 3.43Å; I519-M556 HydrophobicContact CB-CB 4.46Å; I519-M556 PolarHBondContact N-O 2.81Å; I519-M556 PolarHBondContact O-N 3.33Å; I519-L579 HydrophobicContact CD1-CD1 3.65Å; I519-L579 HydrophobicContact CD1-CD2 3.82Å; I519-L579 HydrophobicContact CD1-CG 4.36Å; I519-L579 HydrophobicContact CG1-CD2 4.35Å; I519-L579 HydrophobicContact CG2-CD2 4.34Å; I519-W599 HydrophobicContact CG1-CB 4.45Å; I519-W599 HydrophobicContact CG1-CG 4.04Å
520	V	80.4	Confident	88.1	Confident	68 Å²	68	17.6 Å²	17.6	41%	0.412	9%	0.085	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	125.8	167.2	-171.9	0	0	0	0	106.7	A555 G597 F598	V520-A555 HydrophobicContact CB-CB 4.04Å; V520-A555 HydrophobicContact CG1-CB 4.24Å; V520-A555 HydrophobicContact CG2-CB 3.56Å; V520-G597 CarbonylContact O-C 3.49Å; V520-G597 WeakPolarHBondContact O-CA 3.49Å; V520-F598 PolarHBondContact N-O 2.03Å; V520-F598 PolarHBondContact O-N 3.43Å
521	Y	80	Confident	88.1	Confident	5 Å²	5	17.6 Å²	17.6	2%	0.02	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	128.4	175.6	-169.2	-113.9	0	0	0	108	L467 G469 F471 R523 R524 L526 L527 S551 I595	L467-Y521 HydrophobicContact CB-CD2 3.96Å; L467-Y521 HydrophobicContact CB-CE2 4.07Å; L467-Y521 HydrophobicContact CD1-CD2 4.14Å; G469-Y521 PolarHBondContact O-OH 3.04Å; F471-Y521 HydrophobicContact CE1-CD2 4.27Å; F471-Y521 AromaticContact CE1-CE2 3.64Å; F471-Y521 HydrophobicContact CE1-CE2 3.64Å; F471-Y521 AromaticContact CE1-CZ 3.9Å; F471-Y521 HydrophobicContact CZ-CE2 4.45Å; Y521-R523 VanDerWaalsContact CD1-O 3.24Å; Y521-R523 WeakPolarHBondContact CD1-O 3.36Å; Y521-R523 PolarHBondContact O-N 2.95Å; Y521-R523 VanDerWaalsContact O-N 3.08Å; Y521-R524 PolarHBondContact O-N 3.05Å; Y521-L526 HydrophobicContact CE1-CB 4.28Å; Y521-L527 HydrophobicContact CD1-CD1 4.2Å; Y521-L527 HydrophobicContact CD1-CD2 3.62Å; Y521-L527 HydrophobicContact CD1-CG 3.75Å; Y521-L527 HydrophobicContact CD2-CD2 4.41Å; Y521-L527 HydrophobicContact CE1-CD2 3.98Å; Y521-L527 HydrophobicContact CE1-CG 4.43Å; Y521-L527 HydrophobicContact CG-CD1 4.19Å; Y521-L527 HydrophobicContact CG-CD2 3.87Å; Y521-L527 HydrophobicContact CG-CG 4.17Å; Y521-S551 WeakPolarHBondContact O-CB 3.42Å; Y521-S551 PolarHBondContact O-OG 2.87Å; Y521-I595 HydrophobicContact CD1-CG2 4.45Å; Y521-I595 HydrophobicContact CE1-CG2 3.77Å; Y521-I595 HydrophobicContact CE2-CG2 3.91Å; Y521-I595 VanDerWaalsContact CZ-CG2 3.45Å; Y521-I595 WeakPolarHBondContact OH-CG2 3.43Å
522	E	75.9	Confident	88.1	Confident	95 Å²	95	19.3 Å²	19.3	44%	0.444	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-34.8	-169.3	179.8	175.2	-170.4	0	0	113.6	S551 I595 K596	E522-S551 PolarHBondContact O-N 3.06Å; E522-S551 VanDerWaalsContact O-N 3.15Å; E522-I595 HydrophobicContact CB-CG2 3.97Å; E522-K596 WeakPolarHBondContact CB-O 3.36Å; E522-K596 PolarHBondContact N-O 3.01Å; E522-K596 PolarHBondContact OE2-N 3.33Å
523	R	78.8	Confident	88.2	Confident	43 Å²	43	19.2 Å²	19.2	16%	0.162	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.1	73	174.6	-69	-75.4	-75.6	-139	5.6	111.4	Y521 G525 L526 E549 I595	Y521-R523 VanDerWaalsContact CD1-O 3.24Å; Y521-R523 WeakPolarHBondContact CD1-O 3.36Å; Y521-R523 PolarHBondContact O-N 2.95Å; Y521-R523 VanDerWaalsContact O-N 3.08Å; R523-G525 PolarHBondContact O-N 2.85Å; R523-G525 VanDerWaalsContact O-N 3.1Å; R523-L526 HydrophobicContact CB-CD1 3.74Å; R523-L526 HydrophobicContact CB-CG 4.01Å; R523-L526 HydrophobicContact CG-CD1 4.42Å; R523-L526 WeakPolarHBondContact O-CB 3.38Å; R523-L526 PolarHBondContact O-N 3.16Å; R523-E549 VanDerWaalsContact CD-C 3.48Å; R523-E549 WeakPolarHBondContact CD-O 3.12Å; R523-E549 IonicContact CZ-OE1 3.69Å; R523-E549 PolarHBondContact NE-O 3.41Å; R523-E549 PolarHBondContact NH1-O 3.49Å; R523-E549 IonicContact NH1-OE1 2.87Å; R523-E549 PolarHBondContact NH1-OE1 2.62Å; R523-E549 IonicContact NH2-OE1 3.36Å; R523-E549 PolarHBondContact NH2-OE1 3.19Å; R523-I595 HydrophobicContact CB-CD1 4.42Å; R523-I595 HydrophobicContact CB-CG2 4.34Å; R523-I595 HydrophobicContact CG-CD1 4.11Å; R523-I595 HydrophobicContact CG-CG2 4.45Å
524	R	83.3	Confident	88.2	Confident	17 Å²	17	21.3 Å²	21.3	6%	0.064	11%	0.107	C	C	.	.	G	3₁₀ helix	trans	-50.2	-36	-177.2	169.1	179.5	60.6	-136.8	-8.9	113.8	Y521 L526 L527 D548 S551 I554 M556	Y521-R524 PolarHBondContact O-N 3.05Å; R524-L526 PolarHBondContact O-N 3.49Å; R524-L527 VanDerWaalsContact O-CB 3.28Å; R524-L527 WeakPolarHBondContact O-CB 3.48Å; R524-L527 WeakPolarHBondContact O-CG 3.34Å; R524-L527 PolarHBondContact O-N 2.96Å; R524-D548 WeakPolarHBondContact CD-OD2 3.21Å; R524-D548 VanDerWaalsContact CG-OD2 3.29Å; R524-D548 WeakPolarHBondContact CG-OD2 3.29Å; R524-D548 IonicContact CZ-OD1 2.65Å; R524-D548 IonicContact CZ-OD2 3.8Å; R524-D548 IonicContact NE-OD1 3.57Å; R524-D548 PolarHBondContact NE-OD1 3.27Å; R524-D548 IonicContact NE-OD2 3.81Å; R524-D548 PolarHBondContact NE-OD2 2.86Å; R524-D548 IonicContact NH2-OD1 2.69Å; R524-D548 PolarHBondContact NH2-OD1 3.13Å; R524-D548 IonicContact NH2-OD2 2.83Å; R524-D548 PolarHBondContact NH2-OD2 2.68Å; R524-S551 WeakPolarHBondContact CB-OG 3.49Å; R524-S551 PolarHBondContact N-OG 3.41Å; R524-S551 VanDerWaalsContact N-OG 3.14Å; R524-I554 PolarHBondContact NH1-O 3.32Å; R524-M556 HydrophobicContact CG-CG 4.31Å; R524-M556 HydrophobicContact CG-SD 4.33Å
525	G	84.3	Confident	88.2	Confident	3 Å²	3	23.7 Å²	23.7	3%	0.031	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-56.4	-19.4	178.9	0	0	0	0	0	116.2	R523 L527 P544 R545 D548	R523-G525 PolarHBondContact O-N 2.85Å; R523-G525 VanDerWaalsContact O-N 3.1Å; G525-L527 VanDerWaalsContact C-N 3.33Å; G525-P544 CarbonylContact O-C 3.49Å; G525-P544 WeakPolarHBondContact O-CA 3.26Å; G525-R545 CarbonylContact C-O 3.43Å; G525-R545 WeakPolarHBondContact CA-O 3.01Å; G525-R545 CarbonylContact O-C 3.5Å; G525-R545 PolarHBondContact O-N 3.44Å; G525-D548 WeakPolarHBondContact CA-O 3.46Å; G525-D548 PolarHBondContact N-O 3.36Å; G525-D548 PolarHBondContact N-OD2 3.2Å
526	L	83.8	Confident	88.3	Confident	15 Å²	15	26.3 Å²	26.3	8%	0.079	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-81.6	-13.5	176.7	-60.2	179.5	0	0	0	113.5	Y521 R523 R524 S581 L583 I595	Y521-L526 HydrophobicContact CE1-CB 4.28Å; R523-L526 HydrophobicContact CB-CD1 3.74Å; R523-L526 HydrophobicContact CB-CG 4.01Å; R523-L526 HydrophobicContact CG-CD1 4.42Å; R523-L526 WeakPolarHBondContact O-CB 3.38Å; R523-L526 PolarHBondContact O-N 3.16Å; R524-L526 PolarHBondContact O-N 3.49Å; L526-S581 WeakPolarHBondContact O-CA 3.21Å; L526-L583 HydrophobicContact CD2-CB 3.95Å; L526-I595 HydrophobicContact CD1-CD1 3.73Å
527	L	88.3	Confident	88.8	Confident	4 Å²	4	24.8 Å²	24.8	2%	0.021	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	139.2	-177.3	-61	178.8	0	0	0	111	F471 I519 Y521 R524 G525 L579 D580	F471-L527 HydrophobicContact CE1-CD2 4.27Å; F471-L527 HydrophobicContact CZ-CD2 3.58Å; I519-L527 HydrophobicContact CG2-CD1 3.77Å; Y521-L527 HydrophobicContact CD1-CD1 4.2Å; Y521-L527 HydrophobicContact CD1-CD2 3.62Å; Y521-L527 HydrophobicContact CD1-CG 3.75Å; Y521-L527 HydrophobicContact CD2-CD2 4.41Å; Y521-L527 HydrophobicContact CE1-CD2 3.98Å; Y521-L527 HydrophobicContact CE1-CG 4.43Å; Y521-L527 HydrophobicContact CG-CD1 4.19Å; Y521-L527 HydrophobicContact CG-CD2 3.87Å; Y521-L527 HydrophobicContact CG-CG 4.17Å; R524-L527 VanDerWaalsContact O-CB 3.28Å; R524-L527 WeakPolarHBondContact O-CB 3.48Å; R524-L527 WeakPolarHBondContact O-CG 3.34Å; R524-L527 PolarHBondContact O-N 2.96Å; G525-L527 VanDerWaalsContact C-N 3.33Å; L527-L579 HydrophobicContact CB-CD1 4.45Å; L527-L579 HydrophobicContact CD2-CD1 4.39Å; L527-D580 CarbonylContact C-O 3.49Å; L527-D580 WeakPolarHBondContact CA-O 3.29Å
528	Q	92.1	Very high	89.3	Confident	38 Å²	38	29 Å²	29	18%	0.178	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	125.6	161.8	-175.7	-177.8	-89	0	0	108.4	S530 V540 L542 P544 L579 D580 I582	Q528-S530 PolarHBondContact NE2-OG 3.43Å; Q528-V540 HydrophobicContact CG-CG1 4.02Å; Q528-L542 WeakPolarHBondContact CA-O 3.4Å; Q528-P544 HydrophobicContact CB-CG 4.1Å; Q528-L579 WeakPolarHBondContact O-CA 3.39Å; Q528-D580 HydrophobicContact CB-CB 4.44Å; Q528-D580 PolarHBondContact N-O 2.78Å; Q528-D580 PolarHBondContact O-N 3.47Å; Q528-I582 HydrophobicContact CB-CD1 4.12Å; Q528-I582 HydrophobicContact CG-CD1 4.46Å; Q528-I582 VanDerWaalsContact NE2-CD1 3.3Å
529	L	93.6	Very high	90	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.01	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	124.4	170.4	-176	68.1	0	0	0	108.9	V515 A517 L541 L542 V561 I577 L579	V515-L529 HydrophobicContact CG1-CD2 4.44Å; A517-L529 HydrophobicContact CB-CD2 4.48Å; L529-L541 HydrophobicContact CD2-CB 4.41Å; L529-L541 HydrophobicContact CD2-CD1 4.17Å; L529-L541 HydrophobicContact CG-CB 4.35Å; L529-L541 HydrophobicContact CG-CD1 4.25Å; L529-L541 WeakPolarHBondContact O-CA 3.43Å; L529-L541 WeakPolarHBondContact O-CB 3.5Å; L529-L541 PolarHBondContact O-N 3.37Å; L529-L542 HydrophobicContact CB-CB 4.09Å; L529-L542 PolarHBondContact N-O 3.32Å; L529-L542 PolarHBondContact O-N 3.39Å; L529-V561 HydrophobicContact CD2-CG2 4.1Å; L529-I577 HydrophobicContact CD1-CG2 3.88Å; L529-L579 HydrophobicContact CB-CD1 4.47Å; L529-L579 HydrophobicContact CD1-CD1 4.14Å
530	S	96.1	Very high	90.6	Very high	5 Å²	5	29.9 Å²	29.9	4%	0.035	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	156	177.8	-63.2	0	0	0	0	110.2	Q528 S539 C578	Q528-S530 PolarHBondContact NE2-OG 3.43Å; S530-S539 CarbonylContact C-O 3.55Å; S530-S539 VanDerWaalsContact CA-O 3.29Å; S530-S539 WeakPolarHBondContact CA-O 3.4Å; S530-C578 PolarHBondContact N-O 3.4Å; S530-C578 PolarHBondContact O-N 2.82Å
531	V	97.2	Very high	91.3	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	139.4	175.7	73.1	0	0	0	0	111.1	S539 L541 F566 W575 Q576 I577	V531-S539 PolarHBondContact N-O 3.3Å; V531-S539 PolarHBondContact O-N 3.39Å; V531-L541 HydrophobicContact CB-CD1 3.95Å; V531-L541 HydrophobicContact CB-CG 4.34Å; V531-L541 HydrophobicContact CG1-CD1 3.74Å; V531-L541 HydrophobicContact CG1-CD2 3.78Å; V531-L541 HydrophobicContact CG1-CG 3.84Å; V531-F566 HydrophobicContact CG1-CE2 3.49Å; V531-F566 VanDerWaalsContact CG1-CE2 3.49Å; V531-F566 HydrophobicContact CG1-CZ 3.5Å; V531-W575 HydrophobicContact CG2-CE3 3.72Å; V531-W575 HydrophobicContact CG2-CZ3 4.31Å; V531-Q576 CarbonylContact C-O 3.56Å; V531-Q576 VanDerWaalsContact CA-O 3.31Å; V531-Q576 WeakPolarHBondContact CA-O 3.04Å; V531-Q576 WeakPolarHBondContact CG2-O 3.41Å; V531-I577 HydrophobicContact CG2-CG1 4.03Å
532	I	98	Very high	91.8	Very high	38 Å²	38	26.6 Å²	26.6	20%	0.195	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	124.4	174.8	-54.3	172.2	0	0	0	108.4	T537 L538 Q576	I532-T537 CarbonylContact C-O 3.59Å; I532-T537 VanDerWaalsContact CA-O 3.23Å; I532-T537 WeakPolarHBondContact CA-O 3.39Å; I532-L538 HydrophobicContact CD1-CD1 4.39Å; I532-L538 HydrophobicContact CG1-CB 4.44Å; I532-L538 HydrophobicContact CG1-CD1 3.73Å; I532-Q576 HydrophobicContact CB-CB 4.04Å; I532-Q576 HydrophobicContact CB-CG 4.28Å; I532-Q576 HydrophobicContact CD1-CB 4.46Å; I532-Q576 PolarHBondContact N-O 2.69Å; I532-Q576 PolarHBondContact O-N 3.33Å
533	S	97.3	Very high	92.6	Very high	2 Å²	2	22.7 Å²	22.7	1%	0.014	14%	0.138	C	C	.	.			trans	-68.5	159.3	176.7	80.1	0	0	0	0	111.6	S535 G536 T537 E569	S533-S535 PolarHBondContact O-N 2.92Å; S533-S535 PolarHBondContact OG-N 3.47Å; S533-G536 PolarHBondContact O-N 3.47Å; S533-G536 PolarHBondContact OG-N 3.24Å; S533-T537 PolarHBondContact N-O 2.67Å; S533-T537 PolarHBondContact OG-N 2.94Å; S533-E569 VanDerWaalsContact CB-OE2 3.23Å; S533-E569 WeakPolarHBondContact CB-OE2 3.31Å; S533-E569 PolarHBondContact OG-OE2 2.91Å
534	P	96.8	Very high	93.1	Very high	44 Å²	44	21.9 Å²	21.9	29%	0.286	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-21.9	173.6	-24.8	34.1	0	0	0	113.3	G536 W575	P534-G536 VanDerWaalsContact C-N 3.35Å; P534-W575 HydrophobicContact CG-CD2 4.24Å; P534-W575 HydrophobicContact CG-CG 4.11Å; P534-W575 HydrophobicContact CG-CZ2 4.49Å
535	S	95.8	Very high	93.3	Very high	60 Å²	60	21.1 Å²	21.1	42%	0.42	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-1.1	177.7	-50.4	0	0	0	0	113.2	S533	S533-S535 PolarHBondContact O-N 2.92Å; S533-S535 PolarHBondContact OG-N 3.47Å
536	G	95.3	Very high	93.1	Very high	56 Å²	56	22 Å²	22	58%	0.577	14%	0.141	S	C	*	.	S	Bend	trans	95.1	5.2	173	0	0	0	0	0	115.9	S533 P534	S533-G536 PolarHBondContact O-N 3.47Å; S533-G536 PolarHBondContact OG-N 3.24Å; P534-G536 VanDerWaalsContact C-N 3.35Å
537	T	97.5	Very high	93	Very high	7 Å²	7	24.8 Å²	24.8	4%	0.043	15%	0.153	C	C	.	.			trans	-76.9	131.4	177.8	-58	0	0	0	0	110.3	N420 A421 Y426 I532 S533 F566 E569	N420-T537 WeakPolarHBondContact CA-OG1 3.17Å; N420-T537 HydrophobicContact CB-CG2 3.73Å; A421-T537 PolarHBondContact N-OG1 2.91Å; Y426-T537 HydrophobicContact CE1-CG2 4Å; Y426-T537 VanDerWaalsContact OH-CG2 3.31Å; Y426-T537 WeakPolarHBondContact OH-CG2 3.43Å; I532-T537 CarbonylContact C-O 3.59Å; I532-T537 VanDerWaalsContact CA-O 3.23Å; I532-T537 WeakPolarHBondContact CA-O 3.39Å; S533-T537 PolarHBondContact N-O 2.67Å; S533-T537 PolarHBondContact OG-N 2.94Å; T537-F566 HydrophobicContact CG2-CD1 3.74Å; T537-F566 HydrophobicContact CG2-CE1 3.69Å; T537-F566 WeakPolarHBondContact O-CE1 3.14Å; T537-E569 VanDerWaalsContact CB-OE1 3.26Å; T537-E569 WeakPolarHBondContact CB-OE1 3.37Å; T537-E569 PolarHBondContact OG1-OE1 3.01Å; T537-E569 PolarHBondContact OG1-OE2 3.18Å
538	L	95.7	Very high	92.7	Very high	91 Å²	91	24.7 Å²	24.7	48%	0.476	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	127.5	175.6	172.2	66.9	0	0	0	110.8	Y426 I532	Y426-L538 PolarHBondContact OH-O 2.79Å; I532-L538 HydrophobicContact CD1-CD1 4.39Å; I532-L538 HydrophobicContact CG1-CB 4.44Å; I532-L538 HydrophobicContact CG1-CD1 3.73Å
539	S	96.8	Very high	91.7	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	127.3	170	-170.9	0	0	0	0	110.2	S530 V531 L541 T563 Q565	S530-S539 CarbonylContact C-O 3.55Å; S530-S539 VanDerWaalsContact CA-O 3.29Å; S530-S539 WeakPolarHBondContact CA-O 3.4Å; V531-S539 PolarHBondContact N-O 3.3Å; V531-S539 PolarHBondContact O-N 3.39Å; S539-L541 PolarHBondContact O-N 3.06Å; S539-T563 PolarHBondContact OG-OG1 3.49Å; S539-Q565 PolarHBondContact OG-OE1 2.85Å
540	V	95.5	Very high	90.1	Very high	35 Å²	35	33.9 Å²	33.9	21%	0.212	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	108	170.2	-179	0	0	0	0	107.1	S340 Q428 Q528 P543	S340-V540 WeakPolarHBondContact CB-O 3.48Å; Q428-V540 PolarHBondContact NE2-O 3.42Å; Q428-V540 PolarHBondContact OE1-O 3.27Å; Q528-V540 HydrophobicContact CG-CG1 4.02Å; V540-P543 HydrophobicContact CG1-CB 4.29Å
541	L	94.4	Very high	88.1	Confident	0 Å²	0	34 Å²	34	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	-50.3	-173.7	-60.7	-175.8	0	0	0	111.2	A310 V515 L529 V531 S539 V561 T563	A310-L541 WeakPolarHBondContact CB-O 3.24Å; V515-L541 HydrophobicContact CB-CD1 3.63Å; V515-L541 HydrophobicContact CG1-CD1 4.3Å; V515-L541 HydrophobicContact CG2-CD1 3.37Å; L529-L541 HydrophobicContact CD2-CB 4.41Å; L529-L541 HydrophobicContact CD2-CD1 4.17Å; L529-L541 HydrophobicContact CG-CB 4.35Å; L529-L541 HydrophobicContact CG-CD1 4.25Å; L529-L541 WeakPolarHBondContact O-CA 3.43Å; L529-L541 WeakPolarHBondContact O-CB 3.5Å; L529-L541 PolarHBondContact O-N 3.37Å; V531-L541 HydrophobicContact CB-CD1 3.95Å; V531-L541 HydrophobicContact CB-CG 4.34Å; V531-L541 HydrophobicContact CG1-CD1 3.74Å; V531-L541 HydrophobicContact CG1-CD2 3.78Å; V531-L541 HydrophobicContact CG1-CG 3.84Å; S539-L541 PolarHBondContact O-N 3.06Å; L541-V561 HydrophobicContact CB-CB 4.18Å; L541-V561 HydrophobicContact CB-CG1 3.57Å; L541-V561 VanDerWaalsContact O-CG1 3.31Å; L541-V561 WeakPolarHBondContact O-CG1 3.27Å; L541-T563 HydrophobicContact CD2-CG2 3.52Å
542	L	92	Very high	85.7	Confident	3 Å²	3	36.1 Å²	36.1	2%	0.016	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	108	176.3	178.8	63.9	0	0	0	108.3	Y269 A310 C311 Q528 L529 M556 V561	Y269-L542 WeakPolarHBondContact OH-CD2 3.48Å; A310-L542 HydrophobicContact CB-CD1 4.04Å; C311-L542 WeakPolarHBondContact SG-CD1 3.41Å; Q528-L542 WeakPolarHBondContact CA-O 3.4Å; L529-L542 HydrophobicContact CB-CB 4.09Å; L529-L542 PolarHBondContact N-O 3.32Å; L529-L542 PolarHBondContact O-N 3.39Å; L542-M556 HydrophobicContact CD2-CE 3.49Å; L542-M556 VanDerWaalsContact CD2-CE 3.49Å; L542-M556 HydrophobicContact CD2-SD 3.67Å; L542-V561 HydrophobicContact CB-CG1 4.41Å
543	P	91.8	Very high	83.3	Confident	13 Å²	13	39.7 Å²	39.7	8%	0.084	24%	0.238	C	C	.	.			trans	-71.9	162.1	170.9	32.2	-34.6	0	0	0	110.8	S308 K338 V540	S308-P543 WeakPolarHBondContact OG-CD 3.41Å; K338-P543 HydrophobicContact CB-CG 4.2Å; V540-P543 HydrophobicContact CG1-CB 4.29Å
544	P	89	Confident	81	Confident	26 Å²	26	44.5 Å²	44.5	17%	0.169	26%	0.262	C	S	.	.			trans	-59.8	141.3	173.4	-21.7	32.6	0	0	0	112.3	G525 Q528 L583	G525-P544 CarbonylContact O-C 3.49Å; G525-P544 WeakPolarHBondContact O-CA 3.26Å; Q528-P544 HydrophobicContact CB-CG 4.1Å; P544-L583 HydrophobicContact CB-CD1 3.36Å; P544-L583 HydrophobicContact CB-CG 4.2Å; P544-L583 HydrophobicContact CG-CD1 4.01Å; P544-L583 HydrophobicContact CG-CG 4.41Å
545	R	88	Confident	79.3	Confident	2 Å²	2	43 Å²	43	1%	0.008	25%	0.254	C	S	.	.			trans	-118.8	93.1	178.1	-62.2	175.2	68.8	-167.9	1.1	108.8	G266 L268 Y269 D306 D307 C311 G525 H547 D548	G266-R545 PolarHBondContact O-NE 2.88Å; L268-R545 PolarHBondContact O-NH1 2.81Å; L268-R545 PolarHBondContact O-NH2 2.73Å; Y269-R545 VanDerWaalsContact CD2-NH1 3.31Å; D306-R545 WeakPolarHBondContact O-CA 3.45Å; D306-R545 WeakPolarHBondContact O-CG 3.26Å; D307-R545 VanDerWaalsContact CG-NH2 3.35Å; D307-R545 IonicContact OD1-CZ 3.79Å; D307-R545 IonicContact OD1-NE 3.52Å; D307-R545 PolarHBondContact OD1-NE 2.92Å; D307-R545 IonicContact OD1-NH1 3.6Å; D307-R545 IonicContact OD1-NH2 2.79Å; D307-R545 PolarHBondContact OD1-NH2 2.63Å; D307-R545 IonicContact OD2-NH2 2.76Å; D307-R545 PolarHBondContact OD2-NH2 3.15Å; C311-R545 PolarHBondContact SG-NH1 2.62Å; G525-R545 CarbonylContact C-O 3.43Å; G525-R545 WeakPolarHBondContact CA-O 3.01Å; G525-R545 CarbonylContact O-C 3.5Å; G525-R545 PolarHBondContact O-N 3.44Å; R545-H547 PolarHBondContact O-N 2.89Å; R545-H547 VanDerWaalsContact O-N 3.09Å; R545-D548 HydrophobicContact CB-CB 4Å; R545-D548 WeakPolarHBondContact O-CB 3.48Å; R545-D548 PolarHBondContact O-N 3.08Å
546	T	80.7	Confident	78	Confident	22 Å²	22	40.6 Å²	40.6	14%	0.135	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-28.7	-167.4	52.5	0	0	0	0	114.4	D306 L583 I587	D306-T546 HydrophobicContact CB-CG2 4.46Å; D306-T546 VanDerWaalsContact OD2-CG2 3.31Å; D306-T546 WeakPolarHBondContact OD2-CG2 3.38Å; D306-T546 PolarHBondContact OD2-OG1 3.29Å; T546-L583 HydrophobicContact CG2-CD1 3.73Å; T546-I587 HydrophobicContact CG2-CD1 3.55Å
547	H	80.2	Confident	76.6	Confident	73 Å²	73	41.3 Å²	41.3	34%	0.338	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-10.2	-179.6	-61.8	85.8	0	0	0	113.6	K267 L305 R545 E549	K267-H547 WeakPolarHBondContact CE-O 3.11Å; K267-H547 VanDerWaalsContact CG-O 3.27Å; K267-H547 WeakPolarHBondContact CG-O 3.36Å; L305-H547 PolarHBondContact O-ND1 2.81Å; R545-H547 PolarHBondContact O-N 2.89Å; R545-H547 VanDerWaalsContact O-N 3.09Å; H547-E549 WeakPolarHBondContact O-CG 3.34Å; H547-E549 PolarHBondContact O-N 3.06Å
548	D	83.4	Confident	75.1	Confident	2 Å²	2	47.7 Å²	47.7	1%	0.011	25%	0.249	C	C	.	.			trans	-79.1	71.7	177.4	-175.5	15.5	0	0	0	110.9	G266 R524 G525 R545	G266-D548 WeakPolarHBondContact O-CB 3.36Å; G266-D548 PolarHBondContact O-N 3.46Å; R524-D548 WeakPolarHBondContact CD-OD2 3.21Å; R524-D548 VanDerWaalsContact CG-OD2 3.29Å; R524-D548 WeakPolarHBondContact CG-OD2 3.29Å; R524-D548 IonicContact CZ-OD1 2.65Å; R524-D548 IonicContact CZ-OD2 3.8Å; R524-D548 IonicContact NE-OD1 3.57Å; R524-D548 PolarHBondContact NE-OD1 3.27Å; R524-D548 IonicContact NE-OD2 3.81Å; R524-D548 PolarHBondContact NE-OD2 2.86Å; R524-D548 IonicContact NH2-OD1 2.69Å; R524-D548 PolarHBondContact NH2-OD1 3.13Å; R524-D548 IonicContact NH2-OD2 2.83Å; R524-D548 PolarHBondContact NH2-OD2 2.68Å; G525-D548 WeakPolarHBondContact CA-O 3.46Å; G525-D548 PolarHBondContact N-O 3.36Å; G525-D548 PolarHBondContact N-OD2 3.2Å; R545-D548 HydrophobicContact CB-CB 4Å; R545-D548 WeakPolarHBondContact O-CB 3.48Å; R545-D548 PolarHBondContact O-N 3.08Å
549	E	71.7	Confident	74.4	Confident	99 Å²	99	45.4 Å²	45.4	46%	0.463	23%	0.234	S	C	.	.			trans	-81.4	-5.6	-170.2	-63.4	-148.5	115.2	0	0	115.4	R523 H547	R523-E549 VanDerWaalsContact CD-C 3.48Å; R523-E549 WeakPolarHBondContact CD-O 3.12Å; R523-E549 IonicContact CZ-OE1 3.69Å; R523-E549 PolarHBondContact NE-O 3.41Å; R523-E549 PolarHBondContact NH1-O 3.49Å; R523-E549 IonicContact NH1-OE1 2.87Å; R523-E549 PolarHBondContact NH1-OE1 2.62Å; R523-E549 IonicContact NH2-OE1 3.36Å; R523-E549 PolarHBondContact NH2-OE1 3.19Å; H547-E549 WeakPolarHBondContact O-CG 3.34Å; H547-E549 PolarHBondContact O-N 3.06Å
550	H	59.8	Low	73.9	Confident	134 Å²	134	46.9 Å²	46.9	62%	0.62	24%	0.244	S	C	*	.			trans	-155.6	120.1	-177.5	-140.3	63.3	0	0	0	110.1
551	S	52.3	Low	73.6	Confident	6 Å²	6	45.3 Å²	45.3	4%	0.042	23%	0.234	C	C	.	.			trans	-74.5	-20.4	168.9	-56.3	0	0	0	0	111.7	Y521 E522 R524 D553 I554	Y521-S551 WeakPolarHBondContact O-CB 3.42Å; Y521-S551 PolarHBondContact O-OG 2.87Å; E522-S551 PolarHBondContact O-N 3.06Å; E522-S551 VanDerWaalsContact O-N 3.15Å; R524-S551 WeakPolarHBondContact CB-OG 3.49Å; R524-S551 PolarHBondContact N-OG 3.41Å; R524-S551 VanDerWaalsContact N-OG 3.14Å; S551-D553 PolarHBondContact O-N 3.29Å; S551-I554 CarbonylContact O-C 3.54Å; S551-I554 WeakPolarHBondContact O-CA 3.38Å; S551-I554 WeakPolarHBondContact O-CB 3.31Å; S551-I554 PolarHBondContact O-N 3.44Å; S551-I554 VanDerWaalsContact O-O 3.1Å
552	G	47.9	Very low	73.5	Confident	46 Å²	46	45.4 Å²	45.4	47%	0.474	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	47	-135.9	-170.9	0	0	0	0	0	110.9	I554	G552-I554 VanDerWaalsContact C-N 3.27Å
553	D	46.9	Very low	73.8	Confident	113 Å²	113	45.2 Å²	45.2	60%	0.604	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.3	1.2	170.4	-73.8	-38.5	0	0	0	114.2	S551 A555 H786 K842	S551-D553 PolarHBondContact O-N 3.29Å; D553-A555 PolarHBondContact O-N 3.29Å; D553-H786 PolarHBondContact O-CE1 2.92Å; D553-H786 PolarHBondContact O-ND1 2.77Å; D553-K842 IonicContact OD1-NZ 2.99Å; D553-K842 PolarHBondContact OD1-NZ 2.02Å
554	I	50.2	Low	74.1	Confident	103 Å²	103	44.9 Å²	44.9	53%	0.528	23%	0.232	S	C	.	.			trans	-103.6	79.4	-170.2	-45.8	173.6	0	0	0	108.8	R524 S551 G552	R524-I554 PolarHBondContact NH1-O 3.32Å; S551-I554 CarbonylContact O-C 3.54Å; S551-I554 WeakPolarHBondContact O-CA 3.38Å; S551-I554 WeakPolarHBondContact O-CB 3.31Å; S551-I554 PolarHBondContact O-N 3.44Å; S551-I554 VanDerWaalsContact O-O 3.1Å; G552-I554 VanDerWaalsContact C-N 3.27Å
555	A	60.6	Low	74.5	Confident	13 Å²	13	43.9 Å²	43.9	11%	0.107	23%	0.225	C	C	.	.			trans	-69.4	163.3	171.1	0	0	0	0	0	112.2	I519 V520 D553 L557	I519-A555 WeakPolarHBondContact O-CB 3.43Å; V520-A555 HydrophobicContact CB-CB 4.04Å; V520-A555 HydrophobicContact CG1-CB 4.24Å; V520-A555 HydrophobicContact CG2-CB 3.56Å; D553-A555 PolarHBondContact O-N 3.29Å; A555-L557 VanDerWaalsContact C-N 3.27Å; A555-L557 HydrophobicContact CB-CD1 4.17Å; A555-L557 HydrophobicContact CB-CD2 4Å; A555-L557 HydrophobicContact CB-CG 3.72Å; A555-L557 PolarHBondContact O-N 2.85Å
556	M	68.5	Low	74.9	Confident	8 Å²	8	43.9 Å²	43.9	4%	0.039	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-71.3	88.6	165.4	-68.9	-177.4	72.8	0	0	107.4	D518 I519 R524 L542 V561	D518-M556 CarbonylContact C-O 3.36Å; D518-M556 VanDerWaalsContact CA-O 3.23Å; D518-M556 WeakPolarHBondContact CA-O 3.43Å; I519-M556 HydrophobicContact CB-CB 4.46Å; I519-M556 PolarHBondContact N-O 2.81Å; I519-M556 PolarHBondContact O-N 3.33Å; R524-M556 HydrophobicContact CG-CG 4.31Å; R524-M556 HydrophobicContact CG-SD 4.33Å; L542-M556 HydrophobicContact CD2-CE 3.49Å; L542-M556 VanDerWaalsContact CD2-CE 3.49Å; L542-M556 HydrophobicContact CD2-SD 3.67Å; M556-V561 HydrophobicContact CE-CG2 4.11Å
557	L	65.6	Low	75.7	Confident	72 Å²	72	42.9 Å²	42.9	38%	0.377	22%	0.218	S	C	.	.			trans	-111.6	117.2	-178.6	-63.7	176	0	0	0	109.1	D518 A555 W559	D518-L557 HydrophobicContact CB-CD2 4.19Å; A555-L557 VanDerWaalsContact C-N 3.27Å; A555-L557 HydrophobicContact CB-CD1 4.17Å; A555-L557 HydrophobicContact CB-CD2 4Å; A555-L557 HydrophobicContact CB-CG 3.72Å; A555-L557 PolarHBondContact O-N 2.85Å; L557-W559 PolarHBondContact O-N 3.4Å
558	R	66.6	Low	76.4	Confident	141 Å²	141	39.9 Å²	39.9	53%	0.532	21%	0.208	S	C	.	.	S	Bend	trans	51.3	25	-179.1	-47.7	-170.2	168.2	172.3	-2.9	114.4	Y516 D518 P560 W603	Y516-R558 WeakPolarHBondContact CD1-O 3.24Å; D518-R558 PolarHBondContact OD1-N 3.12Å; R558-P560 WeakPolarHBondContact O-CD 3.48Å; R558-W603 HydrophobicContact CB-CH2 4.41Å; R558-W603 HydrophobicContact CG-CH2 4.11Å
559	W	80.4	Confident	77.1	Confident	42 Å²	42	39.9 Å²	39.9	16%	0.159	21%	0.208	C	C	.	.			trans	-76.6	121	176.4	-175.4	-97.1	0	0	0	109.6	Y269 E270 A310 C311 L557 V561	Y269-W559 HydrophobicContact CD1-CD2 4.17Å; Y269-W559 AromaticContact CD1-CE2 3.91Å; Y269-W559 HydrophobicContact CD1-CG 4.38Å; Y269-W559 HydrophobicContact CD1-CZ2 4.35Å; Y269-W559 AromaticContact CD1-NE1 3.92Å; E270-W559 WeakPolarHBondContact O-CH2 3.34Å; A310-W559 PolarHBondContact O-NE1 2.9Å; C311-W559 WeakPolarHBondContact O-CZ2 3.47Å; L557-W559 PolarHBondContact O-N 3.4Å; W559-V561 PolarHBondContact O-N 2.91Å
560	P	85.4	Confident	78.1	Confident	31 Å²	31	37.8 Å²	37.8	20%	0.201	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	116.8	178.1	28.5	-30.3	0	0	0	110.6	Q514 Y516 R558	Q514-P560 HydrophobicContact CB-CB 4.4Å; Y516-P560 HydrophobicContact CD1-CB 4.37Å; Y516-P560 HydrophobicContact CE1-CB 3.74Å; Y516-P560 HydrophobicContact CE1-CG 4.33Å; Y516-P560 HydrophobicContact CE2-CB 4.21Å; R558-P560 WeakPolarHBondContact O-CD 3.48Å
561	V	89.1	Confident	79.7	Confident	2 Å²	2	31.4 Å²	31.4	1%	0.012	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	108.2	169.3	-159	0	0	0	0	109	A310 Q514 V515 L529 L541 L542 M556 W559	A310-V561 HydrophobicContact CB-CG1 4Å; Q514-V561 WeakPolarHBondContact CA-O 3.01Å; V515-V561 PolarHBondContact N-O 3.48Å; V515-V561 PolarHBondContact O-N 2.98Å; L529-V561 HydrophobicContact CD2-CG2 4.1Å; L541-V561 HydrophobicContact CB-CB 4.18Å; L541-V561 HydrophobicContact CB-CG1 3.57Å; L541-V561 VanDerWaalsContact O-CG1 3.31Å; L541-V561 WeakPolarHBondContact O-CG1 3.27Å; L542-V561 HydrophobicContact CB-CG1 4.41Å; M556-V561 HydrophobicContact CE-CG2 4.11Å; W559-V561 PolarHBondContact O-N 2.91Å
562	T	94.3	Very high	81.6	Confident	2 Å²	2	33 Å²	33	1%	0.012	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	139.9	-172.1	-52.4	0	0	0	0	112	S316 S340 S341 V513 Q514	S316-T562 WeakPolarHBondContact O-CB 3.19Å; S316-T562 WeakPolarHBondContact O-CG2 3.34Å; S316-T562 PolarHBondContact O-OG1 3.18Å; S340-T562 PolarHBondContact OG-O 2.78Å; S341-T562 PolarHBondContact N-O 3.35Å; V513-T562 CarbonylContact O-C 3.58Å; V513-T562 WeakPolarHBondContact O-CA 3.02Å; Q514-T562 HydrophobicContact CG-CG2 4.11Å; Q514-T562 WeakPolarHBondContact CG-OG1 3.14Å; Q514-T562 PolarHBondContact NE2-OG1 3.47Å; Q514-T562 VanDerWaalsContact NE2-OG1 3.14Å
563	T	97.3	Very high	83.7	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	143.3	169.2	-179.5	0	0	0	0	111.9	S340 V513 S539 L541 Q565 F566	S340-T563 WeakPolarHBondContact O-CA 3.29Å; V513-T563 HydrophobicContact CB-CG2 3.96Å; V513-T563 PolarHBondContact N-O 3.33Å; V513-T563 PolarHBondContact O-N 2.04Å; S539-T563 PolarHBondContact OG-OG1 3.49Å; L541-T563 HydrophobicContact CD2-CG2 3.52Å; T563-Q565 PolarHBondContact OG1-N 3.24Å; T563-Q565 VanDerWaalsContact OG1-N 3.16Å; T563-F566 HydrophobicContact CG2-CD2 3.65Å; T563-F566 HydrophobicContact CG2-CE2 3.44Å; T563-F566 VanDerWaalsContact CG2-CE2 3.44Å; T563-F566 HydrophobicContact CG2-CZ 4.45Å
564	V	97.3	Very high	86.1	Confident	5 Å²	5	29.4 Å²	29.4	3%	0.03	16%	0.156	C	C	.	.			trans	-103.9	-3.2	171.2	-66.4	0	0	0	0	112.4	S340 L343 Y432 F566 W567	S340-V564 WeakPolarHBondContact O-CG2 3.48Å; S340-V564 PolarHBondContact O-N 3.32Å; L343-V564 HydrophobicContact CD1-CB 4.27Å; L343-V564 HydrophobicContact CD1-CG1 4.36Å; L343-V564 HydrophobicContact CD1-CG2 4.18Å; Y432-V564 HydrophobicContact CE2-CG2 4.25Å; Y432-V564 PolarHBondContact OH-O 2.61Å; V564-F566 PolarHBondContact O-N 2.99Å; V564-W567 HydrophobicContact CB-CE3 3.97Å; V564-W567 HydrophobicContact CB-CZ3 4.28Å; V564-W567 HydrophobicContact CG1-CE3 4.18Å; V564-W567 HydrophobicContact CG1-CZ3 3.99Å; V564-W567 WeakPolarHBondContact O-CB 3.21Å; V564-W567 PolarHBondContact O-N 3.46Å; V564-W567 VanDerWaalsContact O-N 3.12Å
565	Q	97.3	Very high	88.3	Confident	6 Å²	6	24.5 Å²	24.5	3%	0.028	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-19.2	-167.8	-62.6	176.1	-9.5	0	0	113.9	N420 Y426 Y432 S539 T563 W567	N420-Q565 WeakPolarHBondContact CB-O 3.46Å; N420-Q565 PolarHBondContact ND2-O 3.15Å; Y426-Q565 HydrophobicContact CD2-CB 3.79Å; Y426-Q565 HydrophobicContact CD2-CG 3.46Å; Y426-Q565 VanDerWaalsContact CD2-CG 3.46Å; Y426-Q565 HydrophobicContact CE2-CB 3.82Å; Y426-Q565 HydrophobicContact CE2-CG 3.78Å; Y426-Q565 HydrophobicContact CG-CB 4.16Å; Y426-Q565 HydrophobicContact CG-CG 4.1Å; Y432-Q565 PolarHBondContact OH-O 3.16Å; S539-Q565 PolarHBondContact OG-OE1 2.85Å; T563-Q565 PolarHBondContact OG1-N 3.24Å; T563-Q565 VanDerWaalsContact OG1-N 3.16Å; Q565-W567 VanDerWaalsContact C-N 3.28Å; Q565-W567 PolarHBondContact O-N 2.8Å
566	F	97.6	Very high	90.1	Very high	2 Å²	2	27 Å²	27	1%	0.009	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	9.7	175.7	-51	-51.6	0	0	0	113.9	L510 V513 V531 T537 T563 V564 G568 E569 W575	L510-F566 HydrophobicContact CD1-CB 3.85Å; V513-F566 HydrophobicContact CB-CD2 4.2Å; V513-F566 HydrophobicContact CG2-CD2 3.99Å; V531-F566 HydrophobicContact CG1-CE2 3.49Å; V531-F566 VanDerWaalsContact CG1-CE2 3.49Å; V531-F566 HydrophobicContact CG1-CZ 3.5Å; T537-F566 HydrophobicContact CG2-CD1 3.74Å; T537-F566 HydrophobicContact CG2-CE1 3.69Å; T537-F566 WeakPolarHBondContact O-CE1 3.14Å; T563-F566 HydrophobicContact CG2-CD2 3.65Å; T563-F566 HydrophobicContact CG2-CE2 3.44Å; T563-F566 VanDerWaalsContact CG2-CE2 3.44Å; T563-F566 HydrophobicContact CG2-CZ 4.45Å; V564-F566 PolarHBondContact O-N 2.99Å; F566-G568 PolarHBondContact O-N 2.91Å; F566-G568 VanDerWaalsContact O-N 3.17Å; F566-E569 VanDerWaalsContact O-CB 3.31Å; F566-E569 WeakPolarHBondContact O-CB 3.2Å; F566-E569 WeakPolarHBondContact O-CG 3.11Å; F566-E569 PolarHBondContact O-N 3.34Å; F566-W575 AromaticContact CD2-CH2 3.82Å; F566-W575 HydrophobicContact CD2-CH2 3.82Å; F566-W575 AromaticContact CD2-CZ3 3.75Å; F566-W575 HydrophobicContact CD2-CZ3 3.75Å; F566-W575 HydrophobicContact CE2-CH2 4.17Å; F566-W575 AromaticContact CE2-CZ3 3.6Å; F566-W575 HydrophobicContact CE2-CZ3 3.6Å; F566-W575 HydrophobicContact CG-CH2 4.17Å; F566-W575 HydrophobicContact CG-CZ3 4.31Å; F566-W575 HydrophobicContact CZ-CZ3 4.08Å
567	W	97.4	Very high	91.4	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	125.3	-173.9	-152.8	-68.6	0	0	0	111.8	L343 Q400 Y401 L404 N420 V422 R424 Y432 L510 E511 H512 V564 Q565	L343-W567 HydrophobicContact CD1-CE3 4.33Å; L343-W567 HydrophobicContact CD1-CZ3 4.07Å; Q400-W567 HydrophobicContact CB-CH2 3.83Å; Q400-W567 HydrophobicContact CB-CZ2 4.35Å; Y401-W567 AromaticContact CD1-NE1 3.44Å; Y401-W567 AromaticContact CD2-CZ2 3.7Å; Y401-W567 HydrophobicContact CD2-CZ2 3.7Å; Y401-W567 AromaticContact CD2-NE1 3.95Å; Y401-W567 AromaticContact CE1-CD1 3.76Å; Y401-W567 AromaticContact CE1-NE1 3Å; Y401-W567 AromaticContact CE2-CE2 3.94Å; Y401-W567 AromaticContact CE2-CZ2 3.69Å; Y401-W567 HydrophobicContact CE2-CZ2 3.69Å; Y401-W567 AromaticContact CE2-NE1 3.57Å; Y401-W567 HydrophobicContact CG-CZ2 4.16Å; Y401-W567 AromaticContact CG-NE1 3.89Å; Y401-W567 AromaticContact CZ-CE2 3.88Å; Y401-W567 AromaticContact CZ-NE1 3.06Å; Y401-W567 PolarHBondContact OH-NE1 3.04Å; L404-W567 HydrophobicContact CD1-CG 4.5Å; L404-W567 HydrophobicContact CD2-CB 4.4Å; L404-W567 HydrophobicContact CD2-CD2 3.28Å; L404-W567 HydrophobicContact CD2-CE3 3.73Å; L404-W567 HydrophobicContact CD2-CG 3.6Å; L404-W567 HydrophobicContact CD2-CH2 4.21Å; L404-W567 HydrophobicContact CD2-CZ2 3.81Å; L404-W567 HydrophobicContact CD2-CZ3 4.17Å; N420-W567 PolarHBondContact ND2-O 2.83Å; V422-W567 WeakPolarHBondContact CG2-O 3.38Å; R424-W567 VanDerWaalsContact NH1-C 3.28Å; R424-W567 PolarHBondContact NH1-O 3.49Å; Y432-W567 WeakPolarHBondContact OH-CB 3.36Å; L510-W567 CarbonylContact O-C 3.51Å; L510-W567 WeakPolarHBondContact O-CA 3.39Å; E511-W567 HydrophobicContact CB-CD2 4.34Å; E511-W567 HydrophobicContact CB-CE3 4.48Å; E511-W567 HydrophobicContact CB-CH2 3.99Å; E511-W567 HydrophobicContact CB-CZ2 3.83Å; E511-W567 HydrophobicContact CB-CZ3 4.31Å; E511-W567 HydrophobicContact CG-CH2 4.4Å; E511-W567 HydrophobicContact CG-CZ2 3.76Å; E511-W567 WeakPolarHBondContact O-CZ3 3.45Å; H512-W567 AromaticContact CE1-CH2 3.57Å; H512-W567 AromaticContact CE1-CZ3 3.68Å; H512-W567 AromaticContact NE2-CH2 3.88Å; H512-W567 AromaticContact NE2-CZ3 3.6Å; V564-W567 HydrophobicContact CB-CE3 3.97Å; V564-W567 HydrophobicContact CB-CZ3 4.28Å; V564-W567 HydrophobicContact CG1-CE3 4.18Å; V564-W567 HydrophobicContact CG1-CZ3 3.99Å; V564-W567 WeakPolarHBondContact O-CB 3.21Å; V564-W567 PolarHBondContact O-N 3.46Å; V564-W567 VanDerWaalsContact O-N 3.12Å; Q565-W567 VanDerWaalsContact C-N 3.28Å; Q565-W567 PolarHBondContact O-N 2.8Å
568	G	95.5	Very high	92.8	Very high	11 Å²	11	23.9 Å²	23.9	11%	0.113	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.5	-7.7	-178.7	0	0	0	0	0	116.3	L510 F566	L510-G568 PolarHBondContact O-N 3.18Å; F566-G568 PolarHBondContact O-N 2.91Å; F566-G568 VanDerWaalsContact O-N 3.17Å
569	E	96.9	Very high	94.1	Very high	2 Å²	2	17.2 Å²	17.2	1%	0.009	10%	0.1	C	C	.	.	S	Bend	trans	-72	162.7	177.3	-66.7	-176.3	-162.8	0	0	112.4	N420 A421 V422 Y509 L510 S533 T537 F566	N420-E569 VanDerWaalsContact CB-OE1 3.3Å; N420-E569 WeakPolarHBondContact CB-OE1 3.17Å; A421-E569 HydrophobicContact CB-CG 4.09Å; A421-E569 PolarHBondContact N-OE1 2.81Å; V422-E569 HydrophobicContact CG1-CG 4.11Å; V422-E569 HydrophobicContact CG2-CG 4.47Å; Y509-E569 WeakPolarHBondContact CA-O 3.46Å; L510-E569 HydrophobicContact CD1-CB 4.24Å; L510-E569 WeakPolarHBondContact CG-O 2.96Å; L510-E569 PolarHBondContact N-O 2.76Å; S533-E569 VanDerWaalsContact CB-OE2 3.23Å; S533-E569 WeakPolarHBondContact CB-OE2 3.31Å; S533-E569 PolarHBondContact OG-OE2 2.91Å; T537-E569 VanDerWaalsContact CB-OE1 3.26Å; T537-E569 WeakPolarHBondContact CB-OE1 3.37Å; T537-E569 PolarHBondContact OG1-OE1 3.01Å; T537-E569 PolarHBondContact OG1-OE2 3.18Å; F566-E569 VanDerWaalsContact O-CB 3.31Å; F566-E569 WeakPolarHBondContact O-CB 3.2Å; F566-E569 WeakPolarHBondContact O-CG 3.11Å; F566-E569 PolarHBondContact O-N 3.34Å
570	N	93.9	Very high	94.5	Very high	55 Å²	55	16.1 Å²	16.1	29%	0.294	10%	0.097	S	C	.	.			trans	-77.8	126.6	172.7	-172.5	-1.2	0	0	0	110.7	R508 V572	R508-N570 VanDerWaalsContact O-CA 3.3Å; R508-N570 WeakPolarHBondContact O-CA 3.43Å; N570-V572 VanDerWaalsContact C-N 3.26Å; N570-V572 PolarHBondContact O-N 2.81Å; N570-V572 WeakPolarHBondContact OD1-CB 3.41Å; N570-V572 WeakPolarHBondContact OD1-CG2 3.49Å; N570-V572 PolarHBondContact OD1-N 2.88Å
571	A	91.6	Very high	94.5	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.089	C	C	.	.			trans	-68.8	-25.6	177.7	0	0	0	0	0	113.2	F479 I507 L510 W575	F479-A571 HydrophobicContact CD1-CB 4.18Å; F479-A571 WeakPolarHBondContact CD1-O 3.1Å; F479-A571 HydrophobicContact CE1-CB 3.97Å; I507-A571 HydrophobicContact CB-CB 4.38Å; I507-A571 HydrophobicContact CG2-CB 4.13Å; L510-A571 HydrophobicContact CD1-CB 4.36Å; L510-A571 HydrophobicContact CD2-CB 3.63Å; L510-A571 HydrophobicContact CG-CB 3.96Å; A571-W575 PolarHBondContact O-NE1 3.24Å
572	V	92.4	Very high	93.3	Very high	40 Å²	40	18.4 Å²	18.4	24%	0.242	11%	0.107	C	C	.	.			trans	-77.6	126.8	-169.2	-176.4	0	0	0	0	111.6	F479 S480 R483 N570	F479-V572 WeakPolarHBondContact O-CA 3.45Å; S480-V572 WeakPolarHBondContact O-CG2 3.44Å; R483-V572 HydrophobicContact CG-CG2 4.15Å; N570-V572 VanDerWaalsContact C-N 3.26Å; N570-V572 PolarHBondContact O-N 2.81Å; N570-V572 WeakPolarHBondContact OD1-CB 3.41Å; N570-V572 WeakPolarHBondContact OD1-CG2 3.49Å; N570-V572 PolarHBondContact OD1-N 2.88Å
573	G	93.4	Very high	91.4	Very high	18 Å²	18	20.5 Å²	20.5	19%	0.186	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	139	-160.5	171.9	0	0	0	0	0	112.4	F479	F479-G573 PolarHBondContact N-O 3.49Å; F479-G573 PolarHBondContact O-N 2.83Å
574	T	96.4	Very high	88.7	Confident	64 Å²	64	20.9 Å²	20.9	39%	0.393	12%	0.122	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	113.4	-178.2	-53.6	0	0	0	0	110.6	F476	F476-T574 HydrophobicContact CB-CG2 3.85Å; F476-T574 HydrophobicContact CD1-CG2 3.88Å; F476-T574 HydrophobicContact CG-CG2 4.36Å
575	W	97.6	Very high	86	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	145.5	171.4	-68.8	75.8	0	0	0	110.3	F476 L477 F479 L510 V513 V531 P534 F566 A571 I604	F476-W575 CarbonylContact C-O 3.4Å; F476-W575 WeakPolarHBondContact CA-O 3.3Å; L477-W575 HydrophobicContact CB-CB 4.42Å; L477-W575 PolarHBondContact N-O 3.13Å; L477-W575 PolarHBondContact O-N 3.07Å; F479-W575 AromaticContact CD1-NE1 3.69Å; L510-W575 HydrophobicContact CD1-CH2 3.77Å; L510-W575 HydrophobicContact CD1-CZ2 3.82Å; V513-W575 HydrophobicContact CG2-CH2 4.17Å; V531-W575 HydrophobicContact CG2-CE3 3.72Å; V531-W575 HydrophobicContact CG2-CZ3 4.31Å; P534-W575 HydrophobicContact CG-CD2 4.24Å; P534-W575 HydrophobicContact CG-CG 4.11Å; P534-W575 HydrophobicContact CG-CZ2 4.49Å; F566-W575 AromaticContact CD2-CH2 3.82Å; F566-W575 HydrophobicContact CD2-CH2 3.82Å; F566-W575 AromaticContact CD2-CZ3 3.75Å; F566-W575 HydrophobicContact CD2-CZ3 3.75Å; F566-W575 HydrophobicContact CE2-CH2 4.17Å; F566-W575 AromaticContact CE2-CZ3 3.6Å; F566-W575 HydrophobicContact CE2-CZ3 3.6Å; F566-W575 HydrophobicContact CG-CH2 4.17Å; F566-W575 HydrophobicContact CG-CZ3 4.31Å; F566-W575 HydrophobicContact CZ-CZ3 4.08Å; A571-W575 PolarHBondContact O-NE1 3.24Å; W575-I604 HydrophobicContact CB-CD1 3.93Å; W575-I604 HydrophobicContact CD2-CD1 3.83Å; W575-I604 HydrophobicContact CE3-CD1 4.11Å; W575-I604 HydrophobicContact CG-CD1 3.76Å
576	Q	97.5	Very high	83.5	Confident	66 Å²	66	33.2 Å²	33.2	31%	0.308	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	113.2	174.5	-40.2	-179.5	20.4	0	0	108.5	T474 L475 F476 V531 I532	T474-Q576 HydrophobicContact CG2-CB 3.9Å; L475-Q576 CarbonylContact O-C 3.41Å; L475-Q576 WeakPolarHBondContact O-CA 3.39Å; F476-Q576 HydrophobicContact CD1-CG 3.88Å; F476-Q576 HydrophobicContact CE1-CB 4.44Å; F476-Q576 HydrophobicContact CE1-CG 3.72Å; V531-Q576 CarbonylContact C-O 3.56Å; V531-Q576 VanDerWaalsContact CA-O 3.31Å; V531-Q576 WeakPolarHBondContact CA-O 3.04Å; V531-Q576 WeakPolarHBondContact CG2-O 3.41Å; I532-Q576 HydrophobicContact CB-CB 4.04Å; I532-Q576 HydrophobicContact CB-CG 4.28Å; I532-Q576 HydrophobicContact CD1-CB 4.46Å; I532-Q576 PolarHBondContact N-O 2.69Å; I532-Q576 PolarHBondContact O-N 3.33Å
577	I	96.4	Very high	80.9	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	116.6	177.5	-56.1	176.6	0	0	0	107.6	T474 L475 L477 V515 L529 V531 W599 V602 I604	T474-I577 CarbonylContact C-O 3.53Å; T474-I577 WeakPolarHBondContact CA-O 3.23Å; L475-I577 PolarHBondContact N-O 2.77Å; L475-I577 PolarHBondContact O-N 3.49Å; L477-I577 HydrophobicContact CB-CD1 4.4Å; L477-I577 HydrophobicContact CD1-CD1 4.1Å; V515-I577 HydrophobicContact CG1-CD1 4.32Å; L529-I577 HydrophobicContact CD1-CG2 3.88Å; V531-I577 HydrophobicContact CG2-CG1 4.03Å; I577-W599 HydrophobicContact CG2-CH2 4.28Å; I577-W599 HydrophobicContact CG2-CZ2 4.29Å; I577-V602 HydrophobicContact CD1-CG1 4.4Å; I577-V602 HydrophobicContact CD1-CG2 3.44Å; I577-V602 VanDerWaalsContact CD1-CG2 3.44Å; I577-V602 HydrophobicContact CG2-CG2 4.27Å; I577-I604 HydrophobicContact CD1-CD1 4.31Å; I577-I604 HydrophobicContact CD1-CG1 4.31Å
578	C	94.9	Very high	78.2	Confident	14 Å²	14	39.4 Å²	39.4	10%	0.095	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	126.9	-175.1	-57.4	0	0	0	0	110.3	H473 S530	H473-C578 CarbonylContact O-C 3.35Å; H473-C578 VanDerWaalsContact O-CA 3.31Å; H473-C578 WeakPolarHBondContact O-CA 3.32Å; S530-C578 PolarHBondContact N-O 3.4Å; S530-C578 PolarHBondContact O-N 2.82Å
579	L	93.5	Very high	75.9	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	118.1	173.7	-172.4	71.2	0	0	0	109.2	L467 F471 H473 I519 L527 Q528 L529 W599	L467-L579 HydrophobicContact CD1-CD2 3.97Å; L467-L579 HydrophobicContact CD2-CD2 4.44Å; F471-L579 HydrophobicContact CE2-CB 4.36Å; F471-L579 HydrophobicContact CE2-CD2 3.86Å; F471-L579 HydrophobicContact CE2-CG 3.79Å; F471-L579 WeakPolarHBondContact CE2-O 3.43Å; F471-L579 HydrophobicContact CZ-CD2 4.14Å; F471-L579 HydrophobicContact CZ-CG 4.26Å; H473-L579 PolarHBondContact N-O 3.41Å; H473-L579 PolarHBondContact O-N 3.27Å; I519-L579 HydrophobicContact CD1-CD1 3.65Å; I519-L579 HydrophobicContact CD1-CD2 3.82Å; I519-L579 HydrophobicContact CD1-CG 4.36Å; I519-L579 HydrophobicContact CG1-CD2 4.35Å; I519-L579 HydrophobicContact CG2-CD2 4.34Å; L527-L579 HydrophobicContact CB-CD1 4.45Å; L527-L579 HydrophobicContact CD2-CD1 4.39Å; Q528-L579 WeakPolarHBondContact O-CA 3.39Å; L529-L579 HydrophobicContact CB-CD1 4.47Å; L529-L579 HydrophobicContact CD1-CD1 4.14Å; L579-W599 HydrophobicContact CB-CE3 4.24Å; L579-W599 HydrophobicContact CB-CH2 4.3Å; L579-W599 HydrophobicContact CB-CZ3 3.85Å; L579-W599 HydrophobicContact CD2-CD2 4.13Å; L579-W599 HydrophobicContact CD2-CE3 3.79Å; L579-W599 HydrophobicContact CD2-CZ3 4.27Å
580	D	89.8	Confident	73.6	Confident	20 Å²	20	54 Å²	54	11%	0.107	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	150.7	-175.7	-59.9	-39.2	0	0	0	111.5	N472 L527 Q528 I582	N472-D580 VanDerWaalsContact CA-OD1 3.31Å; N472-D580 WeakPolarHBondContact CA-OD1 3.47Å; N472-D580 WeakPolarHBondContact CB-OD1 3.46Å; N472-D580 PolarHBondContact ND2-OD1 3.22Å; N472-D580 PolarHBondContact OD1-OD1 3.06Å; L527-D580 CarbonylContact C-O 3.49Å; L527-D580 WeakPolarHBondContact CA-O 3.29Å; Q528-D580 HydrophobicContact CB-CB 4.44Å; Q528-D580 PolarHBondContact N-O 2.78Å; Q528-D580 PolarHBondContact O-N 3.47Å; D580-I582 HydrophobicContact CB-CD1 3.93Å; D580-I582 HydrophobicContact CB-CG1 3.55Å
581	S	84	Confident	71.8	Confident	4 Å²	4	56.3 Å²	56.3	3%	0.028	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	70.7	172.5	68.2	0	0	0	0	110.7	G469 K470 F471 L526 L583	G469-S581 PolarHBondContact O-OG 3Å; K470-S581 VanDerWaalsContact CA-OG 3.28Å; K470-S581 WeakPolarHBondContact CA-OG 3.31Å; F471-S581 PolarHBondContact N-OG 3.11Å; F471-S581 PolarHBondContact O-N 2.63Å; F471-S581 VanDerWaalsContact O-N 3.09Å; F471-S581 PolarHBondContact O-OG 3.38Å; L526-S581 WeakPolarHBondContact O-CA 3.21Å; S581-L583 PolarHBondContact O-N 3.17Å
582	I	64.9	Low	70	Confident	76 Å²	76	58 Å²	58	39%	0.39	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-30.8	-161.1	-52.1	178.3	0	0	0	112.8	Q528 D580	Q528-I582 HydrophobicContact CB-CD1 4.12Å; Q528-I582 HydrophobicContact CG-CD1 4.46Å; Q528-I582 VanDerWaalsContact NE2-CD1 3.3Å; D580-I582 HydrophobicContact CB-CD1 3.93Å; D580-I582 HydrophobicContact CB-CG1 3.55Å
583	L	53.7	Low	68.6	Low	46 Å²	46	62 Å²	62	24%	0.241	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	10	-168.3	-74.2	176.4	0	0	0	116.4	L526 P544 T546 S581 T585	L526-L583 HydrophobicContact CD2-CB 3.95Å; P544-L583 HydrophobicContact CB-CD1 3.36Å; P544-L583 HydrophobicContact CB-CG 4.2Å; P544-L583 HydrophobicContact CG-CD1 4.01Å; P544-L583 HydrophobicContact CG-CG 4.41Å; T546-L583 HydrophobicContact CG2-CD1 3.73Å; S581-L583 PolarHBondContact O-N 3.17Å; L583-T585 PolarHBondContact O-N 3.16Å
584	G	41	Very low	67.2	Low	9 Å²	9	66.5 Å²	66.5	9%	0.093	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-15.5	-176.2	0	0	0	0	0	115.9
585	T	41.2	Very low	66	Low	100 Å²	100	64 Å²	64	61%	0.613	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	-16.7	-168.2	48.8	0	0	0	0	116.7	L583	L583-T585 PolarHBondContact O-N 3.16Å
586	E	44.5	Very low	65.1	Low	170 Å²	170	71 Å²	71	79%	0.794	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111	-18	-171.9	-72.7	-171.2	172.9	0	0	115.5
587	I	43.6	Very low	64.4	Low	95 Å²	95	68.5 Å²	68.5	49%	0.487	35%	0.354	S	S	.	.	S	Bend	trans	-120.1	-22.1	-164.9	-56.8	175.3	0	0	0	113.9	T546	T546-I587 HydrophobicContact CG2-CD1 3.55Å
588	S	39.8	Very low	63.9	Low	37 Å²	37	71.1 Å²	71.1	26%	0.259	37%	0.366	S	S	.	.			trans	-106.9	126.6	-171.5	-152.7	0	0	0	0	113	A590	S588-A590 PolarHBondContact O-N 3.17Å; S588-A590 PolarHBondContact OG-N 2.9Å
589	R	47.9	Very low	63.5	Low	266 Å²	266	70.6 Å²	70.6	100%	1.004	36%	0.362	S	S	*	.	S	Bend	trans	-69.2	-8	164.6	-73.6	-178.9	178.6	161	-0.1	112.7
590	A	47.4	Very low	63	Low	52 Å²	52	75 Å²	75	43%	0.43	38%	0.378	S	S	.	.	S	Bend	trans	-84.4	134.9	174.2	0	0	0	0	0	109.7	S588 P592	S588-A590 PolarHBondContact O-N 3.17Å; S588-A590 PolarHBondContact OG-N 2.9Å; A590-P592 WeakPolarHBondContact O-CD 3.43Å
591	D	56.1	Low	62.7	Low	104 Å²	104	74.4 Å²	74.4	56%	0.556	38%	0.376	S	S	*	.			trans	-54.5	108.4	174	-173.5	-3.6	0	0	0	109.4	D593 N594	D591-D593 PolarHBondContact O-N 2.83Å; D591-D593 VanDerWaalsContact O-N 3.11Å; D591-D593 PolarHBondContact OD1-N 3.39Å; D591-N594 PolarHBondContact O-N 2.98Å; D591-N594 VanDerWaalsContact O-N 3.15Å
592	P	55.5	Low	62.9	Low	37 Å²	37	74.2 Å²	74.2	24%	0.24	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-59.4	-27.2	-174.4	21.4	-30.4	0	0	0	111.6	G469 A590 N594 I595	G469-P592 WeakPolarHBondContact CA-O 3.06Å; A590-P592 WeakPolarHBondContact O-CD 3.43Å; P592-N594 PolarHBondContact O-N 2.89Å; P592-I595 PolarHBondContact O-N 2.91Å
593	D	61	Low	64.2	Low	122 Å²	122	72.1 Å²	72.1	65%	0.652	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-69.4	-13.4	-177.2	-69.9	-21.3	0	0	0	113.7	D591	D591-D593 PolarHBondContact O-N 2.83Å; D591-D593 VanDerWaalsContact O-N 3.11Å; D591-D593 PolarHBondContact OD1-N 3.39Å
594	N	65.9	Low	66.1	Low	114 Å²	114	69.9 Å²	69.9	61%	0.61	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-94.9	-5.9	-179.9	-142.7	7.1	0	0	0	114	D591 P592 K596	D591-N594 PolarHBondContact O-N 2.98Å; D591-N594 VanDerWaalsContact O-N 3.15Å; P592-N594 PolarHBondContact O-N 2.89Å; N594-K596 PolarHBondContact O-N 3.09Å
595	I	69.8	Low	68.5	Low	12 Å²	12	69.5 Å²	69.5	6%	0.062	35%	0.346	C	S	.	.			trans	-72.6	125	179.8	-57.9	176.3	0	0	0	109.2	G468 G469 Y521 E522 R523 L526 P592	G468-I595 WeakPolarHBondContact CA-O 3.3Å; G469-I595 PolarHBondContact N-O 3.45Å; Y521-I595 HydrophobicContact CD1-CG2 4.45Å; Y521-I595 HydrophobicContact CE1-CG2 3.77Å; Y521-I595 HydrophobicContact CE2-CG2 3.91Å; Y521-I595 VanDerWaalsContact CZ-CG2 3.45Å; Y521-I595 WeakPolarHBondContact OH-CG2 3.43Å; E522-I595 HydrophobicContact CB-CG2 3.97Å; R523-I595 HydrophobicContact CB-CD1 4.42Å; R523-I595 HydrophobicContact CB-CG2 4.34Å; R523-I595 HydrophobicContact CG-CD1 4.11Å; R523-I595 HydrophobicContact CG-CG2 4.45Å; L526-I595 HydrophobicContact CD1-CD1 3.73Å; P592-I595 PolarHBondContact O-N 2.91Å
596	K	78.2	Confident	71	Confident	145 Å²	145	64.8 Å²	64.8	63%	0.63	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.8	155.5	-178.3	-64.4	178.5	-173.7	175	0	112.6	L467 E522 N594	L467-K596 CarbonylContact O-C 3.52Å; E522-K596 WeakPolarHBondContact CB-O 3.36Å; E522-K596 PolarHBondContact N-O 3.01Å; E522-K596 PolarHBondContact OE2-N 3.33Å; N594-K596 PolarHBondContact O-N 3.09Å
597	G	83.6	Confident	73.4	Confident	14 Å²	14	57.5 Å²	57.5	14%	0.144	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.6	-173.9	170.1	0	0	0	0	0	113.5	L467 V520	L467-G597 PolarHBondContact N-O 3.18Å; L467-G597 PolarHBondContact O-N 3.27Å; V520-G597 CarbonylContact O-C 3.49Å; V520-G597 WeakPolarHBondContact O-CA 3.49Å
598	F	85.2	Confident	75.8	Confident	55 Å²	55	53 Å²	53	24%	0.241	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	127.5	-174.2	-170.3	-108.4	0	0	0	110.6	Q464 K465 N466 V520 R600	Q464-F598 HydrophobicContact CB-CZ 4.13Å; K465-F598 CarbonylContact O-C 3.39Å; K465-F598 WeakPolarHBondContact O-CA 3.34Å; K465-F598 WeakPolarHBondContact O-CD2 3.44Å; N466-F598 VanDerWaalsContact OD1-CD2 3.28Å; N466-F598 WeakPolarHBondContact OD1-CD2 3.4Å; V520-F598 PolarHBondContact N-O 2.03Å; V520-F598 PolarHBondContact O-N 3.43Å; F598-R600 HydrophobicContact CD1-CB 4.01Å; F598-R600 HydrophobicContact CE1-CB 3.76Å; F598-R600 HydrophobicContact CE1-CG 4.16Å
599	W	88	Confident	78.1	Confident	3 Å²	3	51.2 Å²	51.2	1%	0.011	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	108.5	169.5	-176.3	6.3	0	0	0	109.1	V463 Q464 K465 L467 H473 L475 I519 I577 L579 S601 V602	V463-W599 HydrophobicContact CB-CD2 4.33Å; V463-W599 HydrophobicContact CB-CG 4.24Å; V463-W599 HydrophobicContact CG1-CB 4.39Å; V463-W599 HydrophobicContact CG1-CD2 3.76Å; V463-W599 HydrophobicContact CG1-CE3 3.99Å; V463-W599 HydrophobicContact CG1-CG 3.95Å; V463-W599 HydrophobicContact CG2-CD2 4.38Å; V463-W599 HydrophobicContact CG2-CZ2 4.35Å; Q464-W599 PolarHBondContact N-O 3.18Å; K465-W599 HydrophobicContact CB-CB 4.47Å; K465-W599 PolarHBondContact N-O 2.85Å; K465-W599 PolarHBondContact O-N 2.92Å; L467-W599 HydrophobicContact CD1-CB 4.17Å; L467-W599 HydrophobicContact CD2-CB 4.34Å; L467-W599 HydrophobicContact CG-CB 4.38Å; H473-W599 HydrophobicContact CB-CZ3 4.19Å; L475-W599 HydrophobicContact CB-CH2 3.93Å; I519-W599 HydrophobicContact CG1-CB 4.45Å; I519-W599 HydrophobicContact CG1-CG 4.04Å; I577-W599 HydrophobicContact CG2-CH2 4.28Å; I577-W599 HydrophobicContact CG2-CZ2 4.29Å; L579-W599 HydrophobicContact CB-CE3 4.24Å; L579-W599 HydrophobicContact CB-CH2 4.3Å; L579-W599 HydrophobicContact CB-CZ3 3.85Å; L579-W599 HydrophobicContact CD2-CD2 4.13Å; L579-W599 HydrophobicContact CD2-CE3 3.79Å; L579-W599 HydrophobicContact CD2-CZ3 4.27Å; W599-S601 PolarHBondContact NE1-O 3.11Å; W599-V602 HydrophobicContact CZ2-CB 4.02Å; W599-V602 HydrophobicContact CZ2-CG1 3.92Å; W599-V602 HydrophobicContact CZ2-CG2 4.25Å
600	R	82.4	Confident	80	Confident	94 Å²	94	40.9 Å²	40.9	36%	0.355	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	-60.7	-175	-176.6	-172.1	-176.2	157.2	8.2	112	D462 V463 Q464 D518 F598 S843	D462-R600 VanDerWaalsContact OD1-O 3.11Å; V463-R600 PolarHBondContact N-O 3.18Å; Q464-R600 PolarHBondContact N-O 3.09Å; Q464-R600 VanDerWaalsContact N-O 3.13Å; D518-R600 HydrophobicContact CB-CB 3.92Å; D518-R600 PolarHBondContact O-N 2.87Å; F598-R600 HydrophobicContact CD1-CB 4.01Å; F598-R600 HydrophobicContact CE1-CB 3.76Å; F598-R600 HydrophobicContact CE1-CG 4.16Å; R600-S843 VanDerWaalsContact CZ-O 3.23Å; R600-S843 PolarHBondContact NH1-O 3.49Å; R600-S843 PolarHBondContact NH2-O 2.81Å
601	S	83.2	Confident	81.8	Confident	7 Å²	7	44 Å²	44	5%	0.049	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	164.2	-169.8	85.4	0	0	0	0	112.6	I461 A517 D518 W599	I461-S601 CarbonylContact O-C 3.5Å; I461-S601 WeakPolarHBondContact O-CA 3.44Å; I461-S601 WeakPolarHBondContact O-CB 3.01Å; A517-S601 WeakPolarHBondContact CA-O 3.35Å; D518-S601 PolarHBondContact N-O 2.95Å; D518-S601 PolarHBondContact OD2-OG 2.95Å; W599-S601 PolarHBondContact NE1-O 3.11Å
602	V	88.5	Confident	83.3	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	144.6	176.6	63	0	0	0	0	112.6	I461 V463 L475 V515 Y516 A517 I577 W599	I461-V602 HydrophobicContact CB-CG1 4.17Å; I461-V602 PolarHBondContact N-O 3.44Å; I461-V602 PolarHBondContact O-N 2.98Å; V463-V602 HydrophobicContact CG2-CG1 3.67Å; L475-V602 HydrophobicContact CD2-CG1 3.42Å; L475-V602 VanDerWaalsContact CD2-CG1 3.42Å; V515-V602 HydrophobicContact CG1-CG2 4.06Å; Y516-V602 CarbonylContact O-C 3.05Å; Y516-V602 VanDerWaalsContact O-CA 3.23Å; Y516-V602 WeakPolarHBondContact O-CA 2.86Å; Y516-V602 VanDerWaalsContact O-CG2 3.32Å; Y516-V602 WeakPolarHBondContact O-CG2 3.08Å; A517-V602 HydrophobicContact CB-CG2 4.16Å; I577-V602 HydrophobicContact CD1-CG1 4.4Å; I577-V602 HydrophobicContact CD1-CG2 3.44Å; I577-V602 VanDerWaalsContact CD1-CG2 3.44Å; I577-V602 HydrophobicContact CG2-CG2 4.27Å; W599-V602 HydrophobicContact CZ2-CB 4.02Å; W599-V602 HydrophobicContact CZ2-CG1 3.92Å; W599-V602 HydrophobicContact CZ2-CG2 4.25Å
603	W	91.8	Very high	84.9	Confident	32 Å²	32	41.2 Å²	41.2	12%	0.121	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	166.6	173.3	68.8	95.7	0	0	0	112.2	S458 V460 Y516 R558	S458-W603 WeakPolarHBondContact OG-CB 3.41Å; V460-W603 HydrophobicContact CG1-CE3 4Å; V460-W603 HydrophobicContact CG2-CB 4.23Å; V460-W603 HydrophobicContact CG2-CD2 4.07Å; V460-W603 HydrophobicContact CG2-CE3 4.08Å; V460-W603 HydrophobicContact CG2-CG 4.18Å; Y516-W603 AromaticContact CD1-CE2 3.98Å; Y516-W603 HydrophobicContact CD1-CH2 4.18Å; Y516-W603 AromaticContact CD1-CZ2 3.47Å; Y516-W603 HydrophobicContact CD1-CZ2 3.47Å; Y516-W603 VanDerWaalsContact CD1-CZ2 3.47Å; Y516-W603 AromaticContact CD2-CD1 3.91Å; Y516-W603 AromaticContact CD2-CE2 3.79Å; Y516-W603 HydrophobicContact CD2-CZ2 4.16Å; Y516-W603 AromaticContact CD2-NE1 3.3Å; Y516-W603 VanDerWaalsContact CD2-NE1 3.3Å; Y516-W603 HydrophobicContact CE1-CZ2 4.33Å; Y516-W603 AromaticContact CE2-NE1 3.97Å; Y516-W603 HydrophobicContact CG-CD2 4.22Å; Y516-W603 AromaticContact CG-CE2 3.4Å; Y516-W603 HydrophobicContact CG-CH2 4.12Å; Y516-W603 AromaticContact CG-CZ2 3.35Å; Y516-W603 HydrophobicContact CG-CZ2 3.35Å; Y516-W603 AromaticContact CG-NE1 3.44Å; Y516-W603 PolarHBondContact N-O 3.35Å; Y516-W603 PolarHBondContact O-N 2.91Å; R558-W603 HydrophobicContact CB-CH2 4.41Å; R558-W603 HydrophobicContact CG-CH2 4.11Å
