A0A5K4F1V6_SCHMA Loading...

Ras-GAP domain-containing protein

AlphaFold DB (A0A5K4F267), UniProt , Accession A0A5K4F1V6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,948 aa.

						>A0A5K4F1V6_SCHMA|A0A5K4F1V6
MSCLKDFPTRLESWLDVWDVDSIENCYSEWKYFAYNLPSPVWVKKFCIILENEQRFYIFNSKHDSSSLMSPPHIGLSTINDTAYHALQNIAYKVLSNDIDNYNSYHCFINSITDKDDDVKKCISKKYHTNNSLQRCLMNNSYEDLNNTMLYNPLYINITSNNNNNNNNNELINFDNKTLLKIQKFLFRMKNHFSHQTEHTQSHTNPAVLSSNRRTFNSFIGEDTINGNFMGSYTEEPIKQTLSSSPSISTKCIHLLNGKNISSDNISQNDMNYLRSIRKRQRNIKRQRSSKSFTHYSPQNLCRDNNYMSYHFDTFKRSLSYQQIKFNKNPNSTNSLLSSSSSVNLNENFEYSKNKSKQNSVFITESHVQQTSYNIFYFFLSCLSIEFYKIVLPFFSYYNPNRGISLQNCSATRNSLFPSTSSLQYTDFKYNNGKCNLSSTLVYSLAQPGKINVSTIHQSLTGGRPFCFVFTGPIVQMPSIEKNVCIEDKTLFTHIFATESWESRARWIKSLRRTAKPNLENEYHLENSLRLSILEARNIPPKRRYYCDICLDRTLYARTTSKTAASGIFWAEDFDLNNLPNVSVMTISLYREGGSNGRDSRRIGTSRISLKKNRKTQNQLIGYITIPVTEISSRTDIQTWLTLQPPIENSSSQDNLISSFDAIYTDSQQLDKLNSVKLNKLNSSSLNLLHNHSYNNGITDQTNFPQLRIRARYQSLGVLPLCNYWPLRTLVLNNSLLLTNWLESLLLSVKLKEELANSLVYLHENNNTLIEFLTSLVVREVSDLENESMAFRSNTIATKAVECYVKFVGSSYLHHLFHLLIQRVLTCFTPWEVDPEKLSSTQCTGGSLSATDTAAYALSPGNMLKNHRSIITGTLIGNQIMLLRYFDVVWRAIQSSLNYFPSVLIRLFSSFREALETIRGSEFCDNLISGCIFLRLICPALLSPSLFGLISAFPSEPACQRNLTLLAKSLQSLANFSTFDDKEPYMRFLNGYVSYQLSLMRMFIRSISPSSLNSHNNDMIHNAVTGSVTIDNEMLLLSPTNNSHPTKISTLVKTQNNVKDTIDENCELANLHLILSDVMFSDSPISATCNDDTLLSGTVNTATNSTTSTITNTVLFENNNNLMTVNPTCDTNLLSNSTTMLRKSSTAYLKTLNSNVMASLPNELCTLPKILDDISRALQCSSLTRCLNYDKSVYSVNSNDNNHNSNNDNSNNVNNHLIYTSTSRCQQSNTLISSSNNNIDNVDITDVHGSEQSINSIYAHHTNSQLTTPYYTLHYNPGFHNPLLMDNHKNSHRLLIPQLKQSTSLTGLPSDISRPNPNDYDEPYISNDESDYGINDTVNTNCLDDEIINKNKMKDNNDYSLQHQSSLSATKIMELKKCNYSENQKKYEQKSISLDKLNDLNNEHIYDTVPFSSSSSRSSSSSLTKISSRSQLSNFNQSTYNNYDHTLHNGTLNFSKHQSDKMNLLSVTDQSMIKSTSYKSMSLTNNRLTSSEMVPVNQTENNSSTNSLQNNNNINSISPRLFPKQVTTANVILTKPSVMCSSSDSAKISKVQRQFLSNNSSRENMFDRDVNEDKFVFGTSTNTVQSNLLQNYYHHHHYPSNLSNNYSKNNTYAYSKNTLSSASTEELHSQSDANSYNMMRIEEDNSSYSLANNTNITTTAADTSAENNNNNDNNNNNNQQPKELFSEVARLRYELLLSRQDALRAADRLSKQETEIYQLRQLLDKLINNNKTNTTINSNNNQSIHLKVPKSNNYFDYCTNLQGNELKSYDDKQLYSRKQSIPTTTNTTGVNCLQSSTNNTNNNHDANVLQTVSATFKELDDAMARLELEQSELLREQARIRARIVAARPKQLTSSCKQSDSNSLLSRSSKSAIRPRQFDSSLSKMPNNLVNHGLSSPNDHIKCTNSPRTINSNNMYTINNNHNNLQYEIVGDIPKIAFSSTRTSSPHI
					

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(Predicted Aligned Error values between residue pairs)

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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	23.6	Very low	26.9	Very low	204 Å²	204	129.2 Å²	129.2	100%	1.005	67%	0.672	S	S	*	*				0	-49.9	0	-91.2	-55	-176.4	0	0	113	C3	M1-C3 VanDerWaalsContact C-N 3.32Å; M1-C3 PolarHBondContact O-N 3.28Å
2	S	21.1	Very low	27	Very low	105 Å²	105	130 Å²	130	73%	0.734	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-59.9	-36.3	176.1	41.6	0	0	0	0	114.2	L4	S2-L4 PolarHBondContact O-N 3.14Å
3	C	27.1	Very low	27.2	Very low	109 Å²	109	125.5 Å²	125.5	74%	0.736	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-71.2	16	-175.7	-46	0	0	0	0	116.5	M1	M1-C3 VanDerWaalsContact C-N 3.32Å; M1-C3 PolarHBondContact O-N 3.28Å
4	L	26.2	Very low	27.2	Very low	122 Å²	122	130.9 Å²	130.9	64%	0.639	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-111.3	-4.1	-178.6	-81.2	169.2	0	0	0	114.3	S2	S2-L4 PolarHBondContact O-N 3.14Å
5	K	28.9	Very low	27.4	Very low	183 Å²	183	130 Å²	130	80%	0.796	66%	0.662	S	S	*	*	S	Bend	trans	-83	-21.4	178.8	-77.8	-164.4	169.7	-168.4	0	114.8	F7 P8	K5-F7 VanDerWaalsContact C-N 3.34Å; K5-F7 PolarHBondContact O-N 3.21Å; K5-P8 WeakPolarHBondContact O-CD 3.44Å
6	D	29	Very low	27.5	Very low	111 Å²	111	131.7 Å²	131.7	59%	0.594	67%	0.673	S	S	*	*	S	Bend	trans	-91	9.6	-174.8	-50.1	-39.1	0	0	0	114.1
7	F	27.4	Very low	27.9	Very low	147 Å²	147	129.6 Å²	129.6	65%	0.645	67%	0.667	S	S	*	*	S	Bend	trans	-81.7	-41.9	-176.7	-140.9	-92	0	0	0	114.2	K5 L11	K5-F7 VanDerWaalsContact C-N 3.34Å; K5-F7 PolarHBondContact O-N 3.21Å; F7-L11 HydrophobicContact CE1-CD1 4.28Å; F7-L11 PolarHBondContact O-N 3.2Å
8	P	25.8	Very low	27.9	Very low	85 Å²	85	131.6 Å²	131.6	55%	0.552	67%	0.665	S	S	*	*	H	α-helix	trans	-64.1	-48	-178.9	-23	34.6	0	0	0	113.2	K5 R10 L11 E12	K5-P8 WeakPolarHBondContact O-CD 3.44Å; P8-R10 VanDerWaalsContact C-N 3.26Å; P8-R10 PolarHBondContact O-N 3.28Å; P8-L11 WeakPolarHBondContact O-CB 2.89Å; P8-L11 PolarHBondContact O-N 3.45Å; P8-E12 PolarHBondContact O-N 3.39Å
9	T	29.1	Very low	28	Very low	94 Å²	94	129.8 Å²	129.8	58%	0.577	66%	0.658	S	S	*	*	H	α-helix	trans	-67.9	-22.6	-175.7	49.2	0	0	0	0	113.7
10	R	28.3	Very low	28	Very low	170 Å²	170	128.9 Å²	128.9	64%	0.642	66%	0.659	S	S	*	*	H	α-helix	trans	-76.7	-31.6	169.1	-91.7	-178.8	165.9	171.6	-2.8	112.9	P8 S13 W14	P8-R10 VanDerWaalsContact C-N 3.26Å; P8-R10 PolarHBondContact O-N 3.28Å; R10-S13 PolarHBondContact O-N 2.99Å; R10-S13 PolarHBondContact O-OG 3Å; R10-W14 PolarHBondContact O-N 2.93Å
11	L	29.1	Very low	28.1	Very low	91 Å²	91	129.7 Å²	129.7	48%	0.476	66%	0.664	S	S	.	*	H	α-helix	trans	-67.6	-43.5	-177.7	-141.5	86.5	0	0	0	111.8	F7 P8 S13 W14 L15	F7-L11 HydrophobicContact CE1-CD1 4.28Å; F7-L11 PolarHBondContact O-N 3.2Å; P8-L11 WeakPolarHBondContact O-CB 2.89Å; P8-L11 PolarHBondContact O-N 3.45Å; L11-S13 VanDerWaalsContact C-N 3.35Å; L11-S13 PolarHBondContact O-N 3.06Å; L11-W14 WeakPolarHBondContact O-CB 3.35Å; L11-W14 PolarHBondContact O-N 2.89Å; L11-L15 HydrophobicContact CD2-CD1 4.39Å; L11-L15 WeakPolarHBondContact O-CG 3.48Å; L11-L15 PolarHBondContact O-N 2.82Å; L11-L15 VanDerWaalsContact O-N 3.11Å
12	E	28.2	Very low	28.5	Very low	139 Å²	139	122 Å²	122	65%	0.65	63%	0.631	S	S	*	*	H	α-helix	trans	-58.6	-46.9	176.1	-65.8	178.4	143.8	0	0	110.7	P8 W14 L15	P8-E12 PolarHBondContact O-N 3.39Å; E12-W14 PolarHBondContact O-N 3.34Å; E12-L15 PolarHBondContact O-N 3.5Å; E12-L15 VanDerWaalsContact O-N 3.11Å
13	S	29.2	Very low	29	Very low	72 Å²	72	121.7 Å²	121.7	50%	0.503	62%	0.62	S	S	.	*	H	α-helix	trans	-63.5	-12.4	175.6	79.2	0	0	0	0	115.6	R10 L11	R10-S13 PolarHBondContact O-N 2.99Å; R10-S13 PolarHBondContact O-OG 3Å; L11-S13 VanDerWaalsContact C-N 3.35Å; L11-S13 PolarHBondContact O-N 3.06Å
14	W	28.3	Very low	29	Very low	200 Å²	200	124.3 Å²	124.3	76%	0.758	62%	0.621	S	S	*	*	H	α-helix	trans	-98.1	-24.4	176.1	-88.2	31.2	0	0	0	112.8	R10 L11 E12	R10-W14 PolarHBondContact O-N 2.93Å; L11-W14 WeakPolarHBondContact O-CB 3.35Å; L11-W14 PolarHBondContact O-N 2.89Å; E12-W14 PolarHBondContact O-N 3.34Å
15	L	29.6	Very low	29.3	Very low	118 Å²	118	124 Å²	124	62%	0.618	62%	0.62	S	S	*	*	H	α-helix	trans	-81.1	-32.3	-176.8	-74.6	165.3	0	0	0	113.1	L11 E12 V17	L11-L15 HydrophobicContact CD2-CD1 4.39Å; L11-L15 WeakPolarHBondContact O-CG 3.48Å; L11-L15 PolarHBondContact O-N 2.82Å; L11-L15 VanDerWaalsContact O-N 3.11Å; E12-L15 PolarHBondContact O-N 3.5Å; E12-L15 VanDerWaalsContact O-N 3.11Å; L15-V17 PolarHBondContact O-N 3.06Å
16	D	29.1	Very low	29.3	Very low	157 Å²	157	116.8 Å²	116.8	84%	0.84	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	-0.8	178.9	-84.1	-13.1	0	0	0	115.7
17	V	34.1	Very low	29.4	Very low	96 Å²	96	120 Å²	120	58%	0.582	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.6	-19.4	-169.2	-172.7	0	0	0	0	113.5	L15	L15-V17 PolarHBondContact O-N 3.06Å
18	W	27.4	Very low	29.5	Very low	166 Å²	166	116.7 Å²	116.7	63%	0.629	59%	0.592	S	S	*	*			trans	-117.8	132	-167.8	-72.2	-5.1	0	0	0	114.7	C26	W18-C26 HydrophobicContact CZ3-CB 4.46Å; W18-C26 WeakPolarHBondContact CZ3-SG 3.28Å
19	D	29.7	Very low	29.8	Very low	98 Å²	98	118.4 Å²	118.4	52%	0.524	59%	0.593	S	S	.	*			trans	-67.4	144.9	170	-106.8	-44	0	0	0	110.6	D21 S22 R868	D19-D21 VanDerWaalsContact C-N 3.28Å; D19-D21 PolarHBondContact O-N 2.74Å; D19-D21 VanDerWaalsContact O-N 3.13Å; D19-S22 VanDerWaalsContact O-CB 3.26Å; D19-S22 WeakPolarHBondContact O-CB 3.35Å; D19-S22 PolarHBondContact O-N 3.11Å; D19-S22 PolarHBondContact O-OG 3.04Å; D19-R868 IonicContact OD2-CZ 3.3Å; D19-R868 IonicContact OD2-NH2 2.84Å; D19-R868 PolarHBondContact OD2-NH2 3.43Å
20	V	29.6	Very low	30	Very low	111 Å²	111	122 Å²	122	67%	0.673	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-54.7	-37.2	-168	178.7	0	0	0	0	113.6	S22 I23	V20-S22 PolarHBondContact O-N 3.04Å; V20-I23 WeakPolarHBondContact O-CB 3.26Å; V20-I23 WeakPolarHBondContact O-CG1 3.37Å; V20-I23 PolarHBondContact O-N 2.91Å; V20-I23 VanDerWaalsContact O-N 3.08Å
21	D	30.4	Very low	30	Very low	145 Å²	145	121 Å²	121	78%	0.775	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-61.5	-13.4	179.1	-59.1	-26	0	0	0	113.9	D19 I23	D19-D21 VanDerWaalsContact C-N 3.28Å; D19-D21 PolarHBondContact O-N 2.74Å; D19-D21 VanDerWaalsContact O-N 3.13Å; D21-I23 VanDerWaalsContact C-N 3.32Å
22	S	31.6	Very low	30.2	Very low	43 Å²	43	125.2 Å²	125.2	30%	0.301	61%	0.607	S	S	.	*	G	3₁₀ helix	trans	-75.3	-21.8	177	-46.8	0	0	0	0	112.8	D19 V20 N25 C26	D19-S22 VanDerWaalsContact O-CB 3.26Å; D19-S22 WeakPolarHBondContact O-CB 3.35Å; D19-S22 PolarHBondContact O-N 3.11Å; D19-S22 PolarHBondContact O-OG 3.04Å; V20-S22 PolarHBondContact O-N 3.04Å; S22-N25 PolarHBondContact O-N 2.81Å; S22-C26 PolarHBondContact O-N 3.47Å
23	I	30.8	Very low	30.4	Very low	99 Å²	99	124.7 Å²	124.7	51%	0.508	60%	0.603	S	S	.	*	H	α-helix	trans	-72.1	-36.3	-166.1	-62.4	174.3	0	0	0	112.2	V20 D21 N25 C26 Y27	V20-I23 WeakPolarHBondContact O-CB 3.26Å; V20-I23 WeakPolarHBondContact O-CG1 3.37Å; V20-I23 PolarHBondContact O-N 2.91Å; V20-I23 VanDerWaalsContact O-N 3.08Å; D21-I23 VanDerWaalsContact C-N 3.32Å; I23-N25 PolarHBondContact O-N 3.12Å; I23-C26 PolarHBondContact O-N 3.19Å; I23-Y27 PolarHBondContact O-N 3.34Å
24	E	28	Very low	30.5	Very low	164 Å²	164	123.9 Å²	123.9	77%	0.766	60%	0.601	S	S	*	*	H	α-helix	trans	-65.5	-36.7	178.2	-66.2	-158.7	129.3	0	0	113.1	Y27 S28	E24-Y27 PolarHBondContact O-N 3.39Å; E24-S28 PolarHBondContact O-N 3.5Å; E24-S28 PolarHBondContact O-OG 2.88Å; E24-S28 VanDerWaalsContact O-OG 3.14Å
25	N	31	Very low	30.7	Very low	116 Å²	116	124 Å²	124	62%	0.62	60%	0.602	S	S	*	*	H	α-helix	trans	-64.8	-44.7	173.5	-79.9	-58.2	0	0	0	110.6	S22 I23 Y27 S28 E29	S22-N25 PolarHBondContact O-N 2.81Å; I23-N25 PolarHBondContact O-N 3.12Å; N25-Y27 VanDerWaalsContact C-N 3.32Å; N25-Y27 PolarHBondContact O-N 3.48Å; N25-S28 WeakPolarHBondContact O-CA 3.49Å; N25-S28 VanDerWaalsContact O-CB 3.31Å; N25-S28 WeakPolarHBondContact O-CB 3.45Å; N25-S28 PolarHBondContact O-N 3.25Å; N25-S28 VanDerWaalsContact O-N 3.07Å; N25-E29 PolarHBondContact O-N 2.87Å
26	C	29.1	Very low	30.7	Very low	30 Å²	30	123.9 Å²	123.9	20%	0.203	60%	0.603	C	S	.	*	H	α-helix	trans	-68.8	-27.7	178	-69.7	0	0	0	0	113.6	W18 S22 I23 S28 E29 W30	W18-C26 HydrophobicContact CZ3-CB 4.46Å; W18-C26 WeakPolarHBondContact CZ3-SG 3.28Å; S22-C26 PolarHBondContact O-N 3.47Å; I23-C26 PolarHBondContact O-N 3.19Å; C26-S28 VanDerWaalsContact C-N 3.28Å; C26-S28 PolarHBondContact O-N 3.13Å; C26-E29 PolarHBondContact O-N 2.86Å; C26-W30 WeakPolarHBondContact O-CB 3.42Å; C26-W30 PolarHBondContact O-N 2.88Å
27	Y	31.3	Very low	30.8	Very low	179 Å²	179	120.6 Å²	120.6	70%	0.702	58%	0.584	S	S	*	*	H	α-helix	trans	-65.1	-35.3	169.8	-146.2	-84.9	0	0	0	111.6	I23 E24 N25 K31	I23-Y27 PolarHBondContact O-N 3.34Å; E24-Y27 PolarHBondContact O-N 3.39Å; N25-Y27 VanDerWaalsContact C-N 3.32Å; N25-Y27 PolarHBondContact O-N 3.48Å; Y27-K31 PolarHBondContact O-N 2.79Å
28	S	30.6	Very low	30.5	Very low	77 Å²	77	122.3 Å²	122.3	54%	0.538	60%	0.597	S	S	.	*	H	α-helix	trans	-70.7	-40.2	173.8	-58	0	0	0	0	112.3	E24 N25 C26 K31 Y32	E24-S28 PolarHBondContact O-N 3.5Å; E24-S28 PolarHBondContact O-OG 2.88Å; E24-S28 VanDerWaalsContact O-OG 3.14Å; N25-S28 WeakPolarHBondContact O-CA 3.49Å; N25-S28 VanDerWaalsContact O-CB 3.31Å; N25-S28 WeakPolarHBondContact O-CB 3.45Å; N25-S28 PolarHBondContact O-N 3.25Å; N25-S28 VanDerWaalsContact O-N 3.07Å; C26-S28 VanDerWaalsContact C-N 3.28Å; C26-S28 PolarHBondContact O-N 3.13Å; S28-K31 PolarHBondContact O-N 3.01Å; S28-Y32 PolarHBondContact O-N 3.08Å
29	E	32.4	Very low	30.8	Very low	122 Å²	122	116.5 Å²	116.5	57%	0.57	58%	0.583	S	S	*	*	H	α-helix	trans	-66.2	-41.9	173.8	-68.6	-170.1	136.1	0	0	112.5	N25 C26 K31 Y32 F33	N25-E29 PolarHBondContact O-N 2.87Å; C26-E29 PolarHBondContact O-N 2.86Å; E29-K31 VanDerWaalsContact C-N 3.29Å; E29-K31 PolarHBondContact O-N 2.88Å; E29-Y32 CarbonylContact O-C 3.45Å; E29-Y32 WeakPolarHBondContact O-CA 3.45Å; E29-Y32 VanDerWaalsContact O-CB 3.27Å; E29-Y32 WeakPolarHBondContact O-CB 3.17Å; E29-Y32 PolarHBondContact O-N 3.33Å; E29-F33 PolarHBondContact O-N 2.82Å
30	W	31.3	Very low	30.8	Very low	168 Å²	168	117.2 Å²	117.2	64%	0.636	59%	0.592	S	S	*	*	H	α-helix	trans	-60	-39.3	175.5	-107.6	78.5	0	0	0	112.2	C26 Y32 F33 A34	C26-W30 WeakPolarHBondContact O-CB 3.42Å; C26-W30 PolarHBondContact O-N 2.88Å; W30-Y32 PolarHBondContact O-N 3.01Å; W30-F33 WeakPolarHBondContact O-CB 3.28Å; W30-F33 PolarHBondContact O-N 3.21Å; W30-F33 VanDerWaalsContact O-N 3.13Å; W30-A34 PolarHBondContact O-N 3.31Å
31	K	28.8	Very low	31	Very low	150 Å²	150	116.8 Å²	116.8	65%	0.652	59%	0.59	S	S	*	*	H	α-helix	trans	-63	-30.6	174.1	-153.1	166.3	-170	168	0	111.9	Y27 S28 E29 Y35	Y27-K31 PolarHBondContact O-N 2.79Å; S28-K31 PolarHBondContact O-N 3.01Å; E29-K31 VanDerWaalsContact C-N 3.29Å; E29-K31 PolarHBondContact O-N 2.88Å; K31-Y35 WeakPolarHBondContact O-CD2 3.17Å
32	Y	33.3	Very low	31.1	Very low	179 Å²	179	118.2 Å²	118.2	70%	0.702	59%	0.585	S	S	*	*	H	α-helix	trans	-76.1	-35.4	172	-128.9	-85.4	0	0	0	112.9	S28 E29 W30 Y35 N36	S28-Y32 PolarHBondContact O-N 3.08Å; E29-Y32 CarbonylContact O-C 3.45Å; E29-Y32 WeakPolarHBondContact O-CA 3.45Å; E29-Y32 VanDerWaalsContact O-CB 3.27Å; E29-Y32 WeakPolarHBondContact O-CB 3.17Å; E29-Y32 PolarHBondContact O-N 3.33Å; W30-Y32 PolarHBondContact O-N 3.01Å; Y32-Y35 PolarHBondContact O-N 3.08Å; Y32-N36 PolarHBondContact O-ND2 3.28Å
33	F	32.1	Very low	31.1	Very low	129 Å²	129	119.4 Å²	119.4	57%	0.566	59%	0.59	S	S	*	*	H	α-helix	trans	-65.3	-44.8	177.6	-162.1	-96.5	0	0	0	111.7	E29 W30 Y35 N36	E29-F33 PolarHBondContact O-N 2.82Å; W30-F33 WeakPolarHBondContact O-CB 3.28Å; W30-F33 PolarHBondContact O-N 3.21Å; W30-F33 VanDerWaalsContact O-N 3.13Å; F33-Y35 PolarHBondContact O-N 3.44Å; F33-N36 PolarHBondContact O-N 3.29Å
34	A	31.1	Very low	31	Very low	55 Å²	55	122.5 Å²	122.5	46%	0.455	60%	0.6	S	S	.	*	H	α-helix	trans	-59.8	-29.3	178.7	0	0	0	0	0	114	W30	W30-A34 PolarHBondContact O-N 3.31Å
35	Y	33	Very low	31	Very low	201 Å²	201	122.4 Å²	122.4	79%	0.788	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-9.1	-178.4	-99	-87.8	0	0	0	115	K31 Y32 F33	K31-Y35 WeakPolarHBondContact O-CD2 3.17Å; Y32-Y35 PolarHBondContact O-N 3.08Å; F33-Y35 PolarHBondContact O-N 3.44Å
36	N	29.7	Very low	30.9	Very low	117 Å²	117	121.7 Å²	121.7	63%	0.626	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.9	8.7	-171.6	-72.8	-75.9	0	0	0	114.7	Y32 F33	Y32-N36 PolarHBondContact O-ND2 3.28Å; F33-N36 PolarHBondContact O-N 3.29Å
37	L	30.8	Very low	30.8	Very low	87 Å²	87	123 Å²	123	46%	0.455	60%	0.597	S	S	.	*			trans	-80.7	123.8	176.4	-77.3	166.7	0	0	0	111.9	S39	L37-S39 PolarHBondContact O-N 2.9Å
38	P	28.3	Very low	30.6	Very low	132 Å²	132	119.7 Å²	119.7	86%	0.857	59%	0.59	S	S	*	*	S	Bend	trans	-82	49.2	-172.1	34.5	-37.6	0	0	0	114.2
39	S	34	Very low	30.6	Very low	45 Å²	45	121.6 Å²	121.6	32%	0.315	59%	0.593	S	S	.	*			trans	-161.7	123.5	166.4	-176.6	0	0	0	0	113.4	L37 V41 W42	L37-S39 PolarHBondContact O-N 2.9Å; S39-V41 PolarHBondContact O-N 3.39Å; S39-V41 VanDerWaalsContact O-N 3.13Å; S39-V41 PolarHBondContact OG-N 2.85Å; S39-W42 PolarHBondContact O-N 2.89Å
40	P	30.5	Very low	30.4	Very low	113 Å²	113	121.4 Å²	121.4	73%	0.734	60%	0.595	S	S	*	*	H	α-helix	trans	-62.6	-16.7	173.2	-23.1	34.2	0	0	0	114.7
41	V	33.4	Very low	30.2	Very low	102 Å²	102	120.8 Å²	120.8	62%	0.618	60%	0.599	S	S	*	*	H	α-helix	trans	-75.9	-33.2	-175.3	-175.4	0	0	0	0	111.8	S39	S39-V41 PolarHBondContact O-N 3.39Å; S39-V41 VanDerWaalsContact O-N 3.13Å; S39-V41 PolarHBondContact OG-N 2.85Å
42	W	31.5	Very low	30.2	Very low	175 Å²	175	120 Å²	120	66%	0.663	60%	0.602	S	S	*	*	H	α-helix	trans	-71.9	-44.3	178.8	-93.2	60.9	0	0	0	112.1	S39 K44 K45 F46	S39-W42 PolarHBondContact O-N 2.89Å; W42-K44 VanDerWaalsContact C-N 3.3Å; W42-K44 PolarHBondContact O-N 2.85Å; W42-K45 PolarHBondContact O-N 2.95Å; W42-F46 PolarHBondContact O-N 2.83Å
43	V	32.1	Very low	29.9	Very low	67 Å²	67	120.1 Å²	120.1	41%	0.406	61%	0.61	S	S	.	*	H	α-helix	trans	-55.3	-45.9	-179.8	-177.2	0	0	0	0	111	K45 F46 C47	V43-K45 VanDerWaalsContact C-N 3.34Å; V43-K45 PolarHBondContact O-N 3.07Å; V43-F46 PolarHBondContact O-N 2.89Å; V43-C47 PolarHBondContact O-N 3.01Å; V43-C47 PolarHBondContact O-SG 2.99Å; V43-C47 VanDerWaalsContact O-SG 3.37Å
44	K	28.3	Very low	29.5	Very low	165 Å²	165	121.8 Å²	121.8	72%	0.717	62%	0.619	S	S	*	*	H	α-helix	trans	-63.5	-31	177.5	-87.2	-162.9	170.5	-167.5	0	114.7	W42 I48	W42-K44 VanDerWaalsContact C-N 3.3Å; W42-K44 PolarHBondContact O-N 2.85Å; K44-I48 VanDerWaalsContact O-CD1 3.25Å; K44-I48 WeakPolarHBondContact O-CD1 3.48Å; K44-I48 WeakPolarHBondContact O-CG1 3.23Å
45	K	29	Very low	29.2	Very low	161 Å²	161	129.5 Å²	129.5	70%	0.7	64%	0.636	S	S	*	*	H	α-helix	trans	-83.6	-22.8	175.6	-78.4	-161.1	171.7	-168.3	0	113.4	W42 V43	W42-K45 PolarHBondContact O-N 2.95Å; V43-K45 VanDerWaalsContact C-N 3.34Å; V43-K45 PolarHBondContact O-N 3.07Å
46	F	28.4	Very low	28.8	Very low	102 Å²	102	129.4 Å²	129.4	45%	0.447	64%	0.64	S	S	.	*	H	α-helix	trans	-87.9	-36.8	179.4	-135.3	-88.9	0	0	0	113.2	W42 V43 I48 I49 L50	W42-F46 PolarHBondContact O-N 2.83Å; V43-F46 PolarHBondContact O-N 2.89Å; F46-I48 VanDerWaalsContact C-N 3.35Å; F46-I48 PolarHBondContact O-N 2.78Å; F46-I49 PolarHBondContact O-N 2.79Å; F46-L50 HydrophobicContact CD1-CD1 4.06Å; F46-L50 HydrophobicContact CE1-CD1 4.37Å; F46-L50 PolarHBondContact O-N 2.85Å
47	C	26	Very low	28.4	Very low	57 Å²	57	134 Å²	134	39%	0.385	65%	0.65	S	S	.	*	H	α-helix	trans	-62.8	-38.4	177.1	-68.7	0	0	0	0	112.8	V43 I49 L50 E51	V43-C47 PolarHBondContact O-N 3.01Å; V43-C47 PolarHBondContact O-SG 2.99Å; V43-C47 VanDerWaalsContact O-SG 3.37Å; C47-I49 PolarHBondContact O-N 3.13Å; C47-I49 VanDerWaalsContact O-N 3.11Å; C47-L50 PolarHBondContact O-N 2.98Å; C47-E51 PolarHBondContact O-N 3.12Å
48	I	29.1	Very low	28.2	Very low	109 Å²	109	137 Å²	137	56%	0.559	67%	0.665	S	S	*	*	H	α-helix	trans	-60.7	-22.6	177.5	-67.1	173.7	0	0	0	112.6	K44 F46 N52	K44-I48 VanDerWaalsContact O-CD1 3.25Å; K44-I48 WeakPolarHBondContact O-CD1 3.48Å; K44-I48 WeakPolarHBondContact O-CG1 3.23Å; F46-I48 VanDerWaalsContact C-N 3.35Å; F46-I48 PolarHBondContact O-N 2.78Å; I48-N52 PolarHBondContact O-ND2 2.87Å; I48-N52 VanDerWaalsContact O-ND2 3.07Å
49	I	30.2	Very low	27.9	Very low	118 Å²	118	138.6 Å²	138.6	61%	0.605	66%	0.659	S	S	*	*	H	α-helix	trans	-84.3	-29.1	176.3	-61.8	173.4	0	0	0	111.3	F46 C47	F46-I49 PolarHBondContact O-N 2.79Å; C47-I49 PolarHBondContact O-N 3.13Å; C47-I49 VanDerWaalsContact O-N 3.11Å
50	L	26.8	Very low	27.4	Very low	118 Å²	118	143.9 Å²	143.9	62%	0.618	68%	0.684	S	S	*	*	H	α-helix	trans	-94.7	-13.2	-177.1	-74	167.3	0	0	0	114.6	F46 C47 N52	F46-L50 HydrophobicContact CD1-CD1 4.06Å; F46-L50 HydrophobicContact CE1-CD1 4.37Å; F46-L50 PolarHBondContact O-N 2.85Å; C47-L50 PolarHBondContact O-N 2.98Å; L50-N52 VanDerWaalsContact C-N 3.33Å
51	E	27.7	Very low	26.9	Very low	154 Å²	154	142.7 Å²	142.7	72%	0.72	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-6	176.4	-73.1	178.3	142.8	0	0	113.9	C47	C47-E51 PolarHBondContact O-N 3.12Å
52	N	29.4	Very low	26.4	Very low	133 Å²	133	146.5 Å²	146.5	71%	0.711	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	-2.3	-174.7	-81.6	-59.5	0	0	0	115.9	I48 L50	I48-N52 PolarHBondContact O-ND2 2.87Å; I48-N52 VanDerWaalsContact O-ND2 3.07Å; L50-N52 VanDerWaalsContact C-N 3.33Å
53	E	27.1	Very low	26.1	Very low	183 Å²	183	145.4 Å²	145.4	86%	0.855	69%	0.689	S	S	*	*			trans	-115.9	86.6	174	-71.4	-167	168.7	0	0	111.8
54	Q	24.2	Very low	25.7	Very low	163 Å²	163	149 Å²	149	76%	0.762	71%	0.705	S	S	*	*			trans	-123.8	131.1	158.9	-78.5	-154.5	10.5	0	0	111.1
55	R	24.4	Very low	25.4	Very low	218 Å²	218	145.8 Å²	145.8	82%	0.823	70%	0.704	S	S	*	*			trans	68	104.8	168.9	-52.8	174.8	-174.2	-156	-1.1	116.1
56	F	25.1	Very low	25	Very low	198 Å²	198	142.8 Å²	142.8	87%	0.868	70%	0.703	S	S	*	*				-143.8	121.9	99.8	-105.6	-77.3	0	0	0	110.3
57	Y	21	Very low	24.7	Very low	214 Å²	214	142.7 Å²	142.7	84%	0.839	72%	0.715	S	S	*	*			trans	-121.7	122.8	169.9	-106.8	-83.8	0	0	0	106.6
58	I	25.3	Very low	24.6	Very low	150 Å²	150	147.1 Å²	147.1	77%	0.769	73%	0.734	S	S	*	*			trans	-135.9	130.7	159.3	-64.9	-173.3	0	0	0	107.9
59	F	21.7	Very low	24.4	Very low	166 Å²	166	150.1 Å²	150.1	73%	0.728	75%	0.748	S	S	*	*			trans	-64.2	156.6	174.7	-88.5	-118.4	0	0	0	110.6
60	N	23.9	Very low	24.1	Very low	155 Å²	155	149.6 Å²	149.6	83%	0.829	75%	0.754	S	S	*	*				-170	176	72.5	-118.9	-33.4	0	0	0	115.5
61	S	21.3	Very low	24.6	Very low	89 Å²	89	149.3 Å²	149.3	62%	0.622	76%	0.76	S	S	*	*			trans	-116.6	141.1	-166.1	63	0	0	0	0	115.1
62	K	22.2	Very low	24.5	Very low	181 Å²	181	147.7 Å²	147.7	79%	0.787	76%	0.763	S	S	*	*			trans	64.1	154.9	153.5	-66	-175.8	173.2	-175.8	0	119.9
63	H	24.5	Very low	24.2	Very low	153 Å²	153	149.7 Å²	149.7	71%	0.708	77%	0.767	S	S	*	*			trans	66.2	144.4	169.3	-63	-73.8	0	0	0	114.9
64	D	24.3	Very low	24.1	Very low	141 Å²	141	149.2 Å²	149.2	75%	0.754	77%	0.769	S	S	*	*			cis	-149.5	-164.1	-8.2	-116.2	-17.2	0	0	0	112.1
65	S	22	Very low	24.2	Very low	99 Å²	99	144.7 Å²	144.7	69%	0.692	77%	0.766	S	S	*	*			trans	-69.5	145.8	-165.4	55.7	0	0	0	0	118.8
66	S	21.4	Very low	24.1	Very low	97 Å²	97	143 Å²	143	68%	0.678	77%	0.772	S	S	*	*			trans	69.5	114	135.9	63.5	0	0	0	0	123.2
67	S	22.2	Very low	24.1	Very low	100 Å²	100	138.3 Å²	138.3	70%	0.699	76%	0.764	S	S	*	*				93.7	143.8	123.1	77.1	0	0	0	0	122.4
68	L	22.8	Very low	24.3	Very low	151 Å²	151	134.3 Å²	134.3	79%	0.791	76%	0.762	S	S	*	*			trans	55.5	113.1	150.5	-72.1	160.9	0	0	0	117.7
69	M	25.3	Very low	24.5	Very low	172 Å²	172	135 Å²	135	85%	0.847	77%	0.765	S	S	*	*			cis	-159.9	-174.7	48.1	-78.5	-139.1	72.8	0	0	113.1
70	S	23.6	Very low	24.8	Very low	106 Å²	106	133.2 Å²	133.2	74%	0.741	76%	0.763	S	S	*	*			trans	-123.9	-168.5	-176.1	65.4	0	0	0	0	112
71	P	37.5	Very low	24.9	Very low	112 Å²	112	131.7 Å²	131.7	73%	0.727	76%	0.755	S	S	*	*				-118	-172.9	-111.5	38.5	-21	0	0	0	114.2
72	P	25.8	Very low	25.3	Very low	121 Å²	121	132.9 Å²	132.9	79%	0.786	76%	0.759	S	S	*	*			trans	-135.6	155.5	133.2	37.6	-27.1	0	0	0	116.1
73	H	22.8	Very low	25.6	Very low	175 Å²	175	127.9 Å²	127.9	81%	0.81	75%	0.752	S	S	*	*			trans	-40.4	145.1	173.9	-63.5	-110.6	0	0	0	117.6
74	I	25.8	Very low	25.8	Very low	173 Å²	173	129.4 Å²	129.4	89%	0.887	75%	0.753	S	S	*	*				179.6	145.5	105.9	-90.9	158.4	0	0	0	110.7
75	G	25	Very low	26	Very low	67 Å²	67	128 Å²	128	69%	0.691	74%	0.741	S	S	*	*			trans	88.5	92.4	151.9	0	0	0	0	0	118.8
76	L	22.7	Very low	26.4	Very low	182 Å²	182	126 Å²	126	95%	0.953	73%	0.731	S	S	*	*			trans	-85.4	117.4	151.4	-84.3	80.8	0	0	0	109.4
77	S	24	Very low	26.7	Very low	101 Å²	101	127.6 Å²	127.6	71%	0.706	73%	0.731	S	S	*	*			trans	-169.5	141.9	151.2	52.5	0	0	0	0	112.3
78	T	25.8	Very low	27.1	Very low	129 Å²	129	127.4 Å²	127.4	79%	0.791	72%	0.719	S	S	*	*			trans	49.8	103.5	155.8	55.4	0	0	0	0	119
79	I	30.6	Very low	27.4	Very low	164 Å²	164	125 Å²	125	84%	0.841	71%	0.707	S	S	*	*				-157.5	129.3	111.9	-95	149.6	0	0	0	107.5
80	N	27.4	Very low	27.6	Very low	129 Å²	129	122.3 Å²	122.3	69%	0.69	70%	0.695	S	S	*	*			trans	-148.3	-179.5	-173	-131.3	28.3	0	0	0	110	T82	N80-T82 PolarHBondContact O-N 2.87Å
81	D	25.9	Very low	27.7	Very low	123 Å²	123	119.9 Å²	119.9	66%	0.658	68%	0.682	S	S	*	*	S	Bend	trans	69.2	18.2	155.3	-50.1	-29.9	0	0	0	120.9
82	T	29	Very low	27.2	Very low	114 Å²	114	122.6 Å²	122.6	70%	0.699	68%	0.678	S	S	*	*	S	Bend	trans	-114.9	-42.1	169.9	44.5	0	0	0	0	115.3	N80 Y84	N80-T82 PolarHBondContact O-N 2.87Å; T82-Y84 PolarHBondContact O-N 2.84Å
83	A	28.7	Very low	27.2	Very low	77 Å²	77	125.1 Å²	125.1	64%	0.636	68%	0.677	S	S	*	*	H	α-helix	trans	-67	-38	-177.4	0	0	0	0	0	113.7	A86	A83-A86 PolarHBondContact O-N 2.96Å
84	Y	28.7	Very low	27.6	Very low	185 Å²	185	122.6 Å²	122.6	73%	0.725	67%	0.673	S	S	*	*	H	α-helix	trans	-68.7	-38.8	-177.5	-152	-103.6	0	0	0	112.1	T82 A86 L87 Q88	T82-Y84 PolarHBondContact O-N 2.84Å; Y84-A86 VanDerWaalsContact C-N 3.32Å; Y84-A86 PolarHBondContact O-N 2.74Å; Y84-L87 PolarHBondContact O-N 3.27Å; Y84-Q88 PolarHBondContact O-N 2.82Å
85	H	28.9	Very low	27.6	Very low	110 Å²	110	121.5 Å²	121.5	51%	0.509	67%	0.669	S	S	.	*	H	α-helix	trans	-68.1	-26.4	179.1	-98.3	-57.8	0	0	0	113.8	N89	H85-N89 WeakPolarHBondContact O-CB 3.24Å; H85-N89 PolarHBondContact O-N 2.98Å; H85-N89 VanDerWaalsContact O-N 3.13Å; H85-N89 PolarHBondContact O-ND2 2.64Å
86	A	29.9	Very low	27.6	Very low	58 Å²	58	121.4 Å²	121.4	48%	0.479	66%	0.658	S	S	.	*	H	α-helix	trans	-67.1	-49.5	176.5	0	0	0	0	0	111.6	A83 Y84 Q88 N89 I90	A83-A86 PolarHBondContact O-N 2.96Å; Y84-A86 VanDerWaalsContact C-N 3.32Å; Y84-A86 PolarHBondContact O-N 2.74Å; A86-Q88 PolarHBondContact O-N 3.02Å; A86-N89 PolarHBondContact O-N 3.44Å; A86-I90 PolarHBondContact O-N 2.88Å
87	L	29.1	Very low	27.8	Very low	131 Å²	131	119.8 Å²	119.8	69%	0.686	65%	0.65	S	S	*	*	H	α-helix	trans	-64.9	-39.1	177.8	-73.1	166.8	0	0	0	112	Y84 N89 I90 A91	Y84-L87 PolarHBondContact O-N 3.27Å; L87-N89 VanDerWaalsContact C-N 3.32Å; L87-N89 PolarHBondContact O-N 3.24Å; L87-I90 PolarHBondContact O-N 3.32Å; L87-A91 PolarHBondContact O-N 3.32Å
88	Q	28.9	Very low	27.9	Very low	95 Å²	95	122.3 Å²	122.3	44%	0.444	66%	0.656	S	S	.	*	H	α-helix	trans	-65.3	-33.9	177.8	-145.2	171.8	16.6	0	0	112.4	Y84 A86 Y92	Y84-Q88 PolarHBondContact O-N 2.82Å; A86-Q88 PolarHBondContact O-N 3.02Å; Q88-Y92 PolarHBondContact O-N 3.49Å
89	N	29.1	Very low	27.8	Very low	100 Å²	100	123 Å²	123	54%	0.535	65%	0.653	S	S	.	*	H	α-helix	trans	-71.7	-33.6	175.7	-88.7	-66	0	0	0	113.8	H85 A86 L87 Y92 K93	H85-N89 WeakPolarHBondContact O-CB 3.24Å; H85-N89 PolarHBondContact O-N 2.98Å; H85-N89 VanDerWaalsContact O-N 3.13Å; H85-N89 PolarHBondContact O-ND2 2.64Å; A86-N89 PolarHBondContact O-N 3.44Å; L87-N89 VanDerWaalsContact C-N 3.32Å; L87-N89 PolarHBondContact O-N 3.24Å; N89-Y92 PolarHBondContact O-N 3.07Å; N89-K93 PolarHBondContact O-N 3.35Å
90	I	31.2	Very low	27.5	Very low	116 Å²	116	121.8 Å²	121.8	60%	0.595	65%	0.648	S	S	*	*	H	α-helix	trans	-67.9	-42.4	174.8	-66	172.5	0	0	0	110	A86 L87 Y92 K93 V94	A86-I90 PolarHBondContact O-N 2.88Å; L87-I90 PolarHBondContact O-N 3.32Å; I90-Y92 VanDerWaalsContact C-N 3.33Å; I90-Y92 PolarHBondContact O-N 2.89Å; I90-K93 PolarHBondContact O-N 3.32Å; I90-V94 PolarHBondContact O-N 3.41Å
91	A	25.9	Very low	27.5	Very low	56 Å²	56	122.9 Å²	122.9	46%	0.463	65%	0.654	S	S	.	*	H	α-helix	trans	-59.9	-41.1	171.7	0	0	0	0	0	112.4	L87 L95	L87-A91 PolarHBondContact O-N 3.32Å; A91-L95 PolarHBondContact O-N 3.46Å
92	Y	26.4	Very low	27.4	Very low	169 Å²	169	128 Å²	128	66%	0.663	67%	0.666	S	S	*	*	H	α-helix	trans	-65.2	-41.2	177.2	-113.4	-92.4	0	0	0	113.3	Q88 N89 I90 V94 L95 S96	Q88-Y92 PolarHBondContact O-N 3.49Å; N89-Y92 PolarHBondContact O-N 3.07Å; I90-Y92 VanDerWaalsContact C-N 3.33Å; I90-Y92 PolarHBondContact O-N 2.89Å; Y92-V94 PolarHBondContact O-N 2.68Å; Y92-L95 PolarHBondContact O-N 2.73Å; Y92-S96 WeakPolarHBondContact O-CB 3.12Å; Y92-S96 PolarHBondContact O-N 3.39Å
93	K	26.4	Very low	27.3	Very low	174 Å²	174	129.8 Å²	129.8	76%	0.757	67%	0.671	S	S	*	*	H	α-helix	trans	-67.5	-31.6	-179.9	-97.7	-177.6	175.1	176.5	0	113.8	N89 I90 L95	N89-K93 PolarHBondContact O-N 3.35Å; I90-K93 PolarHBondContact O-N 3.32Å; K93-L95 VanDerWaalsContact C-N 3.34Å
94	V	29.7	Very low	27.2	Very low	121 Å²	121	129.8 Å²	129.8	73%	0.733	67%	0.666	S	S	*	*	H	α-helix	trans	-76.5	-23.1	177	178.2	0	0	0	0	112.1	I90 Y92	I90-V94 PolarHBondContact O-N 3.41Å; Y92-V94 PolarHBondContact O-N 2.68Å
95	L	26.6	Very low	26.9	Very low	150 Å²	150	128.2 Å²	128.2	79%	0.785	66%	0.66	S	S	*	*	H	α-helix	trans	-96.2	-2.8	179.5	-76.7	166.3	0	0	0	114.8	A91 Y92 K93	A91-L95 PolarHBondContact O-N 3.46Å; Y92-L95 PolarHBondContact O-N 2.73Å; K93-L95 VanDerWaalsContact C-N 3.34Å
96	S	24.9	Very low	26.6	Very low	66 Å²	66	131.1 Å²	131.1	46%	0.462	67%	0.673	S	S	.	*	S	Bend	trans	-96.6	1.8	-175.5	-167.2	0	0	0	0	115.3	Y92	Y92-S96 WeakPolarHBondContact O-CB 3.12Å; Y92-S96 PolarHBondContact O-N 3.39Å
97	N	26.5	Very low	26.3	Very low	147 Å²	147	133.4 Å²	133.4	79%	0.786	69%	0.685	S	S	*	*	S	Bend	trans	-116.9	50.8	-180	-87.2	-4	0	0	0	112.3
98	D	27.1	Very low	25.9	Very low	155 Å²	155	136.6 Å²	136.6	83%	0.829	69%	0.693	S	S	*	*			trans	-157.2	58.1	160.4	-98.7	-32.4	0	0	0	108.4	D100	D98-D100 PolarHBondContact O-N 3.48Å; D98-D100 VanDerWaalsContact O-N 3.15Å
99	I	23.3	Very low	25.7	Very low	142 Å²	142	139.5 Å²	139.5	73%	0.728	71%	0.71	S	S	*	*			trans	-78.7	93.6	172.9	-59.2	176.7	0	0	0	108.4
100	D	24.6	Very low	25.5	Very low	140 Å²	140	141.6 Å²	141.6	75%	0.749	72%	0.721	S	S	*	*	S	Bend	trans	-169.4	148.7	135.5	-110.3	-24.1	0	0	0	113.7	D98	D98-D100 PolarHBondContact O-N 3.48Å; D98-D100 VanDerWaalsContact O-N 3.15Å
101	N	26	Very low	25.2	Very low	151 Å²	151	141.7 Å²	141.7	81%	0.807	73%	0.733	S	S	*	*			trans	63.3	69	170.6	-64.2	-71.8	0	0	0	118.3
102	Y	24.7	Very low	25.2	Very low	232 Å²	232	146.9 Å²	146.9	91%	0.91	75%	0.751	S	S	*	*			trans	-81.2	130	152.5	-112.5	-97.6	0	0	0	111.1
103	N	27.3	Very low	25.2	Very low	150 Å²	150	144.2 Å²	144.2	80%	0.802	75%	0.752	S	S	*	*				-169.5	153.7	127.9	-109.3	-39.7	0	0	0	114.5
104	S	25.7	Very low	25.2	Very low	77 Å²	77	142.4 Å²	142.4	54%	0.538	75%	0.751	S	S	.	*			trans	62	69.5	163.3	-56.2	0	0	0	0	118.3
105	Y	22.6	Very low	25.1	Very low	153 Å²	153	144.7 Å²	144.7	60%	0.6	75%	0.751	S	S	*	*			trans	-133.8	112.6	132.5	-122.2	-97.4	0	0	0	109.5	G433	Y105-G433 WeakPolarHBondContact CD2-O 3.44Å; Y105-G433 WeakPolarHBondContact CE2-O 3.25Å
106	H	22.5	Very low	25.1	Very low	170 Å²	170	143.7 Å²	143.7	79%	0.787	75%	0.746	S	S	*	*			trans	-121.3	167.8	174.6	-156.7	-94.6	0	0	0	109.4
107	C	23.8	Very low	25.1	Very low	106 Å²	106	147.6 Å²	147.6	72%	0.716	76%	0.762	S	S	*	*			trans	66.6	79.3	178.6	-56.7	0	0	0	0	116.2
108	F	21.7	Very low	25.1	Very low	199 Å²	199	145.7 Å²	145.7	87%	0.873	75%	0.752	S	S	*	*			trans	-155.9	57.7	131.2	-140.1	-85.2	0	0	0	114.5
109	I	23.7	Very low	25.1	Very low	156 Å²	156	145.3 Å²	145.3	80%	0.8	76%	0.755	S	S	*	*			trans	-138.7	119.7	155.2	-63.7	-175	0	0	0	107.9
110	N	25.1	Very low	25.1	Very low	143 Å²	143	145.8 Å²	145.8	77%	0.765	75%	0.752	S	S	*	*			trans	169.9	104	143.5	-94.4	-2.6	0	0	0	110
111	S	24.5	Very low	25.1	Very low	119 Å²	119	148.9 Å²	148.9	83%	0.832	76%	0.759	S	S	*	*			trans	170.5	56.3	150.7	40.9	0	0	0	0	114.3
112	I	26.6	Very low	25	Very low	165 Å²	165	147 Å²	147	85%	0.846	76%	0.755	S	S	*	*	S	Bend	trans	-145.7	121.2	149.7	-56.6	-179.1	0	0	0	106.6
113	T	26.3	Very low	25	Very low	113 Å²	113	143.7 Å²	143.7	69%	0.693	75%	0.752	S	S	*	*			cis	-159.3	145.1	-24	27	0	0	0	0	105.6
114	D	25.2	Very low	24.9	Very low	135 Å²	135	141.6 Å²	141.6	72%	0.722	75%	0.749	S	S	*	*			trans	52.1	121.6	147.8	-74.7	35.6	0	0	0	122.5
115	K	27.3	Very low	24.8	Very low	169 Å²	169	146 Å²	146	74%	0.735	76%	0.758	S	S	*	*			trans	96.7	91.1	140.6	-64.1	-178.7	-178.7	-176.4	0	122
116	D	27.8	Very low	25	Very low	130 Å²	130	148.2 Å²	148.2	70%	0.695	77%	0.772	S	S	*	*				88.7	125.3	112	-55.8	-13.7	0	0	0	122
117	D	25.5	Very low	25.2	Very low	147 Å²	147	148.1 Å²	148.1	79%	0.786	77%	0.765	S	S	*	*			trans	80.7	101.9	142.3	-63.4	-8	0	0	0	124.1
118	D	25.9	Very low	25.2	Very low	107 Å²	107	150.2 Å²	150.2	57%	0.572	76%	0.764	S	S	*	*				59.2	96.8	129.1	-93	-8	0	0	0	121.6	K120	D118-K120 IonicContact OD1-NZ 2.77Å; D118-K120 PolarHBondContact OD1-NZ 2.93Å; D118-K120 IonicContact OD2-NZ 2.75Å; D118-K120 PolarHBondContact OD2-NZ 3.13Å
119	V	26.6	Very low	25.5	Very low	148 Å²	148	146 Å²	146	90%	0.897	76%	0.755	S	S	*	*				-130.1	108	116.2	-178.6	0	0	0	0	110.8
120	K	23	Very low	25.7	Very low	151 Å²	151	144.9 Å²	144.9	66%	0.657	75%	0.751	S	S	*	*			trans	-83.8	122.9	165	-58.7	174.4	-174.9	72.2	0	110.2	D118	D118-K120 IonicContact OD1-NZ 2.77Å; D118-K120 PolarHBondContact OD1-NZ 2.93Å; D118-K120 IonicContact OD2-NZ 2.75Å; D118-K120 PolarHBondContact OD2-NZ 3.13Å
121	K	26.1	Very low	25.8	Very low	206 Å²	206	144.8 Å²	144.8	90%	0.896	75%	0.75	S	S	*	*			trans	-171.3	148.8	143.5	-106.8	155.8	-173.8	175.3	0	112.2
122	C	23.8	Very low	26	Very low	110 Å²	110	144.6 Å²	144.6	74%	0.743	75%	0.749	S	S	*	*			trans	-134.1	176.9	-167.9	-52.2	0	0	0	0	111.4
123	I	23.4	Very low	25.9	Very low	164 Å²	164	145 Å²	145	84%	0.841	75%	0.752	S	S	*	*			trans	77.3	140	164	-56.1	147.6	0	0	0	113.4
124	S	26	Very low	25.8	Very low	106 Å²	106	148.9 Å²	148.9	74%	0.741	76%	0.762	S	S	*	*			cis	-128.4	166.6	10.6	54.8	0	0	0	0	112.2
125	K	24.3	Very low	25.7	Very low	168 Å²	168	153.9 Å²	153.9	73%	0.73	77%	0.771	S	S	*	*			cis	100.9	91.2	12.7	-145.8	-173	-162.1	-172.4	0	116.5	Y127	K125-Y127 HydrophobicContact CG-CD2 4.18Å; K125-Y127 HydrophobicContact CG-CE2 4.06Å
126	K	26.2	Very low	25.5	Very low	201 Å²	201	151.7 Å²	151.7	87%	0.874	78%	0.776	S	S	*	*			trans	-165.4	133.8	151.5	-102	172.4	-177.6	179.2	0	107.5
127	Y	25.4	Very low	25.3	Very low	167 Å²	167	153.6 Å²	153.6	66%	0.655	79%	0.785	S	S	*	*			cis	74.3	138	24.9	-66.7	-62.1	0	0	0	115.1	K125	K125-Y127 HydrophobicContact CG-CD2 4.18Å; K125-Y127 HydrophobicContact CG-CE2 4.06Å
128	H	25.1	Very low	25.2	Very low	151 Å²	151	154.8 Å²	154.8	70%	0.699	79%	0.787	S	S	*	*			cis	-158	-161.3	6.4	-139.1	-29.6	0	0	0	114.2
129	T	28	Very low	25.3	Very low	111 Å²	111	155.7 Å²	155.7	68%	0.681	79%	0.793	S	S	*	*			trans	63.9	156.5	173.6	60.6	0	0	0	0	117
130	N	27.4	Very low	25.4	Very low	131 Å²	131	155 Å²	155	70%	0.701	78%	0.784	S	S	*	*			cis	-160.5	178	-19.6	-105.7	-3.3	0	0	0	109
131	N	28.3	Very low	25.6	Very low	141 Å²	141	152.4 Å²	152.4	75%	0.754	78%	0.784	S	S	*	*				177.2	116.7	-60.4	-93.6	-2.8	0	0	0	110.1
132	S	27.5	Very low	25.6	Very low	116 Å²	116	151.4 Å²	151.4	81%	0.811	78%	0.777	S	S	*	*			trans	-159.8	143.1	152.3	60.6	0	0	0	0	116.3
133	L	24.3	Very low	25.7	Very low	172 Å²	172	153.7 Å²	153.7	90%	0.901	78%	0.776	S	S	*	*	S	Bend	trans	62.5	66	156.7	-78.3	161.2	0	0	0	121.3
134	Q	25.1	Very low	25.9	Very low	196 Å²	196	152.2 Å²	152.2	92%	0.916	77%	0.77	S	S	*	*				-148.8	157.4	110.2	-149.8	165.9	7.8	0	0	111.2
135	R	23.6	Very low	25.8	Very low	240 Å²	240	153.3 Å²	153.3	91%	0.906	77%	0.767	S	S	*	*			trans	-89.3	130.5	-169.2	-68.8	173.1	171.4	148.3	-5	112.6
136	C	22.8	Very low	25.9	Very low	123 Å²	123	151.6 Å²	151.6	83%	0.831	77%	0.766	S	S	*	*			trans	-138.1	144	157.9	-89.1	0	0	0	0	110.2
137	L	23	Very low	26	Very low	169 Å²	169	148.9 Å²	148.9	89%	0.885	76%	0.761	S	S	*	*			trans	28.3	115	153.3	-61.6	168.3	0	0	0	119.2
138	M	23.7	Very low	25.8	Very low	172 Å²	172	147.3 Å²	147.3	85%	0.847	77%	0.769	S	S	*	*			trans	-156.1	158.3	144.8	-117.5	-56.6	-177.3	0	0	111.4
139	N	27.8	Very low	25.8	Very low	127 Å²	127	148.5 Å²	148.5	68%	0.679	78%	0.777	S	S	*	*			trans	65.9	124.5	174	-55	-1.3	0	0	0	115.5
140	N	27.8	Very low	25.5	Very low	133 Å²	133	149.5 Å²	149.5	71%	0.711	78%	0.777	S	S	*	*			cis	-150.9	159	-0.3	-93.2	-23.5	0	0	0	107.6
141	S	27.1	Very low	25.3	Very low	96 Å²	96	154.2 Å²	154.2	67%	0.671	79%	0.787	S	S	*	*			cis	-162.7	142.7	12.2	29.1	0	0	0	0	111.4