604	I	93.3	Very high	86.3	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	137.6	179.6	-61.8	-178.2	0	0	0	109.7	S458 L477 V513 Q514 V515 W575 I577	S458-I604 PolarHBondContact N-O 3.21Å; S458-I604 PolarHBondContact OG-N 3.45Å; S458-I604 PolarHBondContact OG-O 3.45Å; L477-I604 HydrophobicContact CD1-CD1 4.4Å; L477-I604 HydrophobicContact CD1-CG1 4.17Å; L477-I604 HydrophobicContact CD2-CD1 4.15Å; V513-I604 HydrophobicContact CG1-CG2 3.62Å; Q514-I604 WeakPolarHBondContact O-CA 3.27Å; V515-I604 HydrophobicContact CG2-CG1 4.26Å; W575-I604 HydrophobicContact CB-CD1 3.93Å; W575-I604 HydrophobicContact CD2-CD1 3.83Å; W575-I604 HydrophobicContact CE3-CD1 4.11Å; W575-I604 HydrophobicContact CG-CD1 3.76Å; I577-I604 HydrophobicContact CD1-CD1 4.31Å; I577-I604 HydrophobicContact CD1-CG1 4.31Å
605	V	91	Very high	87.4	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.006	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	116	162.9	-175.2	0	0	0	0	108	R455 C456 T457 Q514 Y516 Y607	R455-V605 HydrophobicContact CG-CG1 4.03Å; C456-V605 WeakPolarHBondContact O-CA 3.1Å; T457-V605 HydrophobicContact CG2-CG2 3.99Å; Q514-V605 HydrophobicContact CB-CB 4.38Å; Q514-V605 PolarHBondContact N-O 2.95Å; Q514-V605 PolarHBondContact O-N 2.88Å; Y516-V605 HydrophobicContact CD2-CG2 4.01Å; Y516-V605 HydrophobicContact CE2-CB 4.11Å; Y516-V605 HydrophobicContact CE2-CG2 3.5Å; V605-Y607 HydrophobicContact CB-CE2 4.32Å; V605-Y607 HydrophobicContact CG1-CD2 4.43Å; V605-Y607 HydrophobicContact CG1-CE1 4.42Å; V605-Y607 HydrophobicContact CG1-CE2 3.65Å
606	A	94.7	Very high	88.4	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	146.1	176.7	0	0	0	0	0	110.6	R455 C456 F479 I507 L510	R455-A606 WeakPolarHBondContact CA-O 3.29Å; C456-A606 PolarHBondContact N-O 2.8Å; C456-A606 PolarHBondContact O-N 3.02Å; F479-A606 HydrophobicContact CE1-CB 3.63Å; F479-A606 HydrophobicContact CZ-CB 3.9Å; I507-A606 VanDerWaalsContact CD1-C 3.4Å; I507-A606 HydrophobicContact CD1-CB 3.91Å; I507-A606 WeakPolarHBondContact CD1-O 3.45Å; L510-A606 HydrophobicContact CD2-CB 3.74Å
607	Y	94.8	Very high	88.8	Confident	18 Å²	18	30 Å²	30	7%	0.071	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	143.8	176.1	-60.2	-91.1	0	0	0	108.8	H453 H454 R455 E511 H512 Q514 V605	H453-Y607 AromaticContact CE1-CD1 3.77Å; H453-Y607 WeakPolarHBondContact NE2-CB 3.41Å; H453-Y607 AromaticContact NE2-CD1 3.6Å; H454-Y607 CarbonylContact O-C 3.5Å; H454-Y607 WeakPolarHBondContact O-CA 3.4Å; R455-Y607 HydrophobicContact CB-CD1 4.2Å; R455-Y607 HydrophobicContact CB-CE1 4.3Å; R455-Y607 HydrophobicContact CG-CD1 4.06Å; R455-Y607 HydrophobicContact CG-CE1 3.76Å; E511-Y607 PolarHBondContact N-O 3.18Å; H512-Y607 HydrophobicContact CB-CD2 3.88Å; H512-Y607 HydrophobicContact CB-CG 4.29Å; H512-Y607 PolarHBondContact N-O 3.25Å; H512-Y607 PolarHBondContact O-N 2.76Å; Q514-Y607 HydrophobicContact CG-CE2 3.98Å; Q514-Y607 PolarHBondContact OE1-OH 2.86Å; V605-Y607 HydrophobicContact CB-CE2 4.32Å; V605-Y607 HydrophobicContact CG1-CD2 4.43Å; V605-Y607 HydrophobicContact CG1-CE1 4.42Å; V605-Y607 HydrophobicContact CG1-CE2 3.65Å
608	G	93.3	Very high	88.9	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.1	-147	179.7	0	0	0	0	0	114.3	H454 Y509	H454-G608 PolarHBondContact N-O 3.43Å; H454-G608 PolarHBondContact O-N 2.95Å; Y509-G608 CarbonylContact O-C 3.55Å; Y509-G608 WeakPolarHBondContact O-CA 3.07Å
609	T	89.2	Confident	88.9	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	149.9	-177.2	49.9	0	0	0	0	111	P451 R508 Y509 E611	P451-T609 HydrophobicContact CB-CG2 4.07Å; P451-T609 HydrophobicContact CG-CG2 4.43Å; R508-T609 PolarHBondContact N-O 3.28Å; Y509-T609 PolarHBondContact N-O 2.76Å; Y509-T609 PolarHBondContact O-N 2.94Å; T609-E611 WeakPolarHBondContact CB-O 3.08Å; T609-E611 PolarHBondContact OG1-O 3.36Å; T609-E611 VanDerWaalsContact OG1-O 3.04Å
610	D	87.8	Confident	88.7	Confident	48 Å²	48	35.1 Å²	35.1	26%	0.257	17%	0.169	S	C	.	.	S	Bend	trans	-84.8	-28.1	170	-170.2	23.4	0	0	0	112.1	P506 R508	P506-D610 HydrophobicContact CB-CB 4.48Å; R508-D610 WeakPolarHBondContact CB-O 3.36Å; R508-D610 WeakPolarHBondContact CD-O 3.49Å; R508-D610 IonicContact CZ-OD1 3.12Å; R508-D610 PolarHBondContact NE-O 2.9Å; R508-D610 IonicContact NE-OD1 2.86Å; R508-D610 PolarHBondContact NE-OD1 2.89Å; R508-D610 IonicContact NH2-OD1 2.65Å; R508-D610 PolarHBondContact NH2-OD1 3.36Å
611	E	84.6	Confident	88.6	Confident	117 Å²	117	36.1 Å²	36.1	55%	0.547	19%	0.191	S	C	.	.	S	Bend	trans	-96.9	154.2	176.1	-67.1	178.4	-158.3	0	0	111.5	P451 Y509 T609	P451-E611 HydrophobicContact CB-CB 4.14Å; P451-E611 HydrophobicContact CG-CB 3.93Å; Y509-E611 WeakPolarHBondContact CD2-O 3.19Å; T609-E611 WeakPolarHBondContact CB-O 3.08Å; T609-E611 PolarHBondContact OG1-O 3.36Å; T609-E611 VanDerWaalsContact OG1-O 3.04Å
612	F	87.9	Confident	88.5	Confident	80 Å²	80	44 Å²	44	35%	0.351	23%	0.227	S	C	.	.			trans	-62.3	127.4	180	-176.9	-101.2	0	0	0	110.9	Y509 I614 Y636	Y509-F612 HydrophobicContact CD1-CD2 4.23Å; Y509-F612 AromaticContact CE1-CD2 3.69Å; Y509-F612 HydrophobicContact CE1-CD2 3.69Å; Y509-F612 HydrophobicContact CE1-CE2 4.44Å; Y509-F612 VanDerWaalsContact CE2-CA 3.4Å; Y509-F612 HydrophobicContact CE2-CB 4.01Å; Y509-F612 HydrophobicContact CE2-CD2 4.48Å; Y509-F612 VanDerWaalsContact CE2-N 3.28Å; Y509-F612 AromaticContact CZ-CD2 3.83Å; F612-I614 WeakPolarHBondContact CD1-O 3.33Å; F612-I614 HydrophobicContact CE1-CB 3.69Å; F612-I614 HydrophobicContact CE1-CG1 4.36Å; F612-I614 VanDerWaalsContact CE1-O 3.26Å; F612-I614 WeakPolarHBondContact CE1-O 3.17Å; F612-I614 HydrophobicContact CZ-CB 4.03Å; F612-I614 HydrophobicContact CZ-CD1 4.24Å; F612-I614 HydrophobicContact CZ-CG1 4.24Å; F612-Y636 AromaticContact CE1-CD1 3.51Å; F612-Y636 HydrophobicContact CE1-CD1 3.51Å; F612-Y636 AromaticContact CE1-CE1 3.6Å; F612-Y636 HydrophobicContact CE1-CE1 3.6Å; F612-Y636 HydrophobicContact CE1-CG 4.46Å; F612-Y636 AromaticContact CZ-CD1 3.8Å; F612-Y636 HydrophobicContact CZ-CD1 3.8Å; F612-Y636 AromaticContact CZ-CE1 3.34Å; F612-Y636 HydrophobicContact CZ-CE1 3.34Å
613	P	88.9	Confident	88.2	Confident	3 Å²	3	48.8 Å²	48.8	2%	0.019	25%	0.245	C	C	.	.			trans	-81.3	-32.9	-164.3	27.1	-34.9	0	0	0	115	Y401 V450 R615	Y401-P613 HydrophobicContact CE1-CB 3.85Å; Y401-P613 HydrophobicContact CE1-CG 3.68Å; Y401-P613 HydrophobicContact CE2-CB 4.26Å; Y401-P613 WeakPolarHBondContact OH-CB 3.49Å; Y401-P613 VanDerWaalsContact OH-CG 3.24Å; Y401-P613 WeakPolarHBondContact OH-CG 3.33Å; V450-P613 HydrophobicContact CG1-CB 4.14Å; P613-R615 PolarHBondContact O-N 3.2Å
614	I	90.7	Very high	87.8	Confident	3 Å²	3	51.2 Å²	51.2	2%	0.015	27%	0.265	C	S	.	.			trans	-84.5	119.2	-170.9	-52.8	172.7	0	0	0	109.9	L405 W447 F612 L616 Y636	L405-I614 HydrophobicContact CD1-CD1 3.77Å; L405-I614 HydrophobicContact CD1-CG1 4.2Å; L405-I614 HydrophobicContact CD2-CD1 4.1Å; W447-I614 HydrophobicContact CH2-CG1 4.21Å; W447-I614 HydrophobicContact CH2-CG2 4.17Å; W447-I614 HydrophobicContact CZ3-CG2 4.06Å; F612-I614 WeakPolarHBondContact CD1-O 3.33Å; F612-I614 HydrophobicContact CE1-CB 3.69Å; F612-I614 HydrophobicContact CE1-CG1 4.36Å; F612-I614 VanDerWaalsContact CE1-O 3.26Å; F612-I614 WeakPolarHBondContact CE1-O 3.17Å; F612-I614 HydrophobicContact CZ-CB 4.03Å; F612-I614 HydrophobicContact CZ-CD1 4.24Å; F612-I614 HydrophobicContact CZ-CG1 4.24Å; I614-L616 HydrophobicContact CG2-CG 4.49Å; I614-Y636 HydrophobicContact CB-CD1 4.46Å; I614-Y636 HydrophobicContact CB-CD2 4.43Å; I614-Y636 HydrophobicContact CB-CG 4.25Å; I614-Y636 HydrophobicContact CD1-CE2 4.22Å; I614-Y636 HydrophobicContact CG2-CD1 4.45Å; I614-Y636 HydrophobicContact CG2-CD2 3.7Å; I614-Y636 HydrophobicContact CG2-CE2 4.3Å; I614-Y636 HydrophobicContact CG2-CG 3.76Å
615	R	88.9	Confident	87.5	Confident	76 Å²	76	51.8 Å²	51.8	29%	0.287	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	126.2	178.7	-61.2	179.7	-68	-173.6	-1.9	109.2	R448 G449 P613 V638	R448-R615 HydrophobicContact CB-CB 4Å; R448-R615 WeakPolarHBondContact CB-O 3.4Å; R448-R615 PolarHBondContact N-O 3.06Å; G449-R615 PolarHBondContact O-NH2 2.85Å; P613-R615 PolarHBondContact O-N 3.2Å; R615-V638 HydrophobicContact CB-CG2 4.35Å
616	L	90.1	Very high	87.3	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	147.2	-176.6	-57.7	179.5	0	0	0	111.4	L443 L446 W447 I614 F630 F633 Y636 V637 V638	L443-L616 HydrophobicContact CD1-CD1 4.09Å; L443-L616 HydrophobicContact CD1-CD2 3.78Å; L446-L616 HydrophobicContact CB-CB 4.47Å; L446-L616 HydrophobicContact CB-CD2 4.34Å; L446-L616 CarbonylContact O-C 3.54Å; L446-L616 WeakPolarHBondContact O-CA 3.43Å; W447-L616 HydrophobicContact CE3-CD2 3.78Å; W447-L616 HydrophobicContact CZ3-CD2 4.32Å; I614-L616 HydrophobicContact CG2-CG 4.49Å; L616-F630 HydrophobicContact CD1-CE2 4.34Å; L616-F633 HydrophobicContact CD1-CB 3.76Å; L616-F633 HydrophobicContact CD1-CD1 4.29Å; L616-F633 HydrophobicContact CD1-CG 4.42Å; L616-Y636 PolarHBondContact N-O 3.06Å; L616-V637 HydrophobicContact CB-CG2 4.29Å; L616-V637 WeakPolarHBondContact O-CA 3.32Å; L616-V638 PolarHBondContact O-N 3.37Å
617	K	86.3	Confident	86.9	Confident	78 Å²	78	59.6 Å²	59.6	34%	0.339	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-75	155.4	167.7	-61.2	171.5	-167.5	162.9	0	110.1	L446 R448	L446-K617 PolarHBondContact O-N 2.89Å; R448-K617 HydrophobicContact CG-CG 3.81Å
618	P	86.3	Confident	86.5	Confident	53 Å²	53	67.7 Å²	67.7	34%	0.344	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-56.2	134.8	167.1	-23	34.2	0	0	0	110.9	V637 D640	P618-V637 HydrophobicContact CB-CG1 4.33Å; P618-V637 HydrophobicContact CG-CG1 4.1Å; P618-D640 WeakPolarHBondContact CD-OD1 3.39Å
619	P	86.2	Confident	86.2	Confident	50 Å²	50	69.8 Å²	69.8	33%	0.325	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-58.8	139.3	174.6	-23.5	33.2	0	0	0	112.1	L446 P625 F630	L446-P619 HydrophobicContact CD1-CG 4.32Å; L446-P619 HydrophobicContact CD2-CB 4.41Å; P619-P625 HydrophobicContact CB-CG 4.43Å; P619-P625 HydrophobicContact CG-CG 4.41Å; P619-F630 HydrophobicContact CG-CD1 4.34Å; P619-F630 HydrophobicContact CG-CE1 3.52Å; P619-F630 HydrophobicContact CG-CE2 4.29Å; P619-F630 HydrophobicContact CG-CZ 3.48Å; P619-F630 VanDerWaalsContact CG-CZ 3.48Å
620	T	83.1	Confident	86.3	Confident	77 Å²	77	71 Å²	71	47%	0.472	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-76.4	146.7	172.1	62.2	0	0	0	0	110.2	E622	T620-E622 PolarHBondContact O-N 3.25Å
621	S	79.8	Confident	86.4	Confident	116 Å²	116	76.5 Å²	76.5	81%	0.811	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-22.6	176.1	48.7	0	0	0	0	113
622	E	80.7	Confident	86.4	Confident	172 Å²	172	74.2 Å²	74.2	80%	0.804	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-31.6	-178.2	-64.9	172	-178.6	0	0	113	T620	T620-E622 PolarHBondContact O-N 3.25Å
623	R	82.5	Confident	86.5	Confident	100 Å²	100	71 Å²	71	38%	0.377	38%	0.375	S	S	.	.	S	Bend	trans	-141.5	66.4	-178	-65.7	-177.3	-177.9	-178.5	-7.2	111.6	L147 Y149 E445	L147-R623 PolarHBondContact O-NH1 2.73Å; L147-R623 PolarHBondContact O-NH2 3.38Å; Y149-R623 PolarHBondContact OH-NH1 3.02Å; Y149-R623 VanDerWaalsContact OH-NH1 3.16Å; E445-R623 WeakPolarHBondContact OE1-CD 3.37Å; E445-R623 IonicContact OE1-NH1 3.79Å; E445-R623 PolarHBondContact OE1-NH1 2.73Å
624	P	84.3	Confident	86.5	Confident	83 Å²	83	73.6 Å²	73.6	54%	0.539	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-65.6	136.7	-179	27.7	-33.9	0	0	0	110.4	R442	R442-P624 PolarHBondContact NH1-O 3.06Å
625	P	87.1	Confident	86.4	Confident	12 Å²	12	80.5 Å²	80.5	8%	0.078	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-69.1	154.8	172.2	30	-35.3	0	0	0	110.9	L446 P619 P627 W629 F630	L446-P625 HydrophobicContact CD1-CG 4.38Å; P619-P625 HydrophobicContact CB-CG 4.43Å; P619-P625 HydrophobicContact CG-CG 4.41Å; P625-P627 WeakPolarHBondContact O-CD 3.42Å; P625-W629 HydrophobicContact CB-CE3 3.92Å; P625-W629 HydrophobicContact CB-CZ3 3.62Å; P625-F630 HydrophobicContact CB-CB 3.97Å; P625-F630 HydrophobicContact CB-CD2 4.05Å; P625-F630 HydrophobicContact CB-CG 4.13Å; P625-F630 HydrophobicContact CG-CB 3.7Å; P625-F630 HydrophobicContact CG-CD1 3.98Å; P625-F630 HydrophobicContact CG-CD2 3.49Å; P625-F630 VanDerWaalsContact CG-CD2 3.49Å; P625-F630 HydrophobicContact CG-CE2 4.1Å; P625-F630 HydrophobicContact CG-CG 3.42Å; P625-F630 VanDerWaalsContact CG-CG 3.42Å
626	P	87.2	Confident	86.5	Confident	53 Å²	53	79 Å²	79	34%	0.344	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-54.3	123.6	177.3	-26	33.9	0	0	0	111.2	E628 W629 F630	P626-E628 VanDerWaalsContact C-N 3.34Å; P626-E628 PolarHBondContact O-N 3Å; P626-W629 HydrophobicContact CB-CB 4.3Å; P626-W629 PolarHBondContact O-N 3.01Å; P626-W629 VanDerWaalsContact O-N 3.14Å; P626-F630 WeakPolarHBondContact O-CB 3.45Å; P626-F630 PolarHBondContact O-N 2.91Å
627	P	86	Confident	86.3	Confident	112 Å²	112	81.5 Å²	81.5	73%	0.727	43%	0.434	S	S	*	.	H	α-helix	trans	-58.1	-41.1	-169.5	-28.5	34.4	0	0	0	114.3	P625 F630 K631	P625-P627 WeakPolarHBondContact O-CD 3.42Å; P627-F630 PolarHBondContact O-N 3.29Å; P627-K631 WeakPolarHBondContact O-CB 3.39Å; P627-K631 PolarHBondContact O-N 2.89Å
628	E	85.3	Confident	85.9	Confident	188 Å²	188	80.9 Å²	80.9	88%	0.879	44%	0.436	S	S	*	.	H	α-helix	trans	-64	-41.5	179.5	-69	-171.4	167.7	0	0	112.3	P626	P626-E628 VanDerWaalsContact C-N 3.34Å; P626-E628 PolarHBondContact O-N 3Å
629	W	87.4	Confident	85.2	Confident	45 Å²	45	81.9 Å²	81.9	17%	0.17	44%	0.439	C	S	.	.	H	α-helix	trans	-71.7	-45.7	177.6	169.7	76.5	0	0	0	111.2	K439 R442 L443 P625 P626 K631 S632 F633	K439-W629 HydrophobicContact CB-CZ2 4.06Å; K439-W629 HydrophobicContact CG-CZ2 4.22Å; R442-W629 HydrophobicContact CB-CH2 3.92Å; R442-W629 HydrophobicContact CB-CZ3 3.99Å; L443-W629 HydrophobicContact CB-CH2 4.05Å; L443-W629 HydrophobicContact CB-CZ2 4.31Å; P625-W629 HydrophobicContact CB-CE3 3.92Å; P625-W629 HydrophobicContact CB-CZ3 3.62Å; P626-W629 HydrophobicContact CB-CB 4.3Å; P626-W629 PolarHBondContact O-N 3.01Å; P626-W629 VanDerWaalsContact O-N 3.14Å; W629-K631 PolarHBondContact O-N 2.65Å; W629-S632 PolarHBondContact O-OG 3.43Å; W629-S632 VanDerWaalsContact O-OG 3.14Å; W629-F633 AromaticContact CE2-CE2 3.81Å; W629-F633 HydrophobicContact CZ2-CD2 4.17Å; W629-F633 AromaticContact CZ2-CE2 3.81Å; W629-F633 HydrophobicContact CZ2-CE2 3.81Å; W629-F633 AromaticContact NE1-CE2 3.81Å
630	F	90.7	Very high	84.1	Confident	25 Å²	25	83.3 Å²	83.3	11%	0.11	44%	0.444	C	S	.	.	H	α-helix	trans	-68.7	-21.8	-177.1	-170.4	-111	0	0	0	113.3	L446 L616 P619 P625 P626 P627 S632 F633 S634 V637	L446-F630 HydrophobicContact CD1-CD2 4.16Å; L446-F630 HydrophobicContact CD1-CE2 3.42Å; L446-F630 VanDerWaalsContact CD1-CE2 3.42Å; L446-F630 HydrophobicContact CD1-CZ 4.03Å; L616-F630 HydrophobicContact CD1-CE2 4.34Å; P619-F630 HydrophobicContact CG-CD1 4.34Å; P619-F630 HydrophobicContact CG-CE1 3.52Å; P619-F630 HydrophobicContact CG-CE2 4.29Å; P619-F630 HydrophobicContact CG-CZ 3.48Å; P619-F630 VanDerWaalsContact CG-CZ 3.48Å; P625-F630 HydrophobicContact CB-CB 3.97Å; P625-F630 HydrophobicContact CB-CD2 4.05Å; P625-F630 HydrophobicContact CB-CG 4.13Å; P625-F630 HydrophobicContact CG-CB 3.7Å; P625-F630 HydrophobicContact CG-CD1 3.98Å; P625-F630 HydrophobicContact CG-CD2 3.49Å; P625-F630 VanDerWaalsContact CG-CD2 3.49Å; P625-F630 HydrophobicContact CG-CE2 4.1Å; P625-F630 HydrophobicContact CG-CG 3.42Å; P625-F630 VanDerWaalsContact CG-CG 3.42Å; P626-F630 WeakPolarHBondContact O-CB 3.45Å; P626-F630 PolarHBondContact O-N 2.91Å; P627-F630 PolarHBondContact O-N 3.29Å; F630-S632 PolarHBondContact O-N 3.34Å; F630-S632 VanDerWaalsContact O-N 3.12Å; F630-F633 HydrophobicContact CD2-CB 4.04Å; F630-F633 HydrophobicContact CE2-CB 4.05Å; F630-F633 CarbonylContact O-C 3.58Å; F630-F633 WeakPolarHBondContact O-CA 3.2Å; F630-F633 PolarHBondContact O-N 3.06Å; F630-S634 PolarHBondContact O-N 3.39Å; F630-V637 HydrophobicContact CE1-CG2 4.34Å; F630-V637 HydrophobicContact CZ-CG2 3.8Å
631	K	89.7	Confident	83	Confident	163 Å²	163	89.2 Å²	89.2	71%	0.709	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.4	-40.6	178.2	-173.5	177.2	179.8	179.1	0	112.8	P627 W629 F633 S634	P627-K631 WeakPolarHBondContact O-CB 3.39Å; P627-K631 PolarHBondContact O-N 2.89Å; W629-K631 PolarHBondContact O-N 2.65Å; K631-F633 VanDerWaalsContact C-N 3.3Å; K631-F633 PolarHBondContact O-N 2.99Å; K631-S634 PolarHBondContact O-OG 3.16Å
632	S	86	Confident	81.8	Confident	69 Å²	69	89.3 Å²	89.3	48%	0.483	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-25.5	179.4	63.9	0	0	0	0	113.8	W629 F630 K635	W629-S632 PolarHBondContact O-OG 3.43Å; W629-S632 VanDerWaalsContact O-OG 3.14Å; F630-S632 PolarHBondContact O-N 3.34Å; F630-S632 VanDerWaalsContact O-N 3.12Å; S632-K635 WeakPolarHBondContact O-CE 3.34Å
633	F	90.1	Very high	80.2	Confident	12 Å²	12	86.8 Å²	86.8	5%	0.053	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-20.8	-179.2	-69.4	-76.4	0	0	0	113.6	L405 L443 L616 W629 F630 K631 K635 Y636	L405-F633 HydrophobicContact CB-CE1 4.24Å; L405-F633 HydrophobicContact CB-CZ 4.27Å; L405-F633 HydrophobicContact CD1-CE1 4.39Å; L443-F633 HydrophobicContact CD1-CD1 3.91Å; L443-F633 HydrophobicContact CD1-CE1 4.05Å; L443-F633 HydrophobicContact CD1-CG 4.29Å; L443-F633 HydrophobicContact CD2-CE1 3.92Å; L443-F633 HydrophobicContact CD2-CZ 4.11Å; L616-F633 HydrophobicContact CD1-CB 3.76Å; L616-F633 HydrophobicContact CD1-CD1 4.29Å; L616-F633 HydrophobicContact CD1-CG 4.42Å; W629-F633 AromaticContact CE2-CE2 3.81Å; W629-F633 HydrophobicContact CZ2-CD2 4.17Å; W629-F633 AromaticContact CZ2-CE2 3.81Å; W629-F633 HydrophobicContact CZ2-CE2 3.81Å; W629-F633 AromaticContact NE1-CE2 3.81Å; F630-F633 HydrophobicContact CD2-CB 4.04Å; F630-F633 HydrophobicContact CE2-CB 4.05Å; F630-F633 CarbonylContact O-C 3.58Å; F630-F633 WeakPolarHBondContact O-CA 3.2Å; F630-F633 PolarHBondContact O-N 3.06Å; K631-F633 VanDerWaalsContact C-N 3.3Å; K631-F633 PolarHBondContact O-N 2.99Å; F633-K635 PolarHBondContact O-N 2.86Å; F633-Y636 HydrophobicContact CD1-CD2 4.16Å; F633-Y636 HydrophobicContact CD1-CE2 4.36Å; F633-Y636 WeakPolarHBondContact O-CB 3.41Å; F633-Y636 PolarHBondContact O-N 3.46Å
634	S	88.4	Confident	78.5	Confident	58 Å²	58	89.1 Å²	89.1	41%	0.406	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-52.3	-33	-177.4	64.8	0	0	0	0	114.2	F630 K631 Y636 V637	F630-S634 PolarHBondContact O-N 3.39Å; K631-S634 PolarHBondContact O-OG 3.16Å; S634-Y636 PolarHBondContact O-N 2.92Å; S634-V637 WeakPolarHBondContact O-CG2 3.5Å; S634-V637 PolarHBondContact O-N 3.47Å
635	K	88.8	Confident	77	Confident	149 Å²	149	93.5 Å²	93.5	65%	0.648	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-67	-11.8	176.2	60.3	167.7	168.3	163.1	0	115.1	S632 F633	S632-K635 WeakPolarHBondContact O-CE 3.34Å; F633-K635 PolarHBondContact O-N 2.86Å
636	Y	89.6	Confident	75.3	Confident	44 Å²	44	95.7 Å²	95.7	17%	0.173	47%	0.47	C	S	.	.	G	3₁₀ helix	trans	-102.4	4.6	179.9	-51	-54.1	0	0	0	113	F612 I614 L616 F633 S634	F612-Y636 AromaticContact CE1-CD1 3.51Å; F612-Y636 HydrophobicContact CE1-CD1 3.51Å; F612-Y636 AromaticContact CE1-CE1 3.6Å; F612-Y636 HydrophobicContact CE1-CE1 3.6Å; F612-Y636 HydrophobicContact CE1-CG 4.46Å; F612-Y636 AromaticContact CZ-CD1 3.8Å; F612-Y636 HydrophobicContact CZ-CD1 3.8Å; F612-Y636 AromaticContact CZ-CE1 3.34Å; F612-Y636 HydrophobicContact CZ-CE1 3.34Å; I614-Y636 HydrophobicContact CB-CD1 4.46Å; I614-Y636 HydrophobicContact CB-CD2 4.43Å; I614-Y636 HydrophobicContact CB-CG 4.25Å; I614-Y636 HydrophobicContact CD1-CE2 4.22Å; I614-Y636 HydrophobicContact CG2-CD1 4.45Å; I614-Y636 HydrophobicContact CG2-CD2 3.7Å; I614-Y636 HydrophobicContact CG2-CE2 4.3Å; I614-Y636 HydrophobicContact CG2-CG 3.76Å; L616-Y636 PolarHBondContact N-O 3.06Å; F633-Y636 HydrophobicContact CD1-CD2 4.16Å; F633-Y636 HydrophobicContact CD1-CE2 4.36Å; F633-Y636 WeakPolarHBondContact O-CB 3.41Å; F633-Y636 PolarHBondContact O-N 3.46Å; S634-Y636 PolarHBondContact O-N 2.92Å
637	V	86.7	Confident	73.8	Confident	52 Å²	52	98.1 Å²	98.1	32%	0.315	47%	0.473	S	S	.	.	B	Isolated β-bridge	trans	-72	127.8	175.4	177.7	0	0	0	0	109.5	L616 P618 F630 S634	L616-V637 HydrophobicContact CB-CG2 4.29Å; L616-V637 WeakPolarHBondContact O-CA 3.32Å; P618-V637 HydrophobicContact CB-CG1 4.33Å; P618-V637 HydrophobicContact CG-CG1 4.1Å; F630-V637 HydrophobicContact CE1-CG2 4.34Å; F630-V637 HydrophobicContact CZ-CG2 3.8Å; S634-V637 WeakPolarHBondContact O-CG2 3.5Å; S634-V637 PolarHBondContact O-N 3.47Å
638	V	78.2	Confident	72.4	Confident	66 Å²	66	97.1 Å²	97.1	40%	0.4	47%	0.466	S	S	.	.			trans	-116.6	146.8	-179.8	-169.6	0	0	0	0	109.5	R615 L616	R615-V638 HydrophobicContact CB-CG2 4.35Å; L616-V638 PolarHBondContact O-N 3.37Å
639	D	71.1	Confident	71.4	Confident	74 Å²	74	90.3 Å²	90.3	40%	0.396	44%	0.438	S	S	.	.			trans	-60.9	140.8	178.1	-170.1	-27.4	0	0	0	111.8	R641	D639-R641 VanDerWaalsContact C-N 3.32Å; D639-R641 PolarHBondContact O-N 2.67Å; D639-R641 WeakPolarHBondContact OD1-CG 3.46Å; D639-R641 PolarHBondContact OD1-N 2.87Å; D639-R641 IonicContact OD1-NE 2.92Å; D639-R641 PolarHBondContact OD1-NE 3.3Å; D639-R641 IonicContact OD2-CZ 3.41Å; D639-R641 VanDerWaalsContact OD2-CZ 3.27Å; D639-R641 IonicContact OD2-NE 2.71Å; D639-R641 PolarHBondContact OD2-NE 3.46Å; D639-R641 IonicContact OD2-NH2 3.27Å; D639-R641 PolarHBondContact OD2-NH2 2.89Å
640	D	64.3	Low	70.4	Confident	79 Å²	79	89.9 Å²	89.9	42%	0.422	44%	0.438	S	S	.	.	G	3₁₀ helix	trans	-71.2	-22.4	-178.5	-81.1	-17.6	0	0	0	113.6	R448 P618 D642 W643	R448-D640 IonicContact CZ-OD1 3.48Å; R448-D640 IonicContact NH2-OD1 3.89Å; R448-D640 PolarHBondContact NH2-OD1 3.23Å; P618-D640 WeakPolarHBondContact CD-OD1 3.39Å; D640-D642 VanDerWaalsContact C-N 3.26Å; D640-D642 PolarHBondContact O-N 3.15Å; D640-W643 WeakPolarHBondContact O-CB 3.49Å; D640-W643 PolarHBondContact O-N 3.5Å
641	R	59	Low	69.9	Low	201 Å²	201	91.1 Å²	91.1	76%	0.758	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-62.8	-25.4	-173.5	-71	-179.2	-72.2	178.5	0.9	114.8	D639	D639-R641 VanDerWaalsContact C-N 3.32Å; D639-R641 PolarHBondContact O-N 2.67Å; D639-R641 WeakPolarHBondContact OD1-CG 3.46Å; D639-R641 PolarHBondContact OD1-N 2.87Å; D639-R641 IonicContact OD1-NE 2.92Å; D639-R641 PolarHBondContact OD1-NE 3.3Å; D639-R641 IonicContact OD2-CZ 3.41Å; D639-R641 VanDerWaalsContact OD2-CZ 3.27Å; D639-R641 IonicContact OD2-NE 2.71Å; D639-R641 PolarHBondContact OD2-NE 3.46Å; D639-R641 IonicContact OD2-NH2 3.27Å; D639-R641 PolarHBondContact OD2-NH2 2.89Å
642	D	54.6	Low	69.5	Low	118 Å²	118	84.2 Å²	84.2	63%	0.631	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-94.8	10.3	-178.3	-74.7	-44.7	0	0	0	114.1	D640 H644	D640-D642 VanDerWaalsContact C-N 3.26Å; D640-D642 PolarHBondContact O-N 3.15Å; D642-H644 PolarHBondContact O-N 2.87Å
643	W	46.9	Very low	69	Low	119 Å²	119	81.5 Å²	81.5	45%	0.451	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-66.1	-35.7	-168.9	88.9	-80.2	0	0	0	113.5	D640 K645 V646	D640-W643 WeakPolarHBondContact O-CB 3.49Å; D640-W643 PolarHBondContact O-N 3.5Å; W643-K645 PolarHBondContact O-N 3.05Å; W643-V646 HydrophobicContact CD2-CG2 4.21Å; W643-V646 HydrophobicContact CE3-CG2 3.22Å; W643-V646 HydrophobicContact CZ3-CG2 3.61Å; W643-V646 WeakPolarHBondContact O-CG2 3.03Å; W643-V646 PolarHBondContact O-N 3.27Å
644	H	46.3	Very low	68.4	Low	150 Å²	150	81.8 Å²	81.8	69%	0.694	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-60.2	-3.4	-172.3	-62.8	-74.5	0	0	0	116.8	D642 V646	D642-H644 PolarHBondContact O-N 2.87Å; H644-V646 VanDerWaalsContact C-N 3.29Å
645	K	53.4	Low	67.7	Low	174 Å²	174	85 Å²	85	76%	0.757	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-85.8	11.8	167	-64.8	176.7	-179.2	168.9	0	113.6	W643 Y647	W643-K645 PolarHBondContact O-N 3.05Å; K645-Y647 VanDerWaalsContact C-N 3.27Å; K645-Y647 PolarHBondContact O-N 2.97Å
646	V	52.6	Low	66.7	Low	58 Å²	58	80.5 Å²	80.5	35%	0.352	42%	0.42	S	S	.	.			trans	-46.6	-39.3	-163.8	-168.7	0	0	0	0	115.4	W643 H644	W643-V646 HydrophobicContact CD2-CG2 4.21Å; W643-V646 HydrophobicContact CE3-CG2 3.22Å; W643-V646 HydrophobicContact CZ3-CG2 3.61Å; W643-V646 WeakPolarHBondContact O-CG2 3.03Å; W643-V646 PolarHBondContact O-N 3.27Å; H644-V646 VanDerWaalsContact C-N 3.29Å
647	Y	54.1	Low	65.6	Low	104 Å²	104	79.9 Å²	79.9	41%	0.408	43%	0.428	S	S	.	.			trans	-116.1	97.5	-177.4	-52.5	-61.7	0	0	0	109.3	K645 C649 P661	K645-Y647 VanDerWaalsContact C-N 3.27Å; K645-Y647 PolarHBondContact O-N 2.97Å; Y647-C649 PolarHBondContact O-N 3.07Å; Y647-P661 HydrophobicContact CD1-CB 3.98Å; Y647-P661 VanDerWaalsContact CD1-CD 3.41Å; Y647-P661 HydrophobicContact CD1-CG 3.61Å; Y647-P661 HydrophobicContact CE1-CG 4.09Å; Y647-P661 HydrophobicContact CG-CG 4.47Å
648	T	57.4	Low	64.7	Low	92 Å²	92	78.6 Å²	78.6	56%	0.564	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-64.8	121.8	154.4	5.4	0	0	0	0	107
649	C	63.3	Low	63.7	Low	44 Å²	44	80.1 Å²	80.1	30%	0.297	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-55.2	146.3	174.2	-55.7	0	0	0	0	110.1	Y647 S651 C653 C658	Y647-C649 PolarHBondContact O-N 3.07Å; C649-S651 PolarHBondContact O-N 3.37Å; C649-C653 HydrophobicContact CB-CB 4.1Å; C649-C658 WeakPolarHBondContact CA-SG 3.23Å; C649-C658 HydrophobicContact CB-CB 3.58Å; C649-C658 WeakPolarHBondContact CB-SG 3.42Å; C649-C658 WeakPolarHBondContact SG-CB 3.36Å; C649-C658 PolarHBondContact SG-N 3.06Å; C649-C658 CovalentContact SG-SG 2.04Å; C649-C658 PolarHBondContact SG-SG 2.89Å
650	H	67.4	Low	63.1	Low	37 Å²	37	76.7 Å²	76.7	17%	0.171	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-51.2	143.1	176	-167.5	-95.5	0	0	0	110.3	E652 C653 P661 A663	H650-E652 WeakPolarHBondContact ND1-CB 3.42Å; H650-E652 PolarHBondContact ND1-N 2.86Å; H650-E652 PolarHBondContact O-N 3.48Å; H650-E652 VanDerWaalsContact O-N 3.09Å; H650-C653 WeakPolarHBondContact O-CB 3.31Å; H650-C653 PolarHBondContact O-N 3.36Å; H650-P661 WeakPolarHBondContact CB-O 3.47Å; H650-A663 HydrophobicContact CB-CB 4.13Å; H650-A663 VanDerWaalsContact CG-CB 3.5Å; H650-A663 WeakPolarHBondContact ND1-CB 3.3Å
651	S	79.6	Confident	63	Low	51 Å²	51	75.4 Å²	75.4	36%	0.357	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-18.8	-175.2	56.5	0	0	0	0	114.1	C649 K671	C649-S651 PolarHBondContact O-N 3.37Å; S651-K671 WeakPolarHBondContact O-CD 3.15Å
652	E	81.8	Confident	62.8	Low	17 Å²	17	66.6 Å²	66.6	8%	0.079	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-1.4	172.6	-59.9	-57.4	132.3	0	0	113.8	H650 K671 H672 C680	H650-E652 WeakPolarHBondContact ND1-CB 3.42Å; H650-E652 PolarHBondContact ND1-N 2.86Å; H650-E652 PolarHBondContact O-N 3.48Å; H650-E652 VanDerWaalsContact O-N 3.09Å; E652-K671 VanDerWaalsContact O-CB 3.25Å; E652-K671 WeakPolarHBondContact O-CB 3.42Å; E652-K671 PolarHBondContact O-N 3.4Å; E652-H672 IonicContact OE1-ND1 3.06Å; E652-H672 IonicContact OE2-CE1 3.41Å; E652-H672 IonicContact OE2-CG 2.67Å; E652-H672 IonicContact OE2-ND1 3.35Å; E652-H672 PolarHBondContact OE2-ND1 2.71Å; E652-C680 HydrophobicContact CB-CB 3.6Å; E652-C680 WeakPolarHBondContact CB-O 3.14Å; E652-C680 VanDerWaalsContact O-CB 3.28Å; E652-C680 WeakPolarHBondContact O-CB 3.42Å
653	C	76.2	Confident	63.5	Low	12 Å²	12	61.1 Å²	61.1	8%	0.081	35%	0.35	C	S	.	.	B	Isolated β-bridge	trans	-69.9	135.7	166.1	-64.8	0	0	0	0	110.1	C649 H650 C666	C649-C653 HydrophobicContact CB-CB 4.1Å; H650-C653 WeakPolarHBondContact O-CB 3.31Å; H650-C653 PolarHBondContact O-N 3.36Å; C653-C666 WeakPolarHBondContact CA-SG 3.25Å; C653-C666 HydrophobicContact CB-CB 3.54Å; C653-C666 WeakPolarHBondContact CB-SG 3.48Å; C653-C666 WeakPolarHBondContact SG-CA 3.35Å; C653-C666 WeakPolarHBondContact SG-CB 3.42Å; C653-C666 CovalentContact SG-SG 2.02Å; C653-C666 PolarHBondContact SG-SG 3.17Å
654	A	76.5	Confident	64.3	Low	19 Å²	19	57.6 Å²	57.6	16%	0.157	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-63.5	150.1	167.4	0	0	0	0	0	110.3	G656 S668 G669	A654-G656 PolarHBondContact O-N 3.05Å; A654-S668 WeakPolarHBondContact CB-O 3.37Å; A654-G669 WeakPolarHBondContact CB-O 3.43Å; A654-G669 PolarHBondContact N-O 3.4Å
655	P	74	Confident	65.2	Low	126 Å²	126	51.8 Å²	51.8	82%	0.818	31%	0.313	S	S	*	.	S	Bend	trans	-54.2	129.6	174.1	-23.2	32.9	0	0	0	111.2	S668	P655-S668 WeakPolarHBondContact O-CB 3.06Å
656	G	66.8	Low	66.1	Low	53 Å²	53	44.3 Å²	44.3	55%	0.546	28%	0.283	S	S	.	.	S	Bend	trans	135.8	18.6	-179.9	0	0	0	0	0	115.5	A654 S668	A654-G656 PolarHBondContact O-N 3.05Å; G656-S668 VanDerWaalsContact CA-OG 3.25Å; G656-S668 WeakPolarHBondContact CA-OG 3.35Å; G656-S668 PolarHBondContact O-OG 3.26Å
657	G	67.4	Low	67	Low	32 Å²	32	46.5 Å²	46.5	33%	0.33	29%	0.292	S	S	.	.			trans	90.6	174.4	169.2	0	0	0	0	0	114.4	L667	G657-L667 WeakPolarHBondContact O-CB 3.44Å; G657-L667 PolarHBondContact O-N 2.95Å
658	C	68.4	Low	68	Low	25 Å²	25	44.5 Å²	44.5	17%	0.169	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-150.2	154.1	-176.2	51.4	0	0	0	0	109.9	C649 G660 Q665	C649-C658 WeakPolarHBondContact CA-SG 3.23Å; C649-C658 HydrophobicContact CB-CB 3.58Å; C649-C658 WeakPolarHBondContact CB-SG 3.42Å; C649-C658 WeakPolarHBondContact SG-CB 3.36Å; C649-C658 PolarHBondContact SG-N 3.06Å; C649-C658 CovalentContact SG-SG 2.04Å; C649-C658 PolarHBondContact SG-SG 2.89Å; C658-G660 WeakPolarHBondContact CB-O 3.48Å; C658-G660 PolarHBondContact SG-O 3.48Å; C658-Q665 CarbonylContact C-O 3.56Å; C658-Q665 WeakPolarHBondContact CA-O 3.49Å; C658-Q665 WeakPolarHBondContact CB-O 3.07Å
659	T	57.3	Low	68.9	Low	97 Å²	97	40.5 Å²	40.5	60%	0.595	27%	0.27	S	S	*	.	S	Bend	trans	-81.8	-6.4	170.4	54.2	0	0	0	0	112.8	Q665 L667	T659-Q665 PolarHBondContact N-O 3.35Å; T659-Q665 WeakPolarHBondContact OG1-CB 2.96Å; T659-L667 HydrophobicContact CG2-CD1 4.33Å; T659-L667 HydrophobicContact CG2-CD2 3.51Å; T659-L667 HydrophobicContact CG2-CG 3.98Å
660	G	57.3	Low	69.6	Low	3 Å²	3	39.4 Å²	39.4	3%	0.031	26%	0.263	C	S	.	.	S	Bend	trans	178.3	-174.9	176.6	0	0	0	0	0	111.8	C658 A662	C658-G660 WeakPolarHBondContact CB-O 3.48Å; C658-G660 PolarHBondContact SG-O 3.48Å; G660-A662 VanDerWaalsContact C-N 3.3Å; G660-A662 PolarHBondContact O-N 2.84Å
661	P	61.7	Low	70	Confident	51 Å²	51	42.4 Å²	42.4	33%	0.331	28%	0.275	S	S	.	.	S	Bend	trans	-80.8	-8.5	-168.8	33.6	-33.7	0	0	0	113.6	Y647 H650	Y647-P661 HydrophobicContact CD1-CB 3.98Å; Y647-P661 VanDerWaalsContact CD1-CD 3.41Å; Y647-P661 HydrophobicContact CD1-CG 3.61Å; Y647-P661 HydrophobicContact CE1-CG 4.09Å; Y647-P661 HydrophobicContact CG-CG 4.47Å; H650-P661 WeakPolarHBondContact CB-O 3.47Å
662	A	56.6	Low	70	Confident	17 Å²	17	43.9 Å²	43.9	14%	0.14	28%	0.276	C	S	.	.	S	Bend	trans	-79.1	155.5	-175.2	0	0	0	0	0	112.5	G660 D664 Q665	G660-A662 VanDerWaalsContact C-N 3.3Å; G660-A662 PolarHBondContact O-N 2.84Å; A662-D664 WeakPolarHBondContact CB-OD1 3.37Å; A662-D664 PolarHBondContact O-N 3.26Å; A662-Q665 HydrophobicContact CB-CB 4.5Å; A662-Q665 HydrophobicContact CB-CG 4.05Å; A662-Q665 PolarHBondContact O-N 3.04Å; A662-Q665 VanDerWaalsContact O-N 3.15Å
663	A	68	Low	69.8	Low	3 Å²	3	45.2 Å²	45.2	3%	0.025	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-14	-175.9	0	0	0	0	0	114.4	H650 C666 Q679 C680	H650-A663 HydrophobicContact CB-CB 4.13Å; H650-A663 VanDerWaalsContact CG-CB 3.5Å; H650-A663 WeakPolarHBondContact ND1-CB 3.3Å; A663-C666 PolarHBondContact O-SG 2.94Å; A663-Q679 HydrophobicContact CB-CG 3.69Å; A663-C680 HydrophobicContact CB-CB 4.44Å; A663-C680 WeakPolarHBondContact CB-O 3.3Å; A663-C680 WeakPolarHBondContact O-CB 3.29Å; A663-C680 PolarHBondContact O-N 3.02Å; A663-C680 PolarHBondContact O-SG 3.45Å
664	D	65	Low	69.4	Low	45 Å²	45	44.7 Å²	44.7	24%	0.241	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-7.9	174.9	66.6	-39.2	0	0	0	112.7	V285 T286 A662 C666 R678	V285-D664 HydrophobicContact CG1-CB 4.13Å; V285-D664 WeakPolarHBondContact CG1-OD1 3.4Å; T286-D664 WeakPolarHBondContact CG2-OD2 3.44Å; A662-D664 WeakPolarHBondContact CB-OD1 3.37Å; A662-D664 PolarHBondContact O-N 3.26Å; D664-C666 VanDerWaalsContact C-N 3.26Å; D664-C666 PolarHBondContact O-N 2.93Å; D664-R678 WeakPolarHBondContact CA-O 3.38Å
665	Q	65.3	Low	68.9	Low	27 Å²	27	44.5 Å²	44.5	13%	0.126	28%	0.276	C	S	.	.			trans	-92.5	20.5	-178.2	-68	-179.7	-40.2	0	0	112.6	R289 C658 T659 A662 L667	R289-Q665 PolarHBondContact O-NE2 3.29Å; C658-Q665 CarbonylContact C-O 3.56Å; C658-Q665 WeakPolarHBondContact CA-O 3.49Å; C658-Q665 WeakPolarHBondContact CB-O 3.07Å; T659-Q665 PolarHBondContact N-O 3.35Å; T659-Q665 WeakPolarHBondContact OG1-CB 2.96Å; A662-Q665 HydrophobicContact CB-CB 4.5Å; A662-Q665 HydrophobicContact CB-CG 4.05Å; A662-Q665 PolarHBondContact O-N 3.04Å; A662-Q665 VanDerWaalsContact O-N 3.15Å; Q665-L667 PolarHBondContact O-N 2.82Å
666	C	70.9	Confident	68.2	Low	17 Å²	17	46 Å²	46	12%	0.115	27%	0.272	C	S	.	.	B	Isolated β-bridge	trans	-78.5	114.4	-178.3	-52.1	0	0	0	0	110.5	C653 A663 D664 S668 G669 C680	C653-C666 WeakPolarHBondContact CA-SG 3.25Å; C653-C666 HydrophobicContact CB-CB 3.54Å; C653-C666 WeakPolarHBondContact CB-SG 3.48Å; C653-C666 WeakPolarHBondContact SG-CA 3.35Å; C653-C666 WeakPolarHBondContact SG-CB 3.42Å; C653-C666 CovalentContact SG-SG 2.02Å; C653-C666 PolarHBondContact SG-SG 3.17Å; A663-C666 PolarHBondContact O-SG 2.94Å; D664-C666 VanDerWaalsContact C-N 3.26Å; D664-C666 PolarHBondContact O-N 2.93Å; C666-S668 VanDerWaalsContact C-N 3.32Å; C666-S668 PolarHBondContact O-N 3.17Å; C666-G669 WeakPolarHBondContact CB-O 3.28Å; C666-G669 PolarHBondContact O-N 3.34Å; C666-C680 PolarHBondContact SG-SG 3.07Å
667	L	72.2	Confident	67.6	Low	104 Å²	104	45.2 Å²	45.2	55%	0.545	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-32.1	-177.1	-75.9	170.9	0	0	0	112.5	G657 T659 Q665	G657-L667 WeakPolarHBondContact O-CB 3.44Å; G657-L667 PolarHBondContact O-N 2.95Å; T659-L667 HydrophobicContact CG2-CD1 4.33Å; T659-L667 HydrophobicContact CG2-CD2 3.51Å; T659-L667 HydrophobicContact CG2-CG 3.98Å; Q665-L667 PolarHBondContact O-N 2.82Å
668	S	75.3	Confident	67.6	Low	63 Å²	63	52.9 Å²	52.9	44%	0.441	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	16.1	-178.9	-64.3	0	0	0	0	113.4	A654 P655 G656 C666	A654-S668 WeakPolarHBondContact CB-O 3.37Å; P655-S668 WeakPolarHBondContact O-CB 3.06Å; G656-S668 VanDerWaalsContact CA-OG 3.25Å; G656-S668 WeakPolarHBondContact CA-OG 3.35Å; G656-S668 PolarHBondContact O-OG 3.26Å; C666-S668 VanDerWaalsContact C-N 3.32Å; C666-S668 PolarHBondContact O-N 3.17Å
669	G	75.5	Confident	67.4	Low	7 Å²	7	53.6 Å²	53.6	7%	0.072	28%	0.278	C	S	.	.			trans	81.4	-169	179.2	0	0	0	0	0	114.7	A654 C666 E758	A654-G669 WeakPolarHBondContact CB-O 3.43Å; A654-G669 PolarHBondContact N-O 3.4Å; C666-G669 WeakPolarHBondContact CB-O 3.28Å; C666-G669 PolarHBondContact O-N 3.34Å; G669-E758 WeakPolarHBondContact CA-OE1 3.48Å
670	C	77.7	Confident	68.1	Low	22 Å²	22	49.1 Å²	49.1	15%	0.149	25%	0.25	C	S	.	.	B	Isolated β-bridge	trans	-90.4	140.3	-175	-58.6	0	0	0	0	114	A674 C680 E758	C670-A674 HydrophobicContact CB-CB 4.38Å; C670-A674 VanDerWaalsContact SG-CB 3.57Å; C670-C680 WeakPolarHBondContact CA-SG 3.24Å; C670-C680 HydrophobicContact CB-CB 3.56Å; C670-C680 WeakPolarHBondContact CB-SG 3.49Å; C670-C680 WeakPolarHBondContact SG-CA 3.33Å; C670-C680 WeakPolarHBondContact SG-CB 2.98Å; C670-C680 CovalentContact SG-SG 2.03Å; C670-C680 PolarHBondContact SG-SG 2.84Å; C670-E758 PolarHBondContact N-OE1 2.96Å; C670-E758 VanDerWaalsContact N-OE1 3.17Å
671	K	76.8	Confident	68.8	Low	99 Å²	99	50.2 Å²	50.2	43%	0.43	26%	0.256	S	S	.	.	S	Bend	trans	-65.7	-37.3	176.3	-179.1	-176.5	171.8	-168.4	0	112.9	S651 E652	S651-K671 WeakPolarHBondContact O-CD 3.15Å; E652-K671 VanDerWaalsContact O-CB 3.25Å; E652-K671 WeakPolarHBondContact O-CB 3.42Å; E652-K671 PolarHBondContact O-N 3.4Å
672	H	79.8	Confident	69.3	Low	82 Å²	82	50.1 Å²	50.1	38%	0.38	26%	0.256	S	S	.	.	S	Bend	trans	-124	-77.5	-179.9	-58	110.5	0	0	0	111.9	E652	E652-H672 IonicContact OE1-ND1 3.06Å; E652-H672 IonicContact OE2-CE1 3.41Å; E652-H672 IonicContact OE2-CG 2.67Å; E652-H672 IonicContact OE2-ND1 3.35Å; E652-H672 PolarHBondContact OE2-ND1 2.71Å
673	F	76.1	Confident	69.9	Low	45 Å²	45	53.2 Å²	53.2	20%	0.197	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	151.1	-177.7	-50.7	-75.2	0	0	0	111.1	C680 V681 S682 A690 M759	F673-C680 CarbonylContact O-C 3.58Å; F673-C680 WeakPolarHBondContact O-CA 3.5Å; F673-V681 HydrophobicContact CB-CG2 4.01Å; F673-V681 PolarHBondContact N-O 2.77Å; F673-V681 PolarHBondContact O-N 3.23Å; F673-S682 WeakPolarHBondContact CD2-O 3.37Å; F673-S682 VanDerWaalsContact CE2-O 3.31Å; F673-S682 WeakPolarHBondContact CE2-O 3.16Å; F673-A690 HydrophobicContact CD1-CB 3.74Å; F673-A690 HydrophobicContact CE1-CB 3.49Å; F673-A690 VanDerWaalsContact CE1-CB 3.49Å; F673-A690 HydrophobicContact CZ-CB 4.18Å; F673-M759 CarbonylContact C-O 3.55Å; F673-M759 WeakPolarHBondContact CA-O 3.26Å; F673-M759 WeakPolarHBondContact CB-O 3.46Å; F673-M759 HydrophobicContact CD1-CB 3.63Å; F673-M759 HydrophobicContact CE1-CB 4.03Å; F673-M759 HydrophobicContact CE1-SD 4.06Å
674	A	69.6	Low	70	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.008	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	134.9	169.7	0	0	0	0	0	108.9	C670 Q679 M759 V760 C761	C670-A674 HydrophobicContact CB-CB 4.38Å; C670-A674 VanDerWaalsContact SG-CB 3.57Å; A674-Q679 CarbonylContact C-O 3.54Å; A674-Q679 WeakPolarHBondContact CA-O 2.91Å; A674-M759 PolarHBondContact N-O 2.84Å; A674-V760 HydrophobicContact CB-CG2 4.45Å; A674-V760 CarbonylContact O-C 3.53Å; A674-V760 WeakPolarHBondContact O-CA 3.09Å; A674-V760 WeakPolarHBondContact O-CG1 3.23Å; A674-C761 PolarHBondContact O-N 3.2Å
675	T	66.2	Low	70.2	Confident	16 Å²	16	54.4 Å²	54.4	10%	0.098	28%	0.284	C	S	.	.			trans	-67.8	168.8	165.3	62	0	0	0	0	110.1	S677 R678 Q679 V681	T675-S677 PolarHBondContact O-N 2.67Å; T675-S677 PolarHBondContact OG1-N 3.47Å; T675-S677 PolarHBondContact OG1-OG 2.65Å; T675-R678 WeakPolarHBondContact O-CA 3.36Å; T675-R678 PolarHBondContact O-N 2.79Å; T675-Q679 HydrophobicContact CG2-CB 4.19Å; T675-Q679 PolarHBondContact N-O 2.89Å; T675-Q679 WeakPolarHBondContact OG1-CB 3.46Å; T675-Q679 PolarHBondContact OG1-N 3.17Å; T675-V681 HydrophobicContact CG2-CG1 3.83Å; T675-V681 HydrophobicContact CG2-CG2 4.06Å
676	E	59.1	Low	70.1	Confident	158 Å²	158	60 Å²	60	74%	0.738	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-28.5	172.9	-161.2	171.9	-165	0	0	112.2	R678	E676-R678 PolarHBondContact O-N 3.43Å
677	S	53.3	Low	70.2	Confident	36 Å²	36	60.1 Å²	60.1	25%	0.252	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	9.6	171.4	55.7	0	0	0	0	114.8	T675 Q679	T675-S677 PolarHBondContact O-N 2.67Å; T675-S677 PolarHBondContact OG1-N 3.47Å; T675-S677 PolarHBondContact OG1-OG 2.65Å; S677-Q679 VanDerWaalsContact C-N 3.28Å; S677-Q679 PolarHBondContact O-N 2.84Å
678	R	66.6	Low	70.4	Confident	193 Å²	193	56.8 Å²	56.8	73%	0.728	30%	0.302	S	S	*	.			trans	64.1	20	-176.5	-60.4	-174.6	173.3	-178.1	-3.3	115.9	D664 T675 E676	D664-R678 WeakPolarHBondContact CA-O 3.38Å; T675-R678 WeakPolarHBondContact O-CA 3.36Å; T675-R678 PolarHBondContact O-N 2.79Å; E676-R678 PolarHBondContact O-N 3.43Å
679	Q	64.7	Low	70.1	Confident	40 Å²	40	54.7 Å²	54.7	19%	0.187	29%	0.286	C	S	.	.			trans	-80.7	126.4	176.3	-166.6	-178.7	-13.2	0	0	110.5	V285 A663 A674 T675 S677 V681	V285-Q679 HydrophobicContact CG1-CG 4.2Å; A663-Q679 HydrophobicContact CB-CG 3.69Å; A674-Q679 CarbonylContact C-O 3.54Å; A674-Q679 WeakPolarHBondContact CA-O 2.91Å; T675-Q679 HydrophobicContact CG2-CB 4.19Å; T675-Q679 PolarHBondContact N-O 2.89Å; T675-Q679 WeakPolarHBondContact OG1-CB 3.46Å; T675-Q679 PolarHBondContact OG1-N 3.17Å; S677-Q679 VanDerWaalsContact C-N 3.28Å; S677-Q679 PolarHBondContact O-N 2.84Å; Q679-V681 HydrophobicContact CG-CG1 4.5Å; Q679-V681 PolarHBondContact O-N 2.9Å
680	C	73.4	Confident	69.6	Low	3 Å²	3	55.6 Å²	55.6	2%	0.02	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	118.8	176.7	-56.6	0	0	0	0	111.7	E652 A663 C666 C670 F673	E652-C680 HydrophobicContact CB-CB 3.6Å; E652-C680 WeakPolarHBondContact CB-O 3.14Å; E652-C680 VanDerWaalsContact O-CB 3.28Å; E652-C680 WeakPolarHBondContact O-CB 3.42Å; A663-C680 HydrophobicContact CB-CB 4.44Å; A663-C680 WeakPolarHBondContact CB-O 3.3Å; A663-C680 WeakPolarHBondContact O-CB 3.29Å; A663-C680 PolarHBondContact O-N 3.02Å; A663-C680 PolarHBondContact O-SG 3.45Å; C666-C680 PolarHBondContact SG-SG 3.07Å; C670-C680 WeakPolarHBondContact CA-SG 3.24Å; C670-C680 HydrophobicContact CB-CB 3.56Å; C670-C680 WeakPolarHBondContact CB-SG 3.49Å; C670-C680 WeakPolarHBondContact SG-CA 3.33Å; C670-C680 WeakPolarHBondContact SG-CB 2.98Å; C670-C680 CovalentContact SG-SG 2.03Å; C670-C680 PolarHBondContact SG-SG 2.84Å; F673-C680 CarbonylContact O-C 3.58Å; F673-C680 WeakPolarHBondContact O-CA 3.5Å
681	V	71.7	Confident	68.6	Low	25 Å²	25	57.2 Å²	57.2	15%	0.152	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	147.7	-178.5	-62.6	0	0	0	0	110.8	F673 T675 Q679 V683	F673-V681 HydrophobicContact CB-CG2 4.01Å; F673-V681 PolarHBondContact N-O 2.77Å; F673-V681 PolarHBondContact O-N 3.23Å; T675-V681 HydrophobicContact CG2-CG1 3.83Å; T675-V681 HydrophobicContact CG2-CG2 4.06Å; Q679-V681 HydrophobicContact CG-CG1 4.5Å; Q679-V681 PolarHBondContact O-N 2.9Å; V681-V683 WeakPolarHBondContact CG2-O 3.28Å
682	S	72.1	Confident	67.4	Low	49 Å²	49	53.9 Å²	53.9	34%	0.343	29%	0.292	S	S	.	.	S	Bend	trans	-78.7	-26	178	59.8	0	0	0	0	113.3	F673	F673-S682 WeakPolarHBondContact CD2-O 3.37Å; F673-S682 VanDerWaalsContact CE2-O 3.31Å; F673-S682 WeakPolarHBondContact CE2-O 3.16Å
683	V	69.4	Low	65.7	Low	83 Å²	83	50.6 Å²	50.6	50%	0.503	28%	0.279	S	S	.	.	S	Bend	trans	-143.2	140.9	177.6	-175.7	0	0	0	0	108.2	V681	V681-V683 WeakPolarHBondContact CG2-O 3.28Å
684	C	70	Confident	64.1	Low	22 Å²	22	54.6 Å²	54.6	15%	0.149	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-64	138	176.7	-69	0	0	0	0	112	T688 C761	C684-T688 WeakPolarHBondContact CB-OG1 3.43Å; C684-C761 WeakPolarHBondContact CA-SG 3.27Å; C684-C761 HydrophobicContact CB-CB 3.72Å; C684-C761 WeakPolarHBondContact CB-SG 3.24Å; C684-C761 VanDerWaalsContact SG-CA 3.51Å; C684-C761 WeakPolarHBondContact SG-CB 3.33Å; C684-C761 CovalentContact SG-SG 2.04Å; C684-C761 PolarHBondContact SG-SG 3.11Å
685	P	67.9	Low	62.5	Low	50 Å²	50	63.8 Å²	63.8	33%	0.325	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-63	159.9	179.8	24.1	-32.2	0	0	0	112.4	T688	P685-T688 WeakPolarHBondContact CD-OG1 3.46Å; P685-T688 HydrophobicContact CG-CG2 4.05Å; P685-T688 WeakPolarHBondContact CG-OG1 3.43Å; P685-T688 PolarHBondContact O-N 3.21Å; P685-T688 PolarHBondContact O-OG1 3.1Å
686	L	64.5	Low	60.8	Low	144 Å²	144	68.7 Å²	68.7	75%	0.754	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	142.8	175.6	-71.8	172.1	0	0	0	110.9	T688	L686-T688 PolarHBondContact O-N 2.03Å
687	G	71.5	Confident	59.4	Low	20 Å²	20	63.2 Å²	63.2	21%	0.206	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.1	7.5	-172.4	0	0	0	0	0	114.1	P763 C764 S769	G687-P763 CarbonylContact O-C 3.56Å; G687-P763 WeakPolarHBondContact O-CA 3.35Å; G687-C764 VanDerWaalsContact C-SG 3.57Å; G687-C764 WeakPolarHBondContact O-CB 2.96Å; G687-C764 PolarHBondContact O-N 2.96Å; G687-S769 PolarHBondContact N-O 3.04Å
688	T	77.4	Confident	58.2	Low	35 Å²	35	67.9 Å²	67.9	22%	0.215	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	161	172.8	73.8	0	0	0	0	111.6	C684 P685 L686 Q762 P763	C684-T688 WeakPolarHBondContact CB-OG1 3.43Å; P685-T688 WeakPolarHBondContact CD-OG1 3.46Å; P685-T688 HydrophobicContact CG-CG2 4.05Å; P685-T688 WeakPolarHBondContact CG-OG1 3.43Å; P685-T688 PolarHBondContact O-N 3.21Å; P685-T688 PolarHBondContact O-OG1 3.1Å; L686-T688 PolarHBondContact O-N 2.03Å; T688-Q762 CarbonylContact C-O 3.41Å; T688-Q762 WeakPolarHBondContact CA-O 3.48Å; T688-Q762 WeakPolarHBondContact CB-O 3.44Å; T688-P763 HydrophobicContact CG2-CB 4.43Å
689	T	70	Confident	56.4	Low	18 Å²	18	64 Å²	64	11%	0.11	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	146.1	177.4	179.9	0	0	0	0	110.7	F691 Q762 I772 P774	T689-F691 WeakPolarHBondContact OG1-CB 3.42Å; T689-F691 PolarHBondContact OG1-N 3.4Å; T689-F691 VanDerWaalsContact OG1-N 3.16Å; T689-Q762 PolarHBondContact N-O 2.92Å; T689-Q762 PolarHBondContact O-N 2.88Å; T689-I772 PolarHBondContact OG1-O 2.9Å; T689-P774 HydrophobicContact CG2-CB 3.91Å; T689-P774 HydrophobicContact CG2-CG 4.26Å
690	A	64.6	Low	54.7	Low	27 Å²	27	70.4 Å²	70.4	22%	0.223	41%	0.411	C	S	.	.	S	Bend	trans	-75.2	-17.5	171.7	0	0	0	0	0	112.4	F673 G692	F673-A690 HydrophobicContact CD1-CB 3.74Å; F673-A690 HydrophobicContact CE1-CB 3.49Å; F673-A690 VanDerWaalsContact CE1-CB 3.49Å; F673-A690 HydrophobicContact CZ-CB 4.18Å; A690-G692 PolarHBondContact O-N 2.94Å
691	F	56.4	Low	52.6	Low	55 Å²	55	78.2 Å²	78.2	24%	0.241	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	81.6	-169.1	-170.2	-94	0	0	0	110.4	T689 I772 R773 P774 F804	T689-F691 WeakPolarHBondContact OG1-CB 3.42Å; T689-F691 PolarHBondContact OG1-N 3.4Å; T689-F691 VanDerWaalsContact OG1-N 3.16Å; F691-I772 VanDerWaalsContact CB-O 3.3Å; F691-I772 WeakPolarHBondContact CB-O 3.44Å; F691-I772 HydrophobicContact CD1-CG2 4.13Å; F691-I772 WeakPolarHBondContact CD1-O 3.4Å; F691-I772 HydrophobicContact CE1-CG2 4.22Å; F691-R773 HydrophobicContact CD1-CG 3.48Å; F691-R773 VanDerWaalsContact CD1-CG 3.48Å; F691-R773 HydrophobicContact CE1-CG 3.56Å; F691-P774 WeakPolarHBondContact O-CD 3.34Å; F691-F804 HydrophobicContact CE2-CZ 4.39Å; F691-F804 HydrophobicContact CZ-CZ 4.35Å
692	G	50.5	Low	50.5	Low	29 Å²	29	84.4 Å²	84.4	30%	0.299	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	171.9	-24.7	-179.4	0	0	0	0	0	113.3	A690 L694 Q762	A690-G692 PolarHBondContact O-N 2.94Å; G692-L694 PolarHBondContact O-N 2.68Å; G692-Q762 VanDerWaalsContact CA-OE1 3.27Å; G692-Q762 PolarHBondContact O-OE1 2.88Å
693	A	44.1	Very low	48.4	Very low	13 Å²	13	93.5 Å²	93.5	11%	0.107	51%	0.508	C	S	.	.	G	3₁₀ helix	trans	-70.6	-3.4	175.5	0	0	0	0	0	115.5	R695 M759 V760	A693-R695 PolarHBondContact O-N 2.67Å; A693-M759 HydrophobicContact CB-CB 4.47Å; A693-V760 HydrophobicContact CB-CB 4.31Å; A693-V760 WeakPolarHBondContact CB-O 3.39Å
694	L	42.4	Very low	46.4	Very low	129 Å²	129	94 Å²	94	68%	0.675	52%	0.52	S	S	*	.	G	3₁₀ helix	trans	-57.7	-3.3	176.6	-96.7	139.7	0	0	0	114.8	G692	G692-L694 PolarHBondContact O-N 2.68Å
695	R	36.4	Very low	44.3	Very low	194 Å²	194	102.2 Å²	102.2	73%	0.732	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-82.8	-12	-178.8	-92.8	-172.3	169.7	151.5	-0.5	116.3	A693 G697	A693-R695 PolarHBondContact O-N 2.67Å; R695-G697 VanDerWaalsContact C-N 3.25Å; R695-G697 PolarHBondContact O-N 3.38Å; R695-G697 VanDerWaalsContact O-N 3.13Å
696	L	31.1	Very low	42.4	Very low	119 Å²	119	105 Å²	105	62%	0.623	58%	0.577	S	S	*	*	S	Bend	trans	-81.7	14.5	-169.6	-80.6	165.7	0	0	0	116.4
697	G	28.9	Very low	40.8	Very low	43 Å²	43	105.8 Å²	105.8	44%	0.443	58%	0.582	S	S	.	*			trans	-136.7	53.6	-172.3	0	0	0	0	0	116	R695	R695-G697 VanDerWaalsContact C-N 3.25Å; R695-G697 PolarHBondContact O-N 3.38Å; R695-G697 VanDerWaalsContact O-N 3.13Å
698	T	29.2	Very low	38.8	Very low	135 Å²	135	111.6 Å²	111.6	83%	0.828	61%	0.608	S	S	*	*			trans	-135.7	112.6	154.3	51.5	0	0	0	0	111.4	L700	T698-L700 PolarHBondContact O-N 3.19Å; T698-L700 VanDerWaalsContact O-N 3.12Å
699	S	28.2	Very low	36.6	Very low	111 Å²	111	116.6 Å²	116.6	78%	0.776	63%	0.634	S	S	*	*			trans	-44.3	105.9	173.9	153	0	0	0	0	112.9	H701	S699-H701 VanDerWaalsContact C-N 3.29Å; S699-H701 PolarHBondContact O-N 3.04Å
700	L	29.3	Very low	34.9	Very low	175 Å²	175	122.6 Å²	122.6	92%	0.916	67%	0.665	S	S	*	*			trans	-87.5	70.5	161.3	-155.6	85.8	0	0	0	108.4	T698	T698-L700 PolarHBondContact O-N 3.19Å; T698-L700 VanDerWaalsContact O-N 3.12Å
701	H	28.7	Very low	33.3	Very low	166 Å²	166	127.9 Å²	127.9	77%	0.769	69%	0.69	S	S	*	*			trans	-134.9	82.8	172.4	-125.4	64.6	0	0	0	108.8	S699	S699-H701 VanDerWaalsContact C-N 3.29Å; S699-H701 PolarHBondContact O-N 3.04Å
702	N	28.3	Very low	32.2	Very low	156 Å²	156	132.8 Å²	132.8	83%	0.834	71%	0.713	S	S	*	*			trans	-173	81	162.8	-92.6	-24.9	0	0	0	107.6
703	Y	27.2	Very low	31.3	Very low	240 Å²	240	138.7 Å²	138.7	94%	0.941	74%	0.738	S	S	*	*	S	Bend	trans	179.6	64.1	154.4	-107	-73.2	0	0	0	110
704	A	27.5	Very low	30.7	Very low	92 Å²	92	144.8 Å²	144.8	76%	0.76	77%	0.769	S	S	*	*			trans	-164.9	52.4	166.2	0	0	0	0	0	112.6
705	H	27.1	Very low	30.2	Very low	196 Å²	196	146.6 Å²	146.6	91%	0.907	78%	0.779	S	S	*	*			trans	-142.8	90.1	162	-101.3	-73	0	0	0	109.6
706	S	27.7	Very low	29.8	Very low	108 Å²	108	145.6 Å²	145.6	76%	0.755	79%	0.788	S	S	*	*			trans	-168.2	98.5	142	-166	0	0	0	0	107.4
707	N	30.8	Very low	29.8	Very low	160 Å²	160	142.8 Å²	142.8	86%	0.856	79%	0.788	S	S	*	*			trans	-176.9	93.9	137.6	-85.9	-16.2	0	0	0	107.4
708	N	28.7	Very low	29.5	Very low	143 Å²	143	152.4 Å²	152.4	77%	0.765	81%	0.811	S	S	*	*			trans	-63.7	159.6	161.2	-76.3	-29.2	0	0	0	110.4
709	N	31.3	Very low	29.5	Very low	139 Å²	139	152.6 Å²	152.6	74%	0.743	81%	0.812	S	S	*	*			trans	85.8	98	162	-54.5	-14.1	0	0	0	115.5
710	D	34.6	Very low	29.4	Very low	145 Å²	145	155.9 Å²	155.9	78%	0.775	81%	0.812	S	S	*	*				166.9	122.2	94.2	-82.3	-30.2	0	0	0	111.6
711	D	31.9	Very low	29.4	Very low	138 Å²	138	153.4 Å²	153.4	74%	0.738	81%	0.806	S	S	*	*			trans	38.2	130.4	143	-76.4	-25.6	0	0	0	124.3
712	H	31.8	Very low	29.4	Very low	158 Å²	158	154.1 Å²	154.1	73%	0.731	81%	0.81	S	S	*	*			trans	55	107.6	139.4	-80.6	-80.4	0	0	0	119.6
713	D	33.2	Very low	29.2	Very low	152 Å²	152	152.7 Å²	152.7	81%	0.813	81%	0.807	S	S	*	*				-175.3	138.2	98.4	-110	-24.3	0	0	0	113.9
714	N	29.7	Very low	29.2	Very low	142 Å²	142	152.3 Å²	152.3	76%	0.759	80%	0.804	S	S	*	*			trans	-66.5	131.4	171.6	-79.3	-47.7	0	0	0	111
715	N	32	Very low	29.1	Very low	167 Å²	167	153.8 Å²	153.8	89%	0.893	80%	0.804	S	S	*	*				-170.9	129.7	129.7	-99.7	-34.8	0	0	0	113.7
716	N	28.3	Very low	29	Very low	172 Å²	172	156.3 Å²	156.3	92%	0.92	81%	0.805	S	S	*	*			trans	-57.9	127.7	174	-75.3	-41.1	0	0	0	112.4
717	G	31.1	Very low	29	Very low	61 Å²	61	157.3 Å²	157.3	63%	0.629	81%	0.807	S	S	*	*			trans	-166.6	73.6	177.1	0	0	0	0	0	113.5	V719	G717-V719 WeakPolarHBondContact O-CG2 3.19Å; G717-V719 PolarHBondContact O-N 3.49Å
718	R	24	Very low	28.8	Very low	245 Å²	245	155.3 Å²	155.3	93%	0.925	81%	0.805	S	S	*	*			trans	-10.6	93.5	159.8	-164.7	176.5	-166.7	144	1.3	115.2
719	V	29.1	Very low	28.7	Very low	138 Å²	138	153.3 Å²	153.3	84%	0.836	80%	0.803	S	S	*	*			trans	-91.3	114.5	172.5	179.5	0	0	0	0	109.5	G717	G717-V719 WeakPolarHBondContact O-CG2 3.19Å; G717-V719 PolarHBondContact O-N 3.49Å
720	K	24.7	Very low	28.4	Very low	180 Å²	180	154.1 Å²	154.1	78%	0.783	81%	0.807	S	S	*	*			trans	-70.9	144.9	168.6	-79.4	-180	173.9	-179.4	0	110.3
721	P	30.6	Very low	27.9	Very low	123 Å²	123	157.7 Å²	157.7	80%	0.799	81%	0.811	S	S	*	*			trans	-88	112.5	-173.3	33.1	-30.2	0	0	0	111.5
722	E	27	Very low	27.5	Very low	181 Å²	181	159.6 Å²	159.6	85%	0.846	82%	0.816	S	S	*	*			trans	-130	95.6	162.2	-78.4	-173.5	179.3	0	0	110.5
723	T	26	Very low	27.2	Very low	126 Å²	126	159.7 Å²	159.7	77%	0.773	82%	0.821	S	S	*	*				23	111.1	124.6	44.9	0	0	0	0	118.5
724	R	25.5	Very low	26.7	Very low	232 Å²	232	159.1 Å²	159.1	88%	0.875	82%	0.818	S	S	*	*				175.2	112.1	104	-102.5	-172.2	158.4	152.1	-4.8	113.4
725	T	25.1	Very low	26.4	Very low	123 Å²	123	161.5 Å²	161.5	76%	0.755	83%	0.826	S	S	*	*				28.6	99.9	124.1	46.6	0	0	0	0	118
726	R	25.4	Very low	26.1	Very low	249 Å²	249	164.1 Å²	164.1	94%	0.94	83%	0.826	S	S	*	*			trans	-94.5	109.4	149.7	-91.5	-175	-179.7	177.3	1.8	109.5
727	T	27.6	Very low	26	Very low	129 Å²	129	162.9 Å²	162.9	79%	0.791	82%	0.819	S	S	*	*			trans	-70.4	130.6	155.3	40.9	0	0	0	0	109.2
728	S	27.5	Very low	25.8	Very low	118 Å²	118	167.3 Å²	167.3	83%	0.825	83%	0.828	S	S	*	*			trans	-159	119.4	151.5	-82.6	0	0	0	0	111
729	S	27	Very low	25.9	Very low	101 Å²	101	159 Å²	159	71%	0.706	82%	0.818	S	S	*	*			trans	-46.5	156.7	162.3	44.5	0	0	0	0	115.2
730	N	25.3	Very low	25.9	Very low	156 Å²	156	160.1 Å²	160.1	83%	0.834	82%	0.82	S	S	*	*			trans	99.7	85.7	169.1	-58.4	-5.5	0	0	0	114
731	Y	23.9	Very low	25.9	Very low	221 Å²	221	156.9 Å²	156.9	87%	0.867	82%	0.82	S	S	*	*			trans	-120.2	106.9	158	-132.2	-96.5	0	0	0	108.5
732	Q	22.1	Very low	25.6	Very low	177 Å²	177	160.9 Å²	160.9	83%	0.827	83%	0.825	S	S	*	*			trans	-94	111.5	177.1	-166.9	163.2	-19.1	0	0	105.6	D734	Q732-D734 PolarHBondContact O-N 3.5Å
733	L	26.8	Very low	25.5	Very low	161 Å²	161	159.2 Å²	159.2	84%	0.843	82%	0.82	S	S	*	*			trans	-80.7	103	-178	-85.9	141.6	0	0	0	108.9
734	D	23.1	Very low	25.5	Very low	140 Å²	140	159.9 Å²	159.9	75%	0.749	82%	0.819	S	S	*	*			trans	-73.9	128.3	168.5	-80.2	-31.9	0	0	0	110.2	Q732	Q732-D734 PolarHBondContact O-N 3.5Å
735	M	23.2	Very low	25.6	Very low	191 Å²	191	154.8 Å²	154.8	94%	0.941	81%	0.814	S	S	*	*			trans	-69.2	121.5	177.9	-147.5	177.9	179.6	0	0	109
736	Y	24.8	Very low	25.7	Very low	223 Å²	223	155.6 Å²	155.6	88%	0.875	81%	0.814	S	S	*	*			trans	-124.5	123	166.2	-101.5	-83.8	0	0	0	111
737	D	27.1	Very low	25.7	Very low	145 Å²	145	148.8 Å²	148.8	78%	0.775	80%	0.804	S	S	*	*			trans	-71.4	161.4	172.8	-122.1	-27.4	0	0	0	111.8
738	N	27	Very low	25.6	Very low	154 Å²	154	153.7 Å²	153.7	82%	0.824	81%	0.81	S	S	*	*			trans	90	90.8	167.7	-61.8	-35.7	0	0	0	119.2
739	G	25.7	Very low	25.6	Very low	70 Å²	70	153.8 Å²	153.8	72%	0.722	81%	0.806	S	S	*	*				37.8	120.7	106.7	0	0	0	0	0	120.8
740	N	27.7	Very low	25.5	Very low	163 Å²	163	157 Å²	157	87%	0.872	81%	0.809	S	S	*	*			trans	66.9	92.1	149.9	-70.4	-2.9	0	0	0	119.5
741	S	25.7	Very low	25.6	Very low	111 Å²	111	156 Å²	156	78%	0.776	80%	0.804	S	S	*	*			trans	-160.3	108.8	130	-157.6	0	0	0	0	111
742	F	25	Very low	25.8	Very low	208 Å²	208	154.6 Å²	154.6	91%	0.912	81%	0.805	S	S	*	*			trans	-69.2	120.6	170.8	-91.5	-105.9	0	0	0	109.5
743	I	25.2	Very low	26.1	Very low	145 Å²	145	155.2 Å²	155.2	74%	0.744	81%	0.808	S	S	*	*			trans	-108.7	115.2	167.6	-60.4	-180	0	0	0	108.6	T745	I743-T745 HydrophobicContact CG2-CG2 4.38Å
744	N	24.3	Very low	26.1	Very low	140 Å²	140	150.6 Å²	150.6	75%	0.749	80%	0.799	S	S	*	*			trans	-80.2	111.2	178.8	-173.1	-11.1	0	0	0	109.5
745	T	27.5	Very low	26.7	Very low	126 Å²	126	151.9 Å²	151.9	77%	0.773	80%	0.798	S	S	*	*			trans	-110.9	85.6	177.4	50.9	0	0	0	0	110.7	I743	I743-T745 HydrophobicContact CG2-CG2 4.38Å
746	N	27.5	Very low	27.3	Very low	140 Å²	140	151.6 Å²	151.6	75%	0.749	79%	0.792	S	S	*	*			trans	-83.8	142.4	157.3	-84.9	-22.9	0	0	0	109.2
747	S	26.8	Very low	28.3	Very low	105 Å²	105	144.6 Å²	144.6	73%	0.734	77%	0.769	S	S	*	*			trans	90.7	90.8	175.1	-164.1	0	0	0	0	115.8
748	Y	23.7	Very low	29.5	Very low	232 Å²	232	140.2 Å²	140.2	91%	0.91	74%	0.744	S	S	*	*			trans	-160.2	113.2	130.9	-101	-74.7	0	0	0	109
749	T	27.9	Very low	31.1	Very low	120 Å²	120	137.5 Å²	137.5	74%	0.736	73%	0.728	S	S	*	*			trans	-83.4	152.1	172.8	37.3	0	0	0	0	110.5
750	H	25.5	Very low	33	Very low	168 Å²	168	136 Å²	136	78%	0.778	70%	0.704	S	S	*	*	S	Bend	trans	93.1	110.8	172	-68.7	-75.7	0	0	0	119.7
751	N	28.3	Very low	35.2	Very low	135 Å²	135	128.4 Å²	128.4	72%	0.722	66%	0.664	S	S	*	*			trans	63.5	71.1	137	-72.8	-3.4	0	0	0	119
752	H	27.2	Very low	37.3	Very low	193 Å²	193	126 Å²	126	89%	0.894	64%	0.641	S	S	*	*			trans	-142.4	105.3	132.5	-81.2	-65.1	0	0	0	108.7	G754	H752-G754 PolarHBondContact O-N 2.02Å
753	Q	28.1	Very low	39.6	Very low	190 Å²	190	118.2 Å²	118.2	89%	0.888	61%	0.611	S	S	*	*			trans	-64.5	78.5	167.6	-78.9	172.3	-38.7	0	0	108.8	F755	Q753-F755 PolarHBondContact O-N 3.47Å
754	G	28	Very low	42.2	Very low	64 Å²	64	111.8 Å²	111.8	66%	0.66	58%	0.578	S	S	*	*			trans	-64.7	110.9	160.4	0	0	0	0	0	107.6	H752 K756	H752-G754 PolarHBondContact O-N 2.02Å; G754-K756 PolarHBondContact O-N 3.27Å
755	F	34.3	Very low	44.8	Very low	167 Å²	167	109.8 Å²	109.8	73%	0.732	56%	0.56	S	S	*	*			trans	-50.9	110.2	177.9	-75.9	-95.7	0	0	0	110.1	Q753 N757	Q753-F755 PolarHBondContact O-N 3.47Å; F755-N757 PolarHBondContact O-N 3.47Å
756	K	35.8	Very low	47.2	Very low	185 Å²	185	107.7 Å²	107.7	80%	0.804	55%	0.551	S	S	*	*			trans	-67.2	110.7	175.1	-85.1	-179.3	171.3	179.9	0	109.5	G754 E758	G754-K756 PolarHBondContact O-N 3.27Å; K756-E758 PolarHBondContact O-N 3Å
757	N	45.7	Very low	49.7	Very low	75 Å²	75	102.9 Å²	102.9	40%	0.401	53%	0.525	S	S	.	.			trans	40.4	57.6	150.1	-58.7	-13.2	0	0	0	117.8	F755 M759 Y806	F755-N757 PolarHBondContact O-N 3.47Å; N757-M759 PolarHBondContact O-N 2.96Å; N757-Y806 PolarHBondContact ND2-OH 3.47Å
758	E	52	Low	52.2	Low	54 Å²	54	97.9 Å²	97.9	25%	0.252	49%	0.49	S	S	.	.			trans	-70.7	123	165.9	-70.3	-174	151.1	0	0	110.3	G669 C670 K756 V760	G669-E758 WeakPolarHBondContact CA-OE1 3.48Å; C670-E758 PolarHBondContact N-OE1 2.96Å; C670-E758 VanDerWaalsContact N-OE1 3.17Å; K756-E758 PolarHBondContact O-N 3Å; E758-V760 PolarHBondContact O-N 2.88Å
759	M	61.7	Low	54.8	Low	97 Å²	97	87.2 Å²	87.2	48%	0.478	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	103.2	172.2	-72.4	-173.4	-101	0	0	109.1	F673 A674 A693 N757	F673-M759 CarbonylContact C-O 3.55Å; F673-M759 WeakPolarHBondContact CA-O 3.26Å; F673-M759 WeakPolarHBondContact CB-O 3.46Å; F673-M759 HydrophobicContact CD1-CB 3.63Å; F673-M759 HydrophobicContact CE1-CB 4.03Å; F673-M759 HydrophobicContact CE1-SD 4.06Å; A674-M759 PolarHBondContact N-O 2.84Å; A693-M759 HydrophobicContact CB-CB 4.47Å; N757-M759 PolarHBondContact O-N 2.96Å
760	V	65.2	Low	57.2	Low	37 Å²	37	83 Å²	83	22%	0.224	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	131.9	-179.2	-175.5	0	0	0	0	111.2	A674 A693 E758 Q762	A674-V760 HydrophobicContact CB-CG2 4.45Å; A674-V760 CarbonylContact O-C 3.53Å; A674-V760 WeakPolarHBondContact O-CA 3.09Å; A674-V760 WeakPolarHBondContact O-CG1 3.23Å; A693-V760 HydrophobicContact CB-CB 4.31Å; A693-V760 WeakPolarHBondContact CB-O 3.39Å; E758-V760 PolarHBondContact O-N 2.88Å; V760-Q762 PolarHBondContact O-N 2.82Å
761	C	74.5	Confident	59.6	Low	4 Å²	4	75.6 Å²	75.6	3%	0.027	39%	0.394	C	S	.	.			trans	-69.2	120.9	171.7	-60.5	0	0	0	0	110.2	A674 C684	A674-C761 PolarHBondContact O-N 3.2Å; C684-C761 WeakPolarHBondContact CA-SG 3.27Å; C684-C761 HydrophobicContact CB-CB 3.72Å; C684-C761 WeakPolarHBondContact CB-SG 3.24Å; C684-C761 VanDerWaalsContact SG-CA 3.51Å; C684-C761 WeakPolarHBondContact SG-CB 3.33Å; C684-C761 CovalentContact SG-SG 2.04Å; C684-C761 PolarHBondContact SG-SG 3.11Å
762	Q	68.9	Low	61.7	Low	62 Å²	62	70.3 Å²	70.3	29%	0.29	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	144.1	-178.7	-63.3	-169	-72.1	0	0	111.1	T688 T689 G692 V760 P774	T688-Q762 CarbonylContact C-O 3.41Å; T688-Q762 WeakPolarHBondContact CA-O 3.48Å; T688-Q762 WeakPolarHBondContact CB-O 3.44Å; T689-Q762 PolarHBondContact N-O 2.92Å; T689-Q762 PolarHBondContact O-N 2.88Å; G692-Q762 VanDerWaalsContact CA-OE1 3.27Å; G692-Q762 PolarHBondContact O-OE1 2.88Å; V760-Q762 PolarHBondContact O-N 2.82Å; Q762-P774 HydrophobicContact CB-CB 3.49Å; Q762-P774 VanDerWaalsContact CB-CB 3.49Å; Q762-P774 HydrophobicContact CB-CG 3.84Å
763	P	74.6	Confident	63.9	Low	43 Å²	43	61.8 Å²	61.8	28%	0.279	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	143.8	-173	29	-32.4	0	0	0	112.7	G687 T688 P774 H775	G687-P763 CarbonylContact O-C 3.56Å; G687-P763 WeakPolarHBondContact O-CA 3.35Å; T688-P763 HydrophobicContact CG2-CB 4.43Å; P763-P774 CarbonylContact O-C 3.44Å; P763-P774 WeakPolarHBondContact O-CA 3.31Å; P763-P774 WeakPolarHBondContact O-CB 3.24Å; P763-H775 WeakPolarHBondContact CG-CE1 3.28Å; P763-H775 PolarHBondContact O-N 3.36Å
764	C	79.3	Confident	65.8	Low	10 Å²	10	53.6 Å²	53.6	7%	0.068	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-67.9	171.7	170.8	-65.6	0	0	0	0	111.2	G687 C768 C771	G687-C764 VanDerWaalsContact C-SG 3.57Å; G687-C764 WeakPolarHBondContact O-CB 2.96Å; G687-C764 PolarHBondContact O-N 2.96Å; C764-C768 HydrophobicContact CB-CB 3.99Å; C764-C771 WeakPolarHBondContact CA-SG 3.3Å; C764-C771 HydrophobicContact CB-CB 3.66Å; C764-C771 WeakPolarHBondContact CB-SG 3.41Å; C764-C771 WeakPolarHBondContact SG-CB 3.42Å; C764-C771 PolarHBondContact SG-N 3.02Å; C764-C771 CovalentContact SG-SG 2.03Å; C764-C771 PolarHBondContact SG-SG 2.88Å
765	W	78.7	Confident	67.7	Low	98 Å²	98	55.7 Å²	55.7	37%	0.371	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-59	144.6	166.1	-174.3	-107.9	0	0	0	110.4	L767 C768 E777	W765-L767 PolarHBondContact O-N 2.98Å; W765-C768 PolarHBondContact O-N 3.4Å; W765-E777 HydrophobicContact CD2-CB 4Å; W765-E777 HydrophobicContact CG-CB 3.95Å
766	S	77.9	Confident	69.4	Low	83 Å²	83	49.1 Å²	49.1	58%	0.58	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-15.8	-167.3	56.3	0	0	0	0	115.7
767	L	78.8	Confident	71.2	Confident	38 Å²	38	42.3 Å²	42.3	20%	0.199	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-10.8	178.3	-56.3	-176.5	0	0	0	114.1	W765 L784 C830	W765-L767 PolarHBondContact O-N 2.98Å; L767-L784 PolarHBondContact O-N 2.99Å; L767-C830 HydrophobicContact CB-CB 3.86Å; L767-C830 WeakPolarHBondContact O-CB 3.48Å; L767-C830 PolarHBondContact O-SG 2.99Å
768	C	79.6	Confident	72.7	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.007	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	136	178.6	-44.1	0	0	0	0	110.8	C764 W765 C771 C780 A782 L784	C764-C768 HydrophobicContact CB-CB 3.99Å; W765-C768 PolarHBondContact O-N 3.4Å; C768-C771 HydrophobicContact CB-CB 4.35Å; C768-C780 HydrophobicContact CB-CB 3.72Å; C768-C780 WeakPolarHBondContact CB-SG 3.28Å; C768-C780 VanDerWaalsContact SG-CA 3.52Å; C768-C780 WeakPolarHBondContact SG-CB 3.44Å; C768-C780 CovalentContact SG-SG 2.02Å; C768-C780 PolarHBondContact SG-SG 3.34Å; C768-A782 CarbonylContact C-O 3.49Å; C768-A782 WeakPolarHBondContact CA-O 2.79Å; C768-L784 VanDerWaalsContact O-CD1 3.31Å; C768-L784 WeakPolarHBondContact O-CD1 3.49Å
769	S	79.4	Confident	73.8	Confident	7 Å²	7	37.8 Å²	37.8	5%	0.049	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-23.3	165.1	56.2	0	0	0	0	112.4	G687 A782 C783	G687-S769 PolarHBondContact N-O 3.04Å; S769-A782 PolarHBondContact N-O 3.03Å; S769-A782 WeakPolarHBondContact OG-CB 3.44Å; S769-A782 PolarHBondContact OG-O 2.81Å; S769-C783 WeakPolarHBondContact CB-O 3.47Å; S769-C783 VanDerWaalsContact OG-C 3.26Å; S769-C783 PolarHBondContact OG-N 2.84Å; S769-C783 PolarHBondContact OG-O 2.98Å
770	A	78.5	Confident	74.8	Confident	32 Å²	32	33.2 Å²	33.2	26%	0.264	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	145.1	170.5	0	0	0	0	0	109.2	C780 T781 A782	A770-C780 WeakPolarHBondContact O-CA 3.5Å; A770-T781 WeakPolarHBondContact CB-OG1 3.47Å; A770-T781 PolarHBondContact O-N 3.48Å; A770-T781 PolarHBondContact O-OG1 3.13Å; A770-A782 HydrophobicContact CB-CB 4.23Å; A770-A782 PolarHBondContact N-O 2.81Å; A770-A782 PolarHBondContact O-N 3.19Å
771	C	75.7	Confident	75.5	Confident	13 Å²	13	33.2 Å²	33.2	9%	0.088	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	158.1	-179.2	65	0	0	0	0	111.1	C764 C768 R773 D779	C764-C771 WeakPolarHBondContact CA-SG 3.3Å; C764-C771 HydrophobicContact CB-CB 3.66Å; C764-C771 WeakPolarHBondContact CB-SG 3.41Å; C764-C771 WeakPolarHBondContact SG-CB 3.42Å; C764-C771 PolarHBondContact SG-N 3.02Å; C764-C771 CovalentContact SG-SG 2.03Å; C764-C771 PolarHBondContact SG-SG 2.88Å; C768-C771 HydrophobicContact CB-CB 4.35Å; C771-R773 PolarHBondContact SG-O 3.19Å; C771-D779 CarbonylContact C-O 3.55Å; C771-D779 WeakPolarHBondContact CA-O 3.41Å; C771-D779 WeakPolarHBondContact CB-O 3.06Å
772	I	70.9	Confident	75.7	Confident	23 Å²	23	34.6 Å²	34.6	12%	0.118	19%	0.189	C	C	.	.	S	Bend	trans	-75.4	-57.2	171.4	-61.4	173.2	0	0	0	109.3	T689 F691 D779 T781 L823 P824 I827 Y1336	T689-I772 PolarHBondContact OG1-O 2.9Å; F691-I772 VanDerWaalsContact CB-O 3.3Å; F691-I772 WeakPolarHBondContact CB-O 3.44Å; F691-I772 HydrophobicContact CD1-CG2 4.13Å; F691-I772 WeakPolarHBondContact CD1-O 3.4Å; F691-I772 HydrophobicContact CE1-CG2 4.22Å; I772-D779 HydrophobicContact CB-CB 4.4Å; I772-D779 PolarHBondContact N-O 2.88Å; I772-T781 HydrophobicContact CD1-CG2 4.22Å; I772-T781 HydrophobicContact CG1-CG2 3.74Å; I772-L823 HydrophobicContact CD1-CD2 4.03Å; I772-P824 HydrophobicContact CD1-CG 4.41Å; I772-P824 HydrophobicContact CG1-CG 4.44Å; I772-I827 HydrophobicContact CD1-CD1 3.32Å; I772-I827 HydrophobicContact CD1-CG1 3.72Å; I772-I827 HydrophobicContact CD1-CG2 4.24Å; I772-Y1336 HydrophobicContact CD1-CE1 4.16Å
773	R	73.9	Confident	76.3	Confident	14 Å²	14	32.7 Å²	32.7	5%	0.053	18%	0.182	C	C	.	.	S	Bend	trans	-110.9	146.7	179.8	-75.4	-179.9	-61.5	160.6	11.7	111.5	F691 C771 I776 D779 L1340 I1364 G1365	F691-R773 HydrophobicContact CD1-CG 3.48Å; F691-R773 VanDerWaalsContact CD1-CG 3.48Å; F691-R773 HydrophobicContact CE1-CG 3.56Å; C771-R773 PolarHBondContact SG-O 3.19Å; R773-I776 HydrophobicContact CB-CD1 3.73Å; R773-I776 HydrophobicContact CB-CG1 4.38Å; R773-I776 HydrophobicContact CG-CD1 4.48Å; R773-D779 IonicContact CZ-OD2 2.71Å; R773-D779 IonicContact NE-OD2 3.19Å; R773-D779 PolarHBondContact NE-OD2 3.06Å; R773-D779 IonicContact NH2-OD1 3.91Å; R773-D779 IonicContact NH2-OD2 3.73Å; R773-D779 PolarHBondContact NH2-OD2 3.39Å; R773-L1340 VanDerWaalsContact CZ-CD2 3.43Å; R773-L1340 VanDerWaalsContact NH2-CD2 3.32Å; R773-I1364 PolarHBondContact NH2-O 2.92Å; R773-G1365 PolarHBondContact NH1-O 3.3Å
774	P	67.5	Low	76.2	Confident	18 Å²	18	32.8 Å²	32.8	12%	0.117	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	150.5	-178.9	31.7	-37.1	0	0	0	110.5	T689 F691 Q762 P763 I776	T689-P774 HydrophobicContact CG2-CB 3.91Å; T689-P774 HydrophobicContact CG2-CG 4.26Å; F691-P774 WeakPolarHBondContact O-CD 3.34Å; Q762-P774 HydrophobicContact CB-CB 3.49Å; Q762-P774 VanDerWaalsContact CB-CB 3.49Å; Q762-P774 HydrophobicContact CB-CG 3.84Å; P763-P774 CarbonylContact O-C 3.44Å; P763-P774 WeakPolarHBondContact O-CA 3.31Å; P763-P774 WeakPolarHBondContact O-CB 3.24Å; P774-I776 PolarHBondContact O-N 3.18Å; P774-I776 VanDerWaalsContact O-N 3.09Å
775	H	68.8	Low	75.4	Confident	108 Å²	108	38.6 Å²	38.6	50%	0.5	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	14.4	175.1	-46	-77.6	0	0	0	117.5	P763	P763-H775 WeakPolarHBondContact CG-CE1 3.28Å; P763-H775 PolarHBondContact O-N 3.36Å
776	I	70	Confident	74.8	Confident	29 Å²	29	38.4 Å²	38.4	15%	0.149	21%	0.214	C	C	.	.			trans	-108.3	119.8	-179.7	-60.6	179.5	0	0	0	111.1	R773 P774 Y778 D779	R773-I776 HydrophobicContact CB-CD1 3.73Å; R773-I776 HydrophobicContact CB-CG1 4.38Å; R773-I776 HydrophobicContact CG-CD1 4.48Å; P774-I776 PolarHBondContact O-N 3.18Å; P774-I776 VanDerWaalsContact O-N 3.09Å; I776-Y778 VanDerWaalsContact C-N 3.29Å; I776-Y778 PolarHBondContact O-N 3.41Å; I776-D779 HydrophobicContact CB-CB 4.18Å; I776-D779 HydrophobicContact CG2-CB 4.05Å; I776-D779 PolarHBondContact O-N 3.13Å
777	E	73.8	Confident	74.9	Confident	42 Å²	42	38.1 Å²	38.1	20%	0.196	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-31	-177.7	180	-178.2	172	0	0	113.8	W765 C780 T829 R831	W765-E777 HydrophobicContact CD2-CB 4Å; W765-E777 HydrophobicContact CG-CB 3.95Å; E777-C780 PolarHBondContact O-SG 2.99Å; E777-T829 WeakPolarHBondContact CG-OG1 3.36Å; E777-T829 PolarHBondContact O-OG1 3.37Å; E777-T829 PolarHBondContact OE1-OG1 3.04Å; E777-R831 IonicContact OE1-CZ 3.14Å; E777-R831 IonicContact OE1-NH1 2.72Å; E777-R831 IonicContact OE1-NH2 2.73Å; E777-R831 PolarHBondContact OE1-NH2 2.76Å
778	Y	77.1	Confident	75.1	Confident	34 Å²	34	37.7 Å²	37.7	13%	0.133	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-0.4	-173.2	-56	-66	0	0	0	114.4	I776 G828 V1352 L1359 I1364	I776-Y778 VanDerWaalsContact C-N 3.29Å; I776-Y778 PolarHBondContact O-N 3.41Å; Y778-G828 CarbonylContact C-O 3.37Å; Y778-G828 VanDerWaalsContact C-O 3.26Å; Y778-V1352 HydrophobicContact CD1-CG1 4.47Å; Y778-V1352 HydrophobicContact CD1-CG2 4.09Å; Y778-V1352 HydrophobicContact CE1-CG1 4.5Å; Y778-V1352 HydrophobicContact CE1-CG2 4.1Å; Y778-L1359 HydrophobicContact CE1-CD1 4.4Å; Y778-L1359 HydrophobicContact CE2-CD1 4.26Å; Y778-I1364 HydrophobicContact CD2-CB 4.05Å; Y778-I1364 HydrophobicContact CD2-CG2 3.81Å; Y778-I1364 HydrophobicContact CE2-CG2 4.17Å; Y778-I1364 HydrophobicContact CG-CG2 4.42Å
779	D	75.5	Confident	75.4	Confident	1 Å²	1	38 Å²	38	1%	0.005	20%	0.198	C	C	.	.			trans	-106.8	20.4	-179.4	-73.8	-11.8	0	0	0	112.1	C771 I772 R773 I776 Y1336	C771-D779 CarbonylContact C-O 3.55Å; C771-D779 WeakPolarHBondContact CA-O 3.41Å; C771-D779 WeakPolarHBondContact CB-O 3.06Å; I772-D779 HydrophobicContact CB-CB 4.4Å; I772-D779 PolarHBondContact N-O 2.88Å; R773-D779 IonicContact CZ-OD2 2.71Å; R773-D779 IonicContact NE-OD2 3.19Å; R773-D779 PolarHBondContact NE-OD2 3.06Å; R773-D779 IonicContact NH2-OD1 3.91Å; R773-D779 IonicContact NH2-OD2 3.73Å; R773-D779 PolarHBondContact NH2-OD2 3.39Å; I776-D779 HydrophobicContact CB-CB 4.18Å; I776-D779 HydrophobicContact CG2-CB 4.05Å; I776-D779 PolarHBondContact O-N 3.13Å; D779-Y1336 VanDerWaalsContact CG-OH 3.3Å; D779-Y1336 PolarHBondContact OD1-OH 2.78Å
780	C	81.5	Confident	75.6	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	137	172.4	-55.5	0	0	0	0	109.6	C768 A770 E777 L789 I827 G828	C768-C780 HydrophobicContact CB-CB 3.72Å; C768-C780 WeakPolarHBondContact CB-SG 3.28Å; C768-C780 VanDerWaalsContact SG-CA 3.52Å; C768-C780 WeakPolarHBondContact SG-CB 3.44Å; C768-C780 CovalentContact SG-SG 2.02Å; C768-C780 PolarHBondContact SG-SG 3.34Å; A770-C780 WeakPolarHBondContact O-CA 3.5Å; E777-C780 PolarHBondContact O-SG 2.99Å; C780-L789 HydrophobicContact CB-CD1 3.86Å; C780-I827 CarbonylContact O-C 3.56Å; C780-I827 WeakPolarHBondContact O-CA 3.42Å; C780-G828 VanDerWaalsContact CB-O 3.29Å; C780-G828 WeakPolarHBondContact CB-O 3.22Å; C780-G828 PolarHBondContact N-O 3.38Å; C780-G828 PolarHBondContact O-N 3.14Å
781	T	79.8	Confident	75.5	Confident	38 Å²	38	37.5 Å²	37.5	23%	0.233	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	-14.6	171	59.4	0	0	0	0	111.5	A770 I772 P824 I827	A770-T781 WeakPolarHBondContact CB-OG1 3.47Å; A770-T781 PolarHBondContact O-N 3.48Å; A770-T781 PolarHBondContact O-OG1 3.13Å; I772-T781 HydrophobicContact CD1-CG2 4.22Å; I772-T781 HydrophobicContact CG1-CG2 3.74Å; T781-P824 HydrophobicContact CG2-CB 4Å; T781-P824 HydrophobicContact CG2-CG 3.73Å; T781-I827 HydrophobicContact CG2-CG1 4.33Å
782	A	78.8	Confident	75.2	Confident	33 Å²	33	38 Å²	38	27%	0.273	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	154.4	173.1	0	0	0	0	0	109.9	C768 S769 A770	C768-A782 CarbonylContact C-O 3.49Å; C768-A782 WeakPolarHBondContact CA-O 2.79Å; S769-A782 PolarHBondContact N-O 3.03Å; S769-A782 WeakPolarHBondContact OG-CB 3.44Å; S769-A782 PolarHBondContact OG-O 2.81Å; A770-A782 HydrophobicContact CB-CB 4.23Å; A770-A782 PolarHBondContact N-O 2.81Å; A770-A782 PolarHBondContact O-N 3.19Å
783	C	82.4	Confident	74.8	Confident	21 Å²	21	38.8 Å²	38.8	14%	0.142	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	158.3	-177.6	-58.3	0	0	0	0	112.7	S769 R787 L789 C830	S769-C783 WeakPolarHBondContact CB-O 3.47Å; S769-C783 VanDerWaalsContact OG-C 3.26Å; S769-C783 PolarHBondContact OG-N 2.84Å; S769-C783 PolarHBondContact OG-O 2.98Å; C783-R787 HydrophobicContact CB-CB 3.93Å; C783-L789 WeakPolarHBondContact SG-CA 3.34Å; C783-L789 PolarHBondContact SG-N 2.83Å; C783-C830 WeakPolarHBondContact CA-SG 3.34Å; C783-C830 HydrophobicContact CB-CB 3.68Å; C783-C830 WeakPolarHBondContact CB-SG 3.34Å; C783-C830 WeakPolarHBondContact SG-CA 3.2Å; C783-C830 WeakPolarHBondContact SG-CB 3.42Å; C783-C830 CovalentContact SG-SG 2.02Å; C783-C830 PolarHBondContact SG-SG 3.42Å
784	L	71.5	Confident	73.9	Confident	45 Å²	45	39.7 Å²	39.7	24%	0.236	21%	0.205	C	C	.	.	S	Bend	trans	-86.8	145.5	171.2	-76.7	153.2	0	0	0	110.9	L767 C768 R787	L767-L784 PolarHBondContact O-N 2.99Å; C768-L784 VanDerWaalsContact O-CD1 3.31Å; C768-L784 WeakPolarHBondContact O-CD1 3.49Å; L784-R787 VanDerWaalsContact O-CB 3.28Å; L784-R787 WeakPolarHBondContact O-CB 3.49Å; L784-R787 WeakPolarHBondContact O-CD 3.47Å; L784-R787 VanDerWaalsContact O-CG 3.31Å; L784-R787 WeakPolarHBondContact O-CG 3.33Å; L784-R787 PolarHBondContact O-N 2.8Å
785	N	64.2	Low	73.3	Confident	133 Å²	133	40.7 Å²	40.7	71%	0.711	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	43.7	86.5	160.2	-58.9	-9.9	0	0	0	116.9	R787	N785-R787 PolarHBondContact O-N 3.03Å
786	H	64.7	Low	72.6	Confident	94 Å²	94	39.7 Å²	39.7	44%	0.435	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	13.6	174.1	-54.1	-79.9	0	0	0	116.1	D553	D553-H786 PolarHBondContact O-CE1 2.92Å; D553-H786 PolarHBondContact O-ND1 2.77Å
787	R	80.1	Confident	71.5	Confident	77 Å²	77	46.1 Å²	46.1	29%	0.291	25%	0.248	S	C	.	.			trans	-88.7	151.8	174.8	-66	172.6	-170.5	-104.5	-4.9	110.3	C783 L784 N785 R831 T832	C783-R787 HydrophobicContact CB-CB 3.93Å; L784-R787 VanDerWaalsContact O-CB 3.28Å; L784-R787 WeakPolarHBondContact O-CB 3.49Å; L784-R787 WeakPolarHBondContact O-CD 3.47Å; L784-R787 VanDerWaalsContact O-CG 3.31Å; L784-R787 WeakPolarHBondContact O-CG 3.33Å; L784-R787 PolarHBondContact O-N 2.8Å; N785-R787 PolarHBondContact O-N 3.03Å; R787-R831 CarbonylContact C-O 3.54Å; R787-R831 VanDerWaalsContact CA-O 3.3Å; R787-R831 WeakPolarHBondContact CA-O 3.4Å; R787-R831 VanDerWaalsContact CB-O 3.26Å; R787-R831 WeakPolarHBondContact CB-O 3.19Å; R787-T832 HydrophobicContact CG-CG2 4.08Å
788	F	83	Confident	70.2	Confident	29 Å²	29	53.2 Å²	53.2	13%	0.127	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	135.5	178.9	-59.7	-86.3	0	0	0	110.6	V790 R831 C834 G840 K842 S845 C847	F788-V790 PolarHBondContact O-N 2.86Å; F788-R831 PolarHBondContact N-O 2.54Å; F788-R831 PolarHBondContact O-N 3.26Å; F788-C834 VanDerWaalsContact CB-SG 3.59Å; F788-G840 VanDerWaalsContact CD1-CA 3.42Å; F788-K842 HydrophobicContact CE1-CG 4.38Å; F788-K842 HydrophobicContact CZ-CG 4.19Å; F788-S845 CarbonylContact C-O 3.54Å; F788-S845 VanDerWaalsContact CA-O 3.31Å; F788-S845 WeakPolarHBondContact CA-O 3.04Å; F788-C847 WeakPolarHBondContact CB-SG 3.48Å
789	L	85.9	Confident	68.8	Low	7 Å²	7	52.9 Å²	52.9	4%	0.037	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	114.5	172	-172.5	68.6	0	0	0	108.7	C780 C783 P791 I826 S845 V846 C847	C780-L789 HydrophobicContact CB-CD1 3.86Å; C783-L789 WeakPolarHBondContact SG-CA 3.34Å; C783-L789 PolarHBondContact SG-N 2.83Å; L789-P791 WeakPolarHBondContact O-CD 3.35Å; L789-I826 HydrophobicContact CD2-CB 4.39Å; L789-I826 HydrophobicContact CD2-CG2 3.7Å; L789-S845 PolarHBondContact N-O 3.33Å; L789-V846 HydrophobicContact CB-CG2 4.34Å; L789-V846 WeakPolarHBondContact O-CA 3.31Å; L789-V846 WeakPolarHBondContact O-CG1 3.39Å; L789-C847 PolarHBondContact O-N 2.65Å
790	V	83.3	Confident	67.4	Low	0 Å²	0	61 Å²	61	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	111	171.8	178.8	0	0	0	0	107.8	F788 G828 T829 R831 P835 C847 A1353 D1354	F788-V790 PolarHBondContact O-N 2.86Å; V790-G828 CarbonylContact O-C 3.37Å; V790-G828 WeakPolarHBondContact O-CA 3.36Å; V790-T829 HydrophobicContact CB-CG2 3.96Å; V790-T829 WeakPolarHBondContact CB-O 3.2Å; V790-T829 HydrophobicContact CG1-CG2 4.45Å; V790-T829 PolarHBondContact N-O 2.09Å; V790-T829 PolarHBondContact O-N 3.48Å; V790-R831 HydrophobicContact CG2-CB 4.15Å; V790-R831 HydrophobicContact CG2-CG 3.84Å; V790-P835 HydrophobicContact CG1-CG 4.31Å; V790-P835 HydrophobicContact CG2-CG 4.39Å; V790-C847 HydrophobicContact CG2-CB 4.17Å; V790-C847 VanDerWaalsContact CG2-SG 3.58Å; V790-A1353 HydrophobicContact CG1-CB 3.75Å; V790-D1354 HydrophobicContact CG1-CB 4.4Å
791	P	76.5	Confident	65.5	Low	28 Å²	28	63.9 Å²	63.9	18%	0.182	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	147.9	-173.8	27.1	-33.9	0	0	0	112.5	L789 I826 C847 A1353	L789-P791 WeakPolarHBondContact O-CD 3.35Å; P791-I826 HydrophobicContact CB-CG2 4.05Å; P791-C847 WeakPolarHBondContact CD-O 3.21Å; P791-A1353 VanDerWaalsContact O-CB 3.3Å; P791-A1353 WeakPolarHBondContact O-CB 3.37Å
792	L	70.8	Confident	63.8	Low	25 Å²	25	62.6 Å²	62.6	13%	0.131	33%	0.33	C	S	.	.	B	Isolated β-bridge	trans	-69.5	140.3	164.5	-72.7	167.6	0	0	0	110.1	T794 I827 Y1336 V1352	L792-T794 HydrophobicContact CB-CG2 4.47Å; L792-T794 PolarHBondContact O-N 2.85Å; L792-I827 WeakPolarHBondContact CB-O 3.49Å; L792-I827 HydrophobicContact CD1-CB 4.23Å; L792-I827 HydrophobicContact CD1-CG2 3.9Å; L792-I827 PolarHBondContact N-O 3.09Å; L792-Y1336 HydrophobicContact CD1-CD2 3.88Å; L792-Y1336 HydrophobicContact CD1-CE2 3.63Å; L792-V1352 HydrophobicContact CD2-CB 4.49Å; L792-V1352 HydrophobicContact CD2-CG1 4.45Å; L792-V1352 HydrophobicContact CD2-CG2 3.94Å
793	L	61.5	Low	61.8	Low	38 Å²	38	63.7 Å²	63.7	20%	0.199	33%	0.331	C	S	.	.			trans	-91.7	95.1	177.3	-65.5	170.9	0	0	0	109	C1333 C1351 A1353	L793-C1333 VanDerWaalsContact O-CB 3.24Å; L793-C1333 WeakPolarHBondContact O-CB 3.47Å; L793-C1351 HydrophobicContact CB-CB 3.92Å; L793-C1351 PolarHBondContact N-O 2.85Å; L793-C1351 VanDerWaalsContact N-O 3.11Å; L793-A1353 HydrophobicContact CD1-CB 4.25Å; L793-A1353 HydrophobicContact CD2-CB 4.49Å; L793-A1353 HydrophobicContact CG-CB 4.11Å
794	T	55.8	Low	59.7	Low	33 Å²	33	65.3 Å²	65.3	20%	0.202	34%	0.336	C	S	.	.			trans	-118.5	141.1	176.2	58.7	0	0	0	0	111.2	L792 N796	L792-T794 HydrophobicContact CB-CG2 4.47Å; L792-T794 PolarHBondContact O-N 2.85Å; T794-N796 WeakPolarHBondContact O-CB 3.23Å; T794-N796 PolarHBondContact O-N 3.35Å; T794-N796 VanDerWaalsContact OG1-CG 3.27Å; T794-N796 PolarHBondContact OG1-OD1 3.11Å
795	A	55	Low	58	Low	40 Å²	40	65.7 Å²	65.7	33%	0.331	34%	0.342	S	S	.	.			trans	-73.6	107.7	173.8	0	0	0	0	0	108.8
796	N	52.7	Low	56.7	Low	87 Å²	87	65.1 Å²	65.1	47%	0.465	33%	0.331	S	S	.	.			trans	-120.5	34.5	-147.6	-122.9	25.6	0	0	0	117.6	T794	T794-N796 WeakPolarHBondContact O-CB 3.23Å; T794-N796 PolarHBondContact O-N 3.35Å; T794-N796 VanDerWaalsContact OG1-CG 3.27Å; T794-N796 PolarHBondContact OG1-OD1 3.11Å
797	N	47.4	Very low	55.1	Low	164 Å²	164	65.2 Å²	65.2	88%	0.877	34%	0.338	S	S	*	.	S	Bend	trans	-88.2	-11.1	177.4	-76.8	0	0	0	0	115.9
798	E	46.5	Very low	52.8	Low	191 Å²	191	68.4 Å²	68.4	89%	0.893	36%	0.356	S	S	*	.	S	Bend	trans	-124.3	3.6	-174.4	-67.4	-174.5	172.7	0	0	116.7	K800	E798-K800 PolarHBondContact O-N 2.67Å
799	A	47.5	Very low	50.4	Low	27 Å²	27	74.5 Å²	74.5	22%	0.223	39%	0.391	C	S	.	.			trans	-92.7	35.6	-170.4	0	0	0	0	0	116.5
800	K	47.5	Very low	48	Very low	172 Å²	172	79.1 Å²	79.1	75%	0.748	42%	0.415	S	S	*	.	S	Bend	trans	-77.3	-19.1	-170.9	-78.2	-176.6	178.9	176.1	0	116.2	E798 N822	E798-K800 PolarHBondContact O-N 2.67Å; K800-N822 PolarHBondContact O-OD1 3.08Å
801	T	40.7	Very low	45.8	Very low	60 Å²	60	86.8 Å²	86.8	37%	0.368	46%	0.456	S	S	.	.			trans	-151.6	134.7	-171.3	-25.4	0	0	0	0	112.3	N822	T801-N822 WeakPolarHBondContact CG2-OD1 3.25Å
802	V	43.4	Very low	44.1	Very low	10 Å²	10	92.4 Å²	92.4	6%	0.061	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	129	170.2	-174.5	0	0	0	0	108.6	F804 F821 L823 R1337 I1372	V802-F804 HydrophobicContact CB-CE2 3.94Å; V802-F804 HydrophobicContact CB-CZ 4.28Å; V802-F804 HydrophobicContact CG1-CD2 4.21Å; V802-F804 HydrophobicContact CG1-CE1 4.14Å; V802-F804 HydrophobicContact CG1-CE2 3.5Å; V802-F804 VanDerWaalsContact CG1-CE2 3.5Å; V802-F804 HydrophobicContact CG1-CZ 3.45Å; V802-F804 VanDerWaalsContact CG1-CZ 3.45Å; V802-F821 PolarHBondContact N-O 2.88Å; V802-F821 PolarHBondContact O-N 2.75Å; V802-L823 HydrophobicContact CG2-CD1 3.53Å; V802-L823 HydrophobicContact CG2-CG 4.32Å; V802-R1337 HydrophobicContact CG2-CG 4.2Å; V802-I1372 HydrophobicContact CG1-CD1 4.1Å
803	L	36.8	Very low	42.6	Very low	57 Å²	57	99.5 Å²	99.5	30%	0.298	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	127.6	-175.4	-171.5	75.2	0	0	0	109	L818 N820	L803-L818 HydrophobicContact CD1-CB 3.95Å; L803-L818 HydrophobicContact CD1-CD2 4.11Å; L803-L818 HydrophobicContact CD2-CD2 3.32Å; L803-L818 HydrophobicContact CG-CB 4.27Å; L803-L818 HydrophobicContact CG-CD2 3.66Å; L803-N820 HydrophobicContact CD1-CB 4.21Å; L803-N820 VanDerWaalsContact CD1-CG 3.4Å; L803-N820 WeakPolarHBondContact CD1-OD1 3.49Å
804	F	39.3	Very low	41.2	Very low	55 Å²	55	101.3 Å²	101.3	24%	0.241	55%	0.545	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	134.4	-179.5	-64.8	-84.4	0	0	0	110.4	F691 V802 L818 I819 F821 I1372	F691-F804 HydrophobicContact CE2-CZ 4.39Å; F691-F804 HydrophobicContact CZ-CZ 4.35Å; V802-F804 HydrophobicContact CB-CE2 3.94Å; V802-F804 HydrophobicContact CB-CZ 4.28Å; V802-F804 HydrophobicContact CG1-CD2 4.21Å; V802-F804 HydrophobicContact CG1-CE1 4.14Å; V802-F804 HydrophobicContact CG1-CE2 3.5Å; V802-F804 VanDerWaalsContact CG1-CE2 3.5Å; V802-F804 HydrophobicContact CG1-CZ 3.45Å; V802-F804 VanDerWaalsContact CG1-CZ 3.45Å; F804-L818 CarbonylContact O-C 3.55Å; F804-L818 WeakPolarHBondContact O-CA 3.37Å; F804-I819 PolarHBondContact N-O 3.42Å; F804-I819 PolarHBondContact O-N 3.18Å; F804-F821 HydrophobicContact CD2-CB 4.24Å; F804-F821 HydrophobicContact CE2-CB 4.11Å; F804-I1372 HydrophobicContact CE1-CD1 4.49Å; F804-I1372 HydrophobicContact CE1-CG1 4.06Å
805	S	35.4	Very low	40.2	Very low	53 Å²	53	107.5 Å²	107.5	37%	0.371	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110	140.2	173.4	59.3	0	0	0	0	110.6
806	Y	36.3	Very low	39.2	Very low	121 Å²	121	109.2 Å²	109.2	48%	0.475	58%	0.583	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-126.6	128.2	169.5	176.9	-100.6	0	0	0	109.2	N757 Q808	N757-Y806 PolarHBondContact ND2-OH 3.47Å; Y806-Q808 HydrophobicContact CD1-CB 4.37Å; Y806-Q808 HydrophobicContact CE1-CB 4.07Å; Y806-Q808 HydrophobicContact CE1-CG 4.43Å
807	T	31.9	Very low	38.2	Very low	96 Å²	96	113.5 Å²	113.5	59%	0.589	60%	0.598	S	S	*	*			trans	-88.2	107.6	174	45.9	0	0	0	0	108.8	D809 T816	T807-D809 PolarHBondContact O-N 3.18Å; T807-T816 HydrophobicContact CG2-CG2 4.06Å
808	Q	32.3	Very low	37.6	Very low	143 Å²	143	109.9 Å²	109.9	67%	0.668	58%	0.578	S	S	*	*			trans	-83.9	109.4	168.1	-163.7	172.4	6.2	0	0	106.7	Y806 N810	Y806-Q808 HydrophobicContact CD1-CB 4.37Å; Y806-Q808 HydrophobicContact CE1-CB 4.07Å; Y806-Q808 HydrophobicContact CE1-CG 4.43Å; Q808-N810 PolarHBondContact O-N 2.74Å
809	D	32.3	Very low	37.2	Very low	158 Å²	158	106 Å²	106	85%	0.845	56%	0.563	S	S	*	*			trans	-63.2	85.2	172.6	-80.6	-27.4	0	0	0	109	T807	T807-D809 PolarHBondContact O-N 3.18Å
810	N	35.6	Very low	36.5	Very low	104 Å²	104	110 Å²	110	56%	0.556	58%	0.58	S	S	*	*			trans	-119.7	123.2	162.5	-81.8	-23.5	0	0	0	106.5	Q808	Q808-N810 PolarHBondContact O-N 2.74Å
811	N	37.2	Very low	36.1	Very low	160 Å²	160	107.1 Å²	107.1	86%	0.856	57%	0.568	S	S	*	*	S	Bend	trans	-43.5	138.6	178.9	-67.4	-35.4	0	0	0	112.5
812	D	40.8	Very low	36.2	Very low	147 Å²	147	109.9 Å²	109.9	79%	0.786	58%	0.58	S	S	*	*	S	Bend	trans	57.4	112	173.8	-80.2	-34.6	0	0	0	117.1
813	H	38.3	Very low	36.3	Very low	173 Å²	173	111.1 Å²	111.1	80%	0.801	59%	0.586	S	S	*	*	S	Bend	trans	80.7	77	171.9	-58.6	48.9	0	0	0	113.7	N815	H813-N815 PolarHBondContact O-N 3.22Å
814	G	33.2	Very low	37	Very low	77 Å²	77	111 Å²	111	79%	0.794	59%	0.589	S	S	*	*			trans	-51.1	102.8	177.2	0	0	0	0	0	112.8
815	N	34.8	Very low	37.8	Very low	162 Å²	162	117.4 Å²	117.4	87%	0.866	62%	0.62	S	S	*	*			trans	-104.5	88	170.8	-128.1	-8.6	0	0	0	107.8	H813 K817	H813-N815 PolarHBondContact O-N 3.22Å; N815-K817 PolarHBondContact O-N 3.1Å; N815-K817 VanDerWaalsContact O-N 3.16Å
816	T	33.9	Very low	39.2	Very low	77 Å²	77	118.4 Å²	118.4	47%	0.472	62%	0.62	S	S	.	*			trans	-61.2	110.5	174	-3.5	0	0	0	0	108.9	T807	T807-T816 HydrophobicContact CG2-CG2 4.06Å
817	K	31.7	Very low	40.9	Very low	176 Å²	176	113.4 Å²	113.4	77%	0.765	60%	0.602	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-86.5	118.7	169.8	-101.3	-179.1	177.3	176	0	109.4	N815	N815-K817 PolarHBondContact O-N 3.1Å; N815-K817 VanDerWaalsContact O-N 3.16Å
818	L	34	Very low	43.4	Very low	89 Å²	89	108.9 Å²	108.9	47%	0.466	57%	0.574	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.2	134.2	174.2	-65.5	94	0	0	0	110.3	L803 F804	L803-L818 HydrophobicContact CD1-CB 3.95Å; L803-L818 HydrophobicContact CD1-CD2 4.11Å; L803-L818 HydrophobicContact CD2-CD2 3.32Å; L803-L818 HydrophobicContact CG-CB 4.27Å; L803-L818 HydrophobicContact CG-CD2 3.66Å; F804-L818 CarbonylContact O-C 3.55Å; F804-L818 WeakPolarHBondContact O-CA 3.37Å
819	I	37.6	Very low	45.9	Very low	110 Å²	110	102.1 Å²	102.1	56%	0.564	54%	0.542	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.6	119	173.7	-57.6	175.4	0	0	0	107.9	F804	F804-I819 PolarHBondContact N-O 3.42Å; F804-I819 PolarHBondContact O-N 3.18Å
820	N	34	Very low	48.5	Very low	111 Å²	111	94.6 Å²	94.6	59%	0.594	50%	0.502	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.9	120.8	174.7	-109.8	-30.4	0	0	0	109.8	L803	L803-N820 HydrophobicContact CD1-CB 4.21Å; L803-N820 VanDerWaalsContact CD1-CG 3.4Å; L803-N820 WeakPolarHBondContact CD1-OD1 3.49Å
821	F	38.3	Very low	50.7	Low	110 Å²	110	93.2 Å²	93.2	48%	0.482	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	117.7	175.3	-133.5	-89	0	0	0	110	V802 F804	V802-F821 PolarHBondContact N-O 2.88Å; V802-F821 PolarHBondContact O-N 2.75Å; F804-F821 HydrophobicContact CD2-CB 4.24Å; F804-F821 HydrophobicContact CE2-CB 4.11Å
822	N	42.3	Very low	52.7	Low	119 Å²	119	89.6 Å²	89.6	64%	0.636	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-80.8	122.3	169.9	-75.8	-31.7	0	0	0	108.4	K800 T801	K800-N822 PolarHBondContact O-OD1 3.08Å; T801-N822 WeakPolarHBondContact CG2-OD1 3.25Å
823	L	47.2	Very low	54.6	Low	35 Å²	35	90.2 Å²	90.2	18%	0.183	47%	0.471	C	S	.	.	P	Polyproline II helix	trans	-67	139	173.8	-84.9	150.7	0	0	0	109.9	I772 V802 I827 Y1336	I772-L823 HydrophobicContact CD1-CD2 4.03Å; V802-L823 HydrophobicContact CG2-CD1 3.53Å; V802-L823 HydrophobicContact CG2-CG 4.32Å; L823-I827 HydrophobicContact CD2-CD1 4.03Å; L823-Y1336 HydrophobicContact CD2-CD1 3.93Å; L823-Y1336 HydrophobicContact CD2-CE1 3.8Å
824	P	51.4	Low	56.8	Low	56 Å²	56	83.4 Å²	83.4	36%	0.364	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-56.2	148.6	170.6	-21.3	31.8	0	0	0	111.8	I772 T781 I826	I772-P824 HydrophobicContact CD1-CG 4.41Å; I772-P824 HydrophobicContact CG1-CG 4.44Å; T781-P824 HydrophobicContact CG2-CB 4Å; T781-P824 HydrophobicContact CG2-CG 3.73Å; P824-I826 VanDerWaalsContact C-N 3.3Å; P824-I826 PolarHBondContact O-N 2.79Å
825	Q	56.1	Low	59	Low	188 Å²	188	81 Å²	81	88%	0.879	41%	0.413	S	S	*	.	S	Bend	trans	-66.5	-28	-175.7	-70.3	-172.5	-9.2	0	0	114
826	I	65.2	Low	61.1	Low	74 Å²	74	79.6 Å²	79.6	38%	0.379	40%	0.404	S	S	.	.			trans	-135.7	125.5	-177	-53.4	177.6	0	0	0	108.9	L789 P791 P824 V846	L789-I826 HydrophobicContact CD2-CB 4.39Å; L789-I826 HydrophobicContact CD2-CG2 3.7Å; P791-I826 HydrophobicContact CB-CG2 4.05Å; P824-I826 VanDerWaalsContact C-N 3.3Å; P824-I826 PolarHBondContact O-N 2.79Å; I826-V846 HydrophobicContact CD1-CG2 4.48Å
827	I	72	Confident	63.3	Low	17 Å²	17	76.3 Å²	76.3	9%	0.087	39%	0.385	C	S	.	.			trans	-129.2	140.5	177.3	-55.5	160.8	0	0	0	106.7	I772 C780 T781 L792 L823 Y1336	I772-I827 HydrophobicContact CD1-CD1 3.32Å; I772-I827 HydrophobicContact CD1-CG1 3.72Å; I772-I827 HydrophobicContact CD1-CG2 4.24Å; C780-I827 CarbonylContact O-C 3.56Å; C780-I827 WeakPolarHBondContact O-CA 3.42Å; T781-I827 HydrophobicContact CG2-CG1 4.33Å; L792-I827 WeakPolarHBondContact CB-O 3.49Å; L792-I827 HydrophobicContact CD1-CB 4.23Å; L792-I827 HydrophobicContact CD1-CG2 3.9Å; L792-I827 PolarHBondContact N-O 3.09Å; L823-I827 HydrophobicContact CD2-CD1 4.03Å; I827-Y1336 HydrophobicContact CD1-CD1 3.77Å; I827-Y1336 HydrophobicContact CD1-CE1 3.43Å; I827-Y1336 VanDerWaalsContact CD1-CE1 3.43Å; I827-Y1336 HydrophobicContact CD1-CE2 4.27Å; I827-Y1336 HydrophobicContact CD1-CG 4.31Å; I827-Y1336 HydrophobicContact CG2-CE2 4.15Å
828	G	83	Confident	65.9	Low	0 Å²	0	69.9 Å²	69.9	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171	-166.2	-169.3	0	0	0	0	0	114.7	Y778 C780 V790	Y778-G828 CarbonylContact C-O 3.37Å; Y778-G828 VanDerWaalsContact C-O 3.26Å; C780-G828 VanDerWaalsContact CB-O 3.29Å; C780-G828 WeakPolarHBondContact CB-O 3.22Å; C780-G828 PolarHBondContact N-O 3.38Å; C780-G828 PolarHBondContact O-N 3.14Å; V790-G828 CarbonylContact O-C 3.37Å; V790-G828 WeakPolarHBondContact O-CA 3.36Å
829	T	85.8	Confident	68.4	Low	1 Å²	1	67 Å²	67	1%	0.006	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	149.1	172.8	-178.3	0	0	0	0	110.1	E777 V790 V1352	E777-T829 WeakPolarHBondContact CG-OG1 3.36Å; E777-T829 PolarHBondContact O-OG1 3.37Å; E777-T829 PolarHBondContact OE1-OG1 3.04Å; V790-T829 HydrophobicContact CB-CG2 3.96Å; V790-T829 WeakPolarHBondContact CB-O 3.2Å; V790-T829 HydrophobicContact CG1-CG2 4.45Å; V790-T829 PolarHBondContact N-O 2.09Å; V790-T829 PolarHBondContact O-N 3.48Å; T829-V1352 HydrophobicContact CG2-CG1 4.12Å
830	C	85.9	Confident	70.6	Confident	0 Å²	0	63 Å²	63	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	127.6	-176	-66.7	0	0	0	0	112	L767 C783	L767-C830 HydrophobicContact CB-CB 3.86Å; L767-C830 WeakPolarHBondContact O-CB 3.48Å; L767-C830 PolarHBondContact O-SG 2.99Å; C783-C830 WeakPolarHBondContact CA-SG 3.34Å; C783-C830 HydrophobicContact CB-CB 3.68Å; C783-C830 WeakPolarHBondContact CB-SG 3.34Å; C783-C830 WeakPolarHBondContact SG-CA 3.2Å; C783-C830 WeakPolarHBondContact SG-CB 3.42Å; C783-C830 CovalentContact SG-SG 2.02Å; C783-C830 PolarHBondContact SG-SG 3.42Å
831	R	81.5	Confident	72.8	Confident	76 Å²	76	59.4 Å²	59.4	29%	0.287	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	150.3	178.3	-64.1	-71	-176.7	-150.7	-19.8	111.1	E777 R787 F788 V790 E833 D1354	E777-R831 IonicContact OE1-CZ 3.14Å; E777-R831 IonicContact OE1-NH1 2.72Å; E777-R831 IonicContact OE1-NH2 2.73Å; E777-R831 PolarHBondContact OE1-NH2 2.76Å; R787-R831 CarbonylContact C-O 3.54Å; R787-R831 VanDerWaalsContact CA-O 3.3Å; R787-R831 WeakPolarHBondContact CA-O 3.4Å; R787-R831 VanDerWaalsContact CB-O 3.26Å; R787-R831 WeakPolarHBondContact CB-O 3.19Å; F788-R831 PolarHBondContact N-O 2.54Å; F788-R831 PolarHBondContact O-N 3.26Å; V790-R831 HydrophobicContact CG2-CB 4.15Å; V790-R831 HydrophobicContact CG2-CG 3.84Å; R831-E833 WeakPolarHBondContact CB-O 3.39Å; R831-D1354 IonicContact NE-OD2 3.32Å; R831-D1354 IonicContact NH2-OD2 3.77Å
832	T	80.4	Confident	74.5	Confident	83 Å²	83	60.6 Å²	60.6	51%	0.509	31%	0.312	S	S	.	.	S	Bend	trans	-69.2	-40.8	173.7	41.9	0	0	0	0	111.7	R787	R787-T832 HydrophobicContact CG-CG2 4.08Å
833	E	80.5	Confident	75.9	Confident	161 Å²	161	59 Å²	59	75%	0.752	31%	0.31	S	S	*	.	S	Bend	trans	-121.7	142.1	178.1	-66.1	174.5	-169.4	0	0	109.3	R831	R831-E833 WeakPolarHBondContact CB-O 3.39Å
834	C	83.4	Confident	77.1	Confident	29 Å²	29	59.6 Å²	59.6	20%	0.196	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-71.4	143.3	177.2	-70.1	0	0	0	0	111.2	F788 F838 G840 C847	F788-C834 VanDerWaalsContact CB-SG 3.59Å; C834-F838 HydrophobicContact CB-CB 3.98Å; C834-G840 WeakPolarHBondContact SG-CA 3.28Å; C834-G840 PolarHBondContact SG-N 2.94Å; C834-G840 VanDerWaalsContact SG-N 3.38Å; C834-C847 WeakPolarHBondContact CA-SG 3.3Å; C834-C847 HydrophobicContact CB-CB 3.85Å; C834-C847 WeakPolarHBondContact CB-SG 3.35Å; C834-C847 WeakPolarHBondContact SG-CA 3.18Å; C834-C847 WeakPolarHBondContact SG-CB 3.26Å; C834-C847 CovalentContact SG-SG 2.04Å; C834-C847 PolarHBondContact SG-SG 3.09Å
835	P	80.5	Confident	78.5	Confident	28 Å²	28	59.2 Å²	59.2	18%	0.182	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-66	161.1	178.7	30	-37.1	0	0	0	111.7	V790 G837 F838 D1354	V790-P835 HydrophobicContact CG1-CG 4.31Å; V790-P835 HydrophobicContact CG2-CG 4.39Å; P835-G837 PolarHBondContact O-N 2.99Å; P835-F838 HydrophobicContact CG-CB 4.32Å; P835-F838 HydrophobicContact CG-CD2 3.79Å; P835-F838 HydrophobicContact CG-CE2 4.49Å; P835-F838 HydrophobicContact CG-CG 4.23Å; P835-F838 WeakPolarHBondContact O-CB 3.48Å; P835-F838 PolarHBondContact O-N 3.1Å; P835-D1354 HydrophobicContact CB-CB 3.74Å; P835-D1354 HydrophobicContact CG-CB 3.82Å
836	I	77.8	Confident	79.8	Confident	132 Å²	132	51.2 Å²	51.2	68%	0.677	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.1	133.5	174.9	-62.5	171.9	0	0	0	110.2	A855 Y869	I836-A855 HydrophobicContact CG2-CB 3.93Å; I836-A855 WeakPolarHBondContact CG2-O 3.32Å; I836-Y869 HydrophobicContact CG2-CE1 3.74Å
837	G	79.9	Confident	80.7	Confident	8 Å²	8	47.7 Å²	47.7	8%	0.082	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.1	2.4	-174.8	0	0	0	0	0	114.6	P835 C850 A855 Y869	P835-G837 PolarHBondContact O-N 2.99Å; G837-C850 WeakPolarHBondContact O-CB 3.41Å; G837-C850 PolarHBondContact O-N 3.31Å; G837-A855 PolarHBondContact N-O 2.76Å; G837-Y869 WeakPolarHBondContact CA-OH 3.38Å
838	F	86.9	Confident	81.3	Confident	40 Å²	40	50 Å²	50	18%	0.175	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	150	174.4	-65.4	-101.6	0	0	0	110.8	C834 P835 C847 E848 A849 A1353	C834-F838 HydrophobicContact CB-CB 3.98Å; P835-F838 HydrophobicContact CG-CB 4.32Å; P835-F838 HydrophobicContact CG-CD2 3.79Å; P835-F838 HydrophobicContact CG-CE2 4.49Å; P835-F838 HydrophobicContact CG-CG 4.23Å; P835-F838 WeakPolarHBondContact O-CB 3.48Å; P835-F838 PolarHBondContact O-N 3.1Å; F838-C847 HydrophobicContact CB-CB 4.02Å; F838-C847 HydrophobicContact CD1-CB 4.15Å; F838-C847 HydrophobicContact CG-CB 4.37Å; F838-E848 CarbonylContact C-O 3.53Å; F838-E848 WeakPolarHBondContact CA-O 3.31Å; F838-E848 WeakPolarHBondContact CB-O 3.28Å; F838-A849 HydrophobicContact CD1-CB 4.22Å; F838-A849 HydrophobicContact CE1-CB 3.97Å; F838-A849 HydrophobicContact CZ-CB 4.48Å; F838-A1353 HydrophobicContact CE1-CB 4.21Å; F838-A1353 HydrophobicContact CE2-CB 3.99Å; F838-A1353 HydrophobicContact CZ-CB 3.58Å
839	F	86.4	Confident	81.2	Confident	30 Å²	30	52.5 Å²	52.5	13%	0.132	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	148.5	169.3	74.6	-77.6	0	0	0	109.9	N841 C847 E848 C857	F839-N841 HydrophobicContact CE2-CB 4.08Å; F839-N841 PolarHBondContact O-N 2.56Å; F839-C847 WeakPolarHBondContact O-CA 3.47Å; F839-E848 HydrophobicContact CD1-CB 4.26Å; F839-E848 VanDerWaalsContact CD1-O 3.31Å; F839-E848 WeakPolarHBondContact CD1-O 3.46Å; F839-E848 HydrophobicContact CE1-CB 3.62Å; F839-E848 HydrophobicContact CZ-CB 3.81Å; F839-E848 PolarHBondContact N-O 2.93Å; F839-E848 PolarHBondContact O-N 3.06Å; F839-C857 VanDerWaalsContact CD1-SG 3.54Å
840	G	84.8	Confident	81.2	Confident	24 Å²	24	53.1 Å²	53.1	25%	0.247	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	104	177.7	0	0	0	0	0	110.3	F788 C834 K842	F788-G840 VanDerWaalsContact CD1-CA 3.42Å; C834-G840 WeakPolarHBondContact SG-CA 3.28Å; C834-G840 PolarHBondContact SG-N 2.94Å; C834-G840 VanDerWaalsContact SG-N 3.38Å; G840-K842 PolarHBondContact O-N 2.86Å; G840-K842 VanDerWaalsContact O-N 3.09Å
841	N	80	Confident	81.2	Confident	36 Å²	36	54 Å²	54	19%	0.193	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	105.5	171.4	-177.8	-24.7	0	0	0	108.2	F839 S843 S844 S845 V846 E848	F839-N841 HydrophobicContact CE2-CB 4.08Å; F839-N841 PolarHBondContact O-N 2.56Å; N841-S843 PolarHBondContact O-N 3.13Å; N841-S843 VanDerWaalsContact OD1-CB 3.26Å; N841-S843 WeakPolarHBondContact OD1-CB 3.48Å; N841-S843 PolarHBondContact OD1-N 3.2Å; N841-S844 VanDerWaalsContact CB-OG 3.31Å; N841-S844 WeakPolarHBondContact CB-OG 3Å; N841-S844 PolarHBondContact O-N 3.2Å; N841-S844 PolarHBondContact OD1-N 2.73Å; N841-S845 VanDerWaalsContact O-CA 3.3Å; N841-S845 WeakPolarHBondContact O-CA 3.35Å; N841-S845 PolarHBondContact O-N 2.85Å; N841-V846 PolarHBondContact N-O 3.1Å; N841-E848 HydrophobicContact CB-CG 4.15Å; N841-E848 WeakPolarHBondContact CB-OE1 3.24Å; N841-E848 PolarHBondContact ND2-OE1 3.45Å; N841-E848 PolarHBondContact ND2-OE2 3.23Å
842	K	74.7	Confident	81	Confident	136 Å²	136	56.3 Å²	56.3	59%	0.591	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-27.5	-177.2	-63.2	-174.9	-178.6	-178.7	0	112.5	D553 F788 G840	D553-K842 IonicContact OD1-NZ 2.99Å; D553-K842 PolarHBondContact OD1-NZ 2.02Å; F788-K842 HydrophobicContact CE1-CG 4.38Å; F788-K842 HydrophobicContact CZ-CG 4.19Å; G840-K842 PolarHBondContact O-N 2.86Å; G840-K842 VanDerWaalsContact O-N 3.09Å
843	S	70.2	Confident	81	Confident	85 Å²	85	53.9 Å²	53.9	59%	0.594	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-46.1	-179.8	-51.5	0	0	0	0	112.3	R600 N841	R600-S843 VanDerWaalsContact CZ-O 3.23Å; R600-S843 PolarHBondContact NH1-O 3.49Å; R600-S843 PolarHBondContact NH2-O 2.81Å; N841-S843 PolarHBondContact O-N 3.13Å; N841-S843 VanDerWaalsContact OD1-CB 3.26Å; N841-S843 WeakPolarHBondContact OD1-CB 3.48Å; N841-S843 PolarHBondContact OD1-N 3.2Å
844	S	73	Confident	81.3	Confident	47 Å²	47	46.4 Å²	46.4	33%	0.329	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-18.6	177.8	58.1	0	0	0	0	112.6	N841 V846 E848	N841-S844 VanDerWaalsContact CB-OG 3.31Å; N841-S844 WeakPolarHBondContact CB-OG 3Å; N841-S844 PolarHBondContact O-N 3.2Å; N841-S844 PolarHBondContact OD1-N 2.73Å; S844-V846 PolarHBondContact O-N 3.06Å; S844-V846 PolarHBondContact OG-N 2.94Å; S844-E848 PolarHBondContact OG-OE1 3.42Å
845	S	81	Confident	81.2	Confident	48 Å²	48	45.6 Å²	45.6	34%	0.336	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	34.9	-166.1	-52	0	0	0	0	111.8	F788 L789 N841	F788-S845 CarbonylContact C-O 3.54Å; F788-S845 VanDerWaalsContact CA-O 3.31Å; F788-S845 WeakPolarHBondContact CA-O 3.04Å; L789-S845 PolarHBondContact N-O 3.33Å; N841-S845 VanDerWaalsContact O-CA 3.3Å; N841-S845 WeakPolarHBondContact O-CA 3.35Å; N841-S845 PolarHBondContact O-N 2.85Å
846	V	82.8	Confident	81.5	Confident	20 Å²	20	49.4 Å²	49.4	12%	0.121	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	143.9	178.2	177.7	0	0	0	0	108.3	L789 I826 N841 S844 E848	L789-V846 HydrophobicContact CB-CG2 4.34Å; L789-V846 WeakPolarHBondContact O-CA 3.31Å; L789-V846 WeakPolarHBondContact O-CG1 3.39Å; I826-V846 HydrophobicContact CD1-CG2 4.48Å; N841-V846 PolarHBondContact N-O 3.1Å; S844-V846 PolarHBondContact O-N 3.06Å; S844-V846 PolarHBondContact OG-N 2.94Å; V846-E848 PolarHBondContact O-N 3.24Å
847	C	83.8	Confident	82	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.007	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	113.1	168.7	-67.6	0	0	0	0	109.4	F788 L789 V790 P791 C834 F838 F839	F788-C847 WeakPolarHBondContact CB-SG 3.48Å; L789-C847 PolarHBondContact O-N 2.65Å; V790-C847 HydrophobicContact CG2-CB 4.17Å; V790-C847 VanDerWaalsContact CG2-SG 3.58Å; P791-C847 WeakPolarHBondContact CD-O 3.21Å; C834-C847 WeakPolarHBondContact CA-SG 3.3Å; C834-C847 HydrophobicContact CB-CB 3.85Å; C834-C847 WeakPolarHBondContact CB-SG 3.35Å; C834-C847 WeakPolarHBondContact SG-CA 3.18Å; C834-C847 WeakPolarHBondContact SG-CB 3.26Å; C834-C847 CovalentContact SG-SG 2.04Å; C834-C847 PolarHBondContact SG-SG 3.09Å; F838-C847 HydrophobicContact CB-CB 4.02Å; F838-C847 HydrophobicContact CD1-CB 4.15Å; F838-C847 HydrophobicContact CG-CB 4.37Å; F839-C847 WeakPolarHBondContact O-CA 3.47Å
848	E	84.8	Confident	82.4	Confident	64 Å²	64	47.9 Å²	47.9	30%	0.299	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	145.8	178.8	-73.5	172.4	-160	0	0	110.2	F838 F839 N841 S844 V846	F838-E848 CarbonylContact C-O 3.53Å; F838-E848 WeakPolarHBondContact CA-O 3.31Å; F838-E848 WeakPolarHBondContact CB-O 3.28Å; F839-E848 HydrophobicContact CD1-CB 4.26Å; F839-E848 VanDerWaalsContact CD1-O 3.31Å; F839-E848 WeakPolarHBondContact CD1-O 3.46Å; F839-E848 HydrophobicContact CE1-CB 3.62Å; F839-E848 HydrophobicContact CZ-CB 3.81Å; F839-E848 PolarHBondContact N-O 2.93Å; F839-E848 PolarHBondContact O-N 3.06Å; N841-E848 HydrophobicContact CB-CG 4.15Å; N841-E848 WeakPolarHBondContact CB-OE1 3.24Å; N841-E848 PolarHBondContact ND2-OE1 3.45Å; N841-E848 PolarHBondContact ND2-OE2 3.23Å; S844-E848 PolarHBondContact OG-OE1 3.42Å; V846-E848 PolarHBondContact O-N 3.24Å
849	A	81.7	Confident	82.4	Confident	54 Å²	54	46.4 Å²	46.4	45%	0.446	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	137.4	-174.2	0	0	0	0	0	111.6	F838	F838-A849 HydrophobicContact CD1-CB 4.22Å; F838-A849 HydrophobicContact CE1-CB 3.97Å; F838-A849 HydrophobicContact CZ-CB 4.48Å
850	C	85.7	Confident	82.3	Confident	13 Å²	13	48.4 Å²	48.4	9%	0.088	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-65.1	164.3	168	-65.5	0	0	0	0	111.5	G837 C854 C857	G837-C850 WeakPolarHBondContact O-CB 3.41Å; G837-C850 PolarHBondContact O-N 3.31Å; C850-C854 HydrophobicContact CB-CB 4.02Å; C850-C857 WeakPolarHBondContact CA-SG 3.37Å; C850-C857 HydrophobicContact CB-CB 3.76Å; C850-C857 WeakPolarHBondContact CB-SG 3.45Å; C850-C857 WeakPolarHBondContact SG-CB 3.11Å; C850-C857 CovalentContact SG-SG 2.03Å; C850-C857 PolarHBondContact SG-SG 2.93Å
851	A	84.8	Confident	82.3	Confident	18 Å²	18	53.3 Å²	53.3	15%	0.149	30%	0.303	C	S	.	.	S	Bend	trans	-58.7	165.8	170.9	0	0	0	0	0	112.8	N853 C854 K861	A851-N853 PolarHBondContact O-N 2.92Å; A851-C854 VanDerWaalsContact O-CB 3.29Å; A851-C854 WeakPolarHBondContact O-CB 3.03Å; A851-C854 PolarHBondContact O-N 2.64Å; A851-K861 WeakPolarHBondContact CB-O 3.43Å
852	E	78.7	Confident	82.3	Confident	126 Å²	126	54.8 Å²	54.8	59%	0.589	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	138.6	-176.8	-161.2	158	158.6	0	0	113.1	C854 K1291	E852-C854 PolarHBondContact O-N 3.47Å; E852-K1291 VanDerWaalsContact CB-NZ 3.31Å; E852-K1291 VanDerWaalsContact CD-NZ 3.3Å; E852-K1291 VanDerWaalsContact CG-NZ 3.29Å; E852-K1291 IonicContact OE2-NZ 3.93Å; E852-K1291 PolarHBondContact OE2-NZ 2.83Å
853	N	80.1	Confident	82.7	Confident	32 Å²	32	52.6 Å²	52.6	17%	0.171	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.4	6	-178.7	-52.8	-42.5	0	0	0	115.8	A851 Y869 F872 C879	A851-N853 PolarHBondContact O-N 2.92Å; N853-Y869 WeakPolarHBondContact O-CD2 3.28Å; N853-Y869 PolarHBondContact O-N 3.13Å; N853-F872 HydrophobicContact CB-CD1 3.73Å; N853-F872 HydrophobicContact CB-CD2 4.19Å; N853-F872 HydrophobicContact CB-CE1 3.69Å; N853-F872 HydrophobicContact CB-CE2 4.18Å; N853-F872 HydrophobicContact CB-CG 4Å; N853-F872 HydrophobicContact CB-CZ 3.93Å; N853-F872 VanDerWaalsContact CG-CE1 3.41Å; N853-F872 VanDerWaalsContact CG-CZ 3.43Å; N853-F872 VanDerWaalsContact ND2-CE1 3.29Å; N853-F872 WeakPolarHBondContact ND2-CE1 3.17Å; N853-C879 HydrophobicContact CB-CB 4Å; N853-C879 PolarHBondContact O-SG 3.3Å
854	C	85.5	Confident	83.7	Confident	3 Å²	3	51.2 Å²	51.2	2%	0.02	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	126.9	173.8	-170.5	0	0	0	0	111.9	C850 A851 E852 Q856 C865 Y869	C850-C854 HydrophobicContact CB-CB 4.02Å; A851-C854 VanDerWaalsContact O-CB 3.29Å; A851-C854 WeakPolarHBondContact O-CB 3.03Å; A851-C854 PolarHBondContact O-N 2.64Å; E852-C854 PolarHBondContact O-N 3.47Å; C854-Q856 VanDerWaalsContact SG-C 3.53Å; C854-Q856 PolarHBondContact SG-O 2.84Å; C854-C865 WeakPolarHBondContact CA-SG 3.43Å; C854-C865 HydrophobicContact CB-CB 3.86Å; C854-C865 WeakPolarHBondContact CB-SG 3.04Å; C854-C865 WeakPolarHBondContact SG-CA 3.3Å; C854-C865 WeakPolarHBondContact SG-CB 3.31Å; C854-C865 CovalentContact SG-SG 2.03Å; C854-C865 PolarHBondContact SG-SG 3.2Å; C854-Y869 WeakPolarHBondContact O-CE2 2.92Å
855	A	82.1	Confident	84.5	Confident	13 Å²	13	49.3 Å²	49.3	11%	0.107	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	-36.7	177.1	0	0	0	0	0	112	I836 G837 E867 Y869	I836-A855 HydrophobicContact CG2-CB 3.93Å; I836-A855 WeakPolarHBondContact CG2-O 3.32Å; G837-A855 PolarHBondContact N-O 2.76Å; A855-E867 WeakPolarHBondContact CA-O 3.4Å; A855-E867 WeakPolarHBondContact CB-O 3.41Å; A855-E867 PolarHBondContact N-O 3.41Å; A855-Y869 HydrophobicContact CB-CD1 4Å; A855-Y869 HydrophobicContact CB-CD2 4.4Å; A855-Y869 HydrophobicContact CB-CE1 4.05Å; A855-Y869 HydrophobicContact CB-CE2 4.43Å; A855-Y869 HydrophobicContact CB-CG 4.18Å
856	Q	86.8	Confident	84.9	Confident	108 Å²	108	51.5 Å²	51.5	51%	0.505	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	130.1	176.1	-167.2	178.6	26.3	0	0	110.3	C854 C865 L866 E867	C854-Q856 VanDerWaalsContact SG-C 3.53Å; C854-Q856 PolarHBondContact SG-O 2.84Å; Q856-C865 PolarHBondContact O-SG 2.9Å; Q856-L866 WeakPolarHBondContact O-CB 3.3Å; Q856-L866 PolarHBondContact O-N 2.69Å; Q856-E867 HydrophobicContact CB-CB 4Å; Q856-E867 PolarHBondContact N-O 2.98Å; Q856-E867 PolarHBondContact O-N 3.09Å
857	C	89.2	Confident	85.1	Confident	12 Å²	12	54.2 Å²	54.2	8%	0.081	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	159.9	-176.7	64.1	0	0	0	0	111.7	F839 C850 G859 E864	F839-C857 VanDerWaalsContact CD1-SG 3.54Å; C850-C857 WeakPolarHBondContact CA-SG 3.37Å; C850-C857 HydrophobicContact CB-CB 3.76Å; C850-C857 WeakPolarHBondContact CB-SG 3.45Å; C850-C857 WeakPolarHBondContact SG-CB 3.11Å; C850-C857 CovalentContact SG-SG 2.03Å; C850-C857 PolarHBondContact SG-SG 2.93Å; C857-G859 WeakPolarHBondContact CB-O 3.33Å; C857-G859 PolarHBondContact SG-O 3.02Å; C857-E864 VanDerWaalsContact CA-O 3.31Å; C857-E864 WeakPolarHBondContact CA-O 3.47Å; C857-E864 WeakPolarHBondContact CB-O 3.44Å
858	T	87.7	Confident	85.2	Confident	96 Å²	96	54.4 Å²	54.4	59%	0.589	30%	0.301	S	S	*	.	S	Bend	trans	-92.4	-14.7	168.7	52.7	0	0	0	0	112.9	E864 L866	T858-E864 PolarHBondContact N-O 3.06Å; T858-E864 PolarHBondContact OG1-O 3.42Å; T858-L866 HydrophobicContact CG2-CD1 3.75Å; T858-L866 HydrophobicContact CG2-CD2 4.25Å; T858-L866 HydrophobicContact CG2-CG 4.12Å
859	G	86.9	Confident	84.8	Confident	8 Å²	8	54.4 Å²	54.4	8%	0.082	30%	0.299	C	S	.	.	S	Bend	trans	-164.8	-178.1	178.8	0	0	0	0	0	112.3	C857 K861 E864	C857-G859 WeakPolarHBondContact CB-O 3.33Å; C857-G859 PolarHBondContact SG-O 3.02Å; G859-K861 VanDerWaalsContact C-N 3.34Å; G859-K861 PolarHBondContact O-N 2.78Å; G859-E864 WeakPolarHBondContact CA-OE2 3.31Å
860	S	83.4	Confident	84.1	Confident	73 Å²	73	56.6 Å²	56.6	51%	0.51	31%	0.311	S	S	.	.	S	Bend	trans	-81.9	-7.1	-173.1	60.2	0	0	0	0	114.3	E864	S860-E864 PolarHBondContact N-OE2 2.82Å
861	K	85.2	Confident	83.3	Confident	127 Å²	127	57.7 Å²	57.7	55%	0.552	33%	0.325	S	S	*	.	S	Bend	trans	-80.4	155.8	-177.1	-57.1	179.1	-170.3	157.4	0	111.7	A851 G859 D863 E864	A851-K861 WeakPolarHBondContact CB-O 3.43Å; G859-K861 VanDerWaalsContact C-N 3.34Å; G859-K861 PolarHBondContact O-N 2.78Å; K861-D863 VanDerWaalsContact CB-OD1 3.25Å; K861-D863 WeakPolarHBondContact CB-OD1 3.44Å; K861-D863 PolarHBondContact O-N 3.47Å; K861-E864 HydrophobicContact CB-CG 4.05Å; K861-E864 WeakPolarHBondContact CB-OE2 3.4Å; K861-E864 WeakPolarHBondContact CG-OE2 3.45Å; K861-E864 PolarHBondContact N-OE2 2.92Å; K861-E864 VanDerWaalsContact N-OE2 3.08Å; K861-E864 IonicContact NZ-OE1 2.71Å; K861-E864 PolarHBondContact O-N 3.21Å
862	S	79.4	Confident	83.1	Confident	66 Å²	66	57.6 Å²	57.6	46%	0.462	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-25.7	-174.4	61.4	0	0	0	0	114.9	K878	S862-K878 WeakPolarHBondContact O-CA 3.19Å; S862-K878 WeakPolarHBondContact O-CG 3.06Å
863	D	84.8	Confident	83.4	Confident	91 Å²	91	55.4 Å²	55.4	49%	0.487	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-0.4	-177.2	56.2	-33.4	0	0	0	113.3	K861 G877 K878	K861-D863 VanDerWaalsContact CB-OD1 3.25Å; K861-D863 WeakPolarHBondContact CB-OD1 3.44Å; K861-D863 PolarHBondContact O-N 3.47Å; D863-G877 CarbonylContact C-O 3.53Å; D863-G877 WeakPolarHBondContact CA-O 3.24Å; D863-G877 WeakPolarHBondContact O-CA 3.42Å; D863-K878 HydrophobicContact CB-CG 4.37Å
864	E	89.6	Confident	83.8	Confident	56 Å²	56	56 Å²	56	26%	0.262	31%	0.311	S	S	.	.			trans	-97.8	20.6	179	-68.6	170.4	165.1	0	0	112	C857 T858 G859 S860 K861	C857-E864 VanDerWaalsContact CA-O 3.31Å; C857-E864 WeakPolarHBondContact CA-O 3.47Å; C857-E864 WeakPolarHBondContact CB-O 3.44Å; T858-E864 PolarHBondContact N-O 3.06Å; T858-E864 PolarHBondContact OG1-O 3.42Å; G859-E864 WeakPolarHBondContact CA-OE2 3.31Å; S860-E864 PolarHBondContact N-OE2 2.82Å; K861-E864 HydrophobicContact CB-CG 4.05Å; K861-E864 WeakPolarHBondContact CB-OE2 3.4Å; K861-E864 WeakPolarHBondContact CG-OE2 3.45Å; K861-E864 PolarHBondContact N-OE2 2.92Å; K861-E864 VanDerWaalsContact N-OE2 3.08Å; K861-E864 IonicContact NZ-OE1 2.71Å; K861-E864 PolarHBondContact O-N 3.21Å
865	C	90.7	Very high	83.7	Confident	6 Å²	6	57.4 Å²	57.4	4%	0.041	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	135.3	179	-163.4	0	0	0	0	112.6	C854 Q856 E867 L874 G877 C879	C854-C865 WeakPolarHBondContact CA-SG 3.43Å; C854-C865 HydrophobicContact CB-CB 3.86Å; C854-C865 WeakPolarHBondContact CB-SG 3.04Å; C854-C865 WeakPolarHBondContact SG-CA 3.3Å; C854-C865 WeakPolarHBondContact SG-CB 3.31Å; C854-C865 CovalentContact SG-SG 2.03Å; C854-C865 PolarHBondContact SG-SG 3.2Å; Q856-C865 PolarHBondContact O-SG 2.9Å; C865-E867 PolarHBondContact SG-O 2.01Å; C865-L874 HydrophobicContact CB-CD1 4.01Å; C865-G877 WeakPolarHBondContact CB-O 3.39Å; C865-G877 PolarHBondContact N-O 2.02Å; C865-G877 VanDerWaalsContact N-O 3.1Å; C865-C879 PolarHBondContact SG-SG 3.42Å