142	Y	26.6	Very low	25.1	Very low	186 Å²	186	155.2 Å²	155.2	73%	0.729	79%	0.792	S	S	*	*			trans	60.4	113	147.8	-74.9	-102.2	0	0	0	118.6
143	E	25.3	Very low	25.2	Very low	157 Å²	157	154.5 Å²	154.5	73%	0.734	79%	0.785	S	S	*	*				75.3	133.7	95.7	-72	177.6	-169.2	0	0	113.1
144	D	28.4	Very low	25	Very low	134 Å²	134	152.1 Å²	152.1	72%	0.717	77%	0.773	S	S	*	*			cis	-148.7	169.3	20	-150.6	2.7	0	0	0	116.2
145	L	25	Very low	25	Very low	129 Å²	129	153.5 Å²	153.5	68%	0.675	77%	0.771	S	S	*	*			trans	-17	141.1	177.5	-75.7	156.5	0	0	0	124.6
146	N	25.4	Very low	25	Very low	132 Å²	132	148 Å²	148	71%	0.706	76%	0.758	S	S	*	*			trans	98.3	137.2	133.5	-73.9	-23.9	0	0	0	124
147	N	27.3	Very low	25.1	Very low	143 Å²	143	149 Å²	149	77%	0.765	76%	0.755	S	S	*	*			trans	68.1	91	152	-66.5	-2	0	0	0	121.1
148	T	23	Very low	25	Very low	134 Å²	134	147.5 Å²	147.5	82%	0.822	75%	0.747	S	S	*	*			trans	-35.7	135.3	141.2	49.4	0	0	0	0	115.4
149	M	23.8	Very low	25.1	Very low	177 Å²	177	145.7 Å²	145.7	87%	0.872	75%	0.745	S	S	*	*			trans	-153	165.9	137.5	-118.5	-58.3	178	0	0	110.5
150	L	22.4	Very low	24.8	Very low	132 Å²	132	143.9 Å²	143.9	69%	0.691	74%	0.743	S	S	*	*			trans	-75.5	158.6	177.5	-76.4	83.6	0	0	0	111.9
151	Y	23.2	Very low	24.9	Very low	229 Å²	229	144.3 Å²	144.3	90%	0.898	75%	0.745	S	S	*	*			trans	21.9	110.4	148.4	-82.9	-98.1	0	0	0	118.2
152	N	24.7	Very low	25	Very low	162 Å²	162	145.8 Å²	145.8	87%	0.866	75%	0.746	S	S	*	*			trans	-138.6	136.8	152.5	-140	-5.1	0	0	0	109
153	P	28.7	Very low	25.2	Very low	102 Å²	102	143.6 Å²	143.6	66%	0.662	75%	0.746	S	S	*	*			trans	-97.8	154.7	-170	36.5	-33.6	0	0	0	114.9
154	L	21.2	Very low	25.3	Very low	122 Å²	122	143 Å²	143	64%	0.639	75%	0.748	S	S	*	*			trans	46.6	95.1	151.4	-65.1	172	0	0	0	120.4
155	Y	25.1	Very low	25.3	Very low	224 Å²	224	143.3 Å²	143.3	88%	0.878	75%	0.75	S	S	*	*			trans	-141.8	121.8	137.6	-96	-91.6	0	0	0	106.1
156	I	22.3	Very low	25.4	Very low	124 Å²	124	143.1 Å²	143.1	64%	0.636	75%	0.749	S	S	*	*				73.4	87.1	56.9	-57.2	179.3	0	0	0	113.3
157	N	24.9	Very low	25.5	Very low	144 Å²	144	142.7 Å²	142.7	77%	0.77	75%	0.747	S	S	*	*			trans	166.3	120.3	140.7	-83.4	-22.7	0	0	0	106.2
158	I	21.2	Very low	25.4	Very low	138 Å²	138	142.5 Å²	142.5	71%	0.708	75%	0.746	S	S	*	*			cis	65.9	93	47.8	-48.4	175.7	0	0	0	112.9
159	T	25	Very low	25.6	Very low	134 Å²	134	143.6 Å²	143.6	82%	0.822	75%	0.747	S	S	*	*				-178.7	155.2	123.3	24.9	0	0	0	0	113.2
160	S	23	Very low	25.5	Very low	89 Å²	89	143.7 Å²	143.7	62%	0.622	75%	0.745	S	S	*	*			trans	-20.4	141.4	165.9	52.6	0	0	0	0	118.2
161	N	28.5	Very low	25.6	Very low	142 Å²	142	144.7 Å²	144.7	76%	0.759	75%	0.751	S	S	*	*				-169.5	176.7	66.9	-84.5	-77.6	0	0	0	111.6
162	N	29.5	Very low	25.6	Very low	128 Å²	128	140.4 Å²	140.4	68%	0.684	74%	0.742	S	S	*	*			cis	-176.1	170.8	-38.4	-168.5	19.4	0	0	0	109.8
163	N	31.4	Very low	25.6	Very low	139 Å²	139	139.7 Å²	139.7	74%	0.743	74%	0.738	S	S	*	*			trans	73.5	159.1	167.4	-70.2	-11.3	0	0	0	120.1
164	N	27.4	Very low	25.4	Very low	145 Å²	145	143.3 Å²	143.3	78%	0.775	74%	0.744	S	S	*	*			trans	-134.5	167.1	-157.2	-66.1	-49.3	0	0	0	113.8
165	N	28.3	Very low	25.8	Very low	140 Å²	140	143.3 Å²	143.3	75%	0.749	74%	0.744	S	S	*	*			trans	71.2	146.9	159.3	-59.2	-10.5	0	0	0	116.7
166	N	27.6	Very low	25.8	Very low	125 Å²	125	137 Å²	137	67%	0.668	73%	0.726	S	S	*	*			cis	-159.2	162.9	-7.8	-119.3	-0.9	0	0	0	112.5
167	N	27.9	Very low	26.2	Very low	124 Å²	124	138.1 Å²	138.1	66%	0.663	73%	0.726	S	S	*	*			trans	68.3	121.1	155.1	-61.6	-1.1	0	0	0	121.3
168	N	24.1	Very low	26.6	Very low	138 Å²	138	136.1 Å²	136.1	74%	0.738	72%	0.719	S	S	*	*			trans	53.3	100.3	136.2	-54	1.8	0	0	0	119.6
169	N	26.9	Very low	26.8	Very low	158 Å²	158	133.7 Å²	133.7	85%	0.845	71%	0.707	S	S	*	*				-164	178.8	102.3	-99.5	-5.9	0	0	0	111.9
170	E	23.1	Very low	27	Very low	178 Å²	178	132.1 Å²	132.1	83%	0.832	69%	0.693	S	S	*	*			trans	-52.7	127.4	-177.3	-55.7	164.8	124.8	0	0	113.2
171	L	23.1	Very low	27.5	Very low	154 Å²	154	136 Å²	136	81%	0.806	70%	0.699	S	S	*	*			trans	169.9	141.9	140.8	-92.2	156.5	0	0	0	111
172	I	24.1	Very low	27.6	Very low	139 Å²	139	133.4 Å²	133.4	71%	0.713	68%	0.684	S	S	*	*			trans	15.5	106.5	151.9	-50.6	166.3	0	0	0	116.9
173	N	24.9	Very low	27.5	Very low	147 Å²	147	132.5 Å²	132.5	79%	0.786	68%	0.676	S	S	*	*				-177.5	170.1	127.8	-105	-63.9	0	0	0	115.7
174	F	24.9	Very low	27.5	Very low	177 Å²	177	132.8 Å²	132.8	78%	0.776	67%	0.671	S	S	*	*			trans	-56.3	132.1	-174.9	-74.7	-104.3	0	0	0	116.7	N176	F174-N176 PolarHBondContact O-N 2.99Å; F174-N176 PolarHBondContact O-ND2 3.46Å
175	D	28.7	Very low	27.7	Very low	123 Å²	123	132.1 Å²	132.1	66%	0.658	66%	0.661	S	S	*	*			trans	-81.4	111.6	168	-171.5	0	0	0	0	111.7	K177	D175-K177 PolarHBondContact O-N 3.27Å; D175-K177 VanDerWaalsContact O-N 3.12Å; D175-K177 IonicContact OD1-NZ 3.42Å; D175-K177 PolarHBondContact OD1-NZ 3.45Å; D175-K177 IonicContact OD2-NZ 2.74Å; D175-K177 PolarHBondContact OD2-NZ 3.39Å
176	N	25.2	Very low	27.6	Very low	91 Å²	91	130.6 Å²	130.6	49%	0.487	65%	0.652	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.2	49.4	-167.3	-90.2	-67.7	0	0	0	114.9	F174 L179	F174-N176 PolarHBondContact O-N 2.99Å; F174-N176 PolarHBondContact O-ND2 3.46Å; N176-L179 WeakPolarHBondContact OD1-CB 3.43Å; N176-L179 WeakPolarHBondContact OD1-CD2 3.31Å
177	K	30	Very low	27.6	Very low	147 Å²	147	133.3 Å²	133.3	64%	0.639	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	-18.9	176.4	-74.3	-174.6	-166.3	83.7	0	115.7	D175	D175-K177 PolarHBondContact O-N 3.27Å; D175-K177 VanDerWaalsContact O-N 3.12Å; D175-K177 IonicContact OD1-NZ 3.42Å; D175-K177 PolarHBondContact OD1-NZ 3.45Å; D175-K177 IonicContact OD2-NZ 2.74Å; D175-K177 PolarHBondContact OD2-NZ 3.39Å
178	T	33.2	Very low	27.4	Very low	103 Å²	103	137.5 Å²	137.5	63%	0.632	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-39.7	171.9	-42.9	0	0	0	0	111.3	L180 K181 I182	T178-L180 VanDerWaalsContact C-N 3.34Å; T178-L180 PolarHBondContact O-N 3.15Å; T178-K181 PolarHBondContact O-N 2.77Å; T178-I182 HydrophobicContact CG2-CD1 4.05Å; T178-I182 PolarHBondContact O-N 3.25Å
179	L	26.6	Very low	27.6	Very low	87 Å²	87	137.5 Å²	137.5	46%	0.455	66%	0.662	S	S	.	*	H	α-helix	trans	-60.4	-39.4	-175.2	-144.7	80.3	0	0	0	112.9	N176 K181 I182 Q183	N176-L179 WeakPolarHBondContact OD1-CB 3.43Å; N176-L179 WeakPolarHBondContact OD1-CD2 3.31Å; L179-K181 VanDerWaalsContact C-N 3.32Å; L179-K181 PolarHBondContact O-N 3.38Å; L179-I182 PolarHBondContact O-N 3.37Å; L179-Q183 WeakPolarHBondContact O-CB 3.25Å; L179-Q183 WeakPolarHBondContact O-CG 3.43Å; L179-Q183 PolarHBondContact O-N 3.2Å
180	L	29.2	Very low	27.4	Very low	100 Å²	100	137 Å²	137	52%	0.524	65%	0.652	S	S	.	*	H	α-helix	trans	-71.9	-22.3	-178.2	-159.9	70.5	0	0	0	113.6	T178 K184	T178-L180 VanDerWaalsContact C-N 3.34Å; T178-L180 PolarHBondContact O-N 3.15Å; L180-K184 WeakPolarHBondContact O-CG 3.13Å; L180-K184 PolarHBondContact O-N 3.26Å
181	K	32.4	Very low	27.5	Very low	170 Å²	170	134.6 Å²	134.6	74%	0.739	65%	0.645	S	S	*	*	H	α-helix	trans	-77.6	-42.2	170.3	-72.7	-177.8	178.4	177.1	0	110.8	T178 L179 K184 F185	T178-K181 PolarHBondContact O-N 2.77Å; L179-K181 VanDerWaalsContact C-N 3.32Å; L179-K181 PolarHBondContact O-N 3.38Å; K181-K184 PolarHBondContact O-N 3.3Å; K181-F185 PolarHBondContact O-N 3.24Å
182	I	31.8	Very low	27.6	Very low	88 Å²	88	135.1 Å²	135.1	45%	0.451	64%	0.643	S	S	.	*	H	α-helix	trans	-64.8	-43.1	177.1	-66.6	171.9	0	0	0	110.9	T178 L179 K184 F185 L186	T178-I182 HydrophobicContact CG2-CD1 4.05Å; T178-I182 PolarHBondContact O-N 3.25Å; L179-I182 PolarHBondContact O-N 3.37Å; I182-K184 PolarHBondContact O-N 2.92Å; I182-F185 WeakPolarHBondContact O-CB 3.19Å; I182-F185 PolarHBondContact O-N 3Å; I182-F185 VanDerWaalsContact O-N 3.15Å; I182-L186 HydrophobicContact CG2-CD1 3.82Å; I182-L186 HydrophobicContact CG2-CG 4.37Å; I182-L186 WeakPolarHBondContact O-CG 3.45Å; I182-L186 PolarHBondContact O-N 3.15Å
183	Q	26.7	Very low	27.7	Very low	110 Å²	110	137 Å²	137	51%	0.514	65%	0.647	S	S	.	*	H	α-helix	trans	-61	-40.2	173.9	-76	178.1	-24.1	0	0	112.7	L179 F185 F187	L179-Q183 WeakPolarHBondContact O-CB 3.25Å; L179-Q183 WeakPolarHBondContact O-CG 3.43Å; L179-Q183 PolarHBondContact O-N 3.2Å; Q183-F185 VanDerWaalsContact C-N 3.3Å; Q183-F185 PolarHBondContact O-N 3.41Å; Q183-F187 WeakPolarHBondContact O-CB 3.37Å; Q183-F187 PolarHBondContact O-N 2.96Å
184	K	30.7	Very low	27.6	Very low	145 Å²	145	135.2 Å²	135.2	63%	0.63	65%	0.645	S	S	*	*	H	α-helix	trans	-74.6	-16.1	176.2	-74.7	-179.4	177.3	178.1	0	114.1	L180 K181 I182	L180-K184 WeakPolarHBondContact O-CG 3.13Å; L180-K184 PolarHBondContact O-N 3.26Å; K181-K184 PolarHBondContact O-N 3.3Å; I182-K184 PolarHBondContact O-N 2.92Å
185	F	31.9	Very low	27.7	Very low	131 Å²	131	134.6 Å²	134.6	58%	0.575	65%	0.645	S	S	*	*	H	α-helix	trans	-81.7	-49.4	169.5	-170.8	-105.4	0	0	0	110.9	K181 I182 Q183 F187 R188 M189	K181-F185 PolarHBondContact O-N 3.24Å; I182-F185 WeakPolarHBondContact O-CB 3.19Å; I182-F185 PolarHBondContact O-N 3Å; I182-F185 VanDerWaalsContact O-N 3.15Å; Q183-F185 VanDerWaalsContact C-N 3.3Å; Q183-F185 PolarHBondContact O-N 3.41Å; F185-F187 VanDerWaalsContact C-N 3.29Å; F185-F187 PolarHBondContact O-N 2.89Å; F185-R188 PolarHBondContact O-N 3.09Å; F185-M189 HydrophobicContact CD1-CG 4.37Å; F185-M189 HydrophobicContact CE1-CG 4.15Å; F185-M189 HydrophobicContact CZ-CG 4.49Å; F185-M189 PolarHBondContact O-N 3.32Å; F185-M189 VanDerWaalsContact O-N 3.12Å
186	L	26.8	Very low	27.4	Very low	107 Å²	107	134 Å²	134	56%	0.56	64%	0.638	S	S	*	*	H	α-helix	trans	-64.5	-29.5	178.4	-69	171.6	0	0	0	113.3	I182 R188	I182-L186 HydrophobicContact CG2-CD1 3.82Å; I182-L186 HydrophobicContact CG2-CG 4.37Å; I182-L186 WeakPolarHBondContact O-CG 3.45Å; I182-L186 PolarHBondContact O-N 3.15Å; L186-R188 VanDerWaalsContact C-N 3.27Å; L186-R188 PolarHBondContact O-N 3.11Å
187	F	27	Very low	27.4	Very low	183 Å²	183	135.9 Å²	135.9	80%	0.803	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-11.9	172.4	-154.6	-94.4	0	0	0	113.7	Q183 F185	Q183-F187 WeakPolarHBondContact O-CB 3.37Å; Q183-F187 PolarHBondContact O-N 2.96Å; F185-F187 VanDerWaalsContact C-N 3.29Å; F185-F187 PolarHBondContact O-N 2.89Å
188	R	24.8	Very low	27.1	Very low	212 Å²	212	136.9 Å²	136.9	80%	0.8	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	-26.6	173.1	-83.7	-177.7	166.9	171.6	-2.9	113.7	F185 L186 K190	F185-R188 PolarHBondContact O-N 3.09Å; L186-R188 VanDerWaalsContact C-N 3.27Å; L186-R188 PolarHBondContact O-N 3.11Å; R188-K190 PolarHBondContact O-N 3.34Å
189	M	27.2	Very low	26.8	Very low	138 Å²	138	139.2 Å²	139.2	68%	0.68	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	-2	176.8	-72.3	-82.6	-81.4	0	0	114.2	F185	F185-M189 HydrophobicContact CD1-CG 4.37Å; F185-M189 HydrophobicContact CE1-CG 4.15Å; F185-M189 HydrophobicContact CZ-CG 4.49Å; F185-M189 PolarHBondContact O-N 3.32Å; F185-M189 VanDerWaalsContact O-N 3.12Å
190	K	23	Very low	26.8	Very low	146 Å²	146	141 Å²	141	64%	0.635	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.1	17.2	-173.3	-145.4	177.1	-178.8	-179.1	0	115	R188	R188-K190 PolarHBondContact O-N 3.34Å
191	N	24.5	Very low	26.4	Very low	129 Å²	129	144.3 Å²	144.3	69%	0.69	69%	0.691	S	S	*	*	S	Bend	trans	-152	134.9	169	-85.7	-55	0	0	0	109.6
192	H	26.5	Very low	25.9	Very low	165 Å²	165	141.7 Å²	141.7	76%	0.764	69%	0.694	S	S	*	*			trans	61.5	113	-163.2	-52.1	-85.6	0	0	0	112.6
193	F	26.7	Very low	25.7	Very low	179 Å²	179	145 Å²	145	79%	0.785	71%	0.707	S	S	*	*			cis	-131.1	118	33.1	-103.7	-96.7	0	0	0	114.1	H195	F193-H195 HydrophobicContact CD1-CB 4.21Å; F193-H195 HydrophobicContact CE1-CB 4.37Å
194	S	21.5	Very low	25.5	Very low	108 Å²	108	145.4 Å²	145.4	76%	0.755	72%	0.717	S	S	*	*			trans	-115.4	109.6	140.6	44	0	0	0	0	106.5
195	H	26.7	Very low	25.3	Very low	165 Å²	165	145.4 Å²	145.4	76%	0.764	72%	0.724	S	S	*	*			trans	-165	74	168.2	-102.5	-57.3	0	0	0	112.6	F193	F193-H195 HydrophobicContact CD1-CB 4.21Å; F193-H195 HydrophobicContact CE1-CB 4.37Å
196	Q	23.4	Very low	25.3	Very low	109 Å²	109	145 Å²	145	51%	0.509	73%	0.734	S	S	.	*			trans	-138.7	139	146.6	-83	-165.7	50.2	0	0	105.6	N1016	Q196-N1016 PolarHBondContact OE1-ND2 3.04Å; Q196-N1016 VanDerWaalsContact OE1-ND2 3.12Å
197	T	25.7	Very low	25.1	Very low	131 Å²	131	144.6 Å²	144.6	80%	0.804	75%	0.746	S	S	*	*			cis	-137	164.1	-5.7	20.7	0	0	0	0	109.3
198	E	22.2	Very low	25	Very low	169 Å²	169	141.8 Å²	141.8	79%	0.79	74%	0.744	S	S	*	*			trans	-97.8	151.6	174.9	-146.3	169.6	-147.5	0	0	110.8
199	H	28.3	Very low	25.2	Very low	151 Å²	151	139.6 Å²	139.6	70%	0.699	75%	0.747	S	S	*	*	S	Bend	trans	73.9	108.4	169.7	-67	-67.4	0	0	0	121.5
200	T	25.2	Very low	25.1	Very low	124 Å²	124	137.1 Å²	137.1	76%	0.761	74%	0.744	S	S	*	*			trans	65.8	86.7	135.7	59	0	0	0	0	119.4
201	Q	22	Very low	25.2	Very low	171 Å²	171	134.7 Å²	134.7	80%	0.799	75%	0.745	S	S	*	*				-96.3	113.6	124.4	-86.1	-167	-13.7	0	0	109.9	H203	Q201-H203 VanDerWaalsContact C-N 3.32Å; Q201-H203 PolarHBondContact O-N 3.21Å
202	S	22	Very low	25.3	Very low	115 Å²	115	135 Å²	135	80%	0.804	75%	0.747	S	S	*	*			trans	-87.4	75.8	154.3	56.4	0	0	0	0	108.6
203	H	26.4	Very low	25.2	Very low	158 Å²	158	138.4 Å²	138.4	73%	0.731	75%	0.753	S	S	*	*			trans	-110.2	103.5	165	-98.6	-68	0	0	0	109.5	Q201	Q201-H203 VanDerWaalsContact C-N 3.32Å; Q201-H203 PolarHBondContact O-N 3.21Å
204	T	24	Very low	24.9	Very low	118 Å²	118	139.6 Å²	139.6	72%	0.724	75%	0.752	S	S	*	*			trans	-64.5	138.3	167.9	50	0	0	0	0	110.5
205	N	24.5	Very low	25	Very low	145 Å²	145	139.8 Å²	139.8	78%	0.775	75%	0.749	S	S	*	*			trans	46.7	135.4	143.1	-62.1	-9.2	0	0	0	118.8
206	P	32.5	Very low	24.8	Very low	122 Å²	122	140.5 Å²	140.5	79%	0.792	75%	0.75	S	S	*	*				-152.3	136.9	56.2	37.1	-15.8	0	0	0	117.9
207	A	22.3	Very low	24.8	Very low	98 Å²	98	141.7 Å²	141.7	81%	0.81	76%	0.76	S	S	*	*			trans	-139	118.3	145.4	0	0	0	0	0	107.9
208	V	25.1	Very low	24.7	Very low	124 Å²	124	139.9 Å²	139.9	75%	0.752	75%	0.753	S	S	*	*			trans	-130.8	83.4	177.2	-175	0	0	0	0	110
209	L	29.4	Very low	24.6	Very low	166 Å²	166	140.8 Å²	140.8	87%	0.869	75%	0.754	S	S	*	*			trans	-78	114.9	137.7	-66.7	159.7	0	0	0	104
210	S	26.2	Very low	24.4	Very low	86 Å²	86	141.1 Å²	141.1	60%	0.601	76%	0.76	S	S	*	*			cis	64.2	125.4	39.3	112.4	0	0	0	0	111.3
211	S	24.5	Very low	24.5	Very low	96 Å²	96	138 Å²	138	67%	0.671	75%	0.753	S	S	*	*			cis	-158.1	-170.5	10.6	61.5	0	0	0	0	112.7
212	N	25.5	Very low	24.7	Very low	135 Å²	135	138.2 Å²	138.2	72%	0.722	75%	0.754	S	S	*	*			trans	83	131.6	-167.8	-52.3	-69.1	0	0	0	113
213	R	24.6	Very low	24.8	Very low	236 Å²	236	139.6 Å²	139.6	89%	0.891	75%	0.752	S	S	*	*			cis	-127.2	148.2	22.9	-102.8	-178.4	-168.6	-169.8	3.4	109.8
214	R	21.8	Very low	24.7	Very low	205 Å²	205	137 Å²	137	77%	0.774	75%	0.747	S	S	*	*			cis	54.9	112.4	39.9	-71.5	-169	178.4	-179.2	1.3	112.6
215	T	22.7	Very low	24.8	Very low	112 Å²	112	137.9 Å²	137.9	69%	0.687	75%	0.746	S	S	*	*			cis	-176.2	176.8	29.1	9.3	0	0	0	0	110.3
216	F	23	Very low	24.9	Very low	179 Å²	179	138.3 Å²	138.3	79%	0.785	75%	0.749	S	S	*	*			trans	80.9	128.7	157.9	-78.4	-71	0	0	0	121
217	N	23.5	Very low	24.6	Very low	134 Å²	134	135.5 Å²	135.5	72%	0.717	74%	0.742	S	S	*	*			trans	72.8	107.9	140.8	-74.3	2.7	0	0	0	122.8
218	S	22.2	Very low	24.9	Very low	94 Å²	94	137.6 Å²	137.6	66%	0.657	74%	0.74	S	S	*	*				65.9	127.3	117.5	71.3	0	0	0	0	122.6
219	F	21.8	Very low	24.8	Very low	187 Å²	187	140.7 Å²	140.7	82%	0.82	74%	0.743	S	S	*	*			trans	60.3	131.3	135.2	-83	-103.6	0	0	0	121.4
220	I	24	Very low	24.6	Very low	158 Å²	158	141.3 Å²	141.3	81%	0.81	74%	0.744	S	S	*	*			trans	77.3	147.9	150.4	-62.2	160	0	0	0	117.3
221	G	26.2	Very low	24.6	Very low	60 Å²	60	140 Å²	140	62%	0.619	74%	0.744	S	S	*	*			trans	107.5	88.1	179.9	0	0	0	0	0	111.5
222	E	25.9	Very low	24.6	Very low	174 Å²	174	139.7 Å²	139.7	81%	0.813	74%	0.742	S	S	*	*				55.3	105.4	70.5	-61.3	-174.1	168	0	0	110.7
223	D	24.6	Very low	24.7	Very low	144 Å²	144	142.8 Å²	142.8	77%	0.77	75%	0.745	S	S	*	*				63.2	130.4	85.8	-75.4	-20.8	0	0	0	111
224	T	23.5	Very low	24.8	Very low	104 Å²	104	136.6 Å²	136.6	64%	0.638	73%	0.733	S	S	*	*			cis	173	-162.8	18.3	30.4	0	0	0	0	104.4
225	I	26.2	Very low	25	Very low	137 Å²	137	135.3 Å²	135.3	70%	0.703	74%	0.736	S	S	*	*			trans	81.3	122.5	133.4	-93.5	168.3	0	0	0	120.4
226	N	27.3	Very low	24.9	Very low	153 Å²	153	138.3 Å²	138.3	82%	0.818	74%	0.742	S	S	*	*			trans	63.1	139.9	155.4	-60.1	-9.3	0	0	0	120.9
227	G	27.3	Very low	25.4	Very low	64 Å²	64	134.7 Å²	134.7	66%	0.66	74%	0.737	S	S	*	*			cis	157.8	169.9	-10.2	0	0	0	0	0	115.1
228	N	26.8	Very low	25.6	Very low	142 Å²	142	134.6 Å²	134.6	76%	0.759	74%	0.735	S	S	*	*			trans	69.5	131.8	162.7	-67.7	-9.5	0	0	0	117.5
229	F	23.8	Very low	25.9	Very low	189 Å²	189	138.1 Å²	138.1	83%	0.829	74%	0.738	S	S	*	*				55.3	125.6	76.5	-77.4	-81.4	0	0	0	111.5
230	M	24.9	Very low	26.1	Very low	179 Å²	179	136.2 Å²	136.2	88%	0.882	73%	0.732	S	S	*	*			cis	-137.6	177.1	17.8	-87.4	-172.5	165.2	0	0	111.3
231	G	27	Very low	26.2	Very low	58 Å²	58	134.3 Å²	134.3	60%	0.598	73%	0.728	S	S	*	*			cis	-166	174	4.9	0	0	0	0	0	112
232	S	24.5	Very low	26.2	Very low	89 Å²	89	138.2 Å²	138.2	62%	0.622	73%	0.734	S	S	*	*				60.3	119.9	97	72.7	0	0	0	0	113.6
233	Y	26.6	Very low	26.3	Very low	201 Å²	201	132.9 Å²	132.9	79%	0.788	72%	0.716	S	S	*	*			cis	-160.4	166.8	43.9	-90.2	-80.9	0	0	0	112.8
234	T	26.5	Very low	26.3	Very low	105 Å²	105	130.1 Å²	130.1	64%	0.644	71%	0.707	S	S	*	*			trans	56.4	140	146.4	53.9	0	0	0	0	119.8
235	E	26.1	Very low	26.3	Very low	179 Å²	179	130.3 Å²	130.3	84%	0.836	71%	0.713	S	S	*	*			cis	-161.2	144.7	-1.6	-125.5	160.4	-163	0	0	110.1
236	E	20.9	Very low	26.6	Very low	174 Å²	174	129.2 Å²	129.2	81%	0.813	72%	0.715	S	S	*	*			trans	-81.2	-173	149.1	-58.1	-164.2	133.2	0	0	108.4
237	P	34.4	Very low	26.4	Very low	104 Å²	104	126.5 Å²	126.5	68%	0.675	71%	0.708	S	S	*	*			cis	-128.2	-151.1	-10	29.1	-6	0	0	0	111.5
238	I	28.1	Very low	26.2	Very low	131 Å²	131	131.2 Å²	131.2	67%	0.672	72%	0.716	S	S	*	*			trans	134	101.4	138.5	-73.1	161.4	0	0	0	113.9
239	K	28.3	Very low	25.9	Very low	169 Å²	169	128.8 Å²	128.8	74%	0.735	71%	0.71	S	S	*	*			trans	65.1	159.1	143.6	-64.2	177.4	-173.1	176.2	0	117.9
240	Q	26.2	Very low	26.1	Very low	147 Å²	147	125.1 Å²	125.1	69%	0.687	70%	0.704	S	S	*	*			cis	-165.4	171.8	-27.5	-109.1	167.7	-30.2	0	0	105.2
241	T	25.6	Very low	26.2	Very low	117 Å²	117	121.4 Å²	121.4	72%	0.718	68%	0.683	S	S	*	*			trans	40.8	132.1	146.6	56	0	0	0	0	120
242	L	26.5	Very low	26.2	Very low	143 Å²	143	124.2 Å²	124.2	75%	0.749	69%	0.692	S	S	*	*			cis	-177.8	153.7	45.1	-131.2	156	0	0	0	110.2
243	S	26.5	Very low	26.3	Very low	62 Å²	62	125.6 Å²	125.6	43%	0.434	69%	0.691	S	S	.	*			trans	62	166.8	148	55	0	0	0	0	121.8
244	S	26.3	Very low	26.4	Very low	85 Å²	85	124 Å²	124	59%	0.594	69%	0.691	S	S	*	*				176.4	149.4	-52.6	57.3	0	0	0	0	111.7
245	S	23.7	Very low	26.4	Very low	109 Å²	109	125.5 Å²	125.5	76%	0.762	69%	0.694	S	S	*	*			trans	66.9	160.4	141.3	-63.9	0	0	0	0	121.2
246	P	31.7	Very low	26.5	Very low	113 Å²	113	123.5 Å²	123.5	73%	0.734	69%	0.688	S	S	*	*			trans	-105.1	-175.4	174.5	42	-35.7	0	0	0	113.1
247	S	23	Very low	26.9	Very low	97 Å²	97	122.3 Å²	122.3	68%	0.678	69%	0.687	S	S	*	*			trans	80.5	142.1	151.4	80.4	0	0	0	0	120.7
248	I	23.8	Very low	26.7	Very low	163 Å²	163	120 Å²	120	84%	0.836	68%	0.682	S	S	*	*			trans	69.8	166.1	140.9	-70	167.5	0	0	0	118
249	S	20.7	Very low	26.7	Very low	90 Å²	90	123.1 Å²	123.1	63%	0.629	69%	0.691	S	S	*	*			trans	-86.6	-177.4	-158.7	58.9	0	0	0	0	116
250	T	28	Very low	26.7	Very low	113 Å²	113	120.9 Å²	120.9	69%	0.693	69%	0.687	S	S	*	*			trans	67.4	107.2	154.1	37.2	0	0	0	0	116.3
251	K	25.2	Very low	26.7	Very low	100 Å²	100	120.4 Å²	120.4	44%	0.435	69%	0.688	S	S	.	*				67.8	105.4	69.3	-71	-175.4	177	175.1	0	114.6	T1408	K251-T1408 VanDerWaalsContact CE-OG1 3.22Å; K251-T1408 WeakPolarHBondContact CE-OG1 3.25Å; K251-T1408 PolarHBondContact NZ-OG1 3.06Å
252	C	27.5	Very low	26.7	Very low	117 Å²	117	119.8 Å²	119.8	79%	0.791	69%	0.688	S	S	*	*				-147.3	138.8	127.3	-95.9	0	0	0	0	106.6
253	I	27.2	Very low	26.6	Very low	119 Å²	119	117.3 Å²	117.3	61%	0.61	68%	0.683	S	S	*	*			cis	71.5	133.3	36.1	-54	170	0	0	0	109.9
254	H	27.7	Very low	26.6	Very low	168 Å²	168	120.3 Å²	120.3	78%	0.778	69%	0.694	S	S	*	*			cis	-112.2	-169.1	4.4	-85.8	-63.8	0	0	0	109.7
255	L	27.9	Very low	26.4	Very low	136 Å²	136	123 Å²	123	71%	0.712	70%	0.702	S	S	*	*			cis	-172.2	162.1	-18.6	-103.7	166.9	0	0	0	104.9
256	L	28.3	Very low	26.6	Very low	137 Å²	137	125.3 Å²	125.3	72%	0.717	70%	0.704	S	S	*	*			cis	-126.9	-161.1	-3.9	-88.5	161.4	0	0	0	106
257	N	28.9	Very low	26.1	Very low	148 Å²	148	124.7 Å²	124.7	79%	0.791	70%	0.702	S	S	*	*			cis	-158.5	169.5	-6.2	-130.8	-12.8	0	0	0	106.4
258	G	28.9	Very low	26.2	Very low	55 Å²	55	128.1 Å²	128.1	57%	0.567	71%	0.707	S	S	*	*			cis	164.5	124.3	-13	0	0	0	0	0	112.7
259	K	29.6	Very low	26.3	Very low	197 Å²	197	126.2 Å²	126.2	86%	0.857	70%	0.699	S	S	*	*			trans	70.1	150.3	171.2	-65.8	-176.9	179.8	179.5	0	115.6
260	N	27.3	Very low	26.5	Very low	123 Å²	123	129.5 Å²	129.5	66%	0.658	71%	0.71	S	S	*	*			cis	-159.8	151.5	8.1	-123.6	4	0	0	0	113.8
261	I	26.9	Very low	26.3	Very low	136 Å²	136	132.1 Å²	132.1	70%	0.697	72%	0.716	S	S	*	*			trans	75.1	125.8	139.4	-67.9	167.2	0	0	0	122.8
262	S	26.2	Very low	26.3	Very low	104 Å²	104	133.7 Å²	133.7	73%	0.727	73%	0.729	S	S	*	*			trans	59.9	155.5	152.1	67.6	0	0	0	0	122.2
263	S	23.8	Very low	26.3	Very low	91 Å²	91	138.4 Å²	138.4	64%	0.636	73%	0.732	S	S	*	*			cis	-169.6	171.2	-32.1	61	0	0	0	0	108.9
264	D	26.5	Very low	26.1	Very low	125 Å²	125	141.3 Å²	141.3	67%	0.668	75%	0.748	S	S	*	*			trans	65.8	118.4	161.7	-61.3	-62.1	0	0	0	118.1
265	N	22.6	Very low	26	Very low	141 Å²	141	143.7 Å²	143.7	75%	0.754	75%	0.75	S	S	*	*				91.6	152.7	60.8	-82.9	-46.9	0	0	0	113.7
266	I	26.2	Very low	25.9	Very low	159 Å²	159	141.5 Å²	141.5	82%	0.815	75%	0.746	S	S	*	*			trans	78.8	112.5	175.3	-55.1	175.3	0	0	0	116.4
267	S	22.2	Very low	25.9	Very low	100 Å²	100	143.1 Å²	143.1	70%	0.699	75%	0.753	S	S	*	*			trans	-74.7	145.3	160.9	53.6	0	0	0	0	112.3
268	Q	25.8	Very low	25.7	Very low	168 Å²	168	147.7 Å²	147.7	79%	0.785	76%	0.76	S	S	*	*			trans	-173.3	138.3	137.1	-104.9	161.7	8.7	0	0	114.1
269	N	25.2	Very low	25.6	Very low	124 Å²	124	154.7 Å²	154.7	66%	0.663	78%	0.775	S	S	*	*			trans	53.4	115.4	141.4	-53	-2.9	0	0	0	121.5	M271	N269-M271 PolarHBondContact O-N 3.26Å
270	D	23.9	Very low	25.4	Very low	159 Å²	159	157.3 Å²	157.3	85%	0.85	78%	0.779	S	S	*	*				45.3	63.1	124.3	-59	-23.7	0	0	0	119.9
271	M	25.1	Very low	25.4	Very low	167 Å²	167	159.7 Å²	159.7	82%	0.823	79%	0.786	S	S	*	*			trans	-147.1	18.3	163.7	-112.9	-56.9	175.3	0	0	117.5	N269	N269-M271 PolarHBondContact O-N 3.26Å
272	N	25.1	Very low	25.3	Very low	133 Å²	133	163.6 Å²	163.6	71%	0.711	79%	0.792	S	S	*	*	S	Bend	trans	-124.2	-9	-175.7	-86.9	-51.5	0	0	0	118.2	L274	N272-L274 VanDerWaalsContact C-N 3.34Å; N272-L274 PolarHBondContact O-N 3.46Å
273	Y	26.6	Very low	25.2	Very low	217 Å²	217	165.9 Å²	165.9	85%	0.851	80%	0.796	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-8.1	-179.5	-141.5	-106.9	0	0	0	114.9
274	L	23.4	Very low	25.3	Very low	179 Å²	179	169.7 Å²	169.7	94%	0.937	81%	0.808	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	28.7	-179.9	-73.8	175.6	0	0	0	114.6	N272	N272-L274 VanDerWaalsContact C-N 3.34Å; N272-L274 PolarHBondContact O-N 3.46Å
275	R	26	Very low	25.2	Very low	218 Å²	218	171.8 Å²	171.8	82%	0.823	81%	0.811	S	S	*	*	S	Bend	trans	-117.9	-3.5	173.5	-92.8	-178.1	174.5	173.2	0.7	116.1
276	S	26.4	Very low	25.4	Very low	90 Å²	90	175.2 Å²	175.2	63%	0.629	81%	0.813	S	S	*	*	S	Bend	trans	-108.9	4.1	-166.7	46.6	0	0	0	0	117.1
277	I	28.5	Very low	25.3	Very low	171 Å²	171	176.9 Å²	176.9	88%	0.877	82%	0.818	S	S	*	*	S	Bend	trans	-129.7	22.6	175.1	-95.8	156.3	0	0	0	114.5
278	R	23.6	Very low	25.5	Very low	244 Å²	244	183.5 Å²	183.5	92%	0.921	83%	0.827	S	S	*	*	S	Bend	trans	-124.1	45.1	168.6	-91.6	-171.7	177.5	157.8	2	114.6
279	K	27.2	Very low	25.4	Very low	203 Å²	203	180.7 Å²	180.7	88%	0.883	83%	0.826	S	S	*	*			trans	-151.3	50.1	171.1	-125.8	172.7	-172.9	180	0	115.6
280	R	25.5	Very low	25.5	Very low	252 Å²	252	179.3 Å²	179.3	95%	0.951	83%	0.826	S	S	*	*			trans	-138.5	40	167.1	-123.5	174	-168.8	164.5	3.8	115.4
281	Q	26.3	Very low	25.7	Very low	172 Å²	172	180.6 Å²	180.6	80%	0.804	82%	0.824	S	S	*	*	S	Bend	trans	-111.4	140.7	152.4	-77.4	-166.6	-5.2	0	0	109.6
282	R	25	Very low	25.7	Very low	219 Å²	219	177.3 Å²	177.3	83%	0.826	82%	0.817	S	S	*	*	S	Bend	trans	62.1	92.4	173	-57.9	177.9	-174.4	151.5	4.3	116.1
283	N	25.6	Very low	25.8	Very low	151 Å²	151	179.9 Å²	179.9	81%	0.807	82%	0.823	S	S	*	*				-178.8	103.4	99.3	-88.9	-12.8	0	0	0	113.3
284	I	25.3	Very low	25.8	Very low	172 Å²	172	174.8 Å²	174.8	88%	0.882	81%	0.814	S	S	*	*			trans	-136.9	77.2	152.3	-55	-177.2	0	0	0	108.9
285	K	24.8	Very low	26.1	Very low	169 Å²	169	173.6 Å²	173.6	74%	0.735	80%	0.803	S	S	*	*			trans	-160.5	135.1	158.6	-80.7	-165.5	-178.5	171.1	0	105.3
286	R	25.6	Very low	26.1	Very low	213 Å²	213	173.6 Å²	173.6	80%	0.804	81%	0.805	S	S	*	*			cis	-158.1	149.2	-8.2	-90.5	160.5	170.3	170.2	-8.7	105.3
287	Q	24.3	Very low	25.9	Very low	194 Å²	194	174.5 Å²	174.5	91%	0.907	81%	0.811	S	S	*	*			trans	-145.5	112.6	158.2	-82.6	-153.3	2.9	0	0	114
288	R	25.8	Very low	26.3	Very low	239 Å²	239	171.4 Å²	171.4	90%	0.902	80%	0.802	S	S	*	*			trans	-164.7	101.4	132.2	-101.7	172.2	-174.6	-171.4	0.4	104
289	S	24.9	Very low	26.2	Very low	108 Å²	108	167.5 Å²	167.5	76%	0.755	80%	0.795	S	S	*	*				76	134.3	98.7	65.3	0	0	0	0	112.1
290	S	26.9	Very low	26.1	Very low	95 Å²	95	164.3 Å²	164.3	66%	0.664	79%	0.787	S	S	*	*			cis	-159.7	165	33.8	67.7	0	0	0	0	114.7
291	K	27.8	Very low	26.1	Very low	187 Å²	187	159 Å²	159	81%	0.813	78%	0.777	S	S	*	*			trans	68.2	103.4	158.4	-68.7	170.3	-178.4	-179.1	0	116.2
292	S	24.6	Very low	26	Very low	98 Å²	98	156.2 Å²	156.2	69%	0.685	78%	0.775	S	S	*	*				85.6	134	76.6	68.2	0	0	0	0	112.2
293	F	26.9	Very low	26.1	Very low	187 Å²	187	156.5 Å²	156.5	82%	0.82	78%	0.776	S	S	*	*			cis	-148.8	170.5	37.6	-115.4	-92.5	0	0	0	112.3
294	T	28.3	Very low	26.2	Very low	110 Å²	110	155.7 Å²	155.7	68%	0.675	77%	0.772	S	S	*	*			trans	54.3	151.1	164.8	59.7	0	0	0	0	119.5
295	H	28.4	Very low	26.3	Very low	153 Å²	153	154.2 Å²	154.2	71%	0.708	77%	0.766	S	S	*	*			cis	-152.1	139.9	-22.4	-116.3	-44.3	0	0	0	111
296	Y	27	Very low	26.4	Very low	219 Å²	219	153.7 Å²	153.7	86%	0.859	77%	0.771	S	S	*	*			trans	59	166.1	157.1	-83	-70	0	0	0	122.4
297	S	21.9	Very low	26.5	Very low	108 Å²	108	153 Å²	153	76%	0.755	77%	0.77	S	S	*	*			trans	-147.7	-163.5	-169.5	-147.6	0	0	0	0	109.1
298	P	36.3	Very low	26.6	Very low	106 Å²	106	150.8 Å²	150.8	69%	0.688	76%	0.761	S	S	*	*				-113.8	-169.6	-123.2	37.8	-19.7	0	0	0	115.3
299	Q	22.1	Very low	26.8	Very low	163 Å²	163	144.1 Å²	144.1	76%	0.762	75%	0.751	S	S	*	*			trans	79.4	118.1	176.3	-51.1	176.8	-10.8	0	0	115.9
300	N	25	Very low	26.9	Very low	135 Å²	135	149 Å²	149	72%	0.722	76%	0.755	S	S	*	*				172.6	156	103.6	-92.9	-57.4	0	0	0	115.2
301	L	24.5	Very low	27	Very low	141 Å²	141	151.9 Å²	151.9	74%	0.738	76%	0.757	S	S	*	*			trans	28.5	127.6	141.9	-63	160.1	0	0	0	122.6
302	C	25.2	Very low	26.9	Very low	114 Å²	114	150.4 Å²	150.4	77%	0.77	75%	0.751	S	S	*	*			trans	74	144.3	132.6	-65.7	0	0	0	0	123.3
303	R	27.3	Very low	26.9	Very low	224 Å²	224	151.7 Å²	151.7	85%	0.845	75%	0.751	S	S	*	*			trans	71.6	91.8	156.9	-76.9	-177.1	168.3	164.8	-1.9	120.1
304	D	26.6	Very low	26.8	Very low	134 Å²	134	148 Å²	148	72%	0.717	74%	0.744	S	S	*	*				57	143.3	109.1	-48.7	-26.3	0	0	0	122.3
305	N	27.9	Very low	26.5	Very low	141 Å²	141	152.3 Å²	152.3	75%	0.754	75%	0.753	S	S	*	*			trans	71.8	79	159.1	-59.8	-26.9	0	0	0	118.1
306	N	28.3	Very low	26.3	Very low	159 Å²	159	153.9 Å²	153.9	85%	0.85	76%	0.758	S	S	*	*				-150.9	153	107	-105.2	-40.9	0	0	0	114.3
307	Y	27.5	Very low	26.1	Very low	197 Å²	197	154.5 Å²	154.5	77%	0.773	76%	0.759	S	S	*	*			trans	-62.8	153.9	-177.8	-71.6	-116.2	0	0	0	112
308	M	25.9	Very low	26.1	Very low	149 Å²	149	153.7 Å²	153.7	73%	0.734	75%	0.753	S	S	*	*			cis	-160.8	174.2	0.8	-126.6	-71.8	174.3	0	0	111.3
309	S	29.3	Very low	25.5	Very low	99 Å²	99	156.7 Å²	156.7	69%	0.692	76%	0.762	S	S	*	*			trans	89.6	79.2	162.6	-160.2	0	0	0	0	120.4
310	Y	28.1	Very low	25.5	Very low	211 Å²	211	154 Å²	154	83%	0.827	76%	0.761	S	S	*	*			trans	60.2	80	137.4	-68.6	-73.8	0	0	0	122.3
311	H	27.4	Very low	25.5	Very low	154 Å²	154	157.9 Å²	157.9	71%	0.713	77%	0.767	S	S	*	*			trans	-64	167.9	131.2	-103.3	-111.3	0	0	0	111.2
312	F	26.3	Very low	25.6	Very low	156 Å²	156	159 Å²	159	68%	0.684	77%	0.769	S	S	*	*			cis	-168.3	165.8	-14.2	-144.4	-139.3	0	0	0	110.9
313	D	24.3	Very low	25.6	Very low	126 Å²	126	161.4 Å²	161.4	67%	0.674	77%	0.769	S	S	*	*			trans	56	153.4	144	-90.7	3.9	0	0	0	127.6
314	T	24.7	Very low	25.7	Very low	110 Å²	110	155 Å²	155	68%	0.675	75%	0.75	S	S	*	*			trans	-55	157.3	176.4	53.4	0	0	0	0	118.2
315	F	23.2	Very low	25.7	Very low	200 Å²	200	153.1 Å²	153.1	88%	0.877	74%	0.736	S	S	*	*				-159.6	-177.8	120.4	-130.9	-104.8	0	0	0	114.1
316	K	24	Very low	25.7	Very low	185 Å²	185	153.4 Å²	153.4	80%	0.804	73%	0.731	S	S	*	*			trans	-94.7	163.4	-175.4	-67.3	179.3	174.8	178.6	0	114.4
317	R	23.3	Very low	25.6	Very low	233 Å²	233	147.5 Å²	147.5	88%	0.879	70%	0.699	S	S	*	*			trans	106.6	129.9	131.5	-137	-172.6	-170	167	-0	118.7
318	S	22	Very low	25.8	Very low	90 Å²	90	145.8 Å²	145.8	63%	0.629	70%	0.696	S	S	*	*			trans	51.7	120.2	142.3	57.4	0	0	0	0	123.8
319	L	22.3	Very low	25.9	Very low	170 Å²	170	143 Å²	143	89%	0.89	68%	0.684	S	S	*	*			trans	60.6	166.7	133.9	-106.4	77	0	0	0	122.5
320	S	23.5	Very low	26.1	Very low	106 Å²	106	143.9 Å²	143.9	74%	0.741	69%	0.687	S	S	*	*			trans	58.7	92.4	164.7	51.5	0	0	0	0	120.4
321	Y	24.1	Very low	26.2	Very low	216 Å²	216	140.5 Å²	140.5	85%	0.847	68%	0.683	S	S	*	*				29.4	150.3	116.7	-106.5	-92.9	0	0	0	123.5
322	Q	26.5	Very low	26.1	Very low	165 Å²	165	138.1 Å²	138.1	77%	0.771	68%	0.684	S	S	*	*			trans	77.6	118.2	175	-57.5	-174.7	-8.9	0	0	114.9
323	Q	26	Very low	26.2	Very low	165 Å²	165	136.8 Å²	136.8	77%	0.771	69%	0.689	S	S	*	*				74.5	135	51.9	-62	-179.8	-20.2	0	0	112.4
324	I	29.1	Very low	26.4	Very low	89 Å²	89	138.1 Å²	138.1	46%	0.456	70%	0.696	S	S	.	*				-148	-168.2	56.6	-78.5	161.2	0	0	0	111.5	S339 S340	I324-S339 CarbonylContact O-C 3.36Å; I324-S339 VanDerWaalsContact O-CB 3.22Å; I324-S339 WeakPolarHBondContact O-CB 3.43Å; I324-S340 PolarHBondContact O-N 3.49Å
325	K	26.4	Very low	26.5	Very low	94 Å²	94	137.4 Å²	137.4	41%	0.409	70%	0.695	S	S	.	*			trans	-103.4	154.3	170.2	-66.5	-166.6	154.8	-147.6	0	112.1	L336 L337 S339 S340	K325-L336 PolarHBondContact NZ-O 2.95Å; K325-L336 VanDerWaalsContact NZ-O 3.08Å; K325-L337 WeakPolarHBondContact CD-O 3.35Å; K325-L337 WeakPolarHBondContact CE-O 3.5Å; K325-L337 PolarHBondContact NZ-O 3.41Å; K325-S339 CarbonylContact C-O 3.54Å; K325-S340 VanDerWaalsContact C-N 3.33Å; K325-S340 CarbonylContact C-O 3.49Å; K325-S340 CarbonylContact O-C 3.57Å; K325-S340 VanDerWaalsContact O-C 3.27Å
326	F	28.6	Very low	26.7	Very low	147 Å²	147	130.7 Å²	130.7	65%	0.645	67%	0.668	S	S	*	*				-164.5	-175.1	60.8	-78.5	-90.2	0	0	0	112.9	S338 S339 S340	F326-S338 CarbonylContact C-O 3.47Å; F326-S338 CarbonylContact O-C 3.48Å; F326-S339 PolarHBondContact N-O 2.88Å; F326-S339 PolarHBondContact O-N 3.2Å; F326-S339 VanDerWaalsContact O-N 3.08Å; F326-S340 PolarHBondContact N-O 3.25Å
327	N	25.9	Very low	26.9	Very low	36 Å²	36	126.5 Å²	126.5	19%	0.193	65%	0.654	C	S	.	*				158.4	120.6	-57.4	162.8	25.2	0	0	0	113.2	L336 L337 S338	N327-L336 WeakPolarHBondContact ND2-CB 3.28Å; N327-L336 WeakPolarHBondContact OD1-CB 3.37Å; N327-L337 WeakPolarHBondContact CB-O 3.39Å; N327-L337 VanDerWaalsContact CG-O 3.28Å; N327-L337 PolarHBondContact ND2-N 3.15Å; N327-L337 VanDerWaalsContact ND2-N 3.11Å; N327-L337 PolarHBondContact ND2-O 3.15Å; N327-L337 WeakPolarHBondContact OD1-CD1 3.47Å; N327-L337 PolarHBondContact OD1-N 2.95Å; N327-S338 WeakPolarHBondContact CA-O 3.42Å; N327-S338 VanDerWaalsContact CB-O 3.3Å; N327-S338 WeakPolarHBondContact CB-O 3.29Å; N327-S338 PolarHBondContact N-O 3.33Å
328	K	31.9	Very low	26.9	Very low	161 Å²	161	118 Å²	118	70%	0.7	63%	0.631	S	S	*	*			trans	-179.7	153.3	136	-98.3	153.2	-154.6	-154.8	0	121.3	L336	K328-L336 HydrophobicContact CB-CD2 4.24Å; K328-L336 HydrophobicContact CD-CD1 4.17Å; K328-L336 HydrophobicContact CG-CB 4.43Å; K328-L336 HydrophobicContact CG-CD1 3.69Å; K328-L336 HydrophobicContact CG-CD2 3.58Å; K328-L336 HydrophobicContact CG-CG 4.08Å
329	N	26.7	Very low	27	Very low	91 Å²	91	117.1 Å²	117.1	49%	0.487	62%	0.624	S	S	.	*			trans	-79.3	178.6	177.8	-59.3	-0.6	0	0	0	113.7	L336 L337	N329-L336 HydrophobicContact CB-CD2 3.79Å; N329-L336 VanDerWaalsContact OD1-CD2 3.27Å; N329-L336 WeakPolarHBondContact OD1-CD2 3.35Å; N329-L337 WeakPolarHBondContact OD1-CD1 3.35Å
330	P	34	Very low	27.1	Very low	116 Å²	116	112.6 Å²	112.6	75%	0.753	61%	0.607	S	S	*	*				-144	126.1	95.9	36.5	-21.5	0	0	0	116.6
331	N	29.1	Very low	27.1	Very low	141 Å²	141	111.3 Å²	111.3	75%	0.754	60%	0.598	S	S	*	*	S	Bend		-178.7	146.9	117.1	-94.1	-21.2	0	0	0	111.4
332	S	26.8	Very low	27	Very low	103 Å²	103	105.6 Å²	105.6	72%	0.72	59%	0.589	S	S	*	*	S	Bend	trans	51.7	121.3	176.8	44.8	0	0	0	0	118.6
333	T	27.9	Very low	26.9	Very low	128 Å²	128	103.5 Å²	103.5	79%	0.785	59%	0.587	S	S	*	*	S	Bend	trans	56.1	75.6	160.4	55.8	0	0	0	0	118.3
334	N	27.4	Very low	26.8	Very low	155 Å²	155	102.4 Å²	102.4	83%	0.829	59%	0.587	S	S	*	*			trans	27.3	130	135	-47.2	-13.6	0	0	0	120.6
335	S	28.3	Very low	26.8	Very low	94 Å²	94	105.8 Å²	105.8	66%	0.657	61%	0.605	S	S	*	*			cis	-166.1	100.7	-12.3	42	0	0	0	0	115.8
336	L	27.6	Very low	26.6	Very low	59 Å²	59	108.2 Å²	108.2	31%	0.309	62%	0.623	S	S	.	*				89.8	140.6	121.8	-60.4	160.6	0	0	0	122.4	K325 N327 K328 N329	K325-L336 PolarHBondContact NZ-O 2.95Å; K325-L336 VanDerWaalsContact NZ-O 3.08Å; N327-L336 WeakPolarHBondContact ND2-CB 3.28Å; N327-L336 WeakPolarHBondContact OD1-CB 3.37Å; K328-L336 HydrophobicContact CB-CD2 4.24Å; K328-L336 HydrophobicContact CD-CD1 4.17Å; K328-L336 HydrophobicContact CG-CB 4.43Å; K328-L336 HydrophobicContact CG-CD1 3.69Å; K328-L336 HydrophobicContact CG-CD2 3.58Å; K328-L336 HydrophobicContact CG-CG 4.08Å; N329-L336 HydrophobicContact CB-CD2 3.79Å; N329-L336 VanDerWaalsContact OD1-CD2 3.27Å; N329-L336 WeakPolarHBondContact OD1-CD2 3.35Å
337	L	26.5	Very low	26.5	Very low	98 Å²	98	109.5 Å²	109.5	51%	0.513	63%	0.631	S	S	.	*			trans	-91.3	-151.8	-156.7	-42.7	86.8	0	0	0	117.9	K325 N327 N329	K325-L337 WeakPolarHBondContact CD-O 3.35Å; K325-L337 WeakPolarHBondContact CE-O 3.5Å; K325-L337 PolarHBondContact NZ-O 3.41Å; N327-L337 WeakPolarHBondContact CB-O 3.39Å; N327-L337 VanDerWaalsContact CG-O 3.28Å; N327-L337 PolarHBondContact ND2-N 3.15Å; N327-L337 VanDerWaalsContact ND2-N 3.11Å; N327-L337 PolarHBondContact ND2-O 3.15Å; N327-L337 WeakPolarHBondContact OD1-CD1 3.47Å; N327-L337 PolarHBondContact OD1-N 2.95Å; N329-L337 WeakPolarHBondContact OD1-CD1 3.35Å
338	S	23.7	Very low	26.4	Very low	55 Å²	55	114.6 Å²	114.6	39%	0.385	66%	0.658	S	S	.	*			trans	-111.6	-162.2	170.4	61.8	0	0	0	0	110.7	F326 N327	F326-S338 CarbonylContact C-O 3.47Å; F326-S338 CarbonylContact O-C 3.48Å; N327-S338 WeakPolarHBondContact CA-O 3.42Å; N327-S338 VanDerWaalsContact CB-O 3.3Å; N327-S338 WeakPolarHBondContact CB-O 3.29Å; N327-S338 PolarHBondContact N-O 3.33Å
339	S	24.2	Very low	26.1	Very low	70 Å²	70	115.7 Å²	115.7	49%	0.49	66%	0.663	S	S	.	*			cis	-108.7	140.4	5.1	30.5	0	0	0	0	121.1	I324 K325 F326	I324-S339 CarbonylContact O-C 3.36Å; I324-S339 VanDerWaalsContact O-CB 3.22Å; I324-S339 WeakPolarHBondContact O-CB 3.43Å; K325-S339 CarbonylContact C-O 3.54Å; F326-S339 PolarHBondContact N-O 2.88Å; F326-S339 PolarHBondContact O-N 3.2Å; F326-S339 VanDerWaalsContact O-N 3.08Å
340	S	24.1	Very low	26	Very low	75 Å²	75	118.3 Å²	118.3	52%	0.524	67%	0.672	S	S	.	*			trans	61.6	153.8	155.1	31.2	0	0	0	0	120.9	I324 K325 F326	I324-S340 PolarHBondContact O-N 3.49Å; K325-S340 VanDerWaalsContact C-N 3.33Å; K325-S340 CarbonylContact C-O 3.49Å; K325-S340 CarbonylContact O-C 3.57Å; K325-S340 VanDerWaalsContact O-C 3.27Å; F326-S340 PolarHBondContact N-O 3.25Å
341	S	23.5	Very low	25.6	Very low	79 Å²	79	121.9 Å²	121.9	55%	0.552	67%	0.672	S	S	*	*			cis	-177.8	164.4	-15.4	51	0	0	0	0	113.6
342	S	22.6	Very low	25.3	Very low	96 Å²	96	118.9 Å²	118.9	67%	0.671	66%	0.662	S	S	*	*			trans	85	155.5	154.2	82.4	0	0	0	0	122.1
343	V	25.4	Very low	25.2	Very low	121 Å²	121	122.2 Å²	122.2	73%	0.733	66%	0.664	S	S	*	*			trans	75.8	108.2	160.9	-178.5	0	0	0	0	120.7
344	N	23.6	Very low	25.1	Very low	143 Å²	143	122.5 Å²	122.5	77%	0.765	66%	0.661	S	S	*	*			trans	69.9	148.9	143.2	-80.1	-4.3	0	0	0	125.6
345	L	27.5	Very low	25.2	Very low	160 Å²	160	123 Å²	123	84%	0.838	66%	0.655	S	S	*	*			trans	83.6	156	148.6	-77.5	161.3	0	0	0	121.1
346	N	22.3	Very low	25.1	Very low	144 Å²	144	123.7 Å²	123.7	77%	0.77	66%	0.66	S	S	*	*			trans	-91.8	-171.3	-174	-72.4	-31	0	0	0	111.8
347	E	27	Very low	25.1	Very low	175 Å²	175	128.1 Å²	128.1	82%	0.818	68%	0.677	S	S	*	*			trans	81.5	118	167.9	-58.4	167.8	-163.3	0	0	113.3
348	N	23.4	Very low	25.2	Very low	143 Å²	143	130 Å²	130	77%	0.765	68%	0.683	S	S	*	*			cis	79	147.7	48.5	-71.2	-14.4	0	0	0	114.4
349	F	26.7	Very low	25.3	Very low	184 Å²	184	134 Å²	134	81%	0.807	70%	0.7	S	S	*	*			trans	67	109.9	-170.6	-59.3	-79.3	0	0	0	114.1
350	E	23.9	Very low	25.2	Very low	146 Å²	146	135.7 Å²	135.7	68%	0.682	71%	0.712	S	S	*	*			cis	83.5	123.1	43.4	-67	-145.8	116.9	0	0	116.1
351	Y	25.2	Very low	25.3	Very low	190 Å²	190	138.4 Å²	138.4	75%	0.745	73%	0.725	S	S	*	*			trans	67.9	159.6	144	-82	-130.8	0	0	0	120.4
352	S	23.4	Very low	25.3	Very low	78 Å²	78	143.6 Å²	143.6	55%	0.545	74%	0.738	S	S	.	*			cis	-166.3	159.9	-42.5	73.9	0	0	0	0	111.5
353	K	25.2	Very low	25.4	Very low	174 Å²	174	145.9 Å²	145.9	76%	0.757	74%	0.741	S	S	*	*			trans	47.1	127.4	143.4	-67	164.2	-179.6	169.1	0	121.1
354	N	25.7	Very low	25.3	Very low	134 Å²	134	145.6 Å²	145.6	72%	0.717	74%	0.74	S	S	*	*			trans	-174.8	152.8	136.8	-87.8	-45	0	0	0	107.3
355	K	28.4	Very low	25.3	Very low	165 Å²	165	147.5 Å²	147.5	72%	0.717	74%	0.744	S	S	*	*			cis	-155.4	158.3	-15.1	-101.4	152.5	-179.3	139	0	104.3
356	S	27.3	Very low	25	Very low	108 Å²	108	145 Å²	145	76%	0.755	74%	0.74	S	S	*	*			cis	-149	163.9	43.5	55.4	0	0	0	0	110.3
357	K	28.2	Very low	25.1	Very low	152 Å²	152	146 Å²	146	66%	0.661	74%	0.74	S	S	*	*			cis	70.1	135.8	37.4	-69.7	-176.6	150	-129.9	0	113.1
358	Q	26.9	Very low	25	Very low	138 Å²	138	143.1 Å²	143.1	65%	0.645	73%	0.734	S	S	*	*			cis	-156.3	162.9	4.5	-122.5	166.9	-90.4	0	0	108.2
359	N	27.8	Very low	25.1	Very low	139 Å²	139	143.6 Å²	143.6	74%	0.743	73%	0.731	S	S	*	*			cis	-161.9	178.3	46.9	-98.3	-30.1	0	0	0	112.8
360	S	21.7	Very low	25.2	Very low	106 Å²	106	144.5 Å²	144.5	74%	0.741	74%	0.738	S	S	*	*			trans	-80.8	167.9	178.2	50.8	0	0	0	0	114.4
361	V	25.4	Very low	25.3	Very low	131 Å²	131	141.4 Å²	141.4	79%	0.794	73%	0.729	S	S	*	*				-159.4	171.4	70.9	164.3	0	0	0	0	112.7
362	F	22.7	Very low	25.5	Very low	188 Å²	188	137.9 Å²	137.9	83%	0.825	73%	0.732	S	S	*	*			trans	-58.6	160.8	-172	-81.9	-98.4	0	0	0	120.8
363	I	25.3	Very low	25.5	Very low	144 Å²	144	144.6 Å²	144.6	74%	0.738	75%	0.747	S	S	*	*			trans	92.2	126.8	141	-81.7	160.8	0	0	0	121.7
364	T	23.7	Very low	25.4	Very low	116 Å²	116	142.7 Å²	142.7	71%	0.712	75%	0.745	S	S	*	*			trans	24.5	120.8	162.3	61.7	0	0	0	0	124.2
365	E	23.3	Very low	25.5	Very low	183 Å²	183	143.1 Å²	143.1	86%	0.855	75%	0.746	S	S	*	*				59.5	143.1	129.5	-62.4	-158.8	136.1	0	0	124.7
366	S	22.1	Very low	25.3	Very low	106 Å²	106	144 Å²	144	74%	0.741	75%	0.75	S	S	*	*			trans	94	147.3	152.6	81.7	0	0	0	0	119.5
367	H	24.4	Very low	25.2	Very low	167 Å²	167	147.8 Å²	147.8	77%	0.773	75%	0.749	S	S	*	*			trans	57.9	105.2	177.8	-65.3	-81.8	0	0	0	116.8
368	V	24.9	Very low	25	Very low	114 Å²	114	148.8 Å²	148.8	69%	0.691	75%	0.754	S	S	*	*				55.8	109.5	55	-168.6	0	0	0	0	109.4
369	Q	25	Very low	24.9	Very low	153 Å²	153	150.4 Å²	150.4	72%	0.715	76%	0.759	S	S	*	*				-173.4	133.3	75.4	-155	159	9	0	0	113.9	T371	Q369-T371 HydrophobicContact CG-CG2 3.62Å; Q369-T371 VanDerWaalsContact CG-OG1 3.29Å; Q369-T371 WeakPolarHBondContact CG-OG1 3.4Å; Q369-T371 PolarHBondContact NE2-OG1 3.26Å; Q369-T371 VanDerWaalsContact NE2-OG1 3.16Å
370	Q	29.7	Very low	24.9	Very low	202 Å²	202	149 Å²	149	94%	0.944	75%	0.751	S	S	*	*			trans	-143.4	110.2	146.1	-123.7	-176.7	8.9	0	0	106.6
371	T	26	Very low	25.2	Very low	82 Å²	82	147.5 Å²	147.5	50%	0.503	74%	0.741	S	S	.	*			trans	-147.9	123.3	-158.8	53.8	0	0	0	0	114.6	Q369	Q369-T371 HydrophobicContact CG-CG2 3.62Å; Q369-T371 VanDerWaalsContact CG-OG1 3.29Å; Q369-T371 WeakPolarHBondContact CG-OG1 3.4Å; Q369-T371 PolarHBondContact NE2-OG1 3.26Å; Q369-T371 VanDerWaalsContact NE2-OG1 3.16Å
372	S	27.7	Very low	25.1	Very low	115 Å²	115	146.1 Å²	146.1	80%	0.804	74%	0.736	S	S	*	*			trans	-174.9	137.4	148.9	40.8	0	0	0	0	107.8
373	Y	24.8	Very low	25.2	Very low	219 Å²	219	142.6 Å²	142.6	86%	0.859	73%	0.725	S	S	*	*			cis	-109	144.3	0.8	-103.6	-108.1	0	0	0	112.4
374	N	22.8	Very low	25.1	Very low	134 Å²	134	138.2 Å²	138.2	72%	0.717	71%	0.707	S	S	*	*			trans	-93.4	153.8	151.9	-72.2	-54.8	0	0	0	108.5
375	I	27.3	Very low	25.3	Very low	144 Å²	144	139.5 Å²	139.5	74%	0.738	71%	0.708	S	S	*	*			trans	167.1	118.8	138.1	-90.1	155.5	0	0	0	110.8
376	F	24.9	Very low	25.3	Very low	183 Å²	183	138.1 Å²	138.1	80%	0.803	70%	0.702	S	S	*	*			trans	55.3	153.5	153.1	-77.1	-113.7	0	0	0	121.6
377	Y	23.8	Very low	25.3	Very low	188 Å²	188	141.8 Å²	141.8	74%	0.737	71%	0.705	S	S	*	*			trans	57	87.7	171.8	-80.9	-78.7	0	0	0	118.5	F379	Y377-F379 HydrophobicContact CD1-CB 4.1Å
378	F	24.9	Very low	25.2	Very low	172 Å²	172	143.2 Å²	143.2	75%	0.754	71%	0.705	S	S	*	*			trans	-164.3	89.7	143.8	-130	-93.8	0	0	0	109.5	S381	F378-S381 WeakPolarHBondContact CE1-O 3.31Å; F378-S381 WeakPolarHBondContact CZ-O 3.49Å
379	F	25.4	Very low	25.2	Very low	172 Å²	172	146.5 Å²	146.5	75%	0.754	71%	0.71	S	S	*	*	S	Bend	cis	56.9	88.2	0.4	-111.6	-68.8	0	0	0	116.4	Y377	Y377-F379 HydrophobicContact CD1-CB 4.1Å
380	L	26.2	Very low	25	Very low	110 Å²	110	147 Å²	147	58%	0.576	72%	0.715	S	S	*	*			trans	39.1	101.2	176.3	-87.6	69.9	0	0	0	113.7
381	S	28.7	Very low	24.8	Very low	75 Å²	75	144.1 Å²	144.1	52%	0.524	71%	0.711	S	S	.	*	S	Bend		-170.8	138	74.6	36.4	0	0	0	0	113.3	F378	F378-S381 WeakPolarHBondContact CE1-O 3.31Å; F378-S381 WeakPolarHBondContact CZ-O 3.49Å
382	C	24.4	Very low	24.7	Very low	102 Å²	102	147.1 Å²	147.1	69%	0.689	72%	0.723	S	S	*	*	S	Bend	cis	-141.1	142.7	-21.7	-75.8	0	0	0	0	105.3	S384	C382-S384 PolarHBondContact SG-OG 3.11Å
383	L	24.3	Very low	24.9	Very low	113 Å²	113	146 Å²	146	59%	0.592	71%	0.714	S	S	*	*			cis	-46.4	148.2	13.2	-58.7	179.2	0	0	0	116.2	I385 F387	L383-I385 VanDerWaalsContact CB-N 3.3Å; L383-F387 HydrophobicContact CD1-CB 4.41Å
384	S	22.7	Very low	24.7	Very low	52 Å²	52	144.3 Å²	144.3	36%	0.364	71%	0.711	S	S	.	*			cis	21.6	75	-6.8	47.7	0	0	0	0	119	C382	C382-S384 PolarHBondContact SG-OG 3.11Å
385	I	28.1	Very low	24.9	Very low	143 Å²	143	148 Å²	148	73%	0.733	72%	0.721	S	S	*	*	S	Bend		55.3	113.7	127.2	-58.1	152.7	0	0	0	115.9	L383	L383-I385 VanDerWaalsContact CB-N 3.3Å
386	E	24	Very low	24.8	Very low	155 Å²	155	145.1 Å²	145.1	72%	0.724	71%	0.714	S	S	*	*			cis	-155.8	154.1	2.4	-142.1	173.6	-155.7	0	0	111.5
387	F	20.7	Very low	24.6	Very low	183 Å²	183	144.9 Å²	144.9	80%	0.803	71%	0.709	S	S	*	*			trans	-124.6	92.7	172.3	-162.2	-73.7	0	0	0	108.7	L383	L383-F387 HydrophobicContact CD1-CB 4.41Å
388	Y	23.5	Very low	24.7	Very low	197 Å²	197	140.9 Å²	140.9	77%	0.773	69%	0.693	S	S	*	*			trans	-153.9	145.8	169.2	-113.5	-66	0	0	0	114.5
389	K	23.8	Very low	24.8	Very low	183 Å²	183	137.5 Å²	137.5	80%	0.796	68%	0.683	S	S	*	*			trans	68.1	71.6	163.5	-58.8	-174.7	-178.2	174.4	0	118.3
390	I	22.3	Very low	25.4	Very low	163 Å²	163	133.2 Å²	133.2	84%	0.836	67%	0.672	S	S	*	*				-132.3	93.3	119.6	-54.7	-179.3	0	0	0	109.5
391	V	25.1	Very low	25.3	Very low	141 Å²	141	134.7 Å²	134.7	86%	0.855	68%	0.681	S	S	*	*			trans	-149.8	146	134.9	-165.9	0	0	0	0	108.2
392	L	23.1	Very low	25.1	Very low	145 Å²	145	142.9 Å²	142.9	76%	0.759	70%	0.7	S	S	*	*			trans	-65.8	-177.1	168.7	-95.1	77.4	0	0	0	113
393	P	32	Very low	25	Very low	93 Å²	93	141.4 Å²	141.4	60%	0.604	70%	0.703	S	S	*	*			cis	-144.9	-168.4	-33.3	39.4	-20.9	0	0	0	114.7
394	F	21.7	Very low	25.1	Very low	183 Å²	183	144.3 Å²	144.3	80%	0.803	72%	0.717	S	S	*	*			trans	45.6	115.6	148.4	-68.3	-61.5	0	0	0	120.5
395	F	25.3	Very low	25.1	Very low	210 Å²	210	145.6 Å²	145.6	92%	0.921	73%	0.726	S	S	*	*				-161.9	179.4	99.7	-118	-86.5	0	0	0	112.8
396	S	25.3	Very low	25	Very low	84 Å²	84	147.1 Å²	147.1	59%	0.587	74%	0.735	S	S	*	*			trans	-81.2	125.4	-152.7	-175.5	0	0	0	0	118.1
397	Y	22.6	Very low	25	Very low	179 Å²	179	146.3 Å²	146.3	70%	0.702	73%	0.731	S	S	*	*				24.9	139.7	119.9	-107.5	-60.1	0	0	0	122.9
398	Y	25.3	Very low	25.1	Very low	103 Å²	103	143.9 Å²	143.9	40%	0.404	73%	0.726	S	S	.	*			trans	78.5	140.4	158.6	-88.2	-95.4	0	0	0	119.1	S1192	Y398-S1192 WeakPolarHBondContact OH-CA 3.38Å
399	N	26.4	Very low	25.1	Very low	101 Å²	101	139.8 Å²	139.8	54%	0.54	73%	0.725	S	S	.	*			cis	-172	-157.2	-29.6	-139.5	-16.2	0	0	0	107.9	S1195	N399-S1195 WeakPolarHBondContact CA-OG 3.26Å; N399-S1195 WeakPolarHBondContact CB-OG 3.39Å
400	P	37.2	Very low	25.1	Very low	82 Å²	82	136.4 Å²	136.4	53%	0.532	73%	0.725	S	S	.	*			trans	-120.2	169	-144.2	43.4	-27.2	0	0	0	118	S1195	P400-S1195 WeakPolarHBondContact CD-OG 3.17Å
401	N	24.9	Very low	25.4	Very low	142 Å²	142	132.6 Å²	132.6	76%	0.759	72%	0.717	S	S	*	*			trans	-154.9	172.4	139.8	-117.1	-34	0	0	0	112.8
402	R	24	Very low	25.4	Very low	246 Å²	246	131.9 Å²	131.9	93%	0.928	71%	0.714	S	S	*	*			trans	-107.5	157.6	-157.7	-65.3	174.3	167.1	179.2	-4.4	116.9
403	G	23.7	Very low	25.4	Very low	72 Å²	72	135.7 Å²	135.7	74%	0.742	72%	0.718	S	S	*	*			trans	119.4	149.3	157.4	0	0	0	0	0	114.3
404	I	25.8	Very low	25	Very low	173 Å²	173	138.3 Å²	138.3	89%	0.887	73%	0.727	S	S	*	*			cis	-139.5	168	-0.2	-77.6	-176.6	0	0	0	109.8
405	S	22.1	Very low	25.2	Very low	80 Å²	80	135.4 Å²	135.4	56%	0.559	73%	0.729	S	S	*	*			trans	-73.8	161.9	-170.5	57.5	0	0	0	0	118.3
406	L	25.8	Very low	25	Very low	175 Å²	175	132.6 Å²	132.6	92%	0.916	72%	0.723	S	S	*	*			trans	-125.1	160.6	141.1	-115.6	172.1	0	0	0	110.2
407	Q	23.7	Very low	24.9	Very low	138 Å²	138	137.8 Å²	137.8	65%	0.645	74%	0.735	S	S	*	*			trans	-141.1	176.6	-165.4	-56.3	-169.9	2.2	0	0	110.4
408	N	23.6	Very low	25.1	Very low	131 Å²	131	135.1 Å²	135.1	70%	0.701	74%	0.74	S	S	*	*			cis	-155.3	-179	14.2	-152.8	-16.6	0	0	0	111.9
409	C	24.2	Very low	25	Very low	111 Å²	111	135.6 Å²	135.6	75%	0.75	76%	0.758	S	S	*	*			trans	70.1	154.7	169.5	-70.9	0	0	0	0	116.1
410	S	23.7	Very low	25	Very low	113 Å²	113	137 Å²	137	79%	0.79	77%	0.771	S	S	*	*			cis	-164.4	177.5	-18.6	59.5	0	0	0	0	108.1
411	A	28	Very low	24.4	Very low	82 Å²	82	139.1 Å²	139.1	68%	0.678	79%	0.788	S	S	*	*			cis	-149.3	160.9	9	0	0	0	0	0	113.7
412	T	24.5	Very low	24.4	Very low	127 Å²	127	136.8 Å²	136.8	78%	0.779	78%	0.782	S	S	*	*			trans	9.5	126.9	155	54.8	0	0	0	0	122.9
413	R	24.4	Very low	24.3	Very low	224 Å²	224	132.9 Å²	132.9	85%	0.845	78%	0.779	S	S	*	*			trans	108.6	102.1	134.1	-81.6	176.3	174.8	177.7	-0.9	121.1
414	N	22.7	Very low	24.3	Very low	148 Å²	148	137.1 Å²	137.1	79%	0.791	78%	0.78	S	S	*	*				57.9	102.8	126.9	-58.2	14.6	0	0	0	121
415	S	25.2	Very low	24.1	Very low	122 Å²	122	139.6 Å²	139.6	85%	0.853	78%	0.779	S	S	*	*				-166.7	175.2	122.5	35.7	0	0	0	0	110.4
416	L	22.6	Very low	24.1	Very low	151 Å²	151	141 Å²	141	79%	0.791	78%	0.784	S	S	*	*			trans	-87.3	158.4	-165.6	-69.6	76.5	0	0	0	113.8
417	F	22.8	Very low	23.9	Very low	193 Å²	193	139.4 Å²	139.4	85%	0.846	78%	0.777	S	S	*	*			trans	69.2	116	169.8	-61.9	-82.9	0	0	0	118.9
418	P	26.2	Very low	23.8	Very low	124 Å²	124	142.4 Å²	142.4	81%	0.805	79%	0.788	S	S	*	*			trans	-102.7	103.2	154.3	33.4	-24.3	0	0	0	111.9
419	S	24.4	Very low	23.7	Very low	112 Å²	112	144.8 Å²	144.8	78%	0.783	79%	0.792	S	S	*	*			trans	9.9	131.9	148.3	55.5	0	0	0	0	121
420	T	25.2	Very low	23.8	Very low	131 Å²	131	149.5 Å²	149.5	80%	0.804	80%	0.796	S	S	*	*			trans	-63	144.3	155.7	45.5	0	0	0	0	112	S422	T420-S422 PolarHBondContact O-N 3.48Å; T420-S422 VanDerWaalsContact O-N 3.13Å
421	S	24.1	Very low	23.8	Very low	127 Å²	127	150 Å²	150	89%	0.888	79%	0.79	S	S	*	*			trans	-80.6	86.7	177.5	41.8	0	0	0	0	112.5
422	S	24.7	Very low	23.7	Very low	92 Å²	92	152.6 Å²	152.6	64%	0.643	79%	0.792	S	S	*	*			trans	-79.4	117.8	171.8	51.2	0	0	0	0	111.9	T420 Q424	T420-S422 PolarHBondContact O-N 3.48Å; T420-S422 VanDerWaalsContact O-N 3.13Å; S422-Q424 PolarHBondContact O-N 3.3Å; S422-Q424 VanDerWaalsContact O-N 3.12Å
423	L	23.1	Very low	23.6	Very low	165 Å²	165	148.1 Å²	148.1	86%	0.864	77%	0.771	S	S	*	*			trans	-74.1	97.8	167.5	-92.1	162.3	0	0	0	109.6
424	Q	22.9	Very low	23.7	Very low	161 Å²	161	145.6 Å²	145.6	75%	0.752	77%	0.766	S	S	*	*			trans	-79.4	131.5	166.9	-72.3	-175.7	-30.2	0	0	110.4	S422	S422-Q424 PolarHBondContact O-N 3.3Å; S422-Q424 VanDerWaalsContact O-N 3.12Å
425	Y	22.9	Very low	23.8	Very low	225 Å²	225	144.1 Å²	144.1	88%	0.882	77%	0.766	S	S	*	*			trans	-120.2	123.3	158.9	-107.5	-84.9	0	0	0	108
426	T	21.4	Very low	23.7	Very low	108 Å²	108	144.8 Å²	144.8	66%	0.663	76%	0.761	S	S	*	*			trans	-135.2	120.6	177.6	50.8	0	0	0	0	109.3
427	D	21.2	Very low	23.9	Very low	143 Å²	143	145.7 Å²	145.7	77%	0.765	77%	0.765	S	S	*	*				-172.6	131.2	123.2	-101.4	-23.1	0	0	0	112.4
428	F	21.9	Very low	24	Very low	201 Å²	201	141.5 Å²	141.5	88%	0.882	76%	0.76	S	S	*	*				171	120.1	117.4	-98.8	-70.7	0	0	0	109.6
429	K	22.3	Very low	24	Very low	180 Å²	180	139.5 Å²	139.5	78%	0.783	75%	0.749	S	S	*	*			trans	-110.3	132.9	168.3	-77.3	-177.6	175.6	178.3	0	109.4
430	Y	26.2	Very low	24.3	Very low	210 Å²	210	140.3 Å²	140.3	82%	0.824	75%	0.749	S	S	*	*				-166.9	171.1	100.3	-120.9	-90.5	0	0	0	112.5
431	N	23.8	Very low	24.6	Very low	124 Å²	124	137.8 Å²	137.8	66%	0.663	73%	0.73	S	S	*	*			trans	-95.2	160.4	-162.2	-54.2	-30.8	0	0	0	114.2
432	N	25.9	Very low	24.9	Very low	137 Å²	137	137.3 Å²	137.3	73%	0.733	72%	0.722	S	S	*	*				-144	139.8	112.6	-97.6	-32.2	0	0	0	109.7
433	G	22.1	Very low	25.7	Very low	33 Å²	33	134 Å²	134	34%	0.34	70%	0.695	S	S	.	*			trans	-79.7	141.9	-150.4	0	0	0	0	0	117.9	Y105	Y105-G433 WeakPolarHBondContact CD2-O 3.44Å; Y105-G433 WeakPolarHBondContact CE2-O 3.25Å
434	K	27.1	Very low	26.5	Very low	170 Å²	170	129.2 Å²	129.2	74%	0.739	68%	0.676	S	S	*	*			trans	-164	113.8	141.1	-105.6	151.3	-170.8	167.4	0	108
435	C	23.7	Very low	27.8	Very low	117 Å²	117	122.8 Å²	122.8	79%	0.791	65%	0.647	S	S	*	*			trans	-66.1	151.6	-168	-50.4	0	0	0	0	112.7
436	N	24	Very low	29	Very low	137 Å²	137	114.7 Å²	114.7	73%	0.733	63%	0.626	S	S	*	*			cis	-162.9	116.2	-19.5	-107.7	-15.6	0	0	0	106.8
437	L	26.8	Very low	30.4	Very low	170 Å²	170	114.1 Å²	114.1	89%	0.89	62%	0.616	S	S	*	*			trans	-144.4	18.9	175.2	-121.8	166.4	0	0	0	113.8
438	S	23.4	Very low	31.8	Very low	104 Å²	104	112.2 Å²	112.2	73%	0.727	61%	0.611	S	S	*	*			trans	-104.3	59.9	170.3	60.6	0	0	0	0	110.5
439	S	27.4	Very low	33.3	Very low	83 Å²	83	104.8 Å²	104.8	58%	0.58	59%	0.592	S	S	*	*			trans	-71.8	127.8	160.1	51.8	0	0	0	0	107.6	L441	S439-L441 PolarHBondContact O-N 2.93Å
440	T	29.3	Very low	35	Very low	129 Å²	129	102.6 Å²	102.6	79%	0.791	58%	0.582	S	S	*	*			trans	-69.4	103.2	-179.6	-48.2	0	0	0	0	109	V442	T440-V442 VanDerWaalsContact C-N 3.28Å; T440-V442 HydrophobicContact CG2-CG2 4.23Å; T440-V442 PolarHBondContact O-N 2.98Å
441	L	32.8	Very low	37	Very low	77 Å²	77	92.8 Å²	92.8	40%	0.403	54%	0.544	S	S	.	.			trans	-77.9	75.3	-173.6	-68.7	165.9	0	0	0	111.5	S439 Y443	S439-L441 PolarHBondContact O-N 2.93Å; L441-Y443 HydrophobicContact CB-CD2 4.33Å; L441-Y443 HydrophobicContact CB-CE1 4.39Å; L441-Y443 HydrophobicContact CB-CE2 3.76Å; L441-Y443 HydrophobicContact CD1-CE2 4.38Å; L441-Y443 WeakPolarHBondContact CD1-OH 3.37Å; L441-Y443 HydrophobicContact CD2-CE1 4.2Å; L441-Y443 WeakPolarHBondContact CD2-OH 3.33Å; L441-Y443 HydrophobicContact CG-CE2 4.48Å; L441-Y443 PolarHBondContact O-N 3.23Å
442	V	30.5	Very low	39.2	Very low	117 Å²	117	89.8 Å²	89.8	71%	0.709	53%	0.528	S	S	*	.			trans	-73.8	88.9	169.8	-176.7	0	0	0	0	108.7	T440 S444	T440-V442 VanDerWaalsContact C-N 3.28Å; T440-V442 HydrophobicContact CG2-CG2 4.23Å; T440-V442 PolarHBondContact O-N 2.98Å; V442-S444 PolarHBondContact O-N 3.19Å
443	Y	41.7	Very low	41.6	Very low	22 Å²	22	83.7 Å²	83.7	9%	0.086	50%	0.495	C	S	.	.			trans	-81.6	106.9	173.3	-63.4	-55.8	0	0	0	111.1	L441 L445 M477 W507 L511 T514	L441-Y443 HydrophobicContact CB-CD2 4.33Å; L441-Y443 HydrophobicContact CB-CE1 4.39Å; L441-Y443 HydrophobicContact CB-CE2 3.76Å; L441-Y443 HydrophobicContact CD1-CE2 4.38Å; L441-Y443 WeakPolarHBondContact CD1-OH 3.37Å; L441-Y443 HydrophobicContact CD2-CE1 4.2Å; L441-Y443 WeakPolarHBondContact CD2-OH 3.33Å; L441-Y443 HydrophobicContact CG-CE2 4.48Å; L441-Y443 PolarHBondContact O-N 3.23Å; Y443-L445 VanDerWaalsContact C-N 3.3Å; Y443-L445 PolarHBondContact O-N 2.72Å; Y443-M477 HydrophobicContact CD1-CE 3.46Å; Y443-M477 VanDerWaalsContact CD1-CE 3.46Å; Y443-M477 HydrophobicContact CD1-CG 4.44Å; Y443-M477 HydrophobicContact CD1-SD 3.41Å; Y443-M477 WeakPolarHBondContact CD1-SD 3.31Å; Y443-M477 HydrophobicContact CD2-CE 4.43Å; Y443-M477 HydrophobicContact CE1-CE 3.88Å; Y443-M477 HydrophobicContact CE1-SD 3.29Å; Y443-M477 WeakPolarHBondContact CE1-SD 3.47Å; Y443-M477 HydrophobicContact CG-CE 3.79Å; Y443-M477 HydrophobicContact CG-SD 4.3Å; Y443-W507 WeakPolarHBondContact OH-CH2 3.22Å; Y443-W507 WeakPolarHBondContact OH-CZ3 3.16Å; Y443-L511 HydrophobicContact CD2-CD2 4.36Å; Y443-L511 HydrophobicContact CE2-CD2 4.07Å; Y443-T514 HydrophobicContact CD2-CG2 4.25Å
444	S	39.7	Very low	44.1	Very low	65 Å²	65	82.1 Å²	82.1	46%	0.455	48%	0.48	S	S	.	.			trans	-69.6	90.8	161.4	-69.9	0	0	0	0	109.3	V442 V475	V442-S444 PolarHBondContact O-N 3.19Å; S444-V475 VanDerWaalsContact O-CB 3.22Å; S444-V475 WeakPolarHBondContact O-CB 3.46Å; S444-V475 WeakPolarHBondContact O-CG2 3.42Å; S444-V475 PolarHBondContact O-N 2.82Å
445	L	48.7	Very low	46.3	Very low	27 Å²	27	74.4 Å²	74.4	14%	0.141	45%	0.447	C	S	.	.	B	Isolated β-bridge	trans	-88.3	123.2	168.9	-60.8	-173.3	0	0	0	108.1	Y443 Q447 I451 F470 M477 T514 A515	Y443-L445 VanDerWaalsContact C-N 3.3Å; Y443-L445 PolarHBondContact O-N 2.72Å; L445-Q447 VanDerWaalsContact C-N 3.3Å; L445-Q447 PolarHBondContact O-N 2.98Å; L445-I451 HydrophobicContact CB-CD1 3.66Å; L445-I451 HydrophobicContact CD1-CD1 3.92Å; L445-I451 HydrophobicContact CD2-CD1 3.96Å; L445-I451 HydrophobicContact CG-CD1 4.04Å; L445-F470 HydrophobicContact CD2-CE2 4.5Å; L445-F470 HydrophobicContact CD2-CZ 4.17Å; L445-M477 HydrophobicContact CD2-CE 3.65Å; L445-T514 HydrophobicContact CD1-CG2 3.77Å; L445-T514 HydrophobicContact CG-CG2 4.41Å; L445-A515 HydrophobicContact CD1-CB 4.38Å
446	A	48.7	Very low	48.8	Very low	55 Å²	55	69.2 Å²	69.2	46%	0.455	41%	0.411	S	S	.	.	S	Bend	trans	-63.2	-34.9	-163.3	0	0	0	0	0	113.7	P473 V475	A446-P473 HydrophobicContact CB-CB 3.9Å; A446-P473 HydrophobicContact CB-CG 3.95Å; A446-P473 PolarHBondContact N-O 2.92Å; A446-V475 HydrophobicContact CB-CG2 3.64Å
447	Q	50.7	Low	51.3	Low	96 Å²	96	64.4 Å²	64.4	45%	0.449	38%	0.384	S	S	.	.	S	Bend	trans	-146.7	122.5	171.5	-65.1	-172.4	-22.9	0	0	109.2	L445 K450	L445-Q447 VanDerWaalsContact C-N 3.3Å; L445-Q447 PolarHBondContact O-N 2.98Å; Q447-K450 HydrophobicContact CB-CD 4.47Å; Q447-K450 VanDerWaalsContact OE1-CE 3.28Å
448	P	50.3	Low	53.3	Low	102 Å²	102	58.8 Å²	58.8	66%	0.662	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	152.7	171.3	26.7	-33.5	0	0	0	110.6	K450	P448-K450 VanDerWaalsContact C-N 3.27Å; P448-K450 PolarHBondContact O-N 2.99Å
449	G	53.5	Low	55.4	Low	46 Å²	46	55 Å²	55	47%	0.474	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.6	-22.5	-178.3	0	0	0	0	0	116.7	I451 A515	G449-I451 VanDerWaalsContact C-N 3.29Å; G449-I451 PolarHBondContact O-N 2.99Å; G449-A515 PolarHBondContact N-O 2.91Å
450	K	59.1	Low	57.3	Low	134 Å²	134	52.2 Å²	52.2	58%	0.583	31%	0.305	S	S	*	.	S	Bend	trans	-86.1	7.8	173.3	-80	-170.7	-178.4	167.4	0	114.7	Q447 P448	Q447-K450 HydrophobicContact CB-CD 4.47Å; Q447-K450 VanDerWaalsContact OE1-CE 3.28Å; P448-K450 VanDerWaalsContact C-N 3.27Å; P448-K450 PolarHBondContact O-N 2.99Å
451	I	67.3	Low	59.1	Low	3 Å²	3	46.6 Å²	46.6	2%	0.015	27%	0.271	C	S	.	.			trans	-116.3	125.7	-175.1	-71.8	157.6	0	0	0	109.5	L445 G449 V453 F470 T471 A515	L445-I451 HydrophobicContact CB-CD1 3.66Å; L445-I451 HydrophobicContact CD1-CD1 3.92Å; L445-I451 HydrophobicContact CD2-CD1 3.96Å; L445-I451 HydrophobicContact CG-CD1 4.04Å; G449-I451 VanDerWaalsContact C-N 3.29Å; G449-I451 PolarHBondContact O-N 2.99Å; I451-V453 HydrophobicContact CG2-CG2 4.2Å; I451-F470 HydrophobicContact CB-CZ 4.32Å; I451-F470 HydrophobicContact CD1-CZ 3.95Å; I451-F470 HydrophobicContact CG1-CE1 4.29Å; I451-F470 HydrophobicContact CG1-CZ 3.91Å; I451-F470 HydrophobicContact CG2-CD2 4.16Å; I451-F470 HydrophobicContact CG2-CE1 4.11Å; I451-F470 HydrophobicContact CG2-CE2 3.46Å; I451-F470 VanDerWaalsContact CG2-CE2 3.46Å; I451-F470 HydrophobicContact CG2-CZ 3.43Å; I451-F470 VanDerWaalsContact CG2-CZ 3.43Å; I451-T471 WeakPolarHBondContact CA-O 3.36Å; I451-A515 HydrophobicContact CB-CB 4.08Å; I451-A515 HydrophobicContact CG2-CB 3.87Å
452	N	70.2	Confident	60.3	Low	61 Å²	61	46.7 Å²	46.7	33%	0.326	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	146.2	169.5	-63.1	-51.5	0	0	0	109.7	T471	N452-T471 PolarHBondContact N-O 2.83Å; N452-T471 VanDerWaalsContact N-O 3.13Å; N452-T471 PolarHBondContact O-N 2.79Å
453	V	77	Confident	61.6	Low	9 Å²	9	43 Å²	43	6%	0.055	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	115.4	177.8	-175.1	0	0	0	0	108	I451 F468 V469 F470 I508 L511 R512	I451-V453 HydrophobicContact CG2-CG2 4.2Å; V453-F468 HydrophobicContact CG1-CD2 3.86Å; V453-F468 HydrophobicContact CG1-CE2 4.27Å; V453-V469 WeakPolarHBondContact CA-O 3.33Å; V453-F470 HydrophobicContact CG2-CD2 3.65Å; V453-F470 HydrophobicContact CG2-CE2 4.21Å; V453-F470 HydrophobicContact CG2-CG 4.41Å; V453-I508 HydrophobicContact CG1-CB 4.45Å; V453-I508 HydrophobicContact CG1-CG1 4.17Å; V453-I508 HydrophobicContact CG1-CG2 4.3Å; V453-L511 HydrophobicContact CG1-CB 4.44Å; V453-L511 HydrophobicContact CG1-CD1 4.49Å; V453-L511 HydrophobicContact CG2-CB 3.96Å; V453-R512 HydrophobicContact CB-CG 4.41Å
454	S	73.8	Confident	62.6	Low	1 Å²	1	48.6 Å²	48.6	1%	0.007	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	162.6	-172.5	59	0	0	0	0	111.4	V469 N578	S454-V469 PolarHBondContact N-O 3.2Å; S454-V469 VanDerWaalsContact N-O 3.14Å; S454-V469 PolarHBondContact O-N 3.48Å; S454-V469 WeakPolarHBondContact OG-CG1 3.37Å; S454-N578 WeakPolarHBondContact CB-O 3.44Å
455	T	74.2	Confident	63.9	Low	8 Å²	8	48.1 Å²	48.1	5%	0.049	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	137.4	174.2	55.5	0	0	0	0	110.5	I508 L576 N577	T455-I508 HydrophobicContact CG2-CD1 3.87Å; T455-L576 WeakPolarHBondContact OG1-CA 3.47Å; T455-N577 PolarHBondContact N-O 2.9Å; T455-N577 PolarHBondContact OG1-N 3.32Å; T455-N577 PolarHBondContact OG1-O 3.29Å
456	I	76.5	Confident	65.1	Low	8 Å²	8	49.2 Å²	49.2	4%	0.041	30%	0.296	C	S	.	.			trans	-116.6	150.3	171.9	-162.2	171.6	0	0	0	109.4	L460 C467 V469 I495	I456-L460 HydrophobicContact CD1-CB 4.33Å; I456-L460 HydrophobicContact CD1-CD1 3.73Å; I456-L460 HydrophobicContact CG1-CD1 3.84Å; I456-C467 HydrophobicContact CG2-CB 3.9Å; I456-V469 HydrophobicContact CB-CB 4.25Å; I456-V469 HydrophobicContact CB-CG1 4.38Å; I456-V469 HydrophobicContact CD1-CB 4.21Å; I456-I495 HydrophobicContact CD1-CD1 3.53Å; I456-I495 HydrophobicContact CD1-CG1 3.84Å; I456-I495 HydrophobicContact CG2-CG2 4.06Å
457	H	75.5	Confident	66.4	Low	35 Å²	35	46.7 Å²	46.7	16%	0.162	28%	0.275	C	S	.	.			trans	-80.1	140.8	179.3	-171.2	-103.4	0	0	0	112.6	S459 L460 Y556 A557 F574	H457-S459 WeakPolarHBondContact ND1-CB 3.48Å; H457-S459 PolarHBondContact ND1-N 3.21Å; H457-S459 PolarHBondContact ND1-OG 3Å; H457-S459 PolarHBondContact O-N 3.38Å; H457-L460 PolarHBondContact O-N 2.74Å; H457-L460 VanDerWaalsContact O-N 3.12Å; H457-Y556 PolarHBondContact N-O 3.39Å; H457-A557 HydrophobicContact CB-CB 3.8Å; H457-F574 HydrophobicContact CB-CD1 3.92Å; H457-F574 HydrophobicContact CB-CE1 4.35Å; H457-F574 AromaticContact CD2-CD1 3.76Å; H457-F574 AromaticContact CE1-CE1 3.62Å; H457-F574 AromaticContact CG-CD1 3.5Å; H457-F574 AromaticContact CG-CE1 3.71Å; H457-F574 AromaticContact ND1-CD1 3.72Å; H457-F574 AromaticContact ND1-CE1 3.39Å; H457-F574 WeakPolarHBondContact ND1-CE1 3.43Å
458	Q	68.7	Low	67.8	Low	53 Å²	53	42.1 Å²	42.1	25%	0.248	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-16.5	-177.2	60.1	177.4	-3.4	0	0	115.3	L460 T461 G463 R464	Q458-L460 VanDerWaalsContact C-N 3.35Å; Q458-T461 PolarHBondContact O-N 2.89Å; Q458-T461 PolarHBondContact O-OG1 2.99Å; Q458-G463 VanDerWaalsContact O-CA 3.25Å; Q458-G463 WeakPolarHBondContact O-CA 3.45Å; Q458-G463 PolarHBondContact O-N 3.01Å; Q458-R464 WeakPolarHBondContact CB-O 3.4Å
459	S	68.5	Low	69.1	Low	25 Å²	25	37.6 Å²	37.6	18%	0.175	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-22.9	178.2	58.7	0	0	0	0	113.8	H457 T461 R558	H457-S459 WeakPolarHBondContact ND1-CB 3.48Å; H457-S459 PolarHBondContact ND1-N 3.21Å; H457-S459 PolarHBondContact ND1-OG 3Å; H457-S459 PolarHBondContact O-N 3.38Å; S459-T461 VanDerWaalsContact C-N 3.3Å; S459-R558 WeakPolarHBondContact CB-O 3.26Å; S459-R558 PolarHBondContact OG-N 3.43Å; S459-R558 PolarHBondContact OG-O 3.18Å
460	L	67.5	Low	70.3	Confident	24 Å²	24	35.5 Å²	35.5	13%	0.126	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-19.5	172.1	-67.8	179.9	0	0	0	112.7	I456 H457 Q458 I486 L555 Y556 R558	I456-L460 HydrophobicContact CD1-CB 4.33Å; I456-L460 HydrophobicContact CD1-CD1 3.73Å; I456-L460 HydrophobicContact CG1-CD1 3.84Å; H457-L460 PolarHBondContact O-N 2.74Å; H457-L460 VanDerWaalsContact O-N 3.12Å; Q458-L460 VanDerWaalsContact C-N 3.35Å; L460-I486 WeakPolarHBondContact O-CD1 3.49Å; L460-L555 HydrophobicContact CD1-CG 3.98Å; L460-L555 WeakPolarHBondContact CD1-O 3.46Å; L460-L555 HydrophobicContact CD2-CD1 4.38Å; L460-L555 HydrophobicContact CD2-CD2 3.67Å; L460-L555 HydrophobicContact CD2-CG 3.8Å; L460-Y556 WeakPolarHBondContact CD1-O 3.38Å; L460-R558 HydrophobicContact CD2-CB 3.66Å
461	T	65.6	Low	71	Confident	11 Å²	11	30.8 Å²	30.8	7%	0.067	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	22.5	-178.9	54.8	0	0	0	0	112.9	Q458 S459 G463 R464 C467 C485 I495	Q458-T461 PolarHBondContact O-N 2.89Å; Q458-T461 PolarHBondContact O-OG1 2.99Å; S459-T461 VanDerWaalsContact C-N 3.3Å; T461-G463 VanDerWaalsContact C-N 3.31Å; T461-G463 PolarHBondContact O-N 2.8Å; T461-R464 WeakPolarHBondContact O-CB 3.47Å; T461-R464 WeakPolarHBondContact O-CG 3.44Å; T461-R464 PolarHBondContact O-N 2.97Å; T461-R464 PolarHBondContact OG1-O 3.41Å; T461-C467 HydrophobicContact CG2-CB 3.78Å; T461-C467 PolarHBondContact OG1-SG 3.14Å; T461-C467 VanDerWaalsContact OG1-SG 3.4Å; T461-C485 HydrophobicContact CG2-CB 4.39Å; T461-I495 HydrophobicContact CG2-CG2 3.38Å
462	G	59.1	Low	71.1	Confident	78 Å²	78	31 Å²	31	80%	0.804	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.6	25.3	179.2	0	0	0	0	0	114.1
463	G	58.3	Low	70.7	Confident	40 Å²	40	29.9 Å²	29.9	41%	0.412	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.2	9.7	-175.8	0	0	0	0	0	114.2	Q458 T461 P465	Q458-G463 VanDerWaalsContact O-CA 3.25Å; Q458-G463 WeakPolarHBondContact O-CA 3.45Å; Q458-G463 PolarHBondContact O-N 3.01Å; T461-G463 VanDerWaalsContact C-N 3.31Å; T461-G463 PolarHBondContact O-N 2.8Å; G463-P465 WeakPolarHBondContact O-CD 3.39Å
464	R	62.7	Low	69.8	Low	139 Å²	139	31.7 Å²	31.7	53%	0.525	19%	0.192	S	C	.	.			trans	-71.5	119.2	172	-71.6	-179.5	173.1	-168.1	-2.3	109.7	Q458 T461 C467 C485	Q458-R464 WeakPolarHBondContact CB-O 3.4Å; T461-R464 WeakPolarHBondContact O-CB 3.47Å; T461-R464 WeakPolarHBondContact O-CG 3.44Å; T461-R464 PolarHBondContact O-N 2.97Å; T461-R464 PolarHBondContact OG1-O 3.41Å; R464-C467 PolarHBondContact O-SG 3.33Å; R464-C485 VanDerWaalsContact CD-SG 3.58Å; R464-C485 PolarHBondContact NH1-SG 2.84Å
465	P	66.7	Low	68.5	Low	56 Å²	56	35.8 Å²	35.8	36%	0.364	22%	0.217	S	C	.	.	S	Bend	trans	-70.9	173.8	179.1	32.2	-36.7	0	0	0	111.5	G463 C467	G463-P465 WeakPolarHBondContact O-CD 3.39Å; P465-C467 PolarHBondContact O-N 3.28Å; P465-C467 PolarHBondContact O-SG 3.13Å; P465-C467 VanDerWaalsContact O-SG 3.39Å
466	F	72.9	Confident	67.4	Low	50 Å²	50	41.7 Å²	41.7	22%	0.219	24%	0.244	C	C	.	.	S	Bend	trans	56.7	26.3	169.8	-38	-49.8	0	0	0	115.6	T498 S500 W501 R504	F466-T498 PolarHBondContact O-OG1 3.19Å; F466-S500 VanDerWaalsContact CD2-CA 3.43Å; F466-S500 VanDerWaalsContact CG-C 3.44Å; F466-W501 HydrophobicContact CD1-CB 3.56Å; F466-W501 HydrophobicContact CE1-CB 3.69Å; F466-W501 HydrophobicContact CG-CB 4.44Å; F466-R504 HydrophobicContact CB-CB 4.31Å; F466-R504 WeakPolarHBondContact O-CD 3.37Å
467	C	77.3	Confident	66.2	Low	1 Å²	1	41.6 Å²	41.6	1%	0.007	24%	0.244	C	C	.	.			trans	-79.7	153.1	176.4	-62.5	0	0	0	0	112.9	I456 T461 R464 P465 I495 F496 R504	I456-C467 HydrophobicContact CG2-CB 3.9Å; T461-C467 HydrophobicContact CG2-CB 3.78Å; T461-C467 PolarHBondContact OG1-SG 3.14Å; T461-C467 VanDerWaalsContact OG1-SG 3.4Å; R464-C467 PolarHBondContact O-SG 3.33Å; P465-C467 PolarHBondContact O-N 3.28Å; P465-C467 PolarHBondContact O-SG 3.13Å; P465-C467 VanDerWaalsContact O-SG 3.39Å; C467-I495 HydrophobicContact CB-CG2 4.3Å; C467-F496 CarbonylContact C-O 3.55Å; C467-F496 WeakPolarHBondContact CA-O 3.39Å; C467-F496 WeakPolarHBondContact CB-O 3.41Å; C467-R504 WeakPolarHBondContact O-CD 3.47Å; C467-R504 PolarHBondContact O-NH1 2.97Å
468	F	78.7	Confident	64.5	Low	0 Å²	0	44.8 Å²	44.8	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	157.1	171.6	69.9	-89.3	0	0	0	110.4	V453 F496 T498 R504 W507 I508 L511	V453-F468 HydrophobicContact CG1-CD2 3.86Å; V453-F468 HydrophobicContact CG1-CE2 4.27Å; F468-F496 HydrophobicContact CD1-CB 4.11Å; F468-F496 HydrophobicContact CD2-CB 4.5Å; F468-F496 HydrophobicContact CD2-CD2 4.27Å; F468-F496 HydrophobicContact CE1-CB 3.61Å; F468-F496 HydrophobicContact CE1-CG 4.44Å; F468-F496 HydrophobicContact CE2-CB 4.04Å; F468-F496 AromaticContact CE2-CD2 3.55Å; F468-F496 HydrophobicContact CE2-CD2 3.55Å; F468-F496 HydrophobicContact CE2-CE2 4.38Å; F468-F496 HydrophobicContact CE2-CG 4.16Å; F468-F496 HydrophobicContact CZ-CB 3.57Å; F468-F496 AromaticContact CZ-CD2 3.76Å; F468-F496 HydrophobicContact CZ-CD2 3.76Å; F468-F496 AromaticContact CZ-CG 3.91Å; F468-F496 HydrophobicContact CZ-CG 3.91Å; F468-F496 PolarHBondContact N-O 3.08Å; F468-F496 PolarHBondContact O-N 2.92Å; F468-T498 HydrophobicContact CD1-CG2 4.21Å; F468-T498 HydrophobicContact CE1-CG2 3.81Å; F468-R504 HydrophobicContact CB-CG 4.15Å; F468-R504 HydrophobicContact CD1-CG 4.14Å; F468-W507 HydrophobicContact CD1-CB 4.48Å; F468-W507 HydrophobicContact CE1-CB 3.77Å; F468-W507 HydrophobicContact CE1-CG 4.2Å; F468-W507 HydrophobicContact CZ-CB 4Å; F468-W507 HydrophobicContact CZ-CG 4.41Å; F468-I508 HydrophobicContact CB-CD1 3.81Å; F468-I508 HydrophobicContact CB-CG1 3.83Å; F468-I508 HydrophobicContact CD2-CG1 4.37Å; F468-I508 HydrophobicContact CG-CG1 4.06Å; F468-L511 HydrophobicContact CE2-CD1 3.54Å; F468-L511 HydrophobicContact CZ-CD1 3.85Å
469	V	78.5	Confident	63.6	Low	8 Å²	8	45.2 Å²	45.2	5%	0.048	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	141.2	176.9	70.4	0	0	0	0	110.8	V453 S454 I456 T471 T493 I495	V453-V469 WeakPolarHBondContact CA-O 3.33Å; S454-V469 PolarHBondContact N-O 3.2Å; S454-V469 VanDerWaalsContact N-O 3.14Å; S454-V469 PolarHBondContact O-N 3.48Å; S454-V469 WeakPolarHBondContact OG-CG1 3.37Å; I456-V469 HydrophobicContact CB-CB 4.25Å; I456-V469 HydrophobicContact CB-CG1 4.38Å; I456-V469 HydrophobicContact CD1-CB 4.21Å; V469-T471 HydrophobicContact CG2-CG2 4.31Å; V469-T493 HydrophobicContact CG2-CG2 3.62Å; V469-I495 HydrophobicContact CB-CG1 4.34Å; V469-I495 HydrophobicContact CG2-CG1 3.93Å
470	F	78.8	Confident	62.9	Low	1 Å²	1	44.2 Å²	44.2	0%	0.004	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	129.5	171.5	-179.1	-75.7	0	0	0	107.7	L445 I451 V453 I474 M477 T493 H494 F496 L511	L445-F470 HydrophobicContact CD2-CE2 4.5Å; L445-F470 HydrophobicContact CD2-CZ 4.17Å; I451-F470 HydrophobicContact CB-CZ 4.32Å; I451-F470 HydrophobicContact CD1-CZ 3.95Å; I451-F470 HydrophobicContact CG1-CE1 4.29Å; I451-F470 HydrophobicContact CG1-CZ 3.91Å; I451-F470 HydrophobicContact CG2-CD2 4.16Å; I451-F470 HydrophobicContact CG2-CE1 4.11Å; I451-F470 HydrophobicContact CG2-CE2 3.46Å; I451-F470 VanDerWaalsContact CG2-CE2 3.46Å; I451-F470 HydrophobicContact CG2-CZ 3.43Å; I451-F470 VanDerWaalsContact CG2-CZ 3.43Å; V453-F470 HydrophobicContact CG2-CD2 3.65Å; V453-F470 HydrophobicContact CG2-CE2 4.21Å; V453-F470 HydrophobicContact CG2-CG 4.41Å; F470-I474 HydrophobicContact CD1-CD1 3.89Å; F470-I474 HydrophobicContact CD1-CG1 4.03Å; F470-I474 HydrophobicContact CE1-CD1 3.75Å; F470-I474 HydrophobicContact CE1-CG1 3.37Å; F470-I474 HydrophobicContact CZ-CD1 4.32Å; F470-I474 HydrophobicContact CZ-CG1 3.82Å; F470-M477 HydrophobicContact CE2-CE 4.33Å; F470-T493 WeakPolarHBondContact O-CA 3.48Å; F470-H494 PolarHBondContact N-O 3.31Å; F470-H494 PolarHBondContact O-N 2.88Å; F470-F496 HydrophobicContact CB-CD2 4.21Å; F470-F496 HydrophobicContact CB-CE2 3.75Å; F470-F496 HydrophobicContact CG-CE2 4.35Å; F470-L511 HydrophobicContact CD2-CD1 4.41Å
471	T	73.4	Confident	61.9	Low	35 Å²	35	49 Å²	49	22%	0.215	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	115.9	175.4	64.9	0	0	0	0	109.3	I451 N452 V469 F492 T493	I451-T471 WeakPolarHBondContact CA-O 3.36Å; N452-T471 PolarHBondContact N-O 2.83Å; N452-T471 VanDerWaalsContact N-O 3.13Å; N452-T471 PolarHBondContact O-N 2.79Å; V469-T471 HydrophobicContact CG2-CG2 4.31Å; T471-F492 WeakPolarHBondContact CA-O 3.45Å; T471-T493 HydrophobicContact CG2-CG2 4.14Å
472	G	69.3	Low	61.1	Low	8 Å²	8	58 Å²	58	8%	0.082	33%	0.329	C	S	.	.	S	Bend	trans	150.9	172.4	175.3	0	0	0	0	0	114.3	I474 F492	G472-I474 PolarHBondContact O-N 3.28Å; G472-F492 PolarHBondContact N-O 2.98Å
473	P	62	Low	60.9	Low	37 Å²	37	58.3 Å²	58.3	24%	0.24	31%	0.312	C	S	.	.			trans	-75	111.7	-177.4	29.4	-35	0	0	0	112.6	A446	A446-P473 HydrophobicContact CB-CB 3.9Å; A446-P473 HydrophobicContact CB-CG 3.95Å; A446-P473 PolarHBondContact N-O 2.92Å