866	L	89.4	Confident	83.8	Confident	95 Å²	95	65.3 Å²	65.3	50%	0.497	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	-32.7	177.5	-59.8	180	0	0	0	112.7	Q856 T858 L874	Q856-L866 WeakPolarHBondContact O-CB 3.3Å; Q856-L866 PolarHBondContact O-N 2.69Å; T858-L866 HydrophobicContact CG2-CD1 3.75Å; T858-L866 HydrophobicContact CG2-CD2 4.25Å; T858-L866 HydrophobicContact CG2-CG 4.12Å; L866-L874 VanDerWaalsContact O-CD2 3.27Å; L866-L874 WeakPolarHBondContact O-CD2 3.08Å
867	E	87.4	Confident	83.7	Confident	77 Å²	77	60.9 Å²	60.9	36%	0.36	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	135	179.3	-170.3	176.7	-172.4	0	0	110.1	A855 Q856 C865	A855-E867 WeakPolarHBondContact CA-O 3.4Å; A855-E867 WeakPolarHBondContact CB-O 3.41Å; A855-E867 PolarHBondContact N-O 3.41Å; Q856-E867 HydrophobicContact CB-CB 4Å; Q856-E867 PolarHBondContact N-O 2.98Å; Q856-E867 PolarHBondContact O-N 3.09Å; C865-E867 PolarHBondContact SG-O 2.01Å
868	C	84.8	Confident	83.6	Confident	5 Å²	5	65.4 Å²	65.4	3%	0.034	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	158.6	179.9	-53.9	0	0	0	0	111.7	F872 L874 C879 S898	C868-F872 HydrophobicContact CB-CB 3.59Å; C868-L874 VanDerWaalsContact SG-CD1 3.55Å; C868-C879 WeakPolarHBondContact CA-SG 3.26Å; C868-C879 HydrophobicContact CB-CB 3.73Å; C868-C879 WeakPolarHBondContact CB-SG 3.04Å; C868-C879 WeakPolarHBondContact SG-CA 3.42Å; C868-C879 WeakPolarHBondContact SG-CB 3.46Å; C868-C879 CovalentContact SG-SG 2.03Å; C868-C879 PolarHBondContact SG-SG 2.88Å; C868-S898 WeakPolarHBondContact CA-OG 3.4Å; C868-S898 VanDerWaalsContact CB-OG 3.28Å; C868-S898 WeakPolarHBondContact CB-OG 3.13Å; C868-S898 PolarHBondContact N-OG 3.27Å; C868-S898 PolarHBondContact O-OG 3.35Å; C868-S898 VanDerWaalsContact O-OG 3.09Å
869	Y	76.6	Confident	83.5	Confident	64 Å²	64	61.9 Å²	61.9	25%	0.251	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-60.7	155.5	167.7	-71.6	-72.7	0	0	0	111.3	I836 G837 N853 C854 A855 G871 F872	I836-Y869 HydrophobicContact CG2-CE1 3.74Å; G837-Y869 WeakPolarHBondContact CA-OH 3.38Å; N853-Y869 WeakPolarHBondContact O-CD2 3.28Å; N853-Y869 PolarHBondContact O-N 3.13Å; C854-Y869 WeakPolarHBondContact O-CE2 2.92Å; A855-Y869 HydrophobicContact CB-CD1 4Å; A855-Y869 HydrophobicContact CB-CD2 4.4Å; A855-Y869 HydrophobicContact CB-CE1 4.05Å; A855-Y869 HydrophobicContact CB-CE2 4.43Å; A855-Y869 HydrophobicContact CB-CG 4.18Å; Y869-G871 PolarHBondContact O-N 3.22Å; Y869-F872 PolarHBondContact O-N 2.84Å; Y869-F872 VanDerWaalsContact O-N 3.11Å
870	S	68	Low	83.3	Confident	99 Å²	99	63.3 Å²	63.3	69%	0.692	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	133.1	176.7	55.8	0	0	0	0	111.8
871	G	67.3	Low	83	Confident	37 Å²	37	61.1 Å²	61.1	38%	0.381	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.4	-8.7	-176.3	0	0	0	0	0	114.4	Y869 G882	Y869-G871 PolarHBondContact O-N 3.22Å; G871-G882 VanDerWaalsContact O-CA 3.25Å; G871-G882 WeakPolarHBondContact O-CA 3.37Å; G871-G882 PolarHBondContact O-N 3.38Å
872	F	81.8	Confident	82.4	Confident	16 Å²	16	55.8 Å²	55.8	7%	0.07	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	138.3	176.3	-66.4	-98.1	0	0	0	111	N853 C868 Y869 C879 V880 D881 S898 L1256	N853-F872 HydrophobicContact CB-CD1 3.73Å; N853-F872 HydrophobicContact CB-CD2 4.19Å; N853-F872 HydrophobicContact CB-CE1 3.69Å; N853-F872 HydrophobicContact CB-CE2 4.18Å; N853-F872 HydrophobicContact CB-CG 4Å; N853-F872 HydrophobicContact CB-CZ 3.93Å; N853-F872 VanDerWaalsContact CG-CE1 3.41Å; N853-F872 VanDerWaalsContact CG-CZ 3.43Å; N853-F872 VanDerWaalsContact ND2-CE1 3.29Å; N853-F872 WeakPolarHBondContact ND2-CE1 3.17Å; C868-F872 HydrophobicContact CB-CB 3.59Å; Y869-F872 PolarHBondContact O-N 2.84Å; Y869-F872 VanDerWaalsContact O-N 3.11Å; F872-C879 HydrophobicContact CB-CB 4.19Å; F872-C879 HydrophobicContact CD1-CB 4.41Å; F872-V880 CarbonylContact C-O 3.52Å; F872-V880 VanDerWaalsContact CA-O 3.28Å; F872-V880 WeakPolarHBondContact CA-O 3.32Å; F872-D881 HydrophobicContact CD1-CB 4.38Å; F872-D881 HydrophobicContact CE1-CB 4.1Å; F872-S898 VanDerWaalsContact O-CA 3.27Å; F872-S898 WeakPolarHBondContact O-CA 3.05Å; F872-S898 WeakPolarHBondContact O-CB 3.31Å; F872-S898 PolarHBondContact O-OG 3.4Å; F872-L1256 HydrophobicContact CD2-CD1 4.43Å; F872-L1256 HydrophobicContact CE2-CD1 3.41Å; F872-L1256 VanDerWaalsContact CE2-CD1 3.41Å; F872-L1256 HydrophobicContact CE2-CG 3.86Å; F872-L1256 HydrophobicContact CZ-CD1 4.05Å; F872-L1256 HydrophobicContact CZ-CG 4.45Å
873	R	84.4	Confident	81.7	Confident	79 Å²	79	53.8 Å²	53.8	30%	0.298	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	133.6	174	-174.7	176.9	173.6	-122.1	-6.1	109.3	I875 V880 D886 G887 L895	R873-I875 HydrophobicContact CB-CG1 4.49Å; R873-I875 HydrophobicContact CG-CD1 4.3Å; R873-I875 HydrophobicContact CG-CG1 3.96Å; R873-V880 PolarHBondContact N-O 2.9Å; R873-V880 PolarHBondContact O-N 2.87Å; R873-D886 PolarHBondContact NH1-O 2.8Å; R873-G887 WeakPolarHBondContact CD-O 3.34Å; R873-L895 HydrophobicContact CB-CD1 4.07Å; R873-L895 HydrophobicContact CG-CD1 4.27Å
874	L	87.8	Confident	80.8	Confident	46 Å²	46	50.6 Å²	50.6	24%	0.241	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	117.5	175.5	-172.7	72.1	0	0	0	109.4	C865 L866 C868 S898	C865-L874 HydrophobicContact CB-CD1 4.01Å; L866-L874 VanDerWaalsContact O-CD2 3.27Å; L866-L874 WeakPolarHBondContact O-CD2 3.08Å; C868-L874 VanDerWaalsContact SG-CD1 3.55Å; L874-S898 PolarHBondContact N-O 3.42Å; L874-S898 VanDerWaalsContact N-O 3.08Å
875	I	84.1	Confident	79.8	Confident	32 Å²	32	52.3 Å²	52.3	16%	0.164	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	117.2	179.8	-54.4	176.9	0	0	0	107.7	R873 G877 K878 V880 D886	R873-I875 HydrophobicContact CB-CG1 4.49Å; R873-I875 HydrophobicContact CG-CD1 4.3Å; R873-I875 HydrophobicContact CG-CG1 3.96Å; I875-G877 VanDerWaalsContact C-N 3.29Å; I875-G877 PolarHBondContact O-N 3.23Å; I875-K878 PolarHBondContact N-O 2.91Å; I875-K878 PolarHBondContact O-N 2.9Å; I875-V880 HydrophobicContact CB-CG2 4.18Å; I875-V880 HydrophobicContact CD1-CB 4.02Å; I875-V880 HydrophobicContact CD1-CG1 4.45Å; I875-V880 HydrophobicContact CD1-CG2 4.03Å; I875-V880 HydrophobicContact CG1-CG2 4.35Å; I875-D886 WeakPolarHBondContact CD1-O 3.28Å
876	H	84.9	Confident	79	Confident	178 Å²	178	57.6 Å²	57.6	82%	0.824	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	45.9	-179.3	-51.5	122.9	0	0	0	113.7	K878	H876-K878 PolarHBondContact O-N 3.47Å
877	G	85	Confident	78.4	Confident	16 Å²	16	53.1 Å²	53.1	17%	0.165	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.4	0.6	-179.6	0	0	0	0	0	115.3	D863 C865 I875	D863-G877 CarbonylContact C-O 3.53Å; D863-G877 WeakPolarHBondContact CA-O 3.24Å; D863-G877 WeakPolarHBondContact O-CA 3.42Å; C865-G877 WeakPolarHBondContact CB-O 3.39Å; C865-G877 PolarHBondContact N-O 2.02Å; C865-G877 VanDerWaalsContact N-O 3.1Å; I875-G877 VanDerWaalsContact C-N 3.29Å; I875-G877 PolarHBondContact O-N 3.23Å
878	K	86.6	Confident	77.8	Confident	106 Å²	106	57.2 Å²	57.2	46%	0.461	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	142.4	177	-67	177.5	179.6	176.6	0	111.3	S862 D863 I875 H876 V880	S862-K878 WeakPolarHBondContact O-CA 3.19Å; S862-K878 WeakPolarHBondContact O-CG 3.06Å; D863-K878 HydrophobicContact CB-CG 4.37Å; I875-K878 PolarHBondContact N-O 2.91Å; I875-K878 PolarHBondContact O-N 2.9Å; H876-K878 PolarHBondContact O-N 3.47Å; K878-V880 PolarHBondContact O-N 3.26Å
879	C	85.1	Confident	77.4	Confident	22 Å²	22	58.5 Å²	58.5	15%	0.149	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	103.5	175.6	-66.4	0	0	0	0	111.2	N853 C865 C868 F872	N853-C879 HydrophobicContact CB-CB 4Å; N853-C879 PolarHBondContact O-SG 3.3Å; C865-C879 PolarHBondContact SG-SG 3.42Å; C868-C879 WeakPolarHBondContact CA-SG 3.26Å; C868-C879 HydrophobicContact CB-CB 3.73Å; C868-C879 WeakPolarHBondContact CB-SG 3.04Å; C868-C879 WeakPolarHBondContact SG-CA 3.42Å; C868-C879 WeakPolarHBondContact SG-CB 3.46Å; C868-C879 CovalentContact SG-SG 2.03Å; C868-C879 PolarHBondContact SG-SG 2.88Å; F872-C879 HydrophobicContact CB-CB 4.19Å; F872-C879 HydrophobicContact CD1-CB 4.41Å
880	V	84	Confident	77.3	Confident	38 Å²	38	63.4 Å²	63.4	23%	0.23	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	136.3	179.6	-175.9	0	0	0	0	109.1	F872 R873 I875 K878 G882 S884 D886	F872-V880 CarbonylContact C-O 3.52Å; F872-V880 VanDerWaalsContact CA-O 3.28Å; F872-V880 WeakPolarHBondContact CA-O 3.32Å; R873-V880 PolarHBondContact N-O 2.9Å; R873-V880 PolarHBondContact O-N 2.87Å; I875-V880 HydrophobicContact CB-CG2 4.18Å; I875-V880 HydrophobicContact CD1-CB 4.02Å; I875-V880 HydrophobicContact CD1-CG1 4.45Å; I875-V880 HydrophobicContact CD1-CG2 4.03Å; I875-V880 HydrophobicContact CG1-CG2 4.35Å; K878-V880 PolarHBondContact O-N 3.26Å; V880-G882 PolarHBondContact O-N 3.02Å; V880-S884 WeakPolarHBondContact CG1-OG 3.29Å; V880-D886 HydrophobicContact CG1-CB 4.27Å
881	D	77	Confident	77.4	Confident	28 Å²	28	64.5 Å²	64.5	15%	0.15	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.9	119.9	177.5	176.7	-2.7	0	0	0	110.8	F872 T883 S884 G887 R1255	F872-D881 HydrophobicContact CD1-CB 4.38Å; F872-D881 HydrophobicContact CE1-CB 4.1Å; D881-T883 PolarHBondContact O-N 3.44Å; D881-T883 WeakPolarHBondContact OD1-CB 3.34Å; D881-T883 WeakPolarHBondContact OD1-CG2 3.46Å; D881-T883 PolarHBondContact OD1-N 2.96Å; D881-T883 PolarHBondContact OD1-OG1 3.08Å; D881-T883 PolarHBondContact OD2-OG1 2.82Å; D881-S884 WeakPolarHBondContact O-CB 3.49Å; D881-S884 PolarHBondContact O-N 3.36Å; D881-S884 PolarHBondContact O-OG 2.85Å; D881-G887 WeakPolarHBondContact O-CA 3.39Å; D881-R1255 WeakPolarHBondContact OD2-CD 3Å; D881-R1255 VanDerWaalsContact OD2-CG 3.26Å; D881-R1255 WeakPolarHBondContact OD2-CG 3.38Å; D881-R1255 IonicContact OD2-CZ 2.89Å; D881-R1255 IonicContact OD2-NE 2.73Å; D881-R1255 PolarHBondContact OD2-NE 3.38Å
882	G	71.4	Confident	77.5	Confident	14 Å²	14	63.7 Å²	63.7	14%	0.144	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-10.2	-177.1	0	0	0	0	0	114.3	G871 V880 G887 R888	G871-G882 VanDerWaalsContact O-CA 3.25Å; G871-G882 WeakPolarHBondContact O-CA 3.37Å; G871-G882 PolarHBondContact O-N 3.38Å; V880-G882 PolarHBondContact O-N 3.02Å; G882-G887 CarbonylContact O-C 3.58Å; G882-R888 WeakPolarHBondContact O-CA 3.42Å; G882-R888 VanDerWaalsContact O-CG 3.31Å; G882-R888 WeakPolarHBondContact O-CG 3.31Å; G882-R888 PolarHBondContact O-N 3.38Å
883	T	64.2	Low	77.3	Confident	24 Å²	24	66.1 Å²	66.1	15%	0.147	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-15.5	174.3	71.9	0	0	0	0	113.3	D881 R888 T1253	D881-T883 PolarHBondContact O-N 3.44Å; D881-T883 WeakPolarHBondContact OD1-CB 3.34Å; D881-T883 WeakPolarHBondContact OD1-CG2 3.46Å; D881-T883 PolarHBondContact OD1-N 2.96Å; D881-T883 PolarHBondContact OD1-OG1 3.08Å; D881-T883 PolarHBondContact OD2-OG1 2.82Å; T883-R888 PolarHBondContact O-NE 2.79Å; T883-R888 PolarHBondContact O-NH2 2.98Å; T883-T1253 WeakPolarHBondContact CG2-O 3.33Å
884	S	66.1	Low	76.8	Confident	25 Å²	25	63.5 Å²	63.5	18%	0.175	35%	0.346	C	S	.	.	S	Bend	trans	-69.6	160	176.1	83.8	0	0	0	0	111	V880 D881 D886 G887 R888	V880-S884 WeakPolarHBondContact CG1-OG 3.29Å; D881-S884 WeakPolarHBondContact O-CB 3.49Å; D881-S884 PolarHBondContact O-N 3.36Å; D881-S884 PolarHBondContact O-OG 2.85Å; S884-D886 PolarHBondContact O-N 3.2Å; S884-D886 PolarHBondContact OG-N 2.71Å; S884-G887 PolarHBondContact O-N 3.36Å; S884-G887 VanDerWaalsContact O-N 3.14Å; S884-G887 PolarHBondContact OG-N 3.09Å; S884-R888 WeakPolarHBondContact O-CG 3.18Å; S884-R888 PolarHBondContact O-N 2.94Å; S884-R888 VanDerWaalsContact O-N 3.08Å
885	A	69.1	Low	76.1	Confident	91 Å²	91	64.2 Å²	64.2	75%	0.752	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-40.2	177	0	0	0	0	0	111.7
886	D	74.5	Confident	75.5	Confident	118 Å²	118	67 Å²	67	63%	0.631	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-28.7	-179.4	-53.2	-41	0	0	0	113.5	R873 I875 V880 S884	R873-D886 PolarHBondContact NH1-O 2.8Å; I875-D886 WeakPolarHBondContact CD1-O 3.28Å; V880-D886 HydrophobicContact CG1-CB 4.27Å; S884-D886 PolarHBondContact O-N 3.2Å; S884-D886 PolarHBondContact OG-N 2.71Å
887	G	76	Confident	74.8	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-20.3	-176.1	0	0	0	0	0	114.8	R873 D881 G882 S884	R873-G887 WeakPolarHBondContact CD-O 3.34Å; D881-G887 WeakPolarHBondContact O-CA 3.39Å; G882-G887 CarbonylContact O-C 3.58Å; S884-G887 PolarHBondContact O-N 3.36Å; S884-G887 VanDerWaalsContact O-N 3.14Å; S884-G887 PolarHBondContact OG-N 3.09Å
888	R	75.8	Confident	74.4	Confident	164 Å²	164	64.8 Å²	64.8	62%	0.619	35%	0.347	S	S	*	.	S	Bend	trans	-66	138.8	-179	-77.4	175.6	-158.4	-169	4.6	111.9	G882 T883 S884	G882-R888 WeakPolarHBondContact O-CA 3.42Å; G882-R888 VanDerWaalsContact O-CG 3.31Å; G882-R888 WeakPolarHBondContact O-CG 3.31Å; G882-R888 PolarHBondContact O-N 3.38Å; T883-R888 PolarHBondContact O-NE 2.79Å; T883-R888 PolarHBondContact O-NH2 2.98Å; S884-R888 WeakPolarHBondContact O-CG 3.18Å; S884-R888 PolarHBondContact O-N 2.94Å; S884-R888 VanDerWaalsContact O-N 3.08Å
889	C	76.3	Confident	74.2	Confident	32 Å²	32	66.7 Å²	66.7	22%	0.216	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-72.8	148.3	168.9	-62.9	0	0	0	0	110.6	Q893 C900	C889-Q893 HydrophobicContact CB-CB 3.95Å; C889-C900 WeakPolarHBondContact CA-SG 3.48Å; C889-C900 HydrophobicContact CB-CB 3.76Å; C889-C900 WeakPolarHBondContact CB-SG 3.33Å; C889-C900 VanDerWaalsContact SG-CA 3.5Å; C889-C900 WeakPolarHBondContact SG-CB 3.48Å; C889-C900 CovalentContact SG-SG 2.04Å; C889-C900 PolarHBondContact SG-SG 2.92Å
890	K	74.2	Confident	74	Confident	166 Å²	166	67.2 Å²	67.2	72%	0.722	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-64.5	154.4	177	-63.7	-177.6	178.9	-176.1	0	110.3	G892 Q893	K890-G892 PolarHBondContact O-N 3.42Å; K890-Q893 WeakPolarHBondContact O-CB 3.29Å; K890-Q893 PolarHBondContact O-N 2.99Å
891	S	69	Low	73.8	Confident	122 Å²	122	67.9 Å²	67.9	85%	0.853	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.5	130.5	173.7	-62.3	0	0	0	0	111.3
892	G	70.7	Confident	74	Confident	20 Å²	20	71.7 Å²	71.7	21%	0.206	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.1	2	-174	0	0	0	0	0	115	K890 C903 K909	K890-G892 PolarHBondContact O-N 3.42Å; G892-C903 PolarHBondContact O-N 2.97Å; G892-C903 PolarHBondContact O-SG 2.91Å; G892-K909 WeakPolarHBondContact CA-O 3.04Å; G892-K909 PolarHBondContact N-O 2.84Å
893	Q	78.1	Confident	74.2	Confident	67 Å²	67	72 Å²	72	31%	0.313	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	152.7	174.3	-57.7	-174.5	-35.9	0	0	111.1	C889 K890 C900 V901 N902	C889-Q893 HydrophobicContact CB-CB 3.95Å; K890-Q893 WeakPolarHBondContact O-CB 3.29Å; K890-Q893 PolarHBondContact O-N 2.99Å; Q893-C900 HydrophobicContact CB-CB 4.27Å; Q893-V901 CarbonylContact C-O 3.54Å; Q893-V901 WeakPolarHBondContact CA-O 3.42Å; Q893-N902 WeakPolarHBondContact CG-OD1 3.39Å; Q893-N902 PolarHBondContact NE2-OD1 3.17Å
894	Y	73.2	Confident	74.8	Confident	25 Å²	25	74.6 Å²	74.6	10%	0.098	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	152.5	174.2	72.3	-78.5	0	0	0	110.7	K896 C900 V901 S915	Y894-K896 HydrophobicContact CD2-CB 4.22Å; Y894-K896 HydrophobicContact CE2-CB 3.66Å; Y894-K896 HydrophobicContact CE2-CD 4.02Å; Y894-K896 HydrophobicContact CE2-CG 4.25Å; Y894-K896 PolarHBondContact O-N 2.81Å; Y894-K896 WeakPolarHBondContact OH-CD 3.35Å; Y894-C900 WeakPolarHBondContact O-CA 3.38Å; Y894-V901 HydrophobicContact CD1-CB 4.4Å; Y894-V901 WeakPolarHBondContact CD1-O 3.3Å; Y894-V901 HydrophobicContact CE1-CB 3.83Å; Y894-V901 HydrophobicContact CE1-CG1 3.94Å; Y894-V901 PolarHBondContact N-O 2.93Å; Y894-V901 PolarHBondContact O-N 2.85Å; Y894-S915 WeakPolarHBondContact OH-CB 3.16Å; Y894-S915 PolarHBondContact OH-N 3.44Å
895	L	72.1	Confident	75.3	Confident	61 Å²	61	79 Å²	79	32%	0.319	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	110.6	-178.6	-173.2	67.2	0	0	0	110.2	R873	R873-L895 HydrophobicContact CB-CD1 4.07Å; R873-L895 HydrophobicContact CG-CD1 4.27Å
896	K	72.5	Confident	75.7	Confident	91 Å²	91	75.3 Å²	75.3	40%	0.396	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	121.3	175.9	-175.3	176.5	-179.9	179.2	0	109.8	Y894 S898 K899 V901	Y894-K896 HydrophobicContact CD2-CB 4.22Å; Y894-K896 HydrophobicContact CE2-CB 3.66Å; Y894-K896 HydrophobicContact CE2-CD 4.02Å; Y894-K896 HydrophobicContact CE2-CG 4.25Å; Y894-K896 PolarHBondContact O-N 2.81Å; Y894-K896 WeakPolarHBondContact OH-CD 3.35Å; K896-S898 PolarHBondContact O-N 2.86Å; K896-K899 PolarHBondContact N-O 2.82Å; K896-K899 PolarHBondContact O-N 3.34Å; K896-V901 HydrophobicContact CB-CG2 3.89Å; K896-V901 HydrophobicContact CD-CG2 4.44Å
897	H	69.5	Low	75.9	Confident	140 Å²	140	70.2 Å²	70.2	65%	0.648	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.8	57.4	178.2	-51	127.4	0	0	0	112.9	K899	H897-K899 PolarHBondContact O-N 3.26Å
898	S	78	Confident	75.7	Confident	7 Å²	7	71.5 Å²	71.5	5%	0.049	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.6	2.4	-179	-44.6	0	0	0	0	117.4	C868 F872 L874 K896	C868-S898 WeakPolarHBondContact CA-OG 3.4Å; C868-S898 VanDerWaalsContact CB-OG 3.28Å; C868-S898 WeakPolarHBondContact CB-OG 3.13Å; C868-S898 PolarHBondContact N-OG 3.27Å; C868-S898 PolarHBondContact O-OG 3.35Å; C868-S898 VanDerWaalsContact O-OG 3.09Å; F872-S898 VanDerWaalsContact O-CA 3.27Å; F872-S898 WeakPolarHBondContact O-CA 3.05Å; F872-S898 WeakPolarHBondContact O-CB 3.31Å; F872-S898 PolarHBondContact O-OG 3.4Å; L874-S898 PolarHBondContact N-O 3.42Å; L874-S898 VanDerWaalsContact N-O 3.08Å; K896-S898 PolarHBondContact O-N 2.86Å
899	K	81.4	Confident	75.1	Confident	145 Å²	145	71.9 Å²	71.9	63%	0.63	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.8	147.1	179.7	-64.9	-179	-177.7	177	0	111.2	K896 H897	K896-K899 PolarHBondContact N-O 2.82Å; K896-K899 PolarHBondContact O-N 3.34Å; H897-K899 PolarHBondContact O-N 3.26Å
900	C	81.9	Confident	74.5	Confident	33 Å²	33	74.2 Å²	74.2	22%	0.223	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	126.9	173.7	-62.9	0	0	0	0	109.6	C889 Q893 Y894	C889-C900 WeakPolarHBondContact CA-SG 3.48Å; C889-C900 HydrophobicContact CB-CB 3.76Å; C889-C900 WeakPolarHBondContact CB-SG 3.33Å; C889-C900 VanDerWaalsContact SG-CA 3.5Å; C889-C900 WeakPolarHBondContact SG-CB 3.48Å; C889-C900 CovalentContact SG-SG 2.04Å; C889-C900 PolarHBondContact SG-SG 2.92Å; Q893-C900 HydrophobicContact CB-CB 4.27Å; Y894-C900 WeakPolarHBondContact O-CA 3.38Å
901	V	79.6	Confident	74	Confident	52 Å²	52	67 Å²	67	32%	0.315	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	142.1	-178.5	-177.3	0	0	0	0	109.2	Q893 Y894 K896	Q893-V901 CarbonylContact C-O 3.54Å; Q893-V901 WeakPolarHBondContact CA-O 3.42Å; Y894-V901 HydrophobicContact CD1-CB 4.4Å; Y894-V901 WeakPolarHBondContact CD1-O 3.3Å; Y894-V901 HydrophobicContact CE1-CB 3.83Å; Y894-V901 HydrophobicContact CE1-CG1 3.94Å; Y894-V901 PolarHBondContact N-O 2.93Å; Y894-V901 PolarHBondContact O-N 2.85Å; K896-V901 HydrophobicContact CB-CG2 3.89Å; K896-V901 HydrophobicContact CD-CG2 4.44Å
902	N	80.2	Confident	74.1	Confident	108 Å²	108	61.9 Å²	61.9	58%	0.578	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.1	145.8	179.9	-63.7	-24.3	0	0	0	111.8	Q893	Q893-N902 WeakPolarHBondContact CG-OD1 3.39Å; Q893-N902 PolarHBondContact NE2-OD1 3.17Å
903	C	75.2	Confident	73.6	Confident	22 Å²	22	63.8 Å²	63.8	15%	0.149	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-65.4	161.3	168.8	-61.7	0	0	0	0	112.4	G892 C907 C912	G892-C903 PolarHBondContact O-N 2.97Å; G892-C903 PolarHBondContact O-SG 2.91Å; C903-C907 HydrophobicContact CB-CB 4.5Å; C903-C912 WeakPolarHBondContact CA-SG 3.45Å; C903-C912 HydrophobicContact CB-CB 3.63Å; C903-C912 WeakPolarHBondContact CB-SG 3.33Å; C903-C912 WeakPolarHBondContact SG-CB 3.42Å; C903-C912 CovalentContact SG-SG 2.02Å; C903-C912 PolarHBondContact SG-SG 3.1Å
904	H	77.6	Confident	72.8	Confident	77 Å²	77	63 Å²	63	36%	0.356	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-54.5	142.2	171.1	-158.8	-111.6	0	0	0	110.9	S906 C907 S915	H904-S906 WeakPolarHBondContact ND1-CB 3.46Å; H904-S906 PolarHBondContact ND1-N 3.17Å; H904-S906 PolarHBondContact ND1-OG 3.21Å; H904-S906 PolarHBondContact O-N 3.46Å; H904-S906 VanDerWaalsContact O-N 3.09Å; H904-C907 VanDerWaalsContact CB-SG 3.57Å; H904-C907 WeakPolarHBondContact O-CB 3.43Å; H904-C907 PolarHBondContact O-N 3.37Å; H904-S915 WeakPolarHBondContact CA-O 3.13Å; H904-S915 WeakPolarHBondContact CB-O 3.42Å; H904-S915 PolarHBondContact N-O 3.46Å; H904-S915 VanDerWaalsContact N-O 3.17Å
905	P	77	Confident	72.3	Confident	119 Å²	119	63.1 Å²	63.1	77%	0.773	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-25.4	178.8	-24.7	33.7	0	0	0	114.6	C907	P905-C907 VanDerWaalsContact C-N 3.33Å
906	S	76.6	Confident	71.9	Confident	13 Å²	13	64.8 Å²	64.8	9%	0.091	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-17.6	177.9	71.5	0	0	0	0	113.8	H904 C918 P922 C933	H904-S906 WeakPolarHBondContact ND1-CB 3.46Å; H904-S906 PolarHBondContact ND1-N 3.17Å; H904-S906 PolarHBondContact ND1-OG 3.21Å; H904-S906 PolarHBondContact O-N 3.46Å; H904-S906 VanDerWaalsContact O-N 3.09Å; S906-C918 PolarHBondContact OG-SG 3.35Å; S906-P922 WeakPolarHBondContact O-CD 2.98Å; S906-C933 WeakPolarHBondContact CB-O 3.04Å; S906-C933 WeakPolarHBondContact O-CB 3.28Å
907	C	78.1	Confident	71.5	Confident	10 Å²	10	63.9 Å²	63.9	7%	0.068	34%	0.339	C	S	.	.	S	Bend	trans	-79.7	152.4	-176.8	-54.8	0	0	0	0	110.7	C903 H904 P905 C918	C903-C907 HydrophobicContact CB-CB 4.5Å; H904-C907 VanDerWaalsContact CB-SG 3.57Å; H904-C907 WeakPolarHBondContact O-CB 3.43Å; H904-C907 PolarHBondContact O-N 3.37Å; P905-C907 VanDerWaalsContact C-N 3.33Å; C907-C918 WeakPolarHBondContact CA-SG 3.4Å; C907-C918 HydrophobicContact CB-CB 3.81Å; C907-C918 WeakPolarHBondContact CB-SG 3.1Å; C907-C918 WeakPolarHBondContact SG-CA 3.48Å; C907-C918 WeakPolarHBondContact SG-CB 3.24Å; C907-C918 CovalentContact SG-SG 2.04Å; C907-C918 PolarHBondContact SG-SG 2.76Å
908	D	71.9	Confident	71.7	Confident	27 Å²	27	57.5 Å²	57.5	14%	0.144	31%	0.31	C	S	.	.			trans	-64.6	141.2	170.7	-176.6	26.4	0	0	0	110.7	T910 T911 W920 K964	D908-T910 PolarHBondContact O-N 3.29Å; D908-T910 PolarHBondContact OD2-OG1 3.49Å; D908-T911 PolarHBondContact O-N 3.1Å; D908-W920 PolarHBondContact N-O 3.41Å; D908-K964 IonicContact OD2-NZ 2.66Å; D908-K964 PolarHBondContact OD2-NZ 2.95Å
909	K	64.9	Low	71.4	Confident	172 Å²	172	57.9 Å²	57.9	75%	0.748	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-15.8	-173.9	-72	-173.2	178.9	-178.8	0	113.6	G892	G892-K909 WeakPolarHBondContact CA-O 3.04Å; G892-K909 PolarHBondContact N-O 2.84Å
910	T	62.4	Low	71	Confident	81 Å²	81	51.6 Å²	51.6	50%	0.497	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-17.8	-172.4	56.5	0	0	0	0	115.1	D908 K964	D908-T910 PolarHBondContact O-N 3.29Å; D908-T910 PolarHBondContact OD2-OG1 3.49Å; T910-K964 PolarHBondContact OG1-NZ 3.08Å
911	T	64.3	Low	70.9	Confident	15 Å²	15	50.8 Å²	50.8	9%	0.092	28%	0.278	C	S	.	.			trans	-161.1	114.2	-175	53.9	0	0	0	0	114.3	D908 F951 M1250	D908-T911 PolarHBondContact O-N 3.1Å; T911-F951 HydrophobicContact CG2-CE2 4.44Å; T911-F951 HydrophobicContact CG2-CZ 4.08Å; T911-M1250 HydrophobicContact CG2-CE 3.69Å
912	C	70.1	Confident	70.9	Confident	15 Å²	15	49 Å²	49	10%	0.101	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	151.7	161.3	71.5	0	0	0	0	110.8	C903	C903-C912 WeakPolarHBondContact CA-SG 3.45Å; C903-C912 HydrophobicContact CB-CB 3.63Å; C903-C912 WeakPolarHBondContact CB-SG 3.33Å; C903-C912 WeakPolarHBondContact SG-CB 3.42Å; C903-C912 CovalentContact SG-SG 2.02Å; C903-C912 PolarHBondContact SG-SG 3.1Å
913	I	60.6	Low	70.6	Confident	60 Å²	60	49.3 Å²	49.3	31%	0.308	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	-41.8	177.1	-53.8	167.8	0	0	0	110.2	Q917 I919 F1239	I913-Q917 HydrophobicContact CB-CB 4.38Å; I913-Q917 PolarHBondContact N-O 3.33Å; I913-I919 HydrophobicContact CD1-CD1 4.36Å; I913-I919 HydrophobicContact CD1-CG1 3.95Å; I913-I919 HydrophobicContact CG1-CD1 3.53Å; I913-I919 HydrophobicContact CG1-CG1 3.5Å; I913-I919 VanDerWaalsContact CG1-CG1 3.5Å; I913-F1239 HydrophobicContact CD1-CE2 3.57Å; I913-F1239 HydrophobicContact CD1-CZ 3.93Å; I913-F1239 HydrophobicContact CG1-CE2 4.15Å; I913-F1239 HydrophobicContact CG1-CZ 4.23Å
914	T	62.4	Low	70.8	Confident	49 Å²	49	54.5 Å²	54.5	30%	0.301	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	179.7	177.7	65.4	0	0	0	0	109.5	D916 Q917	T914-D916 PolarHBondContact O-N 2.93Å; T914-D916 VanDerWaalsContact O-N 3.09Å; T914-Q917 PolarHBondContact O-N 2.96Å; T914-Q917 WeakPolarHBondContact OG1-CB 3.41Å; T914-Q917 WeakPolarHBondContact OG1-CG 3.28Å
915	S	61.9	Low	71.2	Confident	29 Å²	29	52.3 Å²	52.3	20%	0.203	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-23.4	179.7	50.8	0	0	0	0	113.7	Y894 H904	Y894-S915 WeakPolarHBondContact OH-CB 3.16Å; Y894-S915 PolarHBondContact OH-N 3.44Å; H904-S915 WeakPolarHBondContact CA-O 3.13Å; H904-S915 WeakPolarHBondContact CB-O 3.42Å; H904-S915 PolarHBondContact N-O 3.46Å; H904-S915 VanDerWaalsContact N-O 3.17Å
916	D	62.8	Low	71.6	Confident	96 Å²	96	48.5 Å²	48.5	51%	0.513	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.9	9.3	-168.8	-31.7	-34.1	0	0	0	112.1	T914	T914-D916 PolarHBondContact O-N 2.93Å; T914-D916 VanDerWaalsContact O-N 3.09Å
917	Q	64.9	Low	72	Confident	72 Å²	72	48.1 Å²	48.1	34%	0.336	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	93.3	-179	-67.9	-172.9	-16.1	0	0	110.7	I913 T914	I913-Q917 HydrophobicContact CB-CB 4.38Å; I913-Q917 PolarHBondContact N-O 3.33Å; T914-Q917 PolarHBondContact O-N 2.96Å; T914-Q917 WeakPolarHBondContact OG1-CB 3.41Å; T914-Q917 WeakPolarHBondContact OG1-CG 3.28Å
918	C	74.2	Confident	72.3	Confident	5 Å²	5	48.7 Å²	48.7	3%	0.034	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	131.8	169.8	-56	0	0	0	0	109.4	S906 C907 F928 S931	S906-C918 PolarHBondContact OG-SG 3.35Å; C907-C918 WeakPolarHBondContact CA-SG 3.4Å; C907-C918 HydrophobicContact CB-CB 3.81Å; C907-C918 WeakPolarHBondContact CB-SG 3.1Å; C907-C918 WeakPolarHBondContact SG-CA 3.48Å; C907-C918 WeakPolarHBondContact SG-CB 3.24Å; C907-C918 CovalentContact SG-SG 2.04Å; C907-C918 PolarHBondContact SG-SG 2.76Å; C918-F928 HydrophobicContact CB-CE2 4.39Å; C918-F928 VanDerWaalsContact O-CE2 3.29Å; C918-F928 WeakPolarHBondContact O-CE2 3.44Å; C918-S931 WeakPolarHBondContact CB-O 3.31Å; C918-S931 PolarHBondContact N-O 3.49Å
919	I	70.8	Confident	72.8	Confident	15 Å²	15	49.8 Å²	49.8	8%	0.077	26%	0.258	C	S	.	.	S	Bend	trans	-82.7	-36.7	167.4	-60.6	168.2	0	0	0	108.9	I913 F1239 M1250	I913-I919 HydrophobicContact CD1-CD1 4.36Å; I913-I919 HydrophobicContact CD1-CG1 3.95Å; I913-I919 HydrophobicContact CG1-CD1 3.53Å; I913-I919 HydrophobicContact CG1-CG1 3.5Å; I913-I919 VanDerWaalsContact CG1-CG1 3.5Å; I919-F1239 HydrophobicContact CD1-CE1 4.41Å; I919-F1239 HydrophobicContact CD1-CZ 3.79Å; I919-F1239 HydrophobicContact CG1-CZ 3.99Å; I919-F1239 HydrophobicContact CG2-CE1 4.23Å; I919-F1239 HydrophobicContact CG2-CZ 4.15Å; I919-M1250 HydrophobicContact CD1-CE 4.44Å; I919-M1250 HydrophobicContact CD1-SD 3.55Å; I919-M1250 VanDerWaalsContact CD1-SD 3.55Å
920	W	74.6	Confident	73.2	Confident	14 Å²	14	47.8 Å²	47.8	5%	0.053	26%	0.255	C	S	.	.	S	Bend	trans	-144.7	150.8	-174.4	-118.2	-178.9	0	0	0	111.7	D908 I947 S949 I967	D908-W920 PolarHBondContact N-O 3.41Å; W920-I947 HydrophobicContact CH2-CB 4.34Å; W920-I947 HydrophobicContact CH2-CG2 4.08Å; W920-I947 WeakPolarHBondContact CH2-O 3.31Å; W920-I947 HydrophobicContact CZ3-CG2 4.41Å; W920-S949 PolarHBondContact NE1-OG 3.41Å; W920-I967 HydrophobicContact CD2-CD1 3.45Å; W920-I967 VanDerWaalsContact CD2-CD1 3.45Å; W920-I967 HydrophobicContact CD2-CG1 4.15Å; W920-I967 HydrophobicContact CE3-CB 4.19Å; W920-I967 HydrophobicContact CE3-CD1 2.96Å; W920-I967 HydrophobicContact CE3-CG1 3.67Å; W920-I967 HydrophobicContact CG-CD1 4.24Å; W920-I967 HydrophobicContact CH2-CB 3.42Å; W920-I967 VanDerWaalsContact CH2-CB 3.42Å; W920-I967 HydrophobicContact CH2-CD1 3.6Å; W920-I967 HydrophobicContact CH2-CG1 3.23Å; W920-I967 HydrophobicContact CZ2-CB 4.43Å; W920-I967 HydrophobicContact CZ2-CD1 4.08Å; W920-I967 HydrophobicContact CZ2-CG1 3.82Å; W920-I967 HydrophobicContact CZ3-CB 3.31Å; W920-I967 HydrophobicContact CZ3-CD1 3.05Å; W920-I967 HydrophobicContact CZ3-CG1 3.19Å; W920-I967 HydrophobicContact CZ3-CG2 4Å
921	C	79.2	Confident	73.8	Confident	15 Å²	15	45.3 Å²	45.3	10%	0.101	24%	0.241	C	C	.	.			trans	-104.5	145.4	-179.6	-48.7	0	0	0	0	112.1	L925 C933 I967	C921-L925 WeakPolarHBondContact CB-O 3.49Å; C921-C933 WeakPolarHBondContact CA-SG 3.14Å; C921-C933 HydrophobicContact CB-CB 3.4Å; C921-C933 VanDerWaalsContact CB-CB 3.4Å; C921-C933 WeakPolarHBondContact CB-SG 3.38Å; C921-C933 WeakPolarHBondContact SG-CB 2.96Å; C921-C933 CovalentContact SG-SG 2.02Å; C921-C933 PolarHBondContact SG-SG 3.44Å; C921-I967 HydrophobicContact CB-CD1 3.48Å; C921-I967 VanDerWaalsContact CB-CD1 3.48Å
922	P	78.6	Confident	74.5	Confident	16 Å²	16	46.5 Å²	46.5	10%	0.104	25%	0.249	C	C	.	.			trans	-72.6	161	173.6	33.3	-35.9	0	0	0	110.8	S906 H924 L925	S906-P922 WeakPolarHBondContact O-CD 2.98Å; P922-H924 VanDerWaalsContact CB-CE1 3.44Å; P922-H924 WeakPolarHBondContact CB-CE1 3.31Å; P922-H924 WeakPolarHBondContact CG-CE1 3.42Å; P922-H924 PolarHBondContact O-N 3.32Å; P922-L925 HydrophobicContact CG-CB 4.17Å; P922-L925 HydrophobicContact CG-CD1 4.12Å; P922-L925 HydrophobicContact CG-CG 4.36Å; P922-L925 CarbonylContact O-C 3.41Å; P922-L925 PolarHBondContact O-N 3.12Å
923	I	74.8	Confident	75.2	Confident	114 Å²	114	46.1 Å²	46.1	59%	0.585	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-33.9	-175.1	-62	170.3	0	0	0	112.7	L925	I923-L925 VanDerWaalsContact C-N 3.3Å; I923-L925 PolarHBondContact O-N 3.13Å
924	H	79.7	Confident	76.4	Confident	130 Å²	130	44.9 Å²	44.9	60%	0.602	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-7.3	-178.7	63.2	-81.3	0	0	0	114.3	P922	P922-H924 VanDerWaalsContact CB-CE1 3.44Å; P922-H924 WeakPolarHBondContact CB-CE1 3.31Å; P922-H924 WeakPolarHBondContact CG-CE1 3.42Å; P922-H924 PolarHBondContact O-N 3.32Å
925	L	86.2	Confident	77.5	Confident	31 Å²	31	50.5 Å²	50.5	16%	0.162	26%	0.262	C	S	.	.			trans	-132.8	65.5	178.6	-61	170.5	0	0	0	110.4	C921 P922 I923 N927 C933 T934 K935	C921-L925 WeakPolarHBondContact CB-O 3.49Å; P922-L925 HydrophobicContact CG-CB 4.17Å; P922-L925 HydrophobicContact CG-CD1 4.12Å; P922-L925 HydrophobicContact CG-CG 4.36Å; P922-L925 CarbonylContact O-C 3.41Å; P922-L925 PolarHBondContact O-N 3.12Å; I923-L925 VanDerWaalsContact C-N 3.3Å; I923-L925 PolarHBondContact O-N 3.13Å; L925-N927 PolarHBondContact O-N 3.23Å; L925-N927 VanDerWaalsContact O-N 3.14Å; L925-C933 HydrophobicContact CB-CB 3.95Å; L925-C933 HydrophobicContact CD1-CB 4.48Å; L925-T934 CarbonylContact C-O 3.53Å; L925-T934 VanDerWaalsContact C-O 3.31Å; L925-T934 WeakPolarHBondContact CA-O 3.42Å; L925-K935 HydrophobicContact CD2-CB 4.03Å
926	P	84.2	Confident	78.6	Confident	39 Å²	39	53 Å²	53	25%	0.253	28%	0.279	S	S	.	.			trans	-74.4	-5.3	-166.4	31	-37	0	0	0	115	I967 Q968	P926-I967 WeakPolarHBondContact O-CG2 3.44Å; P926-Q968 PolarHBondContact O-N 2.65Å
927	N	84.9	Confident	79.7	Confident	6 Å²	6	49.4 Å²	49.4	3%	0.032	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	126.1	-176	-63.2	-81.9	0	0	0	111.1	L925 C933 T934 K935 S943 Q968	L925-N927 PolarHBondContact O-N 3.23Å; L925-N927 VanDerWaalsContact O-N 3.14Å; N927-C933 CarbonylContact O-C 3.59Å; N927-C933 WeakPolarHBondContact O-CA 3.25Å; N927-T934 WeakPolarHBondContact CB-O 3.48Å; N927-T934 PolarHBondContact N-O 3.29Å; N927-T934 PolarHBondContact O-N 2.81Å; N927-K935 PolarHBondContact ND2-O 3.34Å; N927-S943 PolarHBondContact OD1-OG 3.28Å; N927-Q968 CarbonylContact C-O 3.57Å; N927-Q968 WeakPolarHBondContact CA-O 3.48Å
928	F	84.1	Confident	80.8	Confident	22 Å²	22	48.3 Å²	48.3	10%	0.096	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	115.5	176	-170	-96.4	0	0	0	110.5	C918 I967 Q968 C970 P1221	C918-F928 HydrophobicContact CB-CE2 4.39Å; C918-F928 VanDerWaalsContact O-CE2 3.29Å; C918-F928 WeakPolarHBondContact O-CE2 3.44Å; F928-I967 HydrophobicContact CB-CG2 3.63Å; F928-Q968 PolarHBondContact N-O 3.02Å; F928-C970 PolarHBondContact O-N 3.03Å; F928-C970 VanDerWaalsContact O-N 3.11Å; F928-P1221 HydrophobicContact CD1-CG 3.98Å; F928-P1221 HydrophobicContact CE1-CB 4.06Å; F928-P1221 HydrophobicContact CE1-CG 3.55Å; F928-P1221 HydrophobicContact CE2-CB 4.45Å; F928-P1221 HydrophobicContact CE2-CG 4.16Å; F928-P1221 HydrophobicContact CG-CG 4.43Å; F928-P1221 HydrophobicContact CZ-CB 3.78Å; F928-P1221 HydrophobicContact CZ-CG 3.63Å
929	F	82.4	Confident	81.1	Confident	50 Å²	50	52.2 Å²	52.2	22%	0.219	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	120.6	179.9	-176.3	-109.6	0	0	0	110.6	S931 T932 T934 P938 W941 C970	F929-S931 PolarHBondContact O-N 2.88Å; F929-T932 CarbonylContact C-O 3.55Å; F929-T932 PolarHBondContact N-O 3.48Å; F929-T932 CarbonylContact O-C 3.59Å; F929-T932 WeakPolarHBondContact O-CA 3.15Å; F929-T932 PolarHBondContact O-N 3.4Å; F929-T932 PolarHBondContact O-OG1 2.99Å; F929-T934 HydrophobicContact CB-CG2 4.29Å; F929-P938 HydrophobicContact CD1-CG 4.15Å; F929-P938 HydrophobicContact CD2-CG 4.19Å; F929-P938 HydrophobicContact CE1-CG 3.8Å; F929-P938 HydrophobicContact CE2-CG 3.85Å; F929-P938 HydrophobicContact CG-CG 4.33Å; F929-P938 HydrophobicContact CZ-CG 3.64Å; F929-W941 HydrophobicContact CD2-CD2 4.38Å; F929-W941 HydrophobicContact CD2-CE3 4.35Å; F929-W941 AromaticContact CE2-CD2 3.66Å; F929-W941 HydrophobicContact CE2-CD2 3.66Å; F929-W941 AromaticContact CE2-CE2 3.69Å; F929-W941 AromaticContact CE2-CE3 3.95Å; F929-W941 HydrophobicContact CE2-CE3 3.95Å; F929-W941 HydrophobicContact CE2-CG 4.06Å; F929-W941 HydrophobicContact CE2-CH2 4.28Å; F929-W941 HydrophobicContact CE2-CZ2 4.03Å; F929-W941 HydrophobicContact CE2-CZ3 4.26Å; F929-C970 HydrophobicContact CB-CB 4.26Å; F929-C970 HydrophobicContact CD2-CB 3.76Å; F929-C970 HydrophobicContact CG-CB 4.45Å
930	N	74.4	Confident	81.8	Confident	130 Å²	130	51.7 Å²	51.7	70%	0.695	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	48.5	174.3	-152.9	24.5	0	0	0	115.1	T932	N930-T932 PolarHBondContact O-N 2.81Å
931	S	74.4	Confident	82.5	Confident	29 Å²	29	52.1 Å²	52.1	20%	0.203	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.2	5.8	-176.3	-43.8	0	0	0	0	115.9	C918 F929	C918-S931 WeakPolarHBondContact CB-O 3.31Å; C918-S931 PolarHBondContact N-O 3.49Å; F929-S931 PolarHBondContact O-N 2.88Å
932	T	79.3	Confident	83	Confident	40 Å²	40	53 Å²	53	25%	0.245	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	167.8	175.2	64.2	0	0	0	0	111.1	F929 N930	F929-T932 CarbonylContact C-O 3.55Å; F929-T932 PolarHBondContact N-O 3.48Å; F929-T932 CarbonylContact O-C 3.59Å; F929-T932 WeakPolarHBondContact O-CA 3.15Å; F929-T932 PolarHBondContact O-N 3.4Å; F929-T932 PolarHBondContact O-OG1 2.99Å; N930-T932 PolarHBondContact O-N 2.81Å
933	C	84.3	Confident	83.3	Confident	6 Å²	6	54.7 Å²	54.7	4%	0.041	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	128.9	-176.8	-62.3	0	0	0	0	109.9	S906 C921 L925 N927	S906-C933 WeakPolarHBondContact CB-O 3.04Å; S906-C933 WeakPolarHBondContact O-CB 3.28Å; C921-C933 WeakPolarHBondContact CA-SG 3.14Å; C921-C933 HydrophobicContact CB-CB 3.4Å; C921-C933 VanDerWaalsContact CB-CB 3.4Å; C921-C933 WeakPolarHBondContact CB-SG 3.38Å; C921-C933 WeakPolarHBondContact SG-CB 2.96Å; C921-C933 CovalentContact SG-SG 2.02Å; C921-C933 PolarHBondContact SG-SG 3.44Å; L925-C933 HydrophobicContact CB-CB 3.95Å; L925-C933 HydrophobicContact CD1-CB 4.48Å; N927-C933 CarbonylContact O-C 3.59Å; N927-C933 WeakPolarHBondContact O-CA 3.25Å
934	T	85.9	Confident	83.6	Confident	35 Å²	35	49.8 Å²	49.8	22%	0.215	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	156.7	-175.8	70.2	0	0	0	0	111.6	L925 N927 F929 S936	L925-T934 CarbonylContact C-O 3.53Å; L925-T934 VanDerWaalsContact C-O 3.31Å; L925-T934 WeakPolarHBondContact CA-O 3.42Å; N927-T934 WeakPolarHBondContact CB-O 3.48Å; N927-T934 PolarHBondContact N-O 3.29Å; N927-T934 PolarHBondContact O-N 2.81Å; F929-T934 HydrophobicContact CB-CG2 4.29Å; T934-S936 VanDerWaalsContact C-N 3.33Å; T934-S936 PolarHBondContact OG1-O 2.87Å
935	K	85.2	Confident	83.5	Confident	167 Å²	167	46.9 Å²	46.9	73%	0.726	26%	0.256	S	S	*	.	S	Bend	trans	-67.1	-37	176.8	-170.8	177.1	180	179.5	0	111.7	L925 N927	L925-K935 HydrophobicContact CD2-CB 4.03Å; N927-K935 PolarHBondContact ND2-O 3.34Å
936	S	85.1	Confident	83.1	Confident	82 Å²	82	53.7 Å²	53.7	57%	0.573	28%	0.279	S	S	*	.	S	Bend	trans	-144.8	154	177.9	53.7	0	0	0	0	110.2	T934	T934-S936 VanDerWaalsContact C-N 3.33Å; T934-S936 PolarHBondContact OG1-O 2.87Å
937	C	87.3	Confident	82.5	Confident	20 Å²	20	52.4 Å²	52.4	14%	0.135	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-66.3	143.7	171	-62.4	0	0	0	0	110.6	W941 C970	C937-W941 HydrophobicContact CB-CB 4.09Å; C937-C970 WeakPolarHBondContact CA-SG 3.44Å; C937-C970 HydrophobicContact CB-CB 3.87Å; C937-C970 WeakPolarHBondContact CB-SG 3.3Å; C937-C970 WeakPolarHBondContact SG-CA 3.44Å; C937-C970 WeakPolarHBondContact SG-CB 3.47Å; C937-C970 CovalentContact SG-SG 2.04Å; C937-C970 PolarHBondContact SG-SG 3.37Å
938	P	87.1	Confident	81.7	Confident	48 Å²	48	58.8 Å²	58.8	31%	0.312	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-69	164.4	178.8	27.7	-33.4	0	0	0	112.4	F929 W941	F929-P938 HydrophobicContact CD1-CG 4.15Å; F929-P938 HydrophobicContact CD2-CG 4.19Å; F929-P938 HydrophobicContact CE1-CG 3.8Å; F929-P938 HydrophobicContact CE2-CG 3.85Å; F929-P938 HydrophobicContact CG-CG 4.33Å; F929-P938 HydrophobicContact CZ-CG 3.64Å; P938-W941 HydrophobicContact CG-CB 4.24Å; P938-W941 HydrophobicContact CG-CG 4.15Å; P938-W941 WeakPolarHBondContact O-CA 3.27Å; P938-W941 WeakPolarHBondContact O-CB 3.1Å; P938-W941 PolarHBondContact O-N 3.35Å; P938-W941 VanDerWaalsContact O-O 3.07Å
939	E	81	Confident	80.6	Confident	88 Å²	88	58.7 Å²	58.7	41%	0.411	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	140.8	175.3	-70.1	-167.3	170.9	0	0	111.7	W941 K979	E939-W941 VanDerWaalsContact C-N 3.28Å; E939-K979 WeakPolarHBondContact OE1-CE 3.47Å; E939-K979 IonicContact OE1-NZ 2.62Å; E939-K979 PolarHBondContact OE1-NZ 3.37Å; E939-K979 VanDerWaalsContact OE2-CE 3.29Å; E939-K979 WeakPolarHBondContact OE2-CE 3.42Å; E939-K979 IonicContact OE2-NZ 3.69Å
940	G	85.4	Confident	79.3	Confident	3 Å²	3	57.5 Å²	57.5	3%	0.031	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.8	-3.4	-168.6	0	0	0	0	0	114.3	C973 Q978	G940-C973 WeakPolarHBondContact O-CB 3.1Å; G940-C973 PolarHBondContact O-N 2.04Å; G940-C973 PolarHBondContact O-SG 3.2Å; G940-Q978 VanDerWaalsContact CA-O 3.29Å; G940-Q978 WeakPolarHBondContact CA-O 3.32Å; G940-Q978 PolarHBondContact N-O 3.45Å; G940-Q978 VanDerWaalsContact N-O 3.1Å
941	W	89.6	Confident	78.3	Confident	23 Å²	23	56.2 Å²	56.2	9%	0.087	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	145.3	178.4	-61.3	75.1	0	0	0	111	F929 C937 P938 E939 C970 E971 A972 E1055 T1057	F929-W941 HydrophobicContact CD2-CD2 4.38Å; F929-W941 HydrophobicContact CD2-CE3 4.35Å; F929-W941 AromaticContact CE2-CD2 3.66Å; F929-W941 HydrophobicContact CE2-CD2 3.66Å; F929-W941 AromaticContact CE2-CE2 3.69Å; F929-W941 AromaticContact CE2-CE3 3.95Å; F929-W941 HydrophobicContact CE2-CE3 3.95Å; F929-W941 HydrophobicContact CE2-CG 4.06Å; F929-W941 HydrophobicContact CE2-CH2 4.28Å; F929-W941 HydrophobicContact CE2-CZ2 4.03Å; F929-W941 HydrophobicContact CE2-CZ3 4.26Å; C937-W941 HydrophobicContact CB-CB 4.09Å; P938-W941 HydrophobicContact CG-CB 4.24Å; P938-W941 HydrophobicContact CG-CG 4.15Å; P938-W941 WeakPolarHBondContact O-CA 3.27Å; P938-W941 WeakPolarHBondContact O-CB 3.1Å; P938-W941 PolarHBondContact O-N 3.35Å; P938-W941 VanDerWaalsContact O-O 3.07Å; E939-W941 VanDerWaalsContact C-N 3.28Å; W941-C970 HydrophobicContact CB-CB 4.42Å; W941-C970 HydrophobicContact CE3-CB 4.18Å; W941-C970 WeakPolarHBondContact CZ3-O 3.48Å; W941-E971 CarbonylContact C-O 3.58Å; W941-E971 VanDerWaalsContact CA-O 3.25Å; W941-E971 WeakPolarHBondContact CA-O 3.34Å; W941-A972 HydrophobicContact CD2-CB 4.19Å; W941-A972 HydrophobicContact CE3-CB 4.08Å; W941-A972 VanDerWaalsContact CE3-N 3.33Å; W941-A972 HydrophobicContact CH2-CB 4.16Å; W941-A972 HydrophobicContact CZ2-CB 4.23Å; W941-A972 HydrophobicContact CZ3-CB 4.07Å; W941-E1055 HydrophobicContact CH2-CG 4.14Å; W941-E1055 WeakPolarHBondContact CH2-OE1 3.47Å; W941-E1055 VanDerWaalsContact CH2-OE2 3.26Å; W941-E1055 WeakPolarHBondContact CH2-OE2 3.28Å; W941-E1055 HydrophobicContact CZ2-CG 4.4Å; W941-E1055 WeakPolarHBondContact CZ2-OE1 3.44Å; W941-T1057 WeakPolarHBondContact CZ2-OG1 3.42Å
942	Y	89.6	Confident	77	Confident	33 Å²	33	62.2 Å²	62.2	13%	0.129	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	154.9	176.6	70	-86.5	0	0	0	110.8	G944 C970 E971 A972 C980 N982 F983	Y942-G944 PolarHBondContact O-N 2.74Å; Y942-C970 WeakPolarHBondContact O-CA 3.42Å; Y942-E971 HydrophobicContact CD1-CB 4.43Å; Y942-E971 VanDerWaalsContact CD1-O 3.29Å; Y942-E971 WeakPolarHBondContact CD1-O 3.34Å; Y942-E971 HydrophobicContact CE1-CB 3.84Å; Y942-E971 HydrophobicContact CE2-CB 4.18Å; Y942-E971 PolarHBondContact N-O 2.62Å; Y942-E971 PolarHBondContact O-N 3.16Å; Y942-E971 PolarHBondContact OH-OE2 2.88Å; Y942-A972 WeakPolarHBondContact CE1-O 3.11Å; Y942-C980 VanDerWaalsContact CD1-SG 3.53Å; Y942-N982 HydrophobicContact CD2-CB 4.45Å; Y942-N982 HydrophobicContact CE2-CB 4.32Å; Y942-F983 HydrophobicContact CE1-CB 4.12Å
943	S	84.2	Confident	75.1	Confident	52 Å²	52	62.8 Å²	62.8	36%	0.364	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	102.1	174.5	-62.8	0	0	0	0	109.2	N927	N927-S943 PolarHBondContact OD1-OG 3.28Å
944	G	82.1	Confident	72.8	Confident	12 Å²	12	70.3 Å²	70.3	12%	0.124	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	-138.2	-175.9	0	0	0	0	0	112.8	Y942 I969	Y942-G944 PolarHBondContact O-N 2.74Å; G944-I969 VanDerWaalsContact CA-O 3.29Å; G944-I969 WeakPolarHBondContact CA-O 3.32Å; G944-I969 PolarHBondContact N-O 2.97Å
945	E	77.5	Confident	70.4	Confident	69 Å²	69	74.3 Å²	74.3	32%	0.322	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	142	-169.5	-146.6	162	177.4	0	0	112.6	I969 Y1202 K1204 I1229	E945-I969 PolarHBondContact O-N 2.86Å; E945-I969 VanDerWaalsContact O-N 3.12Å; E945-Y1202 PolarHBondContact OE2-OH 3.46Å; E945-K1204 IonicContact OE2-NZ 2.89Å; E945-K1204 PolarHBondContact OE2-NZ 3.1Å; E945-I1229 HydrophobicContact CB-CD1 3.69Å; E945-I1229 HydrophobicContact CG-CD1 3.72Å
946	R	77.1	Confident	68.1	Low	173 Å²	173	72.1 Å²	72.1	65%	0.653	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.5	123.1	179.9	-77.6	179.9	-177	176.8	2.5	110.4	P966 I967 Q968	R946-P966 HydrophobicContact CB-CB 4.31Å; R946-I967 CarbonylContact C-O 3.31Å; R946-I967 VanDerWaalsContact CA-O 3.31Å; R946-I967 WeakPolarHBondContact CA-O 2.85Å; R946-Q968 HydrophobicContact CG-CG 3.59Å
947	I	72.6	Confident	65.8	Low	13 Å²	13	76 Å²	76	7%	0.067	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	132.4	171.8	-63.9	-175.1	0	0	0	109.3	W920 P966 I967 I969 P1220 I1229	W920-I947 HydrophobicContact CH2-CB 4.34Å; W920-I947 HydrophobicContact CH2-CG2 4.08Å; W920-I947 WeakPolarHBondContact CH2-O 3.31Å; W920-I947 HydrophobicContact CZ3-CG2 4.41Å; I947-P966 CarbonylContact O-C 3.26Å; I947-P966 VanDerWaalsContact O-CA 3.22Å; I947-P966 WeakPolarHBondContact O-CA 3.44Å; I947-P966 VanDerWaalsContact O-CB 3.28Å; I947-P966 WeakPolarHBondContact O-CB 3.06Å; I947-I967 PolarHBondContact N-O 3.46Å; I947-I967 PolarHBondContact O-N 2.67Å; I947-I969 HydrophobicContact CD1-CD1 3.14Å; I947-I969 HydrophobicContact CD1-CG1 3.72Å; I947-I969 HydrophobicContact CG1-CD1 3.89Å; I947-I969 HydrophobicContact CG1-CG1 4.25Å; I947-P1220 HydrophobicContact CD1-CB 3.99Å; I947-P1220 HydrophobicContact CD1-CG 4.19Å; I947-I1229 HydrophobicContact CD1-CD1 4.16Å; I947-I1229 HydrophobicContact CD1-CG1 4.19Å; I947-I1229 HydrophobicContact CG1-CD1 3.78Å; I947-I1229 HydrophobicContact CG1-CG1 4.05Å
948	Q	66.6	Low	63.4	Low	140 Å²	140	82.3 Å²	82.3	65%	0.654	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-85.6	151.4	171.1	-73.1	-177.9	-11.3	0	0	111.7	P966	Q948-P966 HydrophobicContact CG-CB 4.4Å
949	S	61	Low	61.2	Low	19 Å²	19	88.7 Å²	88.7	13%	0.133	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-66.2	126.1	178.8	-177.6	0	0	0	0	110.8	W920 F951	W920-S949 PolarHBondContact NE1-OG 3.41Å; S949-F951 PolarHBondContact O-N 3.47Å
950	P	55.6	Low	59.3	Low	26 Å²	26	93 Å²	93	17%	0.169	48%	0.477	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-8.4	178.6	28.8	-34	0	0	0	113.5	Y952 Y1247 L1249	P950-Y952 VanDerWaalsContact C-N 3.27Å; P950-Y952 PolarHBondContact O-N 2.77Å; P950-Y1247 HydrophobicContact CB-CD1 4.3Å; P950-Y1247 HydrophobicContact CB-CD2 4.42Å; P950-Y1247 HydrophobicContact CB-CG 3.95Å; P950-L1249 HydrophobicContact CB-CD2 3.88Å
951	F	53.8	Low	57.1	Low	102 Å²	102	99.1 Å²	99.1	45%	0.447	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	2	-178.1	-65.7	-78.5	0	0	0	115.3	T911 S949	T911-F951 HydrophobicContact CG2-CE2 4.44Å; T911-F951 HydrophobicContact CG2-CZ 4.08Å; S949-F951 PolarHBondContact O-N 3.47Å
952	Y	46.5	Very low	55	Low	155 Å²	155	102.6 Å²	102.6	61%	0.608	53%	0.534	S	S	*	.			trans	-101.8	76.9	172.8	-91.5	-85.9	0	0	0	111.1	P950	P950-Y952 VanDerWaalsContact C-N 3.27Å; P950-Y952 PolarHBondContact O-N 2.77Å
953	A	39.8	Very low	52.9	Low	53 Å²	53	105.8 Å²	105.8	44%	0.438	56%	0.559	S	S	.	*	S	Bend	trans	-143.8	102.7	158.3	0	0	0	0	0	108.1	T1245	A953-T1245 HydrophobicContact CB-CG2 3.96Å
954	N	36.1	Very low	51.4	Low	163 Å²	163	107.5 Å²	107.5	87%	0.872	56%	0.559	S	S	*	*			trans	77.6	75.5	174.2	-53.5	-22.9	0	0	0	116.9
955	S	35.5	Very low	50.4	Low	120 Å²	120	112.7 Å²	112.7	84%	0.839	58%	0.58	S	S	*	*			trans	-113.6	107.8	146.5	172.7	0	0	0	0	107.6
956	V	36.5	Very low	50	Low	121 Å²	121	111.9 Å²	111.9	73%	0.733	58%	0.581	S	S	*	*			trans	-75.6	118.4	173.3	169.8	0	0	0	0	107.4
957	Q	36.6	Very low	49.9	Very low	164 Å²	164	104 Å²	104	77%	0.766	55%	0.552	S	S	*	*	S	Bend	trans	54.5	122.7	156.9	-66.4	178.5	-24.4	0	0	119.1
958	N	36.9	Very low	50.4	Low	152 Å²	152	105.5 Å²	105.5	81%	0.813	56%	0.559	S	S	*	*			trans	76.9	78.6	158.1	-57.7	-17.5	0	0	0	117.1
959	E	41.1	Very low	51.3	Low	181 Å²	181	99.6 Å²	99.6	85%	0.846	53%	0.532	S	S	*	.				-170.8	135.2	123.9	-103	173.4	-159.4	0	0	109.7	L961	E959-L961 VanDerWaalsContact C-N 3.33Å; E959-L961 PolarHBondContact O-N 2.99Å
960	I	41.9	Very low	52.5	Low	178 Å²	178	99 Å²	99	91%	0.913	53%	0.527	S	S	*	.			trans	-77.5	78.3	-168.2	-55.7	167	0	0	0	109.2
961	L	38.9	Very low	54	Low	132 Å²	132	99.2 Å²	99.2	69%	0.691	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-87.7	126.9	162	-94.6	123.9	0	0	0	109.4	E959	E959-L961 VanDerWaalsContact C-N 3.33Å; E959-L961 PolarHBondContact O-N 2.99Å
962	P	44.3	Very low	55.6	Low	97 Å²	97	94.9 Å²	94.9	63%	0.63	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-61.3	136.8	-178.8	23.1	-31.4	0	0	0	110.3	K964	P962-K964 PolarHBondContact O-N 3.38Å; P962-K964 VanDerWaalsContact O-N 3.13Å
963	P	47.2	Very low	57.6	Low	100 Å²	100	87.5 Å²	87.5	65%	0.649	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-58.1	119.1	-177.8	21.9	-31.8	0	0	0	110.4	Q965	P963-Q965 PolarHBondContact O-N 3.09Å
964	K	52.4	Low	59.9	Low	87 Å²	87	85.5 Å²	85.5	38%	0.378	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-61.3	126.6	174.4	-74.3	-169.9	-179.2	-176.1	0	109.3	D908 T910 P962	D908-K964 IonicContact OD2-NZ 2.66Å; D908-K964 PolarHBondContact OD2-NZ 2.95Å; T910-K964 PolarHBondContact OG1-NZ 3.08Å; P962-K964 PolarHBondContact O-N 3.38Å; P962-K964 VanDerWaalsContact O-N 3.13Å
965	Q	61.1	Low	62.3	Low	121 Å²	121	78.6 Å²	78.6	57%	0.565	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-67.7	150.6	-176.7	-71.8	-172.9	-7.1	0	0	112.3	P963	P963-Q965 PolarHBondContact O-N 3.09Å
966	P	68.2	Low	64.6	Low	52 Å²	52	73 Å²	73	34%	0.338	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-66	146.1	174.3	28.5	-34.8	0	0	0	111.4	R946 I947 Q948	R946-P966 HydrophobicContact CB-CB 4.31Å; I947-P966 CarbonylContact O-C 3.26Å; I947-P966 VanDerWaalsContact O-CA 3.22Å; I947-P966 WeakPolarHBondContact O-CA 3.44Å; I947-P966 VanDerWaalsContact O-CB 3.28Å; I947-P966 WeakPolarHBondContact O-CB 3.06Å; Q948-P966 HydrophobicContact CG-CB 4.4Å
967	I	76	Confident	67	Low	7 Å²	7	67.3 Å²	67.3	4%	0.036	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	145	-180	-63.3	-162.5	0	0	0	110.4	W920 C921 P926 F928 R946 I947	W920-I967 HydrophobicContact CD2-CD1 3.45Å; W920-I967 VanDerWaalsContact CD2-CD1 3.45Å; W920-I967 HydrophobicContact CD2-CG1 4.15Å; W920-I967 HydrophobicContact CE3-CB 4.19Å; W920-I967 HydrophobicContact CE3-CD1 2.96Å; W920-I967 HydrophobicContact CE3-CG1 3.67Å; W920-I967 HydrophobicContact CG-CD1 4.24Å; W920-I967 HydrophobicContact CH2-CB 3.42Å; W920-I967 VanDerWaalsContact CH2-CB 3.42Å; W920-I967 HydrophobicContact CH2-CD1 3.6Å; W920-I967 HydrophobicContact CH2-CG1 3.23Å; W920-I967 HydrophobicContact CZ2-CB 4.43Å; W920-I967 HydrophobicContact CZ2-CD1 4.08Å; W920-I967 HydrophobicContact CZ2-CG1 3.82Å; W920-I967 HydrophobicContact CZ3-CB 3.31Å; W920-I967 HydrophobicContact CZ3-CD1 3.05Å; W920-I967 HydrophobicContact CZ3-CG1 3.19Å; W920-I967 HydrophobicContact CZ3-CG2 4Å; C921-I967 HydrophobicContact CB-CD1 3.48Å; C921-I967 VanDerWaalsContact CB-CD1 3.48Å; P926-I967 WeakPolarHBondContact O-CG2 3.44Å; F928-I967 HydrophobicContact CB-CG2 3.63Å; R946-I967 CarbonylContact C-O 3.31Å; R946-I967 VanDerWaalsContact CA-O 3.31Å; R946-I967 WeakPolarHBondContact CA-O 2.85Å; I947-I967 PolarHBondContact N-O 3.46Å; I947-I967 PolarHBondContact O-N 2.67Å
968	Q	83.1	Confident	69.4	Low	45 Å²	45	61.8 Å²	61.8	21%	0.21	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	124.9	174.7	-71.7	178.8	-40.6	0	0	110.4	P926 N927 F928 R946	P926-Q968 PolarHBondContact O-N 2.65Å; N927-Q968 CarbonylContact C-O 3.57Å; N927-Q968 WeakPolarHBondContact CA-O 3.48Å; F928-Q968 PolarHBondContact N-O 3.02Å; R946-Q968 HydrophobicContact CG-CG 3.59Å
969	I	84	Confident	71.8	Confident	17 Å²	17	58.6 Å²	58.6	9%	0.087	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	131.7	171.7	-59.4	167.2	0	0	0	108.8	G944 E945 I947 E971 I1229	G944-I969 VanDerWaalsContact CA-O 3.29Å; G944-I969 WeakPolarHBondContact CA-O 3.32Å; G944-I969 PolarHBondContact N-O 2.97Å; E945-I969 PolarHBondContact O-N 2.86Å; E945-I969 VanDerWaalsContact O-N 3.12Å; I947-I969 HydrophobicContact CD1-CD1 3.14Å; I947-I969 HydrophobicContact CD1-CG1 3.72Å; I947-I969 HydrophobicContact CG1-CD1 3.89Å; I947-I969 HydrophobicContact CG1-CG1 4.25Å; I969-E971 PolarHBondContact O-N 2.84Å; I969-I1229 HydrophobicContact CD1-CD1 4.28Å
970	C	87.8	Confident	74.2	Confident	5 Å²	5	51 Å²	51	3%	0.034	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	121.3	169.6	-64.8	0	0	0	0	110.6	F928 F929 C937 W941 Y942	F928-C970 PolarHBondContact O-N 3.03Å; F928-C970 VanDerWaalsContact O-N 3.11Å; F929-C970 HydrophobicContact CB-CB 4.26Å; F929-C970 HydrophobicContact CD2-CB 3.76Å; F929-C970 HydrophobicContact CG-CB 4.45Å; C937-C970 WeakPolarHBondContact CA-SG 3.44Å; C937-C970 HydrophobicContact CB-CB 3.87Å; C937-C970 WeakPolarHBondContact CB-SG 3.3Å; C937-C970 WeakPolarHBondContact SG-CA 3.44Å; C937-C970 WeakPolarHBondContact SG-CB 3.47Å; C937-C970 CovalentContact SG-SG 2.04Å; C937-C970 PolarHBondContact SG-SG 3.37Å; W941-C970 HydrophobicContact CB-CB 4.42Å; W941-C970 HydrophobicContact CE3-CB 4.18Å; W941-C970 WeakPolarHBondContact CZ3-O 3.48Å; Y942-C970 WeakPolarHBondContact O-CA 3.42Å
971	E	86.3	Confident	76.4	Confident	32 Å²	32	48.1 Å²	48.1	15%	0.15	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	147.3	175.7	-68.8	-175.9	154.6	0	0	110.2	W941 Y942 I969 K1204	W941-E971 CarbonylContact C-O 3.58Å; W941-E971 VanDerWaalsContact CA-O 3.25Å; W941-E971 WeakPolarHBondContact CA-O 3.34Å; Y942-E971 HydrophobicContact CD1-CB 4.43Å; Y942-E971 VanDerWaalsContact CD1-O 3.29Å; Y942-E971 WeakPolarHBondContact CD1-O 3.34Å; Y942-E971 HydrophobicContact CE1-CB 3.84Å; Y942-E971 HydrophobicContact CE2-CB 4.18Å; Y942-E971 PolarHBondContact N-O 2.62Å; Y942-E971 PolarHBondContact O-N 3.16Å; Y942-E971 PolarHBondContact OH-OE2 2.88Å; I969-E971 PolarHBondContact O-N 2.84Å; E971-K1204 IonicContact OE1-NZ 3.78Å; E971-K1204 PolarHBondContact OE1-NZ 3.49Å; E971-K1204 IonicContact OE2-NZ 2.78Å
972	A	86.9	Confident	78.6	Confident	10 Å²	10	44.9 Å²	44.9	8%	0.083	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	147	-177.3	0	0	0	0	0	112.3	W941 Y942 E1055 P1189 F1191	W941-A972 HydrophobicContact CD2-CB 4.19Å; W941-A972 HydrophobicContact CE3-CB 4.08Å; W941-A972 VanDerWaalsContact CE3-N 3.33Å; W941-A972 HydrophobicContact CH2-CB 4.16Å; W941-A972 HydrophobicContact CZ2-CB 4.23Å; W941-A972 HydrophobicContact CZ3-CB 4.07Å; Y942-A972 WeakPolarHBondContact CE1-O 3.11Å; A972-E1055 HydrophobicContact CB-CG 3.7Å; A972-P1189 HydrophobicContact CB-CB 3.82Å; A972-F1191 HydrophobicContact CB-CZ 4.01Å
973	C	89.9	Confident	80.6	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.007	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-61.5	160	170.7	-64.8	0	0	0	0	112.4	G940 C977 C980 F1191	G940-C973 WeakPolarHBondContact O-CB 3.1Å; G940-C973 PolarHBondContact O-N 2.04Å; G940-C973 PolarHBondContact O-SG 3.2Å; C973-C977 HydrophobicContact CB-CB 3.96Å; C973-C980 WeakPolarHBondContact CA-SG 3.46Å; C973-C980 HydrophobicContact CB-CB 3.66Å; C973-C980 WeakPolarHBondContact CB-SG 3.49Å; C973-C980 WeakPolarHBondContact SG-CB 3.35Å; C973-C980 PolarHBondContact SG-N 3.4Å; C973-C980 CovalentContact SG-SG 2.02Å; C973-C980 PolarHBondContact SG-SG 3.07Å; C973-F1191 WeakPolarHBondContact O-CE2 2.94Å; C973-F1191 WeakPolarHBondContact O-CZ 2.99Å
974	S	87.6	Confident	82.2	Confident	10 Å²	10	37.6 Å²	37.6	7%	0.07	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-57.3	152.9	176.6	35.5	0	0	0	0	113.2	G976 C977 F983	S974-G976 PolarHBondContact O-N 3.14Å; S974-C977 WeakPolarHBondContact O-CB 3.43Å; S974-C977 PolarHBondContact O-N 3.38Å; S974-F983 WeakPolarHBondContact CB-O 3.38Å; S974-F983 PolarHBondContact OG-O 2.8Å
975	P	86.1	Confident	83.9	Confident	18 Å²	18	36.2 Å²	36.2	12%	0.117	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	130.9	177.7	-27.8	34.3	0	0	0	113.1	C977 C1044 L1045 L1053 F1191	P975-C977 VanDerWaalsContact C-N 3.28Å; P975-C977 PolarHBondContact O-N 3.39Å; P975-C1044 WeakPolarHBondContact CB-O 3.2Å; P975-L1045 HydrophobicContact CB-CD2 4.07Å; P975-L1053 HydrophobicContact CG-CD1 3.85Å; P975-L1053 HydrophobicContact CG-CD2 3.45Å; P975-L1053 VanDerWaalsContact CG-CD2 3.45Å; P975-L1053 HydrophobicContact CG-CG 4.23Å; P975-F1191 HydrophobicContact CB-CD2 3.95Å; P975-F1191 HydrophobicContact CB-CE2 4.41Å; P975-F1191 HydrophobicContact CB-CG 4.43Å; P975-F1191 HydrophobicContact CG-CB 4.32Å; P975-F1191 HydrophobicContact CG-CD1 4.36Å; P975-F1191 HydrophobicContact CG-CD2 3.73Å; P975-F1191 HydrophobicContact CG-CE2 4.07Å; P975-F1191 HydrophobicContact CG-CG 3.88Å
976	G	83.2	Confident	85.3	Confident	3 Å²	3	30.6 Å²	30.6	3%	0.031	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.5	0	-177.5	0	0	0	0	0	114.7	S974 L990 C1000	S974-G976 PolarHBondContact O-N 3.14Å; G976-L990 WeakPolarHBondContact O-CG 3.49Å; G976-L990 PolarHBondContact O-N 2.86Å; G976-C1000 PolarHBondContact O-SG 2.99Å; G976-C1000 VanDerWaalsContact O-SG 3.33Å
977	C	88	Confident	86.3	Confident	2 Å²	2	31.8 Å²	31.8	1%	0.014	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	127.2	177	-169.4	0	0	0	0	112.4	C973 S974 P975 K979 C986	C973-C977 HydrophobicContact CB-CB 3.96Å; S974-C977 WeakPolarHBondContact O-CB 3.43Å; S974-C977 PolarHBondContact O-N 3.38Å; P975-C977 VanDerWaalsContact C-N 3.28Å; P975-C977 PolarHBondContact O-N 3.39Å; C977-K979 PolarHBondContact SG-O 2.46Å; C977-C986 WeakPolarHBondContact CA-SG 3.2Å; C977-C986 HydrophobicContact CB-CB 3.73Å; C977-C986 WeakPolarHBondContact CB-SG 3.39Å; C977-C986 WeakPolarHBondContact SG-CA 3.38Å; C977-C986 WeakPolarHBondContact SG-CB 3.41Å; C977-C986 CovalentContact SG-SG 2.02Å; C977-C986 PolarHBondContact SG-SG 2.02Å
978	Q	86.8	Confident	87	Confident	48 Å²	48	34.1 Å²	34.1	22%	0.224	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	-42.7	173.4	-176.2	171.6	-3.5	0	0	112.6	G940 V988 L990	G940-Q978 VanDerWaalsContact CA-O 3.29Å; G940-Q978 WeakPolarHBondContact CA-O 3.32Å; G940-Q978 PolarHBondContact N-O 3.45Å; G940-Q978 VanDerWaalsContact N-O 3.1Å; Q978-V988 WeakPolarHBondContact CA-O 3.25Å; Q978-V988 HydrophobicContact CB-CB 4.36Å; Q978-V988 HydrophobicContact CB-CG1 4.15Å; Q978-V988 WeakPolarHBondContact CB-O 3.35Å; Q978-V988 PolarHBondContact N-O 3.04Å; Q978-L990 HydrophobicContact CB-CD2 4.11Å
979	K	87.9	Confident	87.3	Confident	84 Å²	84	32.8 Å²	32.8	37%	0.365	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	130.3	177.9	-57.5	-171.7	-176	-163.9	0	110.2	E939 C977 V987 V988	E939-K979 WeakPolarHBondContact OE1-CE 3.47Å; E939-K979 IonicContact OE1-NZ 2.62Å; E939-K979 PolarHBondContact OE1-NZ 3.37Å; E939-K979 VanDerWaalsContact OE2-CE 3.29Å; E939-K979 WeakPolarHBondContact OE2-CE 3.42Å; E939-K979 IonicContact OE2-NZ 3.69Å; C977-K979 PolarHBondContact SG-O 2.46Å; K979-V987 WeakPolarHBondContact O-CA 3.47Å; K979-V987 PolarHBondContact O-N 2.02Å; K979-V988 HydrophobicContact CB-CB 3.94Å; K979-V988 HydrophobicContact CB-CG2 4Å; K979-V988 HydrophobicContact CD-CG2 4.07Å; K979-V988 HydrophobicContact CG-CB 4.13Å; K979-V988 HydrophobicContact CG-CG2 4.2Å; K979-V988 PolarHBondContact N-O 3.17Å; K979-V988 VanDerWaalsContact N-O 3.1Å; K979-V988 PolarHBondContact O-N 3.37Å; K979-V988 VanDerWaalsContact O-N 3.07Å
980	C	90.7	Very high	87.3	Confident	22 Å²	22	32.6 Å²	32.6	15%	0.149	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	159.8	-178.2	65.9	0	0	0	0	111.7	Y942 C973 N982 V985	Y942-C980 VanDerWaalsContact CD1-SG 3.53Å; C973-C980 WeakPolarHBondContact CA-SG 3.46Å; C973-C980 HydrophobicContact CB-CB 3.66Å; C973-C980 WeakPolarHBondContact CB-SG 3.49Å; C973-C980 WeakPolarHBondContact SG-CB 3.35Å; C973-C980 PolarHBondContact SG-N 3.4Å; C973-C980 CovalentContact SG-SG 2.02Å; C973-C980 PolarHBondContact SG-SG 3.07Å; C980-N982 WeakPolarHBondContact CB-O 3.29Å; C980-V985 WeakPolarHBondContact CA-O 3.34Å; C980-V985 WeakPolarHBondContact CB-O 2.99Å
981	I	87.3	Confident	86.9	Confident	117 Å²	117	36.1 Å²	36.1	60%	0.6	21%	0.205	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-88.8	-42.2	169.8	-62.3	167	0	0	0	109.6	V985 V987	I981-V985 HydrophobicContact CD1-CG1 4.25Å; I981-V985 PolarHBondContact N-O 3.35Å; I981-V985 VanDerWaalsContact N-O 3.1Å; I981-V987 HydrophobicContact CD1-CG2 3.98Å; I981-V987 HydrophobicContact CG1-CG2 3.75Å
982	N	86.5	Confident	86.5	Confident	64 Å²	64	41 Å²	41	34%	0.342	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	178.1	173.8	60.2	50.9	0	0	0	108.1	Y942 C980 S984 V985	Y942-N982 HydrophobicContact CD2-CB 4.45Å; Y942-N982 HydrophobicContact CE2-CB 4.32Å; C980-N982 WeakPolarHBondContact CB-O 3.29Å; N982-S984 VanDerWaalsContact C-N 3.29Å; N982-S984 PolarHBondContact O-N 2.99Å; N982-S984 PolarHBondContact OD1-N 3.06Å; N982-V985 PolarHBondContact O-N 3.1Å; N982-V985 PolarHBondContact OD1-N 3.05Å
983	F	84.8	Confident	86.4	Confident	10 Å²	10	41.3 Å²	41.3	4%	0.044	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-40.3	-177.8	-168.4	-94.5	0	0	0	114.1	Y942 S974 L1053 V1206 I1208 M1215	Y942-F983 HydrophobicContact CE1-CB 4.12Å; S974-F983 WeakPolarHBondContact CB-O 3.38Å; S974-F983 PolarHBondContact OG-O 2.8Å; F983-L1053 HydrophobicContact CE2-CD2 4.36Å; F983-L1053 HydrophobicContact CZ-CD2 3.83Å; F983-V1206 HydrophobicContact CD1-CB 4.47Å; F983-V1206 HydrophobicContact CD1-CG1 3.94Å; F983-I1208 HydrophobicContact CD1-CD1 4Å; F983-I1208 HydrophobicContact CD1-CG1 4.43Å; F983-I1208 HydrophobicContact CE1-CD1 3.52Å; F983-I1208 HydrophobicContact CE1-CG1 4.37Å; F983-M1215 HydrophobicContact CD1-CE 3.47Å; F983-M1215 VanDerWaalsContact CD1-CE 3.47Å; F983-M1215 HydrophobicContact CD2-CE 3.81Å; F983-M1215 HydrophobicContact CD2-SD 4.39Å; F983-M1215 HydrophobicContact CE1-CE 3.19Å; F983-M1215 HydrophobicContact CE2-CE 3.58Å; F983-M1215 HydrophobicContact CE2-SD 4.26Å; F983-M1215 HydrophobicContact CG-CE 3.76Å; F983-M1215 HydrophobicContact CZ-CE 3.27Å; F983-M1215 HydrophobicContact CZ-SD 4.45Å
984	S	81.4	Confident	86	Confident	34 Å²	34	47.5 Å²	47.5	24%	0.238	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-14.2	-174.9	-54.8	0	0	0	0	114.3	N982 L1207	N982-S984 VanDerWaalsContact C-N 3.29Å; N982-S984 PolarHBondContact O-N 2.99Å; N982-S984 PolarHBondContact OD1-N 3.06Å; S984-L1207 PolarHBondContact OG-O 3.06Å
985	V	88.4	Confident	85.8	Confident	58 Å²	58	51 Å²	51	35%	0.352	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	96.2	-175.4	-174.8	0	0	0	0	110.7	C980 I981 N982	C980-V985 WeakPolarHBondContact CA-O 3.34Å; C980-V985 WeakPolarHBondContact CB-O 2.99Å; I981-V985 HydrophobicContact CD1-CG1 4.25Å; I981-V985 PolarHBondContact N-O 3.35Å; I981-V985 VanDerWaalsContact N-O 3.1Å; N982-V985 PolarHBondContact O-N 3.1Å; N982-V985 PolarHBondContact OD1-N 3.05Å
986	C	89.9	Confident	85.6	Confident	3 Å²	3	57.8 Å²	57.8	2%	0.02	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	141.2	167.1	-167.2	0	0	0	0	111.6	C977 V988 L995 G998 C1000	C977-C986 WeakPolarHBondContact CA-SG 3.2Å; C977-C986 HydrophobicContact CB-CB 3.73Å; C977-C986 WeakPolarHBondContact CB-SG 3.39Å; C977-C986 WeakPolarHBondContact SG-CA 3.38Å; C977-C986 WeakPolarHBondContact SG-CB 3.41Å; C977-C986 CovalentContact SG-SG 2.02Å; C977-C986 PolarHBondContact SG-SG 2.02Å; C986-V988 VanDerWaalsContact SG-C 3.56Å; C986-V988 PolarHBondContact SG-O 3.41Å; C986-L995 HydrophobicContact CB-CD1 3.9Å; C986-L995 WeakPolarHBondContact O-CD1 3.48Å; C986-G998 WeakPolarHBondContact CA-O 3.46Å; C986-G998 WeakPolarHBondContact CB-O 3.38Å; C986-G998 PolarHBondContact N-O 2.91Å; C986-C1000 PolarHBondContact SG-SG 2.88Å
987	V	90.8	Very high	85.5	Confident	77 Å²	77	63.3 Å²	63.3	47%	0.467	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	-37.1	177	-173.3	0	0	0	0	110.9	K979 I981	K979-V987 WeakPolarHBondContact O-CA 3.47Å; K979-V987 PolarHBondContact O-N 2.02Å; I981-V987 HydrophobicContact CD1-CG2 3.98Å; I981-V987 HydrophobicContact CG1-CG2 3.75Å
988	V	89.7	Confident	85.2	Confident	56 Å²	56	63.9 Å²	63.9	34%	0.339	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	120.1	178.9	-176.3	0	0	0	0	108.4	Q978 K979 C986	Q978-V988 WeakPolarHBondContact CA-O 3.25Å; Q978-V988 HydrophobicContact CB-CB 4.36Å; Q978-V988 HydrophobicContact CB-CG1 4.15Å; Q978-V988 WeakPolarHBondContact CB-O 3.35Å; Q978-V988 PolarHBondContact N-O 3.04Å; K979-V988 HydrophobicContact CB-CB 3.94Å; K979-V988 HydrophobicContact CB-CG2 4Å; K979-V988 HydrophobicContact CD-CG2 4.07Å; K979-V988 HydrophobicContact CG-CB 4.13Å; K979-V988 HydrophobicContact CG-CG2 4.2Å; K979-V988 PolarHBondContact N-O 3.17Å; K979-V988 VanDerWaalsContact N-O 3.1Å; K979-V988 PolarHBondContact O-N 3.37Å; K979-V988 VanDerWaalsContact O-N 3.07Å; C986-V988 VanDerWaalsContact SG-C 3.56Å; C986-V988 PolarHBondContact SG-O 3.41Å
989	C	88.7	Confident	85	Confident	17 Å²	17	63.5 Å²	63.5	12%	0.115	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	159.8	175.5	-65.7	0	0	0	0	112	L993 L995 C1000	C989-L993 HydrophobicContact CB-CB 3.99Å; C989-L995 VanDerWaalsContact SG-CA 3.54Å; C989-C1000 WeakPolarHBondContact CA-SG 3.32Å; C989-C1000 HydrophobicContact CB-CB 3.8Å; C989-C1000 WeakPolarHBondContact CB-SG 2.94Å; C989-C1000 WeakPolarHBondContact SG-CA 3.49Å; C989-C1000 WeakPolarHBondContact SG-CB 3.35Å; C989-C1000 CovalentContact SG-SG 2.03Å; C989-C1000 PolarHBondContact SG-SG 3.12Å
990	L	83.8	Confident	84.9	Confident	13 Å²	13	60 Å²	60	7%	0.068	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-59	157.4	165	-63.6	-176.3	0	0	0	110.8	G976 Q978 L993 Y1037	G976-L990 WeakPolarHBondContact O-CG 3.49Å; G976-L990 PolarHBondContact O-N 2.86Å; Q978-L990 HydrophobicContact CB-CD2 4.11Å; L990-L993 HydrophobicContact CB-CD1 4.13Å; L990-L993 PolarHBondContact O-N 2.92Å; L990-Y1037 HydrophobicContact CB-CE1 4.04Å; L990-Y1037 HydrophobicContact CD1-CD1 3.81Å; L990-Y1037 HydrophobicContact CD1-CE1 3.73Å
991	P	79.8	Confident	84.4	Confident	80 Å²	80	62.6 Å²	62.6	52%	0.519	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.7	149.5	173.2	-26.4	34.6	0	0	0	111.9	L993 Y1037	P991-L993 PolarHBondContact O-N 3.25Å; P991-Y1037 WeakPolarHBondContact O-CE2 2.98Å; P991-Y1037 PolarHBondContact O-OH 2.88Å
992	D	78.9	Confident	83.8	Confident	135 Å²	135	61.1 Å²	61.1	72%	0.722	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.5	-7.7	-179	-44.7	-41.5	0	0	0	117.3	Y1037	D992-Y1037 HydrophobicContact CB-CE2 4.26Å
993	L	84.2	Confident	82.7	Confident	15 Å²	15	61.2 Å²	61.2	8%	0.079	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	138.8	172.1	-62.8	174.4	0	0	0	110.8	C989 L990 P991 C1000 L1002 Y1037 L1045	C989-L993 HydrophobicContact CB-CB 3.99Å; L990-L993 HydrophobicContact CB-CD1 4.13Å; L990-L993 PolarHBondContact O-N 2.92Å; P991-L993 PolarHBondContact O-N 3.25Å; L993-C1000 HydrophobicContact CB-CB 4.06Å; L993-C1000 HydrophobicContact CD1-CB 4.03Å; L993-L1002 HydrophobicContact CD2-CD2 3.92Å; L993-L1002 HydrophobicContact CD2-CG 3.79Å; L993-Y1037 HydrophobicContact CD1-CD2 3.94Å; L993-Y1037 HydrophobicContact CD1-CE2 4.34Å; L993-Y1037 HydrophobicContact CD1-CG 4.25Å; L993-Y1037 HydrophobicContact CD2-CD2 3.99Å; L993-Y1037 HydrophobicContact CG-CD2 3.83Å; L993-Y1037 HydrophobicContact CG-CE2 4Å; L993-L1045 HydrophobicContact CD1-CD2 4.37Å; L993-L1045 HydrophobicContact CD2-CD1 4.27Å
994	K	82.1	Confident	81.3	Confident	131 Å²	131	66.1 Å²	66.1	57%	0.57	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.3	135.7	174.7	-69.4	-173.3	-178.5	164.7	0	110.3	Y996 I1001 S1003	K994-Y996 PolarHBondContact O-N 3.09Å; K994-I1001 PolarHBondContact N-O 2.77Å; K994-I1001 PolarHBondContact O-N 2.9Å; K994-S1003 VanDerWaalsContact CD-OG 3.31Å; K994-S1003 WeakPolarHBondContact CD-OG 3.05Å; K994-S1003 WeakPolarHBondContact CE-OG 3.45Å; K994-S1003 PolarHBondContact NZ-OG 3.37Å
995	L	83.4	Confident	79.5	Confident	83 Å²	83	71.4 Å²	71.4	44%	0.435	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	116.8	174	-174.3	68.2	0	0	0	109.6	C986 C989	C986-L995 HydrophobicContact CB-CD1 3.9Å; C986-L995 WeakPolarHBondContact O-CD1 3.48Å; C989-L995 VanDerWaalsContact SG-CA 3.54Å
996	Y	80.5	Confident	77.2	Confident	161 Å²	161	76.6 Å²	76.6	63%	0.631	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.3	115.4	175.8	-171	-94.8	0	0	0	109.7	K994 G998 T999 I1001	K994-Y996 PolarHBondContact O-N 3.09Å; Y996-G998 VanDerWaalsContact C-N 3.32Å; Y996-G998 PolarHBondContact O-N 3.08Å; Y996-T999 PolarHBondContact N-O 3Å; Y996-T999 PolarHBondContact O-N 3.49Å; Y996-I1001 HydrophobicContact CD1-CD1 4.4Å; Y996-I1001 HydrophobicContact CG-CD1 3.95Å
997	N	81.7	Confident	74.7	Confident	119 Å²	119	84.1 Å²	84.1	64%	0.636	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	47	50.1	179.3	-158.2	33.7	0	0	0	113.8	T999	N997-T999 PolarHBondContact O-N 2.8Å
998	G	82.2	Confident	72.1	Confident	15 Å²	15	87.6 Å²	87.6	16%	0.155	48%	0.476	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.1	0.9	-179	0	0	0	0	0	115.6	C986 Y996	C986-G998 WeakPolarHBondContact CA-O 3.46Å; C986-G998 WeakPolarHBondContact CB-O 3.38Å; C986-G998 PolarHBondContact N-O 2.91Å; Y996-G998 VanDerWaalsContact C-N 3.32Å; Y996-G998 PolarHBondContact O-N 3.08Å
999	T	82.5	Confident	69.4	Low	39 Å²	39	95.2 Å²	95.2	24%	0.239	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	146	180	-50.9	0	0	0	0	110.8	Y996 N997 N1209	Y996-T999 PolarHBondContact N-O 3Å; Y996-T999 PolarHBondContact O-N 3.49Å; N997-T999 PolarHBondContact O-N 2.8Å; T999-N1209 PolarHBondContact OG1-ND2 3.36Å
1000	C	85	Confident	66.6	Low	11 Å²	11	99.8 Å²	99.8	7%	0.074	53%	0.533	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	123.1	180	-60.9	0	0	0	0	111.5	G976 C986 C989 L993	G976-C1000 PolarHBondContact O-SG 2.99Å; G976-C1000 VanDerWaalsContact O-SG 3.33Å; C986-C1000 PolarHBondContact SG-SG 2.88Å; C989-C1000 WeakPolarHBondContact CA-SG 3.32Å; C989-C1000 HydrophobicContact CB-CB 3.8Å; C989-C1000 WeakPolarHBondContact CB-SG 2.94Å; C989-C1000 WeakPolarHBondContact SG-CA 3.49Å; C989-C1000 WeakPolarHBondContact SG-CB 3.35Å; C989-C1000 CovalentContact SG-SG 2.03Å; C989-C1000 PolarHBondContact SG-SG 3.12Å; L993-C1000 HydrophobicContact CB-CB 4.06Å; L993-C1000 HydrophobicContact CD1-CB 4.03Å
1001	I	80.6	Confident	64	Low	76 Å²	76	106.1 Å²	106.1	39%	0.39	57%	0.567	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.9	156.6	-175.2	62.8	169	0	0	0	113.3	K994 Y996	K994-I1001 PolarHBondContact N-O 2.77Å; K994-I1001 PolarHBondContact O-N 2.9Å; Y996-I1001 HydrophobicContact CD1-CD1 4.4Å; Y996-I1001 HydrophobicContact CG-CD1 3.95Å
1002	L	75	Confident	61.4	Low	86 Å²	86	111.3 Å²	111.3	45%	0.45	58%	0.581	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.5	133.9	176.9	-74.9	153.3	0	0	0	111.2	L993 L1045	L993-L1002 HydrophobicContact CD2-CD2 3.92Å; L993-L1002 HydrophobicContact CD2-CG 3.79Å; L1002-L1045 HydrophobicContact CD1-CD1 4.16Å
1003	S	64.2	Low	59	Low	67 Å²	67	114.9 Å²	114.9	47%	0.469	59%	0.59	S	S	.	*			trans	-69.6	130.8	177.7	-71	0	0	0	0	111.6	K994	K994-S1003 VanDerWaalsContact CD-OG 3.31Å; K994-S1003 WeakPolarHBondContact CD-OG 3.05Å; K994-S1003 WeakPolarHBondContact CE-OG 3.45Å; K994-S1003 PolarHBondContact NZ-OG 3.37Å
1004	S	54.3	Low	56.4	Low	112 Å²	112	119.8 Å²	119.8	78%	0.783	63%	0.626	S	S	*	*			trans	-115.3	67.5	-177.9	-54.1	0	0	0	0	111.3
1005	D	43.3	Very low	53.7	Low	146 Å²	146	118.2 Å²	118.2	78%	0.781	63%	0.632	S	S	*	*			trans	-137.3	96.9	175.5	-77	-44.2	0	0	0	110.3
1006	D	39.9	Very low	51	Low	166 Å²	166	119.5 Å²	119.5	89%	0.888	65%	0.647	S	S	*	*			trans	-163.8	42.5	158.9	-104.1	-17.9	0	0	0	110.8
1007	N	39.2	Very low	48.3	Very low	162 Å²	162	119.3 Å²	119.3	87%	0.866	66%	0.658	S	S	*	*			trans	-99.2	75.4	167.9	-83.8	-22.5	0	0	0	108.9
1008	N	34.6	Very low	45.7	Very low	149 Å²	149	118.8 Å²	118.8	80%	0.797	66%	0.663	S	S	*	*			trans	-176	74.7	159.9	-101	-11	0	0	0	112.6
1009	K	32.8	Very low	43	Very low	216 Å²	216	126.8 Å²	126.8	94%	0.939	70%	0.696	S	S	*	*			trans	-143.2	83.5	149.3	-77.8	-165.1	-179.6	170	0	109.6
1010	T	31.1	Very low	40.4	Very low	114 Å²	114	133.5 Å²	133.5	70%	0.699	73%	0.729	S	S	*	*			trans	-75.6	150.9	165.2	39.1	0	0	0	0	111.1
1011	D	29	Very low	37.7	Very low	145 Å²	145	136.2 Å²	136.2	78%	0.775	76%	0.759	S	S	*	*			trans	100.7	112.3	152.8	-61.1	-27.2	0	0	0	121.4
1012	K	26.1	Very low	35.2	Very low	189 Å²	189	141 Å²	141	82%	0.822	79%	0.785	S	S	*	*			trans	76.5	94.1	149.1	-68.8	177.8	179.8	174.9	0	118.5
1013	F	28.4	Very low	33.1	Very low	210 Å²	210	148.8 Å²	148.8	92%	0.921	81%	0.809	S	S	*	*				-148.2	92.9	126.7	-113.3	-85.7	0	0	0	109.5
1014	S	27.8	Very low	31.6	Very low	119 Å²	119	153.7 Å²	153.7	83%	0.832	82%	0.821	S	S	*	*			trans	-94.9	113.2	163.1	-74.3	0	0	0	0	107.8
1015	S	26.8	Very low	31	Very low	98 Å²	98	153.5 Å²	153.5	69%	0.685	82%	0.82	S	S	*	*			trans	168	132.7	140.6	51	0	0	0	0	112
1016	S	25.6	Very low	31.1	Very low	109 Å²	109	153.5 Å²	153.5	76%	0.762	82%	0.82	S	S	*	*			trans	68.1	104.8	152.7	60.2	0	0	0	0	120.2
1017	N	24.7	Very low	31.8	Very low	158 Å²	158	153.4 Å²	153.4	85%	0.845	81%	0.814	S	S	*	*			trans	47.8	119.7	134.6	-90.5	-5.8	0	0	0	120.9
1018	S	27.5	Very low	33	Very low	107 Å²	107	146.9 Å²	146.9	75%	0.748	78%	0.78	S	S	*	*			trans	75.6	116.9	146.5	68	0	0	0	0	118.8
1019	Q	25.5	Very low	34.1	Very low	184 Å²	184	142.6 Å²	142.6	86%	0.86	77%	0.772	S	S	*	*			trans	85.2	128.9	155.4	-62.5	-177.3	-12	0	0	118.7
1020	I	27.8	Very low	35.6	Very low	180 Å²	180	133.4 Å²	133.4	92%	0.923	74%	0.735	S	S	*	*			trans	93.6	110.9	165.1	-52.7	164.8	0	0	0	116.2
1021	G	27.5	Very low	37.7	Very low	68 Å²	68	136.3 Å²	136.3	70%	0.701	74%	0.74	S	S	*	*			trans	127.9	51.9	142.4	0	0	0	0	0	119.2	R1023	G1021-R1023 PolarHBondContact O-N 3.01Å
1022	N	28.4	Very low	40.2	Very low	175 Å²	175	130.5 Å²	130.5	94%	0.936	71%	0.711	S	S	*	*			trans	-62	99.3	165.4	-113.4	-14.6	0	0	0	110.4
1023	R	30.1	Very low	42.9	Very low	251 Å²	251	122 Å²	122	95%	0.947	68%	0.675	S	S	*	*			trans	-86.8	125.3	172.5	-128.9	179.5	-173.8	-165.9	1	109.7	G1021	G1021-R1023 PolarHBondContact O-N 3.01Å
1024	K	33.8	Very low	45.4	Very low	169 Å²	169	114.7 Å²	114.7	74%	0.735	65%	0.65	S	S	*	*			trans	-46	130	-173.5	-68.7	165.1	173.5	177.6	0	115.4
1025	S	40.5	Very low	47.9	Very low	108 Å²	108	111.5 Å²	111.5	76%	0.755	63%	0.626	S	S	*	*			trans	-88.8	131	156.7	173.8	0	0	0	0	109.2	H1027	S1025-H1027 PolarHBondContact O-N 2.96Å
1026	N	46.7	Very low	50.6	Low	146 Å²	146	107.9 Å²	107.9	78%	0.781	60%	0.6	S	S	*	*			trans	-70.1	77.1	-176.2	-70.5	-20.7	0	0	0	112.5
1027	H	54.1	Low	53.1	Low	165 Å²	165	103.7 Å²	103.7	76%	0.764	57%	0.568	S	S	*	*			trans	-84.4	114.2	169.7	-118.5	61.5	0	0	0	110.1	S1025 G1029	S1025-H1027 PolarHBondContact O-N 2.96Å; H1027-G1029 PolarHBondContact O-N 3.35Å; H1027-G1029 VanDerWaalsContact O-N 3.08Å
1028	C	63.7	Low	55.2	Low	24 Å²	24	100.4 Å²	100.4	16%	0.162	55%	0.55	C	S	.	*			trans	-55.9	115.4	161.9	-63.8	0	0	0	0	106.7	S1030 C1036	C1028-S1030 PolarHBondContact O-N 3.5Å; C1028-C1036 WeakPolarHBondContact CA-SG 3.31Å; C1028-C1036 HydrophobicContact CB-CB 3.92Å; C1028-C1036 WeakPolarHBondContact CB-SG 3.41Å; C1028-C1036 WeakPolarHBondContact SG-CB 3.44Å; C1028-C1036 PolarHBondContact SG-N 3.38Å; C1028-C1036 CovalentContact SG-SG 2.04Å; C1028-C1036 PolarHBondContact SG-SG 3.46Å
1029	G	59.1	Low	57	Low	59 Å²	59	96.4 Å²	96.4	61%	0.608	53%	0.526	S	S	*	.	S	Bend	trans	-62.6	-1.8	-166.8	0	0	0	0	0	114.9	H1027 R1165	H1027-G1029 PolarHBondContact O-N 3.35Å; H1027-G1029 VanDerWaalsContact O-N 3.08Å; G1029-R1165 PolarHBondContact O-NH1 3.47Å; G1029-R1165 PolarHBondContact O-NH2 3.49Å
1030	S	64.2	Low	58.5	Low	24 Å²	24	94.9 Å²	94.9	17%	0.168	53%	0.529	C	S	.	.			trans	-115.5	128.9	178.8	72	0	0	0	0	115.3	C1028 S1032 C1033	C1028-S1030 PolarHBondContact O-N 3.5Å; S1030-S1032 WeakPolarHBondContact CB-OG 3.43Å; S1030-S1032 PolarHBondContact O-N 3.36Å; S1030-S1032 VanDerWaalsContact O-N 3.13Å; S1030-S1032 PolarHBondContact OG-OG 3.5Å; S1030-C1033 PolarHBondContact O-N 3.08Å; S1030-C1033 VanDerWaalsContact O-O 3.13Å; S1030-C1033 WeakPolarHBondContact OG-CB 3.5Å; S1030-C1033 PolarHBondContact OG-N 3.43Å
1031	E	74.9	Confident	59.8	Low	174 Å²	174	90.2 Å²	90.2	81%	0.813	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-24.7	172	-168.8	174.7	-171.1	0	0	112.3	S1048	E1031-S1048 WeakPolarHBondContact O-CB 3.48Å; E1031-S1048 PolarHBondContact O-OG 3.44Å
1032	S	81.1	Confident	61.8	Low	24 Å²	24	92.7 Å²	92.7	17%	0.168	50%	0.495	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-17.3	177.9	63	0	0	0	0	114.5	S1030 S1048 Y1051 C1193	S1030-S1032 WeakPolarHBondContact CB-OG 3.43Å; S1030-S1032 PolarHBondContact O-N 3.36Å; S1030-S1032 VanDerWaalsContact O-N 3.13Å; S1030-S1032 PolarHBondContact OG-OG 3.5Å; S1032-S1048 PolarHBondContact O-N 3.47Å; S1032-Y1051 VanDerWaalsContact CB-CE1 3.45Å; S1032-C1193 WeakPolarHBondContact O-CB 3.49Å; S1032-C1193 PolarHBondContact O-SG 3.19Å
1033	C	82.5	Confident	64.2	Low	10 Å²	10	84.8 Å²	84.8	7%	0.068	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	117.5	-174.4	-175.1	0	0	0	0	110.5	S1030 T1035 C1044	S1030-C1033 PolarHBondContact O-N 3.08Å; S1030-C1033 VanDerWaalsContact O-O 3.13Å; S1030-C1033 WeakPolarHBondContact OG-CB 3.5Å; S1030-C1033 PolarHBondContact OG-N 3.43Å; C1033-T1035 PolarHBondContact SG-O 3.41Å; C1033-C1044 VanDerWaalsContact CA-SG 3.54Å; C1033-C1044 HydrophobicContact CB-CB 4Å; C1033-C1044 WeakPolarHBondContact CB-SG 3.41Å; C1033-C1044 WeakPolarHBondContact SG-CA 3.46Å; C1033-C1044 WeakPolarHBondContact SG-CB 3.32Å; C1033-C1044 CovalentContact SG-SG 2.03Å; C1033-C1044 PolarHBondContact SG-SG 3.11Å
1034	S	81.7	Confident	66.8	Low	57 Å²	57	73.2 Å²	73.2	40%	0.399	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	-38.7	-178.3	61.2	0	0	0	0	112.4	Q1046	S1034-Q1046 PolarHBondContact N-O 3.11Å; S1034-Q1046 WeakPolarHBondContact OG-CB 3.05Å; S1034-Q1046 PolarHBondContact OG-O 2.6Å
1035	T	80.4	Confident	69.1	Low	52 Å²	52	66.5 Å²	66.5	32%	0.319	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	137.6	176.6	59.9	0	0	0	0	110.2	C1033 L1045 Q1046	C1033-T1035 PolarHBondContact SG-O 3.41Å; T1035-L1045 PolarHBondContact O-N 3.16Å; T1035-Q1046 PolarHBondContact N-O 3.15Å; T1035-Q1046 PolarHBondContact O-N 3.46Å; T1035-Q1046 WeakPolarHBondContact OG1-CB 3.26Å; T1035-Q1046 PolarHBondContact OG1-N 3.23Å
1036	C	83.1	Confident	71.1	Confident	22 Å²	22	66.9 Å²	66.9	15%	0.149	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	151.2	-175.9	57.8	0	0	0	0	110.5	C1028 T1043	C1028-C1036 WeakPolarHBondContact CA-SG 3.31Å; C1028-C1036 HydrophobicContact CB-CB 3.92Å; C1028-C1036 WeakPolarHBondContact CB-SG 3.41Å; C1028-C1036 WeakPolarHBondContact SG-CB 3.44Å; C1028-C1036 PolarHBondContact SG-N 3.38Å; C1028-C1036 CovalentContact SG-SG 2.04Å; C1028-C1036 PolarHBondContact SG-SG 3.46Å; C1036-T1043 WeakPolarHBondContact CA-O 3.41Å
1037	Y	78.4	Confident	73	Confident	21 Å²	21	61 Å²	61	8%	0.082	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	121.3	172.5	172.9	-111.4	0	0	0	109	L990 P991 D992 L993 G1039 K1042 T1043	L990-Y1037 HydrophobicContact CB-CE1 4.04Å; L990-Y1037 HydrophobicContact CD1-CD1 3.81Å; L990-Y1037 HydrophobicContact CD1-CE1 3.73Å; P991-Y1037 WeakPolarHBondContact O-CE2 2.98Å; P991-Y1037 PolarHBondContact O-OH 2.88Å; D992-Y1037 HydrophobicContact CB-CE2 4.26Å; L993-Y1037 HydrophobicContact CD1-CD2 3.94Å; L993-Y1037 HydrophobicContact CD1-CE2 4.34Å; L993-Y1037 HydrophobicContact CD1-CG 4.25Å; L993-Y1037 HydrophobicContact CD2-CD2 3.99Å; L993-Y1037 HydrophobicContact CG-CD2 3.83Å; L993-Y1037 HydrophobicContact CG-CE2 4Å; Y1037-G1039 VanDerWaalsContact C-N 3.3Å; Y1037-G1039 PolarHBondContact O-N 3.42Å; Y1037-K1042 WeakPolarHBondContact O-CA 3.06Å; Y1037-T1043 HydrophobicContact CD1-CG2 4.07Å; Y1037-T1043 PolarHBondContact N-O 2.77Å; Y1037-T1043 PolarHBondContact O-N 3.27Å
1038	D	69.1	Low	74.4	Confident	88 Å²	88	54.3 Å²	54.3	47%	0.471	31%	0.314	S	S	.	.			trans	-91.7	44.7	-176	-91.1	1.6	0	0	0	112.2	K1042	D1038-K1042 WeakPolarHBondContact OD1-CD 2.98Å; D1038-K1042 WeakPolarHBondContact OD1-CE 3.31Å; D1038-K1042 WeakPolarHBondContact OD1-CG 3.46Å; D1038-K1042 IonicContact OD1-NZ 3.34Å; D1038-K1042 PolarHBondContact OD1-NZ 3.16Å; D1038-K1042 IonicContact OD2-NZ 3.16Å; D1038-K1042 PolarHBondContact OD2-NZ 2.82Å
1039	G	64.1	Low	75.3	Confident	23 Å²	23	58.5 Å²	58.5	24%	0.237	34%	0.341	C	S	.	.	S	Bend	trans	-75.8	-164.9	170.5	0	0	0	0	0	113.6	Y1037 E1041	Y1037-G1039 VanDerWaalsContact C-N 3.3Å; Y1037-G1039 PolarHBondContact O-N 3.42Å; G1039-E1041 PolarHBondContact O-N 3.14Å
1040	V	57.8	Low	76.3	Confident	153 Å²	153	61.7 Å²	61.7	93%	0.927	34%	0.344	S	S	*	.	S	Bend	trans	-49.3	-33.8	-178.9	-172.9	0	0	0	0	112.6
1041	E	55.3	Low	77.5	Confident	82 Å²	82	64 Å²	64	38%	0.383	35%	0.35	S	S	.	.	S	Bend	trans	-131.3	128.8	166.3	-61	-163.8	178.6	0	0	110.5	G1039 T1043 K1063 K1190	G1039-E1041 PolarHBondContact O-N 3.14Å; E1041-T1043 PolarHBondContact O-N 2.95Å; E1041-K1063 IonicContact OE1-NZ 2.65Å; E1041-K1063 PolarHBondContact OE1-NZ 3.21Å; E1041-K1190 IonicContact OE2-NZ 2.89Å; E1041-K1190 PolarHBondContact OE2-NZ 3.02Å
1042	K	68.3	Low	78.1	Confident	119 Å²	119	57.5 Å²	57.5	52%	0.517	32%	0.319	S	S	.	.			trans	-60.8	120.1	177.5	-63.9	-171.8	179.5	-111.1	0	110.6	Y1037 D1038 K1190	Y1037-K1042 WeakPolarHBondContact O-CA 3.06Å; D1038-K1042 WeakPolarHBondContact OD1-CD 2.98Å; D1038-K1042 WeakPolarHBondContact OD1-CE 3.31Å; D1038-K1042 WeakPolarHBondContact OD1-CG 3.46Å; D1038-K1042 IonicContact OD1-NZ 3.34Å; D1038-K1042 PolarHBondContact OD1-NZ 3.16Å; D1038-K1042 IonicContact OD2-NZ 3.16Å; D1038-K1042 PolarHBondContact OD2-NZ 2.82Å; K1042-K1190 WeakPolarHBondContact O-CE 3.45Å
1043	T	79.4	Confident	78.4	Confident	10 Å²	10	56.8 Å²	56.8	6%	0.061	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	143.2	174.9	-171.2	0	0	0	0	109.9	C1036 Y1037 E1041 F1191	C1036-T1043 WeakPolarHBondContact CA-O 3.41Å; Y1037-T1043 HydrophobicContact CD1-CG2 4.07Å; Y1037-T1043 PolarHBondContact N-O 2.77Å; Y1037-T1043 PolarHBondContact O-N 3.27Å; E1041-T1043 PolarHBondContact O-N 2.95Å; T1043-F1191 PolarHBondContact OG1-N 3.36Å
1044	C	84.1	Confident	78.6	Confident	7 Å²	7	57 Å²	57	5%	0.047	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	127.3	178.8	-166.4	0	0	0	0	110.6	P975 C1033 Q1046 F1191 C1193	P975-C1044 WeakPolarHBondContact CB-O 3.2Å; C1033-C1044 VanDerWaalsContact CA-SG 3.54Å; C1033-C1044 HydrophobicContact CB-CB 4Å; C1033-C1044 WeakPolarHBondContact CB-SG 3.41Å; C1033-C1044 WeakPolarHBondContact SG-CA 3.46Å; C1033-C1044 WeakPolarHBondContact SG-CB 3.32Å; C1033-C1044 CovalentContact SG-SG 2.03Å; C1033-C1044 PolarHBondContact SG-SG 3.11Å; C1044-Q1046 PolarHBondContact SG-O 3.45Å; C1044-F1191 WeakPolarHBondContact CB-O 3.25Å; C1044-F1191 PolarHBondContact N-O 2.77Å; C1044-C1193 PolarHBondContact SG-SG 2.78Å
1045	L	82.3	Confident	78.7	Confident	29 Å²	29	55.1 Å²	55.1	15%	0.152	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-41.3	176.2	-63.3	179.9	0	0	0	111.4	P975 L993 L1002 T1035	P975-L1045 HydrophobicContact CB-CD2 4.07Å; L993-L1045 HydrophobicContact CD1-CD2 4.37Å; L993-L1045 HydrophobicContact CD2-CD1 4.27Å; L1002-L1045 HydrophobicContact CD1-CD1 4.16Å; T1035-L1045 PolarHBondContact O-N 3.16Å
1046	Q	82.5	Confident	78.5	Confident	115 Å²	115	55.4 Å²	55.4	54%	0.537	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	133.8	179.5	-168.3	177.3	-1.8	0	0	110.8	S1034 T1035 C1044	S1034-Q1046 PolarHBondContact N-O 3.11Å; S1034-Q1046 WeakPolarHBondContact OG-CB 3.05Å; S1034-Q1046 PolarHBondContact OG-O 2.6Å; T1035-Q1046 PolarHBondContact N-O 3.15Å; T1035-Q1046 PolarHBondContact O-N 3.46Å; T1035-Q1046 WeakPolarHBondContact OG1-CB 3.26Å; T1035-Q1046 PolarHBondContact OG1-N 3.23Å; C1044-Q1046 PolarHBondContact SG-O 3.45Å
1047	C	86.4	Confident	77.3	Confident	24 Å²	24	56.2 Å²	56.2	16%	0.162	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	148.8	178	-62.8	0	0	0	0	112.2	C1193	C1047-C1193 WeakPolarHBondContact CA-SG 3.33Å; C1047-C1193 HydrophobicContact CB-CB 3.71Å; C1047-C1193 WeakPolarHBondContact CB-SG 3.26Å; C1047-C1193 WeakPolarHBondContact SG-CB 3.45Å; C1047-C1193 CovalentContact SG-SG 2.03Å; C1047-C1193 PolarHBondContact SG-SG 3.49Å
1048	S	85.1	Confident	75.9	Confident	23 Å²	23	60.4 Å²	60.4	16%	0.161	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-62.4	157.5	168.6	-61.3	0	0	0	0	111.1	E1031 S1032 N1050 Y1051	E1031-S1048 WeakPolarHBondContact O-CB 3.48Å; E1031-S1048 PolarHBondContact O-OG 3.44Å; S1032-S1048 PolarHBondContact O-N 3.47Å; S1048-N1050 PolarHBondContact O-N 2.8Å; S1048-Y1051 WeakPolarHBondContact O-CB 3.4Å; S1048-Y1051 PolarHBondContact O-N 2.91Å; S1048-Y1051 VanDerWaalsContact O-N 3.11Å
1049	P	81.4	Confident	74.4	Confident	112 Å²	112	64.7 Å²	64.7	73%	0.727	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	138.6	177	-24.6	33.3	0	0	0	112.3	Y1051	P1049-Y1051 VanDerWaalsContact C-N 3.31Å
1050	N	80.8	Confident	73	Confident	126 Å²	126	65.6 Å²	65.6	67%	0.674	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.2	7.5	-174.1	-47.9	-48.7	0	0	0	116.6	S1048	S1048-N1050 PolarHBondContact O-N 2.8Å
1051	Y	88	Confident	71.9	Confident	74 Å²	74	62.6 Å²	62.6	29%	0.29	33%	0.328	S	S	.	.			trans	-107.6	150.8	170.2	-67.3	-98.8	0	0	0	111.3	S1032 S1048 P1049 C1193 H1195	S1032-Y1051 VanDerWaalsContact CB-CE1 3.45Å; S1048-Y1051 WeakPolarHBondContact O-CB 3.4Å; S1048-Y1051 PolarHBondContact O-N 2.91Å; S1048-Y1051 VanDerWaalsContact O-N 3.11Å; P1049-Y1051 VanDerWaalsContact C-N 3.31Å; Y1051-C1193 HydrophobicContact CD1-CB 4.42Å; Y1051-C1193 HydrophobicContact CG-CB 4.44Å; Y1051-H1195 HydrophobicContact CD1-CB 4.29Å; Y1051-H1195 HydrophobicContact CE1-CB 4.2Å
1052	H	87.7	Confident	70.9	Confident	37 Å²	37	63.3 Å²	63.3	17%	0.171	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	142.3	-176.6	-49.6	-46.1	0	0	0	110.2	L1054 C1193 V1194 I1214	H1052-L1054 PolarHBondContact O-N 3.28Å; H1052-C1193 WeakPolarHBondContact O-CA 3.33Å; H1052-V1194 PolarHBondContact N-O 3.42Å; H1052-V1194 PolarHBondContact O-N 3.07Å; H1052-I1214 WeakPolarHBondContact CA-O 3.33Å; H1052-I1214 HydrophobicContact CB-CG2 4.33Å; H1052-I1214 VanDerWaalsContact ND1-CG2 3.25Å; H1052-I1214 WeakPolarHBondContact ND1-CG2 3.35Å
1053	L	87.9	Confident	68.9	Low	8 Å²	8	64.4 Å²	64.4	4%	0.042	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	123.4	-178.1	-165.5	79.4	0	0	0	110.4	P975 F983 F1191 I1214 M1215 C1216	P975-L1053 HydrophobicContact CG-CD1 3.85Å; P975-L1053 HydrophobicContact CG-CD2 3.45Å; P975-L1053 VanDerWaalsContact CG-CD2 3.45Å; P975-L1053 HydrophobicContact CG-CG 4.23Å; F983-L1053 HydrophobicContact CE2-CD2 4.36Å; F983-L1053 HydrophobicContact CZ-CD2 3.83Å; L1053-F1191 HydrophobicContact CD1-CB 3.82Å; L1053-F1191 HydrophobicContact CD1-CD1 4.11Å; L1053-F1191 HydrophobicContact CD1-CG 4.19Å; L1053-F1191 HydrophobicContact CD2-CD1 3.65Å; L1053-F1191 HydrophobicContact CD2-CE1 3.85Å; L1053-F1191 HydrophobicContact CD2-CG 4.26Å; L1053-F1191 HydrophobicContact CG-CB 4.26Å; L1053-F1191 HydrophobicContact CG-CD1 3.6Å; L1053-F1191 HydrophobicContact CG-CE1 4.25Å; L1053-F1191 HydrophobicContact CG-CG 4.18Å; L1053-I1214 PolarHBondContact N-O 3.32Å; L1053-M1215 HydrophobicContact CB-CB 4.15Å; L1053-M1215 CarbonylContact O-C 3.55Å; L1053-M1215 VanDerWaalsContact O-CA 3.31Å; L1053-M1215 WeakPolarHBondContact O-CA 3.4Å; L1053-C1216 PolarHBondContact O-N 3.11Å
1054	L	86.6	Confident	66.5	Low	14 Å²	14	71.5 Å²	71.5	7%	0.073	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	124.2	177.4	177.1	67.7	0	0	0	110.4	H1052 I1056 F1191 I1192 V1194 P1198 Y1201 C1216	H1052-L1054 PolarHBondContact O-N 3.28Å; L1054-I1056 HydrophobicContact CD2-CG2 4.22Å; L1054-I1056 HydrophobicContact CG-CG2 4.12Å; L1054-F1191 WeakPolarHBondContact O-CA 3.28Å; L1054-I1192 HydrophobicContact CB-CG1 4.19Å; L1054-I1192 HydrophobicContact CD2-CD1 4.31Å; L1054-I1192 HydrophobicContact CD2-CG1 4.41Å; L1054-I1192 PolarHBondContact N-O 3.05Å; L1054-I1192 PolarHBondContact O-N 3.16Å; L1054-V1194 HydrophobicContact CB-CG1 4.33Å; L1054-V1194 HydrophobicContact CB-CG2 3.94Å; L1054-V1194 HydrophobicContact CD2-CG1 3.89Å; L1054-V1194 HydrophobicContact CD2-CG2 4.26Å; L1054-P1198 HydrophobicContact CD1-CG 4.19Å; L1054-P1198 HydrophobicContact CD2-CG 3.88Å; L1054-Y1201 HydrophobicContact CD1-CD1 3.93Å; L1054-Y1201 HydrophobicContact CD1-CE1 3.89Å; L1054-Y1201 HydrophobicContact CD1-CG 4.26Å; L1054-C1216 HydrophobicContact CB-CB 4.4Å; L1054-C1216 HydrophobicContact CD1-CB 3.66Å
1055	E	83.6	Confident	63.8	Low	18 Å²	18	76 Å²	76	8%	0.084	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	130.4	171.8	-177.2	-86.7	133.7	0	0	110.3	W941 A972 T1057 K1190 F1191 K1218	W941-E1055 HydrophobicContact CH2-CG 4.14Å; W941-E1055 WeakPolarHBondContact CH2-OE1 3.47Å; W941-E1055 VanDerWaalsContact CH2-OE2 3.26Å; W941-E1055 WeakPolarHBondContact CH2-OE2 3.28Å; W941-E1055 HydrophobicContact CZ2-CG 4.4Å; W941-E1055 WeakPolarHBondContact CZ2-OE1 3.44Å; A972-E1055 HydrophobicContact CB-CG 3.7Å; E1055-T1057 VanDerWaalsContact OE1-CB 3.27Å; E1055-T1057 WeakPolarHBondContact OE1-CB 3.4Å; E1055-T1057 WeakPolarHBondContact OE1-CG2 3.43Å; E1055-T1057 PolarHBondContact OE1-N 3.14Å; E1055-T1057 PolarHBondContact OE1-OG1 2.82Å; E1055-K1190 CarbonylContact C-O 3.57Å; E1055-K1190 WeakPolarHBondContact CA-O 3.3Å; E1055-F1191 HydrophobicContact CB-CD1 4.07Å; E1055-F1191 HydrophobicContact CB-CE1 3.68Å; E1055-F1191 HydrophobicContact CB-CZ 4.37Å; E1055-F1191 HydrophobicContact CG-CE1 4.2Å; E1055-F1191 HydrophobicContact CG-CZ 4.42Å; E1055-K1218 IonicContact OE2-NZ 3Å; E1055-K1218 PolarHBondContact OE2-NZ 3.39Å
1056	I	77.9	Confident	61.1	Low	58 Å²	58	82.6 Å²	82.6	30%	0.297	44%	0.435	S	S	.	.			trans	-129.8	23.6	-172.8	59.9	154.4	0	0	0	113.9	L1054 L1058 K1190 I1192	L1054-I1056 HydrophobicContact CD2-CG2 4.22Å; L1054-I1056 HydrophobicContact CG-CG2 4.12Å; I1056-L1058 PolarHBondContact O-N 2.85Å; I1056-K1190 HydrophobicContact CD1-CB 4.48Å; I1056-K1190 HydrophobicContact CD1-CD 3.77Å; I1056-K1190 HydrophobicContact CD1-CG 3.92Å; I1056-K1190 HydrophobicContact CG1-CB 3.97Å; I1056-K1190 HydrophobicContact CG1-CD 4.17Å; I1056-K1190 HydrophobicContact CG1-CG 3.9Å; I1056-K1190 VanDerWaalsContact CG1-O 3.31Å; I1056-K1190 WeakPolarHBondContact CG1-O 3.29Å; I1056-K1190 PolarHBondContact N-O 3.28Å; I1056-I1192 HydrophobicContact CD1-CG2 3.59Å; I1056-I1192 HydrophobicContact CG1-CG2 4.2Å; I1056-I1192 HydrophobicContact CG2-CD1 3.69Å; I1056-I1192 HydrophobicContact CG2-CG1 3.66Å
1057	T	57.6	Low	58.5	Low	40 Å²	40	85.4 Å²	85.4	25%	0.245	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	120.9	-177.7	54.7	0	0	0	0	112	W941 E1055 Q1188 P1189	W941-T1057 WeakPolarHBondContact CZ2-OG1 3.42Å; E1055-T1057 VanDerWaalsContact OE1-CB 3.27Å; E1055-T1057 WeakPolarHBondContact OE1-CB 3.4Å; E1055-T1057 WeakPolarHBondContact OE1-CG2 3.43Å; E1055-T1057 PolarHBondContact OE1-N 3.14Å; E1055-T1057 PolarHBondContact OE1-OG1 2.82Å; T1057-Q1188 WeakPolarHBondContact CG2-O 3.02Å; T1057-P1189 HydrophobicContact CG2-CB 4.35Å
1058	L	48.4	Very low	55.6	Low	108 Å²	108	92.3 Å²	92.3	57%	0.565	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.1	72.3	162.8	-111.7	82.4	0	0	0	118.9	I1056 S1060	I1056-L1058 PolarHBondContact O-N 2.85Å; L1058-S1060 WeakPolarHBondContact CD1-OG 3.27Å; L1058-S1060 WeakPolarHBondContact CG-OG 3.46Å
1059	F	38.3	Very low	52.8	Low	178 Å²	178	95.9 Å²	95.9	78%	0.781	51%	0.505	S	S	*	.			trans	-73.1	15.3	130.3	-87.3	-76	0	0	0	112.4	S1061 L1062	F1059-S1061 PolarHBondContact O-N 2.64Å; F1059-L1062 HydrophobicContact CB-CD1 4.28Å; F1059-L1062 HydrophobicContact CD1-CD1 3.99Å; F1059-L1062 HydrophobicContact CG-CD1 4.48Å; F1059-L1062 WeakPolarHBondContact O-CB 3.37Å; F1059-L1062 PolarHBondContact O-N 2.82Å
1060	S	33.3	Very low	50.1	Low	43 Å²	43	94.4 Å²	94.4	30%	0.301	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-67.7	1.2	-177.9	-40.4	0	0	0	0	114.6	L1058 L1062 K1063	L1058-S1060 WeakPolarHBondContact CD1-OG 3.27Å; L1058-S1060 WeakPolarHBondContact CG-OG 3.46Å; S1060-L1062 PolarHBondContact O-N 2.8Å; S1060-K1063 PolarHBondContact O-N 2.96Å
1061	S	35.1	Very low	47.5	Very low	89 Å²	89	95.1 Å²	95.1	62%	0.622	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-60.2	-12.6	157.4	-51.9	0	0	0	0	112.7	F1059	F1059-S1061 PolarHBondContact O-N 2.64Å
1062	L	33.6	Very low	45	Very low	98 Å²	98	96 Å²	96	51%	0.513	53%	0.529	S	S	.	.	G	3₁₀ helix	trans	-94.2	0.8	175.8	-62.8	170.3	0	0	0	114.3	F1059 S1060 N1064 I1065	F1059-L1062 HydrophobicContact CB-CD1 4.28Å; F1059-L1062 HydrophobicContact CD1-CD1 3.99Å; F1059-L1062 HydrophobicContact CG-CD1 4.48Å; F1059-L1062 WeakPolarHBondContact O-CB 3.37Å; F1059-L1062 PolarHBondContact O-N 2.82Å; S1060-L1062 PolarHBondContact O-N 2.8Å; L1062-N1064 PolarHBondContact O-N 2.03Å; L1062-N1064 VanDerWaalsContact O-N 3.15Å; L1062-I1065 HydrophobicContact CD2-CD1 3.39Å; L1062-I1065 HydrophobicContact CD2-CG1 4.23Å; L1062-I1065 PolarHBondContact O-N 3.28Å; L1062-I1065 VanDerWaalsContact O-N 3.12Å
1063	K	27.8	Very low	42.1	Very low	141 Å²	141	101.1 Å²	101.1	61%	0.613	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	-8.2	173.6	-92.4	-172.6	-176.8	172.7	0	113.6	E1041 S1060	E1041-K1063 IonicContact OE1-NZ 2.65Å; E1041-K1063 PolarHBondContact OE1-NZ 3.21Å; S1060-K1063 PolarHBondContact O-N 2.96Å
1064	N	27.7	Very low	39.1	Very low	159 Å²	159	107.3 Å²	107.3	85%	0.85	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	22.9	170.9	-77.1	-8.5	0	0	0	113.7	L1062	L1062-N1064 PolarHBondContact O-N 2.03Å; L1062-N1064 VanDerWaalsContact O-N 3.15Å
1065	I	27.4	Very low	36.2	Very low	101 Å²	101	116 Å²	116	52%	0.518	63%	0.628	S	S	.	*			trans	-113.8	72.9	171.9	-49.1	-168.8	0	0	0	109	L1062 F1067	L1062-I1065 HydrophobicContact CD2-CD1 3.39Å; L1062-I1065 HydrophobicContact CD2-CG1 4.23Å; L1062-I1065 PolarHBondContact O-N 3.28Å; L1062-I1065 VanDerWaalsContact O-N 3.12Å; I1065-F1067 HydrophobicContact CG2-CB 4.1Å; I1065-F1067 PolarHBondContact O-N 3.47Å
1066	D	25.7	Very low	33.4	Very low	168 Å²	168	121.2 Å²	121.2	90%	0.898	66%	0.662	S	S	*	*			trans	-71.3	68.5	159.6	-85.9	-25.2	0	0	0	109
1067	F	28	Very low	31.7	Very low	175 Å²	175	124.2 Å²	124.2	77%	0.768	69%	0.685	S	S	*	*			trans	-97.4	126.9	156.8	-116.6	-99.6	0	0	0	105.6	I1065	I1065-F1067 HydrophobicContact CG2-CB 4.1Å; I1065-F1067 PolarHBondContact O-N 3.47Å
1068	L	26.8	Very low	30.1	Very low	168 Å²	168	127.8 Å²	127.8	88%	0.88	71%	0.712	S	S	*	*	S	Bend	trans	100	59.4	172.8	-46	175.5	0	0	0	117.2
1069	S	25.3	Very low	29.3	Very low	98 Å²	98	128 Å²	128	69%	0.685	72%	0.722	S	S	*	*			trans	-151.3	68.3	143.5	176.6	0	0	0	0	110.5	N1071	S1069-N1071 VanDerWaalsContact C-N 3.28Å; S1069-N1071 PolarHBondContact O-N 3.39Å
1070	G	24.2	Very low	28.6	Very low	82 Å²	82	127.2 Å²	127.2	85%	0.845	73%	0.725	S	S	*	*			trans	-68.1	93.4	156.1	0	0	0	0	0	107.8	P1072	G1070-P1072 WeakPolarHBondContact O-CD 3.35Å
1071	N	26.5	Very low	28.1	Very low	140 Å²	140	129.6 Å²	129.6	75%	0.749	74%	0.742	S	S	*	*			trans	-91.1	110.2	168.8	-163.6	10.1	0	0	0	107.8	S1069	S1069-N1071 VanDerWaalsContact C-N 3.28Å; S1069-N1071 PolarHBondContact O-N 3.39Å
1072	P	36.4	Very low	27.6	Very low	94 Å²	94	130.3 Å²	130.3	61%	0.61	75%	0.746	S	S	*	*			trans	-81.1	124.7	175.4	32.9	-26.9	0	0	0	107.2	G1070	G1070-P1072 WeakPolarHBondContact O-CD 3.35Å
1073	N	26.3	Very low	27.4	Very low	143 Å²	143	132.1 Å²	132.1	77%	0.765	76%	0.756	S	S	*	*			trans	169.3	106.1	143.4	-79.7	-25.4	0	0	0	109.9
1074	N	25	Very low	27.2	Very low	139 Å²	139	133 Å²	133	74%	0.743	77%	0.766	S	S	*	*			trans	67.5	126	161.7	-55	-19.6	0	0	0	115.5
1075	F	26	Very low	27.1	Very low	195 Å²	195	132.4 Å²	132.4	86%	0.855	76%	0.762	S	S	*	*				-165.9	149	70.1	-102	-92.9	0	0	0	112.4
1076	T	23.8	Very low	26.9	Very low	129 Å²	129	132 Å²	132	79%	0.791	77%	0.768	S	S	*	*			trans	-73	172.9	178.3	41.5	0	0	0	0	114.3
1077	P	42	Very low	26.8	Very low	121 Å²	121	128.9 Å²	128.9	79%	0.786	76%	0.759	S	S	*	*			trans	-102.1	155.6	-144.6	39.3	-34.2	0	0	0	115.4
1078	S	23.6	Very low	26.7	Very low	115 Å²	115	125.8 Å²	125.8	80%	0.804	76%	0.759	S	S	*	*			trans	-179.5	126.9	150.7	53.9	0	0	0	0	112.8
1079	S	32.6	Very low	26.8	Very low	111 Å²	111	124 Å²	124	78%	0.776	76%	0.758	S	S	*	*			trans	143.6	79.9	145.9	66.7	0	0	0	0	110.7
1080	L	24	Very low	26.7	Very low	162 Å²	162	125.2 Å²	125.2	85%	0.848	76%	0.762	S	S	*	*				52.4	111.7	88	-74.2	169.3	0	0	0	115.4
1081	S	23.1	Very low	26.6	Very low	94 Å²	94	126.4 Å²	126.4	66%	0.657	76%	0.757	S	S	*	*				85.7	114.2	127.5	-52.6	0	0	0	0	120.5
1082	S	24.6	Very low	26.5	Very low	103 Å²	103	125 Å²	125	72%	0.72	76%	0.758	S	S	*	*				102.9	146.7	114.4	68.8	0	0	0	0	120.9
1083	I	27.9	Very low	25.9	Very low	137 Å²	137	125.2 Å²	125.2	70%	0.703	76%	0.762	S	S	*	*			trans	106.1	95.8	153.6	-54	158	0	0	0	113.2
1084	L	23.6	Very low	25.7	Very low	158 Å²	158	123.5 Å²	123.5	83%	0.827	76%	0.761	S	S	*	*				65.5	144.9	74.1	-80	158.8	0	0	0	115.3
1085	L	26.7	Very low	25.5	Very low	148 Å²	148	121.8 Å²	121.8	78%	0.775	76%	0.76	S	S	*	*			trans	102.3	104.6	162.8	-55.9	160.6	0	0	0	114.1
1086	S	23.1	Very low	25.4	Very low	93 Å²	93	119.3 Å²	119.3	65%	0.65	76%	0.76	S	S	*	*				92.6	135.5	50.1	73.7	0	0	0	0	114.7
1087	S	22.5	Very low	25.5	Very low	101 Å²	101	118.8 Å²	118.8	71%	0.706	76%	0.762	S	S	*	*			trans	72.4	108.9	150.2	58.7	0	0	0	0	120.6
1088	S	26.2	Very low	24.5	Very low	110 Å²	110	122.2 Å²	122.2	77%	0.769	76%	0.764	S	S	*	*				29.1	133.2	124.6	-43.2	0	0	0	0	119.3
1089	P	29.8	Very low	24.4	Very low	132 Å²	132	124.9 Å²	124.9	86%	0.857	76%	0.762	S	S	*	*				-139.3	133.3	118.9	26.6	-7.8	0	0	0	114.5
1090	T	21.9	Very low	24.1	Very low	123 Å²	123	127.6 Å²	127.6	76%	0.755	77%	0.768	S	S	*	*			trans	-75.9	137.9	168.2	42.9	0	0	0	0	112.2
1091	S	23.9	Very low	24	Very low	106 Å²	106	127.5 Å²	127.5	74%	0.741	76%	0.763	S	S	*	*			trans	19.8	119.5	140.9	61.4	0	0	0	0	119.7
1092	S	23.9	Very low	24	Very low	110 Å²	110	129.2 Å²	129.2	77%	0.769	77%	0.77	S	S	*	*				-177.1	127.3	122.7	50.1	0	0	0	0	113.6
1093	S	22.6	Very low	23.9	Very low	99 Å²	99	129.2 Å²	129.2	69%	0.692	77%	0.77	S	S	*	*			trans	58.8	121.8	138.7	62.4	0	0	0	0	122.5
1094	S	22.1	Very low	23.7	Very low	108 Å²	108	129.6 Å²	129.6	76%	0.755	77%	0.773	S	S	*	*				99.3	129.4	118.6	61.5	0	0	0	0	121.6
1095	S	22.3	Very low	23.9	Very low	103 Å²	103	128.4 Å²	128.4	72%	0.72	77%	0.773	S	S	*	*			trans	75.8	93.4	146.4	55.6	0	0	0	0	120.5
1096	V	22.9	Very low	23.8	Very low	142 Å²	142	127.7 Å²	127.7	86%	0.861	77%	0.77	S	S	*	*				25.6	115.3	112.8	-174.6	0	0	0	0	116.9
1097	S	26.2	Very low	23.9	Very low	119 Å²	119	130 Å²	130	83%	0.832	78%	0.775	S	S	*	*			trans	-157.8	142	132.9	52.2	0	0	0	0	111.2
1098	K	21.5	Very low	24	Very low	192 Å²	192	130.3 Å²	130.3	84%	0.835	78%	0.777	S	S	*	*			trans	-79	150	-166.6	-85.4	167	167.4	174	0	113.4
1099	F	21.5	Very low	24	Very low	171 Å²	171	131.7 Å²	131.7	75%	0.75	78%	0.781	S	S	*	*			trans	19.8	126	134.6	-82.9	-97.2	0	0	0	118.5
1100	N	24.9	Very low	23.7	Very low	168 Å²	168	132.9 Å²	132.9	90%	0.898	78%	0.778	S	S	*	*				-153.3	125.4	123.8	-103.4	-12.8	0	0	0	110.7
1101	E	22	Very low	23.9	Very low	160 Å²	160	134.3 Å²	134.3	75%	0.748	78%	0.78	S	S	*	*			trans	-59.1	150.9	167.6	-65.2	168.6	137.2	0	0	110.9
1102	T	24.7	Very low	23.9	Very low	130 Å²	130	134.3 Å²	134.3	80%	0.798	78%	0.78	S	S	*	*				-177.6	122.8	129.1	23.8	0	0	0	0	111.4
1103	S	22.5	Very low	23.9	Very low	104 Å²	104	134 Å²	134	73%	0.727	78%	0.777	S	S	*	*			trans	68.5	100.8	132.2	-51.9	0	0	0	0	120.3
1104	N	23.3	Very low	24.1	Very low	144 Å²	144	136.7 Å²	136.7	77%	0.77	78%	0.784	S	S	*	*				62.9	105.4	109.1	-152.3	12.3	0	0	0	117.4
1105	T	26.6	Very low	24.3	Very low	133 Å²	133	139.6 Å²	139.6	82%	0.816	79%	0.789	S	S	*	*			trans	-164.7	113.1	143.1	19.2	0	0	0	0	111.8
1106	N	25.3	Very low	24.4	Very low	133 Å²	133	140.3 Å²	140.3	71%	0.711	79%	0.792	S	S	*	*			trans	14.6	136.6	143.1	-59.6	-25.8	0	0	0	121.1
1107	N	24.7	Very low	24.4	Very low	143 Å²	143	143 Å²	143	77%	0.765	80%	0.795	S	S	*	*			trans	85.1	103.6	146.4	-70.4	-8.7	0	0	0	119.5
1108	S	26.2	Very low	24.4	Very low	107 Å²	107	144.2 Å²	144.2	75%	0.748	79%	0.791	S	S	*	*			trans	59.7	100.1	132.5	57.6	0	0	0	0	118.2
1109	T	24.6	Very low	24.6	Very low	139 Å²	139	141.8 Å²	141.8	85%	0.853	79%	0.793	S	S	*	*			trans	-150.9	132.1	139.5	1.7	0	0	0	0	111.4
1110	I	24.5	Very low	24.7	Very low	156 Å²	156	138.5 Å²	138.5	80%	0.8	80%	0.797	S	S	*	*			trans	-64.1	120.7	-177.8	-66.1	152.4	0	0	0	110
1111	I	24.8	Very low	24.8	Very low	154 Å²	154	138.8 Å²	138.8	79%	0.79	80%	0.798	S	S	*	*			trans	-122.6	100.2	162.9	-62.4	178.2	0	0	0	107.3
1112	S	24	Very low	24.9	Very low	106 Å²	106	137.3 Å²	137.3	74%	0.741	80%	0.8	S	S	*	*			trans	-68.2	123.1	167.6	-64.6	0	0	0	0	108.6
1113	S	24.9	Very low	24.9	Very low	102 Å²	102	136.1 Å²	136.1	71%	0.713	80%	0.803	S	S	*	*			trans	-132.4	97.7	171	46.1	0	0	0	0	110.8
1114	N	26.2	Very low	25	Very low	157 Å²	157	136.9 Å²	136.9	84%	0.84	80%	0.804	S	S	*	*			trans	40.4	119	130.6	-60	-19.3	0	0	0	120.2
1115	I	25.6	Very low	25.1	Very low	168 Å²	168	136.4 Å²	136.4	86%	0.862	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-80.5	132.5	179.7	-64.4	165.6	0	0	0	110.1
1116	P	25.9	Very low	25.1	Very low	119 Å²	119	137.3 Å²	137.3	77%	0.773	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-84.7	147.8	-179.4	31.6	-31.9	0	0	0	114.2
1117	E	23.2	Very low	25.1	Very low	198 Å²	198	136.3 Å²	136.3	93%	0.925	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-62.1	141	-174.1	-74	168.8	121.8	0	0	115.5
1118	L	26.3	Very low	25.2	Very low	144 Å²	144	136.3 Å²	136.3	75%	0.754	82%	0.815	S	S	*	*			trans	-114.5	123	179.1	-155.6	83	0	0	0	110
1119	T	23.9	Very low	25	Very low	141 Å²	141	137.4 Å²	137.4	87%	0.865	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-94.7	121.9	175.6	42	0	0	0	0	110.7
1120	A	25.1	Very low	25.1	Very low	103 Å²	103	138 Å²	138	85%	0.851	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-94.7	122.7	-178	0	0	0	0	0	111.7
1121	L	25.7	Very low	25.1	Very low	174 Å²	174	138.3 Å²	138.3	91%	0.911	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-101.7	131.4	173.4	-93.6	156	0	0	0	111.2
1122	T	23.9	Very low	25.1	Very low	128 Å²	128	136.2 Å²	136.2	79%	0.785	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-73.4	126.3	-177.3	48.1	0	0	0	0	113.1
1123	A	25.8	Very low	25.1	Very low	105 Å²	105	140.2 Å²	140.2	87%	0.868	82%	0.815	S	S	*	*			trans	-116.1	103	168.9	0	0	0	0	0	110.7
1124	T	24.2	Very low	25.2	Very low	121 Å²	121	142.6 Å²	142.6	74%	0.742	82%	0.819	S	S	*	*			trans	-93.6	115.5	176	38.6	0	0	0	0	112.1
1125	T	25.4	Very low	25.2	Very low	134 Å²	134	141.3 Å²	141.3	82%	0.822	81%	0.812	S	S	*	*			trans	64.5	102.6	136.4	59.5	0	0	0	0	120.8
1126	N	25.8	Very low	25.1	Very low	151 Å²	151	139.1 Å²	139.1	81%	0.807	81%	0.807	S	S	*	*			trans	-86.3	134.6	155.1	-80.8	-22	0	0	0	111.1
1127	S	26.1	Very low	25	Very low	112 Å²	112	139 Å²	139	78%	0.783	80%	0.804	S	S	*	*			trans	-132.4	107.1	161.2	57.8	0	0	0	0	108.7
1128	V	26.2	Very low	25	Very low	144 Å²	144	135.3 Å²	135.3	87%	0.873	80%	0.795	S	S	*	*			trans	-109.6	132.9	174	176.8	0	0	0	0	108.6
1129	I	23.4	Very low	25	Very low	130 Å²	130	133.3 Å²	133.3	67%	0.667	79%	0.793	S	S	*	*			trans	-100.6	137.1	-169.3	-74.1	178.4	0	0	0	110.2
1130	L	26.2	Very low	25.1	Very low	150 Å²	150	133.3 Å²	133.3	79%	0.785	79%	0.788	S	S	*	*			trans	27.8	127.5	135.4	-136.7	84.8	0	0	0	118.9
1131	N	23.9	Very low	25.1	Very low	164 Å²	164	134 Å²	134	88%	0.877	78%	0.782	S	S	*	*			trans	-170.7	128.6	139.6	-95.8	-26	0	0	0	111.9
1132	S	25.6	Very low	25.2	Very low	110 Å²	110	133.4 Å²	133.4	77%	0.769	78%	0.78	S	S	*	*			trans	162.7	96.2	134.2	-176	0	0	0	0	109.9
1133	F	24.1	Very low	25.2	Very low	190 Å²	190	138.4 Å²	138.4	83%	0.833	78%	0.784	S	S	*	*			trans	-61.4	139.9	155.4	-93.4	-106.8	0	0	0	109.4
1134	N	27.1	Very low	25.2	Very low	151 Å²	151	138.2 Å²	138.2	81%	0.807	78%	0.776	S	S	*	*			trans	-160.8	122.7	139.2	-98.1	-24.2	0	0	0	113.3
1135	N	24.9	Very low	25.3	Very low	130 Å²	130	138.9 Å²	138.9	70%	0.695	78%	0.78	S	S	*	*			trans	-22.2	144.1	162.3	-60.4	-34.3	0	0	0	117.3
1136	T	23.7	Very low	25.2	Very low	123 Å²	123	140 Å²	140	76%	0.755	78%	0.78	S	S	*	*				169.3	143.3	100.6	31.6	0	0	0	0	114.1
1137	T	23.8	Very low	25.3	Very low	116 Å²	116	141.8 Å²	141.8	71%	0.712	78%	0.781	S	S	*	*			trans	80.2	115	142.2	49.9	0	0	0	0	123.2
1138	T	24.5	Very low	25.3	Very low	121 Å²	121	144 Å²	144	74%	0.742	78%	0.782	S	S	*	*				87.7	110.6	124.7	55.3	0	0	0	0	122.2
1139	S	24.8	Very low	25.3	Very low	101 Å²	101	141.4 Å²	141.4	71%	0.706	77%	0.769	S	S	*	*				91.7	132.2	121.2	71.9	0	0	0	0	121.2
1140	N	26.8	Very low	25.5	Very low	142 Å²	142	142.4 Å²	142.4	76%	0.759	78%	0.776	S	S	*	*			trans	88.1	96.1	150.9	-63.1	-8.1	0	0	0	119.9
1141	T	25	Very low	25.8	Very low	118 Å²	118	142 Å²	142	72%	0.724	77%	0.773	S	S	*	*				21.2	111.1	122.7	56.6	0	0	0	0	117.1
1142	D	28.4	Very low	26	Very low	161 Å²	161	143.4 Å²	143.4	86%	0.861	77%	0.772	S	S	*	*				-171.4	155	105.9	-105.6	-34.9	0	0	0	114.2
1143	R	23.8	Very low	26.4	Very low	232 Å²	232	142.4 Å²	142.4	88%	0.875	77%	0.765	S	S	*	*			trans	-47.1	147.1	-175.2	-131.1	164	-179.9	173.9	-0.6	115.5
1144	S	25.8	Very low	26.7	Very low	101 Å²	101	141.7 Å²	141.7	71%	0.706	76%	0.761	S	S	*	*			trans	103.1	114.3	144.9	79.1	0	0	0	0	119.2
1145	T	25	Very low	26.9	Very low	135 Å²	135	141.6 Å²	141.6	83%	0.828	76%	0.76	S	S	*	*			trans	75	56.6	153.1	65.2	0	0	0	0	119.5	K1147	T1145-K1147 PolarHBondContact O-N 3.18Å
1146	L	24.8	Very low	27	Very low	157 Å²	157	142.6 Å²	142.6	82%	0.822	76%	0.762	S	S	*	*			trans	-85.1	91.4	162.6	-152.6	79.6	0	0	0	111.1	I1148	L1146-I1148 PolarHBondContact O-N 3.48Å
1147	K	27.8	Very low	27.3	Very low	190 Å²	190	145.8 Å²	145.8	83%	0.826	76%	0.76	S	S	*	*			trans	-54.8	121.5	153.5	-75.7	175	175.5	174.2	0	107.9	T1145 P1149	T1145-K1147 PolarHBondContact O-N 3.18Å; K1147-P1149 WeakPolarHBondContact O-CD 3.44Å; K1147-P1149 VanDerWaalsContact O-N 3.09Å
1148	I	25.7	Very low	27.5	Very low	157 Å²	157	147.7 Å²	147.7	81%	0.805	77%	0.766	S	S	*	*			trans	-50.1	111.8	175.5	-62.6	166.9	0	0	0	108.8	L1146 N1150	L1146-I1148 PolarHBondContact O-N 3.48Å; I1148-N1150 PolarHBondContact O-N 3.47Å
1149	P	26.7	Very low	27.7	Very low	90 Å²	90	152.7 Å²	152.7	58%	0.584	77%	0.771	S	S	*	*			trans	-74.2	128.6	179.3	-12.3	28.1	0	0	0	109.7	K1147 L1151	K1147-P1149 WeakPolarHBondContact O-CD 3.44Å; K1147-P1149 VanDerWaalsContact O-N 3.09Å; P1149-L1151 PolarHBondContact O-N 3.3Å
1150	N	28	Very low	27.9	Very low	152 Å²	152	153.3 Å²	153.3	81%	0.813	77%	0.766	S	S	*	*			trans	-59.9	77.3	170.4	-73.2	-37.3	0	0	0	111.6	I1148 F1152	I1148-N1150 PolarHBondContact O-N 3.47Å; N1150-F1152 PolarHBondContact O-N 3.18Å
1151	L	32.2	Very low	27.9	Very low	141 Å²	141	150.9 Å²	150.9	74%	0.738	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	36.5	174.3	-160.8	74.6	0	0	0	112.1	P1149	P1149-L1151 PolarHBondContact O-N 3.3Å
1152	F	28.1	Very low	28.1	Very low	193 Å²	193	153.6 Å²	153.6	85%	0.846	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.9	1.4	172.7	-97.7	-82	0	0	0	113.9	N1150	N1150-F1152 PolarHBondContact O-N 3.18Å
1153	S	32.4	Very low	27.9	Very low	89 Å²	89	150.9 Å²	150.9	62%	0.622	76%	0.764	S	S	*	*	S	Bend	trans	-97	-1.7	178.5	69.7	0	0	0	0	115.5
1154	K	32.1	Very low	28	Very low	175 Å²	175	144.2 Å²	144.2	76%	0.761	75%	0.753	S	S	*	*	S	Bend	trans	-102.7	-15.5	-178.7	-128.1	176.2	-176.6	-179.2	0	115.8
1155	I	31.1	Very low	27.9	Very low	150 Å²	150	146.3 Å²	146.3	77%	0.769	75%	0.746	S	S	*	*	S	Bend	trans	-93.4	-14.3	-178.4	-65.2	174.6	0	0	0	113.1
1156	M	26.2	Very low	27.9	Very low	151 Å²	151	151.3 Å²	151.3	74%	0.744	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	11	-177	-84.6	-67.9	-141.2	0	0	116.3
1157	R	29.9	Very low	27.9	Very low	189 Å²	189	153 Å²	153	71%	0.713	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	-8.8	179.8	-99.3	-171.9	-89.3	-179.3	-6.1	116.4
1158	N	28.9	Very low	27.8	Very low	156 Å²	156	150 Å²	150	83%	0.834	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	2.1	-177.5	-80.2	-0.4	0	0	0	116.3
1159	R	28.7	Very low	27.6	Very low	226 Å²	226	149.8 Å²	149.8	85%	0.853	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	-9.4	172.1	-97.4	-169.7	178.5	-157.9	0.8	115.3
1160	L	27.8	Very low	27.5	Very low	115 Å²	115	150.9 Å²	150.9	60%	0.602	74%	0.744	S	S	*	*	S	Bend	trans	-100.1	-1.6	-175.7	-83.4	157.7	0	0	0	115	L1162	L1160-L1162 PolarHBondContact O-N 3.15Å
1161	A	28.2	Very low	27.3	Very low	90 Å²	90	149 Å²	149	74%	0.744	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-12.8	179.6	0	0	0	0	0	114.5
1162	L	29.1	Very low	27	Very low	176 Å²	176	148.5 Å²	148.5	92%	0.921	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.2	1	177.8	-82.1	160.4	0	0	0	114.5	L1160	L1160-L1162 PolarHBondContact O-N 3.15Å
1163	T	24.5	Very low	26.9	Very low	104 Å²	104	144.9 Å²	144.9	64%	0.638	73%	0.726	S	S	*	*	S	Bend	trans	-117.3	7.4	179.8	49.2	0	0	0	0	115.1
1164	S	24.3	Very low	26.7	Very low	92 Å²	92	147.9 Å²	147.9	64%	0.643	74%	0.735	S	S	*	*			trans	-114.3	66.9	-179.8	-73.8	0	0	0	0	113.7
1165	R	24.9	Very low	26.4	Very low	145 Å²	145	146.8 Å²	146.8	55%	0.547	74%	0.737	S	S	.	*			trans	-142.5	87.2	156.3	-72.4	-169.7	176.1	-91	-38	111.7	G1029 F1167	G1029-R1165 PolarHBondContact O-NH1 3.47Å; G1029-R1165 PolarHBondContact O-NH2 3.49Å; R1165-F1167 WeakPolarHBondContact O-CD2 3.02Å; R1165-F1167 PolarHBondContact O-N 3.11Å