474	I	57	Low	60.9	Low	47 Å²	47	58.7 Å²	58.7	24%	0.241	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-89.4	132.5	172.6	-60.5	176.5	0	0	0	109.2	F470 G472 M477 H494 F496	F470-I474 HydrophobicContact CD1-CD1 3.89Å; F470-I474 HydrophobicContact CD1-CG1 4.03Å; F470-I474 HydrophobicContact CE1-CD1 3.75Å; F470-I474 HydrophobicContact CE1-CG1 3.37Å; F470-I474 HydrophobicContact CZ-CD1 4.32Å; F470-I474 HydrophobicContact CZ-CG1 3.82Å; G472-I474 PolarHBondContact O-N 3.28Å; I474-M477 HydrophobicContact CD1-CG 4.23Å; I474-M477 HydrophobicContact CG2-CB 4.08Å; I474-M477 HydrophobicContact CG2-CG 3.48Å; I474-M477 VanDerWaalsContact CG2-CG 3.48Å; I474-H494 VanDerWaalsContact CD1-CD2 3.44Å; I474-H494 WeakPolarHBondContact CD1-CD2 3.43Å; I474-F496 HydrophobicContact CD1-CZ 4.48Å
475	V	47.7	Very low	60.6	Low	88 Å²	88	53.6 Å²	53.6	53%	0.533	29%	0.292	S	S	.	.	S	Bend	trans	-90.6	-42.5	169.6	-168.7	0	0	0	0	110.9	S444 A446	S444-V475 VanDerWaalsContact O-CB 3.22Å; S444-V475 WeakPolarHBondContact O-CB 3.46Å; S444-V475 WeakPolarHBondContact O-CG2 3.42Å; S444-V475 PolarHBondContact O-N 2.82Å; A446-V475 HydrophobicContact CB-CG2 3.64Å
476	Q	49.8	Very low	60.2	Low	132 Å²	132	54.4 Å²	54.4	62%	0.617	29%	0.292	S	S	*	.			trans	-162.2	140	172.9	-122.3	171.6	-7.4	0	0	112.1
477	M	51.4	Low	59.3	Low	6 Å²	6	56.7 Å²	56.7	3%	0.03	30%	0.303	C	S	.	.			trans	-139	58.2	178.7	-80.6	-89.6	172.8	0	0	111.3	Y443 L445 F470 I474 S479 I480 L511	Y443-M477 HydrophobicContact CD1-CE 3.46Å; Y443-M477 VanDerWaalsContact CD1-CE 3.46Å; Y443-M477 HydrophobicContact CD1-CG 4.44Å; Y443-M477 HydrophobicContact CD1-SD 3.41Å; Y443-M477 WeakPolarHBondContact CD1-SD 3.31Å; Y443-M477 HydrophobicContact CD2-CE 4.43Å; Y443-M477 HydrophobicContact CE1-CE 3.88Å; Y443-M477 HydrophobicContact CE1-SD 3.29Å; Y443-M477 WeakPolarHBondContact CE1-SD 3.47Å; Y443-M477 HydrophobicContact CG-CE 3.79Å; Y443-M477 HydrophobicContact CG-SD 4.3Å; L445-M477 HydrophobicContact CD2-CE 3.65Å; F470-M477 HydrophobicContact CE2-CE 4.33Å; I474-M477 HydrophobicContact CD1-CG 4.23Å; I474-M477 HydrophobicContact CG2-CB 4.08Å; I474-M477 HydrophobicContact CG2-CG 3.48Å; I474-M477 VanDerWaalsContact CG2-CG 3.48Å; M477-S479 PolarHBondContact O-N 2.83Å; M477-I480 PolarHBondContact O-N 2.91Å; M477-I480 VanDerWaalsContact O-N 3.09Å; M477-I480 HydrophobicContact SD-CD1 3.44Å; M477-I480 WeakPolarHBondContact SD-CD1 3.26Å; M477-I480 HydrophobicContact SD-CG1 4.2Å; M477-L511 HydrophobicContact CE-CD2 3.81Å; M477-L511 HydrophobicContact SD-CD2 4.48Å
478	P	40	Very low	58.2	Low	102 Å²	102	59.9 Å²	59.9	66%	0.662	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-8.8	-160.6	26.4	-37	0	0	0	116.2
479	S	50.7	Low	56.7	Low	61 Å²	61	67.5 Å²	67.5	43%	0.427	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-17	179.7	49.7	0	0	0	0	114.6	M477	M477-S479 PolarHBondContact O-N 2.83Å
480	I	53.2	Low	55.1	Low	5 Å²	5	72.4 Å²	72.4	3%	0.026	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	-18.1	-174.2	-26.6	-179.4	0	0	0	113.2	M477 K482 N483 F496 W507	M477-I480 PolarHBondContact O-N 2.91Å; M477-I480 VanDerWaalsContact O-N 3.09Å; M477-I480 HydrophobicContact SD-CD1 3.44Å; M477-I480 WeakPolarHBondContact SD-CD1 3.26Å; M477-I480 HydrophobicContact SD-CG1 4.2Å; I480-K482 PolarHBondContact O-N 3.26Å; I480-N483 PolarHBondContact O-N 2.94Å; I480-F496 HydrophobicContact CB-CD1 4.08Å; I480-F496 HydrophobicContact CB-CE1 3.82Å; I480-F496 HydrophobicContact CG2-CB 4.5Å; I480-F496 HydrophobicContact CG2-CD1 3.36Å; I480-F496 HydrophobicContact CG2-CE1 3.64Å; I480-F496 HydrophobicContact CG2-CG 4.05Å; I480-W507 HydrophobicContact CD1-CE3 4.04Å; I480-W507 HydrophobicContact CD1-CH2 3.57Å; I480-W507 HydrophobicContact CD1-CZ2 4.5Å; I480-W507 HydrophobicContact CD1-CZ3 3.29Å; I480-W507 HydrophobicContact CG1-CH2 3.69Å; I480-W507 HydrophobicContact CG1-CZ2 4.4Å; I480-W507 HydrophobicContact CG1-CZ3 3.98Å
481	E	47.2	Very low	53.8	Low	123 Å²	123	77.8 Å²	77.8	58%	0.575	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-51.6	-32	-177.6	-72.5	166.3	-157.2	0	0	113.8	N483	E481-N483 VanDerWaalsContact C-N 3.25Å; E481-N483 PolarHBondContact O-N 3.03Å
482	K	48	Very low	53.4	Low	201 Å²	201	83 Å²	83	87%	0.874	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-68.9	-17.1	177.4	-66.6	178.7	-179.1	172.2	0	114.6	I480	I480-K482 PolarHBondContact O-N 3.26Å
483	N	56.2	Low	53.2	Low	85 Å²	85	84 Å²	84	46%	0.455	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-115.3	9.2	-176	-68.5	-1.8	0	0	0	113.4	I480 E481 C485 A497	I480-N483 PolarHBondContact O-N 2.94Å; E481-N483 VanDerWaalsContact C-N 3.25Å; E481-N483 PolarHBondContact O-N 3.03Å; N483-C485 PolarHBondContact O-N 3.48Å; N483-A497 PolarHBondContact O-N 3.45Å; N483-A497 VanDerWaalsContact O-N 3.1Å
484	V	57.9	Low	53.7	Low	48 Å²	48	84.1 Å²	84.1	29%	0.291	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	129.8	169.9	178.1	0	0	0	0	109	E487 F496	V484-E487 HydrophobicContact CG1-CB 4.15Å; V484-F496 HydrophobicContact CG2-CD1 3.77Å; V484-F496 HydrophobicContact CG2-CE1 3.51Å
485	C	56.7	Low	54.5	Low	32 Å²	32	82.8 Å²	82.8	22%	0.216	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	-37.8	177.3	-69.5	0	0	0	0	112.2	T461 R464 N483 I495 A497	T461-C485 HydrophobicContact CG2-CB 4.39Å; R464-C485 VanDerWaalsContact CD-SG 3.58Å; R464-C485 PolarHBondContact NH1-SG 2.84Å; N483-C485 PolarHBondContact O-N 3.48Å; C485-I495 PolarHBondContact N-O 2.96Å; C485-A497 WeakPolarHBondContact SG-CB 3.41Å
486	I	58.6	Low	56	Low	73 Å²	73	78.8 Å²	78.8	37%	0.374	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	128.4	176	-55.3	179.7	0	0	0	107.7	L460 I495	L460-I486 WeakPolarHBondContact O-CD1 3.49Å; I486-I495 HydrophobicContact CB-CB 4.43Å; I486-I495 HydrophobicContact CB-CD1 4.21Å; I486-I495 HydrophobicContact CD1-CD1 4.24Å; I486-I495 PolarHBondContact O-N 3.3Å
487	E	52.9	Low	57.2	Low	97 Å²	97	73.3 Å²	73.3	45%	0.453	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	102.9	171.8	-173.1	-164.1	178	0	0	107.6	V484 K489	V484-E487 HydrophobicContact CG1-CB 4.15Å; E487-K489 HydrophobicContact CG-CG 4.22Å; E487-K489 WeakPolarHBondContact OE1-CE 3.22Å; E487-K489 IonicContact OE1-NZ 3.13Å; E487-K489 PolarHBondContact OE1-NZ 2.69Å; E487-K489 WeakPolarHBondContact OE2-CE 3.33Å; E487-K489 IonicContact OE2-NZ 2.69Å; E487-K489 PolarHBondContact OE2-NZ 3.25Å
488	D	53.6	Low	58.2	Low	68 Å²	68	73.8 Å²	73.8	36%	0.364	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	103.6	172.3	-161.5	-34.2	0	0	0	110.1	T490 L491 T493	D488-T490 PolarHBondContact O-N 3.46Å; D488-T490 WeakPolarHBondContact OD1-CB 3.4Å; D488-T490 PolarHBondContact OD1-N 2.99Å; D488-T490 PolarHBondContact OD1-OG1 3.25Å; D488-L491 PolarHBondContact O-N 2.62Å; D488-T493 PolarHBondContact N-O 2.88Å
489	K	47	Very low	59.4	Low	160 Å²	160	76.2 Å²	76.2	70%	0.696	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-10.9	-176.2	-56.9	-167.3	-169.7	-123.7	0	113.3	E487	E487-K489 HydrophobicContact CG-CG 4.22Å; E487-K489 WeakPolarHBondContact OE1-CE 3.22Å; E487-K489 IonicContact OE1-NZ 3.13Å; E487-K489 PolarHBondContact OE1-NZ 2.69Å; E487-K489 WeakPolarHBondContact OE2-CE 3.33Å; E487-K489 IonicContact OE2-NZ 2.69Å; E487-K489 PolarHBondContact OE2-NZ 3.25Å
490	T	45.1	Very low	59.8	Low	111 Å²	111	74.6 Å²	74.6	68%	0.681	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-21.3	-179.1	66.1	0	0	0	0	113.5	D488	D488-T490 PolarHBondContact O-N 3.46Å; D488-T490 WeakPolarHBondContact OD1-CB 3.4Å; D488-T490 PolarHBondContact OD1-N 2.99Å; D488-T490 PolarHBondContact OD1-OG1 3.25Å
491	L	52.1	Low	60.2	Low	115 Å²	115	78.1 Å²	78.1	60%	0.602	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.7	17.3	-163.9	-76.2	168	0	0	0	115.1	D488 T493	D488-L491 PolarHBondContact O-N 2.62Å; L491-T493 PolarHBondContact O-N 3.5Å; L491-T493 PolarHBondContact O-OG1 2.84Å
492	F	64.3	Low	60.7	Low	144 Å²	144	73.3 Å²	73.3	63%	0.632	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.9	31.7	-175.3	-65.4	-81.9	0	0	0	113.5	T471 G472	T471-F492 WeakPolarHBondContact CA-O 3.45Å; G472-F492 PolarHBondContact N-O 2.98Å
493	T	66	Low	61.6	Low	30 Å²	30	63.9 Å²	63.9	18%	0.184	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	125.4	-167.5	-68.2	0	0	0	0	109.4	V469 F470 T471 D488 L491	V469-T493 HydrophobicContact CG2-CG2 3.62Å; F470-T493 WeakPolarHBondContact O-CA 3.48Å; T471-T493 HydrophobicContact CG2-CG2 4.14Å; D488-T493 PolarHBondContact N-O 2.88Å; L491-T493 PolarHBondContact O-N 3.5Å; L491-T493 PolarHBondContact O-OG1 2.84Å
494	H	72.4	Confident	62.6	Low	39 Å²	39	63 Å²	63	18%	0.181	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	131.7	-175.7	-66.3	5.6	0	0	0	109.9	F470 I474 F496	F470-H494 PolarHBondContact N-O 3.31Å; F470-H494 PolarHBondContact O-N 2.88Å; I474-H494 VanDerWaalsContact CD1-CD2 3.44Å; I474-H494 WeakPolarHBondContact CD1-CD2 3.43Å; H494-F496 HydrophobicContact CB-CE2 3.92Å; H494-F496 HydrophobicContact CB-CZ 4.05Å
495	I	74.6	Confident	63	Low	18 Å²	18	61.8 Å²	61.8	9%	0.092	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	117.8	177.6	-59.2	164.5	0	0	0	109.1	I456 T461 C467 V469 C485 I486	I456-I495 HydrophobicContact CD1-CD1 3.53Å; I456-I495 HydrophobicContact CD1-CG1 3.84Å; I456-I495 HydrophobicContact CG2-CG2 4.06Å; T461-I495 HydrophobicContact CG2-CG2 3.38Å; C467-I495 HydrophobicContact CB-CG2 4.3Å; V469-I495 HydrophobicContact CB-CG1 4.34Å; V469-I495 HydrophobicContact CG2-CG1 3.93Å; C485-I495 PolarHBondContact N-O 2.96Å; I486-I495 HydrophobicContact CB-CB 4.43Å; I486-I495 HydrophobicContact CB-CD1 4.21Å; I486-I495 HydrophobicContact CD1-CD1 4.24Å; I486-I495 PolarHBondContact O-N 3.3Å
496	F	78.6	Confident	63.3	Low	4 Å²	4	65.9 Å²	65.9	2%	0.018	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	147	-179.8	-61.6	-77.4	0	0	0	110.7	C467 F468 F470 I474 I480 V484 H494	C467-F496 CarbonylContact C-O 3.55Å; C467-F496 WeakPolarHBondContact CA-O 3.39Å; C467-F496 WeakPolarHBondContact CB-O 3.41Å; F468-F496 HydrophobicContact CD1-CB 4.11Å; F468-F496 HydrophobicContact CD2-CB 4.5Å; F468-F496 HydrophobicContact CD2-CD2 4.27Å; F468-F496 HydrophobicContact CE1-CB 3.61Å; F468-F496 HydrophobicContact CE1-CG 4.44Å; F468-F496 HydrophobicContact CE2-CB 4.04Å; F468-F496 AromaticContact CE2-CD2 3.55Å; F468-F496 HydrophobicContact CE2-CD2 3.55Å; F468-F496 HydrophobicContact CE2-CE2 4.38Å; F468-F496 HydrophobicContact CE2-CG 4.16Å; F468-F496 HydrophobicContact CZ-CB 3.57Å; F468-F496 AromaticContact CZ-CD2 3.76Å; F468-F496 HydrophobicContact CZ-CD2 3.76Å; F468-F496 AromaticContact CZ-CG 3.91Å; F468-F496 HydrophobicContact CZ-CG 3.91Å; F468-F496 PolarHBondContact N-O 3.08Å; F468-F496 PolarHBondContact O-N 2.92Å; F470-F496 HydrophobicContact CB-CD2 4.21Å; F470-F496 HydrophobicContact CB-CE2 3.75Å; F470-F496 HydrophobicContact CG-CE2 4.35Å; I474-F496 HydrophobicContact CD1-CZ 4.48Å; I480-F496 HydrophobicContact CB-CD1 4.08Å; I480-F496 HydrophobicContact CB-CE1 3.82Å; I480-F496 HydrophobicContact CG2-CB 4.5Å; I480-F496 HydrophobicContact CG2-CD1 3.36Å; I480-F496 HydrophobicContact CG2-CE1 3.64Å; I480-F496 HydrophobicContact CG2-CG 4.05Å; V484-F496 HydrophobicContact CG2-CD1 3.77Å; V484-F496 HydrophobicContact CG2-CE1 3.51Å; H494-F496 HydrophobicContact CB-CE2 3.92Å; H494-F496 HydrophobicContact CB-CZ 4.05Å
497	A	74.7	Confident	64.1	Low	17 Å²	17	65 Å²	65	14%	0.14	31%	0.312	C	S	.	.			trans	-108.9	155.8	166.8	0	0	0	0	0	111.6	N483 C485	N483-A497 PolarHBondContact O-N 3.45Å; N483-A497 VanDerWaalsContact O-N 3.1Å; C485-A497 WeakPolarHBondContact SG-CB 3.41Å
498	T	73.2	Confident	65.2	Low	17 Å²	17	60.8 Å²	60.8	10%	0.104	29%	0.293	C	S	.	.			trans	-129.9	161.4	174	63	0	0	0	0	110.9	F466 F468 S500 R504 W507	F466-T498 PolarHBondContact O-OG1 3.19Å; F468-T498 HydrophobicContact CD1-CG2 4.21Å; F468-T498 HydrophobicContact CE1-CG2 3.81Å; T498-S500 VanDerWaalsContact C-N 3.27Å; T498-S500 PolarHBondContact O-N 3.46Å; T498-S500 PolarHBondContact OG1-O 3.26Å; T498-R504 WeakPolarHBondContact OG1-CA 3.33Å; T498-R504 WeakPolarHBondContact OG1-CB 3.44Å; T498-R504 PolarHBondContact OG1-N 2.98Å; T498-R504 VanDerWaalsContact OG1-N 3.1Å; T498-W507 HydrophobicContact CG2-CB 4.43Å; T498-W507 HydrophobicContact CG2-CG 4.12Å
499	E	63.5	Low	65.8	Low	153 Å²	153	59.4 Å²	59.4	72%	0.715	28%	0.284	S	S	*	.	S	Bend	trans	-64.3	-27.8	-177.4	71.7	-135.3	133.3	0	0	114.2	S503	E499-S503 VanDerWaalsContact OE1-CB 3.24Å; E499-S503 WeakPolarHBondContact OE1-CB 3.17Å; E499-S503 PolarHBondContact OE1-OG 3.3Å
500	S	61.1	Low	66.9	Low	26 Å²	26	54 Å²	54	18%	0.182	27%	0.266	C	S	.	.	S	Bend	trans	-153.4	165.6	-172.1	89	0	0	0	0	111.5	F466 T498 E502 S503 R504	F466-S500 VanDerWaalsContact CD2-CA 3.43Å; F466-S500 VanDerWaalsContact CG-C 3.44Å; T498-S500 VanDerWaalsContact C-N 3.27Å; T498-S500 PolarHBondContact O-N 3.46Å; T498-S500 PolarHBondContact OG1-O 3.26Å; S500-E502 WeakPolarHBondContact CB-OE2 3.34Å; S500-E502 PolarHBondContact OG-N 3.46Å; S500-E502 PolarHBondContact OG-OE2 3.3Å; S500-S503 WeakPolarHBondContact O-CB 3.4Å; S500-S503 PolarHBondContact O-N 2.93Å; S500-S503 PolarHBondContact OG-N 2.87Å; S500-S503 VanDerWaalsContact OG-N 3.12Å; S500-R504 PolarHBondContact O-N 3.36Å
501	W	61.3	Low	68.4	Low	80 Å²	80	48.8 Å²	48.8	30%	0.303	23%	0.234	S	C	.	.	H	α-helix	trans	-69.1	-35.1	178.9	83.1	-84.9	0	0	0	112.3	F466 S503 R504 A505 F807	F466-W501 HydrophobicContact CD1-CB 3.56Å; F466-W501 HydrophobicContact CE1-CB 3.69Å; F466-W501 HydrophobicContact CG-CB 4.44Å; W501-S503 VanDerWaalsContact C-N 3.27Å; W501-S503 PolarHBondContact O-N 3.08Å; W501-R504 WeakPolarHBondContact O-CB 3.34Å; W501-R504 PolarHBondContact O-N 2.85Å; W501-A505 PolarHBondContact O-N 3.21Å; W501-F807 HydrophobicContact CH2-CD2 4.43Å; W501-F807 HydrophobicContact CH2-CE2 4.14Å
502	E	56.3	Low	69.6	Low	22 Å²	22	45.7 Å²	45.7	10%	0.103	21%	0.214	C	C	.	.	H	α-helix	trans	-64.3	-37.1	174.2	-49.4	84.2	166.9	0	0	110.1	S500 A505 R506 S811	S500-E502 WeakPolarHBondContact CB-OE2 3.34Å; S500-E502 PolarHBondContact OG-N 3.46Å; S500-E502 PolarHBondContact OG-OE2 3.3Å; E502-A505 PolarHBondContact O-N 3Å; E502-R506 WeakPolarHBondContact O-CB 3.2Å; E502-R506 WeakPolarHBondContact O-CG 3.46Å; E502-R506 PolarHBondContact O-N 2.93Å; E502-R506 PolarHBondContact O-NE 2.67Å; E502-S811 PolarHBondContact OE1-OG 2.74Å
503	S	66.8	Low	69.9	Low	3 Å²	3	43.4 Å²	43.4	2%	0.021	20%	0.201	C	C	.	.	H	α-helix	trans	-67.1	-44.5	175.5	-154.4	0	0	0	0	110.5	E499 S500 W501 A505 R506 W507	E499-S503 VanDerWaalsContact OE1-CB 3.24Å; E499-S503 WeakPolarHBondContact OE1-CB 3.17Å; E499-S503 PolarHBondContact OE1-OG 3.3Å; S500-S503 WeakPolarHBondContact O-CB 3.4Å; S500-S503 PolarHBondContact O-N 2.93Å; S500-S503 PolarHBondContact OG-N 2.87Å; S500-S503 VanDerWaalsContact OG-N 3.12Å; W501-S503 VanDerWaalsContact C-N 3.27Å; W501-S503 PolarHBondContact O-N 3.08Å; S503-A505 PolarHBondContact O-N 2.86Å; S503-R506 PolarHBondContact O-N 3Å; S503-R506 PolarHBondContact OG-NH1 3.06Å; S503-W507 WeakPolarHBondContact O-CB 3.05Å; S503-W507 PolarHBondContact O-N 2.85Å
504	R	77.3	Confident	70	Confident	66 Å²	66	44.7 Å²	44.7	25%	0.249	21%	0.209	C	C	.	.	H	α-helix	trans	-56	-48	170.8	-174.3	-178.5	69	164.6	3.1	112.1	F466 C467 F468 T498 S500 W501 W507 I508	F466-R504 HydrophobicContact CB-CB 4.31Å; F466-R504 WeakPolarHBondContact O-CD 3.37Å; C467-R504 WeakPolarHBondContact O-CD 3.47Å; C467-R504 PolarHBondContact O-NH1 2.97Å; F468-R504 HydrophobicContact CB-CG 4.15Å; F468-R504 HydrophobicContact CD1-CG 4.14Å; T498-R504 WeakPolarHBondContact OG1-CA 3.33Å; T498-R504 WeakPolarHBondContact OG1-CB 3.44Å; T498-R504 PolarHBondContact OG1-N 2.98Å; T498-R504 VanDerWaalsContact OG1-N 3.1Å; S500-R504 PolarHBondContact O-N 3.36Å; W501-R504 WeakPolarHBondContact O-CB 3.34Å; W501-R504 PolarHBondContact O-N 2.85Å; R504-W507 PolarHBondContact O-N 2.9Å; R504-I508 HydrophobicContact CG-CD1 3.78Å; R504-I508 HydrophobicContact CG-CG1 4.23Å; R504-I508 WeakPolarHBondContact O-CG1 3.36Å; R504-I508 PolarHBondContact O-N 3.38Å
505	A	66	Low	70	Confident	23 Å²	23	43 Å²	43	19%	0.19	20%	0.202	C	C	.	.	H	α-helix	trans	-61	-46.6	-178.3	0	0	0	0	0	111.4	W501 E502 S503 W507 I508 K509	W501-A505 PolarHBondContact O-N 3.21Å; E502-A505 PolarHBondContact O-N 3Å; S503-A505 PolarHBondContact O-N 2.86Å; A505-W507 VanDerWaalsContact C-N 3.34Å; A505-W507 PolarHBondContact O-N 3.1Å; A505-I508 PolarHBondContact O-N 3.02Å; A505-K509 WeakPolarHBondContact O-CB 3.13Å; A505-K509 PolarHBondContact O-N 3.42Å
506	R	64.6	Low	69.8	Low	117 Å²	117	46.3 Å²	46.3	44%	0.442	22%	0.216	S	C	.	.	H	α-helix	trans	-57.8	-44	172.9	-77.7	178.9	-87.4	115.2	-7.7	112.1	E502 S503 S510	E502-R506 WeakPolarHBondContact O-CB 3.2Å; E502-R506 WeakPolarHBondContact O-CG 3.46Å; E502-R506 PolarHBondContact O-N 2.93Å; E502-R506 PolarHBondContact O-NE 2.67Å; S503-R506 PolarHBondContact O-N 3Å; S503-R506 PolarHBondContact OG-NH1 3.06Å; R506-S510 VanDerWaalsContact O-CB 3.23Å; R506-S510 WeakPolarHBondContact O-CB 3.43Å; R506-S510 PolarHBondContact O-N 3.44Å
507	W	75.6	Confident	69.4	Low	55 Å²	55	50.8 Å²	50.8	21%	0.208	25%	0.245	C	C	.	.	H	α-helix	trans	-63.5	-49.1	177.9	-88.6	109.7	0	0	0	113.1	Y443 F468 I480 T498 S503 R504 A505 S510 L511	Y443-W507 WeakPolarHBondContact OH-CH2 3.22Å; Y443-W507 WeakPolarHBondContact OH-CZ3 3.16Å; F468-W507 HydrophobicContact CD1-CB 4.48Å; F468-W507 HydrophobicContact CE1-CB 3.77Å; F468-W507 HydrophobicContact CE1-CG 4.2Å; F468-W507 HydrophobicContact CZ-CB 4Å; F468-W507 HydrophobicContact CZ-CG 4.41Å; I480-W507 HydrophobicContact CD1-CE3 4.04Å; I480-W507 HydrophobicContact CD1-CH2 3.57Å; I480-W507 HydrophobicContact CD1-CZ2 4.5Å; I480-W507 HydrophobicContact CD1-CZ3 3.29Å; I480-W507 HydrophobicContact CG1-CH2 3.69Å; I480-W507 HydrophobicContact CG1-CZ2 4.4Å; I480-W507 HydrophobicContact CG1-CZ3 3.98Å; T498-W507 HydrophobicContact CG2-CB 4.43Å; T498-W507 HydrophobicContact CG2-CG 4.12Å; S503-W507 WeakPolarHBondContact O-CB 3.05Å; S503-W507 PolarHBondContact O-N 2.85Å; R504-W507 PolarHBondContact O-N 2.9Å; A505-W507 VanDerWaalsContact C-N 3.34Å; A505-W507 PolarHBondContact O-N 3.1Å; W507-S510 PolarHBondContact O-N 2.9Å; W507-L511 HydrophobicContact CE3-CD1 4.03Å; W507-L511 HydrophobicContact CE3-CG 4.19Å; W507-L511 WeakPolarHBondContact O-CB 3.36Å; W507-L511 VanDerWaalsContact O-CG 3.31Å; W507-L511 WeakPolarHBondContact O-CG 3.42Å; W507-L511 PolarHBondContact O-N 3.1Å
508	I	75.4	Confident	69.2	Low	9 Å²	9	54 Å²	54	5%	0.046	26%	0.26	C	S	.	.	H	α-helix	trans	-61.4	-46.2	176.6	-66	174.6	0	0	0	110.5	V453 T455 F468 R504 A505 L511 R512	V453-I508 HydrophobicContact CG1-CB 4.45Å; V453-I508 HydrophobicContact CG1-CG1 4.17Å; V453-I508 HydrophobicContact CG1-CG2 4.3Å; T455-I508 HydrophobicContact CG2-CD1 3.87Å; F468-I508 HydrophobicContact CB-CD1 3.81Å; F468-I508 HydrophobicContact CB-CG1 3.83Å; F468-I508 HydrophobicContact CD2-CG1 4.37Å; F468-I508 HydrophobicContact CG-CG1 4.06Å; R504-I508 HydrophobicContact CG-CD1 3.78Å; R504-I508 HydrophobicContact CG-CG1 4.23Å; R504-I508 WeakPolarHBondContact O-CG1 3.36Å; R504-I508 PolarHBondContact O-N 3.38Å; A505-I508 PolarHBondContact O-N 3.02Å; I508-L511 PolarHBondContact O-N 2.89Å; I508-R512 HydrophobicContact CG2-CG 4.31Å; I508-R512 WeakPolarHBondContact O-CB 3.3Å; I508-R512 VanDerWaalsContact O-CG 3.32Å; I508-R512 WeakPolarHBondContact O-CG 3.38Å; I508-R512 PolarHBondContact O-N 3.37Å
509	K	66.7	Low	69.2	Low	39 Å²	39	54.1 Å²	54.1	17%	0.17	26%	0.26	C	S	.	.	H	α-helix	trans	-61.8	-46.3	179.2	-170.2	-178.2	-167.4	-178.3	0	111.9	A505 R512 R513 D1060 I1062	A505-K509 WeakPolarHBondContact O-CB 3.13Å; A505-K509 PolarHBondContact O-N 3.42Å; K509-R512 PolarHBondContact O-N 3.12Å; K509-R513 WeakPolarHBondContact O-CB 3.46Å; K509-R513 WeakPolarHBondContact O-CG 3.29Å; K509-R513 PolarHBondContact O-N 3.39Å; K509-D1060 WeakPolarHBondContact CD-O 3.41Å; K509-D1060 PolarHBondContact NZ-O 2.86Å; K509-D1060 IonicContact NZ-OD1 2.87Å; K509-D1060 PolarHBondContact NZ-OD1 2.99Å; K509-I1062 PolarHBondContact NZ-O 3.22Å
510	S	68.4	Low	69.4	Low	46 Å²	46	49.8 Å²	49.8	32%	0.322	24%	0.24	S	C	.	.	H	α-helix	trans	-60.8	-51.7	178.3	-179.1	0	0	0	0	111.1	R506 W507 R512 R513 T514	R506-S510 VanDerWaalsContact O-CB 3.23Å; R506-S510 WeakPolarHBondContact O-CB 3.43Å; R506-S510 PolarHBondContact O-N 3.44Å; W507-S510 PolarHBondContact O-N 2.9Å; S510-R512 PolarHBondContact O-N 3.08Å; S510-R513 PolarHBondContact O-N 2.86Å; S510-T514 PolarHBondContact O-N 2.94Å; S510-T514 PolarHBondContact O-OG1 2.9Å; S510-T514 VanDerWaalsContact O-OG1 3.04Å
511	L	78.3	Confident	70.1	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-67	-34.5	-179	-65.3	168.8	0	0	0	112.7	Y443 V453 F468 F470 M477 W507 I508 T514 A515	Y443-L511 HydrophobicContact CD2-CD2 4.36Å; Y443-L511 HydrophobicContact CE2-CD2 4.07Å; V453-L511 HydrophobicContact CG1-CB 4.44Å; V453-L511 HydrophobicContact CG1-CD1 4.49Å; V453-L511 HydrophobicContact CG2-CB 3.96Å; F468-L511 HydrophobicContact CE2-CD1 3.54Å; F468-L511 HydrophobicContact CZ-CD1 3.85Å; F470-L511 HydrophobicContact CD2-CD1 4.41Å; M477-L511 HydrophobicContact CE-CD2 3.81Å; M477-L511 HydrophobicContact SD-CD2 4.48Å; W507-L511 HydrophobicContact CE3-CD1 4.03Å; W507-L511 HydrophobicContact CE3-CG 4.19Å; W507-L511 WeakPolarHBondContact O-CB 3.36Å; W507-L511 VanDerWaalsContact O-CG 3.31Å; W507-L511 WeakPolarHBondContact O-CG 3.42Å; W507-L511 PolarHBondContact O-N 3.1Å; I508-L511 PolarHBondContact O-N 2.89Å; L511-T514 PolarHBondContact O-N 3.29Å; L511-A515 VanDerWaalsContact O-CB 3.26Å; L511-A515 WeakPolarHBondContact O-CB 2.88Å; L511-A515 PolarHBondContact O-N 3.12Å
512	R	76	Confident	71	Confident	50 Å²	50	54.8 Å²	54.8	19%	0.189	27%	0.267	C	S	.	.	H	α-helix	trans	-62.8	-47.2	170.8	-78.1	-178.4	67.8	179.1	5.8	111.6	V453 I508 K509 S510 T514 A515 K516 E526 N578	V453-R512 HydrophobicContact CB-CG 4.41Å; I508-R512 HydrophobicContact CG2-CG 4.31Å; I508-R512 WeakPolarHBondContact O-CB 3.3Å; I508-R512 VanDerWaalsContact O-CG 3.32Å; I508-R512 WeakPolarHBondContact O-CG 3.38Å; I508-R512 PolarHBondContact O-N 3.37Å; K509-R512 PolarHBondContact O-N 3.12Å; S510-R512 PolarHBondContact O-N 3.08Å; R512-T514 VanDerWaalsContact C-N 3.34Å; R512-T514 PolarHBondContact O-N 3.04Å; R512-A515 PolarHBondContact O-N 2.75Å; R512-K516 PolarHBondContact O-N 3.38Å; R512-E526 IonicContact CZ-OE1 2.73Å; R512-E526 IonicContact NH1-OE1 2.62Å; R512-E526 PolarHBondContact NH1-OE1 3.37Å; R512-E526 IonicContact NH2-OE1 3.05Å; R512-E526 PolarHBondContact NH2-OE1 3.18Å; R512-N578 PolarHBondContact NH1-ND2 2.82Å; R512-N578 PolarHBondContact NH1-OD1 2.7Å
513	R	70.3	Confident	72.4	Confident	97 Å²	97	56.9 Å²	56.9	37%	0.366	28%	0.275	S	S	.	.	H	α-helix	trans	-60.3	-39.6	174.5	-79.6	179.1	166.1	173.1	-8.4	112	K509 S510 K516 P517 E520 D1060	K509-R513 WeakPolarHBondContact O-CB 3.46Å; K509-R513 WeakPolarHBondContact O-CG 3.29Å; K509-R513 PolarHBondContact O-N 3.39Å; S510-R513 PolarHBondContact O-N 2.86Å; R513-K516 CarbonylContact O-C 3.43Å; R513-K516 VanDerWaalsContact O-C 3.3Å; R513-P517 WeakPolarHBondContact O-CA 3.38Å; R513-P517 VanDerWaalsContact O-N 3.07Å; R513-E520 IonicContact CZ-OE1 3.32Å; R513-E520 IonicContact NE-OE1 2.78Å; R513-E520 PolarHBondContact NE-OE1 3.05Å; R513-E520 VanDerWaalsContact NH2-CD 3.34Å; R513-E520 IonicContact NH2-OE1 2.87Å; R513-E520 PolarHBondContact NH2-OE1 3.17Å; R513-E520 IonicContact NH2-OE2 2.94Å; R513-E520 PolarHBondContact NH2-OE2 3.2Å; R513-D1060 IonicContact NH1-OD1 3.18Å
514	T	69.2	Low	73.2	Confident	56 Å²	56	57.8 Å²	57.8	34%	0.344	28%	0.278	S	S	.	.	H	α-helix	trans	-70.8	-37.6	176.2	-46	0	0	0	0	112.7	Y443 L445 S510 L511 R512	Y443-T514 HydrophobicContact CD2-CG2 4.25Å; L445-T514 HydrophobicContact CD1-CG2 3.77Å; L445-T514 HydrophobicContact CG-CG2 4.41Å; S510-T514 PolarHBondContact O-N 2.94Å; S510-T514 PolarHBondContact O-OG1 2.9Å; S510-T514 VanDerWaalsContact O-OG1 3.04Å; L511-T514 PolarHBondContact O-N 3.29Å; R512-T514 VanDerWaalsContact C-N 3.34Å; R512-T514 PolarHBondContact O-N 3.04Å
515	A	71.7	Confident	73.5	Confident	5 Å²	5	56.7 Å²	56.7	4%	0.041	28%	0.277	C	S	.	.	H	α-helix	trans	-74.1	-28.3	179	0	0	0	0	0	113.6	L445 G449 I451 L511 R512	L445-A515 HydrophobicContact CD1-CB 4.38Å; G449-A515 PolarHBondContact N-O 2.91Å; I451-A515 HydrophobicContact CB-CB 4.08Å; I451-A515 HydrophobicContact CG2-CB 3.87Å; L511-A515 VanDerWaalsContact O-CB 3.26Å; L511-A515 WeakPolarHBondContact O-CB 2.88Å; L511-A515 PolarHBondContact O-N 3.12Å; R512-A515 PolarHBondContact O-N 2.75Å
516	K	71.8	Confident	74.2	Confident	87 Å²	87	57.2 Å²	57.2	38%	0.378	28%	0.276	S	S	.	.			trans	-144.5	79.5	-179.6	-63.3	-178.8	-174.8	171.3	0	110.1	R512 R513 N518 L519	R512-K516 PolarHBondContact O-N 3.38Å; R513-K516 CarbonylContact O-C 3.43Å; R513-K516 VanDerWaalsContact O-C 3.3Å; K516-N518 PolarHBondContact O-N 3.26Å; K516-L519 HydrophobicContact CB-CB 4.17Å; K516-L519 HydrophobicContact CD-CD1 4.36Å; K516-L519 VanDerWaalsContact O-CB 3.3Å; K516-L519 WeakPolarHBondContact O-CB 3.39Å; K516-L519 PolarHBondContact O-N 3.24Å; K516-L519 VanDerWaalsContact O-N 3.16Å
517	P	68.8	Low	75.3	Confident	97 Å²	97	51.9 Å²	51.9	63%	0.63	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-24.1	-174.9	24.3	-34.3	0	0	0	114.3	R513	R513-P517 WeakPolarHBondContact O-CA 3.38Å; R513-P517 VanDerWaalsContact O-N 3.07Å
518	N	71.6	Confident	75.8	Confident	85 Å²	85	50.3 Å²	50.3	46%	0.455	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	3.2	178.1	-67.1	-3.5	0	0	0	114.3	K516 E520 N521 E522	K516-N518 PolarHBondContact O-N 3.26Å; N518-E520 PolarHBondContact O-N 3.31Å; N518-N521 CarbonylContact O-C 3.27Å; N518-N521 WeakPolarHBondContact O-CA 3.5Å; N518-N521 PolarHBondContact O-N 3.36Å; N518-E522 VanDerWaalsContact CB-CD 3.42Å; N518-E522 HydrophobicContact CB-CG 3.93Å; N518-E522 WeakPolarHBondContact CB-OE1 3.43Å; N518-E522 PolarHBondContact ND2-OE1 3.37Å; N518-E522 PolarHBondContact O-N 3.21Å; N518-E522 VanDerWaalsContact O-N 3.09Å
519	L	71.6	Confident	76.4	Confident	20 Å²	20	50 Å²	50	11%	0.105	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-54.4	-34.3	-169.7	-174	69.9	0	0	0	114	K516 N521 H524	K516-L519 HydrophobicContact CB-CB 4.17Å; K516-L519 HydrophobicContact CD-CD1 4.36Å; K516-L519 VanDerWaalsContact O-CB 3.3Å; K516-L519 WeakPolarHBondContact O-CB 3.39Å; K516-L519 PolarHBondContact O-N 3.24Å; K516-L519 VanDerWaalsContact O-N 3.16Å; L519-N521 VanDerWaalsContact C-N 3.25Å; L519-N521 PolarHBondContact O-N 3.25Å; L519-H524 HydrophobicContact CD1-CB 3.95Å; L519-H524 PolarHBondContact O-CE1 3.03Å; L519-H524 PolarHBondContact O-ND1 3.17Å
520	E	69.4	Low	77.4	Confident	61 Å²	61	52.8 Å²	52.8	29%	0.285	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-75.1	-13.2	178.4	-70.2	163.7	-148.1	0	0	113.4	R513 N518 L721 N1065	R513-E520 IonicContact CZ-OE1 3.32Å; R513-E520 IonicContact NE-OE1 2.78Å; R513-E520 PolarHBondContact NE-OE1 3.05Å; R513-E520 VanDerWaalsContact NH2-CD 3.34Å; R513-E520 IonicContact NH2-OE1 2.87Å; R513-E520 PolarHBondContact NH2-OE1 3.17Å; R513-E520 IonicContact NH2-OE2 2.94Å; R513-E520 PolarHBondContact NH2-OE2 3.2Å; N518-E520 PolarHBondContact O-N 3.31Å; E520-L721 PolarHBondContact O-N 3.33Å; E520-L721 VanDerWaalsContact O-N 3.17Å; E520-N1065 WeakPolarHBondContact CA-ND2 3.31Å; E520-N1065 PolarHBondContact O-ND2 2.76Å
521	N	76	Confident	78.4	Confident	112 Å²	112	50.6 Å²	50.6	60%	0.599	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-114.9	1.8	-179.3	-65.2	-51.3	0	0	0	113.3	N518 L519 P720	N518-N521 CarbonylContact O-C 3.27Å; N518-N521 WeakPolarHBondContact O-CA 3.5Å; N518-N521 PolarHBondContact O-N 3.36Å; L519-N521 VanDerWaalsContact C-N 3.25Å; L519-N521 PolarHBondContact O-N 3.25Å; N521-P720 VanDerWaalsContact O-CG 3.28Å; N521-P720 WeakPolarHBondContact O-CG 3.48Å
522	E	79	Confident	78.7	Confident	100 Å²	100	50.8 Å²	50.8	47%	0.467	25%	0.247	S	C	.	.	S	Bend	trans	-124.6	139.7	-177.4	-74.6	175.7	-168	0	0	110.7	N518 H524	N518-E522 VanDerWaalsContact CB-CD 3.42Å; N518-E522 HydrophobicContact CB-CG 3.93Å; N518-E522 WeakPolarHBondContact CB-OE1 3.43Å; N518-E522 PolarHBondContact ND2-OE1 3.37Å; N518-E522 PolarHBondContact O-N 3.21Å; N518-E522 VanDerWaalsContact O-N 3.09Å; E522-H524 PolarHBondContact O-N 2.99Å; E522-H524 PolarHBondContact O-ND1 3.38Å; E522-H524 VanDerWaalsContact O-ND1 3.11Å
523	Y	85.1	Confident	79.2	Confident	66 Å²	66	48.4 Å²	48.4	26%	0.259	24%	0.238	S	C	.	.			trans	-63.5	127.3	173.3	165.1	-102.1	0	0	0	110.4	L525 V718 L719 L1178 S1181	Y523-L525 WeakPolarHBondContact OH-CD2 3.2Å; Y523-V718 VanDerWaalsContact CA-O 3.31Å; Y523-V718 WeakPolarHBondContact CA-O 3.23Å; Y523-V718 VanDerWaalsContact CD2-O 3.24Å; Y523-V718 WeakPolarHBondContact CD2-O 3.49Å; Y523-L719 HydrophobicContact CD2-CD2 3.98Å; Y523-L1178 HydrophobicContact CD2-CD2 4.27Å; Y523-L1178 HydrophobicContact CE2-CD2 3.82Å; Y523-S1181 WeakPolarHBondContact CD1-OG 3.42Å; Y523-S1181 VanDerWaalsContact CD2-OG 3.23Å; Y523-S1181 WeakPolarHBondContact CD2-OG 3.11Å; Y523-S1181 VanDerWaalsContact CE2-OG 3.29Å; Y523-S1181 WeakPolarHBondContact CE2-OG 3.17Å
524	H	83.7	Confident	79.9	Confident	21 Å²	21	44.5 Å²	44.5	10%	0.097	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	172.2	179.6	64.8	-91.3	0	0	0	112.4	L519 E522 V718	L519-H524 HydrophobicContact CD1-CB 3.95Å; L519-H524 PolarHBondContact O-CE1 3.03Å; L519-H524 PolarHBondContact O-ND1 3.17Å; E522-H524 PolarHBondContact O-N 2.99Å; E522-H524 PolarHBondContact O-ND1 3.38Å; E522-H524 VanDerWaalsContact O-ND1 3.11Å; H524-V718 PolarHBondContact N-O 2.92Å; H524-V718 PolarHBondContact O-N 3.14Å
525	L	83.5	Confident	80.8	Confident	44 Å²	44	44.1 Å²	44.1	23%	0.23	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	128.7	172.2	-64.9	173.7	0	0	0	108.7	Y523 L716	Y523-L525 WeakPolarHBondContact OH-CD2 3.2Å; L525-L716 WeakPolarHBondContact CA-O 3.35Å
526	E	82	Confident	81.4	Confident	34 Å²	34	44.2 Å²	44.2	16%	0.159	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	116.9	162.4	-73.9	-113.2	112.5	0	0	108.3	R512 N578 L716 V718 C1066	R512-E526 IonicContact CZ-OE1 2.73Å; R512-E526 IonicContact NH1-OE1 2.62Å; R512-E526 PolarHBondContact NH1-OE1 3.37Å; R512-E526 IonicContact NH2-OE1 3.05Å; R512-E526 PolarHBondContact NH2-OE1 3.18Å; E526-N578 PolarHBondContact OE1-OD1 3.39Å; E526-L716 HydrophobicContact CB-CB 4.25Å; E526-L716 PolarHBondContact N-O 2.87Å; E526-L716 PolarHBondContact O-N 3.34Å; E526-V718 HydrophobicContact CB-CG2 4.43Å; E526-V718 HydrophobicContact CG-CG2 4.01Å; E526-C1066 PolarHBondContact OE2-SG 3.05Å
527	N	86.9	Confident	82	Confident	4 Å²	4	45.9 Å²	45.9	2%	0.021	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	134.4	176.9	-56.6	-61	0	0	0	110.4	N578 L579 P580 N581 Y713 Q714 S715	N527-N578 PolarHBondContact O-N 3.15Å; N527-N578 VanDerWaalsContact O-N 3.15Å; N527-L579 HydrophobicContact CB-CB 3.94Å; N527-L579 WeakPolarHBondContact CB-O 3.35Å; N527-L579 PolarHBondContact ND2-O 3.47Å; N527-L579 VanDerWaalsContact ND2-O 3.14Å; N527-L579 PolarHBondContact O-N 3.48Å; N527-P580 PolarHBondContact ND2-O 3.17Å; N527-N581 PolarHBondContact ND2-N 2.79Å; N527-N581 PolarHBondContact ND2-OD1 2.94Å; N527-Y713 HydrophobicContact CB-CE2 4.2Å; N527-Y713 WeakPolarHBondContact CB-OH 3.48Å; N527-Y713 PolarHBondContact OD1-OH 3.5Å; N527-Y713 VanDerWaalsContact OD1-OH 3.07Å; N527-Q714 WeakPolarHBondContact CA-O 3.44Å; N527-S715 WeakPolarHBondContact OD1-CB 3.32Å; N527-S715 PolarHBondContact OD1-OG 2.98Å
528	S	87.2	Confident	82.6	Confident	22 Å²	22	44.7 Å²	44.7	15%	0.154	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	150.7	173.4	64.5	0	0	0	0	112	L576 N577 Y713 Q714	S528-L576 CarbonylContact C-O 3.57Å; S528-L576 VanDerWaalsContact CA-O 3.25Å; S528-L576 WeakPolarHBondContact CA-O 3.4Å; S528-N577 WeakPolarHBondContact CB-OD1 3.48Å; S528-Y713 WeakPolarHBondContact O-CA 3.38Å; S528-Y713 VanDerWaalsContact O-CD2 3.28Å; S528-Y713 WeakPolarHBondContact O-CD2 3.12Å; S528-Q714 PolarHBondContact N-O 2.97Å; S528-Q714 PolarHBondContact O-N 3.4Å
529	L	88.2	Confident	83.1	Confident	4 Å²	4	41.5 Å²	41.5	2%	0.021	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	119	174.6	176.6	63.7	0	0	0	109.2	L551 L576 L579 M585 I631 R712 Y713	L529-L551 HydrophobicContact CD2-CD1 4.08Å; L529-L551 HydrophobicContact CD2-CD2 3.64Å; L529-L551 HydrophobicContact CD2-CG 4.48Å; L529-L576 HydrophobicContact CB-CB 4.47Å; L529-L576 PolarHBondContact N-O 3.13Å; L529-L576 PolarHBondContact O-N 2.76Å; L529-L579 HydrophobicContact CB-CD1 3.65Å; L529-M585 HydrophobicContact CD2-SD 3.88Å; L529-I631 HydrophobicContact CD1-CD1 3.83Å; L529-R712 WeakPolarHBondContact CA-O 3.29Å; L529-Y713 HydrophobicContact CB-CD2 4.24Å; L529-Y713 HydrophobicContact CD1-CD2 4.49Å
530	R	86.4	Confident	83.3	Confident	96 Å²	96	44.2 Å²	44.2	36%	0.362	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	130.5	161.5	-176.4	170.5	-71.9	178.6	-2	109.1	F574 D575 A711 R712	R530-F574 CarbonylContact C-O 3.55Å; R530-F574 VanDerWaalsContact CA-O 3.32Å; R530-F574 WeakPolarHBondContact CA-O 3.5Å; R530-D575 IonicContact CZ-OD2 3.62Å; R530-D575 IonicContact NE-OD2 2.7Å; R530-D575 PolarHBondContact NE-OD2 3.46Å; R530-D575 IonicContact NH2-OD2 3.9Å; R530-D575 PolarHBondContact NH2-OD2 2.95Å; R530-A711 CarbonylContact O-C 3.58Å; R530-A711 WeakPolarHBondContact O-CA 3.45Å; R530-R712 HydrophobicContact CB-CB 4.49Å; R530-R712 PolarHBondContact N-O 2.83Å; R530-R712 PolarHBondContact O-N 2.88Å
531	L	89.1	Confident	83.2	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	127.8	179.2	173.3	68.9	0	0	0	109.9	I533 I549 F574 M585 I587 I709 R710 A711	L531-I533 HydrophobicContact CD2-CG1 4.5Å; L531-I533 HydrophobicContact CG-CG1 4.44Å; L531-I549 HydrophobicContact CD2-CD1 3.76Å; L531-I549 HydrophobicContact CD2-CG1 3.92Å; L531-I549 HydrophobicContact CD2-CG2 3.78Å; L531-F574 HydrophobicContact CB-CB 4.4Å; L531-F574 HydrophobicContact CG-CD2 4.48Å; L531-F574 PolarHBondContact N-O 3.12Å; L531-F574 WeakPolarHBondContact O-CD2 3.42Å; L531-F574 PolarHBondContact O-N 3.12Å; L531-M585 HydrophobicContact CD1-CE 4.25Å; L531-M585 HydrophobicContact CD1-SD 4.42Å; L531-M585 HydrophobicContact CD2-SD 3.88Å; L531-I587 HydrophobicContact CD1-CD1 4.26Å; L531-I587 HydrophobicContact CD2-CD1 4.23Å; L531-I709 HydrophobicContact CD1-CB 4.22Å; L531-I709 HydrophobicContact CD1-CD1 4.25Å; L531-R710 CarbonylContact C-O 3.54Å; L531-R710 WeakPolarHBondContact CA-O 3.45Å; L531-A711 HydrophobicContact CD1-CB 4.02Å
532	S	86	Confident	82.6	Confident	4 Å²	4	48.7 Å²	48.7	3%	0.028	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	127.1	165.8	-43.2	0	0	0	0	109.1	E572 D573 I709 R710	S532-E572 WeakPolarHBondContact CA-O 3.33Å; S532-D573 WeakPolarHBondContact CB-OD1 3.49Å; S532-D573 PolarHBondContact OG-OD1 3.3Å; S532-I709 CarbonylContact O-C 3.57Å; S532-I709 WeakPolarHBondContact O-CA 3.34Å; S532-R710 PolarHBondContact N-O 3.28Å; S532-R710 PolarHBondContact O-N 2.95Å
533	I	86.2	Confident	82.1	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	118	164.8	-66.2	-177.7	0	0	0	107.4	L531 C547 I549 T559 W570 A571 E572 I587 L707 I709	L531-I533 HydrophobicContact CD2-CG1 4.5Å; L531-I533 HydrophobicContact CG-CG1 4.44Å; I533-C547 HydrophobicContact CD1-CB 3.82Å; I533-I549 HydrophobicContact CD1-CD1 3.93Å; I533-I549 HydrophobicContact CD1-CG1 3.99Å; I533-T559 HydrophobicContact CB-CG2 4.28Å; I533-T559 HydrophobicContact CD1-CG2 3.73Å; I533-T559 HydrophobicContact CG1-CG2 4.44Å; I533-W570 HydrophobicContact CG2-CB 4.22Å; I533-W570 HydrophobicContact CG2-CD2 3.86Å; I533-W570 HydrophobicContact CG2-CE3 3.74Å; I533-W570 HydrophobicContact CG2-CG 4.09Å; I533-W570 HydrophobicContact CG2-CZ3 4.38Å; I533-W570 WeakPolarHBondContact O-CB 3.2Å; I533-A571 WeakPolarHBondContact O-CA 3.44Å; I533-A571 PolarHBondContact O-N 2.61Å; I533-E572 PolarHBondContact N-O 2.53Å; I533-I587 HydrophobicContact CD1-CD1 4.28Å; I533-I587 HydrophobicContact CD1-CG2 3.77Å; I533-L707 HydrophobicContact CD1-CD2 4.36Å; I533-L707 HydrophobicContact CG2-CD1 3.92Å; I533-L707 HydrophobicContact CG2-CD2 4.28Å; I533-L707 HydrophobicContact CG2-CG 4.31Å; I533-I709 HydrophobicContact CG1-CG2 4.26Å
534	L	85.1	Confident	81.7	Confident	15 Å²	15	54.6 Å²	54.6	8%	0.079	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-74.3	-165.8	-58.7	176.2	0	0	0	111.4	F569 W570 Q638 R708 R710	L534-F569 WeakPolarHBondContact O-CD2 3.29Å; L534-W570 PolarHBondContact O-N 3.48Å; L534-Q638 HydrophobicContact CD1-CG 4.13Å; L534-R708 HydrophobicContact CB-CB 4.43Å; L534-R708 WeakPolarHBondContact CB-O 3.42Å; L534-R708 HydrophobicContact CD1-CG 4.2Å; L534-R708 PolarHBondContact N-O 3.25Å; L534-R710 HydrophobicContact CD1-CB 4.31Å
535	E	86.8	Confident	81.7	Confident	49 Å²	49	54 Å²	54	23%	0.229	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	163.5	-176.6	77.6	-171.3	-149	0	0	110.9	R537 I568 F569 W640 R708	E535-R537 IonicContact OE1-NE 3.84Å; E535-R537 IonicContact OE1-NH2 3.6Å; E535-I568 CarbonylContact C-O 3.5Å; E535-I568 WeakPolarHBondContact CA-O 3.41Å; E535-F569 HydrophobicContact CB-CD2 4.17Å; E535-W640 HydrophobicContact CG-CH2 3.55Å; E535-W640 HydrophobicContact CG-CZ2 4.15Å; E535-W640 HydrophobicContact CG-CZ3 4.37Å; E535-W640 VanDerWaalsContact OE1-CH2 3.23Å; E535-W640 WeakPolarHBondContact OE1-CH2 3.31Å; E535-W640 VanDerWaalsContact OE1-CZ2 3.28Å; E535-W640 WeakPolarHBondContact OE1-CZ2 3.49Å; E535-R708 VanDerWaalsContact CD-NH2 3.29Å; E535-R708 HydrophobicContact CG-CB 4.24Å; E535-R708 PolarHBondContact O-N 2.96Å; E535-R708 IonicContact OE1-CZ 2.73Å; E535-R708 IonicContact OE1-NH1 3.17Å; E535-R708 PolarHBondContact OE1-NH1 3.18Å; E535-R708 IonicContact OE2-CZ 2.72Å; E535-R708 VanDerWaalsContact OE2-CZ 3.22Å; E535-R708 IonicContact OE2-NH1 2.65Å; E535-R708 PolarHBondContact OE2-NH1 3.44Å; E535-R708 IonicContact OE2-NH2 3.46Å; E535-R708 PolarHBondContact OE2-NH2 3Å
536	A	85.3	Confident	81.9	Confident	6 Å²	6	53.2 Å²	53.2	5%	0.05	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	151.3	171.6	0	0	0	0	0	113.2	I539 I568 W570 Q706 L707	A536-I539 HydrophobicContact CB-CD1 3.5Å; A536-I568 PolarHBondContact N-O 3.14Å; A536-W570 HydrophobicContact CB-CH2 3.81Å; A536-W570 HydrophobicContact CB-CZ3 3.57Å; A536-Q706 CarbonylContact C-O 3.59Å; A536-Q706 WeakPolarHBondContact CA-O 3.34Å; A536-Q706 VanDerWaalsContact CB-O 3.24Å; A536-Q706 WeakPolarHBondContact CB-O 3.38Å; A536-L707 HydrophobicContact CB-CD1 4.11Å
537	R	84.4	Confident	82.1	Confident	122 Å²	122	51.6 Å²	51.6	46%	0.46	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	164.8	177.4	-66.1	177	-178	177.1	4.3	110.4	E535 I539 W640 Q706	E535-R537 IonicContact OE1-NE 3.84Å; E535-R537 IonicContact OE1-NH2 3.6Å; R537-I539 VanDerWaalsContact C-N 3.3Å; R537-I539 PolarHBondContact O-N 2.98Å; R537-W640 HydrophobicContact CB-CZ3 4.4Å; R537-W640 VanDerWaalsContact CD-CH2 3.49Å; R537-W640 HydrophobicContact CG-CH2 3.7Å; R537-W640 HydrophobicContact CG-CZ3 3.82Å; R537-W640 VanDerWaalsContact NH2-CZ2 3.31Å; R537-Q706 HydrophobicContact CB-CB 4.45Å; R537-Q706 PolarHBondContact N-O 3.22Å; R537-Q706 PolarHBondContact O-N 2.98Å; R537-Q706 VanDerWaalsContact O-N 3.13Å
538	N	82.3	Confident	82.2	Confident	72 Å²	72	51.9 Å²	51.9	39%	0.385	24%	0.236	S	C	.	.	S	Bend	trans	59.7	34.1	176.1	-58.4	-8	0	0	0	114.6	T702 F704	N538-T702 PolarHBondContact ND2-O 3.07Å; N538-F704 VanDerWaalsContact CB-O 3.26Å; N538-F704 WeakPolarHBondContact CB-O 3.37Å; N538-F704 PolarHBondContact ND2-O 3.24Å
539	I	81.3	Confident	82.3	Confident	19 Å²	19	50.9 Å²	50.9	10%	0.097	23%	0.229	C	C	.	.	S	Bend	trans	-135.3	137.2	177.6	-55.5	147.5	0	0	0	109.2	A536 R537 P541 Y545 I568 L589 P705	A536-I539 HydrophobicContact CB-CD1 3.5Å; R537-I539 VanDerWaalsContact C-N 3.3Å; R537-I539 PolarHBondContact O-N 2.98Å; I539-P541 WeakPolarHBondContact O-CD 3.37Å; I539-Y545 HydrophobicContact CG2-CD1 4.12Å; I539-Y545 HydrophobicContact CG2-CE1 3.44Å; I539-Y545 VanDerWaalsContact CG2-CE1 3.44Å; I539-Y545 HydrophobicContact CG2-CE2 4.09Å; I539-Y545 VanDerWaalsContact CG2-CZ 3.42Å; I539-Y545 WeakPolarHBondContact CG2-OH 3.36Å; I539-I568 HydrophobicContact CB-CD1 3.67Å; I539-I568 HydrophobicContact CD1-CD1 4.26Å; I539-I568 HydrophobicContact CG2-CD1 3.36Å; I539-L589 HydrophobicContact CD1-CD2 3.54Å; I539-L589 HydrophobicContact CG1-CD2 4.29Å; I539-P705 HydrophobicContact CD1-CB 4.15Å; I539-P705 HydrophobicContact CG1-CB 3.75Å; I539-P705 HydrophobicContact CG1-CG 4.15Å
540	P	75	Confident	82.2	Confident	77 Å²	77	51.8 Å²	51.8	50%	0.5	24%	0.235	S	C	.	.			trans	-63.6	119.9	-177.5	-25.4	35.2	0	0	0	114.4	K542 Y545	P540-K542 PolarHBondContact O-N 3.21Å; P540-Y545 VanDerWaalsContact O-CE2 3.31Å; P540-Y545 WeakPolarHBondContact O-CE2 3.23Å; P540-Y545 PolarHBondContact O-OH 3.35Å
541	P	67.9	Low	82.2	Confident	64 Å²	64	47.4 Å²	47.4	42%	0.416	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	2.1	-174.6	30.1	-37	0	0	0	115.1	I539	I539-P541 WeakPolarHBondContact O-CD 3.37Å
542	K	64.1	Low	82	Confident	203 Å²	203	50.3 Å²	50.3	88%	0.883	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	2.6	-177	-70.5	-172.8	177.5	179.8	0	114.6	P540	P540-K542 PolarHBondContact O-N 3.21Å
543	R	68.7	Low	81.6	Confident	125 Å²	125	61.3 Å²	61.3	47%	0.472	28%	0.275	S	S	.	.	S	Bend	trans	-126.4	170.4	-179.1	-65.8	179.4	-179.5	-134.6	5.8	110.4	Y545	R543-Y545 VanDerWaalsContact C-CE2 3.43Å; R543-Y545 HydrophobicContact CB-CE2 3.67Å; R543-Y545 WeakPolarHBondContact O-CD2 3.38Å; R543-Y545 WeakPolarHBondContact O-CE2 3.4Å
544	R	76	Confident	81.2	Confident	165 Å²	165	64.7 Å²	64.7	62%	0.623	30%	0.296	S	S	*	.			trans	-95.2	147.4	173.9	-70.7	178.5	174.7	-171.7	-0.9	111	E592	R544-E592 HydrophobicContact CB-CB 3.92Å; R544-E592 WeakPolarHBondContact CB-OE2 3.28Å; R544-E592 WeakPolarHBondContact CD-OE2 3.21Å; R544-E592 IonicContact NE-OE2 3.7Å; R544-E592 IonicContact NH1-OE2 3.65Å; R544-E592 PolarHBondContact NH1-OE2 2.54Å; R544-E592 PolarHBondContact O-N 2.91Å
545	Y	84.7	Confident	80.9	Confident	7 Å²	7	66.8 Å²	66.8	3%	0.027	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	155.6	-172.2	-62.4	-87.5	0	0	0	110.8	I539 P540 R543 S561 I568 Y590 R591 I621	I539-Y545 HydrophobicContact CG2-CD1 4.12Å; I539-Y545 HydrophobicContact CG2-CE1 3.44Å; I539-Y545 VanDerWaalsContact CG2-CE1 3.44Å; I539-Y545 HydrophobicContact CG2-CE2 4.09Å; I539-Y545 VanDerWaalsContact CG2-CZ 3.42Å; I539-Y545 WeakPolarHBondContact CG2-OH 3.36Å; P540-Y545 VanDerWaalsContact O-CE2 3.31Å; P540-Y545 WeakPolarHBondContact O-CE2 3.23Å; P540-Y545 PolarHBondContact O-OH 3.35Å; R543-Y545 VanDerWaalsContact C-CE2 3.43Å; R543-Y545 HydrophobicContact CB-CE2 3.67Å; R543-Y545 WeakPolarHBondContact O-CD2 3.38Å; R543-Y545 WeakPolarHBondContact O-CE2 3.4Å; Y545-S561 PolarHBondContact N-OG 2.75Å; Y545-S561 VanDerWaalsContact N-OG 3.13Å; Y545-S561 WeakPolarHBondContact O-CB 3.42Å; Y545-S561 PolarHBondContact O-N 3.29Å; Y545-S561 PolarHBondContact O-OG 2.75Å; Y545-I568 HydrophobicContact CD1-CD1 4.34Å; Y545-I568 HydrophobicContact CD2-CD1 3.31Å; Y545-I568 HydrophobicContact CD2-CG1 3.96Å; Y545-I568 HydrophobicContact CD2-CG2 4.43Å; Y545-I568 HydrophobicContact CE1-CD1 4.43Å; Y545-I568 HydrophobicContact CE2-CD1 3.42Å; Y545-I568 VanDerWaalsContact CE2-CD1 3.42Å; Y545-I568 HydrophobicContact CE2-CG1 4.21Å; Y545-I568 HydrophobicContact CG-CD1 3.81Å; Y545-Y590 VanDerWaalsContact CA-O 3.25Å; Y545-Y590 WeakPolarHBondContact CA-O 3.24Å; Y545-Y590 WeakPolarHBondContact CD1-O 3.21Å; Y545-R591 HydrophobicContact CD1-CB 4.33Å; Y545-R591 HydrophobicContact CD1-CG 4.32Å; Y545-R591 HydrophobicContact CE1-CB 4.09Å; Y545-R591 HydrophobicContact CE1-CG 3.73Å; Y545-I621 HydrophobicContact CD1-CD1 3.43Å; Y545-I621 VanDerWaalsContact CD1-CD1 3.43Å; Y545-I621 HydrophobicContact CE1-CD1 3.29Å
546	Y	86.1	Confident	80.6	Confident	28 Å²	28	65.1 Å²	65.1	11%	0.11	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	155.1	169.4	62.8	-90.9	0	0	0	109.9	D548 R558 T559 Y590 N618	Y546-D548 VanDerWaalsContact CD2-OD1 3.3Å; Y546-D548 WeakPolarHBondContact CD2-OD1 3.24Å; Y546-D548 WeakPolarHBondContact CE2-OD1 3.47Å; Y546-R558 HydrophobicContact CD2-CG 3.85Å; Y546-R558 HydrophobicContact CG-CG 4.35Å; Y546-T559 VanDerWaalsContact CB-O 3.22Å; Y546-T559 WeakPolarHBondContact CB-O 3.27Å; Y546-Y590 AromaticContact CD2-CD2 3.96Å; Y546-Y590 HydrophobicContact CD2-CD2 3.96Å; Y546-Y590 HydrophobicContact CD2-CG 4.31Å; Y546-Y590 HydrophobicContact CE1-CG 4.37Å; Y546-Y590 AromaticContact CE2-CD2 3.37Å; Y546-Y590 HydrophobicContact CE2-CD2 3.37Å; Y546-Y590 HydrophobicContact CE2-CE2 4.19Å; Y546-Y590 AromaticContact CE2-CG 3.58Å; Y546-Y590 HydrophobicContact CE2-CG 3.58Å; Y546-Y590 AromaticContact CZ-CD2 3.92Å; Y546-Y590 AromaticContact CZ-CG 3.61Å; Y546-Y590 PolarHBondContact N-O 3.23Å; Y546-Y590 VanDerWaalsContact N-O 3.12Å; Y546-Y590 PolarHBondContact O-N 3.44Å; Y546-N618 HydrophobicContact CE1-CB 4.24Å; Y546-N618 WeakPolarHBondContact CE1-ND2 3.44Å; Y546-N618 WeakPolarHBondContact OH-CB 3.34Å; Y546-N618 PolarHBondContact OH-ND2 2.83Å
547	C	87.7	Confident	80.4	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	127.4	173.9	-54.3	0	0	0	0	108.3	I533 R558 T559 I587 S588 L589	I533-C547 HydrophobicContact CD1-CB 3.82Å; C547-R558 CarbonylContact O-C 3.58Å; C547-R558 WeakPolarHBondContact O-CA 3.46Å; C547-T559 HydrophobicContact CB-CG2 3.82Å; C547-T559 PolarHBondContact N-OG1 2.95Å; C547-T559 PolarHBondContact O-N 2.99Å; C547-I587 HydrophobicContact CB-CG2 3.9Å; C547-S588 CarbonylContact C-O 3.5Å; C547-S588 VanDerWaalsContact CA-O 3.28Å; C547-S588 WeakPolarHBondContact CA-O 3.33Å; C547-L589 VanDerWaalsContact SG-CD1 3.55Å
548	D	87.9	Confident	80.2	Confident	11 Å²	11	63.3 Å²	63.3	6%	0.059	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	130.3	167.3	-75.3	-3.7	0	0	0	108.9	Y546 L555 R558 I587 S588 Y590	Y546-D548 VanDerWaalsContact CD2-OD1 3.3Å; Y546-D548 WeakPolarHBondContact CD2-OD1 3.24Å; Y546-D548 WeakPolarHBondContact CE2-OD1 3.47Å; D548-L555 HydrophobicContact CB-CD1 3.72Å; D548-R558 WeakPolarHBondContact OD1-CG 3.31Å; D548-R558 IonicContact OD1-CZ 2.74Å; D548-R558 IonicContact OD1-NE 3.22Å; D548-R558 PolarHBondContact OD1-NE 3.47Å; D548-R558 IonicContact OD1-NH2 2.73Å; D548-R558 PolarHBondContact OD1-NH2 2.88Å; D548-R558 IonicContact OD2-CZ 2.65Å; D548-R558 IonicContact OD2-NE 2.88Å; D548-R558 IonicContact OD2-NH2 2.68Å; D548-R558 PolarHBondContact OD2-NH2 2.86Å; D548-I587 CarbonylContact O-C 3.54Å; D548-I587 WeakPolarHBondContact O-CA 3.35Å; D548-S588 PolarHBondContact N-O 3.25Å; D548-S588 PolarHBondContact O-N 2.97Å; D548-Y590 HydrophobicContact CB-CD2 4.47Å; D548-Y590 HydrophobicContact CB-CE2 4.01Å; D548-Y590 WeakPolarHBondContact OD2-CE2 3.39Å
549	I	89.5	Confident	80.1	Confident	1 Å²	1	60 Å²	60	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	106.1	-179	-61.7	153.1	0	0	0	107.1	L531 I533 Y556 A557 T559 F574	L531-I549 HydrophobicContact CD2-CD1 3.76Å; L531-I549 HydrophobicContact CD2-CG1 3.92Å; L531-I549 HydrophobicContact CD2-CG2 3.78Å; I533-I549 HydrophobicContact CD1-CD1 3.93Å; I533-I549 HydrophobicContact CD1-CG1 3.99Å; I549-Y556 PolarHBondContact O-N 3.46Å; I549-A557 HydrophobicContact CB-CB 4.15Å; I549-A557 HydrophobicContact CD1-CB 3.78Å; I549-A557 PolarHBondContact N-O 2.73Å; I549-A557 PolarHBondContact O-N 3.1Å; I549-T559 HydrophobicContact CD1-CG2 4.13Å; I549-F574 HydrophobicContact CD1-CD1 4.31Å; I549-F574 HydrophobicContact CD1-CD2 3.69Å; I549-F574 HydrophobicContact CD1-CE1 4.24Å; I549-F574 HydrophobicContact CD1-CE2 3.64Å; I549-F574 HydrophobicContact CD1-CG 4.07Å; I549-F574 HydrophobicContact CD1-CZ 3.96Å
550	C	86.1	Confident	79.6	Confident	22 Å²	22	62.7 Å²	62.7	15%	0.149	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	140.8	178.2	-62.8	0	0	0	0	111.1	T554 M585 T586	C550-T554 CarbonylContact C-O 3.57Å; C550-T554 WeakPolarHBondContact CA-O 3.44Å; C550-M585 CarbonylContact O-C 3.45Å; C550-M585 WeakPolarHBondContact O-CA 3.48Å; C550-T586 PolarHBondContact N-O 3.2Å; C550-T586 PolarHBondContact O-N 3.09Å
551	L	85.5	Confident	79.3	Confident	4 Å²	4	60.2 Å²	60.2	2%	0.021	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	118.6	173.3	-56.7	-179.9	0	0	0	107.2	L529 R553 T554 Y556 L576 L579 V582 M585	L529-L551 HydrophobicContact CD2-CD1 4.08Å; L529-L551 HydrophobicContact CD2-CD2 3.64Å; L529-L551 HydrophobicContact CD2-CG 4.48Å; L551-R553 VanDerWaalsContact C-N 3.26Å; L551-R553 PolarHBondContact O-N 3.19Å; L551-T554 PolarHBondContact N-O 3.48Å; L551-T554 WeakPolarHBondContact O-CB 3.37Å; L551-T554 PolarHBondContact O-N 2.98Å; L551-Y556 HydrophobicContact CB-CD2 3.62Å; L551-Y556 HydrophobicContact CB-CE2 3.82Å; L551-Y556 HydrophobicContact CD1-CD1 4.28Å; L551-Y556 HydrophobicContact CD1-CD2 3.7Å; L551-Y556 HydrophobicContact CD1-CE2 4.1Å; L551-Y556 HydrophobicContact CD1-CG 3.8Å; L551-Y556 HydrophobicContact CG-CD2 3.72Å; L551-Y556 HydrophobicContact CG-CE2 4.31Å; L551-Y556 HydrophobicContact CG-CG 4.14Å; L551-L576 HydrophobicContact CD1-CD1 4.26Å; L551-L579 HydrophobicContact CD1-CD1 3.91Å; L551-L579 HydrophobicContact CD1-CD2 3.87Å; L551-V582 HydrophobicContact CB-CG1 3.76Å; L551-V582 HydrophobicContact CB-CG2 4.04Å; L551-V582 HydrophobicContact CD1-CG2 4.32Å; L551-V582 HydrophobicContact CD2-CG1 4.31Å; L551-M585 HydrophobicContact CD2-CB 3.82Å; L551-M585 HydrophobicContact CD2-CG 3.74Å; L551-M585 HydrophobicContact CD2-SD 4.36Å
552	D	86.2	Confident	79.1	Confident	62 Å²	62	61.4 Å²	61.4	33%	0.332	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	42.3	54	-169.2	-66.6	-23.4	0	0	0	112.3	T554 V582 S583 V584	D552-T554 PolarHBondContact O-N 3.42Å; D552-V582 VanDerWaalsContact OD2-CA 3.29Å; D552-V582 WeakPolarHBondContact OD2-CA 3.49Å; D552-S583 PolarHBondContact OD1-N 3.2Å; D552-S583 VanDerWaalsContact OD1-N 3.13Å; D552-S583 PolarHBondContact OD1-OG 3.01Å; D552-S583 PolarHBondContact OD2-N 2.95Å; D552-V584 PolarHBondContact N-O 3.15Å; D552-V584 PolarHBondContact OD1-N 3.25Å
553	R	78.1	Confident	78.8	Confident	236 Å²	236	55.9 Å²	55.9	89%	0.891	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	66	-11.2	-176.9	-49.6	177.5	-176.2	178.9	0.8	116.3	L551	L551-R553 VanDerWaalsContact C-N 3.26Å; L551-R553 PolarHBondContact O-N 3.19Å
554	T	76.9	Confident	78.1	Confident	70 Å²	70	52 Å²	52	43%	0.429	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	131	176.4	-55.7	0	0	0	0	110.6	C550 L551 D552 Y556	C550-T554 CarbonylContact C-O 3.57Å; C550-T554 WeakPolarHBondContact CA-O 3.44Å; L551-T554 PolarHBondContact N-O 3.48Å; L551-T554 WeakPolarHBondContact O-CB 3.37Å; L551-T554 PolarHBondContact O-N 2.98Å; D552-T554 PolarHBondContact O-N 3.42Å; T554-Y556 HydrophobicContact CG2-CD2 4.19Å; T554-Y556 HydrophobicContact CG2-CE2 3.77Å; T554-Y556 WeakPolarHBondContact O-CD2 3.32Å; T554-Y556 PolarHBondContact O-N 3.25Å
555	L	79.3	Confident	77	Confident	60 Å²	60	47 Å²	47	31%	0.314	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	115.9	-177.3	-177.5	62.8	0	0	0	111.8	L460 D548 A557	L460-L555 HydrophobicContact CD1-CG 3.98Å; L460-L555 WeakPolarHBondContact CD1-O 3.46Å; L460-L555 HydrophobicContact CD2-CD1 4.38Å; L460-L555 HydrophobicContact CD2-CD2 3.67Å; L460-L555 HydrophobicContact CD2-CG 3.8Å; D548-L555 HydrophobicContact CB-CD1 3.72Å; L555-A557 WeakPolarHBondContact CD1-O 3.34Å
556	Y	79	Confident	75.5	Confident	14 Å²	14	51.4 Å²	51.4	6%	0.055	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	-26.2	-176.8	-88.4	-91.6	0	0	0	114.6	H457 L460 I549 L551 T554 L576 L579 P580	H457-Y556 PolarHBondContact N-O 3.39Å; L460-Y556 WeakPolarHBondContact CD1-O 3.38Å; I549-Y556 PolarHBondContact O-N 3.46Å; L551-Y556 HydrophobicContact CB-CD2 3.62Å; L551-Y556 HydrophobicContact CB-CE2 3.82Å; L551-Y556 HydrophobicContact CD1-CD1 4.28Å; L551-Y556 HydrophobicContact CD1-CD2 3.7Å; L551-Y556 HydrophobicContact CD1-CE2 4.1Å; L551-Y556 HydrophobicContact CD1-CG 3.8Å; L551-Y556 HydrophobicContact CG-CD2 3.72Å; L551-Y556 HydrophobicContact CG-CE2 4.31Å; L551-Y556 HydrophobicContact CG-CG 4.14Å; T554-Y556 HydrophobicContact CG2-CD2 4.19Å; T554-Y556 HydrophobicContact CG2-CE2 3.77Å; T554-Y556 WeakPolarHBondContact O-CD2 3.32Å; T554-Y556 PolarHBondContact O-N 3.25Å; Y556-L576 HydrophobicContact CD1-CD1 4.36Å; Y556-L576 HydrophobicContact CG-CD1 4.46Å; Y556-L579 HydrophobicContact CD1-CD2 3.96Å; Y556-L579 HydrophobicContact CE1-CD2 3.48Å; Y556-L579 VanDerWaalsContact CE1-CD2 3.48Å; Y556-P580 WeakPolarHBondContact OH-CD 3.08Å
557	A	81.2	Confident	74.4	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	158.4	171.5	0	0	0	0	0	112.3	H457 I549 L555 F574	H457-A557 HydrophobicContact CB-CB 3.8Å; I549-A557 HydrophobicContact CB-CB 4.15Å; I549-A557 HydrophobicContact CD1-CB 3.78Å; I549-A557 PolarHBondContact N-O 2.73Å; I549-A557 PolarHBondContact O-N 3.1Å; L555-A557 WeakPolarHBondContact CD1-O 3.34Å; A557-F574 HydrophobicContact CB-CD1 3.44Å; A557-F574 VanDerWaalsContact CB-CD1 3.44Å; A557-F574 HydrophobicContact CB-CE1 3.62Å; A557-F574 HydrophobicContact CB-CG 4.23Å
558	R	81.1	Confident	73.3	Confident	90 Å²	90	51 Å²	51	34%	0.34	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	135.9	167.8	170.7	169.9	-70.7	145.1	4.7	108.7	S459 L460 Y546 C547 D548	S459-R558 WeakPolarHBondContact CB-O 3.26Å; S459-R558 PolarHBondContact OG-N 3.43Å; S459-R558 PolarHBondContact OG-O 3.18Å; L460-R558 HydrophobicContact CD2-CB 3.66Å; Y546-R558 HydrophobicContact CD2-CG 3.85Å; Y546-R558 HydrophobicContact CG-CG 4.35Å; C547-R558 CarbonylContact O-C 3.58Å; C547-R558 WeakPolarHBondContact O-CA 3.46Å; D548-R558 WeakPolarHBondContact OD1-CG 3.31Å; D548-R558 IonicContact OD1-CZ 2.74Å; D548-R558 IonicContact OD1-NE 3.22Å; D548-R558 PolarHBondContact OD1-NE 3.47Å; D548-R558 IonicContact OD1-NH2 2.73Å; D548-R558 PolarHBondContact OD1-NH2 2.88Å; D548-R558 IonicContact OD2-CZ 2.65Å; D548-R558 IonicContact OD2-NE 2.88Å; D548-R558 IonicContact OD2-NH2 2.68Å; D548-R558 PolarHBondContact OD2-NH2 2.86Å
559	T	80	Confident	72.6	Confident	3 Å²	3	54.3 Å²	54.3	2%	0.018	30%	0.295	C	S	.	.			trans	-86.6	165.1	179.3	70.4	0	0	0	0	112.9	I533 Y546 C547 I549 W570 E572 F574	I533-T559 HydrophobicContact CB-CG2 4.28Å; I533-T559 HydrophobicContact CD1-CG2 3.73Å; I533-T559 HydrophobicContact CG1-CG2 4.44Å; Y546-T559 VanDerWaalsContact CB-O 3.22Å; Y546-T559 WeakPolarHBondContact CB-O 3.27Å; C547-T559 HydrophobicContact CB-CG2 3.82Å; C547-T559 PolarHBondContact N-OG1 2.95Å; C547-T559 PolarHBondContact O-N 2.99Å; I549-T559 HydrophobicContact CD1-CG2 4.13Å; T559-W570 PolarHBondContact OG1-NE1 2.75Å; T559-E572 WeakPolarHBondContact CA-OE2 3.45Å; T559-E572 WeakPolarHBondContact CB-OE2 3.36Å; T559-F574 HydrophobicContact CG2-CE2 3.84Å; T559-F574 HydrophobicContact CG2-CZ 3.68Å
560	T	70.5	Confident	71.8	Confident	75 Å²	75	54.3 Å²	54.3	46%	0.46	30%	0.295	S	S	.	.			trans	-118.5	115	166	77.4	0	0	0	0	110.8	W570 E572	T560-W570 VanDerWaalsContact O-CD1 3.26Å; T560-E572 WeakPolarHBondContact CB-OE1 3.28Å; T560-E572 VanDerWaalsContact N-CD 3.35Å; T560-E572 PolarHBondContact N-OE1 3.39Å; T560-E572 PolarHBondContact N-OE2 3.4Å; T560-E572 PolarHBondContact OG1-OE1 3.12Å
561	S	69.4	Low	70.8	Confident	24 Å²	24	55 Å²	55	17%	0.168	30%	0.302	C	S	.	.			trans	-74.1	136.8	-179.5	74	0	0	0	0	112	Y545 W570	Y545-S561 PolarHBondContact N-OG 2.75Å; Y545-S561 VanDerWaalsContact N-OG 3.13Å; Y545-S561 WeakPolarHBondContact O-CB 3.42Å; Y545-S561 PolarHBondContact O-N 3.29Å; Y545-S561 PolarHBondContact O-OG 2.75Å; S561-W570 VanDerWaalsContact CA-CD1 3.45Å
562	K	63	Low	69.9	Low	90 Å²	90	56.2 Å²	56.2	39%	0.391	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	118.4	166	-64.9	157.9	-164.7	144.7	0	107.9	A564 F569 W570	K562-A564 PolarHBondContact O-N 2.87Å; K562-A564 VanDerWaalsContact O-N 3.14Å; K562-F569 PolarHBondContact N-O 3.26Å; K562-F569 PolarHBondContact O-N 3.49Å; K562-F569 VanDerWaalsContact O-O 3.1Å; K562-W570 PolarHBondContact NZ-O 3.36Å
563	T	58.4	Low	69.3	Low	87 Å²	87	58.1 Å²	58.1	53%	0.534	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	101.7	179.9	50.8	0	0	0	0	110.3
564	A	53.4	Low	69.4	Low	43 Å²	43	46.9 Å²	46.9	36%	0.355	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	154.1	174.4	0	0	0	0	0	111	K562 S566 G567	K562-A564 PolarHBondContact O-N 2.87Å; K562-A564 VanDerWaalsContact O-N 3.14Å; A564-S566 PolarHBondContact O-N 2.67Å; A564-G567 CarbonylContact C-O 3.58Å; A564-G567 WeakPolarHBondContact CB-O 3.16Å; A564-G567 PolarHBondContact N-O 2.97Å; A564-G567 PolarHBondContact O-N 3.07Å
565	A	53.3	Low	69.4	Low	59 Å²	59	46.9 Å²	46.9	49%	0.488	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-2.8	-175	0	0	0	0	0	115.3	V1845	A565-V1845 HydrophobicContact CB-CG2 3.7Å
566	S	53.1	Low	69.5	Low	100 Å²	100	44.1 Å²	44.1	70%	0.699	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.1	9.7	-178.8	57.4	0	0	0	0	114.2	A564	A564-S566 PolarHBondContact O-N 2.67Å
567	G	61.7	Low	69.5	Low	18 Å²	18	46.2 Å²	46.2	19%	0.186	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	160.5	-179.7	-177.8	0	0	0	0	0	112.5	A564	A564-G567 CarbonylContact C-O 3.58Å; A564-G567 WeakPolarHBondContact CB-O 3.16Å; A564-G567 PolarHBondContact N-O 2.97Å; A564-G567 PolarHBondContact O-N 3.07Å
568	I	66.4	Low	69.2	Low	1 Å²	1	48.1 Å²	48.1	1%	0.005	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	134.4	175.2	-56.9	157.7	0	0	0	108.1	E535 A536 I539 Y545 W570	E535-I568 CarbonylContact C-O 3.5Å; E535-I568 WeakPolarHBondContact CA-O 3.41Å; A536-I568 PolarHBondContact N-O 3.14Å; I539-I568 HydrophobicContact CB-CD1 3.67Å; I539-I568 HydrophobicContact CD1-CD1 4.26Å; I539-I568 HydrophobicContact CG2-CD1 3.36Å; Y545-I568 HydrophobicContact CD1-CD1 4.34Å; Y545-I568 HydrophobicContact CD2-CD1 3.31Å; Y545-I568 HydrophobicContact CD2-CG1 3.96Å; Y545-I568 HydrophobicContact CD2-CG2 4.43Å; Y545-I568 HydrophobicContact CE1-CD1 4.43Å; Y545-I568 HydrophobicContact CE2-CD1 3.42Å; Y545-I568 VanDerWaalsContact CE2-CD1 3.42Å; Y545-I568 HydrophobicContact CE2-CG1 4.21Å; Y545-I568 HydrophobicContact CG-CD1 3.81Å; I568-W570 HydrophobicContact CB-CH2 4.15Å; I568-W570 HydrophobicContact CB-CZ3 4.27Å; I568-W570 HydrophobicContact CG2-CD2 4.44Å; I568-W570 HydrophobicContact CG2-CE3 4.27Å; I568-W570 HydrophobicContact CG2-CH2 3.45Å; I568-W570 VanDerWaalsContact CG2-CH2 3.45Å; I568-W570 HydrophobicContact CG2-CZ2 3.63Å; I568-W570 HydrophobicContact CG2-CZ3 3.77Å
569	F	72.9	Confident	69.3	Low	82 Å²	82	44.2 Å²	44.2	36%	0.36	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	145	-172.9	-179.8	-100.9	0	0	0	109.1	L534 E535 K562 A571	L534-F569 WeakPolarHBondContact O-CD2 3.29Å; E535-F569 HydrophobicContact CB-CD2 4.17Å; K562-F569 PolarHBondContact N-O 3.26Å; K562-F569 PolarHBondContact O-N 3.49Å; K562-F569 VanDerWaalsContact O-O 3.1Å; F569-A571 HydrophobicContact CD1-CB 4.29Å; F569-A571 HydrophobicContact CE1-CB 3.44Å; F569-A571 VanDerWaalsContact CE1-CB 3.44Å; F569-A571 HydrophobicContact CE2-CB 4.06Å; F569-A571 HydrophobicContact CZ-CB 3.31Å
570	W	72.2	Confident	69.2	Low	0 Å²	0	46.1 Å²	46.1	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	-61.9	177.3	-68.3	-93.6	0	0	0	109.7	I533 L534 A536 T559 T560 S561 K562 I568 E572 L589 L707	I533-W570 HydrophobicContact CG2-CB 4.22Å; I533-W570 HydrophobicContact CG2-CD2 3.86Å; I533-W570 HydrophobicContact CG2-CE3 3.74Å; I533-W570 HydrophobicContact CG2-CG 4.09Å; I533-W570 HydrophobicContact CG2-CZ3 4.38Å; I533-W570 WeakPolarHBondContact O-CB 3.2Å; L534-W570 PolarHBondContact O-N 3.48Å; A536-W570 HydrophobicContact CB-CH2 3.81Å; A536-W570 HydrophobicContact CB-CZ3 3.57Å; T559-W570 PolarHBondContact OG1-NE1 2.75Å; T560-W570 VanDerWaalsContact O-CD1 3.26Å; S561-W570 VanDerWaalsContact CA-CD1 3.45Å; K562-W570 PolarHBondContact NZ-O 3.36Å; I568-W570 HydrophobicContact CB-CH2 4.15Å; I568-W570 HydrophobicContact CB-CZ3 4.27Å; I568-W570 HydrophobicContact CG2-CD2 4.44Å; I568-W570 HydrophobicContact CG2-CE3 4.27Å; I568-W570 HydrophobicContact CG2-CH2 3.45Å; I568-W570 VanDerWaalsContact CG2-CH2 3.45Å; I568-W570 HydrophobicContact CG2-CZ2 3.63Å; I568-W570 HydrophobicContact CG2-CZ3 3.77Å; W570-E572 PolarHBondContact O-N 3.23Å; W570-L589 HydrophobicContact CH2-CD1 3.92Å; W570-L589 HydrophobicContact CZ2-CD1 3.74Å; W570-L707 HydrophobicContact CH2-CD1 4.04Å; W570-L707 HydrophobicContact CZ3-CD1 3.84Å
571	A	64.4	Low	69.6	Low	37 Å²	37	47.1 Å²	47.1	31%	0.306	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	44.4	56.9	-168.1	0	0	0	0	0	110.7	I533 F569	I533-A571 WeakPolarHBondContact O-CA 3.44Å; I533-A571 PolarHBondContact O-N 2.61Å; F569-A571 HydrophobicContact CD1-CB 4.29Å; F569-A571 HydrophobicContact CE1-CB 3.44Å; F569-A571 VanDerWaalsContact CE1-CB 3.44Å; F569-A571 HydrophobicContact CE2-CB 4.06Å; F569-A571 HydrophobicContact CZ-CB 3.31Å
572	E	68	Low	70.3	Confident	30 Å²	30	46.7 Å²	46.7	14%	0.14	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	125.6	167.6	-68	177.4	155.1	0	0	106.9	S532 I533 T559 T560 W570 F574	S532-E572 WeakPolarHBondContact CA-O 3.33Å; I533-E572 PolarHBondContact N-O 2.53Å; T559-E572 WeakPolarHBondContact CA-OE2 3.45Å; T559-E572 WeakPolarHBondContact CB-OE2 3.36Å; T560-E572 WeakPolarHBondContact CB-OE1 3.28Å; T560-E572 VanDerWaalsContact N-CD 3.35Å; T560-E572 PolarHBondContact N-OE1 3.39Å; T560-E572 PolarHBondContact N-OE2 3.4Å; T560-E572 PolarHBondContact OG1-OE1 3.12Å; W570-E572 PolarHBondContact O-N 3.23Å; E572-F574 HydrophobicContact CB-CE2 3.81Å; E572-F574 HydrophobicContact CB-CZ 3.64Å; E572-F574 WeakPolarHBondContact O-CE2 3.24Å
573	D	72	Confident	71.4	Confident	101 Å²	101	46.1 Å²	46.1	54%	0.54	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	126.2	178	-62.2	-44.2	0	0	0	108.6	S532	S532-D573 WeakPolarHBondContact CB-OD1 3.49Å; S532-D573 PolarHBondContact OG-OD1 3.3Å
574	F	80.4	Confident	72.8	Confident	1 Å²	1	43.9 Å²	43.9	0%	0.004	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	119.7	178.9	-55.5	-82.4	0	0	0	107.8	H457 R530 L531 I549 A557 T559 E572	H457-F574 HydrophobicContact CB-CD1 3.92Å; H457-F574 HydrophobicContact CB-CE1 4.35Å; H457-F574 AromaticContact CD2-CD1 3.76Å; H457-F574 AromaticContact CE1-CE1 3.62Å; H457-F574 AromaticContact CG-CD1 3.5Å; H457-F574 AromaticContact CG-CE1 3.71Å; H457-F574 AromaticContact ND1-CD1 3.72Å; H457-F574 AromaticContact ND1-CE1 3.39Å; H457-F574 WeakPolarHBondContact ND1-CE1 3.43Å; R530-F574 CarbonylContact C-O 3.55Å; R530-F574 VanDerWaalsContact CA-O 3.32Å; R530-F574 WeakPolarHBondContact CA-O 3.5Å; L531-F574 HydrophobicContact CB-CB 4.4Å; L531-F574 HydrophobicContact CG-CD2 4.48Å; L531-F574 PolarHBondContact N-O 3.12Å; L531-F574 WeakPolarHBondContact O-CD2 3.42Å; L531-F574 PolarHBondContact O-N 3.12Å; I549-F574 HydrophobicContact CD1-CD1 4.31Å; I549-F574 HydrophobicContact CD1-CD2 3.69Å; I549-F574 HydrophobicContact CD1-CE1 4.24Å; I549-F574 HydrophobicContact CD1-CE2 3.64Å; I549-F574 HydrophobicContact CD1-CG 4.07Å; I549-F574 HydrophobicContact CD1-CZ 3.96Å; A557-F574 HydrophobicContact CB-CD1 3.44Å; A557-F574 VanDerWaalsContact CB-CD1 3.44Å; A557-F574 HydrophobicContact CB-CE1 3.62Å; A557-F574 HydrophobicContact CB-CG 4.23Å; T559-F574 HydrophobicContact CG2-CE2 3.84Å; T559-F574 HydrophobicContact CG2-CZ 3.68Å; E572-F574 HydrophobicContact CB-CE2 3.81Å; E572-F574 HydrophobicContact CB-CZ 3.64Å; E572-F574 WeakPolarHBondContact O-CE2 3.24Å
575	D	77.2	Confident	74.6	Confident	69 Å²	69	41.9 Å²	41.9	37%	0.369	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	105.1	176.2	-157.4	-68	0	0	0	107.9	R530 N577	R530-D575 IonicContact CZ-OD2 3.62Å; R530-D575 IonicContact NE-OD2 2.7Å; R530-D575 PolarHBondContact NE-OD2 3.46Å; R530-D575 IonicContact NH2-OD2 3.9Å; R530-D575 PolarHBondContact NH2-OD2 2.95Å; D575-N577 PolarHBondContact OD1-ND2 3.3Å
576	L	81.4	Confident	76.5	Confident	3 Å²	3	40.4 Å²	40.4	2%	0.016	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	118.1	-171.6	-61.1	175.2	0	0	0	109.1	T455 S528 L529 L551 Y556 L579	T455-L576 WeakPolarHBondContact OG1-CA 3.47Å; S528-L576 CarbonylContact C-O 3.57Å; S528-L576 VanDerWaalsContact CA-O 3.25Å; S528-L576 WeakPolarHBondContact CA-O 3.4Å; L529-L576 HydrophobicContact CB-CB 4.47Å; L529-L576 PolarHBondContact N-O 3.13Å; L529-L576 PolarHBondContact O-N 2.76Å; L551-L576 HydrophobicContact CD1-CD1 4.26Å; Y556-L576 HydrophobicContact CD1-CD1 4.36Å; Y556-L576 HydrophobicContact CG-CD1 4.46Å; L576-L579 HydrophobicContact CB-CD1 4.16Å; L576-L579 HydrophobicContact CB-CD2 4.25Å; L576-L579 HydrophobicContact CB-CG 4.39Å
577	N	80.2	Confident	78.3	Confident	57 Å²	57	35.7 Å²	35.7	31%	0.305	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	160.5	-176.1	-63.5	-76.3	0	0	0	111.2	T455 S528 D575 L579	T455-N577 PolarHBondContact N-O 2.9Å; T455-N577 PolarHBondContact OG1-N 3.32Å; T455-N577 PolarHBondContact OG1-O 3.29Å; S528-N577 WeakPolarHBondContact CB-OD1 3.48Å; D575-N577 PolarHBondContact OD1-ND2 3.3Å; N577-L579 VanDerWaalsContact C-N 3.29Å; N577-L579 PolarHBondContact O-N 2.78Å
578	N	75.3	Confident	79.7	Confident	40 Å²	40	35.6 Å²	35.6	21%	0.214	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	61.9	37.5	-178	-43.6	-24.4	0	0	0	112	S454 R512 E526 N527	S454-N578 WeakPolarHBondContact CB-O 3.44Å; R512-N578 PolarHBondContact NH1-ND2 2.82Å; R512-N578 PolarHBondContact NH1-OD1 2.7Å; E526-N578 PolarHBondContact OE1-OD1 3.39Å; N527-N578 PolarHBondContact O-N 3.15Å; N527-N578 VanDerWaalsContact O-N 3.15Å
579	L	81.6	Confident	80.9	Confident	8 Å²	8	35.5 Å²	35.5	4%	0.042	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	150.1	179.2	-68	172.6	0	0	0	111	N527 L529 L551 Y556 L576 N577	N527-L579 HydrophobicContact CB-CB 3.94Å; N527-L579 WeakPolarHBondContact CB-O 3.35Å; N527-L579 PolarHBondContact ND2-O 3.47Å; N527-L579 VanDerWaalsContact ND2-O 3.14Å; N527-L579 PolarHBondContact O-N 3.48Å; L529-L579 HydrophobicContact CB-CD1 3.65Å; L551-L579 HydrophobicContact CD1-CD1 3.91Å; L551-L579 HydrophobicContact CD1-CD2 3.87Å; Y556-L579 HydrophobicContact CD1-CD2 3.96Å; Y556-L579 HydrophobicContact CE1-CD2 3.48Å; Y556-L579 VanDerWaalsContact CE1-CD2 3.48Å; L576-L579 HydrophobicContact CB-CD1 4.16Å; L576-L579 HydrophobicContact CB-CD2 4.25Å; L576-L579 HydrophobicContact CB-CG 4.39Å; N577-L579 VanDerWaalsContact C-N 3.29Å; N577-L579 PolarHBondContact O-N 2.78Å
580	P	79.1	Confident	81.6	Confident	43 Å²	43	34.3 Å²	34.3	28%	0.279	20%	0.196	S	C	.	.			trans	-60	171.6	162	30.7	-35.9	0	0	0	110.1	N527 Y556 V582	N527-P580 PolarHBondContact ND2-O 3.17Å; Y556-P580 WeakPolarHBondContact OH-CD 3.08Å; P580-V582 HydrophobicContact CG-CG2 4.42Å; P580-V582 WeakPolarHBondContact O-CG2 3.35Å; P580-V582 PolarHBondContact O-N 3.22Å
581	N	79	Confident	82.2	Confident	97 Å²	97	37.6 Å²	37.6	52%	0.519	21%	0.209	S	C	.	.			trans	-65	109.9	168.8	-81.2	27.2	0	0	0	108.6	N527	N527-N581 PolarHBondContact ND2-N 2.79Å; N527-N581 PolarHBondContact ND2-OD1 2.94Å
582	V	83.4	Confident	83	Confident	15 Å²	15	39.6 Å²	39.6	9%	0.091	21%	0.212	C	C	.	.			trans	-96.5	134	178.4	-175.9	0	0	0	0	109.7	L551 D552 P580 V584 V628	L551-V582 HydrophobicContact CB-CG1 3.76Å; L551-V582 HydrophobicContact CB-CG2 4.04Å; L551-V582 HydrophobicContact CD1-CG2 4.32Å; L551-V582 HydrophobicContact CD2-CG1 4.31Å; D552-V582 VanDerWaalsContact OD2-CA 3.29Å; D552-V582 WeakPolarHBondContact OD2-CA 3.49Å; P580-V582 HydrophobicContact CG-CG2 4.42Å; P580-V582 WeakPolarHBondContact O-CG2 3.35Å; P580-V582 PolarHBondContact O-N 3.22Å; V582-V584 WeakPolarHBondContact CG1-O 3.35Å; V582-V628 HydrophobicContact CB-CG2 4.22Å; V582-V628 HydrophobicContact CG1-CG2 3.81Å
583	S	86.1	Confident	82.8	Confident	78 Å²	78	39.3 Å²	39.3	55%	0.545	22%	0.217	S	C	.	.			trans	-88.5	-40.8	174	75.9	0	0	0	0	113	D552 V628	D552-S583 PolarHBondContact OD1-N 3.2Å; D552-S583 VanDerWaalsContact OD1-N 3.13Å; D552-S583 PolarHBondContact OD1-OG 3.01Å; D552-S583 PolarHBondContact OD2-N 2.95Å; S583-V628 PolarHBondContact O-N 3.02Å
584	V	87.8	Confident	81.8	Confident	40 Å²	40	37 Å²	37	24%	0.242	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	135.5	-167.8	172.1	0	0	0	0	111.5	D552 V582 T625	D552-V584 PolarHBondContact N-O 3.15Å; D552-V584 PolarHBondContact OD1-N 3.25Å; V582-V584 WeakPolarHBondContact CG1-O 3.35Å; V584-T625 HydrophobicContact CG1-CG2 3.28Å
585	M	92.1	Very high	80.2	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	129.3	167.8	178.1	177.5	69.6	0	0	110.1	L529 L531 C550 L551 I587 I626 I631 I709	L529-M585 HydrophobicContact CD2-SD 3.88Å; L531-M585 HydrophobicContact CD1-CE 4.25Å; L531-M585 HydrophobicContact CD1-SD 4.42Å; L531-M585 HydrophobicContact CD2-SD 3.88Å; C550-M585 CarbonylContact O-C 3.45Å; C550-M585 WeakPolarHBondContact O-CA 3.48Å; L551-M585 HydrophobicContact CD2-CB 3.82Å; L551-M585 HydrophobicContact CD2-CG 3.74Å; L551-M585 HydrophobicContact CD2-SD 4.36Å; M585-I587 HydrophobicContact CE-CD1 3.96Å; M585-I587 HydrophobicContact CE-CG1 4.39Å; M585-I587 HydrophobicContact CG-CG1 4.38Å; M585-I587 HydrophobicContact SD-CD1 4.44Å; M585-I587 HydrophobicContact SD-CG1 4.48Å; M585-I626 HydrophobicContact CE-CB 4.48Å; M585-I626 HydrophobicContact CE-CD1 3.69Å; M585-I626 HydrophobicContact CE-CG1 4.33Å; M585-I626 PolarHBondContact N-O 3Å; M585-I626 PolarHBondContact O-N 3.29Å; M585-I631 HydrophobicContact CE-CD1 3.85Å; M585-I631 HydrophobicContact SD-CD1 4.43Å; M585-I709 HydrophobicContact CE-CD1 4.46Å
586	T	91.6	Very high	78	Confident	27 Å²	27	47.1 Å²	47.1	17%	0.166	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	129.2	172.8	-61	0	0	0	0	110.3	C550 I624 T625	C550-T586 PolarHBondContact N-O 3.2Å; C550-T586 PolarHBondContact O-N 3.09Å; T586-I624 CarbonylContact C-O 3.54Å; T586-I624 VanDerWaalsContact CA-O 3.25Å; T586-I624 WeakPolarHBondContact CA-O 3.02Å; T586-T625 PolarHBondContact OG1-OG1 3.37Å
587	I	92.3	Very high	75.7	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.005	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	113.4	174.1	-56.1	175.5	0	0	0	108.3	L531 I533 C547 D548 M585 Y623 I624 L707 I709	L531-I587 HydrophobicContact CD1-CD1 4.26Å; L531-I587 HydrophobicContact CD2-CD1 4.23Å; I533-I587 HydrophobicContact CD1-CD1 4.28Å; I533-I587 HydrophobicContact CD1-CG2 3.77Å; C547-I587 HydrophobicContact CB-CG2 3.9Å; D548-I587 CarbonylContact O-C 3.54Å; D548-I587 WeakPolarHBondContact O-CA 3.35Å; M585-I587 HydrophobicContact CE-CD1 3.96Å; M585-I587 HydrophobicContact CE-CG1 4.39Å; M585-I587 HydrophobicContact CG-CG1 4.38Å; M585-I587 HydrophobicContact SD-CD1 4.44Å; M585-I587 HydrophobicContact SD-CG1 4.48Å; I587-Y623 CarbonylContact O-C 3.3Å; I587-Y623 VanDerWaalsContact O-CA 3.28Å; I587-Y623 WeakPolarHBondContact O-CA 3.39Å; I587-I624 PolarHBondContact N-O 3.46Å; I587-I624 PolarHBondContact O-N 2.99Å; I587-L707 HydrophobicContact CD1-CD2 4.48Å; I587-L707 HydrophobicContact CG2-CD2 3.79Å; I587-I709 HydrophobicContact CD1-CD1 4.38Å; I587-I709 HydrophobicContact CD1-CG2 4.09Å