1166	R	23.8	Very low	26.2	Very low	239 Å²	239	147.1 Å²	147.1	90%	0.902	74%	0.741	S	S	*	*			trans	-53.2	96.3	157.1	-171.5	-177.6	-82.7	172.4	-7.9	107.6	V1168	R1166-V1168 PolarHBondContact O-N 2.73Å; R1166-V1168 VanDerWaalsContact O-N 3.13Å
1167	F	25.5	Very low	26.1	Very low	192 Å²	192	148.9 Å²	148.9	84%	0.842	75%	0.747	S	S	*	*			trans	-64.3	110.4	172	-81.2	-89.5	0	0	0	107.7	R1165 H1169	R1165-F1167 WeakPolarHBondContact O-CD2 3.02Å; R1165-F1167 PolarHBondContact O-N 3.11Å; F1167-H1169 PolarHBondContact O-N 3.3Å; F1167-H1169 VanDerWaalsContact O-N 3.12Å
1168	V	25	Very low	26	Very low	129 Å²	129	148.7 Å²	148.7	78%	0.782	75%	0.754	S	S	*	*			trans	-71.8	105.3	-179.1	175.6	0	0	0	0	107.9	R1166 N1170	R1166-V1168 PolarHBondContact O-N 2.73Å; R1166-V1168 VanDerWaalsContact O-N 3.13Å; V1168-N1170 PolarHBondContact O-N 3.27Å; V1168-N1170 VanDerWaalsContact O-N 3.08Å
1169	H	22.7	Very low	25.9	Very low	152 Å²	152	148.5 Å²	148.5	70%	0.704	75%	0.753	S	S	*	*			trans	-57.4	103.9	164	-129.4	-77.5	0	0	0	107.8	F1167 N1171	F1167-H1169 PolarHBondContact O-N 3.3Å; F1167-H1169 VanDerWaalsContact O-N 3.12Å; H1169-N1171 VanDerWaalsContact C-N 3.25Å; H1169-N1171 PolarHBondContact ND1-OD1 3.43Å; H1169-N1171 PolarHBondContact O-N 3.08Å
1170	N	24.7	Very low	25.8	Very low	112 Å²	112	143.4 Å²	143.4	60%	0.599	75%	0.752	S	S	*	*			trans	-82.3	79.7	171	-167.6	38.6	0	0	0	107.9	V1168 N1172	V1168-N1170 PolarHBondContact O-N 3.27Å; V1168-N1170 VanDerWaalsContact O-N 3.08Å; N1170-N1172 PolarHBondContact O-N 3.27Å
1171	N	24.2	Very low	25.7	Very low	112 Å²	112	145 Å²	145	60%	0.599	76%	0.761	S	S	*	*			trans	-69.7	82	170.8	-78	-6.3	0	0	0	109.3	H1169	H1169-N1171 VanDerWaalsContact C-N 3.25Å; H1169-N1171 PolarHBondContact ND1-OD1 3.43Å; H1169-N1171 PolarHBondContact O-N 3.08Å
1172	N	25.7	Very low	25.7	Very low	131 Å²	131	146.8 Å²	146.8	70%	0.701	77%	0.768	S	S	*	*			trans	-103.3	82.6	156.3	-99.5	1	0	0	0	107.5	N1170 N1174	N1170-N1172 PolarHBondContact O-N 3.27Å; N1172-N1174 VanDerWaalsContact C-N 3.34Å; N1172-N1174 PolarHBondContact O-N 3.03Å; N1172-N1174 VanDerWaalsContact O-N 3.08Å
1173	T	24.9	Very low	25.8	Very low	118 Å²	118	145.7 Å²	145.7	72%	0.724	76%	0.761	S	S	*	*			trans	-65.3	93.7	160.9	45.3	0	0	0	0	108.1
1174	N	27.6	Very low	26.2	Very low	152 Å²	152	146.9 Å²	146.9	81%	0.813	77%	0.769	S	S	*	*			trans	-126.6	106	156.1	-86.6	-15.9	0	0	0	106.9	N1172 N1176	N1172-N1174 VanDerWaalsContact C-N 3.34Å; N1172-N1174 PolarHBondContact O-N 3.03Å; N1172-N1174 VanDerWaalsContact O-N 3.08Å; N1174-N1176 PolarHBondContact O-N 3.49Å
1175	N	26.9	Very low	26.8	Very low	151 Å²	151	149.7 Å²	149.7	81%	0.807	78%	0.776	S	S	*	*			trans	-49.8	126.6	170.4	-62.5	-25.4	0	0	0	109.4
1176	N	27.3	Very low	27.6	Very low	157 Å²	157	147.1 Å²	147.1	84%	0.84	77%	0.772	S	S	*	*			trans	-166.1	114.3	143.8	-87.6	-23.6	0	0	0	108	N1174 H1178	N1174-N1176 PolarHBondContact O-N 3.49Å; N1176-H1178 PolarHBondContact O-N 2.71Å
1177	E	24.1	Very low	29	Very low	188 Å²	188	139.6 Å²	139.6	88%	0.879	75%	0.754	S	S	*	*			trans	-57.2	120.8	171.6	-66.1	169.9	142	0	0	110.1
1178	H	27.6	Very low	30.8	Very low	186 Å²	186	134 Å²	134	86%	0.861	73%	0.731	S	S	*	*			trans	-145	117.1	152.9	-89.5	-62.8	0	0	0	111.3	N1176	N1176-H1178 PolarHBondContact O-N 2.71Å
1179	N	25.4	Very low	33	Very low	152 Å²	152	128.3 Å²	128.3	81%	0.813	70%	0.697	S	S	*	*			trans	-49.8	125.5	169.5	-158.4	7.9	0	0	0	112.2
1180	S	26.9	Very low	35.7	Very low	119 Å²	119	123.8 Å²	123.8	83%	0.832	68%	0.675	S	S	*	*			trans	-161.2	134.9	162.7	-81.8	0	0	0	0	112.7
1181	N	26.7	Very low	38.6	Very low	149 Å²	149	118.9 Å²	118.9	80%	0.797	65%	0.648	S	S	*	*			trans	-71.6	149.9	-164.1	-71.7	-42.6	0	0	0	116.4
1182	S	28.6	Very low	41.6	Very low	127 Å²	127	116.8 Å²	116.8	89%	0.888	64%	0.636	S	S	*	*			trans	-21.2	116.1	165.8	-107	0	0	0	0	117.6
1183	I	30.9	Very low	44.5	Very low	152 Å²	152	111 Å²	111	78%	0.779	61%	0.607	S	S	*	*			trans	-105	121.4	162.2	-63.3	173.2	0	0	0	107.9	N1185	I1183-N1185 PolarHBondContact O-N 3.22Å
1184	V	31.8	Very low	47.4	Very low	130 Å²	130	106.8 Å²	106.8	79%	0.788	58%	0.58	S	S	*	*			trans	-65.1	116.9	174.8	176.3	0	0	0	0	109.4	I1186	V1184-I1186 PolarHBondContact O-N 3.28Å
1185	N	36.6	Very low	50	Low	151 Å²	151	105 Å²	105	81%	0.807	57%	0.567	S	S	*	*			trans	-73.6	99.3	-178.9	-86.8	-35.5	0	0	0	111.7	I1183	I1183-N1185 PolarHBondContact O-N 3.22Å
1186	I	42.6	Very low	52.7	Low	90 Å²	90	102.6 Å²	102.6	46%	0.462	56%	0.558	S	S	.	*			trans	-76.5	127.7	169.4	-58.9	169.7	0	0	0	108.4	V1184 Q1188	V1184-I1186 PolarHBondContact O-N 3.28Å; I1186-Q1188 PolarHBondContact O-N 3.16Å; I1186-Q1188 VanDerWaalsContact O-N 3.07Å
1187	P	52.3	Low	55.5	Low	81 Å²	81	96.3 Å²	96.3	53%	0.526	53%	0.526	S	S	.	.			trans	-69.6	105.3	-178.4	25.8	-31.4	0	0	0	110.7
1188	Q	64.2	Low	58.3	Low	74 Å²	74	89.9 Å²	89.9	35%	0.346	50%	0.5	S	S	.	.			trans	-94.9	145.1	-178.8	-66.7	-160.2	-35.6	0	0	113.1	T1057 I1186 K1190	T1057-Q1188 WeakPolarHBondContact CG2-O 3.02Å; I1186-Q1188 PolarHBondContact O-N 3.16Å; I1186-Q1188 VanDerWaalsContact O-N 3.07Å; Q1188-K1190 PolarHBondContact O-N 2.02Å
1189	P	71.6	Confident	60.7	Low	10 Å²	10	87.3 Å²	87.3	7%	0.065	49%	0.493	C	S	.	.			trans	-60.2	117.5	179.5	25.7	-34.1	0	0	0	112.8	A972 T1057 F1191	A972-P1189 HydrophobicContact CB-CB 3.82Å; T1057-P1189 HydrophobicContact CG2-CB 4.35Å; P1189-F1191 HydrophobicContact CB-CE2 3.8Å; P1189-F1191 HydrophobicContact CB-CZ 4.18Å; P1189-F1191 HydrophobicContact CG-CE2 4.43Å
1190	K	78.7	Confident	63.2	Low	58 Å²	58	80.9 Å²	80.9	25%	0.252	46%	0.462	S	S	.	.			trans	-105.3	135.9	178.2	-174.6	176.9	-170.8	167.4	0	110.2	E1041 K1042 E1055 I1056 Q1188	E1041-K1190 IonicContact OE2-NZ 2.89Å; E1041-K1190 PolarHBondContact OE2-NZ 3.02Å; K1042-K1190 WeakPolarHBondContact O-CE 3.45Å; E1055-K1190 CarbonylContact C-O 3.57Å; E1055-K1190 WeakPolarHBondContact CA-O 3.3Å; I1056-K1190 HydrophobicContact CD1-CB 4.48Å; I1056-K1190 HydrophobicContact CD1-CD 3.77Å; I1056-K1190 HydrophobicContact CD1-CG 3.92Å; I1056-K1190 HydrophobicContact CG1-CB 3.97Å; I1056-K1190 HydrophobicContact CG1-CD 4.17Å; I1056-K1190 HydrophobicContact CG1-CG 3.9Å; I1056-K1190 VanDerWaalsContact CG1-O 3.31Å; I1056-K1190 WeakPolarHBondContact CG1-O 3.29Å; I1056-K1190 PolarHBondContact N-O 3.28Å; Q1188-K1190 PolarHBondContact O-N 2.02Å
1191	F	86	Confident	66.1	Low	8 Å²	8	78 Å²	78	4%	0.035	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	137.1	-174.4	-67.8	-82.7	0	0	0	112.2	A972 C973 P975 T1043 C1044 L1053 L1054 E1055 P1189	A972-F1191 HydrophobicContact CB-CZ 4.01Å; C973-F1191 WeakPolarHBondContact O-CE2 2.94Å; C973-F1191 WeakPolarHBondContact O-CZ 2.99Å; P975-F1191 HydrophobicContact CB-CD2 3.95Å; P975-F1191 HydrophobicContact CB-CE2 4.41Å; P975-F1191 HydrophobicContact CB-CG 4.43Å; P975-F1191 HydrophobicContact CG-CB 4.32Å; P975-F1191 HydrophobicContact CG-CD1 4.36Å; P975-F1191 HydrophobicContact CG-CD2 3.73Å; P975-F1191 HydrophobicContact CG-CE2 4.07Å; P975-F1191 HydrophobicContact CG-CG 3.88Å; T1043-F1191 PolarHBondContact OG1-N 3.36Å; C1044-F1191 WeakPolarHBondContact CB-O 3.25Å; C1044-F1191 PolarHBondContact N-O 2.77Å; L1053-F1191 HydrophobicContact CD1-CB 3.82Å; L1053-F1191 HydrophobicContact CD1-CD1 4.11Å; L1053-F1191 HydrophobicContact CD1-CG 4.19Å; L1053-F1191 HydrophobicContact CD2-CD1 3.65Å; L1053-F1191 HydrophobicContact CD2-CE1 3.85Å; L1053-F1191 HydrophobicContact CD2-CG 4.26Å; L1053-F1191 HydrophobicContact CG-CB 4.26Å; L1053-F1191 HydrophobicContact CG-CD1 3.6Å; L1053-F1191 HydrophobicContact CG-CE1 4.25Å; L1053-F1191 HydrophobicContact CG-CG 4.18Å; L1054-F1191 WeakPolarHBondContact O-CA 3.28Å; E1055-F1191 HydrophobicContact CB-CD1 4.07Å; E1055-F1191 HydrophobicContact CB-CE1 3.68Å; E1055-F1191 HydrophobicContact CB-CZ 4.37Å; E1055-F1191 HydrophobicContact CG-CE1 4.2Å; E1055-F1191 HydrophobicContact CG-CZ 4.42Å; P1189-F1191 HydrophobicContact CB-CE2 3.8Å; P1189-F1191 HydrophobicContact CB-CZ 4.18Å; P1189-F1191 HydrophobicContact CG-CE2 4.43Å
1192	I	87.1	Confident	69.1	Low	68 Å²	68	71.8 Å²	71.8	35%	0.349	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	167.5	169.3	64.3	169.9	0	0	0	109.7	L1054 I1056 V1194	L1054-I1192 HydrophobicContact CB-CG1 4.19Å; L1054-I1192 HydrophobicContact CD2-CD1 4.31Å; L1054-I1192 HydrophobicContact CD2-CG1 4.41Å; L1054-I1192 PolarHBondContact N-O 3.05Å; L1054-I1192 PolarHBondContact O-N 3.16Å; I1056-I1192 HydrophobicContact CD1-CG2 3.59Å; I1056-I1192 HydrophobicContact CG1-CG2 4.2Å; I1056-I1192 HydrophobicContact CG2-CD1 3.69Å; I1056-I1192 HydrophobicContact CG2-CG1 3.66Å; I1192-V1194 HydrophobicContact CD1-CG1 4.03Å; I1192-V1194 HydrophobicContact CG1-CG1 4.28Å
1193	C	85.6	Confident	71.8	Confident	11 Å²	11	75.6 Å²	75.6	7%	0.074	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	121.2	-179.1	-62.7	0	0	0	0	109.9	S1032 C1044 C1047 Y1051 H1052	S1032-C1193 WeakPolarHBondContact O-CB 3.49Å; S1032-C1193 PolarHBondContact O-SG 3.19Å; C1044-C1193 PolarHBondContact SG-SG 2.78Å; C1047-C1193 WeakPolarHBondContact CA-SG 3.33Å; C1047-C1193 HydrophobicContact CB-CB 3.71Å; C1047-C1193 WeakPolarHBondContact CB-SG 3.26Å; C1047-C1193 WeakPolarHBondContact SG-CB 3.45Å; C1047-C1193 CovalentContact SG-SG 2.03Å; C1047-C1193 PolarHBondContact SG-SG 3.49Å; Y1051-C1193 HydrophobicContact CD1-CB 4.42Å; Y1051-C1193 HydrophobicContact CG-CB 4.44Å; H1052-C1193 WeakPolarHBondContact O-CA 3.33Å
1194	V	86.4	Confident	74.5	Confident	29 Å²	29	70.5 Å²	70.5	18%	0.176	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	141.6	-178	-63.5	0	0	0	0	110.5	H1052 L1054 I1192 T1196	H1052-V1194 PolarHBondContact N-O 3.42Å; H1052-V1194 PolarHBondContact O-N 3.07Å; L1054-V1194 HydrophobicContact CB-CG1 4.33Å; L1054-V1194 HydrophobicContact CB-CG2 3.94Å; L1054-V1194 HydrophobicContact CD2-CG1 3.89Å; L1054-V1194 HydrophobicContact CD2-CG2 4.26Å; I1192-V1194 HydrophobicContact CD1-CG1 4.03Å; I1192-V1194 HydrophobicContact CG1-CG1 4.28Å; V1194-T1196 WeakPolarHBondContact CG2-O 3.41Å; V1194-T1196 PolarHBondContact O-N 3.34Å
1195	H	83.4	Confident	76.9	Confident	114 Å²	114	68 Å²	68	53%	0.528	35%	0.354	S	S	.	.	S	Bend	trans	-72.5	-18.8	178.4	-171.1	-81.6	0	0	0	112.4	Y1051	Y1051-H1195 HydrophobicContact CD1-CB 4.29Å; Y1051-H1195 HydrophobicContact CE1-CB 4.2Å
1196	T	83.4	Confident	79.1	Confident	101 Å²	101	62 Å²	62	62%	0.62	32%	0.323	S	S	*	.	S	Bend	trans	-149.3	133	-179.7	-52.4	0	0	0	0	108.6	V1194	V1194-T1196 WeakPolarHBondContact CG2-O 3.41Å; V1194-T1196 PolarHBondContact O-N 3.34Å
1197	C	84.8	Confident	80.7	Confident	24 Å²	24	63.3 Å²	63.3	16%	0.162	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-63.7	134.5	177.7	-64.5	0	0	0	0	110.4	C1216	C1197-C1216 WeakPolarHBondContact CA-SG 3.46Å; C1197-C1216 HydrophobicContact CB-CB 3.78Å; C1197-C1216 WeakPolarHBondContact CB-SG 3.11Å; C1197-C1216 WeakPolarHBondContact SG-CA 3.41Å; C1197-C1216 WeakPolarHBondContact SG-CB 3.42Å; C1197-C1216 CovalentContact SG-SG 2.04Å; C1197-C1216 PolarHBondContact SG-SG 2.92Å
1198	P	83.4	Confident	81.5	Confident	53 Å²	53	60.8 Å²	60.8	34%	0.344	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-71.1	162.5	178.9	29.2	-33.4	0	0	0	111.5	L1054 G1200 Y1201	L1054-P1198 HydrophobicContact CD1-CG 4.19Å; L1054-P1198 HydrophobicContact CD2-CG 3.88Å; P1198-G1200 PolarHBondContact O-N 2.78Å; P1198-Y1201 HydrophobicContact CG-CD2 3.8Å; P1198-Y1201 HydrophobicContact CG-CE2 4.29Å; P1198-Y1201 HydrophobicContact CG-CG 4.41Å; P1198-Y1201 WeakPolarHBondContact O-CB 3.49Å; P1198-Y1201 PolarHBondContact O-N 3.15Å; P1198-Y1201 VanDerWaalsContact O-N 3.07Å
1199	N	77.6	Confident	81.6	Confident	133 Å²	133	62 Å²	62	71%	0.711	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	139.2	172.8	-69.6	-8.8	0	0	0	110.7	T1225	N1199-T1225 HydrophobicContact CB-CG2 3.83Å
1200	G	79	Confident	81.4	Confident	16 Å²	16	64.4 Å²	64.4	17%	0.165	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.9	-3.7	-171.5	0	0	0	0	0	113.8	P1198 K1218 C1219 S1224	P1198-G1200 PolarHBondContact O-N 2.78Å; G1200-K1218 WeakPolarHBondContact O-CA 3.19Å; G1200-C1219 PolarHBondContact O-N 3.28Å; G1200-C1219 PolarHBondContact O-SG 2.91Å; G1200-S1224 WeakPolarHBondContact CA-O 3.27Å; G1200-S1224 PolarHBondContact N-O 2.77Å
1201	Y	87.9	Confident	81	Confident	58 Å²	58	67.1 Å²	67.1	23%	0.227	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	146.8	176.7	-60.6	-105.7	0	0	0	111.3	L1054 P1198 C1216 S1217 K1218	L1054-Y1201 HydrophobicContact CD1-CD1 3.93Å; L1054-Y1201 HydrophobicContact CD1-CE1 3.89Å; L1054-Y1201 HydrophobicContact CD1-CG 4.26Å; P1198-Y1201 HydrophobicContact CG-CD2 3.8Å; P1198-Y1201 HydrophobicContact CG-CE2 4.29Å; P1198-Y1201 HydrophobicContact CG-CG 4.41Å; P1198-Y1201 WeakPolarHBondContact O-CB 3.49Å; P1198-Y1201 PolarHBondContact O-N 3.15Å; P1198-Y1201 VanDerWaalsContact O-N 3.07Å; Y1201-C1216 HydrophobicContact CD1-CB 4.23Å; Y1201-C1216 WeakPolarHBondContact CD1-O 3.27Å; Y1201-C1216 HydrophobicContact CG-CB 4.4Å; Y1201-S1217 CarbonylContact C-O 3.51Å; Y1201-S1217 WeakPolarHBondContact CA-O 3.09Å; Y1201-S1217 WeakPolarHBondContact CB-O 3.31Å; Y1201-K1218 HydrophobicContact CD1-CG 3.81Å; Y1201-K1218 HydrophobicContact CE1-CB 4.41Å; Y1201-K1218 HydrophobicContact CE1-CD 4.19Å; Y1201-K1218 HydrophobicContact CE1-CG 3.28Å; Y1201-K1218 WeakPolarHBondContact OH-CE 3.38Å
1202	Y	88.3	Confident	80.6	Confident	19 Å²	19	72.9 Å²	72.9	8%	0.075	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	157.8	172.7	70.7	-83.1	0	0	0	110.9	E945 K1204 C1216 S1217 C1226	E945-Y1202 PolarHBondContact OE2-OH 3.46Å; Y1202-K1204 HydrophobicContact CE2-CB 4.02Å; Y1202-K1204 HydrophobicContact CE2-CD 4.37Å; Y1202-K1204 HydrophobicContact CE2-CG 4.36Å; Y1202-K1204 PolarHBondContact O-N 2.03Å; Y1202-C1216 WeakPolarHBondContact O-CA 3.41Å; Y1202-S1217 VanDerWaalsContact CD1-O 3.23Å; Y1202-S1217 WeakPolarHBondContact CD1-O 3.45Å; Y1202-S1217 PolarHBondContact N-O 3.06Å; Y1202-S1217 PolarHBondContact O-N 3.49Å; Y1202-C1226 VanDerWaalsContact CD1-SG 3.55Å
1203	R	85.9	Confident	80.4	Confident	207 Å²	207	71.8 Å²	71.8	78%	0.781	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.9	124.6	177.8	70.5	-176.7	-172.3	178.4	1.9	109.5
1204	K	86.8	Confident	80.3	Confident	45 Å²	45	74.4 Å²	74.4	20%	0.196	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	125.1	176	-169.6	173.7	-176.7	166.6	0	108.9	E945 E971 Y1202 V1206 M1215 S1217	E945-K1204 IonicContact OE2-NZ 2.89Å; E945-K1204 PolarHBondContact OE2-NZ 3.1Å; E971-K1204 IonicContact OE1-NZ 3.78Å; E971-K1204 PolarHBondContact OE1-NZ 3.49Å; E971-K1204 IonicContact OE2-NZ 2.78Å; Y1202-K1204 HydrophobicContact CE2-CB 4.02Å; Y1202-K1204 HydrophobicContact CE2-CD 4.37Å; Y1202-K1204 HydrophobicContact CE2-CG 4.36Å; Y1202-K1204 PolarHBondContact O-N 2.03Å; K1204-V1206 HydrophobicContact CG-CG2 4.27Å; K1204-M1215 HydrophobicContact CB-CG 4.06Å; K1204-M1215 PolarHBondContact N-O 3.28Å; K1204-M1215 WeakPolarHBondContact O-CG 3.13Å; K1204-M1215 PolarHBondContact O-N 3.44Å; K1204-S1217 WeakPolarHBondContact CB-OG 3.34Å; K1204-S1217 WeakPolarHBondContact CD-OG 3.41Å
1205	S	83	Confident	80.4	Confident	77 Å²	77	73.8 Å²	73.8	54%	0.538	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	125.1	174	51.4	0	0	0	0	109.4	E1212	S1205-E1212 VanDerWaalsContact CB-OE1 3.23Å; S1205-E1212 WeakPolarHBondContact CB-OE1 3.21Å
1206	V	82.1	Confident	80.6	Confident	26 Å²	26	68.8 Å²	68.8	16%	0.158	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	133.1	177.7	-179	0	0	0	0	109.3	F983 K1204 V1213 M1215	F983-V1206 HydrophobicContact CD1-CB 4.47Å; F983-V1206 HydrophobicContact CD1-CG1 3.94Å; K1204-V1206 HydrophobicContact CG-CG2 4.27Å; V1206-V1213 PolarHBondContact N-O 3.41Å; V1206-V1213 PolarHBondContact O-N 3.06Å; V1206-M1215 HydrophobicContact CB-CE 3.73Å; V1206-M1215 HydrophobicContact CG1-CE 4.41Å; V1206-M1215 HydrophobicContact CG2-CE 3.36Å; V1206-M1215 HydrophobicContact CG2-SD 4.02Å
1207	L	76.4	Confident	80.8	Confident	118 Å²	118	64.4 Å²	64.4	62%	0.618	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	126.5	176.4	-126.8	83.4	0	0	0	110.4	S984 E1212	S984-L1207 PolarHBondContact OG-O 3.06Å; L1207-E1212 HydrophobicContact CD1-CB 4.3Å
1208	I	69.9	Low	80.7	Confident	28 Å²	28	66.9 Å²	66.9	14%	0.144	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	115.1	174.5	-50.2	173.7	0	0	0	108.2	F983 G1210 N1211 V1213	F983-I1208 HydrophobicContact CD1-CD1 4Å; F983-I1208 HydrophobicContact CD1-CG1 4.43Å; F983-I1208 HydrophobicContact CE1-CD1 3.52Å; F983-I1208 HydrophobicContact CE1-CG1 4.37Å; I1208-G1210 PolarHBondContact O-N 3.38Å; I1208-G1210 VanDerWaalsContact O-N 3.07Å; I1208-N1211 PolarHBondContact N-O 3.09Å; I1208-N1211 PolarHBondContact O-N 3.11Å; I1208-V1213 HydrophobicContact CD1-CB 4.12Å; I1208-V1213 HydrophobicContact CD1-CG2 3.67Å; I1208-V1213 HydrophobicContact CG1-CG2 4.18Å
1209	N	67.3	Low	80.9	Confident	99 Å²	99	64.9 Å²	64.9	53%	0.529	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.9	35.2	179.1	-65.3	-20.3	0	0	0	114	T999	T999-N1209 PolarHBondContact OG1-ND2 3.36Å
1210	G	67	Low	81.1	Confident	60 Å²	60	59 Å²	59	62%	0.619	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	89	-11.5	-178.2	0	0	0	0	0	115.4	I1208	I1208-G1210 PolarHBondContact O-N 3.38Å; I1208-G1210 VanDerWaalsContact O-N 3.07Å
1211	N	70.3	Confident	81	Confident	115 Å²	115	59.2 Å²	59.2	62%	0.615	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.9	130.5	177	-69.6	-21	0	0	0	111	I1208	I1208-N1211 PolarHBondContact N-O 3.09Å; I1208-N1211 PolarHBondContact O-N 3.11Å
1212	E	78	Confident	80.4	Confident	130 Å²	130	57.1 Å²	57.1	61%	0.607	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	122	174.9	-172.8	180	-167.2	0	0	110.5	S1205 L1207	S1205-E1212 VanDerWaalsContact CB-OE1 3.23Å; S1205-E1212 WeakPolarHBondContact CB-OE1 3.21Å; L1207-E1212 HydrophobicContact CD1-CB 4.3Å
1213	V	81.1	Confident	80.1	Confident	45 Å²	45	56.2 Å²	56.2	27%	0.273	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	123.9	175	-178.9	0	0	0	0	108.9	V1206 I1208	V1206-V1213 PolarHBondContact N-O 3.41Å; V1206-V1213 PolarHBondContact O-N 3.06Å; I1208-V1213 HydrophobicContact CD1-CB 4.12Å; I1208-V1213 HydrophobicContact CD1-CG2 3.67Å; I1208-V1213 HydrophobicContact CG1-CG2 4.18Å
1214	I	84	Confident	79.9	Confident	65 Å²	65	48 Å²	48	33%	0.333	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	121.5	179	-53.1	172.7	0	0	0	108.8	H1052 L1053	H1052-I1214 WeakPolarHBondContact CA-O 3.33Å; H1052-I1214 HydrophobicContact CB-CG2 4.33Å; H1052-I1214 VanDerWaalsContact ND1-CG2 3.25Å; H1052-I1214 WeakPolarHBondContact ND1-CG2 3.35Å; L1053-I1214 PolarHBondContact N-O 3.32Å
1215	M	88.2	Confident	79.7	Confident	16 Å²	16	47.2 Å²	47.2	8%	0.079	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	164.1	178.9	71.9	179.1	67.1	0	0	112.5	F983 L1053 K1204 V1206	F983-M1215 HydrophobicContact CD1-CE 3.47Å; F983-M1215 VanDerWaalsContact CD1-CE 3.47Å; F983-M1215 HydrophobicContact CD2-CE 3.81Å; F983-M1215 HydrophobicContact CD2-SD 4.39Å; F983-M1215 HydrophobicContact CE1-CE 3.19Å; F983-M1215 HydrophobicContact CE2-CE 3.58Å; F983-M1215 HydrophobicContact CE2-SD 4.26Å; F983-M1215 HydrophobicContact CG-CE 3.76Å; F983-M1215 HydrophobicContact CZ-CE 3.27Å; F983-M1215 HydrophobicContact CZ-SD 4.45Å; L1053-M1215 HydrophobicContact CB-CB 4.15Å; L1053-M1215 CarbonylContact O-C 3.55Å; L1053-M1215 VanDerWaalsContact O-CA 3.31Å; L1053-M1215 WeakPolarHBondContact O-CA 3.4Å; K1204-M1215 HydrophobicContact CB-CG 4.06Å; K1204-M1215 PolarHBondContact N-O 3.28Å; K1204-M1215 WeakPolarHBondContact O-CG 3.13Å; K1204-M1215 PolarHBondContact O-N 3.44Å; V1206-M1215 HydrophobicContact CB-CE 3.73Å; V1206-M1215 HydrophobicContact CG1-CE 4.41Å; V1206-M1215 HydrophobicContact CG2-CE 3.36Å; V1206-M1215 HydrophobicContact CG2-SD 4.02Å
1216	C	89.4	Confident	79.9	Confident	9 Å²	9	44.1 Å²	44.1	6%	0.061	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	111.6	173.3	-59.5	0	0	0	0	110.2	L1053 L1054 C1197 Y1201 Y1202	L1053-C1216 PolarHBondContact O-N 3.11Å; L1054-C1216 HydrophobicContact CB-CB 4.4Å; L1054-C1216 HydrophobicContact CD1-CB 3.66Å; C1197-C1216 WeakPolarHBondContact CA-SG 3.46Å; C1197-C1216 HydrophobicContact CB-CB 3.78Å; C1197-C1216 WeakPolarHBondContact CB-SG 3.11Å; C1197-C1216 WeakPolarHBondContact SG-CA 3.41Å; C1197-C1216 WeakPolarHBondContact SG-CB 3.42Å; C1197-C1216 CovalentContact SG-SG 2.04Å; C1197-C1216 PolarHBondContact SG-SG 2.92Å; Y1201-C1216 HydrophobicContact CD1-CB 4.23Å; Y1201-C1216 WeakPolarHBondContact CD1-O 3.27Å; Y1201-C1216 HydrophobicContact CG-CB 4.4Å; Y1202-C1216 WeakPolarHBondContact O-CA 3.41Å
1217	S	86.6	Confident	80	Confident	9 Å²	9	46.8 Å²	46.8	6%	0.063	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	144.9	-179.3	-64.8	0	0	0	0	111.7	Y1201 Y1202 K1204	Y1201-S1217 CarbonylContact C-O 3.51Å; Y1201-S1217 WeakPolarHBondContact CA-O 3.09Å; Y1201-S1217 WeakPolarHBondContact CB-O 3.31Å; Y1202-S1217 VanDerWaalsContact CD1-O 3.23Å; Y1202-S1217 WeakPolarHBondContact CD1-O 3.45Å; Y1202-S1217 PolarHBondContact N-O 3.06Å; Y1202-S1217 PolarHBondContact O-N 3.49Å; K1204-S1217 WeakPolarHBondContact CB-OG 3.34Å; K1204-S1217 WeakPolarHBondContact CD-OG 3.41Å
1218	K	83.7	Confident	80.5	Confident	77 Å²	77	43.8 Å²	43.8	34%	0.335	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	140.4	-175.4	-73.8	175.2	179.3	155.8	0	112.2	E1055 G1200 Y1201	E1055-K1218 IonicContact OE2-NZ 3Å; E1055-K1218 PolarHBondContact OE2-NZ 3.39Å; G1200-K1218 WeakPolarHBondContact O-CA 3.19Å; Y1201-K1218 HydrophobicContact CD1-CG 3.81Å; Y1201-K1218 HydrophobicContact CE1-CB 4.41Å; Y1201-K1218 HydrophobicContact CE1-CD 4.19Å; Y1201-K1218 HydrophobicContact CE1-CG 3.28Å; Y1201-K1218 WeakPolarHBondContact OH-CE 3.38Å
1219	C	86.4	Confident	81	Confident	10 Å²	10	43.5 Å²	43.5	7%	0.068	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-68.9	162.2	170.2	-64.8	0	0	0	0	112.3	G1200 C1223 C1226	G1200-C1219 PolarHBondContact O-N 3.28Å; G1200-C1219 PolarHBondContact O-SG 2.91Å; C1219-C1223 HydrophobicContact CB-CB 4.18Å; C1219-C1226 WeakPolarHBondContact CA-SG 3.45Å; C1219-C1226 HydrophobicContact CB-CB 3.85Å; C1219-C1226 WeakPolarHBondContact CB-SG 3.43Å; C1219-C1226 WeakPolarHBondContact SG-CB 3.08Å; C1219-C1226 PolarHBondContact SG-N 2.96Å; C1219-C1226 CovalentContact SG-SG 2.03Å; C1219-C1226 PolarHBondContact SG-SG 3.45Å
1220	P	81.9	Confident	81.6	Confident	10 Å²	10	41.8 Å²	41.8	7%	0.065	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-53.2	149.9	170.9	-27.2	35.3	0	0	0	113.2	I947 S1222 C1223 I1229	I947-P1220 HydrophobicContact CD1-CB 3.99Å; I947-P1220 HydrophobicContact CD1-CG 4.19Å; P1220-S1222 VanDerWaalsContact C-N 3.29Å; P1220-S1222 PolarHBondContact O-N 3.38Å; P1220-S1222 VanDerWaalsContact O-N 3.13Å; P1220-C1223 HydrophobicContact CB-CB 4.33Å; P1220-C1223 WeakPolarHBondContact O-CA 3.26Å; P1220-C1223 WeakPolarHBondContact O-CB 3.49Å; P1220-C1223 PolarHBondContact O-N 2.8Å; P1220-I1229 HydrophobicContact CG-CG1 4.24Å; P1220-I1229 VanDerWaalsContact CG-O 3.23Å; P1220-I1229 WeakPolarHBondContact CG-O 3.04Å
1221	P	76.5	Confident	82.3	Confident	20 Å²	20	42.4 Å²	42.4	13%	0.13	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-32.1	-172.8	-27.5	35	0	0	0	115.9	F928 C1223 R1236	F928-P1221 HydrophobicContact CD1-CG 3.98Å; F928-P1221 HydrophobicContact CE1-CB 4.06Å; F928-P1221 HydrophobicContact CE1-CG 3.55Å; F928-P1221 HydrophobicContact CE2-CB 4.45Å; F928-P1221 HydrophobicContact CE2-CG 4.16Å; F928-P1221 HydrophobicContact CG-CG 4.43Å; F928-P1221 HydrophobicContact CZ-CB 3.78Å; F928-P1221 HydrophobicContact CZ-CG 3.63Å; P1221-C1223 VanDerWaalsContact C-N 3.3Å; P1221-R1236 WeakPolarHBondContact O-CD 3.37Å; P1221-R1236 VanDerWaalsContact O-CZ 3.32Å; P1221-R1236 PolarHBondContact O-NE 2.84Å; P1221-R1236 PolarHBondContact O-NH1 2.03Å
1222	S	75.1	Confident	83	Confident	14 Å²	14	37.4 Å²	37.4	10%	0.098	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-5.4	177.5	55.1	0	0	0	0	113.7	P1220 R1236 C1248	P1220-S1222 VanDerWaalsContact C-N 3.29Å; P1220-S1222 PolarHBondContact O-N 3.38Å; P1220-S1222 VanDerWaalsContact O-N 3.13Å; S1222-R1236 PolarHBondContact O-N 2.92Å; S1222-C1248 WeakPolarHBondContact O-CB 3.38Å; S1222-C1248 PolarHBondContact OG-O 3.45Å
1223	C	82.8	Confident	83.2	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.007	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	135.5	-174	-169.4	0	0	0	0	112.3	C1219 P1220 P1221 T1225 C1232 R1236	C1219-C1223 HydrophobicContact CB-CB 4.18Å; P1220-C1223 HydrophobicContact CB-CB 4.33Å; P1220-C1223 WeakPolarHBondContact O-CA 3.26Å; P1220-C1223 WeakPolarHBondContact O-CB 3.49Å; P1220-C1223 PolarHBondContact O-N 2.8Å; P1221-C1223 VanDerWaalsContact C-N 3.3Å; C1223-T1225 PolarHBondContact SG-O 2.83Å; C1223-C1232 VanDerWaalsContact CA-SG 3.54Å; C1223-C1232 HydrophobicContact CB-CB 3.86Å; C1223-C1232 WeakPolarHBondContact CB-SG 3.47Å; C1223-C1232 WeakPolarHBondContact SG-CA 3.17Å; C1223-C1232 WeakPolarHBondContact SG-CB 3.47Å; C1223-C1232 CovalentContact SG-SG 2.03Å; C1223-C1232 PolarHBondContact SG-SG 3.01Å; C1223-R1236 PolarHBondContact O-NE 2.03Å
1224	S	81.5	Confident	83.2	Confident	35 Å²	35	37.3 Å²	37.3	25%	0.245	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	-39.2	175.1	-175.8	0	0	0	0	112.3	G1200 L1234	G1200-S1224 WeakPolarHBondContact CA-O 3.27Å; G1200-S1224 PolarHBondContact N-O 2.77Å; S1224-L1234 WeakPolarHBondContact CA-O 3.35Å; S1224-L1234 WeakPolarHBondContact CB-O 2.99Å; S1224-L1234 PolarHBondContact N-O 3.3Å
1225	T	82.4	Confident	83	Confident	28 Å²	28	35.2 Å²	35.2	17%	0.172	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	134.2	172.1	64	0	0	0	0	110	N1199 C1223 N1233 L1234	N1199-T1225 HydrophobicContact CB-CG2 3.83Å; C1223-T1225 PolarHBondContact SG-O 2.83Å; T1225-N1233 WeakPolarHBondContact O-CA 2.97Å; T1225-N1233 WeakPolarHBondContact O-CB 3.04Å; T1225-N1233 PolarHBondContact O-N 2.99Å; T1225-L1234 PolarHBondContact N-O 2.91Å; T1225-L1234 VanDerWaalsContact N-O 3.1Å; T1225-L1234 PolarHBondContact O-N 2.71Å; T1225-L1234 WeakPolarHBondContact OG1-CB 3.49Å
1226	C	87.3	Confident	82.1	Confident	11 Å²	11	38.9 Å²	38.9	7%	0.074	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	155.2	-177	63	0	0	0	0	110.6	Y1202 C1219 D1228 H1231	Y1202-C1226 VanDerWaalsContact CD1-SG 3.55Å; C1219-C1226 WeakPolarHBondContact CA-SG 3.45Å; C1219-C1226 HydrophobicContact CB-CB 3.85Å; C1219-C1226 WeakPolarHBondContact CB-SG 3.43Å; C1219-C1226 WeakPolarHBondContact SG-CB 3.08Å; C1219-C1226 PolarHBondContact SG-N 2.96Å; C1219-C1226 CovalentContact SG-SG 2.03Å; C1219-C1226 PolarHBondContact SG-SG 3.45Å; C1226-D1228 WeakPolarHBondContact CB-O 3.46Å; C1226-H1231 WeakPolarHBondContact CA-O 3.31Å; C1226-H1231 WeakPolarHBondContact CB-O 3.43Å
1227	T	84.3	Confident	80.8	Confident	82 Å²	82	44 Å²	44	50%	0.503	24%	0.244	S	C	.	.	S	Bend	trans	-90	-34.6	170.4	41.4	0	0	0	0	111.8	H1231 N1233	T1227-H1231 PolarHBondContact N-O 2.9Å; T1227-H1231 VanDerWaalsContact OG1-CB 3.27Å; T1227-H1231 WeakPolarHBondContact OG1-CB 3.03Å; T1227-H1231 PolarHBondContact OG1-O 3.18Å; T1227-N1233 VanDerWaalsContact CG2-ND2 3.27Å; T1227-N1233 WeakPolarHBondContact CG2-ND2 3.38Å; T1227-N1233 PolarHBondContact N-ND2 3.34Å
1228	D	86.1	Confident	79.7	Confident	55 Å²	55	45.8 Å²	45.8	29%	0.294	26%	0.264	S	S	.	.	S	Bend	trans	-149.3	-172.9	170.9	62.5	36.1	0	0	0	109.6	C1226 T1230 H1231	C1226-D1228 WeakPolarHBondContact CB-O 3.46Å; D1228-T1230 VanDerWaalsContact C-N 3.25Å; D1228-T1230 PolarHBondContact O-N 2.94Å; D1228-T1230 WeakPolarHBondContact OD1-CA 3.38Å; D1228-T1230 PolarHBondContact OD1-N 3.34Å; D1228-T1230 PolarHBondContact OD1-OG1 3.02Å; D1228-H1231 WeakPolarHBondContact OD1-CB 3.43Å; D1228-H1231 IonicContact OD1-CG 3.38Å; D1228-H1231 PolarHBondContact OD1-N 3.5Å; D1228-H1231 IonicContact OD1-ND1 3.05Å; D1228-H1231 PolarHBondContact OD1-ND1 2.65Å; D1228-H1231 IonicContact OD2-CE1 3.25Å; D1228-H1231 IonicContact OD2-CG 2.81Å; D1228-H1231 IonicContact OD2-ND1 3.99Å; D1228-H1231 PolarHBondContact OD2-ND1 3.25Å; D1228-H1231 VanDerWaalsContact OD2-ND1 3.09Å
1229	I	81.6	Confident	79.1	Confident	22 Å²	22	42.9 Å²	42.9	11%	0.113	25%	0.251	C	S	.	.	S	Bend	trans	-69.8	-18	-178.6	-160.3	167	0	0	0	114.1	E945 I947 I969 P1220	E945-I1229 HydrophobicContact CB-CD1 3.69Å; E945-I1229 HydrophobicContact CG-CD1 3.72Å; I947-I1229 HydrophobicContact CD1-CD1 4.16Å; I947-I1229 HydrophobicContact CD1-CG1 4.19Å; I947-I1229 HydrophobicContact CG1-CD1 3.78Å; I947-I1229 HydrophobicContact CG1-CG1 4.05Å; I969-I1229 HydrophobicContact CD1-CD1 4.28Å; P1220-I1229 HydrophobicContact CG-CG1 4.24Å; P1220-I1229 VanDerWaalsContact CG-O 3.23Å; P1220-I1229 WeakPolarHBondContact CG-O 3.04Å
1230	T	79.6	Confident	78.5	Confident	63 Å²	63	42.9 Å²	42.9	39%	0.387	25%	0.25	S	C	.	.	S	Bend	trans	-105.3	-14.3	-177.8	58.8	0	0	0	0	113.4	D1228	D1228-T1230 VanDerWaalsContact C-N 3.25Å; D1228-T1230 PolarHBondContact O-N 2.94Å; D1228-T1230 WeakPolarHBondContact OD1-CA 3.38Å; D1228-T1230 PolarHBondContact OD1-N 3.34Å; D1228-T1230 PolarHBondContact OD1-OG1 3.02Å
1231	H	82.3	Confident	78.1	Confident	74 Å²	74	45.2 Å²	45.2	34%	0.343	26%	0.259	S	S	.	.			trans	-119.4	97.1	-177.3	-65.2	82.6	0	0	0	111.1	C1226 T1227 D1228 N1246	C1226-H1231 WeakPolarHBondContact CA-O 3.31Å; C1226-H1231 WeakPolarHBondContact CB-O 3.43Å; T1227-H1231 PolarHBondContact N-O 2.9Å; T1227-H1231 VanDerWaalsContact OG1-CB 3.27Å; T1227-H1231 WeakPolarHBondContact OG1-CB 3.03Å; T1227-H1231 PolarHBondContact OG1-O 3.18Å; D1228-H1231 WeakPolarHBondContact OD1-CB 3.43Å; D1228-H1231 IonicContact OD1-CG 3.38Å; D1228-H1231 PolarHBondContact OD1-N 3.5Å; D1228-H1231 IonicContact OD1-ND1 3.05Å; D1228-H1231 PolarHBondContact OD1-ND1 2.65Å; D1228-H1231 IonicContact OD2-CE1 3.25Å; D1228-H1231 IonicContact OD2-CG 2.81Å; D1228-H1231 IonicContact OD2-ND1 3.99Å; D1228-H1231 PolarHBondContact OD2-ND1 3.25Å; D1228-H1231 VanDerWaalsContact OD2-ND1 3.09Å; H1231-N1246 PolarHBondContact CD2-ND2 2.91Å; H1231-N1246 PolarHBondContact NE2-ND2 2.69Å
1232	C	83.9	Confident	78	Confident	10 Å²	10	46.5 Å²	46.5	7%	0.068	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	136.2	168	-169.2	0	0	0	0	110.7	C1223 L1234 F1241 N1246 C1248	C1223-C1232 VanDerWaalsContact CA-SG 3.54Å; C1223-C1232 HydrophobicContact CB-CB 3.86Å; C1223-C1232 WeakPolarHBondContact CB-SG 3.47Å; C1223-C1232 WeakPolarHBondContact SG-CA 3.17Å; C1223-C1232 WeakPolarHBondContact SG-CB 3.47Å; C1223-C1232 CovalentContact SG-SG 2.03Å; C1223-C1232 PolarHBondContact SG-SG 3.01Å; C1232-L1234 VanDerWaalsContact SG-C 3.52Å; C1232-L1234 PolarHBondContact SG-O 3.47Å; C1232-F1241 WeakPolarHBondContact O-CE2 3.49Å; C1232-N1246 PolarHBondContact N-O 3.02Å; C1232-C1248 PolarHBondContact SG-SG 3.34Å
1233	N	82.8	Confident	77.8	Confident	87 Å²	87	52.2 Å²	52.2	47%	0.465	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-30.3	175	-53.2	-30.7	0	0	0	111.9	T1225 T1227	T1225-N1233 WeakPolarHBondContact O-CA 2.97Å; T1225-N1233 WeakPolarHBondContact O-CB 3.04Å; T1225-N1233 PolarHBondContact O-N 2.99Å; T1227-N1233 VanDerWaalsContact CG2-ND2 3.27Å; T1227-N1233 WeakPolarHBondContact CG2-ND2 3.38Å; T1227-N1233 PolarHBondContact N-ND2 3.34Å
1234	L	80.8	Confident	77.1	Confident	86 Å²	86	61.4 Å²	61.4	45%	0.45	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	123.9	-178.1	-171.7	70.3	0	0	0	109.7	S1224 T1225 C1232	S1224-L1234 WeakPolarHBondContact CA-O 3.35Å; S1224-L1234 WeakPolarHBondContact CB-O 2.99Å; S1224-L1234 PolarHBondContact N-O 3.3Å; T1225-L1234 PolarHBondContact N-O 2.91Å; T1225-L1234 VanDerWaalsContact N-O 3.1Å; T1225-L1234 PolarHBondContact O-N 2.71Å; T1225-L1234 WeakPolarHBondContact OG1-CB 3.49Å; C1232-L1234 VanDerWaalsContact SG-C 3.52Å; C1232-L1234 PolarHBondContact SG-O 3.47Å
1235	C	79.7	Confident	76.7	Confident	20 Å²	20	61.6 Å²	61.6	14%	0.135	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	155.9	-179.9	-60.7	0	0	0	0	113.1	F1239 Y1240 F1241 C1248	C1235-F1239 HydrophobicContact CB-CB 3.97Å; C1235-F1239 WeakPolarHBondContact CB-O 3.45Å; C1235-Y1240 VanDerWaalsContact SG-C 3.53Å; C1235-F1241 WeakPolarHBondContact SG-CA 3.37Å; C1235-F1241 PolarHBondContact SG-N 3.08Å; C1235-C1248 WeakPolarHBondContact CA-SG 3.05Å; C1235-C1248 HydrophobicContact CB-CB 3.69Å; C1235-C1248 WeakPolarHBondContact CB-SG 3.5Å; C1235-C1248 VanDerWaalsContact SG-CA 3.5Å; C1235-C1248 WeakPolarHBondContact SG-CB 3.43Å; C1235-C1248 CovalentContact SG-SG 2.02Å; C1235-C1248 PolarHBondContact SG-SG 3.33Å
1236	R	69.4	Low	76.4	Confident	93 Å²	93	62.7 Å²	62.7	35%	0.351	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-69.7	153.7	168.1	-72.5	-167.4	-175.6	177.4	-5.5	110.5	P1221 S1222 C1223 G1238 F1239	P1221-R1236 WeakPolarHBondContact O-CD 3.37Å; P1221-R1236 VanDerWaalsContact O-CZ 3.32Å; P1221-R1236 PolarHBondContact O-NE 2.84Å; P1221-R1236 PolarHBondContact O-NH1 2.03Å; S1222-R1236 PolarHBondContact O-N 2.92Å; C1223-R1236 PolarHBondContact O-NE 2.03Å; R1236-G1238 PolarHBondContact O-N 3.16Å; R1236-F1239 HydrophobicContact CB-CD2 4.29Å; R1236-F1239 PolarHBondContact O-N 3.38Å
1237	P	63.2	Low	75.8	Confident	118 Å²	118	64.9 Å²	64.9	77%	0.766	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	133.6	173.6	-25	33.9	0	0	0	111.5
1238	G	62.1	Low	75.3	Confident	46 Å²	46	61 Å²	61	47%	0.474	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.3	-7.2	-173.5	0	0	0	0	0	114.7	R1236 R1251	R1236-G1238 PolarHBondContact O-N 3.16Å; G1238-R1251 WeakPolarHBondContact O-CB 3.09Å; G1238-R1251 PolarHBondContact O-N 3.11Å
1239	F	72.3	Confident	74.5	Confident	16 Å²	16	59.9 Å²	59.9	7%	0.07	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	146.8	174.6	-58.2	-99.2	0	0	0	110.9	I913 I919 C1235 R1236 C1248 L1249 M1250	I913-F1239 HydrophobicContact CD1-CE2 3.57Å; I913-F1239 HydrophobicContact CD1-CZ 3.93Å; I913-F1239 HydrophobicContact CG1-CE2 4.15Å; I913-F1239 HydrophobicContact CG1-CZ 4.23Å; I919-F1239 HydrophobicContact CD1-CE1 4.41Å; I919-F1239 HydrophobicContact CD1-CZ 3.79Å; I919-F1239 HydrophobicContact CG1-CZ 3.99Å; I919-F1239 HydrophobicContact CG2-CE1 4.23Å; I919-F1239 HydrophobicContact CG2-CZ 4.15Å; C1235-F1239 HydrophobicContact CB-CB 3.97Å; C1235-F1239 WeakPolarHBondContact CB-O 3.45Å; R1236-F1239 HydrophobicContact CB-CD2 4.29Å; R1236-F1239 PolarHBondContact O-N 3.38Å; F1239-C1248 HydrophobicContact CB-CB 3.87Å; F1239-C1248 HydrophobicContact CG-CB 4.45Å; F1239-L1249 CarbonylContact C-O 3.5Å; F1239-L1249 WeakPolarHBondContact CA-O 3.07Å; F1239-L1249 VanDerWaalsContact CB-O 3.31Å; F1239-L1249 WeakPolarHBondContact CB-O 3.48Å; F1239-M1250 HydrophobicContact CD1-CB 4.16Å; F1239-M1250 HydrophobicContact CE1-CB 4.09Å; F1239-M1250 HydrophobicContact CE1-CG 4.36Å; F1239-M1250 HydrophobicContact CE1-SD 4.44Å; F1239-M1250 HydrophobicContact CZ-SD 4.49Å
1240	Y	72	Confident	73.6	Confident	9 Å²	9	62.4 Å²	62.4	4%	0.035	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	151.6	172.6	78.4	-89	0	0	0	110.7	C1235 H1242 C1248 L1249 R1251 F1260 D1265	C1235-Y1240 VanDerWaalsContact SG-C 3.53Å; Y1240-H1242 HydrophobicContact CE2-CB 3.98Å; Y1240-H1242 PolarHBondContact O-N 2.78Å; Y1240-C1248 WeakPolarHBondContact O-CA 3.13Å; Y1240-L1249 HydrophobicContact CD1-CB 4.16Å; Y1240-L1249 WeakPolarHBondContact CD1-O 3.27Å; Y1240-L1249 HydrophobicContact CE1-CB 3.68Å; Y1240-L1249 PolarHBondContact N-O 3.2Å; Y1240-L1249 PolarHBondContact O-N 3.08Å; Y1240-R1251 HydrophobicContact CD1-CB 4.36Å; Y1240-F1260 AromaticContact CD1-CE1 3.73Å; Y1240-F1260 HydrophobicContact CD1-CE1 3.73Å; Y1240-F1260 AromaticContact CD1-CZ 3.68Å; Y1240-F1260 HydrophobicContact CD1-CZ 3.68Å; Y1240-F1260 HydrophobicContact CD2-CE1 4.13Å; Y1240-F1260 HydrophobicContact CE1-CE1 4.26Å; Y1240-F1260 AromaticContact CE1-CZ 3.81Å; Y1240-F1260 HydrophobicContact CE1-CZ 3.81Å; Y1240-F1260 AromaticContact CG-CE1 3.63Å; Y1240-F1260 HydrophobicContact CG-CE1 3.63Å; Y1240-F1260 HydrophobicContact CG-CZ 4.05Å; Y1240-D1265 PolarHBondContact OH-OD1 2.79Å; Y1240-D1265 VanDerWaalsContact OH-OD1 3.14Å; Y1240-D1265 PolarHBondContact OH-OD2 3.06Å
1241	F	75.3	Confident	72.7	Confident	59 Å²	59	64.4 Å²	64.4	26%	0.259	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	110.1	-179.6	-179.4	-109.3	0	0	0	110.3	C1232 C1235 K1243 N1246	C1232-F1241 WeakPolarHBondContact O-CE2 3.49Å; C1235-F1241 WeakPolarHBondContact SG-CA 3.37Å; C1235-F1241 PolarHBondContact SG-N 3.08Å; F1241-K1243 HydrophobicContact CD1-CG 4.04Å; F1241-K1243 HydrophobicContact CE1-CB 4.47Å; F1241-K1243 HydrophobicContact CE1-CG 4.11Å; F1241-K1243 PolarHBondContact O-N 3.23Å; F1241-N1246 HydrophobicContact CE2-CB 4.38Å; F1241-N1246 HydrophobicContact CZ-CB 4.37Å
1242	H	73.6	Confident	71.7	Confident	47 Å²	47	64.9 Å²	64.9	22%	0.218	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	98.6	178	-175.4	-110.8	0	0	0	110.2	Y1240 K1244 T1245 N1246 Y1247 L1249	Y1240-H1242 HydrophobicContact CE2-CB 3.98Å; Y1240-H1242 PolarHBondContact O-N 2.78Å; H1242-K1244 PolarHBondContact O-N 2.95Å; H1242-T1245 WeakPolarHBondContact ND1-CG2 2.99Å; H1242-T1245 PolarHBondContact ND1-N 3.01Å; H1242-T1245 PolarHBondContact ND1-OG1 3.03Å; H1242-T1245 PolarHBondContact O-N 2.84Å; H1242-N1246 PolarHBondContact O-N 3.04Å; H1242-Y1247 PolarHBondContact N-O 2.95Å; H1242-L1249 HydrophobicContact CB-CD1 3.65Å; H1242-L1249 HydrophobicContact CB-CG 3.94Å
1243	K	70	Confident	70.5	Confident	135 Å²	135	69.6 Å²	69.6	59%	0.587	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-28.1	-172.8	-66.1	174.3	-176.8	164.1	0	114.8	F1241 D1263	F1241-K1243 HydrophobicContact CD1-CG 4.04Å; F1241-K1243 HydrophobicContact CE1-CB 4.47Å; F1241-K1243 HydrophobicContact CE1-CG 4.11Å; F1241-K1243 PolarHBondContact O-N 3.23Å; K1243-D1263 IonicContact NZ-OD1 3.91Å; K1243-D1263 PolarHBondContact NZ-OD1 3.14Å
1244	K	68.9	Low	69.6	Low	193 Å²	193	67 Å²	67	84%	0.839	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-32.6	-179.2	-68.8	178.7	-179.8	172.9	0	113.5	H1242	H1242-K1244 PolarHBondContact O-N 2.95Å
1245	T	74.1	Confident	68.7	Low	40 Å²	40	68.3 Å²	68.3	25%	0.245	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107	-7.2	-175.6	61.5	0	0	0	0	113.1	A953 H1242 Y1247	A953-T1245 HydrophobicContact CB-CG2 3.96Å; H1242-T1245 WeakPolarHBondContact ND1-CG2 2.99Å; H1242-T1245 PolarHBondContact ND1-N 3.01Å; H1242-T1245 PolarHBondContact ND1-OG1 3.03Å; H1242-T1245 PolarHBondContact O-N 2.84Å; T1245-Y1247 WeakPolarHBondContact O-CD2 3.38Å; T1245-Y1247 PolarHBondContact O-N 2.95Å; T1245-Y1247 VanDerWaalsContact O-N 3.08Å
1246	N	75.4	Confident	68	Low	51 Å²	51	69.7 Å²	69.7	27%	0.273	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	14.2	-173.7	-64.6	-27.3	0	0	0	114.9	H1231 C1232 F1241 H1242	H1231-N1246 PolarHBondContact CD2-ND2 2.91Å; H1231-N1246 PolarHBondContact NE2-ND2 2.69Å; C1232-N1246 PolarHBondContact N-O 3.02Å; F1241-N1246 HydrophobicContact CE2-CB 4.38Å; F1241-N1246 HydrophobicContact CZ-CB 4.37Å; H1242-N1246 PolarHBondContact O-N 3.04Å
1247	Y	75.1	Confident	68.1	Low	56 Å²	56	68.3 Å²	68.3	22%	0.22	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	155.2	175.7	-71.8	-68.4	0	0	0	111.8	P950 H1242 T1245	P950-Y1247 HydrophobicContact CB-CD1 4.3Å; P950-Y1247 HydrophobicContact CB-CD2 4.42Å; P950-Y1247 HydrophobicContact CB-CG 3.95Å; H1242-Y1247 PolarHBondContact N-O 2.95Å; T1245-Y1247 WeakPolarHBondContact O-CD2 3.38Å; T1245-Y1247 PolarHBondContact O-N 2.95Å; T1245-Y1247 VanDerWaalsContact O-N 3.08Å
1248	C	74.1	Confident	68.9	Low	2 Å²	2	65 Å²	65	1%	0.014	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	111.5	170.6	-66.3	0	0	0	0	109.9	S1222 C1232 C1235 F1239 Y1240	S1222-C1248 WeakPolarHBondContact O-CB 3.38Å; S1222-C1248 PolarHBondContact OG-O 3.45Å; C1232-C1248 PolarHBondContact SG-SG 3.34Å; C1235-C1248 WeakPolarHBondContact CA-SG 3.05Å; C1235-C1248 HydrophobicContact CB-CB 3.69Å; C1235-C1248 WeakPolarHBondContact CB-SG 3.5Å; C1235-C1248 VanDerWaalsContact SG-CA 3.5Å; C1235-C1248 WeakPolarHBondContact SG-CB 3.43Å; C1235-C1248 CovalentContact SG-SG 2.02Å; C1235-C1248 PolarHBondContact SG-SG 3.33Å; F1239-C1248 HydrophobicContact CB-CB 3.87Å; F1239-C1248 HydrophobicContact CG-CB 4.45Å; Y1240-C1248 WeakPolarHBondContact O-CA 3.13Å
1249	L	69.2	Low	69.8	Low	30 Å²	30	64.2 Å²	64.2	16%	0.157	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	149.3	177.5	-62.4	-178.9	0	0	0	110.1	P950 F1239 Y1240 H1242 R1251	P950-L1249 HydrophobicContact CB-CD2 3.88Å; F1239-L1249 CarbonylContact C-O 3.5Å; F1239-L1249 WeakPolarHBondContact CA-O 3.07Å; F1239-L1249 VanDerWaalsContact CB-O 3.31Å; F1239-L1249 WeakPolarHBondContact CB-O 3.48Å; Y1240-L1249 HydrophobicContact CD1-CB 4.16Å; Y1240-L1249 WeakPolarHBondContact CD1-O 3.27Å; Y1240-L1249 HydrophobicContact CE1-CB 3.68Å; Y1240-L1249 PolarHBondContact N-O 3.2Å; Y1240-L1249 PolarHBondContact O-N 3.08Å; H1242-L1249 HydrophobicContact CB-CD1 3.65Å; H1242-L1249 HydrophobicContact CB-CG 3.94Å; L1249-R1251 PolarHBondContact O-N 3.3Å
1250	M	60.9	Low	70	Confident	76 Å²	76	64.2 Å²	64.2	37%	0.374	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	127.4	-177.7	-163.1	148.6	65.8	0	0	109.7	T911 I919 F1239	T911-M1250 HydrophobicContact CG2-CE 3.69Å; I919-M1250 HydrophobicContact CD1-CE 4.44Å; I919-M1250 HydrophobicContact CD1-SD 3.55Å; I919-M1250 VanDerWaalsContact CD1-SD 3.55Å; F1239-M1250 HydrophobicContact CD1-CB 4.16Å; F1239-M1250 HydrophobicContact CE1-CB 4.09Å; F1239-M1250 HydrophobicContact CE1-CG 4.36Å; F1239-M1250 HydrophobicContact CE1-SD 4.44Å; F1239-M1250 HydrophobicContact CZ-SD 4.49Å
1251	R	61.9	Low	70.2	Confident	104 Å²	104	64.9 Å²	64.9	39%	0.392	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-74	127.2	-178.1	-173	-178	-87.3	-168.6	-4.9	109	G1238 Y1240 L1249 T1253 F1260 E1262	G1238-R1251 WeakPolarHBondContact O-CB 3.09Å; G1238-R1251 PolarHBondContact O-N 3.11Å; Y1240-R1251 HydrophobicContact CD1-CB 4.36Å; L1249-R1251 PolarHBondContact O-N 3.3Å; R1251-T1253 PolarHBondContact O-N 3.44Å; R1251-F1260 HydrophobicContact CG-CB 4.08Å; R1251-F1260 HydrophobicContact CG-CD1 3.6Å; R1251-F1260 HydrophobicContact CG-CD2 3.79Å; R1251-F1260 HydrophobicContact CG-CE1 3.86Å; R1251-F1260 HydrophobicContact CG-CE2 4.06Å; R1251-F1260 HydrophobicContact CG-CG 3.53Å; R1251-F1260 HydrophobicContact CG-CZ 4.06Å; R1251-E1262 IonicContact CZ-OE1 3.09Å; R1251-E1262 IonicContact NH2-OE1 3.92Å; R1251-E1262 PolarHBondContact NH2-OE1 3.47Å
1252	T	62	Low	70	Confident	84 Å²	84	66.1 Å²	66.1	52%	0.515	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-58.6	128.5	170.9	-53.4	0	0	0	0	109.3	C1254	T1252-C1254 PolarHBondContact O-N 3.13Å; T1252-C1254 VanDerWaalsContact O-N 3.16Å
1253	T	58.4	Low	69.8	Low	110 Å²	110	69.8 Å²	69.8	68%	0.675	34%	0.344	S	S	*	.			trans	-67.1	113.7	179	-13	0	0	0	0	109.1	T883 R1251	T883-T1253 WeakPolarHBondContact CG2-O 3.33Å; R1251-T1253 PolarHBondContact O-N 3.44Å
1254	C	63.6	Low	69.9	Low	31 Å²	31	69 Å²	69	21%	0.209	34%	0.343	C	S	.	.			trans	-85.6	157.5	175.3	-57.9	0	0	0	0	111.4	T1252 E1258 F1260 C1267	T1252-C1254 PolarHBondContact O-N 3.13Å; T1252-C1254 VanDerWaalsContact O-N 3.16Å; C1254-E1258 HydrophobicContact CB-CB 4.02Å; C1254-F1260 VanDerWaalsContact SG-CA 3.57Å; C1254-F1260 VanDerWaalsContact SG-CB 3.57Å; C1254-C1267 WeakPolarHBondContact CA-SG 3.37Å; C1254-C1267 HydrophobicContact CB-CB 3.67Å; C1254-C1267 WeakPolarHBondContact CB-SG 2.93Å; C1254-C1267 VanDerWaalsContact SG-CA 3.59Å; C1254-C1267 WeakPolarHBondContact SG-CB 3.46Å; C1254-C1267 CovalentContact SG-SG 2.03Å; C1254-C1267 PolarHBondContact SG-SG 3.12Å
1255	R	61.8	Low	69.8	Low	114 Å²	114	63.8 Å²	63.8	43%	0.43	32%	0.324	S	S	.	.			trans	-62.4	156.5	172	-59.7	-174.8	163.3	154	1.4	110.3	D881 S1257 E1258	D881-R1255 WeakPolarHBondContact OD2-CD 3Å; D881-R1255 VanDerWaalsContact OD2-CG 3.26Å; D881-R1255 WeakPolarHBondContact OD2-CG 3.38Å; D881-R1255 IonicContact OD2-CZ 2.89Å; D881-R1255 IonicContact OD2-NE 2.73Å; D881-R1255 PolarHBondContact OD2-NE 3.38Å; R1255-S1257 PolarHBondContact O-N 3.15Å; R1255-S1257 VanDerWaalsContact O-N 3.15Å; R1255-E1258 HydrophobicContact CB-CB 4.31Å; R1255-E1258 HydrophobicContact CB-CG 4.13Å; R1255-E1258 WeakPolarHBondContact CG-OE2 3.36Å; R1255-E1258 PolarHBondContact N-OE2 3.02Å; R1255-E1258 PolarHBondContact O-N 3.12Å; R1255-E1258 VanDerWaalsContact O-O 3.05Å
1256	L	65.4	Low	69.8	Low	50 Å²	50	65 Å²	65	26%	0.262	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-38.2	176.7	-78.9	179.3	0	0	0	112.4	F872 E1258 R1275 T1276	F872-L1256 HydrophobicContact CD2-CD1 4.43Å; F872-L1256 HydrophobicContact CE2-CD1 3.41Å; F872-L1256 VanDerWaalsContact CE2-CD1 3.41Å; F872-L1256 HydrophobicContact CE2-CG 3.86Å; F872-L1256 HydrophobicContact CZ-CD1 4.05Å; F872-L1256 HydrophobicContact CZ-CG 4.45Å; L1256-E1258 PolarHBondContact O-N 3.39Å; L1256-R1275 CarbonylContact C-O 3.54Å; L1256-T1276 HydrophobicContact CB-CG2 3.94Å; L1256-T1276 HydrophobicContact CD2-CG2 3.51Å; L1256-T1276 HydrophobicContact CG-CG2 4.24Å; L1256-T1276 VanDerWaalsContact O-CA 3.31Å; L1256-T1276 WeakPolarHBondContact O-CA 3.45Å; L1256-T1276 WeakPolarHBondContact O-CG2 3.36Å
1257	S	71.3	Confident	69.9	Low	64 Å²	64	64.1 Å²	64.1	45%	0.448	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	11.5	179.1	58.6	0	0	0	0	113.8	R1255 P1269 C1270	R1255-S1257 PolarHBondContact O-N 3.15Å; R1255-S1257 VanDerWaalsContact O-N 3.15Å; S1257-P1269 CarbonylContact O-C 3.6Å; S1257-P1269 WeakPolarHBondContact O-CA 3.02Å; S1257-C1270 WeakPolarHBondContact O-CB 3.19Å; S1257-C1270 PolarHBondContact O-N 2.83Å
1258	E	80.3	Confident	70.1	Confident	48 Å²	48	65.9 Å²	65.9	22%	0.224	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	149.5	-177.5	-67.7	168.6	178.6	0	0	110.5	C1254 R1255 L1256 C1267 R1268	C1254-E1258 HydrophobicContact CB-CB 4.02Å; R1255-E1258 HydrophobicContact CB-CB 4.31Å; R1255-E1258 HydrophobicContact CB-CG 4.13Å; R1255-E1258 WeakPolarHBondContact CG-OE2 3.36Å; R1255-E1258 PolarHBondContact N-OE2 3.02Å; R1255-E1258 PolarHBondContact O-N 3.12Å; R1255-E1258 VanDerWaalsContact O-O 3.05Å; L1256-E1258 PolarHBondContact O-N 3.39Å; E1258-C1267 HydrophobicContact CB-CB 4.31Å; E1258-C1267 WeakPolarHBondContact OE2-CB 3.32Å; E1258-R1268 CarbonylContact C-O 3.59Å; E1258-R1268 WeakPolarHBondContact CA-O 3.4Å; E1258-R1268 VanDerWaalsContact CB-O 3.26Å; E1258-R1268 WeakPolarHBondContact CB-O 3Å
1259	Y	79.7	Confident	70.5	Confident	29 Å²	29	70.3 Å²	70.3	11%	0.114	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	152.8	167	71.3	-79.6	0	0	0	109.7	D1261 C1267 R1268 P1269 P1280	Y1259-D1261 HydrophobicContact CE2-CB 4.12Å; Y1259-D1261 PolarHBondContact O-N 2.78Å; Y1259-C1267 WeakPolarHBondContact O-CA 3.03Å; Y1259-R1268 HydrophobicContact CD1-CB 4.33Å; Y1259-R1268 VanDerWaalsContact CD1-O 3.32Å; Y1259-R1268 WeakPolarHBondContact CD1-O 3.5Å; Y1259-R1268 HydrophobicContact CE1-CB 3.7Å; Y1259-R1268 PolarHBondContact N-O 3.34Å; Y1259-R1268 PolarHBondContact O-N 3.08Å; Y1259-P1269 WeakPolarHBondContact CE1-O 3.41Å; Y1259-P1280 HydrophobicContact CE1-CB 3.7Å; Y1259-P1280 HydrophobicContact CE1-CG 4.28Å; Y1259-P1280 VanDerWaalsContact CZ-CD 3.47Å; Y1259-P1280 WeakPolarHBondContact OH-CB 2.99Å; Y1259-P1280 WeakPolarHBondContact OH-CG 3.28Å
1260	F	76.6	Confident	71.2	Confident	17 Å²	17	69.8 Å²	69.8	8%	0.075	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	116.1	175.1	-175.6	-101.2	0	0	0	109.7	Y1240 R1251 C1254 E1262 D1265	Y1240-F1260 AromaticContact CD1-CE1 3.73Å; Y1240-F1260 HydrophobicContact CD1-CE1 3.73Å; Y1240-F1260 AromaticContact CD1-CZ 3.68Å; Y1240-F1260 HydrophobicContact CD1-CZ 3.68Å; Y1240-F1260 HydrophobicContact CD2-CE1 4.13Å; Y1240-F1260 HydrophobicContact CE1-CE1 4.26Å; Y1240-F1260 AromaticContact CE1-CZ 3.81Å; Y1240-F1260 HydrophobicContact CE1-CZ 3.81Å; Y1240-F1260 AromaticContact CG-CE1 3.63Å; Y1240-F1260 HydrophobicContact CG-CE1 3.63Å; Y1240-F1260 HydrophobicContact CG-CZ 4.05Å; R1251-F1260 HydrophobicContact CG-CB 4.08Å; R1251-F1260 HydrophobicContact CG-CD1 3.6Å; R1251-F1260 HydrophobicContact CG-CD2 3.79Å; R1251-F1260 HydrophobicContact CG-CE1 3.86Å; R1251-F1260 HydrophobicContact CG-CE2 4.06Å; R1251-F1260 HydrophobicContact CG-CG 3.53Å; R1251-F1260 HydrophobicContact CG-CZ 4.06Å; C1254-F1260 VanDerWaalsContact SG-CA 3.57Å; C1254-F1260 VanDerWaalsContact SG-CB 3.57Å; F1260-E1262 HydrophobicContact CD1-CG 3.87Å; F1260-E1262 HydrophobicContact CE1-CG 4.05Å; F1260-E1262 PolarHBondContact O-N 3.06Å; F1260-D1265 WeakPolarHBondContact CZ-OD1 3.2Å
1261	D	77.5	Confident	72.4	Confident	22 Å²	22	67.9 Å²	67.9	12%	0.118	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	102.3	173.8	-172.1	-23.3	0	0	0	109.1	Y1259 D1263 Q1264 D1265 V1266 R1268	Y1259-D1261 HydrophobicContact CE2-CB 4.12Å; Y1259-D1261 PolarHBondContact O-N 2.78Å; D1261-D1263 PolarHBondContact O-N 2.98Å; D1261-D1263 PolarHBondContact OD1-N 3.18Å; D1261-D1263 VanDerWaalsContact OD1-N 3.11Å; D1261-Q1264 PolarHBondContact O-N 3.39Å; D1261-Q1264 PolarHBondContact OD1-N 2.73Å; D1261-D1265 PolarHBondContact O-N 2.02Å; D1261-V1266 WeakPolarHBondContact CB-O 3.47Å; D1261-V1266 PolarHBondContact N-O 3.1Å; D1261-V1266 PolarHBondContact O-N 3.37Å; D1261-R1268 HydrophobicContact CB-CG 4.28Å; D1261-R1268 WeakPolarHBondContact OD2-CD 3.49Å; D1261-R1268 IonicContact OD2-CZ 2.83Å; D1261-R1268 IonicContact OD2-NE 3.94Å; D1261-R1268 PolarHBondContact OD2-NE 2.9Å; D1261-R1268 IonicContact OD2-NH1 3.26Å
1262	E	70.3	Confident	73.4	Confident	85 Å²	85	67.5 Å²	67.5	40%	0.397	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-24.4	-177.4	-64.6	-170.2	158.6	0	0	113.6	R1251 F1260	R1251-E1262 IonicContact CZ-OE1 3.09Å; R1251-E1262 IonicContact NH2-OE1 3.92Å; R1251-E1262 PolarHBondContact NH2-OE1 3.47Å; F1260-E1262 HydrophobicContact CD1-CG 3.87Å; F1260-E1262 HydrophobicContact CE1-CG 4.05Å; F1260-E1262 PolarHBondContact O-N 3.06Å
1263	D	69	Low	74.4	Confident	124 Å²	124	65.4 Å²	65.4	66%	0.663	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-26	-178.3	-71.2	-39.1	0	0	0	112	K1243 D1261	K1243-D1263 IonicContact NZ-OD1 3.91Å; K1243-D1263 PolarHBondContact NZ-OD1 3.14Å; D1261-D1263 PolarHBondContact O-N 2.98Å; D1261-D1263 PolarHBondContact OD1-N 3.18Å; D1261-D1263 VanDerWaalsContact OD1-N 3.11Å
1264	Q	72.9	Confident	75.6	Confident	118 Å²	118	60.4 Å²	60.4	55%	0.551	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.3	-5	179.8	-65.1	-149.4	-22.9	0	0	114.9	D1261 V1266	D1261-Q1264 PolarHBondContact O-N 3.39Å; D1261-Q1264 PolarHBondContact OD1-N 2.73Å; Q1264-V1266 HydrophobicContact CB-CG1 3.81Å; Q1264-V1266 PolarHBondContact O-N 3.22Å
1265	D	67.1	Low	76.5	Confident	84 Å²	84	62.4 Å²	62.4	45%	0.449	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	37.5	-176.9	-159	16.9	0	0	0	112.7	Y1240 F1260 D1261	Y1240-D1265 PolarHBondContact OH-OD1 2.79Å; Y1240-D1265 VanDerWaalsContact OH-OD1 3.14Å; Y1240-D1265 PolarHBondContact OH-OD2 3.06Å; F1260-D1265 WeakPolarHBondContact CZ-OD1 3.2Å; D1261-D1265 PolarHBondContact O-N 2.02Å
1266	V	74.2	Confident	77.5	Confident	65 Å²	65	58.2 Å²	58.2	39%	0.394	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	145.2	-176.1	75.3	0	0	0	0	112.1	D1261 Q1264 R1268	D1261-V1266 WeakPolarHBondContact CB-O 3.47Å; D1261-V1266 PolarHBondContact N-O 3.1Å; D1261-V1266 PolarHBondContact O-N 3.37Å; Q1264-V1266 HydrophobicContact CB-CG1 3.81Å; Q1264-V1266 PolarHBondContact O-N 3.22Å; V1266-R1268 HydrophobicContact CG1-CG 4.12Å
1267	C	76	Confident	78.4	Confident	33 Å²	33	56.6 Å²	56.6	22%	0.223	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	129.6	172.1	-62.2	0	0	0	0	110.5	C1254 E1258 Y1259	C1254-C1267 WeakPolarHBondContact CA-SG 3.37Å; C1254-C1267 HydrophobicContact CB-CB 3.67Å; C1254-C1267 WeakPolarHBondContact CB-SG 2.93Å; C1254-C1267 VanDerWaalsContact SG-CA 3.59Å; C1254-C1267 WeakPolarHBondContact SG-CB 3.46Å; C1254-C1267 CovalentContact SG-SG 2.03Å; C1254-C1267 PolarHBondContact SG-SG 3.12Å; E1258-C1267 HydrophobicContact CB-CB 4.31Å; E1258-C1267 WeakPolarHBondContact OE2-CB 3.32Å; Y1259-C1267 WeakPolarHBondContact O-CA 3.03Å
1268	R	80.6	Confident	79	Confident	93 Å²	93	57.4 Å²	57.4	35%	0.351	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	147.7	180	-72.7	-173.8	167	-157.8	-7	111	E1258 Y1259 D1261 V1266	E1258-R1268 CarbonylContact C-O 3.59Å; E1258-R1268 WeakPolarHBondContact CA-O 3.4Å; E1258-R1268 VanDerWaalsContact CB-O 3.26Å; E1258-R1268 WeakPolarHBondContact CB-O 3Å; Y1259-R1268 HydrophobicContact CD1-CB 4.33Å; Y1259-R1268 VanDerWaalsContact CD1-O 3.32Å; Y1259-R1268 WeakPolarHBondContact CD1-O 3.5Å; Y1259-R1268 HydrophobicContact CE1-CB 3.7Å; Y1259-R1268 PolarHBondContact N-O 3.34Å; Y1259-R1268 PolarHBondContact O-N 3.08Å; D1261-R1268 HydrophobicContact CB-CG 4.28Å; D1261-R1268 WeakPolarHBondContact OD2-CD 3.49Å; D1261-R1268 IonicContact OD2-CZ 2.83Å; D1261-R1268 IonicContact OD2-NE 3.94Å; D1261-R1268 PolarHBondContact OD2-NE 2.9Å; D1261-R1268 IonicContact OD2-NH1 3.26Å; V1266-R1268 HydrophobicContact CG1-CG 4.12Å
1269	P	81	Confident	79.1	Confident	96 Å²	96	55.2 Å²	55.2	62%	0.623	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.8	144.2	-178.7	26.6	-34.5	0	0	0	112.6	S1257 Y1259	S1257-P1269 CarbonylContact O-C 3.6Å; S1257-P1269 WeakPolarHBondContact O-CA 3.02Å; Y1259-P1269 WeakPolarHBondContact CE1-O 3.41Å
1270	C	85.4	Confident	79.4	Confident	19 Å²	19	56.7 Å²	56.7	13%	0.128	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-68.4	164	169.4	-68.8	0	0	0	0	112.1	S1257 C1274 C1277	S1257-C1270 WeakPolarHBondContact O-CB 3.19Å; S1257-C1270 PolarHBondContact O-N 2.83Å; C1270-C1274 HydrophobicContact CB-CB 4.14Å; C1270-C1277 WeakPolarHBondContact CA-SG 3.01Å; C1270-C1277 HydrophobicContact CB-CB 3.69Å; C1270-C1277 WeakPolarHBondContact CB-SG 3Å; C1270-C1277 WeakPolarHBondContact SG-CB 3.44Å; C1270-C1277 PolarHBondContact SG-N 2.04Å; C1270-C1277 CovalentContact SG-SG 2.02Å; C1270-C1277 PolarHBondContact SG-SG 3.13Å
1271	D	86.4	Confident	79.7	Confident	36 Å²	36	59 Å²	59	19%	0.193	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-56.1	142.4	166.2	-179.7	-104.4	0	0	0	111.1	N1273 C1274 P1282	D1271-N1273 PolarHBondContact O-N 3.35Å; D1271-N1273 VanDerWaalsContact OD1-CB 3.25Å; D1271-N1273 WeakPolarHBondContact OD1-CB 3.2Å; D1271-N1273 PolarHBondContact OD1-N 3.44Å; D1271-N1273 PolarHBondContact OD1-ND2 2.8Å; D1271-C1274 WeakPolarHBondContact O-CB 3.35Å; D1271-C1274 PolarHBondContact O-N 2.96Å; D1271-P1282 HydrophobicContact CB-CG 4.39Å
1272	S	82	Confident	79.9	Confident	96 Å²	96	60.6 Å²	60.6	67%	0.671	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-19.7	-177.1	61.8	0	0	0	0	115.1	N1289	S1272-N1289 PolarHBondContact O-ND2 2.82Å
1273	N	83.6	Confident	80.5	Confident	40 Å²	40	60.7 Å²	60.7	21%	0.214	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-20.4	176.9	-56.5	-58.4	0	0	0	113.3	D1271 N1289 R1296 C1330	D1271-N1273 PolarHBondContact O-N 3.35Å; D1271-N1273 VanDerWaalsContact OD1-CB 3.25Å; D1271-N1273 WeakPolarHBondContact OD1-CB 3.2Å; D1271-N1273 PolarHBondContact OD1-N 3.44Å; D1271-N1273 PolarHBondContact OD1-ND2 2.8Å; N1273-N1289 PolarHBondContact O-N 2.96Å; N1273-R1296 PolarHBondContact OD1-NE 2.86Å; N1273-R1296 PolarHBondContact OD1-NH1 3.44Å; N1273-R1296 PolarHBondContact OD1-NH2 3.04Å; N1273-C1330 HydrophobicContact CB-CB 4.33Å
1274	C	83.9	Confident	81.2	Confident	5 Å²	5	57.6 Å²	57.6	3%	0.034	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	144.2	177.4	-49.6	0	0	0	0	110.3	C1270 D1271 C1277 C1285 N1289	C1270-C1274 HydrophobicContact CB-CB 4.14Å; D1271-C1274 WeakPolarHBondContact O-CB 3.35Å; D1271-C1274 PolarHBondContact O-N 2.96Å; C1274-C1277 HydrophobicContact CB-CB 4.11Å; C1274-C1285 WeakPolarHBondContact CA-SG 3.25Å; C1274-C1285 HydrophobicContact CB-CB 3.65Å; C1274-C1285 WeakPolarHBondContact CB-SG 3.38Å; C1274-C1285 WeakPolarHBondContact SG-CA 3.43Å; C1274-C1285 WeakPolarHBondContact SG-CB 3.36Å; C1274-C1285 CovalentContact SG-SG 2.02Å; C1274-C1285 PolarHBondContact SG-SG 3.13Å; C1274-N1289 PolarHBondContact O-ND2 3.07Å; C1274-N1289 VanDerWaalsContact O-ND2 3.12Å
1275	R	82.4	Confident	81.8	Confident	73 Å²	73	52.1 Å²	52.1	28%	0.275	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	-41.5	162	-179	178.2	-175.5	-169.3	-1.2	110.7	L1256 S1287 N1289	L1256-R1275 CarbonylContact C-O 3.54Å; R1275-S1287 WeakPolarHBondContact CB-OG 2.94Å; R1275-S1287 PolarHBondContact N-O 3.22Å; R1275-N1289 WeakPolarHBondContact CA-OD1 3.03Å; R1275-N1289 WeakPolarHBondContact CB-OD1 3.04Å
1276	T	82	Confident	82.5	Confident	26 Å²	26	51.8 Å²	51.8	16%	0.16	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	148.2	170.1	62.3	0	0	0	0	109	L1256 C1285 T1286 S1287	L1256-T1276 HydrophobicContact CB-CG2 3.94Å; L1256-T1276 HydrophobicContact CD2-CG2 3.51Å; L1256-T1276 HydrophobicContact CG-CG2 4.24Å; L1256-T1276 VanDerWaalsContact O-CA 3.31Å; L1256-T1276 WeakPolarHBondContact O-CA 3.45Å; L1256-T1276 WeakPolarHBondContact O-CG2 3.36Å; T1276-C1285 WeakPolarHBondContact O-CA 3.35Å; T1276-T1286 VanDerWaalsContact C-OG1 3.28Å; T1276-T1286 WeakPolarHBondContact CB-OG1 3.31Å; T1276-T1286 PolarHBondContact O-N 3.47Å; T1276-T1286 PolarHBondContact O-OG1 3.03Å; T1276-T1286 PolarHBondContact OG1-OG1 3.11Å; T1276-S1287 WeakPolarHBondContact CB-OG 3.02Å; T1276-S1287 WeakPolarHBondContact CG2-OG 3.48Å; T1276-S1287 PolarHBondContact N-O 2.04Å; T1276-S1287 PolarHBondContact N-OG 3.14Å; T1276-S1287 VanDerWaalsContact N-OG 3.14Å; T1276-S1287 PolarHBondContact O-N 2.76Å; T1276-S1287 VanDerWaalsContact O-N 3.16Å; T1276-S1287 VanDerWaalsContact OG1-CB 3.3Å; T1276-S1287 WeakPolarHBondContact OG1-CB 3.45Å; T1276-S1287 PolarHBondContact OG1-N 2.89Å; T1276-S1287 VanDerWaalsContact OG1-N 3.14Å; T1276-S1287 PolarHBondContact OG1-OG 3.18Å
1277	C	84.5	Confident	83	Confident	15 Å²	15	50.3 Å²	50.3	10%	0.101	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	161.8	-177.2	67.9	0	0	0	0	111.8	C1270 C1274 G1279 Q1284 T1286	C1270-C1277 WeakPolarHBondContact CA-SG 3.01Å; C1270-C1277 HydrophobicContact CB-CB 3.69Å; C1270-C1277 WeakPolarHBondContact CB-SG 3Å; C1270-C1277 WeakPolarHBondContact SG-CB 3.44Å; C1270-C1277 PolarHBondContact SG-N 2.04Å; C1270-C1277 CovalentContact SG-SG 2.02Å; C1270-C1277 PolarHBondContact SG-SG 3.13Å; C1274-C1277 HydrophobicContact CB-CB 4.11Å; C1277-G1279 WeakPolarHBondContact CB-O 3.47Å; C1277-G1279 PolarHBondContact SG-O 2.93Å; C1277-Q1284 CarbonylContact C-O 3.58Å; C1277-Q1284 WeakPolarHBondContact CA-O 3.37Å; C1277-T1286 PolarHBondContact N-OG1 3.46Å
1278	S	82.8	Confident	83.4	Confident	81 Å²	81	49 Å²	49	57%	0.566	28%	0.28	S	S	*	.	S	Bend	trans	-98.2	-6.7	171	54.4	0	0	0	0	112.7	Q1284	S1278-Q1284 PolarHBondContact N-O 3.08Å; S1278-Q1284 PolarHBondContact OG-O 3.07Å
1279	G	83.8	Confident	83.4	Confident	3 Å²	3	47.5 Å²	47.5	3%	0.031	28%	0.279	C	S	.	.	S	Bend	trans	-174.3	-179.5	-178.1	0	0	0	0	0	111	C1277 N1281	C1277-G1279 WeakPolarHBondContact CB-O 3.47Å; C1277-G1279 PolarHBondContact SG-O 2.93Å; G1279-N1281 VanDerWaalsContact C-N 3.25Å; G1279-N1281 PolarHBondContact O-N 2.81Å
1280	P	85	Confident	83	Confident	60 Å²	60	45.3 Å²	45.3	39%	0.39	26%	0.258	S	S	.	.	S	Bend	trans	-72.3	-16.6	-171.4	26.5	-31.2	0	0	0	113.9	Y1259	Y1259-P1280 HydrophobicContact CE1-CB 3.7Å; Y1259-P1280 HydrophobicContact CE1-CG 4.28Å; Y1259-P1280 VanDerWaalsContact CZ-CD 3.47Å; Y1259-P1280 WeakPolarHBondContact OH-CB 2.99Å; Y1259-P1280 WeakPolarHBondContact OH-CG 3.28Å
1281	N	84.4	Confident	82.1	Confident	66 Å²	66	49.8 Å²	49.8	35%	0.353	28%	0.275	S	S	.	.	S	Bend	trans	-88.7	150.7	-166	-62.7	-25.9	0	0	0	113.2	G1279 F1283 Q1284	G1279-N1281 VanDerWaalsContact C-N 3.25Å; G1279-N1281 PolarHBondContact O-N 2.81Å; N1281-F1283 HydrophobicContact CB-CD1 4.1Å; N1281-F1283 HydrophobicContact CB-CD2 4.19Å; N1281-F1283 HydrophobicContact CB-CE1 3.62Å; N1281-F1283 HydrophobicContact CB-CE2 3.71Å; N1281-F1283 HydrophobicContact CB-CG 4.37Å; N1281-F1283 HydrophobicContact CB-CZ 3.41Å; N1281-F1283 VanDerWaalsContact CB-CZ 3.41Å; N1281-F1283 VanDerWaalsContact ND2-CZ 3.31Å; N1281-F1283 WeakPolarHBondContact ND2-CZ 3.02Å; N1281-F1283 PolarHBondContact O-N 2.79Å; N1281-Q1284 HydrophobicContact CB-CG 4.21Å; N1281-Q1284 WeakPolarHBondContact O-CB 3.13Å; N1281-Q1284 PolarHBondContact O-N 2.72Å
1282	P	81.4	Confident	80.6	Confident	55 Å²	55	53.4 Å²	53.4	36%	0.357	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-18.2	-179.3	-23	30	0	0	0	116.4	D1271 C1285	D1271-P1282 HydrophobicContact CB-CG 4.39Å; P1282-C1285 PolarHBondContact O-SG 2.76Å; P1282-C1285 VanDerWaalsContact O-SG 3.35Å
1283	F	81.7	Confident	79.1	Confident	86 Å²	86	54.8 Å²	54.8	38%	0.377	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	0.8	177	47.6	-95.6	0	0	0	112.6	N1281 G1328	N1281-F1283 HydrophobicContact CB-CD1 4.1Å; N1281-F1283 HydrophobicContact CB-CD2 4.19Å; N1281-F1283 HydrophobicContact CB-CE1 3.62Å; N1281-F1283 HydrophobicContact CB-CE2 3.71Å; N1281-F1283 HydrophobicContact CB-CG 4.37Å; N1281-F1283 HydrophobicContact CB-CZ 3.41Å; N1281-F1283 VanDerWaalsContact CB-CZ 3.41Å; N1281-F1283 VanDerWaalsContact ND2-CZ 3.31Å; N1281-F1283 WeakPolarHBondContact ND2-CZ 3.02Å; N1281-F1283 PolarHBondContact O-N 2.79Å; F1283-G1328 CarbonylContact C-O 3.5Å; F1283-G1328 CarbonylContact O-C 3.6Å; F1283-G1328 WeakPolarHBondContact O-CA 3.23Å
1284	Q	84.9	Confident	78.3	Confident	59 Å²	59	54.7 Å²	54.7	28%	0.276	31%	0.312	S	S	.	.			trans	-101.9	17.3	177.6	-67.5	-179.8	-55.8	0	0	112	C1277 S1278 N1281	C1277-Q1284 CarbonylContact C-O 3.58Å; C1277-Q1284 WeakPolarHBondContact CA-O 3.37Å; S1278-Q1284 PolarHBondContact N-O 3.08Å; S1278-Q1284 PolarHBondContact OG-O 3.07Å; N1281-Q1284 HydrophobicContact CB-CG 4.21Å; N1281-Q1284 WeakPolarHBondContact O-CB 3.13Å; N1281-Q1284 PolarHBondContact O-N 2.72Å
1285	C	85.2	Confident	77.8	Confident	4 Å²	4	54.9 Å²	54.9	3%	0.027	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	135.1	175.3	-48.7	0	0	0	0	110.2	C1274 T1276 P1282 L1298 G1328 C1330	C1274-C1285 WeakPolarHBondContact CA-SG 3.25Å; C1274-C1285 HydrophobicContact CB-CB 3.65Å; C1274-C1285 WeakPolarHBondContact CB-SG 3.38Å; C1274-C1285 WeakPolarHBondContact SG-CA 3.43Å; C1274-C1285 WeakPolarHBondContact SG-CB 3.36Å; C1274-C1285 CovalentContact SG-SG 2.02Å; C1274-C1285 PolarHBondContact SG-SG 3.13Å; T1276-C1285 WeakPolarHBondContact O-CA 3.35Å; P1282-C1285 PolarHBondContact O-SG 2.76Å; P1282-C1285 VanDerWaalsContact O-SG 3.35Å; C1285-L1298 HydrophobicContact CB-CD1 4.19Å; C1285-L1298 WeakPolarHBondContact O-CD1 3.47Å; C1285-G1328 WeakPolarHBondContact CA-O 3.48Å; C1285-G1328 WeakPolarHBondContact CB-O 3.18Å; C1285-G1328 PolarHBondContact N-O 2.02Å; C1285-G1328 VanDerWaalsContact O-CA 3.3Å; C1285-G1328 WeakPolarHBondContact O-CA 3.29Å; C1285-C1330 WeakPolarHBondContact CB-SG 3.07Å; C1285-C1330 PolarHBondContact SG-SG 3.17Å
1286	T	82.3	Confident	77.9	Confident	77 Å²	77	53.8 Å²	53.8	47%	0.472	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	-18	169.7	52.9	0	0	0	0	111.5	T1276 C1277	T1276-T1286 VanDerWaalsContact C-OG1 3.28Å; T1276-T1286 WeakPolarHBondContact CB-OG1 3.31Å; T1276-T1286 PolarHBondContact O-N 3.47Å; T1276-T1286 PolarHBondContact O-OG1 3.03Å; T1276-T1286 PolarHBondContact OG1-OG1 3.11Å; C1277-T1286 PolarHBondContact N-OG1 3.46Å
1287	S	83.1	Confident	78	Confident	33 Å²	33	52.5 Å²	52.5	23%	0.231	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	161.3	166.3	72.6	0	0	0	0	110.8	R1275 T1276	R1275-S1287 WeakPolarHBondContact CB-OG 2.94Å; R1275-S1287 PolarHBondContact N-O 3.22Å; T1276-S1287 WeakPolarHBondContact CB-OG 3.02Å; T1276-S1287 WeakPolarHBondContact CG2-OG 3.48Å; T1276-S1287 PolarHBondContact N-O 2.04Å; T1276-S1287 PolarHBondContact N-OG 3.14Å; T1276-S1287 VanDerWaalsContact N-OG 3.14Å; T1276-S1287 PolarHBondContact O-N 2.76Å; T1276-S1287 VanDerWaalsContact O-N 3.16Å; T1276-S1287 VanDerWaalsContact OG1-CB 3.3Å; T1276-S1287 WeakPolarHBondContact OG1-CB 3.45Å; T1276-S1287 PolarHBondContact OG1-N 2.89Å; T1276-S1287 VanDerWaalsContact OG1-N 3.14Å; T1276-S1287 PolarHBondContact OG1-OG 3.18Å
1288	C	85.1	Confident	78	Confident	7 Å²	7	53 Å²	53	5%	0.047	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	153.1	-172.2	-57.3	0	0	0	0	113	R1290 R1296 C1297 L1298 C1330	C1288-R1290 PolarHBondContact O-N 2.86Å; C1288-R1296 HydrophobicContact CB-CB 3.91Å; C1288-C1297 PolarHBondContact SG-O 2.03Å; C1288-C1297 VanDerWaalsContact SG-O 3.41Å; C1288-L1298 WeakPolarHBondContact SG-CA 3.44Å; C1288-L1298 PolarHBondContact SG-N 3.21Å; C1288-L1298 VanDerWaalsContact SG-N 3.37Å; C1288-C1330 WeakPolarHBondContact CA-SG 3.29Å; C1288-C1330 HydrophobicContact CB-CB 3.69Å; C1288-C1330 WeakPolarHBondContact CB-SG 3.48Å; C1288-C1330 WeakPolarHBondContact SG-CA 3.1Å; C1288-C1330 WeakPolarHBondContact SG-CB 3.33Å; C1288-C1330 CovalentContact SG-SG 2.02Å; C1288-C1330 PolarHBondContact SG-SG 3.32Å
1289	N	79.6	Confident	77.6	Confident	61 Å²	61	50.2 Å²	50.2	33%	0.326	28%	0.282	S	S	.	.			trans	-66.2	113.5	173.2	-76.6	-30.1	0	0	0	110.5	S1272 N1273 C1274 R1275 R1296	S1272-N1289 PolarHBondContact O-ND2 2.82Å; N1273-N1289 PolarHBondContact O-N 2.96Å; C1274-N1289 PolarHBondContact O-ND2 3.07Å; C1274-N1289 VanDerWaalsContact O-ND2 3.12Å; R1275-N1289 WeakPolarHBondContact CA-OD1 3.03Å; R1275-N1289 WeakPolarHBondContact CB-OD1 3.04Å; N1289-R1296 PolarHBondContact O-N 3.43Å
1290	R	74.2	Confident	76.9	Confident	49 Å²	49	51.7 Å²	51.7	19%	0.185	29%	0.29	C	S	.	.			trans	-95.9	-9.1	-176	-78.6	-84.4	169.6	146.9	-3.3	114.1	C1288 P1295 R1296 V1352 K1355 P1356	C1288-R1290 PolarHBondContact O-N 2.86Å; R1290-P1295 WeakPolarHBondContact O-CB 3.45Å; R1290-R1296 WeakPolarHBondContact CD-O 3.31Å; R1290-R1296 PolarHBondContact NE-O 2.81Å; R1290-V1352 PolarHBondContact NH1-O 2.81Å; R1290-K1355 PolarHBondContact NH1-O 2.53Å; R1290-K1355 PolarHBondContact NH2-O 3.46Å; R1290-P1356 VanDerWaalsContact NH2-CA 3.29Å; R1290-P1356 PolarHBondContact NH2-O 2.91Å
1291	K	65	Low	75.7	Confident	113 Å²	113	52.9 Å²	52.9	49%	0.491	29%	0.293	S	S	.	.	S	Bend	trans	-87.9	152.4	-176.8	-72.2	-170.2	177.7	-169	0	111.7	E852	E852-K1291 VanDerWaalsContact CB-NZ 3.31Å; E852-K1291 VanDerWaalsContact CD-NZ 3.3Å; E852-K1291 VanDerWaalsContact CG-NZ 3.29Å; E852-K1291 IonicContact OE2-NZ 3.93Å; E852-K1291 PolarHBondContact OE2-NZ 2.83Å
1292	P	54.8	Low	74.3	Confident	112 Å²	112	58.2 Å²	58.2	73%	0.727	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	155.2	170.1	-20.7	31.8	0	0	0	111.7
1293	P	52.2	Low	72.8	Confident	125 Å²	125	59.1 Å²	59.1	81%	0.812	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	cis	-84.9	-13.6	13.2	31.2	-34.7	0	0	0	115.5
1294	A	65.5	Low	71.2	Confident	38 Å²	38	56 Å²	56	31%	0.314	30%	0.301	S	S	.	.	S	Bend	trans	-133.9	78.4	-173.8	0	0	0	0	0	111.1	L1332	A1294-L1332 HydrophobicContact CB-CD2 3.73Å
1295	P	74.4	Confident	69.4	Low	10 Å²	10	57.5 Å²	57.5	7%	0.065	32%	0.317	C	S	.	.			trans	-61.2	142.9	178.4	27.4	-34.7	0	0	0	110.8	R1290 C1333	R1290-P1295 WeakPolarHBondContact O-CB 3.45Å; P1295-C1333 HydrophobicContact CG-CB 4.17Å; P1295-C1333 PolarHBondContact O-N 2.94Å; P1295-C1333 PolarHBondContact O-SG 3.08Å
1296	R	83.6	Confident	67.3	Low	49 Å²	49	65.4 Å²	65.4	19%	0.185	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	155.2	-178.2	-64.3	-176.3	176.6	-132.4	6.4	112.6	N1273 C1288 N1289 R1290 C1330 L1331 L1332	N1273-R1296 PolarHBondContact OD1-NE 2.86Å; N1273-R1296 PolarHBondContact OD1-NH1 3.44Å; N1273-R1296 PolarHBondContact OD1-NH2 3.04Å; C1288-R1296 HydrophobicContact CB-CB 3.91Å; N1289-R1296 PolarHBondContact O-N 3.43Å; R1290-R1296 WeakPolarHBondContact CD-O 3.31Å; R1290-R1296 PolarHBondContact NE-O 2.81Å; R1296-C1330 HydrophobicContact CB-CB 4.15Å; R1296-C1330 PolarHBondContact NH1-O 2.97Å; R1296-L1331 CarbonylContact C-O 3.57Å; R1296-L1331 WeakPolarHBondContact CA-O 3.12Å; R1296-L1331 WeakPolarHBondContact CB-O 3.41Å; R1296-L1332 HydrophobicContact CG-CG 4.44Å
1297	C	83.9	Confident	65.5	Low	0 Å²	0	65 Å²	65	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	155.5	174.5	56.7	0	0	0	0	111.1	C1288 C1330 L1331 C1351 C1358	C1288-C1297 PolarHBondContact SG-O 2.03Å; C1288-C1297 VanDerWaalsContact SG-O 3.41Å; C1297-C1330 WeakPolarHBondContact O-CA 3.26Å; C1297-L1331 PolarHBondContact N-O 3Å; C1297-L1331 PolarHBondContact O-N 3.23Å; C1297-C1351 VanDerWaalsContact CB-SG 3.57Å; C1297-C1351 PolarHBondContact SG-SG 3.49Å; C1297-C1358 HydrophobicContact CB-CB 3.95Å; C1297-C1358 WeakPolarHBondContact CB-SG 2.88Å; C1297-C1358 PolarHBondContact O-SG 3.23Å; C1297-C1358 WeakPolarHBondContact SG-CA 3.39Å; C1297-C1358 WeakPolarHBondContact SG-CB 2.94Å; C1297-C1358 CovalentContact SG-SG 2.02Å; C1297-C1358 PolarHBondContact SG-SG 3.45Å
1298	L	84	Confident	63.4	Low	25 Å²	25	69 Å²	69	13%	0.131	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	129.8	-178.3	-168.6	70.4	0	0	0	110.6	C1285 C1288 T1300 P1356 I1357 C1358	C1285-L1298 HydrophobicContact CB-CD1 4.19Å; C1285-L1298 WeakPolarHBondContact O-CD1 3.47Å; C1288-L1298 WeakPolarHBondContact SG-CA 3.44Å; C1288-L1298 PolarHBondContact SG-N 3.21Å; C1288-L1298 VanDerWaalsContact SG-N 3.37Å; L1298-T1300 HydrophobicContact CD2-CG2 4.22Å; L1298-T1300 HydrophobicContact CG-CG2 4.4Å; L1298-P1356 PolarHBondContact N-O 3.29Å; L1298-P1356 VanDerWaalsContact N-O 3.16Å; L1298-I1357 WeakPolarHBondContact O-CA 3.48Å; L1298-I1357 VanDerWaalsContact O-CG2 3.28Å; L1298-I1357 WeakPolarHBondContact O-CG2 3.49Å; L1298-C1358 PolarHBondContact O-N 3.34Å; L1298-C1358 VanDerWaalsContact O-N 3.09Å
1299	L	76.1	Confident	61.3	Low	23 Å²	23	79.4 Å²	79.4	12%	0.12	40%	0.399	C	S	.	.			trans	-86.1	128.3	170.2	-171.5	68.7	0	0	0	110.3	V1304 N1326 G1328 Q1329 L1331 M1349	L1299-V1304 HydrophobicContact CD2-CG2 4.4Å; L1299-V1304 HydrophobicContact CG-CG2 4.43Å; L1299-N1326 HydrophobicContact CD2-CB 3.84Å; L1299-G1328 PolarHBondContact O-N 2.03Å; L1299-Q1329 PolarHBondContact N-O 2.86Å; L1299-L1331 HydrophobicContact CB-CD1 4.29Å; L1299-L1331 HydrophobicContact CD1-CD1 4.25Å; L1299-L1331 HydrophobicContact CD2-CD1 4.14Å; L1299-L1331 HydrophobicContact CG-CD1 4.47Å; L1299-M1349 HydrophobicContact CD1-CE 4.41Å; L1299-M1349 HydrophobicContact CD1-SD 3.57Å; L1299-M1349 VanDerWaalsContact CD1-SD 3.57Å
1300	T	68	Low	59.3	Low	33 Å²	33	82.3 Å²	82.3	20%	0.202	42%	0.419	C	S	.	.			trans	-120.5	147.1	-177.4	62.6	0	0	0	0	113.1	L1298 Q1302 R1303 I1357	L1298-T1300 HydrophobicContact CD2-CG2 4.22Å; L1298-T1300 HydrophobicContact CG-CG2 4.4Å; T1300-Q1302 VanDerWaalsContact C-N 3.26Å; T1300-Q1302 PolarHBondContact O-N 2.88Å; T1300-Q1302 VanDerWaalsContact O-N 3.13Å; T1300-R1303 PolarHBondContact O-N 3.13Å; T1300-I1357 HydrophobicContact CG2-CD1 4.21Å; T1300-I1357 HydrophobicContact CG2-CG1 4.16Å; T1300-I1357 HydrophobicContact CG2-CG2 3.94Å
1301	N	59.3	Low	57.5	Low	85 Å²	85	83.6 Å²	83.6	46%	0.455	44%	0.436	S	S	.	.	H	α-helix	trans	-57	-30	-173.4	-80.7	-17.5	0	0	0	115.2	R1303 S1327	N1301-R1303 PolarHBondContact O-N 3.27Å; N1301-R1303 VanDerWaalsContact O-N 3.09Å; N1301-S1327 VanDerWaalsContact CG-CB 3.45Å; N1301-S1327 VanDerWaalsContact ND2-CB 3.32Å; N1301-S1327 WeakPolarHBondContact ND2-CB 3.27Å; N1301-S1327 PolarHBondContact ND2-OG 3.21Å; N1301-S1327 WeakPolarHBondContact OD1-CB 3.23Å
1302	Q	55.2	Low	56.5	Low	179 Å²	179	88.3 Å²	88.3	84%	0.836	46%	0.456	S	S	*	.	H	α-helix	trans	-62	-19.4	178.9	-72.1	-175.7	-10.8	0	0	112.9	T1300	T1300-Q1302 VanDerWaalsContact C-N 3.26Å; T1300-Q1302 PolarHBondContact O-N 2.88Å; T1300-Q1302 VanDerWaalsContact O-N 3.13Å
1303	R	50.3	Low	55.6	Low	73 Å²	73	89.3 Å²	89.3	28%	0.275	46%	0.455	S	S	.	.	H	α-helix	trans	-105.4	-24.7	-171.8	-62.9	-174.9	-178	179	-3.2	114.2	T1300 N1301 S1305 K1306 C1358	T1300-R1303 PolarHBondContact O-N 3.13Å; N1301-R1303 PolarHBondContact O-N 3.27Å; N1301-R1303 VanDerWaalsContact O-N 3.09Å; R1303-S1305 PolarHBondContact O-N 3.21Å; R1303-K1306 PolarHBondContact O-N 3.49Å; R1303-C1358 PolarHBondContact NH1-O 3.3Å
1304	V	49.4	Very low	54.8	Low	22 Å²	22	89 Å²	89	13%	0.133	45%	0.446	C	S	.	.	H	α-helix	trans	-61.5	-30.5	176.8	-175.6	0	0	0	0	111.8	L1299 K1306 L1307	L1299-V1304 HydrophobicContact CD2-CG2 4.4Å; L1299-V1304 HydrophobicContact CG-CG2 4.43Å; V1304-K1306 PolarHBondContact O-N 3.09Å; V1304-K1306 VanDerWaalsContact O-N 3.13Å; V1304-L1307 PolarHBondContact O-N 2.98Å; V1304-L1307 VanDerWaalsContact O-N 3.17Å
1305	S	45	Very low	53.1	Low	90 Å²	90	91.4 Å²	91.4	63%	0.629	47%	0.466	S	S	*	.	H	α-helix	trans	-60.5	-24.1	178.8	-57.9	0	0	0	0	114.1	R1303	R1303-S1305 PolarHBondContact O-N 3.21Å
1306	K	43.1	Very low	51.4	Low	170 Å²	170	95.7 Å²	95.7	74%	0.739	49%	0.494	S	S	*	.	H	α-helix	trans	-86	-31.2	177.5	-80.8	-175.2	177.6	179.9	0	113.1	R1303 V1304 H1308	R1303-K1306 PolarHBondContact O-N 3.49Å; V1304-K1306 PolarHBondContact O-N 3.09Å; V1304-K1306 VanDerWaalsContact O-N 3.13Å; K1306-H1308 VanDerWaalsContact C-N 3.29Å; K1306-H1308 PolarHBondContact O-N 3.08Å
1307	L	42.5	Very low	48.8	Very low	67 Å²	67	105.8 Å²	105.8	35%	0.351	53%	0.532	S	S	.	.	H	α-helix	trans	-64.3	-33.1	177.9	-109.4	80.3	0	0	0	112.5	V1304 R1309 D1344	V1304-L1307 PolarHBondContact O-N 2.98Å; V1304-L1307 VanDerWaalsContact O-N 3.17Å; L1307-R1309 VanDerWaalsContact C-N 3.27Å; L1307-R1309 PolarHBondContact O-N 2.99Å; L1307-D1344 WeakPolarHBondContact CD2-OD1 3.45Å; L1307-D1344 VanDerWaalsContact CG-OD1 3.28Å; L1307-D1344 WeakPolarHBondContact CG-OD1 3Å; L1307-D1344 WeakPolarHBondContact CG-OD2 3.42Å
1308	H	41	Very low	46.3	Very low	118 Å²	118	111.2 Å²	111.2	55%	0.546	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.4	3.3	-172.3	-76.7	-47.5	0	0	0	116.4	K1306	K1306-H1308 VanDerWaalsContact C-N 3.29Å; K1306-H1308 PolarHBondContact O-N 3.08Å
1309	R	40	Very low	44.2	Very low	226 Å²	226	116.8 Å²	116.8	85%	0.853	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-6	-171.8	-104.2	-176	-171.9	175.4	4.2	116.6	L1307	L1307-R1309 VanDerWaalsContact C-N 3.27Å; L1307-R1309 PolarHBondContact O-N 2.99Å
1310	T	38.2	Very low	42.3	Very low	121 Å²	121	125.5 Å²	125.5	74%	0.742	63%	0.628	S	S	*	*	S	Bend	trans	-140.2	125.9	179.9	51.3	0	0	0	0	112.5
1311	S	36.8	Very low	41	Very low	77 Å²	77	129.2 Å²	129.2	54%	0.538	66%	0.655	S	S	.	*			trans	100.8	120.7	170.8	-169	0	0	0	0	117.1	D1313	S1311-D1313 VanDerWaalsContact C-N 3.26Å; S1311-D1313 PolarHBondContact O-N 3.26Å; S1311-D1313 PolarHBondContact OG-N 3.02Å
1312	K	42.3	Very low	40.1	Very low	212 Å²	212	133.1 Å²	133.1	92%	0.922	68%	0.676	S	S	*	*	S	Bend	trans	-78.8	5.8	178.7	-102.5	177.8	174.6	178.5	0	113.8	L1314	K1312-L1314 PolarHBondContact O-N 3.48Å
1313	D	36.5	Very low	39.4	Very low	133 Å²	133	128.3 Å²	128.3	71%	0.711	66%	0.659	S	S	*	*			trans	-97.2	52.9	-178.2	-63.6	-32.1	0	0	0	112.9	S1311	S1311-D1313 VanDerWaalsContact C-N 3.26Å; S1311-D1313 PolarHBondContact O-N 3.26Å; S1311-D1313 PolarHBondContact OG-N 3.02Å
1314	L	35.9	Very low	39.1	Very low	118 Å²	118	131.4 Å²	131.4	62%	0.618	68%	0.676	S	S	*	*			trans	-98.7	75	168.8	-84.7	158.4	0	0	0	109.8	K1312	K1312-L1314 PolarHBondContact O-N 3.48Å
1315	A	28.7	Very low	39	Very low	89 Å²	89	134.1 Å²	134.1	74%	0.736	69%	0.694	S	S	*	*			trans	-149.2	134.1	160.3	0	0	0	0	0	108.5
1316	P	40	Very low	39.4	Very low	99 Å²	99	133.5 Å²	133.5	64%	0.643	68%	0.684	S	S	*	*			cis	-125.4	121.4	-0.3	33.9	-14.4	0	0	0	113.1
1317	W	28.3	Very low	40.4	Very low	261 Å²	261	127.3 Å²	127.3	99%	0.989	66%	0.662	S	S	*	*			trans	-116.4	42.9	153.4	-77.6	72.8	0	0	0	108.8
1318	T	31.8	Very low	41.8	Very low	114 Å²	114	124.7 Å²	124.7	70%	0.699	65%	0.651	S	S	*	*			trans	-98.9	91	-179.3	51.6	0	0	0	0	108.7
1319	D	39.1	Very low	43.7	Very low	143 Å²	143	122.2 Å²	122.2	77%	0.765	64%	0.64	S	S	*	*	S	Bend	trans	-155.1	8.4	145	-131	4.1	0	0	0	116.3
1320	Y	37	Very low	45.8	Very low	206 Å²	206	111.6 Å²	111.6	81%	0.808	60%	0.6	S	S	*	*			trans	-123	78.8	169.7	-84.5	-87.6	0	0	0	110.3	N1322	Y1320-N1322 PolarHBondContact O-N 3Å
1321	S	40.7	Very low	47.8	Very low	110 Å²	110	107 Å²	107	77%	0.769	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	11.5	-168.8	-55.1	0	0	0	0	116.6
1322	N	41	Very low	49.9	Very low	168 Å²	168	106.6 Å²	106.6	90%	0.898	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.7	18.5	-176.6	-76	-31.1	0	0	0	115.1	Y1320	Y1320-N1322 PolarHBondContact O-N 3Å
1323	V	40.1	Very low	51.5	Low	77 Å²	77	96.7 Å²	96.7	47%	0.467	52%	0.52	S	S	.	.	S	Bend	trans	-104.2	119.4	175.5	-176	0	0	0	0	109.2
1324	E	44.4	Very low	53	Low	138 Å²	138	90.6 Å²	90.6	65%	0.645	49%	0.488	S	S	*	.			trans	-51.7	131.6	169.4	-80.9	179	141.6	0	0	109.6	N1326	E1324-N1326 PolarHBondContact O-N 2.86Å
1325	P	46.4	Very low	54.3	Low	79 Å²	79	87.1 Å²	87.1	51%	0.513	47%	0.472	S	S	.	.	S	Bend	trans	-69	100.7	-167.6	25.9	-32	0	0	0	111.6	S1327	P1325-S1327 PolarHBondContact O-N 3.05Å
1326	N	53.7	Low	55.9	Low	77 Å²	77	83.4 Å²	83.4	41%	0.412	44%	0.439	S	S	.	.			trans	70.2	18	151.1	-50.7	-20	0	0	0	119.7	L1299 E1324 G1328	L1299-N1326 HydrophobicContact CD2-CB 3.84Å; E1324-N1326 PolarHBondContact O-N 2.86Å; N1326-G1328 PolarHBondContact O-N 3.5Å
1327	S	63.3	Low	56.7	Low	40 Å²	40	83.1 Å²	83.1	28%	0.28	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	131.7	162.1	38.9	0	0	0	0	111	N1301 P1325	N1301-S1327 VanDerWaalsContact CG-CB 3.45Å; N1301-S1327 VanDerWaalsContact ND2-CB 3.32Å; N1301-S1327 WeakPolarHBondContact ND2-CB 3.27Å; N1301-S1327 PolarHBondContact ND2-OG 3.21Å; N1301-S1327 WeakPolarHBondContact OD1-CB 3.23Å; P1325-S1327 PolarHBondContact O-N 3.05Å
1328	G	72.7	Confident	58.1	Low	12 Å²	12	75.3 Å²	75.3	12%	0.124	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.4	6.8	173.7	0	0	0	0	0	114.3	F1283 C1285 L1299 N1326	F1283-G1328 CarbonylContact C-O 3.5Å; F1283-G1328 CarbonylContact O-C 3.6Å; F1283-G1328 WeakPolarHBondContact O-CA 3.23Å; C1285-G1328 WeakPolarHBondContact CA-O 3.48Å; C1285-G1328 WeakPolarHBondContact CB-O 3.18Å; C1285-G1328 PolarHBondContact N-O 2.02Å; C1285-G1328 VanDerWaalsContact O-CA 3.3Å; C1285-G1328 WeakPolarHBondContact O-CA 3.29Å; L1299-G1328 PolarHBondContact O-N 2.03Å; N1326-G1328 PolarHBondContact O-N 3.5Å
1329	Q	81.5	Confident	59.3	Low	66 Å²	66	69.9 Å²	69.9	31%	0.308	37%	0.369	S	S	.	.			trans	-85.4	135.1	175.8	-168.4	177.4	10.2	0	0	111.4	L1299	L1299-Q1329 PolarHBondContact N-O 2.86Å
1330	C	84.5	Confident	60.1	Low	3 Å²	3	64.9 Å²	64.9	2%	0.02	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	110.6	174.6	-70	0	0	0	0	111.9	N1273 C1285 C1288 R1296 C1297	N1273-C1330 HydrophobicContact CB-CB 4.33Å; C1285-C1330 WeakPolarHBondContact CB-SG 3.07Å; C1285-C1330 PolarHBondContact SG-SG 3.17Å; C1288-C1330 WeakPolarHBondContact CA-SG 3.29Å; C1288-C1330 HydrophobicContact CB-CB 3.69Å; C1288-C1330 WeakPolarHBondContact CB-SG 3.48Å; C1288-C1330 WeakPolarHBondContact SG-CA 3.1Å; C1288-C1330 WeakPolarHBondContact SG-CB 3.33Å; C1288-C1330 CovalentContact SG-SG 2.02Å; C1288-C1330 PolarHBondContact SG-SG 3.32Å; R1296-C1330 HydrophobicContact CB-CB 4.15Å; R1296-C1330 PolarHBondContact NH1-O 2.97Å; C1297-C1330 WeakPolarHBondContact O-CA 3.26Å
1331	L	80.2	Confident	60.9	Low	24 Å²	24	58.6 Å²	58.6	13%	0.126	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	145.8	179.6	-66.8	176.5	0	0	0	111.8	R1296 C1297 L1299 M1349	R1296-L1331 CarbonylContact C-O 3.57Å; R1296-L1331 WeakPolarHBondContact CA-O 3.12Å; R1296-L1331 WeakPolarHBondContact CB-O 3.41Å; C1297-L1331 PolarHBondContact N-O 3Å; C1297-L1331 PolarHBondContact O-N 3.23Å; L1299-L1331 HydrophobicContact CB-CD1 4.29Å; L1299-L1331 HydrophobicContact CD1-CD1 4.25Å; L1299-L1331 HydrophobicContact CD2-CD1 4.14Å; L1299-L1331 HydrophobicContact CG-CD1 4.47Å; L1331-M1349 HydrophobicContact CD1-CG 3.8Å; L1331-M1349 HydrophobicContact CD1-SD 3.64Å
1332	L	79.5	Confident	61.4	Low	69 Å²	69	55.1 Å²	55.1	36%	0.361	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	141.6	173.9	-79.2	129.7	0	0	0	111.3	A1294 R1296 C1348 M1349	A1294-L1332 HydrophobicContact CB-CD2 3.73Å; R1296-L1332 HydrophobicContact CG-CG 4.44Å; L1332-C1348 CarbonylContact O-C 3.57Å; L1332-C1348 WeakPolarHBondContact O-CA 3.43Å; L1332-C1348 VanDerWaalsContact O-CB 3.27Å; L1332-C1348 WeakPolarHBondContact O-CB 3.42Å; L1332-M1349 PolarHBondContact O-N 2.87Å
1333	C	75.9	Confident	62	Low	5 Å²	5	53.7 Å²	53.7	3%	0.034	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	129.9	170.8	-53.9	0	0	0	0	110.3	L793 P1295 M1349 C1351	L793-C1333 VanDerWaalsContact O-CB 3.24Å; L793-C1333 WeakPolarHBondContact O-CB 3.47Å; P1295-C1333 HydrophobicContact CG-CB 4.17Å; P1295-C1333 PolarHBondContact O-N 2.94Å; P1295-C1333 PolarHBondContact O-SG 3.08Å; C1333-M1349 CarbonylContact C-O 3.11Å; C1333-M1349 VanDerWaalsContact CA-O 3.26Å; C1333-M1349 WeakPolarHBondContact CA-O 3.34Å; C1333-C1351 VanDerWaalsContact CA-SG 3.54Å; C1333-C1351 HydrophobicContact CB-CB 3.76Å; C1333-C1351 WeakPolarHBondContact CB-SG 3.21Å; C1333-C1351 WeakPolarHBondContact SG-CB 3.35Å; C1333-C1351 CovalentContact SG-SG 2.01Å; C1333-C1351 PolarHBondContact SG-SG 2.84Å
1334	C	68.3	Low	62.8	Low	4 Å²	4	53 Å²	53	3%	0.027	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-65.6	145.1	177	-64.2	0	0	0	0	111.7	Y1336 A1339 C1348 M1349	C1334-Y1336 PolarHBondContact O-N 3.08Å; C1334-A1339 HydrophobicContact CB-CB 3.97Å; C1334-C1348 WeakPolarHBondContact CA-SG 3.44Å; C1334-C1348 HydrophobicContact CB-CB 3.98Å; C1334-C1348 WeakPolarHBondContact CB-SG 3.12Å; C1334-C1348 WeakPolarHBondContact SG-CB 3.33Å; C1334-C1348 PolarHBondContact SG-O 2.04Å; C1334-C1348 CovalentContact SG-SG 2.04Å; C1334-C1348 PolarHBondContact SG-SG 2.84Å; C1334-M1349 PolarHBondContact N-O 3.5Å; C1334-M1349 PolarHBondContact SG-N 3.14Å
1335	P	63.9	Low	63.1	Low	45 Å²	45	47.3 Å²	47.3	29%	0.292	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-58.3	135.6	160.7	-18.9	31	0	0	0	109.7	R1337 L1338 A1339	P1335-R1337 PolarHBondContact O-N 2.99Å; P1335-L1338 HydrophobicContact CG-CD1 4.21Å; P1335-L1338 PolarHBondContact O-N 2.96Å; P1335-A1339 PolarHBondContact O-N 2.85Å; P1335-A1339 VanDerWaalsContact O-N 3.15Å
1336	Y	61.9	Low	63.6	Low	11 Å²	11	51.1 Å²	51.1	4%	0.043	26%	0.256	C	S	.	.	H	α-helix	trans	-51.4	-37.6	-171.2	-172.2	-105.8	0	0	0	113.7	I772 D779 L792 L823 I827 C1334 A1339 L1340	I772-Y1336 HydrophobicContact CD1-CE1 4.16Å; D779-Y1336 VanDerWaalsContact CG-OH 3.3Å; D779-Y1336 PolarHBondContact OD1-OH 2.78Å; L792-Y1336 HydrophobicContact CD1-CD2 3.88Å; L792-Y1336 HydrophobicContact CD1-CE2 3.63Å; L823-Y1336 HydrophobicContact CD2-CD1 3.93Å; L823-Y1336 HydrophobicContact CD2-CE1 3.8Å; I827-Y1336 HydrophobicContact CD1-CD1 3.77Å; I827-Y1336 HydrophobicContact CD1-CE1 3.43Å; I827-Y1336 VanDerWaalsContact CD1-CE1 3.43Å; I827-Y1336 HydrophobicContact CD1-CE2 4.27Å; I827-Y1336 HydrophobicContact CD1-CG 4.31Å; I827-Y1336 HydrophobicContact CG2-CE2 4.15Å; C1334-Y1336 PolarHBondContact O-N 3.08Å; Y1336-A1339 WeakPolarHBondContact O-CB 3.13Å; Y1336-A1339 PolarHBondContact O-N 2.78Å; Y1336-L1340 HydrophobicContact CD1-CD1 4.04Å; Y1336-L1340 HydrophobicContact CD1-CG 4.49Å; Y1336-L1340 HydrophobicContact CE1-CD1 3.56Å; Y1336-L1340 HydrophobicContact CE1-CD2 4.49Å; Y1336-L1340 HydrophobicContact CE1-CG 4.11Å; Y1336-L1340 PolarHBondContact O-N 3.11Å; Y1336-L1340 VanDerWaalsContact O-N 3.12Å
1337	R	57.3	Low	64.1	Low	94 Å²	94	55.9 Å²	55.9	36%	0.355	28%	0.276	S	S	.	.	H	α-helix	trans	-62.2	-47.2	177.5	-176.1	-178.6	174.6	177.5	-7.8	113.7	V802 P1335 A1339 L1340 T1341	V802-R1337 HydrophobicContact CG2-CG 4.2Å; P1335-R1337 PolarHBondContact O-N 2.99Å; R1337-A1339 PolarHBondContact O-N 2.71Å; R1337-L1340 PolarHBondContact O-N 2.03Å; R1337-T1341 PolarHBondContact O-OG1 3.24Å
1338	L	57.1	Low	64.3	Low	97 Å²	97	54.8 Å²	54.8	51%	0.508	27%	0.268	S	S	.	.	H	α-helix	trans	-63.6	-33.9	176.5	-108.2	136.2	0	0	0	111	P1335 T1341 S1342	P1335-L1338 HydrophobicContact CG-CD1 4.21Å; P1335-L1338 PolarHBondContact O-N 2.96Å; L1338-T1341 PolarHBondContact O-N 2.03Å; L1338-T1341 PolarHBondContact O-OG1 2.97Å; L1338-T1341 VanDerWaalsContact O-OG1 3.1Å; L1338-S1342 PolarHBondContact O-N 2.87Å
1339	A	57.5	Low	64.3	Low	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-64.4	-46.6	-179.2	0	0	0	0	0	110.9	C1334 P1335 Y1336 R1337 T1341 F1350 A1366	C1334-A1339 HydrophobicContact CB-CB 3.97Å; P1335-A1339 PolarHBondContact O-N 2.85Å; P1335-A1339 VanDerWaalsContact O-N 3.15Å; Y1336-A1339 WeakPolarHBondContact O-CB 3.13Å; Y1336-A1339 PolarHBondContact O-N 2.78Å; R1337-A1339 PolarHBondContact O-N 2.71Å; A1339-T1341 VanDerWaalsContact C-N 3.28Å; A1339-T1341 PolarHBondContact O-N 3.48Å; A1339-F1350 HydrophobicContact CB-CD1 3.78Å; A1339-F1350 HydrophobicContact CB-CE1 2.97Å; A1339-F1350 HydrophobicContact CB-CE2 3.93Å; A1339-F1350 HydrophobicContact CB-CZ 3.09Å; A1339-F1350 WeakPolarHBondContact O-CZ 3.47Å; A1339-A1366 WeakPolarHBondContact O-CB 3.49Å
1340	L	55.2	Low	64	Low	37 Å²	37	52.5 Å²	52.5	19%	0.194	25%	0.254	C	S	.	.	H	α-helix	trans	-63.5	-27.3	-179.7	-71.6	173.5	0	0	0	115	R773 Y1336 R1337 G1367	R773-L1340 VanDerWaalsContact CZ-CD2 3.43Å; R773-L1340 VanDerWaalsContact NH2-CD2 3.32Å; Y1336-L1340 HydrophobicContact CD1-CD1 4.04Å; Y1336-L1340 HydrophobicContact CD1-CG 4.49Å; Y1336-L1340 HydrophobicContact CE1-CD1 3.56Å; Y1336-L1340 HydrophobicContact CE1-CD2 4.49Å; Y1336-L1340 HydrophobicContact CE1-CG 4.11Å; Y1336-L1340 PolarHBondContact O-N 3.11Å; Y1336-L1340 VanDerWaalsContact O-N 3.12Å; R1337-L1340 PolarHBondContact O-N 2.03Å; L1340-G1367 PolarHBondContact O-N 2.86Å
1341	T	53.6	Low	63.6	Low	74 Å²	74	52.6 Å²	52.6	45%	0.454	26%	0.255	S	S	.	.	H	α-helix	trans	-92.7	-30.1	-173	48.3	0	0	0	0	114	R1337 L1338 A1339 I1372	R1337-T1341 PolarHBondContact O-OG1 3.24Å; L1338-T1341 PolarHBondContact O-N 2.03Å; L1338-T1341 PolarHBondContact O-OG1 2.97Å; L1338-T1341 VanDerWaalsContact O-OG1 3.1Å; A1339-T1341 VanDerWaalsContact C-N 3.28Å; A1339-T1341 PolarHBondContact O-N 3.48Å; T1341-I1372 HydrophobicContact CG2-CB 4.13Å; T1341-I1372 HydrophobicContact CG2-CD1 3.4Å; T1341-I1372 VanDerWaalsContact CG2-CD1 3.4Å; T1341-I1372 HydrophobicContact CG2-CG1 3.83Å
1342	S	52.5	Low	63.2	Low	38 Å²	38	51.5 Å²	51.5	27%	0.266	25%	0.249	S	C	.	.			trans	-104.2	118.5	-176	-177.8	0	0	0	0	111.7	L1338 D1344	L1338-S1342 PolarHBondContact O-N 2.87Å; S1342-D1344 PolarHBondContact O-N 3.49Å; S1342-D1344 PolarHBondContact OG-N 2.83Å
1343	R	52.9	Low	62.7	Low	138 Å²	138	49 Å²	49	52%	0.521	24%	0.238	S	C	.	.	S	Bend	trans	-66.1	-26.6	172.3	-78.4	-173.8	177.8	169.5	-0.8	113	G1361	R1343-G1361 PolarHBondContact O-N 2.97Å
1344	D	55.9	Low	62.4	Low	63 Å²	63	50.4 Å²	50.4	34%	0.337	25%	0.245	S	C	.	.	S	Bend	trans	-144.4	73.5	-177.4	-171	19.5	0	0	0	112.5	L1307 S1342 R1346	L1307-D1344 WeakPolarHBondContact CD2-OD1 3.45Å; L1307-D1344 VanDerWaalsContact CG-OD1 3.28Å; L1307-D1344 WeakPolarHBondContact CG-OD1 3Å; L1307-D1344 WeakPolarHBondContact CG-OD2 3.42Å; S1342-D1344 PolarHBondContact O-N 3.49Å; S1342-D1344 PolarHBondContact OG-N 2.83Å; D1344-R1346 PolarHBondContact O-N 2.84Å
1345	P	51	Low	62.4	Low	18 Å²	18	54.1 Å²	54.1	12%	0.117	26%	0.261	C	S	.	.			trans	-69.8	105	175.6	23.1	-22.7	0	0	0	109.8	Q1347 C1348	P1345-Q1347 PolarHBondContact O-N 2.93Å; P1345-C1348 WeakPolarHBondContact CB-O 3.45Å; P1345-C1348 VanDerWaalsContact CG-O 3.3Å; P1345-C1348 WeakPolarHBondContact CG-O 3.15Å
1346	R	57.4	Low	62.7	Low	159 Å²	159	56.5 Å²	56.5	60%	0.6	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-20.2	-178.5	-67.6	-171.8	177.8	-177.6	1.7	114.7	D1344	D1344-R1346 PolarHBondContact O-N 2.84Å
1347	Q	63.9	Low	63.4	Low	176 Å²	176	58.2 Å²	58.2	82%	0.822	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	-15.9	-172.4	-67.9	-179.3	-14.1	0	0	114.5	P1345	P1345-Q1347 PolarHBondContact O-N 2.93Å
1348	C	68.7	Low	64.2	Low	18 Å²	18	53.8 Å²	53.8	12%	0.122	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	157.6	-179.8	66	0	0	0	0	109.3	L1332 C1334 P1345	L1332-C1348 CarbonylContact O-C 3.57Å; L1332-C1348 WeakPolarHBondContact O-CA 3.43Å; L1332-C1348 VanDerWaalsContact O-CB 3.27Å; L1332-C1348 WeakPolarHBondContact O-CB 3.42Å; C1334-C1348 WeakPolarHBondContact CA-SG 3.44Å; C1334-C1348 HydrophobicContact CB-CB 3.98Å; C1334-C1348 WeakPolarHBondContact CB-SG 3.12Å; C1334-C1348 WeakPolarHBondContact SG-CB 3.33Å; C1334-C1348 PolarHBondContact SG-O 2.04Å; C1334-C1348 CovalentContact SG-SG 2.04Å; C1334-C1348 PolarHBondContact SG-SG 2.84Å; P1345-C1348 WeakPolarHBondContact CB-O 3.45Å; P1345-C1348 VanDerWaalsContact CG-O 3.3Å; P1345-C1348 WeakPolarHBondContact CG-O 3.15Å
1349	M	72.4	Confident	64.9	Low	18 Å²	18	49.6 Å²	49.6	9%	0.089	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	173.3	176.3	-70.5	-170.9	72.1	0	0	112.3	L1299 L1331 L1332 C1333 C1334 C1358 L1359	L1299-M1349 HydrophobicContact CD1-CE 4.41Å; L1299-M1349 HydrophobicContact CD1-SD 3.57Å; L1299-M1349 VanDerWaalsContact CD1-SD 3.57Å; L1331-M1349 HydrophobicContact CD1-CG 3.8Å; L1331-M1349 HydrophobicContact CD1-SD 3.64Å; L1332-M1349 PolarHBondContact O-N 2.87Å; C1333-M1349 CarbonylContact C-O 3.11Å; C1333-M1349 VanDerWaalsContact CA-O 3.26Å; C1333-M1349 WeakPolarHBondContact CA-O 3.34Å; C1334-M1349 PolarHBondContact N-O 3.5Å; C1334-M1349 PolarHBondContact SG-N 3.14Å; M1349-C1358 HydrophobicContact CB-CB 3.61Å; M1349-C1358 HydrophobicContact CE-CB 3.63Å; M1349-C1358 HydrophobicContact CG-CB 4.17Å; M1349-C1358 HydrophobicContact SD-CB 3.5Å; M1349-C1358 WeakPolarHBondContact SD-CB 3.14Å; M1349-L1359 WeakPolarHBondContact CE-O 3.23Å
1350	F	75	Confident	65.3	Low	12 Å²	12	50.8 Å²	50.8	5%	0.053	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-79.9	134.7	-179	-72.2	-95	0	0	0	112.3	A1339 L1359 I1364 A1366	A1339-F1350 HydrophobicContact CB-CD1 3.78Å; A1339-F1350 HydrophobicContact CB-CE1 2.97Å; A1339-F1350 HydrophobicContact CB-CE2 3.93Å; A1339-F1350 HydrophobicContact CB-CZ 3.09Å; A1339-F1350 WeakPolarHBondContact O-CZ 3.47Å; F1350-L1359 HydrophobicContact CB-CB 3.91Å; F1350-L1359 WeakPolarHBondContact CB-O 3.26Å; F1350-L1359 PolarHBondContact N-O 2.74Å; F1350-L1359 PolarHBondContact O-N 3Å; F1350-I1364 HydrophobicContact CB-CG2 4.47Å; F1350-I1364 HydrophobicContact CD1-CD1 3.71Å; F1350-I1364 HydrophobicContact CD1-CG1 3.82Å; F1350-I1364 HydrophobicContact CD1-CG2 4.49Å; F1350-I1364 HydrophobicContact CD2-CG1 4.07Å; F1350-I1364 HydrophobicContact CE1-CD1 3Å; F1350-I1364 HydrophobicContact CE1-CG1 3.51Å; F1350-I1364 HydrophobicContact CE2-CD1 4.06Å; F1350-I1364 HydrophobicContact CE2-CG1 3.83Å; F1350-I1364 HydrophobicContact CG-CD1 4.4Å; F1350-I1364 HydrophobicContact CG-CG1 4.03Å; F1350-I1364 HydrophobicContact CG-CG2 4.42Å; F1350-I1364 HydrophobicContact CZ-CD1 3.18Å; F1350-I1364 HydrophobicContact CZ-CG1 3.47Å; F1350-I1364 VanDerWaalsContact CZ-CG1 3.47Å; F1350-A1366 HydrophobicContact CZ-CB 4.2Å
1351	C	75.1	Confident	65.6	Low	4 Å²	4	49.1 Å²	49.1	3%	0.027	25%	0.247	C	C	.	.			trans	-119	119.5	178.5	-60.7	0	0	0	0	110.8	L793 C1297 C1333	L793-C1351 HydrophobicContact CB-CB 3.92Å; L793-C1351 PolarHBondContact N-O 2.85Å; L793-C1351 VanDerWaalsContact N-O 3.11Å; C1297-C1351 VanDerWaalsContact CB-SG 3.57Å; C1297-C1351 PolarHBondContact SG-SG 3.49Å; C1333-C1351 VanDerWaalsContact CA-SG 3.54Å; C1333-C1351 HydrophobicContact CB-CB 3.76Å; C1333-C1351 WeakPolarHBondContact CB-SG 3.21Å; C1333-C1351 WeakPolarHBondContact SG-CB 3.35Å; C1333-C1351 CovalentContact SG-SG 2.01Å; C1333-C1351 PolarHBondContact SG-SG 2.84Å
1352	V	72	Confident	65.9	Low	1 Å²	1	51 Å²	51	1%	0.006	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-102.6	137.9	167.2	-164.2	0	0	0	0	108	Y778 L792 T829 R1290 D1354 K1355 L1359	Y778-V1352 HydrophobicContact CD1-CG1 4.47Å; Y778-V1352 HydrophobicContact CD1-CG2 4.09Å; Y778-V1352 HydrophobicContact CE1-CG1 4.5Å; Y778-V1352 HydrophobicContact CE1-CG2 4.1Å; L792-V1352 HydrophobicContact CD2-CB 4.49Å; L792-V1352 HydrophobicContact CD2-CG1 4.45Å; L792-V1352 HydrophobicContact CD2-CG2 3.94Å; T829-V1352 HydrophobicContact CG2-CG1 4.12Å; R1290-V1352 PolarHBondContact NH1-O 2.81Å; V1352-D1354 WeakPolarHBondContact CG1-OD1 3.43Å; V1352-D1354 PolarHBondContact O-N 2.98Å; V1352-K1355 HydrophobicContact CB-CB 4.45Å; V1352-K1355 HydrophobicContact CB-CG 4.32Å; V1352-K1355 PolarHBondContact O-N 3.26Å; V1352-K1355 VanDerWaalsContact O-N 3.13Å; V1352-K1355 VanDerWaalsContact O-O 3.11Å; V1352-L1359 HydrophobicContact CG2-CD1 3.38Å; V1352-L1359 HydrophobicContact CG2-CG 4.31Å
1353	A	69.2	Low	66.3	Low	16 Å²	16	52.8 Å²	52.8	13%	0.132	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-32.9	-175.7	0	0	0	0	0	113.7	V790 P791 L793 F838	V790-A1353 HydrophobicContact CG1-CB 3.75Å; P791-A1353 VanDerWaalsContact O-CB 3.3Å; P791-A1353 WeakPolarHBondContact O-CB 3.37Å; L793-A1353 HydrophobicContact CD1-CB 4.25Å; L793-A1353 HydrophobicContact CD2-CB 4.49Å; L793-A1353 HydrophobicContact CG-CB 4.11Å; F838-A1353 HydrophobicContact CE1-CB 4.21Å; F838-A1353 HydrophobicContact CE2-CB 3.99Å; F838-A1353 HydrophobicContact CZ-CB 3.58Å
1354	D	69.4	Low	66.8	Low	35 Å²	35	46.5 Å²	46.5	19%	0.187	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-6.9	-179.6	72.9	-24.9	0	0	0	114.6	V790 R831 P835 V1352	V790-D1354 HydrophobicContact CG1-CB 4.4Å; R831-D1354 IonicContact NE-OD2 3.32Å; R831-D1354 IonicContact NH2-OD2 3.77Å; P835-D1354 HydrophobicContact CB-CB 3.74Å; P835-D1354 HydrophobicContact CG-CB 3.82Å; V1352-D1354 WeakPolarHBondContact CG1-OD1 3.43Å; V1352-D1354 PolarHBondContact O-N 2.98Å
1355	K	69.1	Low	66.7	Low	83 Å²	83	44.4 Å²	44.4	36%	0.361	23%	0.228	S	C	.	.			trans	-114.3	122.4	-179	-61.6	-54.9	177.9	-173.9	0	110.8	R1290 V1352 I1357	R1290-K1355 PolarHBondContact NH1-O 2.53Å; R1290-K1355 PolarHBondContact NH2-O 3.46Å; V1352-K1355 HydrophobicContact CB-CB 4.45Å; V1352-K1355 HydrophobicContact CB-CG 4.32Å; V1352-K1355 PolarHBondContact O-N 3.26Å; V1352-K1355 VanDerWaalsContact O-N 3.13Å; V1352-K1355 VanDerWaalsContact O-O 3.11Å; K1355-I1357 VanDerWaalsContact C-N 3.25Å; K1355-I1357 PolarHBondContact O-N 3.09Å
1356	P	70.2	Confident	67	Low	94 Å²	94	43.6 Å²	43.6	61%	0.61	22%	0.224	S	C	*	.	S	Bend	trans	-71.5	-19	176.9	26.1	-31.1	0	0	0	113.6	R1290 L1298	R1290-P1356 VanDerWaalsContact NH2-CA 3.29Å; R1290-P1356 PolarHBondContact NH2-O 2.91Å; L1298-P1356 PolarHBondContact N-O 3.29Å; L1298-P1356 VanDerWaalsContact N-O 3.16Å
1357	I	76.2	Confident	66.8	Low	47 Å²	47	37.8 Å²	37.8	24%	0.241	21%	0.213	C	C	.	.	B	Isolated β-bridge	trans	-100.1	147.2	-174.4	-50	169.7	0	0	0	110.2	L1298 T1300 K1355	L1298-I1357 WeakPolarHBondContact O-CA 3.48Å; L1298-I1357 VanDerWaalsContact O-CG2 3.28Å; L1298-I1357 WeakPolarHBondContact O-CG2 3.49Å; T1300-I1357 HydrophobicContact CG2-CD1 4.21Å; T1300-I1357 HydrophobicContact CG2-CG1 4.16Å; T1300-I1357 HydrophobicContact CG2-CG2 3.94Å; K1355-I1357 VanDerWaalsContact C-N 3.25Å; K1355-I1357 PolarHBondContact O-N 3.09Å
1358	C	74.5	Confident	65.9	Low	1 Å²	1	34.7 Å²	34.7	1%	0.007	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-65.8	136.8	174.7	-59.2	0	0	0	0	113.5	C1297 L1298 R1303 M1349	C1297-C1358 HydrophobicContact CB-CB 3.95Å; C1297-C1358 WeakPolarHBondContact CB-SG 2.88Å; C1297-C1358 PolarHBondContact O-SG 3.23Å; C1297-C1358 WeakPolarHBondContact SG-CA 3.39Å; C1297-C1358 WeakPolarHBondContact SG-CB 2.94Å; C1297-C1358 CovalentContact SG-SG 2.02Å; C1297-C1358 PolarHBondContact SG-SG 3.45Å; L1298-C1358 PolarHBondContact O-N 3.34Å; L1298-C1358 VanDerWaalsContact O-N 3.09Å; R1303-C1358 PolarHBondContact NH1-O 3.3Å; M1349-C1358 HydrophobicContact CB-CB 3.61Å; M1349-C1358 HydrophobicContact CE-CB 3.63Å; M1349-C1358 HydrophobicContact CG-CB 4.17Å; M1349-C1358 HydrophobicContact SD-CB 3.5Å; M1349-C1358 WeakPolarHBondContact SD-CB 3.14Å
1359	L	70.7	Confident	64.6	Low	9 Å²	9	36.5 Å²	36.5	5%	0.047	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-93.7	146.7	170.3	-57.7	-178.7	0	0	0	111.4	Y778 M1349 F1350 V1352 E1363 I1364	Y778-L1359 HydrophobicContact CE1-CD1 4.4Å; Y778-L1359 HydrophobicContact CE2-CD1 4.26Å; M1349-L1359 WeakPolarHBondContact CE-O 3.23Å; F1350-L1359 HydrophobicContact CB-CB 3.91Å; F1350-L1359 WeakPolarHBondContact CB-O 3.26Å; F1350-L1359 PolarHBondContact N-O 2.74Å; F1350-L1359 PolarHBondContact O-N 3Å; V1352-L1359 HydrophobicContact CG2-CD1 3.38Å; V1352-L1359 HydrophobicContact CG2-CG 4.31Å; L1359-E1363 WeakPolarHBondContact CA-OE2 3.45Å; L1359-I1364 HydrophobicContact CB-CG2 4Å; L1359-I1364 HydrophobicContact CD1-CG2 3.76Å
1360	S	65.5	Low	63	Low	26 Å²	26	38.4 Å²	38.4	18%	0.182	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-82.6	162.3	173.5	59.1	0	0	0	0	112	D1362 E1363 I1364	S1360-D1362 VanDerWaalsContact C-N 3.31Å; S1360-D1362 PolarHBondContact O-N 3.17Å; S1360-E1363 PolarHBondContact N-OE2 3.29Å; S1360-E1363 PolarHBondContact O-N 3.19Å; S1360-E1363 VanDerWaalsContact OG-CD 3.25Å; S1360-E1363 VanDerWaalsContact OG-CG 3.24Å; S1360-E1363 WeakPolarHBondContact OG-CG 3.32Å; S1360-E1363 PolarHBondContact OG-OE2 2.96Å; S1360-I1364 PolarHBondContact O-N 3.36Å
1361	G	61.8	Low	61	Low	1 Å²	1	48.5 Å²	48.5	1%	0.01	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-41	175.8	0	0	0	0	0	112.5	R1343 E1363 I1364 G1365 A1366	R1343-G1361 PolarHBondContact O-N 2.97Å; G1361-E1363 VanDerWaalsContact C-N 3.32Å; G1361-E1363 PolarHBondContact O-N 2.81Å; G1361-I1364 PolarHBondContact O-N 2.9Å; G1361-G1365 PolarHBondContact O-N 2.04Å; G1361-A1366 WeakPolarHBondContact O-CB 3.36Å; G1361-A1366 PolarHBondContact O-N 3.06Å
1362	D	60	Low	59.1	Low	114 Å²	114	50.2 Å²	50.2	61%	0.61	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-62.4	-36.5	177.3	-68.2	-17.7	0	0	0	112.8	S1360 I1364 G1365	S1360-D1362 VanDerWaalsContact C-N 3.31Å; S1360-D1362 PolarHBondContact O-N 3.17Å; D1362-I1364 VanDerWaalsContact C-N 3.28Å; D1362-I1364 PolarHBondContact O-N 2.98Å; D1362-G1365 PolarHBondContact O-N 3.09Å
1363	E	62	Low	57.3	Low	76 Å²	76	54.1 Å²	54.1	36%	0.355	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-69.6	-23.9	-179.5	-76.1	167.9	149.4	0	0	113.3	L1359 S1360 G1361	L1359-E1363 WeakPolarHBondContact CA-OE2 3.45Å; S1360-E1363 PolarHBondContact N-OE2 3.29Å; S1360-E1363 PolarHBondContact O-N 3.19Å; S1360-E1363 VanDerWaalsContact OG-CD 3.25Å; S1360-E1363 VanDerWaalsContact OG-CG 3.24Å; S1360-E1363 WeakPolarHBondContact OG-CG 3.32Å; S1360-E1363 PolarHBondContact OG-OE2 2.96Å; G1361-E1363 VanDerWaalsContact C-N 3.32Å; G1361-E1363 PolarHBondContact O-N 2.81Å
1364	I	61.7	Low	55.6	Low	6 Å²	6	59.6 Å²	59.6	3%	0.031	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-106.2	5	176.5	74	108.3	0	0	0	112.5	R773 Y778 F1350 L1359 S1360 G1361 D1362 A1366	R773-I1364 PolarHBondContact NH2-O 2.92Å; Y778-I1364 HydrophobicContact CD2-CB 4.05Å; Y778-I1364 HydrophobicContact CD2-CG2 3.81Å; Y778-I1364 HydrophobicContact CE2-CG2 4.17Å; Y778-I1364 HydrophobicContact CG-CG2 4.42Å; F1350-I1364 HydrophobicContact CB-CG2 4.47Å; F1350-I1364 HydrophobicContact CD1-CD1 3.71Å; F1350-I1364 HydrophobicContact CD1-CG1 3.82Å; F1350-I1364 HydrophobicContact CD1-CG2 4.49Å; F1350-I1364 HydrophobicContact CD2-CG1 4.07Å; F1350-I1364 HydrophobicContact CE1-CD1 3Å; F1350-I1364 HydrophobicContact CE1-CG1 3.51Å; F1350-I1364 HydrophobicContact CE2-CD1 4.06Å; F1350-I1364 HydrophobicContact CE2-CG1 3.83Å; F1350-I1364 HydrophobicContact CG-CD1 4.4Å; F1350-I1364 HydrophobicContact CG-CG1 4.03Å; F1350-I1364 HydrophobicContact CG-CG2 4.42Å; F1350-I1364 HydrophobicContact CZ-CD1 3.18Å; F1350-I1364 HydrophobicContact CZ-CG1 3.47Å; F1350-I1364 VanDerWaalsContact CZ-CG1 3.47Å; L1359-I1364 HydrophobicContact CB-CG2 4Å; L1359-I1364 HydrophobicContact CD1-CG2 3.76Å; S1360-I1364 PolarHBondContact O-N 3.36Å; G1361-I1364 PolarHBondContact O-N 2.9Å; D1362-I1364 VanDerWaalsContact C-N 3.28Å; D1362-I1364 PolarHBondContact O-N 2.98Å; I1364-A1366 HydrophobicContact CD1-CB 4.24Å; I1364-A1366 HydrophobicContact CG1-CB 4.44Å
1365	G	55.9	Low	53.8	Low	18 Å²	18	61.5 Å²	61.5	19%	0.186	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.7	26.9	179.2	0	0	0	0	0	115	R773 G1361 D1362	R773-G1365 PolarHBondContact NH1-O 3.3Å; G1361-G1365 PolarHBondContact O-N 2.04Å; D1362-G1365 PolarHBondContact O-N 3.09Å
1366	A	56.7	Low	52.1	Low	2 Å²	2	65.2 Å²	65.2	2%	0.017	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	147.5	175.6	0	0	0	0	0	112.4	A1339 F1350 G1361 I1364 E1368	A1339-A1366 WeakPolarHBondContact O-CB 3.49Å; F1350-A1366 HydrophobicContact CZ-CB 4.2Å; G1361-A1366 WeakPolarHBondContact O-CB 3.36Å; G1361-A1366 PolarHBondContact O-N 3.06Å; I1364-A1366 HydrophobicContact CD1-CB 4.24Å; I1364-A1366 HydrophobicContact CG1-CB 4.44Å; A1366-E1368 PolarHBondContact O-N 2.89Å
1367	G	52.2	Low	50.3	Low	36 Å²	36	66.5 Å²	66.5	37%	0.371	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.5	-0.3	-178.5	0	0	0	0	0	115.8	L1340	L1340-G1367 PolarHBondContact O-N 2.86Å
1368	E	44.9	Very low	48.2	Very low	112 Å²	112	70.6 Å²	70.6	52%	0.523	40%	0.403	S	S	.	.	S	Bend	trans	-95.5	97.5	162.9	-68.1	-161.4	150.5	0	0	109.4	A1366	A1366-E1368 PolarHBondContact O-N 2.89Å
1369	G	41.1	Very low	46.5	Very low	56 Å²	56	78.6 Å²	78.6	58%	0.577	45%	0.446	S	S	*	.	S	Bend	trans	115.9	106.1	171.4	0	0	0	0	0	114.4
1370	G	39	Very low	44.7	Very low	58 Å²	58	89.3 Å²	89.3	60%	0.598	49%	0.486	S	S	*	.			trans	94.2	115.5	166.9	0	0	0	0	0	115.1	I1372	G1370-I1372 PolarHBondContact O-N 3.39Å
1371	Y	34.3	Very low	43.7	Very low	224 Å²	224	92.1 Å²	92.1	88%	0.878	51%	0.506	S	S	*	.			trans	-72.6	107.6	158	-76.1	-87.6	0	0	0	107.5	V1373	Y1371-V1373 PolarHBondContact O-N 3.03Å
1372	I	34.6	Very low	43.1	Very low	39 Å²	39	98.6 Å²	98.6	20%	0.2	54%	0.539	C	S	.	.			trans	-76.1	104.7	164.1	-55.3	-170	0	0	0	105.6	V802 F804 T1341 G1370 D1374	V802-I1372 HydrophobicContact CG1-CD1 4.1Å; F804-I1372 HydrophobicContact CE1-CD1 4.49Å; F804-I1372 HydrophobicContact CE1-CG1 4.06Å; T1341-I1372 HydrophobicContact CG2-CB 4.13Å; T1341-I1372 HydrophobicContact CG2-CD1 3.4Å; T1341-I1372 VanDerWaalsContact CG2-CD1 3.4Å; T1341-I1372 HydrophobicContact CG2-CG1 3.83Å; G1370-I1372 PolarHBondContact O-N 3.39Å; I1372-D1374 PolarHBondContact O-N 3.32Å
1373	V	33.9	Very low	42.5	Very low	83 Å²	83	103.6 Å²	103.6	50%	0.503	55%	0.55	S	S	.	.			trans	-78.5	115.1	173.3	-177.1	0	0	0	0	107.2	Y1371 V1375	Y1371-V1373 PolarHBondContact O-N 3.03Å; V1373-V1375 VanDerWaalsContact C-N 3.33Å; V1373-V1375 HydrophobicContact CG1-CG2 4.17Å; V1373-V1375 PolarHBondContact O-N 3.38Å
1374	D	33.3	Very low	41.9	Very low	132 Å²	132	106.8 Å²	106.8	71%	0.706	56%	0.564	S	S	*	*			trans	-65	96.9	165	-82.4	-30.9	0	0	0	107.7	I1372 D1376	I1372-D1374 PolarHBondContact O-N 3.32Å; D1374-D1376 PolarHBondContact O-N 3.12Å
1375	V	32.5	Very low	41.6	Very low	74 Å²	74	109.9 Å²	109.9	45%	0.448	59%	0.587	S	S	.	*			trans	-82.7	95.1	165.7	-176.4	0	0	0	0	105.7	V1373 N1377	V1373-V1375 VanDerWaalsContact C-N 3.33Å; V1373-V1375 HydrophobicContact CG1-CG2 4.17Å; V1373-V1375 PolarHBondContact O-N 3.38Å; V1375-N1377 VanDerWaalsContact C-N 3.31Å; V1375-N1377 PolarHBondContact O-N 2.93Å
1376	D	33.6	Very low	41.5	Very low	161 Å²	161	111.9 Å²	111.9	86%	0.861	59%	0.59	S	S	*	*			trans	-57.2	98.6	166.9	-98.6	-24.5	0	0	0	107.9	D1374 N1378	D1374-D1376 PolarHBondContact O-N 3.12Å; D1376-N1378 PolarHBondContact O-N 3.37Å
1377	N	31.8	Very low	41.4	Very low	121 Å²	121	116.1 Å²	116.1	65%	0.647	62%	0.62	S	S	*	*			trans	-73.1	112.3	178.3	-83.7	-31.4	0	0	0	109.2	V1375	V1375-N1377 VanDerWaalsContact C-N 3.31Å; V1375-N1377 PolarHBondContact O-N 2.93Å
1378	N	32.8	Very low	41.6	Very low	133 Å²	133	123.2 Å²	123.2	71%	0.711	64%	0.641	S	S	*	*	S	Bend	trans	75.4	98.4	156.3	-63.4	-14.8	0	0	0	118.3	D1376 R1380	D1376-N1378 PolarHBondContact O-N 3.37Å; N1378-R1380 PolarHBondContact O-N 2.82Å
1379	D	39.2	Very low	42.4	Very low	170 Å²	170	121.9 Å²	121.9	91%	0.909	63%	0.634	S	S	*	*				39.9	55.5	122.3	-70.8	-22.6	0	0	0	117.2
1380	R	32.2	Very low	43.5	Very low	234 Å²	234	124 Å²	124	88%	0.883	64%	0.638	S	S	*	*			trans	-92.5	105.3	163.2	-95.5	179.3	167.2	178.4	-3.6	110	N1378 L1382	N1378-R1380 PolarHBondContact O-N 2.82Å; R1380-L1382 PolarHBondContact O-N 3.34Å
1381	S	44	Very low	45.3	Very low	85 Å²	85	126.9 Å²	126.9	59%	0.594	63%	0.632	S	S	*	*			trans	-36.4	124.2	-175.9	60	0	0	0	0	114.3	W1383 E1384	S1381-W1383 PolarHBondContact O-N 3.3Å; S1381-E1384 PolarHBondContact O-N 3.18Å
1382	L	49.2	Very low	46.6	Very low	136 Å²	136	121.9 Å²	121.9	71%	0.712	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-40.8	-20.7	175.8	-98.9	142.8	0	0	0	116.2	R1380 F1386	R1380-L1382 PolarHBondContact O-N 3.34Å; L1382-F1386 HydrophobicContact CD2-CE2 3.91Å; L1382-F1386 WeakPolarHBondContact O-CD2 3.42Å
1383	W	47.3	Very low	48.5	Very low	220 Å²	220	123.9 Å²	123.9	83%	0.833	62%	0.622	S	S	*	*	H	α-helix	trans	-70.7	-29.4	-175.3	-95.9	86.1	0	0	0	115.2	S1381	S1381-W1383 PolarHBondContact O-N 3.3Å
1384	E	50.1	Low	50.6	Low	142 Å²	142	125.5 Å²	125.5	66%	0.664	63%	0.627	S	S	*	*	H	α-helix	trans	-80.3	-19.5	-177.3	-80.9	-167	151.4	0	0	114.5	S1381 F1386	S1381-E1384 PolarHBondContact O-N 3.18Å; E1384-F1386 VanDerWaalsContact C-N 3.3Å; E1384-F1386 PolarHBondContact O-N 2.97Å
1385	S	54.8	Low	52.6	Low	72 Å²	72	124.6 Å²	124.6	50%	0.503	62%	0.621	S	S	.	*	H	α-helix	trans	-71.5	-27.3	176.6	-170	0	0	0	0	112.3
1386	F	53.3	Low	54.7	Low	59 Å²	59	124 Å²	124	26%	0.259	62%	0.615	S	S	.	*	H	α-helix	trans	-88.2	-20.2	-174.1	-69.3	-64.1	0	0	0	114.7	L1382 E1384 L1393 L1396	L1382-F1386 HydrophobicContact CD2-CE2 3.91Å; L1382-F1386 WeakPolarHBondContact O-CD2 3.42Å; E1384-F1386 VanDerWaalsContact C-N 3.3Å; E1384-F1386 PolarHBondContact O-N 2.97Å; F1386-L1393 HydrophobicContact CB-CD1 4.14Å; F1386-L1396 HydrophobicContact CD1-CD2 4.1Å; F1386-L1396 HydrophobicContact CE1-CB 4.33Å; F1386-L1396 HydrophobicContact CE1-CD1 3.64Å; F1386-L1396 HydrophobicContact CE1-CD2 3.95Å; F1386-L1396 HydrophobicContact CE1-CG 4.17Å; F1386-L1396 HydrophobicContact CE2-CD2 4.46Å; F1386-L1396 HydrophobicContact CG-CD2 4.45Å; F1386-L1396 HydrophobicContact CZ-CD1 3.78Å; F1386-L1396 HydrophobicContact CZ-CD2 4.13Å
1387	S	56.2	Low	57.1	Low	92 Å²	92	120.3 Å²	120.3	64%	0.643	59%	0.594	S	S	*	*	H	α-helix	trans	-82.5	-20.1	-176.4	64.4	0	0	0	0	114.3	Q1389	S1387-Q1389 PolarHBondContact O-N 2.99Å
1388	K	56.2	Low	59.8	Low	184 Å²	184	116.3 Å²	116.3	80%	0.8	58%	0.582	S	S	*	*	S	Bend	trans	-77.4	-19.9	-170.1	-84.5	-175.2	176	175.3	0	115.5
1389	Q	60.4	Low	62.3	Low	84 Å²	84	112.7 Å²	112.7	39%	0.393	57%	0.567	S	S	.	*			trans	-142.5	116.5	177.6	-66.9	-167.4	-32.2	0	0	111.3	S1387 Y1391 R1392	S1387-Q1389 PolarHBondContact O-N 2.99Å; Q1389-Y1391 HydrophobicContact CB-CD1 3.85Å; Q1389-Y1391 HydrophobicContact CB-CE1 3.53Å; Q1389-Y1391 HydrophobicContact CG-CE1 4.07Å; Q1389-Y1391 PolarHBondContact O-N 3.21Å; Q1389-Y1391 VanDerWaalsContact O-N 3.13Å; Q1389-Y1391 PolarHBondContact OE1-OH 2.83Å; Q1389-R1392 HydrophobicContact CB-CG 4.32Å; Q1389-R1392 WeakPolarHBondContact O-CB 3.22Å; Q1389-R1392 PolarHBondContact O-N 3.25Å
1390	P	64.9	Low	64.6	Low	100 Å²	100	108.5 Å²	108.5	65%	0.649	54%	0.543	S	S	*	.	H	α-helix	trans	-61.7	-27.9	-171.3	22.4	-32.4	0	0	0	112.8	R1392 L1393 I1394	P1390-R1392 VanDerWaalsContact C-N 3.31Å; P1390-R1392 PolarHBondContact O-N 3.07Å; P1390-L1393 PolarHBondContact O-N 2.94Å; P1390-I1394 WeakPolarHBondContact O-CD1 3Å; P1390-I1394 VanDerWaalsContact O-CG1 3.23Å; P1390-I1394 WeakPolarHBondContact O-CG1 3.28Å; P1390-I1394 PolarHBondContact O-N 3.25Å
1391	Y	77.6	Confident	67.4	Low	120 Å²	120	101.8 Å²	101.8	47%	0.471	52%	0.524	S	S	.	.	H	α-helix	trans	-66.1	-30.8	175.3	77.4	-95.2	0	0	0	112.7	Q1389 I1394 L1395	Q1389-Y1391 HydrophobicContact CB-CD1 3.85Å; Q1389-Y1391 HydrophobicContact CB-CE1 3.53Å; Q1389-Y1391 HydrophobicContact CG-CE1 4.07Å; Q1389-Y1391 PolarHBondContact O-N 3.21Å; Q1389-Y1391 VanDerWaalsContact O-N 3.13Å; Q1389-Y1391 PolarHBondContact OE1-OH 2.83Å; Y1391-I1394 PolarHBondContact O-N 2.87Å; Y1391-L1395 WeakPolarHBondContact O-CB 3.06Å; Y1391-L1395 PolarHBondContact O-N 2.81Å
1392	R	61.1	Low	69.6	Low	119 Å²	119	104.1 Å²	104.1	45%	0.449	52%	0.523	S	S	.	.	H	α-helix	trans	-71.6	-37	177.3	-66.5	-172.8	178.5	-168.1	-3.5	111.5	Q1389 P1390 L1395 L1396	Q1389-R1392 HydrophobicContact CB-CG 4.32Å; Q1389-R1392 WeakPolarHBondContact O-CB 3.22Å; Q1389-R1392 PolarHBondContact O-N 3.25Å; P1390-R1392 VanDerWaalsContact C-N 3.31Å; P1390-R1392 PolarHBondContact O-N 3.07Å; R1392-L1395 PolarHBondContact O-N 3.36Å; R1392-L1396 WeakPolarHBondContact O-CB 3.1Å; R1392-L1396 PolarHBondContact O-N 2.85Å