588	S	90.9	Very high	73.3	Confident	16 Å²	16	59.1 Å²	59.1	11%	0.112	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	115.4	-175.2	-65.8	0	0	0	0	111.2	C547 D548 Y590	C547-S588 CarbonylContact C-O 3.5Å; C547-S588 VanDerWaalsContact CA-O 3.28Å; C547-S588 WeakPolarHBondContact CA-O 3.33Å; D548-S588 PolarHBondContact N-O 3.25Å; D548-S588 PolarHBondContact O-N 2.97Å; S588-Y590 WeakPolarHBondContact O-CD2 3.3Å
589	L	90.2	Very high	71.1	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	122.6	-178.1	178.5	71.8	0	0	0	111.3	I539 C547 W570 I621 G622 L643	I539-L589 HydrophobicContact CD1-CD2 3.54Å; I539-L589 HydrophobicContact CG1-CD2 4.29Å; C547-L589 VanDerWaalsContact SG-CD1 3.55Å; W570-L589 HydrophobicContact CH2-CD1 3.92Å; W570-L589 HydrophobicContact CZ2-CD1 3.74Å; L589-I621 HydrophobicContact CD2-CB 4.18Å; L589-I621 HydrophobicContact CD2-CD1 3.92Å; L589-I621 HydrophobicContact CD2-CG2 4.26Å; L589-I621 HydrophobicContact CG-CB 4.32Å; L589-I621 HydrophobicContact CG-CD1 3.99Å; L589-I621 HydrophobicContact CG-CG1 4.5Å; L589-I621 WeakPolarHBondContact O-CB 3.04Å; L589-I621 PolarHBondContact O-N 3.41Å; L589-G622 PolarHBondContact N-O 3.36Å; L589-L643 HydrophobicContact CB-CD1 4.12Å; L589-L643 HydrophobicContact CB-CD2 4.12Å; L589-L643 HydrophobicContact CD2-CD1 3.59Å; L589-L643 HydrophobicContact CG-CD1 4.49Å
590	Y	88	Confident	68.8	Low	56 Å²	56	70.1 Å²	70.1	22%	0.22	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	152.8	178.6	-69.5	-88.9	0	0	0	113.3	Y545 Y546 D548 S588 Q619 L620	Y545-Y590 VanDerWaalsContact CA-O 3.25Å; Y545-Y590 WeakPolarHBondContact CA-O 3.24Å; Y545-Y590 WeakPolarHBondContact CD1-O 3.21Å; Y546-Y590 AromaticContact CD2-CD2 3.96Å; Y546-Y590 HydrophobicContact CD2-CD2 3.96Å; Y546-Y590 HydrophobicContact CD2-CG 4.31Å; Y546-Y590 HydrophobicContact CE1-CG 4.37Å; Y546-Y590 AromaticContact CE2-CD2 3.37Å; Y546-Y590 HydrophobicContact CE2-CD2 3.37Å; Y546-Y590 HydrophobicContact CE2-CE2 4.19Å; Y546-Y590 AromaticContact CE2-CG 3.58Å; Y546-Y590 HydrophobicContact CE2-CG 3.58Å; Y546-Y590 AromaticContact CZ-CD2 3.92Å; Y546-Y590 AromaticContact CZ-CG 3.61Å; Y546-Y590 PolarHBondContact N-O 3.23Å; Y546-Y590 VanDerWaalsContact N-O 3.12Å; Y546-Y590 PolarHBondContact O-N 3.44Å; D548-Y590 HydrophobicContact CB-CD2 4.47Å; D548-Y590 HydrophobicContact CB-CE2 4.01Å; D548-Y590 WeakPolarHBondContact OD2-CE2 3.39Å; S588-Y590 WeakPolarHBondContact O-CD2 3.3Å; Y590-Q619 CarbonylContact C-O 3.56Å; Y590-Q619 WeakPolarHBondContact CA-O 3.48Å; Y590-L620 HydrophobicContact CD1-CB 4.12Å; Y590-L620 HydrophobicContact CD1-CD1 4.28Å; Y590-L620 HydrophobicContact CD2-CD1 4.46Å; Y590-L620 HydrophobicContact CE1-CB 3.85Å; Y590-L620 HydrophobicContact CE1-CD1 3.92Å; Y590-L620 HydrophobicContact CE1-CG 4.47Å; Y590-L620 HydrophobicContact CE2-CD1 4.13Å
591	R	85.9	Confident	66.4	Low	69 Å²	69	79.7 Å²	79.7	26%	0.26	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	122	170.5	-162.3	161.1	76.5	163.4	2.6	109	Y545 N618 Q619 I621	Y545-R591 HydrophobicContact CD1-CB 4.33Å; Y545-R591 HydrophobicContact CD1-CG 4.32Å; Y545-R591 HydrophobicContact CE1-CB 4.09Å; Y545-R591 HydrophobicContact CE1-CG 3.73Å; R591-N618 WeakPolarHBondContact O-CA 3.33Å; R591-Q619 HydrophobicContact CB-CB 4.33Å; R591-Q619 VanDerWaalsContact CZ-OE1 3.27Å; R591-Q619 PolarHBondContact N-O 3.31Å; R591-Q619 PolarHBondContact O-N 3.08Å; R591-I621 HydrophobicContact CB-CD1 3.91Å; R591-I621 HydrophobicContact CB-CG1 4.04Å
592	E	80.2	Confident	64	Low	79 Å²	79	85.7 Å²	85.7	37%	0.369	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-70.2	137.6	-180	-162.5	175.8	-140.1	0	0	111.1	R544 N618	R544-E592 HydrophobicContact CB-CB 3.92Å; R544-E592 WeakPolarHBondContact CB-OE2 3.28Å; R544-E592 WeakPolarHBondContact CD-OE2 3.21Å; R544-E592 IonicContact NE-OE2 3.7Å; R544-E592 IonicContact NH1-OE2 3.65Å; R544-E592 PolarHBondContact NH1-OE2 2.54Å; R544-E592 PolarHBondContact O-N 2.91Å; E592-N618 WeakPolarHBondContact CA-OD1 3.34Å
593	G	65.1	Low	61.4	Low	24 Å²	24	92.4 Å²	92.4	25%	0.247	49%	0.492	C	S	.	.	P	Polyproline II helix	trans	-70	125.2	177.7	0	0	0	0	0	112	N618	G593-N618 PolarHBondContact N-OD1 3.1Å
594	G	50	Low	58.5	Low	54 Å²	54	92.1 Å²	92.1	56%	0.557	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-73.5	129.1	-179	0	0	0	0	0	112.9	N596	G594-N596 PolarHBondContact O-N 2.93Å; G594-N596 VanDerWaalsContact O-N 3.08Å
595	S	46.5	Very low	55.7	Low	114 Å²	114	96.9 Å²	96.9	80%	0.797	53%	0.531	S	S	*	.			trans	-73.2	93.8	173	58	0	0	0	0	111.1	G597	S595-G597 PolarHBondContact O-N 3.35Å
596	N	31.6	Very low	52.5	Low	168 Å²	168	103 Å²	103	90%	0.898	57%	0.573	S	S	*	*			trans	-73.1	119.7	170.3	-76.6	-9.4	0	0	0	110.2	G594	G594-N596 PolarHBondContact O-N 2.93Å; G594-N596 VanDerWaalsContact O-N 3.08Å
597	G	32.1	Very low	49.6	Very low	74 Å²	74	112.8 Å²	112.8	76%	0.763	61%	0.607	S	S	*	*			trans	132.3	132.2	171.8	0	0	0	0	0	113.4	S595	S595-G597 PolarHBondContact O-N 3.35Å
598	R	30.2	Very low	46.5	Very low	238 Å²	238	120.3 Å²	120.3	90%	0.898	65%	0.646	S	S	*	*			trans	-90.7	134.5	161.8	-54.2	169.6	-170.1	145.8	1.7	106.6
599	D	29.4	Very low	43.4	Very low	160 Å²	160	124.3 Å²	124.3	86%	0.856	67%	0.674	S	S	*	*			trans	164.7	179.6	135.2	-84.9	-19.1	0	0	0	112.8
600	S	32.5	Very low	40.4	Very low	119 Å²	119	133 Å²	133	83%	0.832	72%	0.72	S	S	*	*			trans	71.3	61.9	169.6	-62.1	0	0	0	0	117.9
601	R	28.6	Very low	37.5	Very low	244 Å²	244	139.8 Å²	139.8	92%	0.921	75%	0.75	S	S	*	*			trans	-83.3	100.2	137.6	-91.3	-168.7	-78.7	179.8	-7.1	109.1
602	R	30.1	Very low	34.8	Very low	222 Å²	222	146.8 Å²	146.8	84%	0.838	78%	0.783	S	S	*	*			trans	178.6	129.8	147.8	-101.9	168.9	-168.5	-138.6	1.6	113.2
603	I	28.5	Very low	32.3	Very low	157 Å²	157	150.4 Å²	150.4	81%	0.805	81%	0.805	S	S	*	*			trans	55.7	133.2	136.6	-55.5	163.4	0	0	0	119.6
604	G	25.4	Very low	30.7	Very low	72 Å²	72	161.1 Å²	161.1	74%	0.742	84%	0.837	S	S	*	*			trans	123	134.3	135	0	0	0	0	0	117.1
605	T	29.4	Very low	30.2	Very low	140 Å²	140	168 Å²	168	86%	0.859	85%	0.852	S	S	*	*			trans	-94.2	120.8	172.9	47.1	0	0	0	0	111.8
606	S	25.1	Very low	30.1	Very low	128 Å²	128	166.9 Å²	166.9	90%	0.895	84%	0.84	S	S	*	*			trans	-171.4	162.4	143.2	-91	0	0	0	0	112.8
607	R	30.1	Very low	31.4	Very low	233 Å²	233	167.6 Å²	167.6	88%	0.879	84%	0.838	S	S	*	*			trans	-83	149.7	179.3	-59.3	170.4	175.6	165.3	-3.3	111
608	I	27.5	Very low	33.4	Very low	159 Å²	159	166.9 Å²	166.9	82%	0.815	82%	0.817	S	S	*	*				164.7	160.8	126.9	-86.7	159.1	0	0	0	111.9
609	S	26.1	Very low	36	Very low	100 Å²	100	159.8 Å²	159.8	70%	0.699	79%	0.794	S	S	*	*			trans	67.4	88.8	165.5	56.5	0	0	0	0	119.5	K611	S609-K611 PolarHBondContact O-N 3.17Å
610	L	25.7	Very low	38.7	Very low	184 Å²	184	154.5 Å²	154.5	96%	0.963	77%	0.766	S	S	*	*			trans	-65.3	108.2	151.6	-78.7	159.3	0	0	0	110.2
611	K	27.6	Very low	41.2	Very low	197 Å²	197	150.6 Å²	150.6	86%	0.857	74%	0.735	S	S	*	*			trans	-120.8	138.3	158.2	-85.3	-171.5	174.2	-179.6	0	110.3	S609 N613	S609-K611 PolarHBondContact O-N 3.17Å; K611-N613 PolarHBondContact O-N 3.46Å
612	K	28.8	Very low	44.1	Very low	217 Å²	217	139 Å²	139	94%	0.943	69%	0.691	S	S	*	*			trans	-63.2	114.7	-176.1	-63	178.4	179.7	-178.9	0	110.2
613	N	28.3	Very low	47	Very low	155 Å²	155	130.9 Å²	130.9	83%	0.829	66%	0.661	S	S	*	*			trans	-122	131	163.4	-101.8	-22.1	0	0	0	108.9	K611 K615	K611-N613 PolarHBondContact O-N 3.46Å; N613-K615 PolarHBondContact O-N 3.44Å; N613-K615 VanDerWaalsContact O-N 3.08Å
614	R	31.2	Very low	50	Low	248 Å²	248	124 Å²	124	94%	0.936	63%	0.626	S	S	*	*			trans	-64	107.9	-179.5	-74.4	175.3	167	156.3	-6.4	109.2
615	K	39.6	Very low	53.1	Low	198 Å²	198	123.8 Å²	123.8	86%	0.861	61%	0.61	S	S	*	*			trans	-62.3	143.1	169.7	-72.1	-176.1	177.2	179.6	0	109.1	N613 Q617	N613-K615 PolarHBondContact O-N 3.44Å; N613-K615 VanDerWaalsContact O-N 3.08Å; K615-Q617 PolarHBondContact O-N 2.95Å
616	T	44.5	Very low	56.1	Low	91 Å²	91	117.6 Å²	117.6	56%	0.558	57%	0.572	S	S	*	*			trans	-59.2	106.9	177.2	46.4	0	0	0	0	110.3
617	Q	58.3	Low	59.2	Low	183 Å²	183	113.7 Å²	113.7	86%	0.855	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-74.7	129.2	-173.8	-162.3	167.8	1.9	0	0	110.2	K615	K615-Q617 PolarHBondContact O-N 2.95Å
618	N	75.4	Confident	61.9	Low	59 Å²	59	102.9 Å²	102.9	32%	0.316	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-71	134.9	176.7	-67.9	-19.2	0	0	0	109.5	Y546 R591 E592 G593	Y546-N618 HydrophobicContact CE1-CB 4.24Å; Y546-N618 WeakPolarHBondContact CE1-ND2 3.44Å; Y546-N618 WeakPolarHBondContact OH-CB 3.34Å; Y546-N618 PolarHBondContact OH-ND2 2.83Å; R591-N618 WeakPolarHBondContact O-CA 3.33Å; E592-N618 WeakPolarHBondContact CA-OD1 3.34Å; G593-N618 PolarHBondContact N-OD1 3.1Å
619	Q	83.3	Confident	64.6	Low	90 Å²	90	100.8 Å²	100.8	42%	0.421	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	124	-173.8	-179.4	178.7	10.9	0	0	110.6	Y590 R591	Y590-Q619 CarbonylContact C-O 3.56Å; Y590-Q619 WeakPolarHBondContact CA-O 3.48Å; R591-Q619 HydrophobicContact CB-CB 4.33Å; R591-Q619 VanDerWaalsContact CZ-OE1 3.27Å; R591-Q619 PolarHBondContact N-O 3.31Å; R591-Q619 PolarHBondContact O-N 3.08Å
620	L	86.6	Confident	67.4	Low	49 Å²	49	102.1 Å²	102.1	26%	0.257	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	131.5	167.2	-176.3	66.9	0	0	0	109.4	Y590 P646	Y590-L620 HydrophobicContact CD1-CB 4.12Å; Y590-L620 HydrophobicContact CD1-CD1 4.28Å; Y590-L620 HydrophobicContact CD2-CD1 4.46Å; Y590-L620 HydrophobicContact CE1-CB 3.85Å; Y590-L620 HydrophobicContact CE1-CD1 3.92Å; Y590-L620 HydrophobicContact CE1-CG 4.47Å; Y590-L620 HydrophobicContact CE2-CD1 4.13Å; L620-P646 HydrophobicContact CD2-CB 4.32Å; L620-P646 HydrophobicContact CG-CG 4.4Å; L620-P646 WeakPolarHBondContact O-CG 3.34Å
621	I	86	Confident	70.4	Confident	37 Å²	37	93.7 Å²	93.7	19%	0.19	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	-31.3	177.8	-53.3	-179.2	0	0	0	110.6	Y545 L589 R591 P646 P705	Y545-I621 HydrophobicContact CD1-CD1 3.43Å; Y545-I621 VanDerWaalsContact CD1-CD1 3.43Å; Y545-I621 HydrophobicContact CE1-CD1 3.29Å; L589-I621 HydrophobicContact CD2-CB 4.18Å; L589-I621 HydrophobicContact CD2-CD1 3.92Å; L589-I621 HydrophobicContact CD2-CG2 4.26Å; L589-I621 HydrophobicContact CG-CB 4.32Å; L589-I621 HydrophobicContact CG-CD1 3.99Å; L589-I621 HydrophobicContact CG-CG1 4.5Å; L589-I621 WeakPolarHBondContact O-CB 3.04Å; L589-I621 PolarHBondContact O-N 3.41Å; R591-I621 HydrophobicContact CB-CD1 3.91Å; R591-I621 HydrophobicContact CB-CG1 4.04Å; I621-P646 WeakPolarHBondContact O-CD 3.43Å; I621-P705 HydrophobicContact CG2-CG 4.01Å
622	G	89	Confident	73.1	Confident	0 Å²	0	87.2 Å²	87.2	0%	0	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.9	173.4	-179.1	0	0	0	0	0	110.8	L589 Q644	L589-G622 PolarHBondContact N-O 3.36Å; G622-Q644 CarbonylContact C-O 3.46Å; G622-Q644 WeakPolarHBondContact CA-O 3.36Å
623	Y	90.9	Very high	75.5	Confident	51 Å²	51	78.1 Å²	78.1	20%	0.2	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	161.4	179.8	63.9	-86.6	0	0	0	111	I587 Q644	I587-Y623 CarbonylContact O-C 3.3Å; I587-Y623 VanDerWaalsContact O-CA 3.28Å; I587-Y623 WeakPolarHBondContact O-CA 3.39Å; Y623-Q644 HydrophobicContact CE1-CB 4.33Å; Y623-Q644 HydrophobicContact CE2-CB 4.21Å; Y623-Q644 VanDerWaalsContact CZ-OE1 3.28Å; Y623-Q644 PolarHBondContact N-O 2.94Å; Y623-Q644 WeakPolarHBondContact O-CB 3.42Å; Y623-Q644 PolarHBondContact O-N 3.21Å; Y623-Q644 PolarHBondContact OH-OE1 3.1Å
624	I	91.4	Very high	77.4	Confident	14 Å²	14	74.8 Å²	74.8	7%	0.072	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	139.1	170.3	-71.6	149.4	0	0	0	107.1	T586 I587 I626 L641 L643 L707	T586-I624 CarbonylContact C-O 3.54Å; T586-I624 VanDerWaalsContact CA-O 3.25Å; T586-I624 WeakPolarHBondContact CA-O 3.02Å; I587-I624 PolarHBondContact N-O 3.46Å; I587-I624 PolarHBondContact O-N 2.99Å; I624-I626 HydrophobicContact CG2-CD1 4.03Å; I624-I626 HydrophobicContact CG2-CG1 3.58Å; I624-L641 HydrophobicContact CD1-CB 3.52Å; I624-L641 HydrophobicContact CG1-CB 4.21Å; I624-L641 HydrophobicContact CG2-CB 4.4Å; I624-L641 HydrophobicContact CG2-CD1 4.04Å; I624-L643 HydrophobicContact CD1-CD2 3.65Å; I624-L643 HydrophobicContact CD1-CG 3.77Å; I624-L643 HydrophobicContact CG1-CD2 3.86Å; I624-L643 HydrophobicContact CG1-CG 4.15Å; I624-L707 HydrophobicContact CD1-CB 4.14Å
625	T	91.2	Very high	79.4	Confident	67 Å²	67	67.9 Å²	67.9	41%	0.411	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	114.9	178.3	-64.4	0	0	0	0	107.7	V584 T586	V584-T625 HydrophobicContact CG1-CG2 3.28Å; T586-T625 PolarHBondContact OG1-OG1 3.37Å
626	I	90.7	Very high	81.3	Confident	9 Å²	9	61.2 Å²	61.2	5%	0.046	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	119.8	-174.1	-42	-174.8	0	0	0	108.7	M585 I624 V628 E630 I631 L641 I709	M585-I626 HydrophobicContact CE-CB 4.48Å; M585-I626 HydrophobicContact CE-CD1 3.69Å; M585-I626 HydrophobicContact CE-CG1 4.33Å; M585-I626 PolarHBondContact N-O 3Å; M585-I626 PolarHBondContact O-N 3.29Å; I624-I626 HydrophobicContact CG2-CD1 4.03Å; I624-I626 HydrophobicContact CG2-CG1 3.58Å; I626-V628 PolarHBondContact O-N 3.28Å; I626-E630 HydrophobicContact CG2-CB 4.15Å; I626-I631 HydrophobicContact CG2-CG2 4.13Å; I626-L641 HydrophobicContact CD1-CD1 3.44Å; I626-L641 VanDerWaalsContact CD1-CD1 3.44Å; I626-L641 HydrophobicContact CG1-CD1 4.36Å; I626-I709 HydrophobicContact CD1-CD1 3.63Å
627	P	90.3	Very high	83.2	Confident	47 Å²	47	59.8 Å²	59.8	31%	0.305	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	130.1	164.6	-23.6	34.3	0	0	0	110.6	T629 E630	P627-T629 PolarHBondContact O-N 2.94Å; P627-E630 HydrophobicContact CB-CG 4.3Å; P627-E630 WeakPolarHBondContact CD-OE1 3.39Å; P627-E630 WeakPolarHBondContact CG-OE1 3.49Å; P627-E630 WeakPolarHBondContact O-CB 3.5Å; P627-E630 PolarHBondContact O-N 2.77Å
628	V	87	Confident	84.7	Confident	6 Å²	6	56 Å²	56	4%	0.036	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-62	-23.3	-175.5	170.2	0	0	0	0	112.4	V582 S583 I626 E630 I631 S632 Y713	V582-V628 HydrophobicContact CB-CG2 4.22Å; V582-V628 HydrophobicContact CG1-CG2 3.81Å; S583-V628 PolarHBondContact O-N 3.02Å; I626-V628 PolarHBondContact O-N 3.28Å; V628-E630 VanDerWaalsContact C-N 3.29Å; V628-E630 PolarHBondContact O-N 3.41Å; V628-I631 WeakPolarHBondContact O-CG1 3.47Å; V628-I631 PolarHBondContact O-N 3.13Å; V628-S632 PolarHBondContact O-N 3.12Å; V628-S632 PolarHBondContact O-OG 3.5Å; V628-Y713 HydrophobicContact CG1-CD1 3.26Å; V628-Y713 HydrophobicContact CG1-CD2 3.48Å; V628-Y713 VanDerWaalsContact CG1-CD2 3.48Å; V628-Y713 HydrophobicContact CG1-CE1 3.48Å; V628-Y713 VanDerWaalsContact CG1-CE1 3.48Å; V628-Y713 HydrophobicContact CG1-CE2 3.69Å; V628-Y713 HydrophobicContact CG1-CG 3.24Å
629	T	85.4	Confident	85.2	Confident	114 Å²	114	55.7 Å²	55.7	70%	0.699	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-60.1	-31	171.7	47.5	0	0	0	0	114.1	P627 I631	P627-T629 PolarHBondContact O-N 2.94Å; T629-I631 VanDerWaalsContact C-N 3.3Å; T629-I631 PolarHBondContact O-N 3.48Å
630	E	84.7	Confident	85.4	Confident	128 Å²	128	55.4 Å²	55.4	60%	0.598	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-74.8	-21.6	-179.8	-66.4	175	-167.8	0	0	112.8	I626 P627 V628	I626-E630 HydrophobicContact CG2-CB 4.15Å; P627-E630 HydrophobicContact CB-CG 4.3Å; P627-E630 WeakPolarHBondContact CD-OE1 3.39Å; P627-E630 WeakPolarHBondContact CG-OE1 3.49Å; P627-E630 WeakPolarHBondContact O-CB 3.5Å; P627-E630 PolarHBondContact O-N 2.77Å; V628-E630 VanDerWaalsContact C-N 3.29Å; V628-E630 PolarHBondContact O-N 3.41Å
631	I	87.4	Confident	85.5	Confident	7 Å²	7	55 Å²	55	4%	0.036	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-108.9	7.2	178.4	58.7	169.3	0	0	0	113	L529 M585 I626 V628 T629 S633 A711 Y713	L529-I631 HydrophobicContact CD1-CD1 3.83Å; M585-I631 HydrophobicContact CE-CD1 3.85Å; M585-I631 HydrophobicContact SD-CD1 4.43Å; I626-I631 HydrophobicContact CG2-CG2 4.13Å; V628-I631 WeakPolarHBondContact O-CG1 3.47Å; V628-I631 PolarHBondContact O-N 3.13Å; T629-I631 VanDerWaalsContact C-N 3.3Å; T629-I631 PolarHBondContact O-N 3.48Å; I631-S633 PolarHBondContact O-N 2.92Å; I631-S633 PolarHBondContact O-OG 3.16Å; I631-S633 VanDerWaalsContact O-OG 3.12Å; I631-A711 HydrophobicContact CB-CB 4.17Å; I631-A711 HydrophobicContact CD1-CB 4.26Å; I631-A711 HydrophobicContact CG2-CB 3.9Å; I631-Y713 PolarHBondContact O-N 3.23Å
632	S	84.4	Confident	85.7	Confident	62 Å²	62	56.7 Å²	56.7	43%	0.434	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	-78.4	105.2	-179.1	-71.4	0	0	0	0	111.1	V628 Y713	V628-S632 PolarHBondContact O-N 3.12Å; V628-S632 PolarHBondContact O-OG 3.5Å; S632-Y713 WeakPolarHBondContact CA-O 3.36Å
633	S	79	Confident	85.6	Confident	26 Å²	26	56.9 Å²	56.9	18%	0.182	31%	0.305	C	S	.	.			trans	-160.4	160.4	-166.4	49	0	0	0	0	113.3	I631 T635 I637 R712 Y713 Q714	I631-S633 PolarHBondContact O-N 2.92Å; I631-S633 PolarHBondContact O-OG 3.16Å; I631-S633 VanDerWaalsContact O-OG 3.12Å; S633-T635 WeakPolarHBondContact CB-O 3.03Å; S633-T635 PolarHBondContact OG-O 3.42Å; S633-I637 WeakPolarHBondContact OG-CD1 3.45Å; S633-R712 WeakPolarHBondContact O-CD 3.43Å; S633-R712 WeakPolarHBondContact O-CG 3.45Å; S633-Y713 PolarHBondContact N-O 2.96Å; S633-Y713 VanDerWaalsContact N-O 3.12Å; S633-Q714 WeakPolarHBondContact O-CG 3.48Å
634	R	69.1	Low	85.4	Confident	84 Å²	84	59.3 Å²	59.3	32%	0.317	32%	0.318	S	S	.	.	S	Bend	trans	-83.4	-34.4	170.2	-81.8	-164.5	-179.7	-133.7	14.6	113.1	R712 L1073 D1077	R634-R712 WeakPolarHBondContact O-CD 3.15Å; R634-R712 PolarHBondContact O-NH1 2.9Å; R634-L1073 PolarHBondContact NH1-O 3.14Å; R634-L1073 PolarHBondContact NH2-O 3.42Å; R634-D1077 VanDerWaalsContact CD-OD2 3.29Å; R634-D1077 WeakPolarHBondContact CD-OD2 3.4Å; R634-D1077 IonicContact CZ-OD1 2.67Å; R634-D1077 VanDerWaalsContact CZ-OD1 3.27Å; R634-D1077 IonicContact CZ-OD2 3.71Å; R634-D1077 IonicContact NE-OD1 2.82Å; R634-D1077 IonicContact NE-OD2 3.75Å; R634-D1077 PolarHBondContact NE-OD2 2.78Å; R634-D1077 IonicContact NH1-OD2 3.55Å; R634-D1077 PolarHBondContact NH1-OD2 2.92Å; R634-D1077 IonicContact NH2-OD1 3.66Å; R634-D1077 PolarHBondContact NH2-OD1 2.9Å; R634-D1077 IonicContact NH2-OD2 3.87Å; R634-D1077 PolarHBondContact NH2-OD2 2.96Å
635	T	74	Confident	84.9	Confident	104 Å²	104	62.3 Å²	62.3	64%	0.638	34%	0.338	S	S	*	.	S	Bend	trans	-95.1	160.2	176.5	45.4	0	0	0	0	110.8	S633 I637	S633-T635 WeakPolarHBondContact CB-O 3.03Å; S633-T635 PolarHBondContact OG-O 3.42Å; T635-I637 PolarHBondContact O-N 2.67Å
636	D	79.6	Confident	84.1	Confident	57 Å²	57	61 Å²	61	31%	0.305	33%	0.331	S	S	.	.			trans	-83.3	114.8	-179.8	-58	-21.2	0	0	0	110.4	R710 R712	D636-R710 HydrophobicContact CB-CG 3.65Å; D636-R712 WeakPolarHBondContact OD1-CD 3.12Å; D636-R712 IonicContact OD1-NE 2.68Å
637	I	83.6	Confident	83	Confident	62 Å²	62	66.7 Å²	66.7	32%	0.318	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	125.1	178.8	-65.1	164.8	0	0	0	109.2	S633 T635 R710 A711	S633-I637 WeakPolarHBondContact OG-CD1 3.45Å; T635-I637 PolarHBondContact O-N 2.67Å; I637-R710 CarbonylContact O-C 3.56Å; I637-R710 VanDerWaalsContact O-CA 3.24Å; I637-R710 WeakPolarHBondContact O-CA 3.42Å; I637-A711 PolarHBondContact N-O 2.66Å; I637-A711 PolarHBondContact O-N 2.74Å
638	Q	88.8	Confident	80.5	Confident	102 Å²	102	72.2 Å²	72.2	48%	0.477	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	122	177.4	-169	-178.2	-94	0	0	111.1	L534 R708 I709 R710	L534-Q638 HydrophobicContact CD1-CG 4.13Å; Q638-R708 HydrophobicContact CG-CG 4.46Å; Q638-I709 WeakPolarHBondContact CA-O 3.36Å; Q638-I709 WeakPolarHBondContact CG-O 3.38Å; Q638-R710 HydrophobicContact CB-CB 4.38Å; Q638-R710 HydrophobicContact CB-CG 4.38Å; Q638-R710 HydrophobicContact CG-CB 4.27Å
639	T	86.8	Confident	77.9	Confident	54 Å²	54	78.3 Å²	78.3	33%	0.331	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	159.7	-171.5	-174.5	0	0	0	0	113.3	L641 R708 I709	T639-L641 HydrophobicContact CG2-CD1 4.11Å; T639-L641 HydrophobicContact CG2-CD2 4.01Å; T639-L641 HydrophobicContact CG2-CG 3.97Å; T639-R708 WeakPolarHBondContact O-CA 3.42Å; T639-R708 WeakPolarHBondContact O-CG 3.48Å; T639-I709 HydrophobicContact CG2-CD1 4.48Å; T639-I709 HydrophobicContact CG2-CG1 3.97Å; T639-I709 PolarHBondContact N-O 3.15Å; T639-I709 PolarHBondContact O-N 3.18Å
640	W	87.8	Confident	75	Confident	83 Å²	83	77.6 Å²	77.6	31%	0.314	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	129	172.2	-79.4	101.5	0	0	0	109.9	E535 R537 Q706 R708	E535-W640 HydrophobicContact CG-CH2 3.55Å; E535-W640 HydrophobicContact CG-CZ2 4.15Å; E535-W640 HydrophobicContact CG-CZ3 4.37Å; E535-W640 VanDerWaalsContact OE1-CH2 3.23Å; E535-W640 WeakPolarHBondContact OE1-CH2 3.31Å; E535-W640 VanDerWaalsContact OE1-CZ2 3.28Å; E535-W640 WeakPolarHBondContact OE1-CZ2 3.49Å; R537-W640 HydrophobicContact CB-CZ3 4.4Å; R537-W640 VanDerWaalsContact CD-CH2 3.49Å; R537-W640 HydrophobicContact CG-CH2 3.7Å; R537-W640 HydrophobicContact CG-CZ3 3.82Å; R537-W640 VanDerWaalsContact NH2-CZ2 3.31Å; W640-Q706 HydrophobicContact CE3-CB 4.14Å; W640-Q706 HydrophobicContact CZ3-CB 4.38Å; W640-R708 HydrophobicContact CD2-CB 3.78Å; W640-R708 HydrophobicContact CD2-CG 4.08Å; W640-R708 HydrophobicContact CE3-CB 3.75Å; W640-R708 HydrophobicContact CG-CG 4.38Å; W640-R708 HydrophobicContact CH2-CB 3.82Å; W640-R708 HydrophobicContact CZ2-CB 3.85Å; W640-R708 HydrophobicContact CZ2-CG 4.26Å; W640-R708 HydrophobicContact CZ3-CB 3.78Å
641	L	88.8	Confident	72.1	Confident	40 Å²	40	77 Å²	77	21%	0.209	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	129.2	-175.4	-59.1	173.2	0	0	0	109.8	I624 I626 T639 Q706 L707 I709	I624-L641 HydrophobicContact CD1-CB 3.52Å; I624-L641 HydrophobicContact CG1-CB 4.21Å; I624-L641 HydrophobicContact CG2-CB 4.4Å; I624-L641 HydrophobicContact CG2-CD1 4.04Å; I626-L641 HydrophobicContact CD1-CD1 3.44Å; I626-L641 VanDerWaalsContact CD1-CD1 3.44Å; I626-L641 HydrophobicContact CG1-CD1 4.36Å; T639-L641 HydrophobicContact CG2-CD1 4.11Å; T639-L641 HydrophobicContact CG2-CD2 4.01Å; T639-L641 HydrophobicContact CG2-CG 3.97Å; L641-Q706 CarbonylContact O-C 3.6Å; L641-Q706 WeakPolarHBondContact O-CA 3.43Å; L641-L707 PolarHBondContact N-O 3.04Å; L641-L707 PolarHBondContact O-N 2.89Å; L641-I709 HydrophobicContact CD1-CD1 3.55Å; L641-I709 HydrophobicContact CD1-CG1 3.88Å
642	T	89.8	Confident	69.2	Low	73 Å²	73	80.7 Å²	80.7	45%	0.448	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	131.9	175.4	-54.2	0	0	0	0	109.6	F704 Q706	T642-F704 HydrophobicContact CG2-CB 3.71Å; T642-Q706 HydrophobicContact CG2-CG 4.39Å; T642-Q706 PolarHBondContact OG1-NE2 2.82Å
643	L	87.7	Confident	66.5	Low	4 Å²	4	85.5 Å²	85.5	2%	0.021	47%	0.466	C	S	.	.	P	Polyproline II helix	trans	-76.5	131	179.6	-71.8	148.8	0	0	0	110.8	L589 I624 P705	L589-L643 HydrophobicContact CB-CD1 4.12Å; L589-L643 HydrophobicContact CB-CD2 4.12Å; L589-L643 HydrophobicContact CD2-CD1 3.59Å; L589-L643 HydrophobicContact CG-CD1 4.49Å; I624-L643 HydrophobicContact CD1-CD2 3.65Å; I624-L643 HydrophobicContact CD1-CG 3.77Å; I624-L643 HydrophobicContact CG1-CD2 3.86Å; I624-L643 HydrophobicContact CG1-CG 4.15Å; L643-P705 HydrophobicContact CB-CB 4.25Å; L643-P705 HydrophobicContact CD1-CB 3.64Å; L643-P705 PolarHBondContact N-O 3.44Å
644	Q	86.2	Confident	64	Low	102 Å²	102	91.8 Å²	91.8	48%	0.477	50%	0.497	S	S	.	.	B	Isolated β-bridge	trans	-68.9	138.1	168.9	-63.7	-174.9	-9.5	0	0	109.2	G622 Y623	G622-Q644 CarbonylContact C-O 3.46Å; G622-Q644 WeakPolarHBondContact CA-O 3.36Å; Y623-Q644 HydrophobicContact CE1-CB 4.33Å; Y623-Q644 HydrophobicContact CE2-CB 4.21Å; Y623-Q644 VanDerWaalsContact CZ-OE1 3.28Å; Y623-Q644 PolarHBondContact N-O 2.94Å; Y623-Q644 WeakPolarHBondContact O-CB 3.42Å; Y623-Q644 PolarHBondContact O-N 3.21Å; Y623-Q644 PolarHBondContact OH-OE1 3.1Å
645	P	80.4	Confident	62	Low	77 Å²	77	93.2 Å²	93.2	50%	0.5	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-65.5	159.9	178.5	28.6	-35.4	0	0	0	111.8
646	P	75.3	Confident	59.7	Low	40 Å²	40	92.9 Å²	92.9	26%	0.26	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-64.8	139.5	171.5	-13.6	30.7	0	0	0	109.7	L620 I621 E648	L620-P646 HydrophobicContact CD2-CB 4.32Å; L620-P646 HydrophobicContact CG-CG 4.4Å; L620-P646 WeakPolarHBondContact O-CG 3.34Å; I621-P646 WeakPolarHBondContact O-CD 3.43Å; P646-E648 PolarHBondContact O-N 3.12Å
647	I	66.7	Low	57.4	Low	128 Å²	128	97.8 Å²	97.8	66%	0.656	53%	0.53	S	S	*	.			trans	-77.3	91.4	176.1	-55.9	175.5	0	0	0	108.3	N649	I647-N649 VanDerWaalsContact C-N 3.28Å; I647-N649 PolarHBondContact O-N 2.95Å
648	E	38.1	Very low	54.6	Low	163 Å²	163	98.1 Å²	98.1	76%	0.762	54%	0.538	S	S	*	.			trans	-75.5	73.1	179.4	-67.4	-164	165.7	0	0	112.2	P646 S650	P646-E648 PolarHBondContact O-N 3.12Å; E648-S650 PolarHBondContact O-N 3.05Å
649	N	32	Very low	51.6	Low	135 Å²	135	96.5 Å²	96.5	72%	0.722	54%	0.538	S	S	*	.			trans	-75.1	111.9	163.6	-82.5	-1.2	0	0	0	109.7	I647	I647-N649 VanDerWaalsContact C-N 3.28Å; I647-N649 PolarHBondContact O-N 2.95Å
650	S	24	Very low	48.8	Very low	99 Å²	99	101.3 Å²	101.3	69%	0.692	55%	0.554	S	S	*	*			trans	-63.2	138.8	-176.1	53.3	0	0	0	0	113.9	E648	E648-S650 PolarHBondContact O-N 3.05Å
651	S	24.8	Very low	45.9	Very low	115 Å²	115	103.1 Å²	103.1	80%	0.804	57%	0.57	S	S	*	*	S	Bend	trans	53.7	66.4	155.8	60.5	0	0	0	0	118.5
652	S	26.6	Very low	42.8	Very low	85 Å²	85	104.7 Å²	104.7	59%	0.594	59%	0.589	S	S	*	*			trans	-168.3	22.3	150.1	42.9	0	0	0	0	115.9	D654	S652-D654 VanDerWaalsContact C-N 3.28Å; S652-D654 PolarHBondContact O-N 2.85Å
653	Q	27.1	Very low	39.8	Very low	163 Å²	163	107.5 Å²	107.5	76%	0.762	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	64.8	-179.2	-74.4	-172.4	-24.4	0	0	114.6
654	D	27.4	Very low	36.9	Very low	157 Å²	157	116 Å²	116	84%	0.84	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.8	-3.5	154.9	-97.4	-41.4	0	0	0	112.2	S652	S652-D654 VanDerWaalsContact C-N 3.28Å; S652-D654 PolarHBondContact O-N 2.85Å
655	N	26.5	Very low	33.9	Very low	115 Å²	115	116.6 Å²	116.6	62%	0.615	64%	0.644	S	S	*	*	S	Bend	trans	-126.9	1.9	-177.7	-89.1	-29.6	0	0	0	115.9	S658 S659	N655-S658 PolarHBondContact O-N 3.09Å; N655-S658 PolarHBondContact O-OG 3.28Å; N655-S658 VanDerWaalsContact O-OG 3.06Å; N655-S659 PolarHBondContact O-OG 3.36Å
656	L	26.6	Very low	31.3	Very low	97 Å²	97	120 Å²	120	51%	0.508	66%	0.657	S	S	.	*	S	Bend	trans	-88.4	-1.3	179.6	-83.4	168.2	0	0	0	114.7
657	I	30.2	Very low	29	Very low	159 Å²	159	122.9 Å²	122.9	82%	0.815	68%	0.679	S	S	*	*	S	Bend	trans	-90.9	-15.1	167.4	-65.4	175.5	0	0	0	111
658	S	25.6	Very low	27.1	Very low	70 Å²	70	125.5 Å²	125.5	49%	0.49	69%	0.688	S	S	.	*	S	Bend	trans	-108.4	3.3	-179.6	46.6	0	0	0	0	114.5	N655	N655-S658 PolarHBondContact O-N 3.09Å; N655-S658 PolarHBondContact O-OG 3.28Å; N655-S658 VanDerWaalsContact O-OG 3.06Å
659	S	25	Very low	26.5	Very low	67 Å²	67	126.9 Å²	126.9	47%	0.469	70%	0.695	S	S	.	*	S	Bend	trans	-112.8	-3.8	-175.8	-57.4	0	0	0	0	114.8	N655	N655-S659 PolarHBondContact O-OG 3.36Å
660	F	28.9	Very low	26.2	Very low	156 Å²	156	126.4 Å²	126.4	68%	0.684	69%	0.691	S	S	*	*	S	Bend	trans	-95	-21.5	167.8	-97.8	-83.3	0	0	0	112.8	A662 I663	F660-A662 PolarHBondContact O-N 2.98Å; F660-A662 VanDerWaalsContact O-N 3.12Å; F660-I663 PolarHBondContact O-N 3.37Å
661	D	26.6	Very low	26.3	Very low	120 Å²	120	129 Å²	129	64%	0.642	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	-5.9	178.8	-67.5	-16	0	0	0	113.9
662	A	23.9	Very low	26.3	Very low	74 Å²	74	132.7 Å²	132.7	61%	0.612	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	4.3	-180	0	0	0	0	0	114.6	F660	F660-A662 PolarHBondContact O-N 2.98Å; F660-A662 VanDerWaalsContact O-N 3.12Å
663	I	25.9	Very low	26.2	Very low	131 Å²	131	135.9 Å²	135.9	67%	0.672	71%	0.709	S	S	*	*	S	Bend	trans	-118.5	-3.9	-178.2	-65.2	179.5	0	0	0	112.6	F660	F660-I663 PolarHBondContact O-N 3.37Å
664	Y	26.3	Very low	26.3	Very low	184 Å²	184	136.1 Å²	136.1	72%	0.722	72%	0.715	S	S	*	*	S	Bend	trans	-124.5	30.2	175.1	-99.9	-80.8	0	0	0	114.4
665	T	24.8	Very low	26.1	Very low	114 Å²	114	133.5 Å²	133.5	70%	0.699	71%	0.709	S	S	*	*			trans	-100	44.6	166	57.8	0	0	0	0	112.3
666	D	25.6	Very low	26.1	Very low	147 Å²	147	134.7 Å²	134.7	79%	0.786	72%	0.72	S	S	*	*			trans	-144.8	130.8	153.8	-126.4	-26.8	0	0	0	111.4
667	S	27.5	Very low	26.1	Very low	102 Å²	102	140 Å²	140	71%	0.713	74%	0.739	S	S	*	*			trans	-100.8	139.7	173.3	-71.6	0	0	0	0	108.4
668	Q	26	Very low	25.9	Very low	183 Å²	183	140.1 Å²	140.1	86%	0.855	74%	0.741	S	S	*	*	S	Bend	trans	88.2	60.8	-176.3	-47.9	170.2	41.1	0	0	116.5
669	Q	25	Very low	25.9	Very low	192 Å²	192	144.9 Å²	144.9	90%	0.897	76%	0.761	S	S	*	*			trans	-174	84.9	143.6	-107.8	164.1	94	0	0	113.8
670	L	25.4	Very low	25.9	Very low	124 Å²	124	151.4 Å²	151.4	65%	0.649	78%	0.781	S	S	*	*			trans	-152.7	23.5	165.3	-147	68.7	0	0	0	117.3
671	D	25.7	Very low	25.7	Very low	153 Å²	153	152 Å²	152	82%	0.818	79%	0.79	S	S	*	*	S	Bend	trans	-98.1	9.4	179.3	-76.5	-55.8	0	0	0	114.9
672	K	26.6	Very low	25.5	Very low	194 Å²	194	154.3 Å²	154.3	84%	0.843	80%	0.802	S	S	*	*	S	Bend	trans	-130	14.8	-173.7	-77.9	-170.2	174	177.4	0	117.5
673	L	24.6	Very low	25.5	Very low	152 Å²	152	155.6 Å²	155.6	80%	0.796	81%	0.807	S	S	*	*	S	Bend	trans	-127.8	17.4	-178.2	-102.1	168	0	0	0	116.3
674	N	27.7	Very low	25.3	Very low	168 Å²	168	154.9 Å²	154.9	90%	0.898	81%	0.813	S	S	*	*	S	Bend	trans	-124.3	47.5	172.9	-95.7	-40.8	0	0	0	113.6
675	S	24.5	Very low	25.2	Very low	101 Å²	101	151.6 Å²	151.6	71%	0.706	82%	0.817	S	S	*	*	S	Bend	trans	-131.2	162	154.1	73.3	0	0	0	0	109.6
676	V	25.3	Very low	25.3	Very low	141 Å²	141	153.8 Å²	153.8	86%	0.855	82%	0.824	S	S	*	*	S	Bend	trans	68.3	35.3	-177.4	-154.4	0	0	0	0	115.7
677	K	27.7	Very low	25.3	Very low	208 Å²	208	154.9 Å²	154.9	90%	0.904	83%	0.83	S	S	*	*	S	Bend	trans	-152	26.3	155.8	-125.4	170.1	-172.2	177.3	0	117.9
678	L	25.9	Very low	25.1	Very low	161 Å²	161	156.6 Å²	156.6	84%	0.843	83%	0.83	S	S	*	*	S	Bend	trans	-138.6	27.3	-179.6	-119.9	163.4	0	0	0	114.7
679	N	24.1	Very low	25.2	Very low	170 Å²	170	156.1 Å²	156.1	91%	0.909	83%	0.833	S	S	*	*			trans	-125.6	53.5	177.4	-85.5	-42.1	0	0	0	111.8
680	K	25.9	Very low	25.2	Very low	205 Å²	205	155.4 Å²	155.4	89%	0.891	83%	0.829	S	S	*	*	S	Bend	trans	-156.8	46.5	172	-137.2	179.6	-174	-174.3	0	114.3
681	L	23.6	Very low	25.3	Very low	167 Å²	167	155.8 Å²	155.8	87%	0.874	83%	0.832	S	S	*	*			trans	-164.5	85.4	166.1	-106.1	167.9	0	0	0	108
682	N	24.4	Very low	25.4	Very low	169 Å²	169	157.2 Å²	157.2	90%	0.904	83%	0.833	S	S	*	*			trans	-164.4	66.1	170.2	-115.5	-18.6	0	0	0	110.8
683	S	22.3	Very low	25.3	Very low	101 Å²	101	151.9 Å²	151.9	71%	0.706	82%	0.821	S	S	*	*	S	Bend	trans	-161.9	137.3	168.4	-23.3	0	0	0	0	107.9
684	S	22.7	Very low	25.4	Very low	116 Å²	116	155 Å²	155	81%	0.811	82%	0.823	S	S	*	*	S	Bend	trans	60	139.7	179.7	42.2	0	0	0	0	117.9
685	S	24	Very low	25.2	Very low	115 Å²	115	153.7 Å²	153.7	80%	0.804	82%	0.816	S	S	*	*			trans	68.2	81	158.2	-53.6	0	0	0	0	119.4
686	L	26.5	Very low	25.3	Very low	160 Å²	160	156.8 Å²	156.8	84%	0.838	83%	0.825	S	S	*	*			trans	-129.1	24.3	154.6	-97.7	177.8	0	0	0	114.9	L688	L686-L688 PolarHBondContact O-N 3.15Å
687	N	25	Very low	25.3	Very low	171 Å²	171	153.4 Å²	153.4	91%	0.914	82%	0.819	S	S	*	*			trans	-77.3	66.5	156.7	-87	-12.2	0	0	0	109.6
688	L	24.2	Very low	25.3	Very low	137 Å²	137	152 Å²	152	72%	0.717	82%	0.819	S	S	*	*			trans	-162.6	73.6	176.5	-114.9	168.4	0	0	0	113.1	L686	L686-L688 PolarHBondContact O-N 3.15Å
689	L	27	Very low	25.5	Very low	173 Å²	173	150.4 Å²	150.4	91%	0.906	82%	0.816	S	S	*	*			trans	-135.3	46.2	157.3	-109.9	172.6	0	0	0	111
690	H	26.3	Very low	26	Very low	177 Å²	177	147.9 Å²	147.9	82%	0.819	80%	0.802	S	S	*	*	S	Bend	trans	-94.9	148	160.4	-120.1	65.2	0	0	0	109	H692	H690-H692 PolarHBondContact O-N 2.8Å
691	N	28.3	Very low	26.8	Very low	133 Å²	133	144.9 Å²	144.9	71%	0.711	79%	0.792	S	S	*	*			trans	-71.2	92.9	-173.7	-74.5	-31.6	0	0	0	113.4
692	H	26.4	Very low	28	Very low	182 Å²	182	141.5 Å²	141.5	84%	0.843	78%	0.778	S	S	*	*			trans	-156	139.9	152.4	-73.8	-55	0	0	0	108.4	H690	H690-H692 PolarHBondContact O-N 2.8Å
693	S	25.5	Very low	29.8	Very low	83 Å²	83	138.9 Å²	138.9	58%	0.58	76%	0.764	S	S	*	*			cis	-148.6	142.6	-1.3	-179.1	0	0	0	0	110.3	N695	S693-N695 PolarHBondContact OG-N 2.92Å
694	Y	25.8	Very low	32.2	Very low	217 Å²	217	139 Å²	139	85%	0.851	75%	0.752	S	S	*	*			trans	-133.3	58.7	164	-115	-75.9	0	0	0	109.2	N696	Y694-N696 PolarHBondContact O-N 2.91Å
695	N	23.9	Very low	35.1	Very low	141 Å²	141	134.6 Å²	134.6	75%	0.754	72%	0.721	S	S	*	*			trans	-80.4	92.5	171.9	-90.7	2.3	0	0	0	110.6	S693	S693-N695 PolarHBondContact OG-N 2.92Å
696	N	25.7	Very low	38.2	Very low	166 Å²	166	131.9 Å²	131.9	89%	0.888	70%	0.695	S	S	*	*	S	Bend	trans	-160	102.8	152.9	-101.7	-26.3	0	0	0	108.9	Y694	Y694-N696 PolarHBondContact O-N 2.91Å
697	G	25.5	Very low	41.2	Very low	70 Å²	70	124.3 Å²	124.3	72%	0.722	66%	0.656	S	S	*	*	S	Bend	trans	107.6	118.7	-175.2	0	0	0	0	0	113.1	T699	G697-T699 PolarHBondContact O-N 2.83Å
698	I	28.9	Very low	44.3	Very low	179 Å²	179	118.4 Å²	118.4	92%	0.918	62%	0.621	S	S	*	*			trans	-79.8	104.2	-178.9	-60.4	169.1	0	0	0	109.5
699	T	29.7	Very low	47.4	Very low	127 Å²	127	111.9 Å²	111.9	78%	0.779	59%	0.586	S	S	*	*			trans	-147.6	143.1	160	49.4	0	0	0	0	110.1	G697 Q701	G697-T699 PolarHBondContact O-N 2.83Å; T699-Q701 PolarHBondContact O-N 3.2Å
700	D	34.6	Very low	50.4	Low	116 Å²	116	107.9 Å²	107.9	62%	0.62	56%	0.559	S	S	*	*			trans	-70.5	123.5	-169.1	-59.2	-75.3	0	0	0	114.5	T702	D700-T702 WeakPolarHBondContact CB-OG1 3.45Å; D700-T702 PolarHBondContact O-N 3.24Å
701	Q	42	Very low	53.5	Low	142 Å²	142	99.6 Å²	99.6	66%	0.664	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-66.4	-4.2	170.1	-64.9	-173.6	-3	0	0	113.8	T699 N703	T699-Q701 PolarHBondContact O-N 3.2Å; Q701-N703 PolarHBondContact O-N 3.45Å
702	T	49.5	Very low	56.4	Low	97 Å²	97	94.5 Å²	94.5	60%	0.595	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-78.8	-12.9	-173.9	59.6	0	0	0	0	114.6	N538 D700	N538-T702 PolarHBondContact ND2-O 3.07Å; D700-T702 WeakPolarHBondContact CB-OG1 3.45Å; D700-T702 PolarHBondContact O-N 3.24Å
703	N	61.3	Low	59.3	Low	113 Å²	113	86.6 Å²	86.6	60%	0.604	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-104.4	-1.8	-166.9	-90.4	-46.9	0	0	0	116.5	Q701	Q701-N703 PolarHBondContact O-N 3.45Å
704	F	73.5	Confident	62.2	Low	105 Å²	105	85.3 Å²	85.3	46%	0.461	44%	0.44	S	S	.	.	S	Bend	trans	-70.8	138.6	179.4	-79.6	-82.9	0	0	0	112.4	N538 T642 Q706	N538-F704 VanDerWaalsContact CB-O 3.26Å; N538-F704 WeakPolarHBondContact CB-O 3.37Å; N538-F704 PolarHBondContact ND2-O 3.24Å; T642-F704 HydrophobicContact CG2-CB 3.71Å; F704-Q706 PolarHBondContact O-N 2.82Å
705	P	84.6	Confident	65.1	Low	23 Å²	23	77.9 Å²	77.9	15%	0.149	42%	0.42	C	S	.	.			trans	-55.5	134.5	176.3	-29.6	38.2	0	0	0	113.4	I539 I621 L643	I539-P705 HydrophobicContact CD1-CB 4.15Å; I539-P705 HydrophobicContact CG1-CB 3.75Å; I539-P705 HydrophobicContact CG1-CG 4.15Å; I621-P705 HydrophobicContact CG2-CG 4.01Å; L643-P705 HydrophobicContact CB-CB 4.25Å; L643-P705 HydrophobicContact CD1-CB 3.64Å; L643-P705 PolarHBondContact N-O 3.44Å
706	Q	87.9	Confident	68	Low	58 Å²	58	72.1 Å²	72.1	27%	0.271	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	139	178.7	-66.9	-173	-32.1	0	0	111.8	A536 R537 W640 L641 T642 F704	A536-Q706 CarbonylContact C-O 3.59Å; A536-Q706 WeakPolarHBondContact CA-O 3.34Å; A536-Q706 VanDerWaalsContact CB-O 3.24Å; A536-Q706 WeakPolarHBondContact CB-O 3.38Å; R537-Q706 HydrophobicContact CB-CB 4.45Å; R537-Q706 PolarHBondContact N-O 3.22Å; R537-Q706 PolarHBondContact O-N 2.98Å; R537-Q706 VanDerWaalsContact O-N 3.13Å; W640-Q706 HydrophobicContact CE3-CB 4.14Å; W640-Q706 HydrophobicContact CZ3-CB 4.38Å; L641-Q706 CarbonylContact O-C 3.6Å; L641-Q706 WeakPolarHBondContact O-CA 3.43Å; T642-Q706 HydrophobicContact CG2-CG 4.39Å; T642-Q706 PolarHBondContact OG1-NE2 2.82Å; F704-Q706 PolarHBondContact O-N 2.82Å
707	L	88.9	Confident	70.9	Confident	0 Å²	0	65 Å²	65	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	130	179	-164.1	78.9	0	0	0	109.7	I533 A536 W570 I587 I624 L641 I709	I533-L707 HydrophobicContact CD1-CD2 4.36Å; I533-L707 HydrophobicContact CG2-CD1 3.92Å; I533-L707 HydrophobicContact CG2-CD2 4.28Å; I533-L707 HydrophobicContact CG2-CG 4.31Å; A536-L707 HydrophobicContact CB-CD1 4.11Å; W570-L707 HydrophobicContact CH2-CD1 4.04Å; W570-L707 HydrophobicContact CZ3-CD1 3.84Å; I587-L707 HydrophobicContact CD1-CD2 4.48Å; I587-L707 HydrophobicContact CG2-CD2 3.79Å; I624-L707 HydrophobicContact CD1-CB 4.14Å; L641-L707 PolarHBondContact N-O 3.04Å; L641-L707 PolarHBondContact O-N 2.89Å; L707-I709 HydrophobicContact CD2-CG2 3.6Å; L707-I709 HydrophobicContact CG-CG2 4.04Å
708	R	90.2	Very high	73.8	Confident	48 Å²	48	61.7 Å²	61.7	18%	0.181	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	123.1	165.8	-165	177.9	64.4	-126.9	-8.3	109.6	L534 E535 Q638 T639 W640	L534-R708 HydrophobicContact CB-CB 4.43Å; L534-R708 WeakPolarHBondContact CB-O 3.42Å; L534-R708 HydrophobicContact CD1-CG 4.2Å; L534-R708 PolarHBondContact N-O 3.25Å; E535-R708 VanDerWaalsContact CD-NH2 3.29Å; E535-R708 HydrophobicContact CG-CB 4.24Å; E535-R708 PolarHBondContact O-N 2.96Å; E535-R708 IonicContact OE1-CZ 2.73Å; E535-R708 IonicContact OE1-NH1 3.17Å; E535-R708 PolarHBondContact OE1-NH1 3.18Å; E535-R708 IonicContact OE2-CZ 2.72Å; E535-R708 VanDerWaalsContact OE2-CZ 3.22Å; E535-R708 IonicContact OE2-NH1 2.65Å; E535-R708 PolarHBondContact OE2-NH1 3.44Å; E535-R708 IonicContact OE2-NH2 3.46Å; E535-R708 PolarHBondContact OE2-NH2 3Å; Q638-R708 HydrophobicContact CG-CG 4.46Å; T639-R708 WeakPolarHBondContact O-CA 3.42Å; T639-R708 WeakPolarHBondContact O-CG 3.48Å; W640-R708 HydrophobicContact CD2-CB 3.78Å; W640-R708 HydrophobicContact CD2-CG 4.08Å; W640-R708 HydrophobicContact CE3-CB 3.75Å; W640-R708 HydrophobicContact CG-CG 4.38Å; W640-R708 HydrophobicContact CH2-CB 3.82Å; W640-R708 HydrophobicContact CZ2-CB 3.85Å; W640-R708 HydrophobicContact CZ2-CG 4.26Å; W640-R708 HydrophobicContact CZ3-CB 3.78Å
709	I	90.9	Very high	76.7	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	161.7	174.1	70.3	168.9	0	0	0	111.1	L531 S532 I533 M585 I587 I626 Q638 T639 L641 L707 A711	L531-I709 HydrophobicContact CD1-CB 4.22Å; L531-I709 HydrophobicContact CD1-CD1 4.25Å; S532-I709 CarbonylContact O-C 3.57Å; S532-I709 WeakPolarHBondContact O-CA 3.34Å; I533-I709 HydrophobicContact CG1-CG2 4.26Å; M585-I709 HydrophobicContact CE-CD1 4.46Å; I587-I709 HydrophobicContact CD1-CD1 4.38Å; I587-I709 HydrophobicContact CD1-CG2 4.09Å; I626-I709 HydrophobicContact CD1-CD1 3.63Å; Q638-I709 WeakPolarHBondContact CA-O 3.36Å; Q638-I709 WeakPolarHBondContact CG-O 3.38Å; T639-I709 HydrophobicContact CG2-CD1 4.48Å; T639-I709 HydrophobicContact CG2-CG1 3.97Å; T639-I709 PolarHBondContact N-O 3.15Å; T639-I709 PolarHBondContact O-N 3.18Å; L641-I709 HydrophobicContact CD1-CD1 3.55Å; L641-I709 HydrophobicContact CD1-CG1 3.88Å; L707-I709 HydrophobicContact CD2-CG2 3.6Å; L707-I709 HydrophobicContact CG-CG2 4.04Å; I709-A711 HydrophobicContact CD1-CB 4.21Å
710	R	90	Very high	79.3	Confident	89 Å²	89	48.4 Å²	48.4	34%	0.336	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	128.4	160	-179.3	-174.2	-58.8	153.3	2.8	107.3	L531 S532 L534 D636 I637 Q638	L531-R710 CarbonylContact C-O 3.54Å; L531-R710 WeakPolarHBondContact CA-O 3.45Å; S532-R710 PolarHBondContact N-O 3.28Å; S532-R710 PolarHBondContact O-N 2.95Å; L534-R710 HydrophobicContact CD1-CB 4.31Å; D636-R710 HydrophobicContact CB-CG 3.65Å; I637-R710 CarbonylContact O-C 3.56Å; I637-R710 VanDerWaalsContact O-CA 3.24Å; I637-R710 WeakPolarHBondContact O-CA 3.42Å; Q638-R710 HydrophobicContact CB-CB 4.38Å; Q638-R710 HydrophobicContact CB-CG 4.38Å; Q638-R710 HydrophobicContact CG-CB 4.27Å
711	A	90	Very high	81.6	Confident	2 Å²	2	45 Å²	45	2%	0.017	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	147.3	-174.5	0	0	0	0	0	112.1	R530 L531 I631 I637 I709	R530-A711 CarbonylContact O-C 3.58Å; R530-A711 WeakPolarHBondContact O-CA 3.45Å; L531-A711 HydrophobicContact CD1-CB 4.02Å; I631-A711 HydrophobicContact CB-CB 4.17Å; I631-A711 HydrophobicContact CD1-CB 4.26Å; I631-A711 HydrophobicContact CG2-CB 3.9Å; I637-A711 PolarHBondContact N-O 2.66Å; I637-A711 PolarHBondContact O-N 2.74Å; I709-A711 HydrophobicContact CD1-CB 4.21Å
712	R	88.9	Confident	83.6	Confident	26 Å²	26	42.7 Å²	42.7	10%	0.098	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	114	171.2	-171.2	-178.1	69.1	161	4.4	109.5	L529 R530 S633 R634 D636 Q714	L529-R712 WeakPolarHBondContact CA-O 3.29Å; R530-R712 HydrophobicContact CB-CB 4.49Å; R530-R712 PolarHBondContact N-O 2.83Å; R530-R712 PolarHBondContact O-N 2.88Å; S633-R712 WeakPolarHBondContact O-CD 3.43Å; S633-R712 WeakPolarHBondContact O-CG 3.45Å; R634-R712 WeakPolarHBondContact O-CD 3.15Å; R634-R712 PolarHBondContact O-NH1 2.9Å; D636-R712 WeakPolarHBondContact OD1-CD 3.12Å; D636-R712 IonicContact OD1-NE 2.68Å; R712-Q714 HydrophobicContact CG-CG 4.07Å; R712-Q714 VanDerWaalsContact CZ-CD 3.49Å
713	Y	89.1	Confident	85.4	Confident	16 Å²	16	41 Å²	41	6%	0.063	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	141.4	164.6	-174.8	-95.9	0	0	0	109.8	N527 S528 L529 V628 I631 S632 S633	N527-Y713 HydrophobicContact CB-CE2 4.2Å; N527-Y713 WeakPolarHBondContact CB-OH 3.48Å; N527-Y713 PolarHBondContact OD1-OH 3.5Å; N527-Y713 VanDerWaalsContact OD1-OH 3.07Å; S528-Y713 WeakPolarHBondContact O-CA 3.38Å; S528-Y713 VanDerWaalsContact O-CD2 3.28Å; S528-Y713 WeakPolarHBondContact O-CD2 3.12Å; L529-Y713 HydrophobicContact CB-CD2 4.24Å; L529-Y713 HydrophobicContact CD1-CD2 4.49Å; V628-Y713 HydrophobicContact CG1-CD1 3.26Å; V628-Y713 HydrophobicContact CG1-CD2 3.48Å; V628-Y713 VanDerWaalsContact CG1-CD2 3.48Å; V628-Y713 HydrophobicContact CG1-CE1 3.48Å; V628-Y713 VanDerWaalsContact CG1-CE1 3.48Å; V628-Y713 HydrophobicContact CG1-CE2 3.69Å; V628-Y713 HydrophobicContact CG1-CG 3.24Å; I631-Y713 PolarHBondContact O-N 3.23Å; S632-Y713 WeakPolarHBondContact CA-O 3.36Å; S633-Y713 PolarHBondContact N-O 2.96Å; S633-Y713 VanDerWaalsContact N-O 3.12Å
714	Q	86.3	Confident	86.8	Confident	56 Å²	56	35.6 Å²	35.6	26%	0.262	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	139.2	172.8	-55.5	-169.9	-80.7	0	0	109.7	N527 S528 S633 R712	N527-Q714 WeakPolarHBondContact CA-O 3.44Å; S528-Q714 PolarHBondContact N-O 2.97Å; S528-Q714 PolarHBondContact O-N 3.4Å; S633-Q714 WeakPolarHBondContact O-CG 3.48Å; R712-Q714 HydrophobicContact CG-CG 4.07Å; R712-Q714 VanDerWaalsContact CZ-CD 3.49Å
715	S	86	Confident	87.6	Confident	62 Å²	62	36.9 Å²	36.9	43%	0.434	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	105	170.7	-165.2	0	0	0	0	107.9	N527	N527-S715 WeakPolarHBondContact OD1-CB 3.32Å; N527-S715 PolarHBondContact OD1-OG 2.98Å
716	L	85.1	Confident	87.9	Confident	20 Å²	20	38.9 Å²	38.9	11%	0.105	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	121	-177	177.6	65.6	0	0	0	109.3	L525 E526 V718 A1069 N1070 L1073	L525-L716 WeakPolarHBondContact CA-O 3.35Å; E526-L716 HydrophobicContact CB-CB 4.25Å; E526-L716 PolarHBondContact N-O 2.87Å; E526-L716 PolarHBondContact O-N 3.34Å; L716-V718 HydrophobicContact CD2-CG2 3.94Å; L716-V718 HydrophobicContact CG-CG2 3.84Å; L716-V718 PolarHBondContact O-N 3.45Å; L716-A1069 HydrophobicContact CD1-CB 3.98Å; L716-A1069 HydrophobicContact CD2-CB 3.98Å; L716-A1069 HydrophobicContact CG-CB 4.08Å; L716-N1070 WeakPolarHBondContact CD2-OD1 3.19Å; L716-L1073 HydrophobicContact CD1-CD1 3.4Å; L716-L1073 VanDerWaalsContact CD1-CD1 3.4Å; L716-L1073 HydrophobicContact CD1-CG 3.92Å
717	G	86.2	Confident	88.1	Confident	17 Å²	17	36.1 Å²	36.1	18%	0.175	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	116.8	168.9	0	0	0	0	0	110.5	Y724 L1178	G717-Y724 PolarHBondContact O-OH 3.02Å; G717-L1178 WeakPolarHBondContact O-CD2 3.29Å
718	V	86.7	Confident	88.3	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	117.8	-179	-177.8	0	0	0	0	109.1	Y523 H524 E526 L716 Y724 N1065 A1069	Y523-V718 VanDerWaalsContact CA-O 3.31Å; Y523-V718 WeakPolarHBondContact CA-O 3.23Å; Y523-V718 VanDerWaalsContact CD2-O 3.24Å; Y523-V718 WeakPolarHBondContact CD2-O 3.49Å; H524-V718 PolarHBondContact N-O 2.92Å; H524-V718 PolarHBondContact O-N 3.14Å; E526-V718 HydrophobicContact CB-CG2 4.43Å; E526-V718 HydrophobicContact CG-CG2 4.01Å; L716-V718 HydrophobicContact CD2-CG2 3.94Å; L716-V718 HydrophobicContact CG-CG2 3.84Å; L716-V718 PolarHBondContact O-N 3.45Å; V718-Y724 HydrophobicContact CG1-CE2 4.42Å; V718-N1065 HydrophobicContact CG1-CB 3.48Å; V718-N1065 VanDerWaalsContact CG1-CB 3.48Å; V718-A1069 HydrophobicContact CG2-CB 4.06Å
719	L	88.6	Confident	88.3	Confident	5 Å²	5	37.8 Å²	37.8	3%	0.026	20%	0.2	C	C	.	.			trans	-80.1	165.4	173.9	-66.4	176.7	0	0	0	112	Y523 N723 Y724 I1174 A1177 L1178	Y523-L719 HydrophobicContact CD2-CD2 3.98Å; L719-N723 HydrophobicContact CB-CB 3.8Å; L719-N723 HydrophobicContact CD1-CB 3.64Å; L719-N723 HydrophobicContact CG-CB 4.34Å; L719-Y724 HydrophobicContact CB-CD2 4.37Å; L719-Y724 HydrophobicContact CB-CE2 3.66Å; L719-Y724 PolarHBondContact N-OH 2.9Å; L719-Y724 WeakPolarHBondContact O-CE2 3.25Å; L719-I1174 HydrophobicContact CD1-CG2 3.94Å; L719-A1177 HydrophobicContact CD1-CB 3.66Å; L719-A1177 HydrophobicContact CD2-CB 4.3Å; L719-L1178 HydrophobicContact CD1-CD2 4.4Å; L719-L1178 HydrophobicContact CD1-CG 4.13Å; L719-L1178 HydrophobicContact CD2-CD2 3.87Å; L719-L1178 HydrophobicContact CD2-CG 4.22Å; L719-L1178 HydrophobicContact CG-CD2 3.71Å; L719-L1178 HydrophobicContact CG-CG 3.99Å
720	P	85.1	Confident	88.4	Confident	21 Å²	21	38.4 Å²	38.4	14%	0.136	20%	0.203	C	C	.	.			trans	-53.9	148.4	164.3	-26	35.9	0	0	0	113	N521 C722 N723	N521-P720 VanDerWaalsContact O-CG 3.28Å; N521-P720 WeakPolarHBondContact O-CG 3.48Å; P720-C722 PolarHBondContact O-N 3.4Å; P720-N723 WeakPolarHBondContact O-CB 3.2Å; P720-N723 PolarHBondContact O-N 2.99Å
721	L	82.5	Confident	88.4	Confident	46 Å²	46	34.1 Å²	34.1	24%	0.241	19%	0.187	C	C	.	.	H	α-helix	trans	-53.5	-34.5	-177.2	-177.9	55.7	0	0	0	113.7	E520 N723 Y724 W725 N1065 L1068	E520-L721 PolarHBondContact O-N 3.33Å; E520-L721 VanDerWaalsContact O-N 3.17Å; L721-N723 VanDerWaalsContact C-N 3.25Å; L721-N723 PolarHBondContact O-N 2.97Å; L721-Y724 PolarHBondContact O-N 2.9Å; L721-Y724 VanDerWaalsContact O-N 3.15Å; L721-W725 PolarHBondContact O-N 3.48Å; L721-N1065 WeakPolarHBondContact CA-OD1 3.21Å; L721-N1065 WeakPolarHBondContact CB-OD1 3.18Å; L721-N1065 VanDerWaalsContact CD1-OD1 3.25Å; L721-N1065 WeakPolarHBondContact CD1-OD1 3.27Å; L721-L1068 HydrophobicContact CD1-CD1 4.02Å
722	C	83.9	Confident	88.5	Confident	92 Å²	92	35.3 Å²	35.3	62%	0.622	19%	0.193	S	C	*	.	H	α-helix	trans	-63.2	-28.1	-179.7	59.5	0	0	0	0	113.4	P720	P720-C722 PolarHBondContact O-N 3.4Å
723	N	87.2	Confident	88.5	Confident	61 Å²	61	39.9 Å²	39.9	33%	0.326	22%	0.219	S	C	.	.	H	α-helix	trans	-72.2	-33.8	174.8	-69.2	92.7	0	0	0	112.4	L719 P720 L721 P726	L719-N723 HydrophobicContact CB-CB 3.8Å; L719-N723 HydrophobicContact CD1-CB 3.64Å; L719-N723 HydrophobicContact CG-CB 4.34Å; P720-N723 WeakPolarHBondContact O-CB 3.2Å; P720-N723 PolarHBondContact O-N 2.99Å; L721-N723 VanDerWaalsContact C-N 3.25Å; L721-N723 PolarHBondContact O-N 2.97Å; N723-P726 WeakPolarHBondContact O-CD 3.12Å
724	Y	91.4	Very high	88.6	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-84	-10.5	178.3	-63.6	-66.3	0	0	0	113.6	G717 V718 L719 L721 P726 L727 R728 N1065 L1068 A1069 H1072 I1174	G717-Y724 PolarHBondContact O-OH 3.02Å; V718-Y724 HydrophobicContact CG1-CE2 4.42Å; L719-Y724 HydrophobicContact CB-CD2 4.37Å; L719-Y724 HydrophobicContact CB-CE2 3.66Å; L719-Y724 PolarHBondContact N-OH 2.9Å; L719-Y724 WeakPolarHBondContact O-CE2 3.25Å; L721-Y724 PolarHBondContact O-N 2.9Å; L721-Y724 VanDerWaalsContact O-N 3.15Å; Y724-P726 VanDerWaalsContact C-CD 3.43Å; Y724-L727 WeakPolarHBondContact O-CB 3.35Å; Y724-L727 PolarHBondContact O-N 3.23Å; Y724-R728 WeakPolarHBondContact O-CB 3.48Å; Y724-R728 PolarHBondContact O-N 3.06Å; Y724-N1065 HydrophobicContact CE2-CB 4.48Å; Y724-L1068 HydrophobicContact CD1-CB 3.97Å; Y724-L1068 HydrophobicContact CD2-CB 4.17Å; Y724-L1068 HydrophobicContact CG-CB 3.72Å; Y724-A1069 HydrophobicContact CE1-CB 4.31Å; Y724-A1069 HydrophobicContact CE2-CB 4.42Å; Y724-A1069 WeakPolarHBondContact OH-CB 3.39Å; Y724-H1072 HydrophobicContact CE1-CB 4.31Å; Y724-I1174 HydrophobicContact CD1-CD1 4.01Å; Y724-I1174 HydrophobicContact CD1-CG2 4.35Å; Y724-I1174 HydrophobicContact CE1-CD1 4.48Å; Y724-I1174 HydrophobicContact CE1-CG2 3.8Å
725	W	89.2	Confident	88.7	Confident	133 Å²	133	38.9 Å²	38.9	50%	0.504	22%	0.218	S	C	.	.	H	α-helix	trans	-53.6	-39.2	-176.2	-162.5	-91.9	0	0	0	115.2	L721 T729	L721-W725 PolarHBondContact O-N 3.48Å; W725-T729 WeakPolarHBondContact O-CB 3.43Å; W725-T729 PolarHBondContact O-N 3.29Å; W725-T729 PolarHBondContact O-OG1 3.45Å
726	P	90.8	Very high	88.8	Confident	64 Å²	64	38.9 Å²	38.9	42%	0.416	21%	0.213	S	C	.	.	H	α-helix	trans	-64.4	-43.2	174.9	-21	34	0	0	0	112.8	N723 Y724 T729 L730 I1170	N723-P726 WeakPolarHBondContact O-CD 3.12Å; Y724-P726 VanDerWaalsContact C-CD 3.43Å; P726-T729 PolarHBondContact O-N 3.39Å; P726-L730 WeakPolarHBondContact O-CB 3.44Å; P726-L730 PolarHBondContact O-N 2.93Å; P726-I1170 HydrophobicContact CB-CD1 4.08Å; P726-I1170 HydrophobicContact CB-CG1 4.09Å; P726-I1170 HydrophobicContact CB-CG2 4.13Å
727	L	93.3	Very high	89	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-63.7	-50.3	177	179	63	0	0	0	110.3	Y724 T729 L730 V731 L1071 H1072 L1075 L1167 I1170 L1171 I1174	Y724-L727 WeakPolarHBondContact O-CB 3.35Å; Y724-L727 PolarHBondContact O-N 3.23Å; L727-T729 VanDerWaalsContact C-N 3.31Å; L727-T729 PolarHBondContact O-N 3.37Å; L727-L730 PolarHBondContact O-N 2.83Å; L727-V731 HydrophobicContact CD1-CG2 3.85Å; L727-V731 HydrophobicContact CG-CG2 4.23Å; L727-V731 WeakPolarHBondContact O-CB 3.25Å; L727-V731 VanDerWaalsContact O-CG2 3.26Å; L727-V731 WeakPolarHBondContact O-CG2 3.22Å; L727-V731 PolarHBondContact O-N 3.42Å; L727-L1071 HydrophobicContact CD1-CD2 4.23Å; L727-L1071 HydrophobicContact CD2-CD2 4.19Å; L727-L1071 HydrophobicContact CG-CD2 4.31Å; L727-H1072 HydrophobicContact CD2-CB 3.94Å; L727-L1075 HydrophobicContact CD1-CD1 4.2Å; L727-L1167 HydrophobicContact CD1-CD1 3.67Å; L727-I1170 HydrophobicContact CB-CG2 3.77Å; L727-I1170 HydrophobicContact CD1-CG2 4.45Å; L727-L1171 HydrophobicContact CD1-CD2 4.14Å; L727-L1171 HydrophobicContact CD2-CD2 4.43Å; L727-I1174 HydrophobicContact CB-CD1 3.96Å; L727-I1174 HydrophobicContact CD2-CD1 3.99Å
728	R	92.8	Very high	89.2	Confident	31 Å²	31	39.6 Å²	39.6	12%	0.117	21%	0.212	C	C	.	.	H	α-helix	trans	-48.8	-50.2	174.7	-174.6	-166.2	-164.7	-82.9	-10.3	112.1	Y724 L732 L762 N766 E1064 L1068	Y724-R728 WeakPolarHBondContact O-CB 3.48Å; Y724-R728 PolarHBondContact O-N 3.06Å; R728-L732 HydrophobicContact CG-CD1 3.97Å; R728-L732 WeakPolarHBondContact O-CB 3.49Å; R728-L732 WeakPolarHBondContact O-CD1 3.48Å; R728-L732 VanDerWaalsContact O-CG 3.29Å; R728-L732 WeakPolarHBondContact O-CG 3.25Å; R728-L732 PolarHBondContact O-N 3.3Å; R728-L762 HydrophobicContact CG-CD1 4.33Å; R728-N766 PolarHBondContact NH2-OD1 3.21Å; R728-E1064 IonicContact CZ-OE1 3.4Å; R728-E1064 IonicContact NE-OE1 3.27Å; R728-E1064 PolarHBondContact NE-OE1 3.41Å; R728-E1064 IonicContact NH2-OE1 3.24Å; R728-E1064 PolarHBondContact NH2-OE1 3.41Å; R728-E1064 IonicContact NH2-OE2 2.71Å; R728-L1068 HydrophobicContact CB-CD1 4.01Å; R728-L1068 HydrophobicContact CB-CD2 3.9Å; R728-L1068 HydrophobicContact CG-CD1 4.12Å; R728-L1068 HydrophobicContact CG-CD2 4.34Å
729	T	91.1	Very high	89.3	Confident	52 Å²	52	39.6 Å²	39.6	32%	0.319	21%	0.212	S	C	.	.	H	α-helix	trans	-68.3	-42.2	-177.5	-55.6	0	0	0	0	111.8	W725 P726 L727 N733	W725-T729 WeakPolarHBondContact O-CB 3.43Å; W725-T729 PolarHBondContact O-N 3.29Å; W725-T729 PolarHBondContact O-OG1 3.45Å; P726-T729 PolarHBondContact O-N 3.39Å; L727-T729 VanDerWaalsContact C-N 3.31Å; L727-T729 PolarHBondContact O-N 3.37Å; T729-N733 WeakPolarHBondContact O-CB 3.38Å; T729-N733 PolarHBondContact O-N 3.43Å; T729-N733 PolarHBondContact O-ND2 3.07Å
730	L	91.4	Very high	89.3	Confident	13 Å²	13	42.4 Å²	42.4	7%	0.068	23%	0.227	C	C	.	.	H	α-helix	trans	-65.1	-45.9	177.1	177.2	152.7	0	0	0	112.1	P726 L727 N733 N734 L1164 T1166 L1167 I1170	P726-L730 WeakPolarHBondContact O-CB 3.44Å; P726-L730 PolarHBondContact O-N 2.93Å; L727-L730 PolarHBondContact O-N 2.83Å; L730-N733 PolarHBondContact O-N 3.22Å; L730-N734 WeakPolarHBondContact O-CB 3.34Å; L730-N734 PolarHBondContact O-N 3.45Å; L730-L1164 HydrophobicContact CD2-CD2 3.65Å; L730-L1164 HydrophobicContact CG-CD2 4.26Å; L730-T1166 VanDerWaalsContact CD1-OG1 3.27Å; L730-T1166 WeakPolarHBondContact CD1-OG1 3.41Å; L730-L1167 HydrophobicContact CD1-CB 4.24Å; L730-L1167 HydrophobicContact CD2-CB 4.47Å; L730-L1167 HydrophobicContact CD2-CD1 4.14Å; L730-I1170 HydrophobicContact CD1-CD1 3.9Å
731	V	91.3	Very high	89.4	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-64.3	-46.7	-179.3	172.4	0	0	0	0	110.8	L727 N733 N734 S735 L738 L759 L762 L1071	L727-V731 HydrophobicContact CD1-CG2 3.85Å; L727-V731 HydrophobicContact CG-CG2 4.23Å; L727-V731 WeakPolarHBondContact O-CB 3.25Å; L727-V731 VanDerWaalsContact O-CG2 3.26Å; L727-V731 WeakPolarHBondContact O-CG2 3.22Å; L727-V731 PolarHBondContact O-N 3.42Å; V731-N733 PolarHBondContact O-N 3.26Å; V731-N734 PolarHBondContact O-N 3.43Å; V731-S735 WeakPolarHBondContact O-CA 3.4Å; V731-S735 WeakPolarHBondContact O-CB 3.32Å; V731-S735 PolarHBondContact O-N 3.44Å; V731-L738 HydrophobicContact CB-CD2 4.49Å; V731-L738 HydrophobicContact CG1-CD2 4.05Å; V731-L738 HydrophobicContact CG2-CD2 4.09Å; V731-L759 HydrophobicContact CG1-CD2 3.61Å; V731-L762 HydrophobicContact CB-CD2 4.24Å; V731-L762 HydrophobicContact CG1-CD2 3.67Å; V731-L1071 HydrophobicContact CG1-CD1 4.1Å; V731-L1071 HydrophobicContact CG2-CD2 3.75Å
732	L	91.4	Very high	89.6	Confident	26 Å²	26	39.6 Å²	39.6	14%	0.136	21%	0.211	C	C	.	.	H	α-helix	trans	-64.1	-38.9	179.9	-75.8	165.1	0	0	0	113.2	R728 L762 N766	R728-L732 HydrophobicContact CG-CD1 3.97Å; R728-L732 WeakPolarHBondContact O-CB 3.49Å; R728-L732 WeakPolarHBondContact O-CD1 3.48Å; R728-L732 VanDerWaalsContact O-CG 3.29Å; R728-L732 WeakPolarHBondContact O-CG 3.25Å; R728-L732 PolarHBondContact O-N 3.3Å; L732-L762 HydrophobicContact CD2-CD2 4.31Å; L732-L762 HydrophobicContact CD2-CG 4.03Å; L732-L762 HydrophobicContact CG-CD2 4.19Å; L732-L762 HydrophobicContact CG-CG 4.27Å; L732-N766 WeakPolarHBondContact CD1-ND2 3.39Å; L732-N766 HydrophobicContact CD2-CB 3.98Å
733	N	88.8	Confident	89.7	Confident	123 Å²	123	36.8 Å²	36.8	66%	0.658	19%	0.188	S	C	*	.	H	α-helix	trans	-75.2	-32.2	-178.9	-69.8	-9.9	0	0	0	112.6	T729 L730 V731	T729-N733 WeakPolarHBondContact O-CB 3.38Å; T729-N733 PolarHBondContact O-N 3.43Å; T729-N733 PolarHBondContact O-ND2 3.07Å; L730-N733 PolarHBondContact O-N 3.22Å; V731-N733 PolarHBondContact O-N 3.26Å
734	N	91.3	Very high	89.5	Confident	40 Å²	40	37.8 Å²	37.8	21%	0.214	20%	0.2	C	C	.	.	H	α-helix	trans	-115.1	18.1	-173.3	-63.6	-31.1	0	0	0	113.2	L730 V731 L736 L737 L738 E1163 L1164	L730-N734 WeakPolarHBondContact O-CB 3.34Å; L730-N734 PolarHBondContact O-N 3.45Å; V731-N734 PolarHBondContact O-N 3.43Å; N734-L736 VanDerWaalsContact C-N 3.34Å; N734-L736 PolarHBondContact O-N 3.02Å; N734-L737 WeakPolarHBondContact O-CB 3.48Å; N734-L737 PolarHBondContact O-N 3.26Å; N734-L738 WeakPolarHBondContact O-CB 3.46Å; N734-L738 PolarHBondContact O-N 2.97Å; N734-E1163 PolarHBondContact ND2-O 2.9Å; N734-E1163 VanDerWaalsContact ND2-O 3.1Å; N734-L1164 HydrophobicContact CB-CD2 3.78Å
735	S	87.7	Confident	88.9	Confident	11 Å²	11	40.1 Å²	40.1	8%	0.077	21%	0.212	C	C	.	.	H	α-helix	trans	-58.9	-40.7	-167.4	59.4	0	0	0	0	113.6	V731 L737 L738 T739 H763 F772	V731-S735 WeakPolarHBondContact O-CA 3.4Å; V731-S735 WeakPolarHBondContact O-CB 3.32Å; V731-S735 PolarHBondContact O-N 3.44Å; S735-L737 PolarHBondContact O-N 3.16Å; S735-L738 PolarHBondContact O-N 2.99Å; S735-T739 WeakPolarHBondContact O-CG2 3.44Å; S735-T739 PolarHBondContact O-N 3.41Å; S735-H763 WeakPolarHBondContact CB-NE2 3.48Å; S735-H763 PolarHBondContact OG-CE1 3.21Å; S735-H763 PolarHBondContact OG-NE2 2.96Å; S735-F772 WeakPolarHBondContact OG-CD2 3.43Å; S735-F772 WeakPolarHBondContact OG-CE2 3.38Å
736	L	89.7	Confident	88	Confident	62 Å²	62	41.2 Å²	41.2	33%	0.325	23%	0.227	S	C	.	.	H	α-helix	trans	-60.2	-48.2	175.4	-161.7	78.2	0	0	0	111.3	N734 L738 T739 N740 L776	N734-L736 VanDerWaalsContact C-N 3.34Å; N734-L736 PolarHBondContact O-N 3.02Å; L736-L738 PolarHBondContact O-N 3.15Å; L736-T739 PolarHBondContact O-N 2.76Å; L736-T739 PolarHBondContact O-OG1 3.42Å; L736-N740 PolarHBondContact O-N 3.25Å; L736-N740 PolarHBondContact O-OD1 2.93Å; L736-L776 HydrophobicContact CD1-CB 4.34Å; L736-L776 HydrophobicContact CD1-CD1 4.04Å
737	L	88.8	Confident	87.1	Confident	51 Å²	51	39.1 Å²	39.1	27%	0.267	21%	0.213	S	C	.	.	H	α-helix	trans	-63.4	-40.8	178.3	-178.7	64.2	0	0	0	112.1	N734 S735 T739 N740 W741 P1161 E1163 L1164	N734-L737 WeakPolarHBondContact O-CB 3.48Å; N734-L737 PolarHBondContact O-N 3.26Å; S735-L737 PolarHBondContact O-N 3.16Å; L737-T739 VanDerWaalsContact C-N 3.35Å; L737-N740 PolarHBondContact O-N 3Å; L737-W741 PolarHBondContact O-N 3.04Å; L737-P1161 HydrophobicContact CD1-CB 4Å; L737-P1161 HydrophobicContact CD1-CG 3.88Å; L737-P1161 HydrophobicContact CD2-CB 3.79Å; L737-P1161 HydrophobicContact CD2-CG 4.37Å; L737-P1161 HydrophobicContact CG-CB 4Å; L737-P1161 HydrophobicContact CG-CG 4.02Å; L737-E1163 HydrophobicContact CD2-CB 3.71Å; L737-E1163 HydrophobicContact CD2-CG 4.09Å; L737-L1164 HydrophobicContact CD2-CG 4.4Å; L737-L1164 HydrophobicContact CG-CD1 4.39Å
738	L	89.6	Confident	86.6	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-60.7	-43	173.7	-175.1	70.7	0	0	0	110.9	V731 N734 S735 L736 W741 L742 L1075 L1164 L1167	V731-L738 HydrophobicContact CB-CD2 4.49Å; V731-L738 HydrophobicContact CG1-CD2 4.05Å; V731-L738 HydrophobicContact CG2-CD2 4.09Å; N734-L738 WeakPolarHBondContact O-CB 3.46Å; N734-L738 PolarHBondContact O-N 2.97Å; S735-L738 PolarHBondContact O-N 2.99Å; L736-L738 PolarHBondContact O-N 3.15Å; L738-W741 HydrophobicContact CD1-CE3 3.96Å; L738-W741 HydrophobicContact CD1-CZ3 4.02Å; L738-L742 HydrophobicContact CD1-CD1 4Å; L738-L742 HydrophobicContact CD1-CG 4.42Å; L738-L742 HydrophobicContact CD2-CD1 4.49Å; L738-L742 HydrophobicContact CG-CD1 3.8Å; L738-L742 WeakPolarHBondContact O-CB 3.32Å; L738-L742 VanDerWaalsContact O-CG 3.28Å; L738-L742 WeakPolarHBondContact O-CG 3.43Å; L738-L742 PolarHBondContact O-N 3.06Å; L738-L1075 HydrophobicContact CD1-CD2 4.35Å; L738-L1164 HydrophobicContact CB-CD1 4.42Å; L738-L1164 HydrophobicContact CD1-CD1 4.01Å; L738-L1164 HydrophobicContact CD1-CD2 4.47Å; L738-L1167 HydrophobicContact CD1-CD2 4.31Å
739	T	90.4	Very high	86.1	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64.6	-40.9	174.1	65.4	0	0	0	0	112.4	S735 L736 L737 W741 L742 E743 L759 F772 L776 R779 I796	S735-T739 WeakPolarHBondContact O-CG2 3.44Å; S735-T739 PolarHBondContact O-N 3.41Å; L736-T739 PolarHBondContact O-N 2.76Å; L736-T739 PolarHBondContact O-OG1 3.42Å; L737-T739 VanDerWaalsContact C-N 3.35Å; T739-W741 PolarHBondContact O-N 3.42Å; T739-L742 PolarHBondContact O-N 3.42Å; T739-E743 WeakPolarHBondContact O-CB 3.37Å; T739-E743 PolarHBondContact O-N 3.34Å; T739-L759 HydrophobicContact CG2-CD1 3.77Å; T739-F772 HydrophobicContact CG2-CE2 4.46Å; T739-F772 HydrophobicContact CG2-CZ 4.26Å; T739-L776 HydrophobicContact CG2-CD1 3.96Å; T739-L776 VanDerWaalsContact OG1-CD1 3.31Å; T739-L776 WeakPolarHBondContact OG1-CD1 3.1Å; T739-R779 PolarHBondContact OG1-NH2 2.88Å; T739-R779 VanDerWaalsContact OG1-NH2 3.07Å; T739-I796 HydrophobicContact CG2-CD1 4.46Å; T739-I796 HydrophobicContact CG2-CG2 3.83Å
740	N	87.6	Confident	85.5	Confident	64 Å²	64	45.2 Å²	45.2	34%	0.342	25%	0.248	S	C	.	.	H	α-helix	trans	-59.7	-47.1	178.9	-65.4	7.8	0	0	0	111.6	L736 L737 E743 S744 R779	L736-N740 PolarHBondContact O-N 3.25Å; L736-N740 PolarHBondContact O-OD1 2.93Å; L737-N740 PolarHBondContact O-N 3Å; N740-E743 PolarHBondContact O-N 3.48Å; N740-S744 PolarHBondContact O-N 3.36Å; N740-S744 VanDerWaalsContact O-N 3.12Å; N740-R779 WeakPolarHBondContact OD1-CD 3.32Å; N740-R779 PolarHBondContact OD1-NE 3.02Å; N740-R779 PolarHBondContact OD1-NH2 3.09Å
741	W	87.7	Confident	85.1	Confident	8 Å²	8	46.9 Å²	46.9	3%	0.03	26%	0.257	C	S	.	.	H	α-helix	trans	-69.4	-42.2	-178.7	170	70.2	0	0	0	112.4	L737 L738 T739 E743 S744 L745 V1078 M1079 V1156 S1159 L1160 P1161 L1164 L1167	L737-W741 PolarHBondContact O-N 3.04Å; L738-W741 HydrophobicContact CD1-CE3 3.96Å; L738-W741 HydrophobicContact CD1-CZ3 4.02Å; T739-W741 PolarHBondContact O-N 3.42Å; W741-E743 VanDerWaalsContact C-N 3.29Å; W741-E743 PolarHBondContact O-N 2.88Å; W741-S744 PolarHBondContact O-N 3.28Å; W741-S744 PolarHBondContact O-OG 3.19Å; W741-L745 HydrophobicContact CD2-CD1 4.15Å; W741-L745 HydrophobicContact CH2-CD1 4.13Å; W741-L745 HydrophobicContact CZ2-CD1 3.6Å; W741-L745 WeakPolarHBondContact O-CG 3.33Å; W741-L745 PolarHBondContact O-N 3.37Å; W741-V1078 HydrophobicContact CH2-CG1 4.39Å; W741-M1079 HydrophobicContact CH2-CG 4.46Å; W741-M1079 HydrophobicContact CH2-SD 3.53Å; W741-M1079 VanDerWaalsContact CH2-SD 3.53Å; W741-M1079 HydrophobicContact CZ2-SD 3.85Å; W741-V1156 HydrophobicContact CH2-CG1 4.27Å; W741-V1156 HydrophobicContact CZ2-CG1 3.61Å; W741-S1159 PolarHBondContact NE1-O 2.88Å; W741-S1159 PolarHBondContact NE1-OG 2.85Å; W741-L1160 HydrophobicContact CD2-CD1 4.16Å; W741-L1160 HydrophobicContact CE3-CD1 4.42Å; W741-L1160 HydrophobicContact CH2-CD1 3.86Å; W741-L1160 HydrophobicContact CZ2-CD1 3.49Å; W741-L1160 VanDerWaalsContact CZ2-CD1 3.49Å; W741-L1160 HydrophobicContact CZ3-CD1 4.3Å; W741-P1161 HydrophobicContact CB-CG 4.06Å; W741-P1161 HydrophobicContact CG-CG 4.25Å; W741-L1164 HydrophobicContact CE3-CD1 4.27Å; W741-L1167 HydrophobicContact CZ3-CD2 4.32Å
742	L	86.5	Confident	85	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-68.3	-28.6	174.2	-70.6	172.5	0	0	0	112.8	L738 T739 L747 L755 I796 L1075 V1078	L738-L742 HydrophobicContact CD1-CD1 4Å; L738-L742 HydrophobicContact CD1-CG 4.42Å; L738-L742 HydrophobicContact CD2-CD1 4.49Å; L738-L742 HydrophobicContact CG-CD1 3.8Å; L738-L742 WeakPolarHBondContact O-CB 3.32Å; L738-L742 VanDerWaalsContact O-CG 3.28Å; L738-L742 WeakPolarHBondContact O-CG 3.43Å; L738-L742 PolarHBondContact O-N 3.06Å; T739-L742 PolarHBondContact O-N 3.42Å; L742-L747 HydrophobicContact CB-CD1 3.79Å; L742-L747 HydrophobicContact CD2-CD1 4.28Å; L742-L747 WeakPolarHBondContact O-CD1 3.39Å; L742-L747 VanDerWaalsContact O-CG 3.32Å; L742-L747 WeakPolarHBondContact O-CG 3.48Å; L742-L755 HydrophobicContact CB-CD2 4.1Å; L742-L755 HydrophobicContact CD1-CD1 3.83Å; L742-L755 HydrophobicContact CD1-CD2 3.5Å; L742-L755 HydrophobicContact CD1-CG 4.32Å; L742-L755 HydrophobicContact CG-CD2 4.41Å; L742-I796 HydrophobicContact CB-CD1 4.29Å; L742-L1075 HydrophobicContact CD1-CD2 3.75Å; L742-L1075 HydrophobicContact CD2-CD2 4.09Å; L742-V1078 HydrophobicContact CD2-CG1 4.16Å
743	E	85.7	Confident	84.8	Confident	32 Å²	32	50.3 Å²	50.3	15%	0.15	27%	0.272	C	S	.	.	H	α-helix	trans	-73	-33.4	176.4	-166.5	119.1	-109.1	0	0	112.3	T739 N740 W741 K752 R779 T795 I796	T739-E743 WeakPolarHBondContact O-CB 3.37Å; T739-E743 PolarHBondContact O-N 3.34Å; N740-E743 PolarHBondContact O-N 3.48Å; W741-E743 VanDerWaalsContact C-N 3.29Å; W741-E743 PolarHBondContact O-N 2.88Å; E743-K752 IonicContact OE1-NZ 3.58Å; E743-K752 PolarHBondContact OE1-NZ 3.14Å; E743-R779 IonicContact OE2-NH1 2.94Å; E743-R779 IonicContact OE2-NH2 3.27Å; E743-R779 PolarHBondContact OE2-NH2 3.14Å; E743-T795 WeakPolarHBondContact OE1-CA 3.32Å; E743-I796 HydrophobicContact CB-CD1 4.08Å; E743-I796 PolarHBondContact OE1-N 3.38Å
744	S	82.3	Confident	84.5	Confident	82 Å²	82	47.2 Å²	47.2	57%	0.573	25%	0.254	S	S	*	.	H	α-helix	trans	-76.3	-24.3	176	68.4	0	0	0	0	113.7	N740 W741 L746	N740-S744 PolarHBondContact O-N 3.36Å; N740-S744 VanDerWaalsContact O-N 3.12Å; W741-S744 PolarHBondContact O-N 3.28Å; W741-S744 PolarHBondContact O-OG 3.19Å; S744-L746 PolarHBondContact O-N 3.35Å
745	L	80.1	Confident	84.5	Confident	49 Å²	49	45.4 Å²	45.4	26%	0.257	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	17.3	175.7	-71.9	176.2	0	0	0	114.9	W741 L747 V1078 V1156	W741-L745 HydrophobicContact CD2-CD1 4.15Å; W741-L745 HydrophobicContact CH2-CD1 4.13Å; W741-L745 HydrophobicContact CZ2-CD1 3.6Å; W741-L745 WeakPolarHBondContact O-CG 3.33Å; W741-L745 PolarHBondContact O-N 3.37Å; L745-L747 PolarHBondContact O-N 3.31Å; L745-L747 VanDerWaalsContact O-N 3.13Å; L745-V1078 HydrophobicContact CD1-CG1 3.91Å; L745-V1156 HydrophobicContact CD1-CG1 4.16Å; L745-V1156 HydrophobicContact CD2-CG2 4.2Å
746	L	68.6	Low	84.7	Confident	156 Å²	156	44.9 Å²	44.9	82%	0.817	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.3	35.1	175.6	-68.1	169.8	0	0	0	114.6	S744 S748	S744-L746 PolarHBondContact O-N 3.35Å; L746-S748 PolarHBondContact O-N 2.82Å
747	L	73.4	Confident	84.6	Confident	21 Å²	21	44.6 Å²	44.6	11%	0.11	24%	0.239	C	C	.	.			trans	-51.3	136.3	177.4	-77	-179.8	0	0	0	112.7	L742 L745 L751 K752 L755 V1078	L742-L747 HydrophobicContact CB-CD1 3.79Å; L742-L747 HydrophobicContact CD2-CD1 4.28Å; L742-L747 WeakPolarHBondContact O-CD1 3.39Å; L742-L747 VanDerWaalsContact O-CG 3.32Å; L742-L747 WeakPolarHBondContact O-CG 3.48Å; L745-L747 PolarHBondContact O-N 3.31Å; L745-L747 VanDerWaalsContact O-N 3.13Å; L747-L751 HydrophobicContact CD2-CB 4.2Å; L747-L751 HydrophobicContact CD2-CD1 4Å; L747-K752 HydrophobicContact CB-CG 3.88Å; L747-L755 HydrophobicContact CD1-CD2 4.22Å; L747-V1078 HydrophobicContact CD2-CG2 3.97Å
748	S	81.4	Confident	84.6	Confident	64 Å²	64	42.4 Å²	42.4	45%	0.448	23%	0.228	S	C	.	.			trans	-57.9	148.4	173.1	76.2	0	0	0	0	111.2	L746 K750 L751 K752	L746-S748 PolarHBondContact O-N 2.82Å; S748-K750 PolarHBondContact O-N 2.7Å; S748-K750 VanDerWaalsContact O-N 3.11Å; S748-L751 PolarHBondContact O-N 3.28Å; S748-L751 PolarHBondContact OG-N 3.18Å; S748-K752 PolarHBondContact O-N 3.44Å
749	V	82.5	Confident	84.8	Confident	61 Å²	61	42.4 Å²	42.4	37%	0.37	23%	0.228	S	C	.	.	H	α-helix	trans	-56.3	-34.6	-176.3	-175.2	0	0	0	0	111.7	K752 E753 N794	V749-K752 PolarHBondContact O-N 2.65Å; V749-E753 WeakPolarHBondContact O-CG 3.48Å; V749-E753 PolarHBondContact O-N 3.2Å; V749-N794 HydrophobicContact CG1-CB 4.37Å; V749-N794 HydrophobicContact CG2-CB 4.16Å
750	K	79.2	Confident	84.8	Confident	85 Å²	85	42.4 Å²	42.4	37%	0.37	23%	0.228	S	C	.	.	H	α-helix	trans	-66.9	-43.4	176	-164.5	-170.6	-176.4	-148.4	0	112.6	S748 K752 E753 E754	S748-K750 PolarHBondContact O-N 2.7Å; S748-K750 VanDerWaalsContact O-N 3.11Å; K750-K752 VanDerWaalsContact C-N 3.32Å; K750-K752 PolarHBondContact O-N 3.16Å; K750-E753 PolarHBondContact O-N 3.44Å; K750-E754 WeakPolarHBondContact CE-OE1 3.45Å; K750-E754 IonicContact NZ-OE1 3.23Å; K750-E754 PolarHBondContact NZ-OE1 2.67Å; K750-E754 WeakPolarHBondContact O-CG 3.31Å; K750-E754 PolarHBondContact O-N 2.79Å
751	L	83.4	Confident	84.7	Confident	49 Å²	49	41.6 Å²	41.6	26%	0.257	22%	0.221	S	C	.	.	H	α-helix	trans	-66.3	-34.9	175.5	-74.1	171.8	0	0	0	111.7	L747 S748 E753 E754 L755	L747-L751 HydrophobicContact CD2-CB 4.2Å; L747-L751 HydrophobicContact CD2-CD1 4Å; S748-L751 PolarHBondContact O-N 3.28Å; S748-L751 PolarHBondContact OG-N 3.18Å; L751-E753 VanDerWaalsContact C-N 3.35Å; L751-E754 PolarHBondContact O-N 2.8Å; L751-L755 WeakPolarHBondContact O-CB 3.49Å; L751-L755 PolarHBondContact O-N 3.43Å
752	K	88.2	Confident	84.8	Confident	25 Å²	25	41.4 Å²	41.4	11%	0.109	22%	0.22	C	C	.	.	H	α-helix	trans	-62.7	-39.3	171.2	-67.6	-167.7	178.1	-162.8	0	112.4	E743 L747 S748 V749 K750 A756 N794 I796	E743-K752 IonicContact OE1-NZ 3.58Å; E743-K752 PolarHBondContact OE1-NZ 3.14Å; L747-K752 HydrophobicContact CB-CG 3.88Å; S748-K752 PolarHBondContact O-N 3.44Å; V749-K752 PolarHBondContact O-N 2.65Å; K750-K752 VanDerWaalsContact C-N 3.32Å; K750-K752 PolarHBondContact O-N 3.16Å; K752-A756 WeakPolarHBondContact O-CB 3.32Å; K752-A756 PolarHBondContact O-N 2.68Å; K752-N794 WeakPolarHBondContact CD-O 3.39Å; K752-N794 PolarHBondContact NZ-O 3.4Å; K752-I796 HydrophobicContact CB-CG1 4.23Å; K752-I796 HydrophobicContact CD-CG1 4.13Å; K752-I796 HydrophobicContact CG-CG1 4.06Å
753	E	87.2	Confident	85	Confident	73 Å²	73	41.6 Å²	41.6	34%	0.341	22%	0.221	S	C	.	.	H	α-helix	trans	-67.6	-48	174.6	-74.6	-179.6	166.1	0	0	112.2	V749 K750 L751 L755 A756 N757 K799	V749-E753 WeakPolarHBondContact O-CG 3.48Å; V749-E753 PolarHBondContact O-N 3.2Å; K750-E753 PolarHBondContact O-N 3.44Å; L751-E753 VanDerWaalsContact C-N 3.35Å; E753-L755 PolarHBondContact O-N 3.46Å; E753-A756 PolarHBondContact O-N 3.33Å; E753-N757 PolarHBondContact O-N 3.3Å; E753-N757 PolarHBondContact O-ND2 3.33Å; E753-N757 PolarHBondContact O-OD1 2.82Å; E753-K799 HydrophobicContact CG-CB 4.26Å; E753-K799 HydrophobicContact CG-CD 3.72Å; E753-K799 HydrophobicContact CG-CG 3.79Å; E753-K799 WeakPolarHBondContact OE1-CE 3.34Å; E753-K799 IonicContact OE1-NZ 3.84Å; E753-K799 PolarHBondContact OE1-NZ 2.92Å
754	E	83.5	Confident	85.1	Confident	58 Å²	58	41.4 Å²	41.4	27%	0.271	22%	0.22	S	C	.	.	H	α-helix	trans	-60.6	-45.6	178.4	-70.9	174.1	179.4	0	0	111.2	K750 L751 N757 S758 I1074	K750-E754 WeakPolarHBondContact CE-OE1 3.45Å; K750-E754 IonicContact NZ-OE1 3.23Å; K750-E754 PolarHBondContact NZ-OE1 2.67Å; K750-E754 WeakPolarHBondContact O-CG 3.31Å; K750-E754 PolarHBondContact O-N 2.79Å; L751-E754 PolarHBondContact O-N 2.8Å; E754-N757 PolarHBondContact O-N 3.19Å; E754-S758 PolarHBondContact O-N 3.07Å; E754-I1074 HydrophobicContact CB-CD1 4.1Å
755	L	90.3	Very high	85.1	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-61	-46.5	173.1	176.2	70.4	0	0	0	112.8	L742 L747 L751 E753 N757 S758 L759 I796	L742-L755 HydrophobicContact CB-CD2 4.1Å; L742-L755 HydrophobicContact CD1-CD1 3.83Å; L742-L755 HydrophobicContact CD1-CD2 3.5Å; L742-L755 HydrophobicContact CD1-CG 4.32Å; L742-L755 HydrophobicContact CG-CD2 4.41Å; L747-L755 HydrophobicContact CD1-CD2 4.22Å; L751-L755 WeakPolarHBondContact O-CB 3.49Å; L751-L755 PolarHBondContact O-N 3.43Å; E753-L755 PolarHBondContact O-N 3.46Å; L755-N757 VanDerWaalsContact C-N 3.29Å; L755-N757 PolarHBondContact O-N 3.39Å; L755-S758 PolarHBondContact O-N 2.69Å; L755-L759 HydrophobicContact CD1-CD1 4.04Å; L755-L759 HydrophobicContact CD1-CG 4.25Å; L755-L759 HydrophobicContact CG-CD1 3.94Å; L755-L759 HydrophobicContact CG-CG 4.47Å; L755-L759 WeakPolarHBondContact O-CB 3.35Å; L755-L759 WeakPolarHBondContact O-CG 3.48Å; L755-L759 PolarHBondContact O-N 3.05Å; L755-I796 HydrophobicContact CD2-CD1 3.75Å; L755-I796 HydrophobicContact CD2-CG1 4.35Å