1393	L	73.5	Confident	71.5	Confident	80 Å²	80	102 Å²	102	42%	0.419	51%	0.512	S	S	.	.	H	α-helix	trans	-66.4	-43.8	172.7	-164.8	78.4	0	0	0	110.7	F1386 P1390 L1395 L1396 I1397	F1386-L1393 HydrophobicContact CB-CD1 4.14Å; P1390-L1393 PolarHBondContact O-N 2.94Å; L1393-L1395 VanDerWaalsContact C-N 3.32Å; L1393-L1395 PolarHBondContact O-N 3.11Å; L1393-L1396 PolarHBondContact O-N 2.78Å; L1393-I1397 HydrophobicContact CD2-CD1 4.3Å; L1393-I1397 HydrophobicContact CG-CD1 3.97Å; L1393-I1397 WeakPolarHBondContact O-CB 3.39Å; L1393-I1397 WeakPolarHBondContact O-CG1 3.1Å; L1393-I1397 PolarHBondContact O-N 2.79Å
1394	I	78	Confident	73.7	Confident	118 Å²	118	95.8 Å²	95.8	61%	0.605	49%	0.494	S	S	*	.	H	α-helix	trans	-61.6	-41.1	175.1	-67.4	163.8	0	0	0	111	P1390 Y1391 I1397 G1398	P1390-I1394 WeakPolarHBondContact O-CD1 3Å; P1390-I1394 VanDerWaalsContact O-CG1 3.23Å; P1390-I1394 WeakPolarHBondContact O-CG1 3.28Å; P1390-I1394 PolarHBondContact O-N 3.25Å; Y1391-I1394 PolarHBondContact O-N 2.87Å; I1394-I1397 PolarHBondContact O-N 2.84Å; I1394-G1398 PolarHBondContact O-N 2.02Å
1395	L	75.2	Confident	75.7	Confident	113 Å²	113	93.9 Å²	93.9	59%	0.592	49%	0.488	S	S	*	.	H	α-helix	trans	-71.6	-36.7	-179.8	-152.2	148.2	0	0	0	111.3	Y1391 R1392 L1393 G1398 C1399	Y1391-L1395 WeakPolarHBondContact O-CB 3.06Å; Y1391-L1395 PolarHBondContact O-N 2.81Å; R1392-L1395 PolarHBondContact O-N 3.36Å; L1393-L1395 VanDerWaalsContact C-N 3.32Å; L1393-L1395 PolarHBondContact O-N 3.11Å; L1395-G1398 PolarHBondContact O-N 2.82Å; L1395-C1399 WeakPolarHBondContact O-CB 3.09Å; L1395-C1399 PolarHBondContact O-N 3.34Å; L1395-C1399 PolarHBondContact O-SG 3.07Å
1396	L	76.6	Confident	77.3	Confident	61 Å²	61	93.9 Å²	93.9	32%	0.319	48%	0.482	S	S	.	.	H	α-helix	trans	-66.2	-46.7	171.7	-169.5	88	0	0	0	111.4	F1386 R1392 L1393 G1398 C1399 I1400	F1386-L1396 HydrophobicContact CD1-CD2 4.1Å; F1386-L1396 HydrophobicContact CE1-CB 4.33Å; F1386-L1396 HydrophobicContact CE1-CD1 3.64Å; F1386-L1396 HydrophobicContact CE1-CD2 3.95Å; F1386-L1396 HydrophobicContact CE1-CG 4.17Å; F1386-L1396 HydrophobicContact CE2-CD2 4.46Å; F1386-L1396 HydrophobicContact CG-CD2 4.45Å; F1386-L1396 HydrophobicContact CZ-CD1 3.78Å; F1386-L1396 HydrophobicContact CZ-CD2 4.13Å; R1392-L1396 WeakPolarHBondContact O-CB 3.1Å; R1392-L1396 PolarHBondContact O-N 2.85Å; L1393-L1396 PolarHBondContact O-N 2.78Å; L1396-G1398 VanDerWaalsContact C-N 3.28Å; L1396-G1398 PolarHBondContact O-N 2.93Å; L1396-C1399 CarbonylContact O-C 3.52Å; L1396-C1399 PolarHBondContact O-N 2.94Å; L1396-I1400 HydrophobicContact CD2-CD1 3.96Å; L1396-I1400 HydrophobicContact CG-CD1 3.93Å; L1396-I1400 HydrophobicContact CG-CG1 4.47Å; L1396-I1400 WeakPolarHBondContact O-CB 3.33Å; L1396-I1400 VanDerWaalsContact O-CG1 3.27Å; L1396-I1400 WeakPolarHBondContact O-CG1 3.48Å; L1396-I1400 PolarHBondContact O-N 2.92Å
1397	I	84.3	Confident	79.1	Confident	83 Å²	83	95.6 Å²	95.6	43%	0.426	49%	0.493	S	S	.	.	H	α-helix	trans	-60.1	-43	175.2	-69	165.9	0	0	0	109.5	L1393 I1394 I1400 I1401	L1393-I1397 HydrophobicContact CD2-CD1 4.3Å; L1393-I1397 HydrophobicContact CG-CD1 3.97Å; L1393-I1397 WeakPolarHBondContact O-CB 3.39Å; L1393-I1397 WeakPolarHBondContact O-CG1 3.1Å; L1393-I1397 PolarHBondContact O-N 2.79Å; I1394-I1397 PolarHBondContact O-N 2.84Å; I1397-I1400 PolarHBondContact O-N 2.66Å; I1397-I1401 HydrophobicContact CG2-CD1 3.7Å; I1397-I1401 HydrophobicContact CG2-CG1 4.36Å; I1397-I1401 WeakPolarHBondContact O-CB 2.98Å; I1397-I1401 WeakPolarHBondContact O-CG1 3.29Å; I1397-I1401 PolarHBondContact O-N 3.33Å
1398	G	88.1	Confident	80.8	Confident	37 Å²	37	96.1 Å²	96.1	38%	0.381	49%	0.487	S	S	.	.	H	α-helix	trans	-59.7	-44.6	173.7	0	0	0	0	0	112.5	I1394 L1395 L1396 I1401 F1402	I1394-G1398 PolarHBondContact O-N 2.02Å; L1395-G1398 PolarHBondContact O-N 2.82Å; L1396-G1398 VanDerWaalsContact C-N 3.28Å; L1396-G1398 PolarHBondContact O-N 2.93Å; G1398-I1401 PolarHBondContact O-N 3.46Å; G1398-F1402 VanDerWaalsContact O-CB 3.25Å; G1398-F1402 WeakPolarHBondContact O-CB 3.29Å; G1398-F1402 PolarHBondContact O-N 2.89Å
1399	C	85.3	Confident	82.4	Confident	58 Å²	58	93.8 Å²	93.8	39%	0.392	48%	0.478	S	S	.	.	H	α-helix	trans	-65.6	-41.2	175.2	-76.4	0	0	0	0	112.2	L1395 L1396 F1402 I1403	L1395-C1399 WeakPolarHBondContact O-CB 3.09Å; L1395-C1399 PolarHBondContact O-N 3.34Å; L1395-C1399 PolarHBondContact O-SG 3.07Å; L1396-C1399 CarbonylContact O-C 3.52Å; L1396-C1399 PolarHBondContact O-N 2.94Å; C1399-F1402 PolarHBondContact O-N 2.87Å; C1399-I1403 WeakPolarHBondContact O-CB 3.25Å; C1399-I1403 WeakPolarHBondContact O-CD1 3.35Å; C1399-I1403 WeakPolarHBondContact O-CG1 3.41Å; C1399-I1403 PolarHBondContact O-N 2.79Å
1400	I	88.5	Confident	83.6	Confident	82 Å²	82	94.2 Å²	94.2	42%	0.421	48%	0.481	S	S	.	.	H	α-helix	trans	-65.6	-44.6	177.2	-69.7	167.1	0	0	0	109.8	L1396 I1397 F1402 I1403 I1404	L1396-I1400 HydrophobicContact CD2-CD1 3.96Å; L1396-I1400 HydrophobicContact CG-CD1 3.93Å; L1396-I1400 HydrophobicContact CG-CG1 4.47Å; L1396-I1400 WeakPolarHBondContact O-CB 3.33Å; L1396-I1400 VanDerWaalsContact O-CG1 3.27Å; L1396-I1400 WeakPolarHBondContact O-CG1 3.48Å; L1396-I1400 PolarHBondContact O-N 2.92Å; I1397-I1400 PolarHBondContact O-N 2.66Å; I1400-F1402 VanDerWaalsContact C-N 3.34Å; I1400-F1402 PolarHBondContact O-N 2.91Å; I1400-I1403 PolarHBondContact O-N 2.78Å; I1400-I1404 HydrophobicContact CG2-CD1 3.71Å; I1400-I1404 HydrophobicContact CG2-CG1 4.39Å; I1400-I1404 WeakPolarHBondContact O-CB 3.48Å; I1400-I1404 WeakPolarHBondContact O-CG1 3.42Å; I1400-I1404 PolarHBondContact O-N 2.96Å
1401	I	91.9	Very high	84.7	Confident	93 Å²	93	93 Å²	93	48%	0.477	47%	0.472	S	S	.	.	H	α-helix	trans	-61	-45.1	174.3	-68.9	167.5	0	0	0	110	I1397 G1398 I1404 L1405	I1397-I1401 HydrophobicContact CG2-CD1 3.7Å; I1397-I1401 HydrophobicContact CG2-CG1 4.36Å; I1397-I1401 WeakPolarHBondContact O-CB 2.98Å; I1397-I1401 WeakPolarHBondContact O-CG1 3.29Å; I1397-I1401 PolarHBondContact O-N 3.33Å; G1398-I1401 PolarHBondContact O-N 3.46Å; I1401-I1404 PolarHBondContact O-N 3.49Å; I1401-L1405 HydrophobicContact CG2-CD1 3.9Å; I1401-L1405 HydrophobicContact CG2-CG 4.36Å; I1401-L1405 WeakPolarHBondContact O-CB 3.29Å; I1401-L1405 VanDerWaalsContact O-CG 3.26Å; I1401-L1405 WeakPolarHBondContact O-CG 3.05Å; I1401-L1405 PolarHBondContact O-N 3.18Å
1402	F	89.7	Confident	84.9	Confident	133 Å²	133	89.5 Å²	89.5	58%	0.583	47%	0.468	S	S	*	.	H	α-helix	trans	-62.7	-43.9	178.4	-172.5	-101.3	0	0	0	111.9	G1398 C1399 I1400 L1405 L1406	G1398-F1402 VanDerWaalsContact O-CB 3.25Å; G1398-F1402 WeakPolarHBondContact O-CB 3.29Å; G1398-F1402 PolarHBondContact O-N 2.89Å; C1399-F1402 PolarHBondContact O-N 2.87Å; I1400-F1402 VanDerWaalsContact C-N 3.34Å; I1400-F1402 PolarHBondContact O-N 2.91Å; F1402-L1405 PolarHBondContact O-N 3.33Å; F1402-L1406 HydrophobicContact CD1-CD1 3.89Å; F1402-L1406 HydrophobicContact CE1-CD1 3.38Å; F1402-L1406 HydrophobicContact CE1-CG 4.4Å; F1402-L1406 HydrophobicContact CZ-CD1 4.04Å; F1402-L1406 WeakPolarHBondContact O-CB 3.47Å; F1402-L1406 PolarHBondContact O-N 2.98Å
1403	I	88.8	Confident	85.8	Confident	92 Å²	92	89 Å²	89	47%	0.472	47%	0.47	S	S	.	.	H	α-helix	trans	-64.5	-43.4	176.4	-71	165.3	0	0	0	110.6	C1399 I1400 L1405 L1406 I1407	C1399-I1403 WeakPolarHBondContact O-CB 3.25Å; C1399-I1403 WeakPolarHBondContact O-CD1 3.35Å; C1399-I1403 WeakPolarHBondContact O-CG1 3.41Å; C1399-I1403 PolarHBondContact O-N 2.79Å; I1400-I1403 PolarHBondContact O-N 2.78Å; I1403-L1405 VanDerWaalsContact C-N 3.35Å; I1403-L1405 PolarHBondContact O-N 2.87Å; I1403-L1406 CarbonylContact O-C 3.47Å; I1403-L1406 WeakPolarHBondContact O-CB 3.05Å; I1403-L1406 PolarHBondContact O-N 3.31Å; I1403-I1407 HydrophobicContact CG2-CD1 3.7Å; I1403-I1407 HydrophobicContact CG2-CG1 4.3Å; I1403-I1407 WeakPolarHBondContact O-CB 3.45Å; I1403-I1407 VanDerWaalsContact O-CG1 3.25Å; I1403-I1407 WeakPolarHBondContact O-CG1 3.31Å; I1403-I1407 PolarHBondContact O-N 2.62Å
1404	I	92.5	Very high	86	Confident	89 Å²	89	90.8 Å²	90.8	46%	0.456	48%	0.475	S	S	.	.	H	α-helix	trans	-62.4	-44	176.1	-70.4	168.2	0	0	0	110.2	I1400 I1401 L1406 I1407 I1408	I1400-I1404 HydrophobicContact CG2-CD1 3.71Å; I1400-I1404 HydrophobicContact CG2-CG1 4.39Å; I1400-I1404 WeakPolarHBondContact O-CB 3.48Å; I1400-I1404 WeakPolarHBondContact O-CG1 3.42Å; I1400-I1404 PolarHBondContact O-N 2.96Å; I1401-I1404 PolarHBondContact O-N 3.49Å; I1404-L1406 VanDerWaalsContact C-N 3.33Å; I1404-L1406 PolarHBondContact O-N 3.1Å; I1404-I1407 PolarHBondContact O-N 2.83Å; I1404-I1408 HydrophobicContact CG2-CD1 3.75Å; I1404-I1408 HydrophobicContact CG2-CG1 4.4Å; I1404-I1408 WeakPolarHBondContact O-CB 3.33Å; I1404-I1408 VanDerWaalsContact O-CG1 3.23Å; I1404-I1408 WeakPolarHBondContact O-CG1 3.44Å; I1404-I1408 PolarHBondContact O-N 2.94Å
1405	L	92.8	Very high	86	Confident	102 Å²	102	89.2 Å²	89.2	53%	0.534	47%	0.467	S	S	.	.	H	α-helix	trans	-63.6	-38.5	174.9	-72.2	172.8	0	0	0	111.9	I1401 F1402 I1403 I1408 F1409	I1401-L1405 HydrophobicContact CG2-CD1 3.9Å; I1401-L1405 HydrophobicContact CG2-CG 4.36Å; I1401-L1405 WeakPolarHBondContact O-CB 3.29Å; I1401-L1405 VanDerWaalsContact O-CG 3.26Å; I1401-L1405 WeakPolarHBondContact O-CG 3.05Å; I1401-L1405 PolarHBondContact O-N 3.18Å; F1402-L1405 PolarHBondContact O-N 3.33Å; I1403-L1405 VanDerWaalsContact C-N 3.35Å; I1403-L1405 PolarHBondContact O-N 2.87Å; L1405-I1408 PolarHBondContact O-N 3.37Å; L1405-F1409 WeakPolarHBondContact O-CB 3.47Å; L1405-F1409 PolarHBondContact O-N 2.83Å
1406	L	89.3	Confident	85.5	Confident	73 Å²	73	87 Å²	87	38%	0.382	46%	0.458	S	S	.	.	H	α-helix	trans	-65.1	-42.8	174.7	-120.1	163	0	0	0	111.4	F1402 I1403 I1404 F1409 I1410	F1402-L1406 HydrophobicContact CD1-CD1 3.89Å; F1402-L1406 HydrophobicContact CE1-CD1 3.38Å; F1402-L1406 HydrophobicContact CE1-CG 4.4Å; F1402-L1406 HydrophobicContact CZ-CD1 4.04Å; F1402-L1406 WeakPolarHBondContact O-CB 3.47Å; F1402-L1406 PolarHBondContact O-N 2.98Å; I1403-L1406 CarbonylContact O-C 3.47Å; I1403-L1406 WeakPolarHBondContact O-CB 3.05Å; I1403-L1406 PolarHBondContact O-N 3.31Å; I1404-L1406 VanDerWaalsContact C-N 3.33Å; I1404-L1406 PolarHBondContact O-N 3.1Å; L1406-F1409 PolarHBondContact O-N 3.12Å; L1406-I1410 HydrophobicContact CD2-CD1 3.76Å; L1406-I1410 HydrophobicContact CD2-CG1 4.14Å; L1406-I1410 WeakPolarHBondContact O-CB 3.3Å; L1406-I1410 WeakPolarHBondContact O-CD1 2.99Å; L1406-I1410 WeakPolarHBondContact O-CG1 3.44Å; L1406-I1410 PolarHBondContact O-N 2.81Å
1407	I	90.7	Very high	84.7	Confident	95 Å²	95	85.2 Å²	85.2	49%	0.487	45%	0.453	S	S	.	.	H	α-helix	trans	-66.6	-44.3	176.9	-69.2	167.8	0	0	0	109.8	I1403 I1404 F1409 I1410 V1411	I1403-I1407 HydrophobicContact CG2-CD1 3.7Å; I1403-I1407 HydrophobicContact CG2-CG1 4.3Å; I1403-I1407 WeakPolarHBondContact O-CB 3.45Å; I1403-I1407 VanDerWaalsContact O-CG1 3.25Å; I1403-I1407 WeakPolarHBondContact O-CG1 3.31Å; I1403-I1407 PolarHBondContact O-N 2.62Å; I1404-I1407 PolarHBondContact O-N 2.83Å; I1407-F1409 VanDerWaalsContact C-N 3.31Å; I1407-F1409 PolarHBondContact O-N 2.04Å; I1407-I1410 PolarHBondContact O-N 2.98Å; I1407-V1411 HydrophobicContact CG2-CG2 4.21Å; I1407-V1411 VanDerWaalsContact O-CB 3.31Å; I1407-V1411 WeakPolarHBondContact O-CB 3.38Å; I1407-V1411 WeakPolarHBondContact O-CG2 3.5Å; I1407-V1411 PolarHBondContact O-N 2.82Å
1408	I	92	Very high	83.4	Confident	103 Å²	103	90.2 Å²	90.2	53%	0.528	47%	0.466	S	S	.	.	H	α-helix	trans	-60.9	-43.1	174.6	-69	166.8	0	0	0	110.2	I1404 L1405 V1411 A1412	I1404-I1408 HydrophobicContact CG2-CD1 3.75Å; I1404-I1408 HydrophobicContact CG2-CG1 4.4Å; I1404-I1408 WeakPolarHBondContact O-CB 3.33Å; I1404-I1408 VanDerWaalsContact O-CG1 3.23Å; I1404-I1408 WeakPolarHBondContact O-CG1 3.44Å; I1404-I1408 PolarHBondContact O-N 2.94Å; L1405-I1408 PolarHBondContact O-N 3.37Å; I1408-V1411 PolarHBondContact O-N 3.04Å; I1408-A1412 WeakPolarHBondContact O-CB 3.19Å; I1408-A1412 PolarHBondContact O-N 3.19Å
1409	F	88.6	Confident	81.9	Confident	135 Å²	135	98.4 Å²	98.4	59%	0.592	49%	0.486	S	S	*	.	H	α-helix	trans	-64	-46.1	176.5	-176.1	-94.3	0	0	0	111.4	L1405 L1406 I1407 A1412 H1413	L1405-F1409 WeakPolarHBondContact O-CB 3.47Å; L1405-F1409 PolarHBondContact O-N 2.83Å; L1406-F1409 PolarHBondContact O-N 3.12Å; I1407-F1409 VanDerWaalsContact C-N 3.31Å; I1407-F1409 PolarHBondContact O-N 2.04Å; F1409-A1412 PolarHBondContact O-N 2.7Å; F1409-H1413 AromaticContact CE1-CD2 3.97Å; F1409-H1413 AromaticContact CZ-CD2 3.94Å; F1409-H1413 WeakPolarHBondContact O-CA 3.49Å; F1409-H1413 WeakPolarHBondContact O-CB 2.95Å; F1409-H1413 PolarHBondContact O-N 3.44Å
1410	I	86.1	Confident	80.3	Confident	92 Å²	92	105.2 Å²	105.2	47%	0.472	50%	0.503	S	S	.	.	H	α-helix	trans	-62.2	-45.4	176.9	-71.5	164.4	0	0	0	110	L1406 I1407 H1413 F1414	L1406-I1410 HydrophobicContact CD2-CD1 3.76Å; L1406-I1410 HydrophobicContact CD2-CG1 4.14Å; L1406-I1410 WeakPolarHBondContact O-CB 3.3Å; L1406-I1410 WeakPolarHBondContact O-CD1 2.99Å; L1406-I1410 WeakPolarHBondContact O-CG1 3.44Å; L1406-I1410 PolarHBondContact O-N 2.81Å; I1407-I1410 PolarHBondContact O-N 2.98Å; I1410-H1413 CarbonylContact O-C 3.59Å; I1410-H1413 PolarHBondContact O-N 3.07Å; I1410-F1414 WeakPolarHBondContact O-CB 3.43Å; I1410-F1414 PolarHBondContact O-N 3.3Å
1411	V	87.7	Confident	78.1	Confident	74 Å²	74	111.4 Å²	111.4	45%	0.448	52%	0.521	S	S	.	.	H	α-helix	trans	-66.1	-42.8	178.8	171.5	0	0	0	0	110.6	I1407 I1408 H1413 F1414 I1415	I1407-V1411 HydrophobicContact CG2-CG2 4.21Å; I1407-V1411 VanDerWaalsContact O-CB 3.31Å; I1407-V1411 WeakPolarHBondContact O-CB 3.38Å; I1407-V1411 WeakPolarHBondContact O-CG2 3.5Å; I1407-V1411 PolarHBondContact O-N 2.82Å; I1408-V1411 PolarHBondContact O-N 3.04Å; V1411-H1413 VanDerWaalsContact C-N 3.35Å; V1411-H1413 PolarHBondContact O-N 3.14Å; V1411-F1414 PolarHBondContact O-N 3.13Å; V1411-I1415 HydrophobicContact CG1-CD1 3.69Å; V1411-I1415 HydrophobicContact CG1-CG1 4.34Å; V1411-I1415 WeakPolarHBondContact O-CB 2.94Å; V1411-I1415 WeakPolarHBondContact O-CG1 3.02Å; V1411-I1415 PolarHBondContact O-N 2.9Å
1412	A	83.3	Confident	75.6	Confident	48 Å²	48	115.6 Å²	115.6	40%	0.397	54%	0.538	S	S	.	.	H	α-helix	trans	-64	-40.6	174.1	0	0	0	0	0	111.6	I1408 F1409 F1414 I1415 T1416	I1408-A1412 WeakPolarHBondContact O-CB 3.19Å; I1408-A1412 PolarHBondContact O-N 3.19Å; F1409-A1412 PolarHBondContact O-N 2.7Å; A1412-F1414 VanDerWaalsContact C-N 3.33Å; A1412-I1415 PolarHBondContact O-N 2.92Å; A1412-T1416 WeakPolarHBondContact O-CB 3.37Å; A1412-T1416 WeakPolarHBondContact O-CG2 3.4Å; A1412-T1416 PolarHBondContact O-N 2.95Å; A1412-T1416 PolarHBondContact O-OG1 2.96Å
1413	H	78.6	Confident	72.8	Confident	107 Å²	107	120.3 Å²	120.3	50%	0.495	55%	0.552	S	S	.	*	H	α-helix	trans	-70.3	-31.6	176.7	-154.5	-63.5	0	0	0	111.4	F1409 I1410 V1411 T1416 A1417	F1409-H1413 AromaticContact CE1-CD2 3.97Å; F1409-H1413 AromaticContact CZ-CD2 3.94Å; F1409-H1413 WeakPolarHBondContact O-CA 3.49Å; F1409-H1413 WeakPolarHBondContact O-CB 2.95Å; F1409-H1413 PolarHBondContact O-N 3.44Å; I1410-H1413 CarbonylContact O-C 3.59Å; I1410-H1413 PolarHBondContact O-N 3.07Å; V1411-H1413 VanDerWaalsContact C-N 3.35Å; V1411-H1413 PolarHBondContact O-N 3.14Å; H1413-T1416 VanDerWaalsContact CA-OG1 3.25Å; H1413-T1416 WeakPolarHBondContact CA-OG1 3.36Å; H1413-T1416 PolarHBondContact O-OG1 3.26Å; H1413-A1417 WeakPolarHBondContact O-CA 3.41Å; H1413-A1417 WeakPolarHBondContact O-CB 3.43Å; H1413-A1417 PolarHBondContact O-N 2.96Å
1414	F	77.4	Confident	70.1	Confident	119 Å²	119	119.5 Å²	119.5	52%	0.522	57%	0.566	S	S	.	*	H	α-helix	trans	-76.6	-39.2	175.6	-152.3	-89	0	0	0	110.8	I1410 V1411 A1412 R1418	I1410-F1414 WeakPolarHBondContact O-CB 3.43Å; I1410-F1414 PolarHBondContact O-N 3.3Å; V1411-F1414 PolarHBondContact O-N 3.13Å; A1412-F1414 VanDerWaalsContact C-N 3.33Å; F1414-R1418 WeakPolarHBondContact O-CA 3.42Å; F1414-R1418 WeakPolarHBondContact O-CB 3.03Å; F1414-R1418 PolarHBondContact O-N 3.22Å
1415	I	78	Confident	66.9	Low	85 Å²	85	120.4 Å²	120.4	44%	0.436	58%	0.581	S	S	.	*	H	α-helix	trans	-65.3	-42.5	173	-68.7	166.9	0	0	0	110.2	V1411 A1412 R1419	V1411-I1415 HydrophobicContact CG1-CD1 3.69Å; V1411-I1415 HydrophobicContact CG1-CG1 4.34Å; V1411-I1415 WeakPolarHBondContact O-CB 2.94Å; V1411-I1415 WeakPolarHBondContact O-CG1 3.02Å; V1411-I1415 PolarHBondContact O-N 2.9Å; A1412-I1415 PolarHBondContact O-N 2.92Å; I1415-R1419 WeakPolarHBondContact O-CB 3.29Å; I1415-R1419 WeakPolarHBondContact O-CG 3.06Å; I1415-R1419 PolarHBondContact O-N 2.92Å
1416	T	65	Low	63.8	Low	66 Å²	66	122.1 Å²	122.1	41%	0.405	59%	0.59	S	S	.	*	H	α-helix	trans	-72.7	-38	176.5	51.1	0	0	0	0	112.6	A1412 H1413 R1419 R1420	A1412-T1416 WeakPolarHBondContact O-CB 3.37Å; A1412-T1416 WeakPolarHBondContact O-CG2 3.4Å; A1412-T1416 PolarHBondContact O-N 2.95Å; A1412-T1416 PolarHBondContact O-OG1 2.96Å; H1413-T1416 VanDerWaalsContact CA-OG1 3.25Å; H1413-T1416 WeakPolarHBondContact CA-OG1 3.36Å; H1413-T1416 PolarHBondContact O-OG1 3.26Å; T1416-R1419 PolarHBondContact O-N 3.26Å; T1416-R1420 WeakPolarHBondContact O-CB 3.31Å; T1416-R1420 WeakPolarHBondContact O-CG 3.2Å; T1416-R1420 PolarHBondContact O-N 2.03Å
1417	A	61	Low	61	Low	24 Å²	24	127 Å²	127	20%	0.198	61%	0.612	C	S	.	*	H	α-helix	trans	-68.6	-37.5	174	0	0	0	0	0	111.9	H1413 R1420 R1421	H1413-A1417 WeakPolarHBondContact O-CA 3.41Å; H1413-A1417 WeakPolarHBondContact O-CB 3.43Å; H1413-A1417 PolarHBondContact O-N 2.96Å; A1417-R1420 CarbonylContact O-C 3.58Å; A1417-R1420 PolarHBondContact O-N 3.38Å; A1417-R1420 VanDerWaalsContact O-N 3.09Å; A1417-R1421 PolarHBondContact O-N 3.33Å
1418	R	55.7	Low	57.9	Low	188 Å²	188	129 Å²	129	71%	0.709	62%	0.62	S	S	*	*	H	α-helix	trans	-70.6	-32	175.1	-159.5	172.7	-169.7	159.6	2.9	111.5	F1414 R1420	F1414-R1418 WeakPolarHBondContact O-CA 3.42Å; F1414-R1418 WeakPolarHBondContact O-CB 3.03Å; F1414-R1418 PolarHBondContact O-N 3.22Å; R1418-R1420 VanDerWaalsContact C-N 3.31Å
1419	R	56.9	Low	54.9	Low	209 Å²	209	133.2 Å²	133.2	79%	0.789	63%	0.631	S	S	*	*	H	α-helix	trans	-69.8	-23.5	167	-76.5	-178	-176.6	176.8	2.4	113.5	I1415 T1416	I1415-R1419 WeakPolarHBondContact O-CB 3.29Å; I1415-R1419 WeakPolarHBondContact O-CG 3.06Å; I1415-R1419 PolarHBondContact O-N 2.92Å; T1416-R1419 PolarHBondContact O-N 3.26Å
1420	R	53	Low	51.9	Low	201 Å²	201	131.7 Å²	131.7	76%	0.758	64%	0.637	S	S	*	*	H	α-helix	trans	-95.8	-19.5	-179.9	-74.4	-179	179.7	169.2	0.9	115.1	T1416 A1417 R1418 H1422	T1416-R1420 WeakPolarHBondContact O-CB 3.31Å; T1416-R1420 WeakPolarHBondContact O-CG 3.2Å; T1416-R1420 PolarHBondContact O-N 2.03Å; A1417-R1420 CarbonylContact O-C 3.58Å; A1417-R1420 PolarHBondContact O-N 3.38Å; A1417-R1420 VanDerWaalsContact O-N 3.09Å; R1418-R1420 VanDerWaalsContact C-N 3.31Å; R1420-H1422 PolarHBondContact O-N 2.79Å
1421	R	41.6	Very low	49.2	Very low	211 Å²	211	133.9 Å²	133.9	80%	0.796	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	8.1	178.5	-79.9	-174.5	-171.3	156.2	3.3	115.8	A1417	A1417-R1421 PolarHBondContact O-N 3.33Å
1422	H	39	Very low	46.3	Very low	181 Å²	181	135.9 Å²	135.9	84%	0.838	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	19.1	168.1	-103.2	-72.8	0	0	0	114.4	R1420	R1420-H1422 PolarHBondContact O-N 2.79Å
1423	R	31.5	Very low	43.7	Very low	232 Å²	232	143.8 Å²	143.8	88%	0.875	70%	0.701	S	S	*	*	S	Bend	trans	-139	116.6	176.7	-87.3	-176.8	168.4	159.7	-3.3	113.9
1424	G	31.5	Very low	41.2	Very low	75 Å²	75	147.7 Å²	147.7	77%	0.773	72%	0.716	S	S	*	*			trans	69	119.3	154.6	0	0	0	0	0	116.2
1425	S	26	Very low	38.8	Very low	109 Å²	109	150.7 Å²	150.7	76%	0.762	73%	0.732	S	S	*	*			cis	51.4	89.7	34.6	-157.8	0	0	0	0	114.5
1426	N	27.5	Very low	36.3	Very low	137 Å²	137	154.8 Å²	154.8	73%	0.733	75%	0.747	S	S	*	*				160.3	141	122.9	-91.7	-26.5	0	0	0	114.3
1427	Q	28.9	Very low	34.2	Very low	177 Å²	177	160.2 Å²	160.2	83%	0.827	76%	0.761	S	S	*	*			trans	72.8	153.3	151.7	-71.1	171.4	-8.9	0	0	120.2
1428	M	26.4	Very low	32.6	Very low	136 Å²	136	167.9 Å²	167.9	67%	0.67	79%	0.792	S	S	*	*			cis	165.2	159.8	-28.6	-178	171.1	162.6	0	0	106
1429	Y	29.4	Very low	31.2	Very low	191 Å²	191	166.4 Å²	166.4	75%	0.749	79%	0.793	S	S	*	*			trans	94.2	110.1	168.2	-60.4	-80.4	0	0	0	117
1430	S	25.3	Very low	29.7	Very low	103 Å²	103	161.2 Å²	161.2	72%	0.72	79%	0.789	S	S	*	*				83.4	110.4	66.2	-173	0	0	0	0	113.7
1431	C	29.4	Very low	28.4	Very low	138 Å²	138	157.9 Å²	157.9	93%	0.932	79%	0.786	S	S	*	*			trans	-151.8	104.5	156.8	-102.5	0	0	0	0	110
1432	C	26.4	Very low	27.5	Very low	117 Å²	117	156.9 Å²	156.9	79%	0.791	79%	0.788	S	S	*	*			trans	-83.3	144.6	163.2	-75.3	0	0	0	0	110
1433	F	29.7	Very low	26.9	Very low	214 Å²	214	159.7 Å²	159.7	94%	0.939	79%	0.791	S	S	*	*			trans	-142.9	128.2	146.4	-125.3	-88.3	0	0	0	111.7
1434	K	24.6	Very low	26.5	Very low	188 Å²	188	154.2 Å²	154.2	82%	0.817	78%	0.783	S	S	*	*			trans	-96.2	154.1	-174	-106.4	174.6	171.4	170.6	0	110.5
1435	Q	28.2	Very low	26.2	Very low	182 Å²	182	159.9 Å²	159.9	85%	0.85	79%	0.787	S	S	*	*			trans	143.6	150.9	134.1	-87.8	177.6	-21.3	0	0	111.4
1436	K	24.6	Very low	26.2	Very low	172 Å²	172	164.1 Å²	164.1	75%	0.748	79%	0.791	S	S	*	*			cis	-176.7	137	-35.2	-117	-159	172.5	-179	0	103.8
1437	Y	22	Very low	26.3	Very low	180 Å²	180	166 Å²	166	71%	0.706	80%	0.8	S	S	*	*			trans	52.6	121.3	148.7	-78.8	-96.6	0	0	0	121.8
1438	H	27.3	Very low	26.1	Very low	185 Å²	185	163 Å²	163	86%	0.856	79%	0.793	S	S	*	*				-166.1	119.6	102.3	-124.7	-83.1	0	0	0	112.5
1439	E	25.1	Very low	26.3	Very low	156 Å²	156	162.2 Å²	162.2	73%	0.729	80%	0.796	S	S	*	*			trans	-78	150.3	162.4	-75.2	171.5	119	0	0	110.6
1440	S	25.7	Very low	26.2	Very low	100 Å²	100	158.6 Å²	158.6	70%	0.699	80%	0.799	S	S	*	*				150	135.9	109.5	61.8	0	0	0	0	115.3
1441	N	25.7	Very low	26.4	Very low	131 Å²	131	160.1 Å²	160.1	70%	0.701	80%	0.804	S	S	*	*			trans	86.2	103.4	143.4	-72.3	-30.9	0	0	0	123.4
1442	K	24	Very low	26.5	Very low	190 Å²	190	159.9 Å²	159.9	83%	0.826	80%	0.798	S	S	*	*				50.4	111.8	116	-70.6	176.7	175.4	172.6	0	119.2
1443	R	25.1	Very low	26.9	Very low	240 Å²	240	163.9 Å²	163.9	91%	0.906	80%	0.802	S	S	*	*				-179.1	108.7	112.4	-116.2	175.9	171.9	169.9	-2.7	113.9
1444	T	24	Very low	27.3	Very low	117 Å²	117	163 Å²	163	72%	0.718	80%	0.798	S	S	*	*			trans	18.1	130.8	130.5	-4	0	0	0	0	121.7
1445	K	25.9	Very low	27.5	Very low	194 Å²	194	165.5 Å²	165.5	84%	0.843	80%	0.802	S	S	*	*			trans	61.4	104.2	140.5	-84.1	173.4	178.6	179.7	0	118.8
1446	K	24.7	Very low	27.9	Very low	198 Å²	198	165.5 Å²	165.5	86%	0.861	80%	0.799	S	S	*	*				171.1	96.4	123.5	-97.5	174.9	178.6	179.9	0	108.7
1447	I	29	Very low	28.5	Very low	177 Å²	177	161.2 Å²	161.2	91%	0.908	80%	0.796	S	S	*	*			trans	-122.2	87.3	161.9	-59.4	-179.9	0	0	0	106.7
1448	V	26.1	Very low	28.9	Very low	114 Å²	114	164 Å²	164	69%	0.691	81%	0.805	S	S	*	*			trans	-95.7	125.2	166.6	167.6	0	0	0	0	106.1
1449	T	29.2	Very low	29.1	Very low	119 Å²	119	163.2 Å²	163.2	73%	0.73	80%	0.802	S	S	*	*			trans	59.2	100.1	153.6	60.5	0	0	0	0	119.7
1450	S	28.7	Very low	29.4	Very low	115 Å²	115	164 Å²	164	80%	0.804	81%	0.808	S	S	*	*			trans	-155.9	47.3	142.2	72.6	0	0	0	0	113.2
1451	V	29.5	Very low	29.7	Very low	136 Å²	136	164 Å²	164	82%	0.824	81%	0.813	S	S	*	*			trans	-135.5	54.1	168.4	-163.6	0	0	0	0	111
1452	T	31.7	Very low	29.7	Very low	132 Å²	132	163 Å²	163	81%	0.81	82%	0.817	S	S	*	*	S	Bend	trans	-118.6	7.6	161.5	31.1	0	0	0	0	113
1453	K	34.6	Very low	29.8	Very low	201 Å²	201	160.8 Å²	160.8	87%	0.874	81%	0.813	S	S	*	*	S	Bend	trans	-104.2	2.8	-177.5	-91.2	-172.9	176.5	-179.5	0	117.8
1454	K	38	Very low	29.8	Very low	196 Å²	196	155.5 Å²	155.5	85%	0.852	81%	0.807	S	S	*	*	S	Bend	trans	-119.3	4	179.5	-90.8	-175.6	176.6	179.3	0	117.8
1455	R	29.1	Very low	30.1	Very low	240 Å²	240	157.8 Å²	157.8	91%	0.906	82%	0.815	S	S	*	*	S	Bend	trans	-94.8	-9	168.6	-105.4	-179.5	177.7	161.9	-0.5	115.6
1456	K	36.9	Very low	30.1	Very low	183 Å²	183	155.6 Å²	155.6	80%	0.796	81%	0.808	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-0.8	172	-90.3	-172.4	173.8	-176.1	0	115.5
1457	A	35.2	Very low	30.3	Very low	81 Å²	81	152.5 Å²	152.5	67%	0.669	80%	0.796	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96	0.9	-177.3	0	0	0	0	0	115.5
1458	R	32.4	Very low	30.1	Very low	240 Å²	240	150 Å²	150	91%	0.906	78%	0.784	S	S	*	*	S	Bend	trans	-124.6	6.7	175.2	-75.5	-173.2	178.2	170.7	-1.2	115.1
1459	Q	31.2	Very low	30	Very low	168 Å²	168	151 Å²	151	79%	0.785	78%	0.777	S	S	*	*	S	Bend	trans	-109.1	18.2	169	-97.9	-179.8	-24.8	0	0	113.2
1460	M	30.3	Very low	29.8	Very low	173 Å²	173	152.1 Å²	152.1	85%	0.852	77%	0.769	S	S	*	*	S	Bend	trans	-128.3	35	172.2	-77.5	-175.5	168	0	0	113.1
1461	A	31.7	Very low	29.4	Very low	99 Å²	99	152.7 Å²	152.7	82%	0.818	76%	0.758	S	S	*	*	S	Bend	trans	-132.5	20.5	168.6	0	0	0	0	0	113
1462	S	26.7	Very low	29.2	Very low	110 Å²	110	150.8 Å²	150.8	77%	0.769	74%	0.744	S	S	*	*	S	Bend	trans	-143.2	62	177.9	171.7	0	0	0	0	109.1
1463	L	25.8	Very low	28.8	Very low	144 Å²	144	151 Å²	151	75%	0.754	74%	0.736	S	S	*	*	S	Bend	trans	-157.5	67.8	167.9	-102.4	149.8	0	0	0	106.7
1464	T	26	Very low	28.3	Very low	128 Å²	128	150.2 Å²	150.2	79%	0.785	73%	0.728	S	S	*	*	S	Bend	trans	168.3	83.3	152.3	37	0	0	0	0	107.7
1465	N	29.2	Very low	27.7	Very low	166 Å²	166	150.5 Å²	150.5	89%	0.888	73%	0.73	S	S	*	*				-157.3	74.1	121.6	-95.6	-4.8	0	0	0	104.9	H1467	N1465-H1467 PolarHBondContact O-N 2.87Å
1466	H	26.2	Very low	27.5	Very low	147 Å²	147	145.7 Å²	145.7	68%	0.681	72%	0.722	S	S	*	*			trans	-43.5	127.4	147.3	-94.7	-80.8	0	0	0	107.3
1467	H	28.7	Very low	27.2	Very low	133 Å²	133	143.9 Å²	143.9	62%	0.616	72%	0.721	S	S	*	*				52	107	92.9	-102.8	-63	0	0	0	108.8	N1465	N1465-H1467 PolarHBondContact O-N 2.87Å
1468	N	25.7	Very low	26.9	Very low	124 Å²	124	146.2 Å²	146.2	66%	0.663	73%	0.73	S	S	*	*				-174.9	136.3	94.1	-92	-21.1	0	0	0	110.2
1469	Y	23.4	Very low	26.5	Very low	137 Å²	137	140.1 Å²	140.1	54%	0.537	72%	0.719	S	S	.	*				60.4	123.8	80.6	-113	-126.6	0	0	0	106.6
1470	Y	24	Very low	26.2	Very low	141 Å²	141	139.1 Å²	139.1	55%	0.553	72%	0.718	S	S	*	*			cis	168.7	162.6	33.3	-136.6	-147.4	0	0	0	105.8
1471	H	21.9	Very low	26	Very low	127 Å²	127	138.5 Å²	138.5	59%	0.588	72%	0.717	S	S	*	*			trans	56.3	141	134.3	-86.1	-115.3	0	0	0	118.2
1472	D	24.6	Very low	25.7	Very low	96 Å²	96	140.9 Å²	140.9	51%	0.513	71%	0.711	S	S	.	*			cis	170.8	167.6	0.7	-134.6	-2.3	0	0	0	101.8
1473	Q	23.1	Very low	25.6	Very low	138 Å²	138	144.7 Å²	144.7	65%	0.645	71%	0.709	S	S	*	*			trans	70.5	114.6	137.7	-73.5	176.3	21.3	0	0	120.3
1474	Y	24.9	Very low	25.6	Very low	184 Å²	184	143.7 Å²	143.7	72%	0.722	70%	0.704	S	S	*	*			trans	63.5	127.2	133.8	-66.8	-71.1	0	0	0	117.8
1475	F	25.1	Very low	25.5	Very low	201 Å²	201	146.5 Å²	146.5	88%	0.882	71%	0.706	S	S	*	*				-172.6	145.8	99.4	-104.1	-80	0	0	0	111.8
1476	N	25.9	Very low	25.6	Very low	140 Å²	140	145.6 Å²	145.6	75%	0.749	71%	0.706	S	S	*	*			trans	-64.3	157.1	-173.6	-74.9	-51.2	0	0	0	115.3
1477	N	29.1	Very low	25.5	Very low	145 Å²	145	145.8 Å²	145.8	78%	0.775	71%	0.707	S	S	*	*			trans	-25.3	145.1	162.6	-78	-33.1	0	0	0	116.3
1478	P	28.8	Very low	25.4	Very low	130 Å²	130	145.7 Å²	145.7	84%	0.844	71%	0.711	S	S	*	*				-124.3	117.4	128.7	30.7	-17.4	0	0	0	111.2
1479	T	24.4	Very low	25.7	Very low	112 Å²	112	147.5 Å²	147.5	69%	0.687	72%	0.721	S	S	*	*			trans	-68	167	159.1	32.2	0	0	0	0	112.1
1480	I	24.3	Very low	25.8	Very low	146 Å²	146	149.8 Å²	149.8	75%	0.749	74%	0.736	S	S	*	*			trans	102.8	102.8	160.1	-48.1	165.6	0	0	0	113.9
1481	L	25.9	Very low	26.2	Very low	160 Å²	160	149 Å²	149	84%	0.838	75%	0.751	S	S	*	*				-174.4	119.6	98.4	-119	116.6	0	0	0	110.4
1482	E	26.4	Very low	26.4	Very low	150 Å²	150	151.1 Å²	151.1	70%	0.701	76%	0.762	S	S	*	*			trans	-61.9	153.2	160.7	-52.9	177.5	152.8	0	0	110.1
1483	R	24	Very low	26.6	Very low	189 Å²	189	152.9 Å²	152.9	71%	0.713	77%	0.771	S	S	*	*				155.4	151	93	-128.2	-178.3	-146.8	-170	-1.8	114.2
1484	N	26	Very low	27	Very low	123 Å²	123	154 Å²	154	66%	0.658	78%	0.776	S	S	*	*			trans	91	92.5	145.7	-67.2	-20.5	0	0	0	119.7
1485	K	24.5	Very low	27.2	Very low	188 Å²	188	151.7 Å²	151.7	82%	0.817	78%	0.776	S	S	*	*				10	125.1	113.5	-75.1	-176	171	-172.2	0	116.2
1486	V	30.9	Very low	27.4	Very low	147 Å²	147	148.6 Å²	148.6	89%	0.891	77%	0.769	S	S	*	*			trans	-125.5	133.4	146.6	173.6	0	0	0	0	107
1487	E	25	Very low	27.6	Very low	150 Å²	150	148.8 Å²	148.8	70%	0.701	77%	0.77	S	S	*	*			trans	-83.2	164	-171.6	-77.5	165.1	157.6	0	0	113.5
1488	D	26.4	Very low	27.9	Very low	132 Å²	132	150 Å²	150	71%	0.706	78%	0.777	S	S	*	*			trans	67	120.6	147.8	-54.4	-19.7	0	0	0	121.4
1489	N	31.1	Very low	28	Very low	162 Å²	162	149.9 Å²	149.9	87%	0.866	77%	0.769	S	S	*	*				-172.4	132.4	106.9	-88.6	-33.5	0	0	0	112.1
1490	E	25.4	Very low	28.5	Very low	184 Å²	184	150.2 Å²	150.2	86%	0.86	77%	0.773	S	S	*	*			trans	-64.9	150.7	171.7	-64.8	161.9	147.1	0	0	112
1491	S	32.2	Very low	28.7	Very low	124 Å²	124	151.6 Å²	151.6	87%	0.867	78%	0.776	S	S	*	*			trans	-164	121.6	143.3	7.3	0	0	0	0	110.3
1492	E	26.6	Very low	28.6	Very low	173 Å²	173	149 Å²	149	81%	0.808	78%	0.778	S	S	*	*			trans	-64.4	162.8	176.2	-66.7	162.4	146.2	0	0	114.5
1493	D	29.2	Very low	28.7	Very low	133 Å²	133	150.4 Å²	150.4	71%	0.711	78%	0.784	S	S	*	*			trans	116	121.7	134.4	-68	-29	0	0	0	122.1
1494	E	30.3	Very low	28.7	Very low	161 Å²	161	150.5 Å²	150.5	75%	0.752	79%	0.793	S	S	*	*			trans	87.2	99.7	137.1	-69.8	177.8	-176.2	0	0	122.1
1495	D	29.8	Very low	28.7	Very low	135 Å²	135	151.1 Å²	151.1	72%	0.722	80%	0.795	S	S	*	*				74.6	128.4	110	-62.9	-12.2	0	0	0	124.4
1496	D	29.7	Very low	28.7	Very low	137 Å²	137	147.2 Å²	147.2	73%	0.733	79%	0.791	S	S	*	*			trans	85.6	110.8	137.8	-66.3	-15	0	0	0	124
1497	D	28.9	Very low	28.5	Very low	144 Å²	144	148.5 Å²	148.5	77%	0.77	79%	0.792	S	S	*	*				59.1	114.1	128.7	-76	-19.9	0	0	0	121.9
1498	D	35.6	Very low	28.5	Very low	171 Å²	171	150.7 Å²	150.7	91%	0.914	80%	0.799	S	S	*	*				-169.6	122.5	123.9	-99	-29.5	0	0	0	112.7
1499	N	32	Very low	28.3	Very low	126 Å²	126	151 Å²	151	67%	0.674	81%	0.81	S	S	*	*			trans	-95.7	141.7	172.7	175.1	33.6	0	0	0	108.9	Q1501	N1499-Q1501 PolarHBondContact OD1-N 3.07Å; N1499-Q1501 VanDerWaalsContact OD1-N 3.13Å
1500	P	34.4	Very low	28	Very low	120 Å²	120	153 Å²	153	78%	0.779	81%	0.811	S	S	*	*				-152.3	126.3	101.9	32	-10.3	0	0	0	116.6
1501	Q	27.7	Very low	27.8	Very low	174 Å²	174	155.5 Å²	155.5	81%	0.813	81%	0.812	S	S	*	*			trans	25.2	121.2	137	-68.3	-170	-28.9	0	0	121.7	N1499	N1499-Q1501 PolarHBondContact OD1-N 3.07Å; N1499-Q1501 VanDerWaalsContact OD1-N 3.13Å
1502	A	25.2	Very low	27.4	Very low	106 Å²	106	157.7 Å²	157.7	88%	0.876	81%	0.813	S	S	*	*			trans	-76.3	132.1	166.8	0	0	0	0	0	112.9
1503	E	28.9	Very low	27.2	Very low	179 Å²	179	157.9 Å²	157.9	84%	0.836	81%	0.811	S	S	*	*			trans	-97.4	123.5	179.6	-155.1	175.8	-163.7	0	0	110.5
1504	Q	24.1	Very low	27	Very low	191 Å²	191	158 Å²	158	89%	0.893	81%	0.812	S	S	*	*			trans	-117.4	105.5	-173.2	-150.7	-171.7	16.2	0	0	108.6
1505	I	25.9	Very low	26.9	Very low	137 Å²	137	157 Å²	157	70%	0.703	81%	0.811	S	S	*	*			trans	-137.9	100.3	174.4	-57.9	-178.6	0	0	0	112.4
1506	S	22.7	Very low	26.7	Very low	105 Å²	105	157.5 Å²	157.5	73%	0.734	81%	0.814	S	S	*	*			trans	29.7	106.7	130.8	-170.1	0	0	0	0	119.9
1507	L	27.4	Very low	26.6	Very low	174 Å²	174	159 Å²	159	91%	0.911	82%	0.82	S	S	*	*			trans	-105.6	107.5	163.9	-96.7	137.6	0	0	0	110.8	C1509	L1507-C1509 PolarHBondContact O-N 2.8Å
1508	K	25.1	Very low	26.4	Very low	197 Å²	197	159.3 Å²	159.3	86%	0.857	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-60.3	119.4	177.4	-80.5	169.8	172	167.9	0	112.9
1509	C	22.5	Very low	25.9	Very low	137 Å²	137	158.9 Å²	158.9	93%	0.926	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-75	122.5	165	-82.4	0	0	0	0	111.6	L1507	L1507-C1509 PolarHBondContact O-N 2.8Å
1510	K	24.4	Very low	25.7	Very low	204 Å²	204	155.7 Å²	155.7	89%	0.887	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-98.7	129.7	-179.1	-164.3	172.8	-178	178.3	0	110.4
1511	R	20.9	Very low	25.4	Very low	237 Å²	237	161.2 Å²	161.2	89%	0.894	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-51.6	134.6	178.4	-75.7	172.5	172.4	168.2	-3.2	113.7
1512	I	24.5	Very low	25.3	Very low	171 Å²	171	160.1 Å²	160.1	88%	0.877	82%	0.82	S	S	*	*			trans	-127.6	127.6	153.4	-63	179.8	0	0	0	107.5
1513	K	22.2	Very low	25.4	Very low	176 Å²	176	162.4 Å²	162.4	77%	0.765	82%	0.818	S	S	*	*			trans	-90.9	158	-178.2	-92.3	-178.1	169.4	-175.7	0	110.7
1514	D	25.5	Very low	25.3	Very low	136 Å²	136	163.8 Å²	163.8	73%	0.727	82%	0.821	S	S	*	*			trans	108.6	104.4	151.9	-58.2	-28.3	0	0	0	118.9
1515	N	28.8	Very low	25.4	Very low	139 Å²	139	164.3 Å²	164.3	74%	0.743	82%	0.82	S	S	*	*			trans	82.5	90.8	137.5	-63	-16.1	0	0	0	122.2
1516	N	25.1	Very low	25.4	Very low	147 Å²	147	165.9 Å²	165.9	79%	0.786	83%	0.828	S	S	*	*				50.9	87.5	118.8	-70.8	-8.5	0	0	0	120.3
1517	I	26.5	Very low	25.5	Very low	167 Å²	167	168 Å²	168	86%	0.856	83%	0.831	S	S	*	*			trans	-143.5	111.6	130.3	-59	-175.6	0	0	0	106.7
1518	N	24.9	Very low	25.5	Very low	151 Å²	151	167.1 Å²	167.1	81%	0.807	83%	0.828	S	S	*	*			trans	-121.7	101.8	-171.8	-149	2	0	0	0	109.4
1519	I	25.3	Very low	25.7	Very low	162 Å²	162	165.9 Å²	165.9	83%	0.831	83%	0.829	S	S	*	*			trans	-110.9	95.5	161.8	-65.6	176.1	0	0	0	104.8	Y1521	I1519-Y1521 PolarHBondContact O-N 2.02Å
1520	G	28.2	Very low	25.9	Very low	60 Å²	60	167.6 Å²	167.6	62%	0.619	82%	0.823	S	S	*	*			trans	-76.1	118	-168.6	0	0	0	0	0	113.2
1521	Y	27.6	Very low	25.8	Very low	236 Å²	236	166.3 Å²	166.3	93%	0.925	83%	0.825	S	S	*	*			trans	-66.3	126.4	156.3	-110.7	-105.2	0	0	0	109.7	I1519	I1519-Y1521 PolarHBondContact O-N 2.02Å
1522	I	26.3	Very low	26.1	Very low	151 Å²	151	160.5 Å²	160.5	77%	0.774	82%	0.816	S	S	*	*			trans	-110	111.3	167.2	-63.3	174.8	0	0	0	106.4
1523	D	26.8	Very low	26.1	Very low	153 Å²	153	159.7 Å²	159.7	82%	0.818	81%	0.813	S	S	*	*			trans	166.9	79.3	142.4	-90.1	-18.4	0	0	0	110.4
1524	K	26.8	Very low	26.3	Very low	208 Å²	208	159 Å²	159	90%	0.904	82%	0.818	S	S	*	*			trans	-150.3	97.9	158.5	-90.7	-167.6	178.4	-179.9	0	108.7
1525	K	25.2	Very low	26.1	Very low	203 Å²	203	158 Å²	158	88%	0.883	82%	0.82	S	S	*	*			trans	176.3	76.1	145.5	-105.6	-172.3	176.8	-169.7	0	110.8
1526	I	27.1	Very low	25.8	Very low	170 Å²	170	158.8 Å²	158.8	87%	0.872	82%	0.823	S	S	*	*			trans	-146.2	73.1	147	-52.8	-178	0	0	0	106.6
1527	N	24.9	Very low	25.8	Very low	148 Å²	148	158.1 Å²	158.1	79%	0.791	82%	0.824	S	S	*	*			trans	-122.5	147.3	149.3	-82.5	-6	0	0	0	104.6
1528	D	26.9	Very low	25.5	Very low	157 Å²	157	156.6 Å²	156.6	84%	0.84	82%	0.823	S	S	*	*			trans	102.5	62.2	177.7	-46.9	-16.9	0	0	0	114.3
1529	I	28.8	Very low	25.6	Very low	170 Å²	170	156.2 Å²	156.2	87%	0.872	83%	0.826	S	S	*	*			trans	-135	108.1	139.8	-57.7	-176.9	0	0	0	107.6
1530	E	26.3	Very low	25.5	Very low	173 Å²	173	153.2 Å²	153.2	81%	0.808	82%	0.819	S	S	*	*			trans	-59.4	130.2	174.5	-117.8	162.7	165.1	0	0	111	T1532	E1530-T1532 PolarHBondContact O-N 3.15Å
1531	L	24	Very low	25.3	Very low	178 Å²	178	158.3 Å²	158.3	93%	0.932	83%	0.832	S	S	*	*			trans	-84.7	90.4	170.1	-78.6	153.9	0	0	0	107.9
1532	T	25.3	Very low	25.2	Very low	115 Å²	115	151.3 Å²	151.3	71%	0.706	83%	0.832	S	S	*	*			trans	-100	123.1	166.6	47.5	0	0	0	0	109.7	E1530 D1534	E1530-T1532 PolarHBondContact O-N 3.15Å; T1532-D1534 PolarHBondContact O-N 3.09Å; T1532-D1534 VanDerWaalsContact O-N 3.11Å
1533	D	25.5	Very low	25.2	Very low	153 Å²	153	147.9 Å²	147.9	82%	0.818	83%	0.834	S	S	*	*			trans	-58.7	101.9	174.9	-72.8	-48.5	0	0	0	111.5
1534	D	26	Very low	25.2	Very low	162 Å²	162	145.6 Å²	145.6	87%	0.866	83%	0.83	S	S	*	*			trans	-129.5	57.7	152.9	-92.5	-30.8	0	0	0	107.9	T1532 I1536	T1532-D1534 PolarHBondContact O-N 3.09Å; T1532-D1534 VanDerWaalsContact O-N 3.11Å; D1534-I1536 PolarHBondContact O-N 3.1Å
1535	C	22.5	Very low	25.2	Very low	114 Å²	114	142.6 Å²	142.6	77%	0.77	82%	0.824	S	S	*	*			trans	-83.4	88	165.2	-79.5	0	0	0	0	108.9
1536	I	22.1	Very low	25.2	Very low	156 Å²	156	139.2 Å²	139.2	80%	0.8	81%	0.811	S	S	*	*			trans	-174.1	105.4	140.8	-83.6	139.2	0	0	0	105.8	D1534	D1534-I1536 PolarHBondContact O-N 3.1Å
1537	T	23.9	Very low	25.1	Very low	133 Å²	133	140.1 Å²	140.1	82%	0.816	81%	0.809	S	S	*	*			trans	-162.9	114.4	135.8	18	0	0	0	0	108.6	V1539	T1537-V1539 PolarHBondContact O-N 2.74Å
1538	T	21.7	Very low	25.1	Very low	136 Å²	136	143.3 Å²	143.3	83%	0.834	81%	0.811	S	S	*	*			trans	-39.3	121.3	167.9	44.8	0	0	0	0	114
1539	V	25.3	Very low	24.9	Very low	143 Å²	143	142.1 Å²	142.1	87%	0.867	81%	0.809	S	S	*	*			trans	-137.2	121.1	143.7	-175.8	0	0	0	0	109.1	T1537	T1537-V1539 PolarHBondContact O-N 2.74Å
1540	S	23.3	Very low	24.6	Very low	98 Å²	98	139.7 Å²	139.7	69%	0.685	80%	0.804	S	S	*	*			trans	-70.3	143.7	-176.8	43.9	0	0	0	0	115
1541	N	24.4	Very low	24.5	Very low	168 Å²	168	136 Å²	136	90%	0.898	80%	0.798	S	S	*	*			trans	70.8	119	144.3	-71.4	-12.7	0	0	0	121.5
1542	G	25.6	Very low	24.6	Very low	88 Å²	88	138.6 Å²	138.6	91%	0.907	80%	0.797	S	S	*	*				126.5	93.1	128.2	0	0	0	0	0	116.7
1543	G	26.4	Very low	24.5	Very low	80 Å²	80	142.6 Å²	142.6	83%	0.825	81%	0.805	S	S	*	*			trans	-168.7	99.3	166.7	0	0	0	0	0	112.1
1544	S	27.2	Very low	24.6	Very low	104 Å²	104	141.1 Å²	141.1	73%	0.727	81%	0.806	S	S	*	*			trans	-77.7	134.4	-172.5	44.2	0	0	0	0	113.8
1545	N	27	Very low	24.5	Very low	146 Å²	146	138.4 Å²	138.4	78%	0.781	80%	0.8	S	S	*	*			trans	-78.5	124.2	172.9	-83.1	-28.8	0	0	0	111.3	F1547	N1545-F1547 HydrophobicContact CB-CE2 4.35Å
1546	H	24.7	Very low	24.7	Very low	132 Å²	132	140.6 Å²	140.6	61%	0.611	80%	0.804	S	S	*	*			trans	-91.5	115.4	173.3	-72.1	-62.2	0	0	0	111.2	I1572	H1546-I1572 VanDerWaalsContact CE1-CD1 3.48Å; H1546-I1572 WeakPolarHBondContact CE1-CD1 3.34Å
1547	F	24.6	Very low	24.8	Very low	189 Å²	189	139.6 Å²	139.6	83%	0.829	81%	0.81	S	S	*	*			trans	-92.6	129.9	173	-83.3	-93.1	0	0	0	111.2	N1545	N1545-F1547 HydrophobicContact CB-CE2 4.35Å
1548	Y	24.8	Very low	25	Very low	214 Å²	214	138 Å²	138	84%	0.839	80%	0.804	S	S	*	*			trans	-94.7	120.8	177.3	-76.8	-96.5	0	0	0	109.9
1549	V	22.4	Very low	25.3	Very low	132 Å²	132	139.2 Å²	139.2	80%	0.8	81%	0.805	S	S	*	*			trans	-122.2	99.6	170.7	-175.7	0	0	0	0	109.1
1550	P	24.3	Very low	25.4	Very low	119 Å²	119	136 Å²	136	77%	0.773	80%	0.8	S	S	*	*			trans	-88.9	104.5	170.7	18.4	-3.4	0	0	0	109.3
1551	S	23.7	Very low	25.6	Very low	97 Å²	97	140.6 Å²	140.6	68%	0.678	81%	0.808	S	S	*	*			trans	-94.8	115.7	167	90.9	0	0	0	0	108.9
1552	Y	26.7	Very low	25.7	Very low	231 Å²	231	141.3 Å²	141.3	91%	0.906	81%	0.811	S	S	*	*			trans	-143.3	123.8	163.7	-87	-77.3	0	0	0	112
1553	K	22.8	Very low	25.6	Very low	200 Å²	200	145.3 Å²	145.3	87%	0.87	81%	0.806	S	S	*	*			trans	-67.4	143.7	176.2	-81.6	177.8	172.5	176.1	0	110.9	S1555	K1553-S1555 PolarHBondContact O-N 3.17Å
1554	S	26.2	Very low	25.6	Very low	122 Å²	122	147.5 Å²	147.5	85%	0.853	81%	0.808	S	S	*	*			trans	-51.8	124.5	174.6	63.2	0	0	0	0	112.2
1555	S	25.8	Very low	25.4	Very low	104 Å²	104	145.8 Å²	145.8	73%	0.727	81%	0.807	S	S	*	*			trans	-144.5	132.9	156.5	57.4	0	0	0	0	110.1	K1553 C1557	K1553-S1555 PolarHBondContact O-N 3.17Å; S1555-C1557 PolarHBondContact O-N 3.06Å
1556	N	25.1	Very low	25.3	Very low	161 Å²	161	149.3 Å²	149.3	86%	0.861	81%	0.81	S	S	*	*			trans	-45.9	116.8	-179.1	-75.4	-31.5	0	0	0	112.6	S1558	N1556-S1558 PolarHBondContact O-N 3.26Å
1557	C	25.7	Very low	25.2	Very low	135 Å²	135	149.8 Å²	149.8	91%	0.912	82%	0.821	S	S	*	*			trans	-88.1	82.1	170.2	-70.3	0	0	0	0	110.5	S1555	S1555-C1557 PolarHBondContact O-N 3.06Å
1558	S	26.3	Very low	25.2	Very low	99 Å²	99	150.6 Å²	150.6	69%	0.692	82%	0.82	S	S	*	*			trans	-79.6	123.6	158.9	40.6	0	0	0	0	110	N1556	N1556-S1558 PolarHBondContact O-N 3.26Å
1559	N	29	Very low	25.1	Very low	162 Å²	162	152.2 Å²	152.2	87%	0.866	83%	0.825	S	S	*	*	S	Bend	trans	69.6	104.8	164.4	-65.9	-17.5	0	0	0	119.5
1560	G	27.6	Very low	25.1	Very low	74 Å²	74	153.9 Å²	153.9	76%	0.763	83%	0.829	S	S	*	*				72.1	108.7	117.1	0	0	0	0	0	119.3
1561	K	27	Very low	25.2	Very low	196 Å²	196	153.4 Å²	153.4	85%	0.852	83%	0.828	S	S	*	*			trans	76.3	91.1	160.6	-58.4	-176.8	178.7	-178.9	0	116.2
1562	L	25.8	Very low	25.5	Very low	183 Å²	183	154.8 Å²	154.8	96%	0.958	83%	0.827	S	S	*	*			trans	-103.2	114.3	161.4	-142.6	82.5	0	0	0	110.1
1563	H	24.9	Very low	25.7	Very low	171 Å²	171	150.7 Å²	150.7	79%	0.792	82%	0.821	S	S	*	*			trans	-64.1	143.5	171	-83.5	-93.7	0	0	0	111	G1565	H1563-G1565 PolarHBondContact O-N 3.01Å
1564	S	26.2	Very low	26.1	Very low	126 Å²	126	148.9 Å²	148.9	88%	0.881	82%	0.82	S	S	*	*			trans	-47.1	94.3	171.3	165.8	0	0	0	0	112.3
1565	G	23.5	Very low	26.2	Very low	69 Å²	69	151.1 Å²	151.1	71%	0.711	82%	0.822	S	S	*	*			trans	-84.4	114.3	176.5	0	0	0	0	0	111.7	H1563	H1563-G1565 PolarHBondContact O-N 3.01Å
1566	R	24	Very low	26.4	Very low	220 Å²	220	152.1 Å²	152.1	83%	0.83	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-60.2	136.1	173.7	-87.5	175.8	174.5	165	-2.3	111.8
1567	V	23.7	Very low	26.6	Very low	141 Å²	141	151 Å²	151	86%	0.855	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-70.2	119.1	173.8	179.6	0	0	0	0	109.6
1568	Y	23	Very low	26.9	Very low	206 Å²	206	151.2 Å²	151.2	81%	0.808	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-95.6	131.4	168.6	-76.1	-87.3	0	0	0	110.1
1569	R	23.4	Very low	27.1	Very low	248 Å²	248	152 Å²	152	94%	0.936	82%	0.817	S	S	*	*			trans	-98.8	107.5	-177.8	-168.2	179.9	-168	154.8	1.9	107.3
1570	L	23.6	Very low	27.6	Very low	167 Å²	167	150.4 Å²	150.4	87%	0.874	82%	0.816	S	S	*	*			trans	-113.9	131.6	173.9	-84.2	158.1	0	0	0	109
1571	S	25.8	Very low	27.7	Very low	110 Å²	110	153.2 Å²	153.2	77%	0.769	82%	0.818	S	S	*	*			trans	-83.1	151.1	-168.9	61	0	0	0	0	113.3	D1573	S1571-D1573 PolarHBondContact O-N 3.23Å
1572	I	29.7	Very low	27.6	Very low	126 Å²	126	148.9 Å²	148.9	65%	0.646	81%	0.812	S	S	*	*	S	Bend	trans	-86.6	89.9	-176.2	-71.1	159.3	0	0	0	109.1	H1546	H1546-I1572 VanDerWaalsContact CE1-CD1 3.48Å; H1546-I1572 WeakPolarHBondContact CE1-CD1 3.34Å
1573	D	30.4	Very low	27.7	Very low	145 Å²	145	148 Å²	148	78%	0.775	81%	0.807	S	S	*	*			trans	-134.4	2.3	164.9	-85.6	-40.6	0	0	0	114.5	S1571	S1571-D1573 PolarHBondContact O-N 3.23Å
1574	D	31.2	Very low	27.6	Very low	161 Å²	161	145.3 Å²	145.3	86%	0.861	80%	0.803	S	S	*	*	S	Bend	trans	-116.5	19.4	-173.7	-77.4	-28.9	0	0	0	115.9
1575	L	28.7	Very low	27.4	Very low	170 Å²	170	144.7 Å²	144.7	89%	0.89	79%	0.794	S	S	*	*			trans	-132.5	81.6	-177	-82.3	152.3	0	0	0	112.8
1576	V	30.6	Very low	27.5	Very low	124 Å²	124	147.5 Å²	147.5	75%	0.752	80%	0.798	S	S	*	*			trans	-130	130.6	168.5	170.6	0	0	0	0	109.8
1577	D	29.4	Very low	27.6	Very low	139 Å²	139	142.8 Å²	142.8	74%	0.743	79%	0.793	S	S	*	*			trans	70.8	101.1	157	-62.3	-19.5	0	0	0	121.8
1578	T	31.7	Very low	27.7	Very low	139 Å²	139	142.7 Å²	142.7	85%	0.853	79%	0.793	S	S	*	*				179.3	148.2	99.1	29.3	0	0	0	0	112.9
1579	P	30.4	Very low	27.8	Very low	115 Å²	115	138.2 Å²	138.2	75%	0.747	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-94.7	169.6	-164	4	18.5	0	0	0	114.7
1580	P	38.9	Very low	27.9	Very low	129 Å²	129	133 Å²	133	84%	0.838	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-94.3	126.6	-149.7	34.9	-31.8	0	0	0	113.5
1581	T	29.7	Very low	27.8	Very low	133 Å²	133	130.3 Å²	130.3	82%	0.816	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-88.9	124	162.2	35.1	0	0	0	0	110.2
1582	S	25.5	Very low	27.8	Very low	104 Å²	104	131.4 Å²	131.4	73%	0.727	78%	0.782	S	S	*	*			trans	-32.7	137	158.1	51.5	0	0	0	0	113.3
1583	I	26.7	Very low	27.5	Very low	164 Å²	164	135.6 Å²	135.6	84%	0.841	80%	0.796	S	S	*	*			trans	-162	130.9	135.8	-90.8	138.6	0	0	0	110.4
1584	T	23.3	Very low	27.3	Very low	115 Å²	115	136.2 Å²	136.2	71%	0.706	80%	0.799	S	S	*	*			trans	-52.3	142	168	8.3	0	0	0	0	114.6
1585	T	22.8	Very low	27	Very low	113 Å²	113	134.5 Å²	134.5	69%	0.693	79%	0.794	S	S	*	*			trans	32.6	115.8	141.1	55.6	0	0	0	0	118.5
1586	T	24	Very low	26.9	Very low	129 Å²	129	130.7 Å²	130.7	79%	0.791	79%	0.787	S	S	*	*				172.7	145.9	111.2	30.5	0	0	0	0	113.4
1587	T	26.7	Very low	26.7	Very low	121 Å²	121	131.8 Å²	131.8	74%	0.742	79%	0.789	S	S	*	*			trans	68.7	107	156.1	52.6	0	0	0	0	120	P1589	T1587-P1589 WeakPolarHBondContact O-CD 3.48Å
1588	T	25.7	Very low	26.6	Very low	139 Å²	139	130.5 Å²	130.5	85%	0.853	79%	0.786	S	S	*	*			trans	-40.6	127.2	151.7	44.1	0	0	0	0	113.8
1589	P	26.3	Very low	26.3	Very low	111 Å²	111	131.2 Å²	131.2	72%	0.721	78%	0.78	S	S	*	*			trans	-118	114.2	154.5	24.2	-4.7	0	0	0	110.2	T1587 C1591	T1587-P1589 WeakPolarHBondContact O-CD 3.48Å; P1589-C1591 PolarHBondContact O-N 3.1Å
1590	T	24.6	Very low	26.2	Very low	138 Å²	138	133.9 Å²	133.9	85%	0.847	79%	0.788	S	S	*	*			trans	-47.3	123.4	154.4	42.2	0	0	0	0	111.5
1591	C	21.9	Very low	25.6	Very low	111 Å²	111	135.2 Å²	135.2	75%	0.75	78%	0.782	S	S	*	*			trans	-132.9	92.4	162.7	-85.1	0	0	0	0	110.3	P1589	P1589-C1591 PolarHBondContact O-N 3.1Å
1592	T	25	Very low	25.3	Very low	134 Å²	134	135.3 Å²	135.3	82%	0.822	78%	0.782	S	S	*	*			trans	12	111.9	139.5	49.8	0	0	0	0	118.2	N1594	T1592-N1594 PolarHBondContact O-N 2.02Å
1593	F	23.9	Very low	25.3	Very low	214 Å²	214	140.9 Å²	140.9	94%	0.939	79%	0.787	S	S	*	*			trans	-71.2	114.3	163.6	-97.7	-97.4	0	0	0	109.9
1594	N	25.9	Very low	25.1	Very low	157 Å²	157	143.4 Å²	143.4	84%	0.84	79%	0.788	S	S	*	*			trans	-89.3	124.4	173.2	-139.5	-1	0	0	0	109.7	T1592	T1592-N1594 PolarHBondContact O-N 2.02Å
1595	T	25.9	Very low	25.3	Very low	126 Å²	126	143.4 Å²	143.4	77%	0.773	79%	0.793	S	S	*	*			trans	-75.1	126.4	-179.7	44.2	0	0	0	0	111.8
1596	A	25.6	Very low	25.4	Very low	89 Å²	89	146.7 Å²	146.7	74%	0.736	80%	0.8	S	S	*	*			trans	-173.5	122.7	144.3	0	0	0	0	0	111.5
1597	N	27.6	Very low	25.6	Very low	148 Å²	148	149.5 Å²	149.5	79%	0.791	81%	0.809	S	S	*	*			trans	124.4	68.8	154.7	-65	-8.7	0	0	0	116.5
1598	T	26.1	Very low	25.6	Very low	111 Å²	111	148.9 Å²	148.9	68%	0.681	81%	0.81	S	S	*	*				34.6	118.6	117.7	54.3	0	0	0	0	121
1599	H	25.2	Very low	25.5	Very low	155 Å²	155	147.2 Å²	147.2	72%	0.718	80%	0.804	S	S	*	*			trans	68.3	102.5	131.3	-70.5	-70.3	0	0	0	119.8
1600	N	29	Very low	25.6	Very low	171 Å²	171	146.9 Å²	146.9	91%	0.914	80%	0.804	S	S	*	*				-157.2	93.3	124	-94.8	-23.9	0	0	0	110.3
1601	H	25.5	Very low	25.9	Very low	157 Å²	157	147.3 Å²	147.3	73%	0.727	81%	0.806	S	S	*	*			trans	-86	113.6	172.4	-91.2	-75.9	0	0	0	109.6
1602	V	24.5	Very low	26	Very low	135 Å²	135	149.8 Å²	149.8	82%	0.818	81%	0.811	S	S	*	*			trans	-91.8	95.5	160.4	179.9	0	0	0	0	107
1603	R	25.1	Very low	27	Very low	220 Å²	220	148.2 Å²	148.2	83%	0.83	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-84.3	122.1	173.6	-90.2	-176.9	177.4	174.2	-0.2	109.4	S1605	R1603-S1605 PolarHBondContact O-N 3.34Å
1604	Y	22.8	Very low	27.3	Very low	217 Å²	217	145 Å²	145	85%	0.851	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-63.6	125.4	164.2	-87.8	-99.7	0	0	0	109.7	Q1606	Y1604-Q1606 PolarHBondContact O-N 2.62Å
1605	S	27.2	Very low	27.5	Very low	116 Å²	116	143.8 Å²	143.8	81%	0.811	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-64.6	120.3	179	37.2	0	0	0	0	111.2	R1603	R1603-S1605 PolarHBondContact O-N 3.34Å
1606	Q	26.1	Very low	27.7	Very low	182 Å²	182	144 Å²	144	85%	0.85	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-76.1	122.6	165.4	-67.9	-176.1	-35	0	0	108.3	Y1604 S1608	Y1604-Q1606 PolarHBondContact O-N 2.62Å; Q1606-S1608 PolarHBondContact O-N 2.95Å
1607	L	26.2	Very low	28	Very low	187 Å²	187	146.3 Å²	146.3	98%	0.979	79%	0.786	S	S	*	*			trans	-68.1	109.3	166.8	-93.5	138.9	0	0	0	108.4
1608	S	27.3	Very low	28.1	Very low	108 Å²	108	145.6 Å²	145.6	76%	0.755	78%	0.782	S	S	*	*			trans	-87.9	148.2	-171.8	43.5	0	0	0	0	113	Q1606	Q1606-S1608 PolarHBondContact O-N 2.95Å
1609	S	24.6	Very low	28.4	Very low	104 Å²	104	146.9 Å²	146.9	73%	0.727	79%	0.785	S	S	*	*			trans	-63.3	137.3	164.5	47.3	0	0	0	0	113.6
1610	S	28.8	Very low	28.6	Very low	105 Å²	105	146.4 Å²	146.4	73%	0.734	79%	0.787	S	S	*	*			trans	13.6	123.9	142	60.3	0	0	0	0	119.4
1611	V	29.2	Very low	28.6	Very low	146 Å²	146	143.8 Å²	143.8	89%	0.885	78%	0.778	S	S	*	*				-163	147.6	128.8	168.4	0	0	0	0	109.1
1612	L	25.2	Very low	28.9	Very low	163 Å²	163	142 Å²	142	85%	0.853	77%	0.774	S	S	*	*			trans	-50.5	167.5	-173.1	-74.9	158.5	0	0	0	119.7
1613	P	45.9	Very low	29.1	Very low	101 Å²	101	141.5 Å²	141.5	66%	0.656	77%	0.766	S	S	*	*			trans	-96.1	164.4	-158.9	39.9	-33.7	0	0	0	114.1
1614	N	30.1	Very low	29.6	Very low	146 Å²	146	138.4 Å²	138.4	78%	0.781	77%	0.766	S	S	*	*			trans	-177.7	106.8	153.1	-82.3	-18.2	0	0	0	104.3
1615	D	29.2	Very low	29.9	Very low	133 Å²	133	132.6 Å²	132.6	71%	0.711	76%	0.757	S	S	*	*				85.8	127.1	88.6	-80.5	-13.2	0	0	0	112
1616	D	30.1	Very low	30.3	Very low	130 Å²	130	134.9 Å²	134.9	70%	0.695	76%	0.76	S	S	*	*			trans	90.6	123.7	148.8	-57.9	-22.2	0	0	0	120.8
1617	D	31.5	Very low	30.4	Very low	138 Å²	138	130.5 Å²	130.5	74%	0.738	75%	0.75	S	S	*	*			trans	74.8	141.7	144.1	-51.8	-19.4	0	0	0	118.2
1618	D	29.6	Very low	30.8	Very low	133 Å²	133	129.4 Å²	129.4	71%	0.711	75%	0.745	S	S	*	*			cis	-175	170.2	-23.7	-116.9	-25.1	0	0	0	102.6
1619	D	32.8	Very low	30.9	Very low	138 Å²	138	128.5 Å²	128.5	74%	0.738	74%	0.738	S	S	*	*			trans	75.9	96.9	163.1	-52	-33.8	0	0	0	117.6
1620	D	29.1	Very low	31.4	Very low	144 Å²	144	131.8 Å²	131.8	77%	0.77	75%	0.748	S	S	*	*				88.4	138.3	66.9	-92.8	-21.9	0	0	0	114.6
1621	V	29.8	Very low	31.5	Very low	117 Å²	117	132.2 Å²	132.2	71%	0.709	75%	0.746	S	S	*	*			trans	79.8	126.3	147.4	162.9	0	0	0	0	116.1
1622	D	31.9	Very low	31.9	Very low	120 Å²	120	132.5 Å²	132.5	64%	0.642	74%	0.743	S	S	*	*			cis	-167.6	146.3	7.9	-117.1	-21.3	0	0	0	110.3
1623	N	29.3	Very low	33.1	Very low	123 Å²	123	129.3 Å²	129.3	66%	0.658	73%	0.732	S	S	*	*			trans	34.2	122.6	133.2	-68.9	-38	0	0	0	120.2
1624	D	35.3	Very low	32.5	Very low	156 Å²	156	131.8 Å²	131.8	83%	0.834	74%	0.739	S	S	*	*				-164.7	129.1	92.6	-107.1	-27.2	0	0	0	114.5
1625	S	29.5	Very low	32.5	Very low	94 Å²	94	131.7 Å²	131.7	66%	0.657	74%	0.744	S	S	*	*			trans	-66.4	143.5	175.3	41.3	0	0	0	0	114.3
1626	N	35.4	Very low	32.5	Very low	165 Å²	165	132.2 Å²	132.2	88%	0.882	75%	0.747	S	S	*	*			trans	-147.5	107	134.7	-138.9	-10.4	0	0	0	112.5
1627	S	28.7	Very low	32.4	Very low	90 Å²	90	130.7 Å²	130.7	63%	0.629	75%	0.747	S	S	*	*			trans	-68.5	142	172.2	48.9	0	0	0	0	112.2
1628	N	34.2	Very low	32.3	Very low	163 Å²	163	131 Å²	131	87%	0.872	75%	0.749	S	S	*	*			trans	-148.1	107.6	137	-111.8	-16.6	0	0	0	111.2
1629	S	29.2	Very low	32.3	Very low	89 Å²	89	131.8 Å²	131.8	62%	0.622	75%	0.753	S	S	*	*			trans	-64.7	137.5	171.7	48.2	0	0	0	0	112.4
1630	N	35.9	Very low	32.2	Very low	174 Å²	174	131.4 Å²	131.4	93%	0.93	76%	0.755	S	S	*	*			trans	-133.7	115.9	143.7	-95	-26.9	0	0	0	108.6
1631	T	30.1	Very low	32.1	Very low	113 Å²	113	130.4 Å²	130.4	69%	0.693	75%	0.754	S	S	*	*			trans	-80.3	136.4	-174.2	35.1	0	0	0	0	113.1
1632	D	36.8	Very low	32.1	Very low	152 Å²	152	133.8 Å²	133.8	81%	0.813	76%	0.762	S	S	*	*			trans	55.3	167.1	136.4	-86.4	-22.7	0	0	0	121.8
1633	P	50.6	Low	32	Very low	96 Å²	96	133.4 Å²	133.4	62%	0.623	77%	0.769	S	S	*	*			cis	-134.3	169.9	-26.5	32.1	-12.8	0	0	0	112.5
1634	D	34.1	Very low	31.9	Very low	153 Å²	153	138 Å²	138	82%	0.818	78%	0.779	S	S	*	*			trans	155.4	86.6	135.1	-82.4	-16.8	0	0	0	110.9	N1636	D1634-N1636 PolarHBondContact O-N 3.24Å
1635	T	28.9	Very low	31.6	Very low	144 Å²	144	135.7 Å²	135.7	88%	0.883	78%	0.781	S	S	*	*			trans	-70.4	112.1	159	26.5	0	0	0	0	108.4
1636	N	29.6	Very low	31.7	Very low	144 Å²	144	136.4 Å²	136.4	77%	0.77	78%	0.781	S	S	*	*			trans	-128.8	92.3	160.9	-136.8	-9.8	0	0	0	109.8	D1634 N1638	D1634-N1636 PolarHBondContact O-N 3.24Å; N1636-N1638 PolarHBondContact O-N 3.39Å
1637	S	28.4	Very low	31.8	Very low	98 Å²	98	138 Å²	138	69%	0.685	78%	0.784	S	S	*	*			trans	-64.7	109.2	172.4	49.7	0	0	0	0	110.8
1638	N	30	Very low	32	Very low	146 Å²	146	140.2 Å²	140.2	78%	0.781	79%	0.788	S	S	*	*			trans	-114.9	87.2	161.2	-84.3	-27.5	0	0	0	109	N1636 V1640	N1636-N1638 PolarHBondContact O-N 3.39Å; N1638-V1640 PolarHBondContact O-N 3.26Å
1639	N	29.8	Very low	31.8	Very low	149 Å²	149	139.9 Å²	139.9	80%	0.797	79%	0.787	S	S	*	*			trans	-66.2	104.8	164.2	-83.4	-23.4	0	0	0	109
1640	V	30.2	Very low	32.3	Very low	130 Å²	130	144.9 Å²	144.9	79%	0.788	82%	0.822	S	S	*	*			trans	-93.8	100.3	163	-179.8	0	0	0	0	107.3	N1638	N1638-V1640 PolarHBondContact O-N 3.26Å
1641	T	27.6	Very low	32.1	Very low	123 Å²	123	143.5 Å²	143.5	76%	0.755	82%	0.816	S	S	*	*			trans	-86.6	108	171.2	28.3	0	0	0	0	108	S1643	T1641-S1643 PolarHBondContact O-N 2.79Å
1642	E	28.9	Very low	32.2	Very low	188 Å²	188	145.1 Å²	145.1	88%	0.879	82%	0.823	S	S	*	*			trans	-82.8	100.9	167.1	-83.6	-177.5	163.7	0	0	108.6
1643	S	29.3	Very low	31.9	Very low	111 Å²	111	144.7 Å²	144.7	78%	0.776	82%	0.823	S	S	*	*			trans	-75	138.7	180	49.4	0	0	0	0	112.6	T1641	T1641-S1643 PolarHBondContact O-N 2.79Å
1644	Y	28	Very low	30.8	Very low	220 Å²	220	147.5 Å²	147.5	86%	0.863	84%	0.835	S	S	*	*			trans	-55.1	132.4	170.7	-74.1	-98.1	0	0	0	112.9	V1646	Y1644-V1646 PolarHBondContact O-N 3.07Å
1645	A	29.7	Very low	30.6	Very low	107 Å²	107	147.2 Å²	147.2	88%	0.884	84%	0.836	S	S	*	*			trans	-82	102.6	165.1	0	0	0	0	0	109
1646	V	30.5	Very low	30.7	Very low	109 Å²	109	147.4 Å²	147.4	66%	0.661	83%	0.833	S	S	*	*			trans	-103.1	113	161.6	175.3	0	0	0	0	105.4	Y1644	Y1644-V1646 PolarHBondContact O-N 3.07Å
1647	E	38.2	Very low	30.8	Very low	200 Å²	200	147.6 Å²	147.6	94%	0.935	84%	0.837	S	S	*	*			trans	-88.3	110.9	166.2	-85.1	-177.6	157.2	0	0	108.3
1648	D	32.9	Very low	31	Very low	135 Å²	135	151.5 Å²	151.5	72%	0.722	85%	0.849	S	S	*	*			trans	-83.8	141	175.8	-92.8	-39.4	0	0	0	112.1
1649	N	28.6	Very low	31.1	Very low	157 Å²	157	151.9 Å²	151.9	84%	0.84	86%	0.855	S	S	*	*			trans	17.7	113.5	149.9	-69.1	-34.2	0	0	0	120.7
1650	S	39.4	Very low	31.2	Very low	194 Å²	194	152.2 Å²	152.2	100%	1.357	86%	0.86	S	S	*	*				-157.1	0	126.7	66.6	0	0	0	0	110.7

Retrieved 1,650 of 1,650 residues in 2224.5 ms (Link to these results)

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