756	A	91.8	Very high	85.4	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62.2	-37.9	-179.1	0	0	0	0	0	111.8	K752 E753 V760 I796 K799 A800	K752-A756 WeakPolarHBondContact O-CB 3.32Å; K752-A756 PolarHBondContact O-N 2.68Å; E753-A756 PolarHBondContact O-N 3.33Å; A756-V760 WeakPolarHBondContact O-CB 3.48Å; A756-V760 WeakPolarHBondContact O-CG2 3.29Å; A756-V760 PolarHBondContact O-N 2.84Å; A756-I796 HydrophobicContact CB-CG2 4.35Å; A756-K799 HydrophobicContact CB-CB 3.92Å; A756-A800 HydrophobicContact CB-CB 4.15Å
757	N	88.3	Confident	86.2	Confident	56 Å²	56	37.8 Å²	37.8	30%	0.299	20%	0.196	S	C	.	.	H	α-helix	trans	-60.7	-54.8	175.4	-64.3	-23.7	0	0	0	111.3	E753 E754 L755 L759 V760 Y761 C803	E753-N757 PolarHBondContact O-N 3.3Å; E753-N757 PolarHBondContact O-ND2 3.33Å; E753-N757 PolarHBondContact O-OD1 2.82Å; E754-N757 PolarHBondContact O-N 3.19Å; L755-N757 VanDerWaalsContact C-N 3.29Å; L755-N757 PolarHBondContact O-N 3.39Å; N757-L759 VanDerWaalsContact C-N 3.33Å; N757-L759 PolarHBondContact O-N 2.92Å; N757-V760 PolarHBondContact O-N 2.95Å; N757-Y761 HydrophobicContact CB-CE2 4.24Å; N757-Y761 WeakPolarHBondContact O-CD2 3.06Å; N757-Y761 PolarHBondContact O-N 3.49Å; N757-C803 WeakPolarHBondContact OD1-CB 3.32Å; N757-C803 PolarHBondContact OD1-SG 3.18Å
758	S	89.2	Confident	87.1	Confident	6 Å²	6	39 Å²	39	4%	0.042	20%	0.204	C	C	.	.	H	α-helix	trans	-64.1	-35.8	-178.4	-61.3	0	0	0	0	112.8	E754 L755 L762 E1067	E754-S758 PolarHBondContact O-N 3.07Å; L755-S758 PolarHBondContact O-N 2.69Å; S758-L762 VanDerWaalsContact O-CB 3.28Å; S758-L762 WeakPolarHBondContact O-CB 3.19Å; S758-L762 PolarHBondContact O-N 3.22Å; S758-E1067 WeakPolarHBondContact CA-OE2 3.25Å; S758-E1067 WeakPolarHBondContact CB-OE2 3.44Å; S758-E1067 PolarHBondContact OG-OE2 2.86Å
759	L	92.3	Very high	87.7	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-65.9	-41.1	173.3	-71.9	175.8	0	0	0	112.4	V731 T739 L755 N757 H763 F772 L1071	V731-L759 HydrophobicContact CG1-CD2 3.61Å; T739-L759 HydrophobicContact CG2-CD1 3.77Å; L755-L759 HydrophobicContact CD1-CD1 4.04Å; L755-L759 HydrophobicContact CD1-CG 4.25Å; L755-L759 HydrophobicContact CG-CD1 3.94Å; L755-L759 HydrophobicContact CG-CG 4.47Å; L755-L759 WeakPolarHBondContact O-CB 3.35Å; L755-L759 WeakPolarHBondContact O-CG 3.48Å; L755-L759 PolarHBondContact O-N 3.05Å; N757-L759 VanDerWaalsContact C-N 3.33Å; N757-L759 PolarHBondContact O-N 2.92Å; L759-H763 WeakPolarHBondContact O-CB 3.1Å; L759-H763 PolarHBondContact O-CD2 2.74Å; L759-H763 PolarHBondContact O-N 3.4Å; L759-F772 HydrophobicContact CB-CE1 4.35Å; L759-F772 HydrophobicContact CB-CZ 4.34Å; L759-F772 HydrophobicContact CD1-CZ 4.32Å; L759-L1071 HydrophobicContact CD2-CD1 4.1Å
760	V	92	Very high	88.2	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-61.6	-47.3	175.7	164	0	0	0	0	110.9	A756 N757 H763 E764 L769 L773 A800 Y804	A756-V760 WeakPolarHBondContact O-CB 3.48Å; A756-V760 WeakPolarHBondContact O-CG2 3.29Å; A756-V760 PolarHBondContact O-N 2.84Å; N757-V760 PolarHBondContact O-N 2.95Å; V760-H763 PolarHBondContact O-N 2.71Å; V760-E764 WeakPolarHBondContact O-CB 3.37Å; V760-E764 PolarHBondContact O-N 2.92Å; V760-L769 HydrophobicContact CB-CD1 4.32Å; V760-L769 HydrophobicContact CG1-CD1 4.31Å; V760-L769 HydrophobicContact CG1-CD2 4.04Å; V760-L769 HydrophobicContact CG2-CD1 4.25Å; V760-L773 HydrophobicContact CG2-CD2 4.41Å; V760-A800 HydrophobicContact CG2-CB 3.82Å; V760-A800 WeakPolarHBondContact CG2-O 3.44Å; V760-Y804 HydrophobicContact CG1-CD2 3.79Å; V760-Y804 HydrophobicContact CG1-CG 4.29Å
761	Y	85.7	Confident	88.9	Confident	47 Å²	47	36 Å²	36	18%	0.184	18%	0.18	C	C	.	.	H	α-helix	trans	-66.8	-39.9	179.7	-65	-50.2	0	0	0	112.9	N757 E764 N765 F807 I1062	N757-Y761 HydrophobicContact CB-CE2 4.24Å; N757-Y761 WeakPolarHBondContact O-CD2 3.06Å; N757-Y761 PolarHBondContact O-N 3.49Å; Y761-E764 PolarHBondContact O-N 3.33Å; Y761-N765 WeakPolarHBondContact O-CB 3.5Å; Y761-N765 PolarHBondContact O-N 3.46Å; Y761-F807 AromaticContact CE1-CD2 3.91Å; Y761-F807 HydrophobicContact CE1-CD2 3.91Å; Y761-F807 AromaticContact CE1-CE2 3.93Å; Y761-F807 HydrophobicContact CE1-CE2 3.93Å; Y761-F807 HydrophobicContact CE1-CG 4.31Å; Y761-F807 HydrophobicContact CE1-CZ 4.35Å; Y761-I1062 HydrophobicContact CD1-CD1 3.74Å; Y761-I1062 HydrophobicContact CD2-CD1 3.69Å; Y761-I1062 HydrophobicContact CE1-CD1 3.58Å; Y761-I1062 HydrophobicContact CE2-CD1 3.52Å; Y761-I1062 HydrophobicContact CG-CD1 3.8Å; Y761-I1062 VanDerWaalsContact CZ-CD1 3.47Å
762	L	89.2	Confident	89.4	Confident	3 Å²	3	34.1 Å²	34.1	2%	0.016	17%	0.171	C	C	.	.	H	α-helix	trans	-62.6	-45	176.1	-173.3	65.7	0	0	0	111.8	R728 V731 L732 S758 N766 E1064 L1068	R728-L762 HydrophobicContact CG-CD1 4.33Å; V731-L762 HydrophobicContact CB-CD2 4.24Å; V731-L762 HydrophobicContact CG1-CD2 3.67Å; L732-L762 HydrophobicContact CD2-CD2 4.31Å; L732-L762 HydrophobicContact CD2-CG 4.03Å; L732-L762 HydrophobicContact CG-CD2 4.19Å; L732-L762 HydrophobicContact CG-CG 4.27Å; S758-L762 VanDerWaalsContact O-CB 3.28Å; S758-L762 WeakPolarHBondContact O-CB 3.19Å; S758-L762 PolarHBondContact O-N 3.22Å; L762-N766 WeakPolarHBondContact O-CB 3.48Å; L762-N766 PolarHBondContact O-N 3.49Å; L762-N766 VanDerWaalsContact O-N 3.16Å; L762-N766 PolarHBondContact O-OD1 3.22Å; L762-E1064 HydrophobicContact CD1-CG 4.47Å; L762-L1068 HydrophobicContact CD1-CD2 4.04Å; L762-L1068 HydrophobicContact CD1-CG 4.38Å; L762-L1068 HydrophobicContact CD2-CD2 4.37Å
763	H	91.5	Very high	89.8	Confident	5 Å²	5	33 Å²	33	2%	0.023	17%	0.165	C	C	.	.	H	α-helix	trans	-72.4	-32.2	178.4	-84	-72.7	0	0	0	113.6	S735 L759 V760 N766 N767 T768 L769 F772	S735-H763 WeakPolarHBondContact CB-NE2 3.48Å; S735-H763 PolarHBondContact OG-CE1 3.21Å; S735-H763 PolarHBondContact OG-NE2 2.96Å; L759-H763 WeakPolarHBondContact O-CB 3.1Å; L759-H763 PolarHBondContact O-CD2 2.74Å; L759-H763 PolarHBondContact O-N 3.4Å; V760-H763 PolarHBondContact O-N 2.71Å; H763-N766 CarbonylContact O-C 3.44Å; H763-N766 PolarHBondContact O-N 3.24Å; H763-N767 PolarHBondContact O-N 3.2Å; H763-N767 VanDerWaalsContact O-N 3.15Å; H763-T768 PolarHBondContact ND1-OG1 2.66Å; H763-T768 PolarHBondContact O-N 3.12Å; H763-L769 HydrophobicContact CB-CB 4.01Å; H763-L769 HydrophobicContact CB-CD1 3.65Å; H763-L769 HydrophobicContact CB-CG 4.45Å; H763-L769 PolarHBondContact O-N 2.69Å; H763-F772 HydrophobicContact CB-CD1 4.43Å; H763-F772 AromaticContact CD2-CD1 3.65Å; H763-F772 AromaticContact CD2-CD2 3.96Å; H763-F772 AromaticContact CD2-CE1 4Å; H763-F772 AromaticContact CD2-CG 3.61Å; H763-F772 AromaticContact CG-CG 3.98Å; H763-F772 AromaticContact NE2-CD2 3.62Å; H763-F772 AromaticContact NE2-CG 3.7Å
764	E	87.5	Confident	90.1	Very high	28 Å²	28	30 Å²	30	13%	0.131	15%	0.153	C	C	.	.	H	α-helix	trans	-64.5	-48.3	172.5	-177.5	66.9	-166.3	0	0	110.4	V760 Y761 N766 N767 L769 Y804 K1059	V760-E764 WeakPolarHBondContact O-CB 3.37Å; V760-E764 PolarHBondContact O-N 2.92Å; Y761-E764 PolarHBondContact O-N 3.33Å; E764-N766 PolarHBondContact O-N 3.43Å; E764-N766 VanDerWaalsContact O-N 3.13Å; E764-N767 PolarHBondContact O-N 3.39Å; E764-L769 HydrophobicContact CB-CD2 4.11Å; E764-L769 WeakPolarHBondContact OE2-CD2 3.45Å; E764-Y804 VanDerWaalsContact OE2-CE2 3.31Å; E764-Y804 WeakPolarHBondContact OE2-CE2 3.36Å; E764-Y804 PolarHBondContact OE2-OH 3.42Å; E764-K1059 WeakPolarHBondContact O-CE 3.43Å
765	N	81.6	Confident	90.6	Very high	40 Å²	40	30.2 Å²	30.2	21%	0.214	16%	0.16	C	C	.	.	H	α-helix	trans	-55.7	-31	173.8	-76.4	-16.3	0	0	0	112	Y761 K1059	Y761-N765 WeakPolarHBondContact O-CB 3.5Å; Y761-N765 PolarHBondContact O-N 3.46Å; N765-K1059 WeakPolarHBondContact O-CE 3.47Å; N765-K1059 PolarHBondContact O-NZ 3.03Å
766	N	85.8	Confident	90.8	Very high	47 Å²	47	30.1 Å²	30.1	25%	0.251	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	0	177.5	-91	65.8	0	0	0	116.5	R728 L732 L762 H763 E764 T768	R728-N766 PolarHBondContact NH2-OD1 3.21Å; L732-N766 WeakPolarHBondContact CD1-ND2 3.39Å; L732-N766 HydrophobicContact CD2-CB 3.98Å; L762-N766 WeakPolarHBondContact O-CB 3.48Å; L762-N766 PolarHBondContact O-N 3.49Å; L762-N766 VanDerWaalsContact O-N 3.16Å; L762-N766 PolarHBondContact O-OD1 3.22Å; H763-N766 CarbonylContact O-C 3.44Å; H763-N766 PolarHBondContact O-N 3.24Å; E764-N766 PolarHBondContact O-N 3.43Å; E764-N766 VanDerWaalsContact O-N 3.13Å; N766-T768 PolarHBondContact O-N 3.22Å
767	N	87.2	Confident	90.8	Very high	125 Å²	125	30.2 Å²	30.2	67%	0.668	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.6	-1.5	-169	-71.4	-15.2	0	0	0	115.9	H763 E764 L769 K1059	H763-N767 PolarHBondContact O-N 3.2Å; H763-N767 VanDerWaalsContact O-N 3.15Å; E764-N767 PolarHBondContact O-N 3.39Å; N767-L769 PolarHBondContact O-N 3.35Å; N767-K1059 VanDerWaalsContact CG-NZ 3.28Å; N767-K1059 VanDerWaalsContact OD1-CE 3.28Å; N767-K1059 WeakPolarHBondContact OD1-CE 3.37Å; N767-K1059 PolarHBondContact OD1-NZ 2.91Å
768	T	91.7	Very high	91	Very high	45 Å²	45	29.2 Å²	29.2	28%	0.276	16%	0.156	S	C	.	.			trans	-91.9	7.9	-173.4	50.6	0	0	0	0	114.1	H763 N766 I770 E771 F772	H763-T768 PolarHBondContact ND1-OG1 2.66Å; H763-T768 PolarHBondContact O-N 3.12Å; N766-T768 PolarHBondContact O-N 3.22Å; T768-I770 PolarHBondContact O-N 3.11Å; T768-E771 PolarHBondContact O-N 3.09Å; T768-F772 WeakPolarHBondContact O-CB 3.16Å; T768-F772 PolarHBondContact O-N 3.23Å
769	L	92.8	Very high	91	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.01	16%	0.16	C	C	.	.	H	α-helix	trans	-64.6	-40.5	-171.9	-173.2	67.1	0	0	0	114.9	V760 H763 E764 N767 E771 F772 L773 Y804	V760-L769 HydrophobicContact CB-CD1 4.32Å; V760-L769 HydrophobicContact CG1-CD1 4.31Å; V760-L769 HydrophobicContact CG1-CD2 4.04Å; V760-L769 HydrophobicContact CG2-CD1 4.25Å; H763-L769 HydrophobicContact CB-CB 4.01Å; H763-L769 HydrophobicContact CB-CD1 3.65Å; H763-L769 HydrophobicContact CB-CG 4.45Å; H763-L769 PolarHBondContact O-N 2.69Å; E764-L769 HydrophobicContact CB-CD2 4.11Å; E764-L769 WeakPolarHBondContact OE2-CD2 3.45Å; N767-L769 PolarHBondContact O-N 3.35Å; L769-E771 VanDerWaalsContact C-N 3.32Å; L769-E771 PolarHBondContact O-N 3.17Å; L769-F772 HydrophobicContact CD1-CD1 4.03Å; L769-F772 PolarHBondContact O-N 3.04Å; L769-L773 HydrophobicContact CD1-CD1 3.98Å; L769-L773 HydrophobicContact CD1-CD2 4.3Å; L769-L773 HydrophobicContact CD1-CG 3.79Å; L769-L773 HydrophobicContact CD2-CD1 4.14Å; L769-L773 HydrophobicContact CG-CD1 3.78Å; L769-L773 HydrophobicContact CG-CG 3.99Å; L769-L773 WeakPolarHBondContact O-CB 3.13Å; L769-L773 WeakPolarHBondContact O-CG 3.46Å; L769-L773 PolarHBondContact O-N 3.16Å; L769-Y804 HydrophobicContact CD2-CD1 4.02Å; L769-Y804 HydrophobicContact CD2-CD2 3.33Å; L769-Y804 HydrophobicContact CD2-CE1 3.86Å; L769-Y804 HydrophobicContact CD2-CE2 3.13Å; L769-Y804 HydrophobicContact CD2-CG 3.73Å
770	I	93.9	Very high	90.9	Very high	29 Å²	29	31 Å²	31	15%	0.149	16%	0.162	C	C	.	.	H	α-helix	trans	-65.4	-40	-178.9	-63.3	179	0	0	0	110.3	T768 T774 V903 R906 L907	T768-I770 PolarHBondContact O-N 3.11Å; I770-T774 WeakPolarHBondContact O-CB 3.24Å; I770-T774 PolarHBondContact O-N 3.23Å; I770-T774 PolarHBondContact O-OG1 2.89Å; I770-V903 HydrophobicContact CD1-CG1 4.38Å; I770-R906 HydrophobicContact CD1-CB 3.82Å; I770-L907 HydrophobicContact CB-CD1 4.48Å; I770-L907 HydrophobicContact CG1-CD1 4.3Å; I770-L907 HydrophobicContact CG2-CD1 4.24Å
771	E	92.9	Very high	90.8	Very high	116 Å²	116	31.1 Å²	31.1	54%	0.542	16%	0.163	S	C	.	.	H	α-helix	trans	-65.6	-45.2	175.4	-61.3	174.6	172.2	0	0	111.5	T768 L769 S775	T768-E771 PolarHBondContact O-N 3.09Å; L769-E771 VanDerWaalsContact C-N 3.32Å; L769-E771 PolarHBondContact O-N 3.17Å; E771-S775 VanDerWaalsContact O-CB 3.31Å; E771-S775 WeakPolarHBondContact O-CB 3.17Å; E771-S775 PolarHBondContact O-N 2.86Å; E771-S775 PolarHBondContact O-OG 3.25Å
772	F	95	Very high	90.8	Very high	11 Å²	11	32.3 Å²	32.3	5%	0.048	18%	0.178	C	C	.	.	H	α-helix	trans	-60.1	-55.7	175.7	170	-111.7	0	0	0	111.8	S735 T739 L759 H763 T768 L769 T774 S775 L776	S735-F772 WeakPolarHBondContact OG-CD2 3.43Å; S735-F772 WeakPolarHBondContact OG-CE2 3.38Å; T739-F772 HydrophobicContact CG2-CE2 4.46Å; T739-F772 HydrophobicContact CG2-CZ 4.26Å; L759-F772 HydrophobicContact CB-CE1 4.35Å; L759-F772 HydrophobicContact CB-CZ 4.34Å; L759-F772 HydrophobicContact CD1-CZ 4.32Å; H763-F772 HydrophobicContact CB-CD1 4.43Å; H763-F772 AromaticContact CD2-CD1 3.65Å; H763-F772 AromaticContact CD2-CD2 3.96Å; H763-F772 AromaticContact CD2-CE1 4Å; H763-F772 AromaticContact CD2-CG 3.61Å; H763-F772 AromaticContact CG-CG 3.98Å; H763-F772 AromaticContact NE2-CD2 3.62Å; H763-F772 AromaticContact NE2-CG 3.7Å; T768-F772 WeakPolarHBondContact O-CB 3.16Å; T768-F772 PolarHBondContact O-N 3.23Å; L769-F772 HydrophobicContact CD1-CD1 4.03Å; L769-F772 PolarHBondContact O-N 3.04Å; F772-T774 VanDerWaalsContact C-N 3.33Å; F772-T774 PolarHBondContact O-N 3.46Å; F772-S775 PolarHBondContact O-N 3.39Å; F772-L776 HydrophobicContact CE1-CD2 3.93Å; F772-L776 HydrophobicContact CE2-CD1 4.36Å; F772-L776 HydrophobicContact CE2-CD2 4.4Å; F772-L776 HydrophobicContact CZ-CD1 4.37Å; F772-L776 HydrophobicContact CZ-CD2 3.78Å; F772-L776 WeakPolarHBondContact O-CB 3.33Å; F772-L776 PolarHBondContact O-N 2.99Å
773	L	95.6	Very high	90.5	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61.4	-40.7	-179.4	-70.1	-179.5	0	0	0	111.5	V760 L769 L776 V777 A800 V801 Y804 L907 F911	V760-L773 HydrophobicContact CG2-CD2 4.41Å; L769-L773 HydrophobicContact CD1-CD1 3.98Å; L769-L773 HydrophobicContact CD1-CD2 4.3Å; L769-L773 HydrophobicContact CD1-CG 3.79Å; L769-L773 HydrophobicContact CD2-CD1 4.14Å; L769-L773 HydrophobicContact CG-CD1 3.78Å; L769-L773 HydrophobicContact CG-CG 3.99Å; L769-L773 WeakPolarHBondContact O-CB 3.13Å; L769-L773 WeakPolarHBondContact O-CG 3.46Å; L769-L773 PolarHBondContact O-N 3.16Å; L773-L776 HydrophobicContact CD2-CD2 4.37Å; L773-L776 PolarHBondContact O-N 3.15Å; L773-V777 WeakPolarHBondContact O-CB 3.39Å; L773-V777 WeakPolarHBondContact O-CG2 3.41Å; L773-V777 PolarHBondContact O-N 3.42Å; L773-A800 HydrophobicContact CD2-CB 3.64Å; L773-V801 HydrophobicContact CD2-CG2 4.2Å; L773-Y804 HydrophobicContact CD1-CD1 3.96Å; L773-Y804 HydrophobicContact CD1-CG 4.24Å; L773-L907 HydrophobicContact CB-CD1 4Å; L773-L907 HydrophobicContact CD1-CD1 3.96Å; L773-L907 HydrophobicContact CD1-CD2 4.3Å; L773-F911 HydrophobicContact CB-CE1 4.15Å; L773-F911 HydrophobicContact CB-CZ 4.29Å
774	T	95	Very high	90	Very high	12 Å²	12	38.1 Å²	38.1	7%	0.074	21%	0.209	C	C	.	.	H	α-helix	trans	-65.3	-43.4	177.8	-56.4	0	0	0	0	110.9	I770 F772 L776 V777 V778 S910 F911 A914	I770-T774 WeakPolarHBondContact O-CB 3.24Å; I770-T774 PolarHBondContact O-N 3.23Å; I770-T774 PolarHBondContact O-OG1 2.89Å; F772-T774 VanDerWaalsContact C-N 3.33Å; F772-T774 PolarHBondContact O-N 3.46Å; T774-L776 VanDerWaalsContact C-N 3.33Å; T774-L776 PolarHBondContact O-N 3.44Å; T774-V777 PolarHBondContact O-N 2.9Å; T774-V778 HydrophobicContact CG2-CG2 4.27Å; T774-V778 WeakPolarHBondContact O-CB 3.31Å; T774-V778 WeakPolarHBondContact O-CG2 3.35Å; T774-V778 PolarHBondContact O-N 3.19Å; T774-S910 PolarHBondContact OG1-OG 3.3Å; T774-F911 HydrophobicContact CG2-CD1 4.26Å; T774-F911 WeakPolarHBondContact OG1-CD1 3.42Å; T774-A914 HydrophobicContact CG2-CB 3.67Å
775	S	93.7	Very high	89.4	Confident	61 Å²	61	43.3 Å²	43.3	43%	0.427	23%	0.234	S	C	.	.	H	α-helix	trans	-62.3	-40.5	175	-56.1	0	0	0	0	112.4	E771 F772 R779	E771-S775 VanDerWaalsContact O-CB 3.31Å; E771-S775 WeakPolarHBondContact O-CB 3.17Å; E771-S775 PolarHBondContact O-N 2.86Å; E771-S775 PolarHBondContact O-OG 3.25Å; F772-S775 PolarHBondContact O-N 3.39Å; S775-R779 WeakPolarHBondContact O-CB 3.32Å; S775-R779 PolarHBondContact O-N 3.3Å
776	L	93	Very high	89.1	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-66.9	-38.4	179.7	-167	69.8	0	0	0	112	L736 T739 F772 L773 T774 E780 A797 A800	L736-L776 HydrophobicContact CD1-CB 4.34Å; L736-L776 HydrophobicContact CD1-CD1 4.04Å; T739-L776 HydrophobicContact CG2-CD1 3.96Å; T739-L776 VanDerWaalsContact OG1-CD1 3.31Å; T739-L776 WeakPolarHBondContact OG1-CD1 3.1Å; F772-L776 HydrophobicContact CE1-CD2 3.93Å; F772-L776 HydrophobicContact CE2-CD1 4.36Å; F772-L776 HydrophobicContact CE2-CD2 4.4Å; F772-L776 HydrophobicContact CZ-CD1 4.37Å; F772-L776 HydrophobicContact CZ-CD2 3.78Å; F772-L776 WeakPolarHBondContact O-CB 3.33Å; F772-L776 PolarHBondContact O-N 2.99Å; L773-L776 HydrophobicContact CD2-CD2 4.37Å; L773-L776 PolarHBondContact O-N 3.15Å; T774-L776 VanDerWaalsContact C-N 3.33Å; T774-L776 PolarHBondContact O-N 3.44Å; L776-E780 PolarHBondContact O-N 2.95Å; L776-E780 VanDerWaalsContact O-N 3.09Å; L776-A797 HydrophobicContact CD2-CB 4.26Å; L776-A797 HydrophobicContact CG-CB 3.83Å; L776-A800 HydrophobicContact CD2-CB 3.92Å
777	V	92.7	Very high	88.7	Confident	1 Å²	1	41 Å²	41	1%	0.006	22%	0.221	C	C	.	.	H	α-helix	trans	-79	-37.9	177.2	174.7	0	0	0	0	111.8	L773 T774 R779 E780 V781 F791 V801 F911 L915 L927	L773-V777 WeakPolarHBondContact O-CB 3.39Å; L773-V777 WeakPolarHBondContact O-CG2 3.41Å; L773-V777 PolarHBondContact O-N 3.42Å; T774-V777 PolarHBondContact O-N 2.9Å; V777-R779 PolarHBondContact O-N 2.87Å; V777-E780 PolarHBondContact O-N 3.39Å; V777-V781 HydrophobicContact CG1-CG2 4.18Å; V777-V781 VanDerWaalsContact O-CB 3.3Å; V777-V781 WeakPolarHBondContact O-CB 3.04Å; V777-V781 VanDerWaalsContact O-CG2 3.26Å; V777-V781 WeakPolarHBondContact O-CG2 3.42Å; V777-V781 PolarHBondContact O-N 3.23Å; V777-F791 HydrophobicContact CB-CZ 4.31Å; V777-F791 HydrophobicContact CG1-CE2 3.79Å; V777-F791 HydrophobicContact CG1-CZ 3.7Å; V777-F791 HydrophobicContact CG2-CE1 4.25Å; V777-F791 HydrophobicContact CG2-CE2 4.48Å; V777-F791 HydrophobicContact CG2-CZ 3.56Å; V777-V801 HydrophobicContact CG2-CG2 3.67Å; V777-F911 HydrophobicContact CB-CE1 4.45Å; V777-F911 HydrophobicContact CG2-CE1 4.21Å; V777-F911 HydrophobicContact CG2-CE2 4.35Å; V777-F911 HydrophobicContact CG2-CZ 3.9Å; V777-L915 HydrophobicContact CG1-CD1 4.23Å; V777-L927 HydrophobicContact CG1-CD1 4.33Å
778	V	92.2	Very high	88	Confident	36 Å²	36	37.5 Å²	37.5	22%	0.218	21%	0.205	C	C	.	.	H	α-helix	trans	-60.7	-37.8	171.6	168.8	0	0	0	0	110.7	T774 S782 A914 L915	T774-V778 HydrophobicContact CG2-CG2 4.27Å; T774-V778 WeakPolarHBondContact O-CB 3.31Å; T774-V778 WeakPolarHBondContact O-CG2 3.35Å; T774-V778 PolarHBondContact O-N 3.19Å; V778-S782 WeakPolarHBondContact O-CB 3.46Å; V778-S782 PolarHBondContact O-N 2.93Å; V778-S782 PolarHBondContact O-OG 3.1Å; V778-A914 HydrophobicContact CG2-CB 3.64Å; V778-L915 HydrophobicContact CB-CD2 4.46Å; V778-L915 HydrophobicContact CG2-CD2 3.85Å; V778-L915 HydrophobicContact CG2-CG 4.21Å
779	R	90	Very high	87	Confident	35 Å²	35	37.4 Å²	37.4	13%	0.132	20%	0.203	C	C	.	.	H	α-helix	trans	-61.8	-58.6	170.8	-179.3	178	64	77.7	-20.3	111.5	T739 N740 E743 S775 V777 V781 S782 D783	T739-R779 PolarHBondContact OG1-NH2 2.88Å; T739-R779 VanDerWaalsContact OG1-NH2 3.07Å; N740-R779 WeakPolarHBondContact OD1-CD 3.32Å; N740-R779 PolarHBondContact OD1-NE 3.02Å; N740-R779 PolarHBondContact OD1-NH2 3.09Å; E743-R779 IonicContact OE2-NH1 2.94Å; E743-R779 IonicContact OE2-NH2 3.27Å; E743-R779 PolarHBondContact OE2-NH2 3.14Å; S775-R779 WeakPolarHBondContact O-CB 3.32Å; S775-R779 PolarHBondContact O-N 3.3Å; V777-R779 PolarHBondContact O-N 2.87Å; R779-V781 VanDerWaalsContact C-N 3.25Å; R779-V781 PolarHBondContact O-N 3.37Å; R779-S782 WeakPolarHBondContact O-CA 3.41Å; R779-S782 WeakPolarHBondContact O-CB 3.19Å; R779-S782 PolarHBondContact O-N 2.94Å; R779-D783 WeakPolarHBondContact CG-OD2 3.31Å; R779-D783 IonicContact NH1-OD2 2.7Å; R779-D783 PolarHBondContact O-N 2.84Å
780	E	89.6	Confident	86.2	Confident	8 Å²	8	38.2 Å²	38.2	4%	0.037	21%	0.209	C	C	.	.	H	α-helix	trans	-51.8	-46.5	178.5	177.5	168.2	-140.7	0	0	111.1	L776 V777 S782 D783 L784 S793 T795 A797 T798	L776-E780 PolarHBondContact O-N 2.95Å; L776-E780 VanDerWaalsContact O-N 3.09Å; V777-E780 PolarHBondContact O-N 3.39Å; E780-S782 VanDerWaalsContact C-N 3.27Å; E780-S782 PolarHBondContact O-N 3.45Å; E780-D783 CarbonylContact O-C 3.51Å; E780-D783 PolarHBondContact O-N 3.23Å; E780-L784 VanDerWaalsContact O-CG 3.32Å; E780-L784 WeakPolarHBondContact O-CG 3.26Å; E780-L784 PolarHBondContact O-N 3.22Å; E780-S793 PolarHBondContact OE1-OG 3.02Å; E780-T795 WeakPolarHBondContact OE1-CB 3.45Å; E780-T795 VanDerWaalsContact OE1-CG2 3.24Å; E780-T795 WeakPolarHBondContact OE1-CG2 3.24Å; E780-T795 PolarHBondContact OE1-OG1 3.13Å; E780-T795 PolarHBondContact OE2-OG1 2.92Å; E780-A797 HydrophobicContact CB-CB 3.91Å; E780-A797 HydrophobicContact CG-CB 4.47Å; E780-A797 VanDerWaalsContact OE2-CB 3.28Å; E780-A797 WeakPolarHBondContact OE2-CB 3.3Å; E780-T798 PolarHBondContact OE1-OG1 3.41Å; E780-T798 PolarHBondContact OE2-OG1 2.83Å
781	V	89.4	Confident	85.3	Confident	2 Å²	2	37 Å²	37	1%	0.012	20%	0.203	C	C	.	.	H	α-helix	trans	-69.8	-18.5	179.7	173.9	0	0	0	0	113.9	V777 R779 L784 L915 R919 F923 L927	V777-V781 HydrophobicContact CG1-CG2 4.18Å; V777-V781 VanDerWaalsContact O-CB 3.3Å; V777-V781 WeakPolarHBondContact O-CB 3.04Å; V777-V781 VanDerWaalsContact O-CG2 3.26Å; V777-V781 WeakPolarHBondContact O-CG2 3.42Å; V777-V781 PolarHBondContact O-N 3.23Å; R779-V781 VanDerWaalsContact C-N 3.25Å; R779-V781 PolarHBondContact O-N 3.37Å; V781-L784 HydrophobicContact CB-CD1 4.36Å; V781-L784 HydrophobicContact CG2-CD1 4.04Å; V781-L915 HydrophobicContact CB-CD2 4.1Å; V781-L915 HydrophobicContact CG1-CD1 4.48Å; V781-L915 HydrophobicContact CG1-CD2 3.78Å; V781-L915 HydrophobicContact CG2-CD1 4.23Å; V781-R919 HydrophobicContact CG1-CG 3.88Å; V781-R919 PolarHBondContact O-NE 2.69Å; V781-R919 PolarHBondContact O-NH2 2.98Å; V781-F923 HydrophobicContact CB-CZ 4.48Å; V781-F923 HydrophobicContact CG1-CE1 3.61Å; V781-F923 HydrophobicContact CG1-CZ 3.67Å; V781-F923 HydrophobicContact CG2-CE1 4.11Å; V781-F923 HydrophobicContact CG2-CZ 3.91Å; V781-L927 HydrophobicContact CG2-CD1 3.96Å
782	S	86.2	Confident	84.3	Confident	72 Å²	72	38.5 Å²	38.5	50%	0.503	20%	0.204	S	C	.	.	H	α-helix	trans	-78.4	-42.2	169.7	-59.7	0	0	0	0	111.2	V778 R779 E780 L784	V778-S782 WeakPolarHBondContact O-CB 3.46Å; V778-S782 PolarHBondContact O-N 2.93Å; V778-S782 PolarHBondContact O-OG 3.1Å; R779-S782 WeakPolarHBondContact O-CA 3.41Å; R779-S782 WeakPolarHBondContact O-CB 3.19Å; R779-S782 PolarHBondContact O-N 2.94Å; E780-S782 VanDerWaalsContact C-N 3.27Å; E780-S782 PolarHBondContact O-N 3.45Å; S782-L784 VanDerWaalsContact C-N 3.28Å; S782-L784 PolarHBondContact O-N 3.26Å
783	D	82.1	Confident	83.2	Confident	110 Å²	110	39.7 Å²	39.7	59%	0.588	21%	0.214	S	C	*	.	H	α-helix	trans	-74.7	-16.2	178.9	-53.9	-29.6	0	0	0	112.5	R779 E780 E785	R779-D783 WeakPolarHBondContact CG-OD2 3.31Å; R779-D783 IonicContact NH1-OD2 2.7Å; R779-D783 PolarHBondContact O-N 2.84Å; E780-D783 CarbonylContact O-C 3.51Å; E780-D783 PolarHBondContact O-N 3.23Å; D783-E785 PolarHBondContact O-N 3.43Å; D783-E785 VanDerWaalsContact O-N 3.08Å
784	L	82.6	Confident	82.6	Confident	21 Å²	21	44.2 Å²	44.2	11%	0.11	24%	0.238	C	C	.	.			trans	-62.5	108.4	177.4	-82.1	180	0	0	0	112.6	E780 V781 S782 N786 M789 A790 F923	E780-L784 VanDerWaalsContact O-CG 3.32Å; E780-L784 WeakPolarHBondContact O-CG 3.26Å; E780-L784 PolarHBondContact O-N 3.22Å; V781-L784 HydrophobicContact CB-CD1 4.36Å; V781-L784 HydrophobicContact CG2-CD1 4.04Å; S782-L784 VanDerWaalsContact C-N 3.28Å; S782-L784 PolarHBondContact O-N 3.26Å; L784-N786 PolarHBondContact O-N 2.9Å; L784-M789 HydrophobicContact CD2-CB 3.98Å; L784-A790 VanDerWaalsContact CD1-CA 3.44Å; L784-A790 HydrophobicContact CD1-CB 3.47Å; L784-A790 VanDerWaalsContact CD1-CB 3.47Å; L784-F923 HydrophobicContact CD1-CZ 4.46Å
785	E	74.1	Confident	82.3	Confident	137 Å²	137	44.8 Å²	44.8	64%	0.64	24%	0.241	S	C	*	.	S	Bend	trans	-63.6	-25.7	159.2	-67	176.6	-147.1	0	0	112.5	D783 V1531 I1532	D783-E785 PolarHBondContact O-N 3.43Å; D783-E785 VanDerWaalsContact O-N 3.08Å; E785-V1531 HydrophobicContact CB-CB 3.79Å; E785-V1531 HydrophobicContact CB-CG1 3.48Å; E785-V1531 VanDerWaalsContact CB-CG1 3.48Å; E785-V1531 HydrophobicContact CB-CG2 4.18Å; E785-V1531 WeakPolarHBondContact O-CB 3.37Å; E785-V1531 WeakPolarHBondContact OE2-CG1 3.42Å; E785-I1532 WeakPolarHBondContact O-CA 3.43Å; E785-I1532 WeakPolarHBondContact O-CB 3.43Å; E785-I1532 VanDerWaalsContact O-CD1 3.3Å; E785-I1532 WeakPolarHBondContact O-CD1 3.29Å; E785-I1532 WeakPolarHBondContact O-CG1 3.44Å; E785-I1532 PolarHBondContact O-N 2.88Å
786	N	75.8	Confident	82.2	Confident	14 Å²	14	41.9 Å²	41.9	8%	0.075	22%	0.221	C	C	.	.			trans	-129.2	127.8	174.2	-155.5	-18	0	0	0	113.7	L784 S788 M789 A790 N1530 V1531 I1532	L784-N786 PolarHBondContact O-N 2.9Å; N786-S788 VanDerWaalsContact CG-OG 3.28Å; N786-S788 PolarHBondContact ND2-OG 3.42Å; N786-S788 PolarHBondContact O-N 3.13Å; N786-S788 PolarHBondContact OD1-N 3.06Å; N786-S788 PolarHBondContact OD1-OG 3.43Å; N786-M789 HydrophobicContact CB-CB 3.97Å; N786-M789 HydrophobicContact CB-CG 3.76Å; N786-M789 WeakPolarHBondContact O-CA 3.22Å; N786-M789 WeakPolarHBondContact O-CB 3.33Å; N786-M789 PolarHBondContact O-N 2.89Å; N786-A790 PolarHBondContact O-N 3.11Å; N786-N1530 HydrophobicContact CB-CB 4.47Å; N786-V1531 HydrophobicContact CB-CB 4.03Å; N786-V1531 HydrophobicContact CB-CG1 4.03Å; N786-V1531 WeakPolarHBondContact ND2-CA 3.41Å; N786-I1532 VanDerWaalsContact CG-N 3.34Å; N786-I1532 WeakPolarHBondContact OD1-CA 3.2Å; N786-I1532 PolarHBondContact OD1-N 3.4Å
787	E	77.4	Confident	82.1	Confident	25 Å²	25	41.9 Å²	41.9	12%	0.117	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-58.5	-29.8	165.5	-65.7	-177.9	-81.6	0	0	112.6	M789 A790 F923 I1532 T1534	E787-M789 VanDerWaalsContact C-N 3.3Å; E787-M789 PolarHBondContact O-N 3.4Å; E787-A790 WeakPolarHBondContact O-CB 3.41Å; E787-A790 PolarHBondContact O-N 2.93Å; E787-F923 HydrophobicContact CB-CD2 3.79Å; E787-F923 HydrophobicContact CB-CE2 3.8Å; E787-F923 HydrophobicContact CG-CD2 3.87Å; E787-F923 HydrophobicContact CG-CE2 3.96Å; E787-F923 WeakPolarHBondContact OE2-CD2 3.28Å; E787-I1532 HydrophobicContact CG-CG1 4.06Å; E787-T1534 HydrophobicContact CB-CG2 4.16Å; E787-T1534 VanDerWaalsContact CD-OG1 3.29Å; E787-T1534 HydrophobicContact CG-CG2 4.41Å; E787-T1534 WeakPolarHBondContact OE1-CB 3.07Å; E787-T1534 WeakPolarHBondContact OE1-CG2 3.38Å; E787-T1534 PolarHBondContact OE1-N 3.46Å; E787-T1534 PolarHBondContact OE1-OG1 3.19Å; E787-T1534 WeakPolarHBondContact OE2-CG2 3.34Å; E787-T1534 PolarHBondContact OE2-OG1 2.95Å
788	S	71.3	Confident	82	Confident	50 Å²	50	41.9 Å²	41.9	35%	0.35	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-75.9	-12.9	171.8	95	0	0	0	0	114.3	N786 R792	N786-S788 VanDerWaalsContact CG-OG 3.28Å; N786-S788 PolarHBondContact ND2-OG 3.42Å; N786-S788 PolarHBondContact O-N 3.13Å; N786-S788 PolarHBondContact OD1-N 3.06Å; N786-S788 PolarHBondContact OD1-OG 3.43Å; S788-R792 WeakPolarHBondContact O-CD 3.29Å; S788-R792 PolarHBondContact O-NE 3.02Å; S788-R792 VanDerWaalsContact O-NE 3.13Å; S788-R792 PolarHBondContact O-NH1 3.46Å
789	M	71.5	Confident	82	Confident	44 Å²	44	41.3 Å²	41.3	22%	0.217	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-92.4	-5.7	172.8	-70.4	-60.9	106	0	0	112.8	L784 N786 E787 F791 R792 N1530	L784-M789 HydrophobicContact CD2-CB 3.98Å; N786-M789 HydrophobicContact CB-CB 3.97Å; N786-M789 HydrophobicContact CB-CG 3.76Å; N786-M789 WeakPolarHBondContact O-CA 3.22Å; N786-M789 WeakPolarHBondContact O-CB 3.33Å; N786-M789 PolarHBondContact O-N 2.89Å; E787-M789 VanDerWaalsContact C-N 3.3Å; E787-M789 PolarHBondContact O-N 3.4Å; M789-F791 PolarHBondContact O-N 2.97Å; M789-F791 VanDerWaalsContact O-N 3.15Å; M789-R792 PolarHBondContact O-N 2.99Å; M789-R792 HydrophobicContact SD-CB 4.32Å; M789-N1530 WeakPolarHBondContact CE-OD1 3.32Å; M789-N1530 HydrophobicContact CG-CB 4.19Å; M789-N1530 PolarHBondContact SD-ND2 3.36Å; M789-N1530 VanDerWaalsContact SD-ND2 3.42Å
790	A	75.2	Confident	82.1	Confident	18 Å²	18	39.7 Å²	39.7	15%	0.149	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	121.2	172.9	0	0	0	0	0	110.7	L784 N786 E787 R792 F923	L784-A790 VanDerWaalsContact CD1-CA 3.44Å; L784-A790 HydrophobicContact CD1-CB 3.47Å; L784-A790 VanDerWaalsContact CD1-CB 3.47Å; N786-A790 PolarHBondContact O-N 3.11Å; E787-A790 WeakPolarHBondContact O-CB 3.41Å; E787-A790 PolarHBondContact O-N 2.93Å; A790-R792 VanDerWaalsContact C-N 3.29Å; A790-R792 PolarHBondContact O-N 3.27Å; A790-F923 HydrophobicContact CB-CE2 3.82Å; A790-F923 HydrophobicContact CB-CZ 3.81Å
791	F	76	Confident	82.3	Confident	3 Å²	3	39.3 Å²	39.3	1%	0.013	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	50	46	-173.7	-65.8	-81.4	0	0	0	113.7	V777 M789 T798 V801 L927 R935	V777-F791 HydrophobicContact CB-CZ 4.31Å; V777-F791 HydrophobicContact CG1-CE2 3.79Å; V777-F791 HydrophobicContact CG1-CZ 3.7Å; V777-F791 HydrophobicContact CG2-CE1 4.25Å; V777-F791 HydrophobicContact CG2-CE2 4.48Å; V777-F791 HydrophobicContact CG2-CZ 3.56Å; M789-F791 PolarHBondContact O-N 2.97Å; M789-F791 VanDerWaalsContact O-N 3.15Å; F791-T798 HydrophobicContact CD1-CG2 4.37Å; F791-T798 WeakPolarHBondContact CD1-OG1 3.47Å; F791-V801 HydrophobicContact CE1-CB 3.82Å; F791-V801 HydrophobicContact CE1-CG1 4.07Å; F791-V801 HydrophobicContact CE1-CG2 3.88Å; F791-V801 HydrophobicContact CZ-CB 4.34Å; F791-V801 HydrophobicContact CZ-CG1 4.31Å; F791-V801 HydrophobicContact CZ-CG2 4.06Å; F791-L927 HydrophobicContact CD2-CD1 4.3Å; F791-L927 HydrophobicContact CD2-CG 3.87Å; F791-L927 HydrophobicContact CE2-CD1 3.87Å; F791-L927 HydrophobicContact CE2-CD2 3.85Å; F791-L927 HydrophobicContact CE2-CG 3.6Å; F791-R935 VanDerWaalsContact O-CZ 3.24Å; F791-R935 PolarHBondContact O-NH1 3.24Å; F791-R935 PolarHBondContact O-NH2 3.37Å
792	R	72.4	Confident	82.4	Confident	148 Å²	148	40.8 Å²	40.8	56%	0.558	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-122.4	-15.5	163.6	-61.8	-167.4	178.8	158.6	-7.4	113.4	S788 M789 A790	S788-R792 WeakPolarHBondContact O-CD 3.29Å; S788-R792 PolarHBondContact O-NE 3.02Å; S788-R792 VanDerWaalsContact O-NE 3.13Å; S788-R792 PolarHBondContact O-NH1 3.46Å; M789-R792 PolarHBondContact O-N 2.99Å; M789-R792 HydrophobicContact SD-CB 4.32Å; A790-R792 VanDerWaalsContact C-N 3.29Å; A790-R792 PolarHBondContact O-N 3.27Å
793	S	72	Confident	82.6	Confident	37 Å²	37	38.1 Å²	38.1	26%	0.259	20%	0.195	S	C	.	.	S	Bend	trans	-73.7	150.5	176	26.1	0	0	0	0	113.2	E780 T795 T798	E780-S793 PolarHBondContact OE1-OG 3.02Å; S793-T795 PolarHBondContact O-N 3.49Å; S793-T795 VanDerWaalsContact O-N 3.14Å; S793-T798 WeakPolarHBondContact O-CB 3.45Å; S793-T798 WeakPolarHBondContact O-CG2 3.48Å; S793-T798 PolarHBondContact O-OG1 2.63Å
794	N	82.6	Confident	83.1	Confident	94 Å²	94	33 Å²	33	50%	0.503	17%	0.168	S	C	.	.			trans	-86	61	169.5	-76	-41	0	0	0	110.8	V749 K752	V749-N794 HydrophobicContact CG1-CB 4.37Å; V749-N794 HydrophobicContact CG2-CB 4.16Å; K752-N794 WeakPolarHBondContact CD-O 3.39Å; K752-N794 PolarHBondContact NZ-O 3.4Å
795	T	88	Confident	83.6	Confident	24 Å²	24	32 Å²	32	15%	0.147	16%	0.163	C	C	.	.			trans	-91.7	157	176.2	49.3	0	0	0	0	112.4	E743 E780 S793 A797 T798 K799	E743-T795 WeakPolarHBondContact OE1-CA 3.32Å; E780-T795 WeakPolarHBondContact OE1-CB 3.45Å; E780-T795 VanDerWaalsContact OE1-CG2 3.24Å; E780-T795 WeakPolarHBondContact OE1-CG2 3.24Å; E780-T795 PolarHBondContact OE1-OG1 3.13Å; E780-T795 PolarHBondContact OE2-OG1 2.92Å; S793-T795 PolarHBondContact O-N 3.49Å; S793-T795 VanDerWaalsContact O-N 3.14Å; T795-A797 PolarHBondContact O-N 3.5Å; T795-T798 PolarHBondContact O-N 2.9Å; T795-T798 VanDerWaalsContact OG1-CB 3.22Å; T795-T798 WeakPolarHBondContact OG1-CB 3.46Å; T795-T798 PolarHBondContact OG1-N 3.48Å; T795-T798 PolarHBondContact OG1-OG1 2.98Å; T795-K799 WeakPolarHBondContact O-CG 3.45Å; T795-K799 PolarHBondContact O-N 3.49Å
796	I	91.1	Very high	84.2	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-58.5	-37.9	167.7	-60.4	167.3	0	0	0	109.9	T739 L742 E743 K752 L755 A756 K799 A800	T739-I796 HydrophobicContact CG2-CD1 4.46Å; T739-I796 HydrophobicContact CG2-CG2 3.83Å; L742-I796 HydrophobicContact CB-CD1 4.29Å; E743-I796 HydrophobicContact CB-CD1 4.08Å; E743-I796 PolarHBondContact OE1-N 3.38Å; K752-I796 HydrophobicContact CB-CG1 4.23Å; K752-I796 HydrophobicContact CD-CG1 4.13Å; K752-I796 HydrophobicContact CG-CG1 4.06Å; L755-I796 HydrophobicContact CD2-CD1 3.75Å; L755-I796 HydrophobicContact CD2-CG1 4.35Å; A756-I796 HydrophobicContact CB-CG2 4.35Å; I796-K799 PolarHBondContact O-N 3.32Å; I796-A800 VanDerWaalsContact O-CB 3.31Å; I796-A800 WeakPolarHBondContact O-CB 3.37Å; I796-A800 PolarHBondContact O-N 3.2Å
797	A	91.8	Very high	84.7	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-56.5	-53.8	174.5	0	0	0	0	0	112.7	L776 E780 T795 K799 A800 V801	L776-A797 HydrophobicContact CD2-CB 4.26Å; L776-A797 HydrophobicContact CG-CB 3.83Å; E780-A797 HydrophobicContact CB-CB 3.91Å; E780-A797 HydrophobicContact CG-CB 4.47Å; E780-A797 VanDerWaalsContact OE2-CB 3.28Å; E780-A797 WeakPolarHBondContact OE2-CB 3.3Å; T795-A797 PolarHBondContact O-N 3.5Å; A797-K799 VanDerWaalsContact C-N 3.31Å; A797-K799 PolarHBondContact O-N 2.95Å; A797-A800 PolarHBondContact O-N 3.02Å; A797-V801 PolarHBondContact O-N 3.29Å
798	T	91.4	Very high	85.2	Confident	2 Å²	2	29.5 Å²	29.5	1%	0.012	15%	0.151	C	C	.	.	H	α-helix	trans	-58.9	-40.8	176.4	-79.2	0	0	0	0	112.2	E780 F791 S793 T795 E802	E780-T798 PolarHBondContact OE1-OG1 3.41Å; E780-T798 PolarHBondContact OE2-OG1 2.83Å; F791-T798 HydrophobicContact CD1-CG2 4.37Å; F791-T798 WeakPolarHBondContact CD1-OG1 3.47Å; S793-T798 WeakPolarHBondContact O-CB 3.45Å; S793-T798 WeakPolarHBondContact O-CG2 3.48Å; S793-T798 PolarHBondContact O-OG1 2.63Å; T795-T798 PolarHBondContact O-N 2.9Å; T795-T798 VanDerWaalsContact OG1-CB 3.22Å; T795-T798 WeakPolarHBondContact OG1-CB 3.46Å; T795-T798 PolarHBondContact OG1-N 3.48Å; T795-T798 PolarHBondContact OG1-OG1 2.98Å; T798-E802 WeakPolarHBondContact O-CB 3.3Å; T798-E802 PolarHBondContact O-N 3.38Å
799	K	90.9	Very high	86	Confident	24 Å²	24	27.1 Å²	27.1	10%	0.104	13%	0.134	C	C	.	.	H	α-helix	trans	-74.9	-34.6	-178.8	-65.5	-52.4	-172.1	168.2	0	114	E753 A756 T795 I796 A797 E802 C803	E753-K799 HydrophobicContact CG-CB 4.26Å; E753-K799 HydrophobicContact CG-CD 3.72Å; E753-K799 HydrophobicContact CG-CG 3.79Å; E753-K799 WeakPolarHBondContact OE1-CE 3.34Å; E753-K799 IonicContact OE1-NZ 3.84Å; E753-K799 PolarHBondContact OE1-NZ 2.92Å; A756-K799 HydrophobicContact CB-CB 3.92Å; T795-K799 WeakPolarHBondContact O-CG 3.45Å; T795-K799 PolarHBondContact O-N 3.49Å; I796-K799 PolarHBondContact O-N 3.32Å; A797-K799 VanDerWaalsContact C-N 3.31Å; A797-K799 PolarHBondContact O-N 2.95Å; K799-E802 WeakPolarHBondContact CD-OE2 3.49Å; K799-E802 IonicContact NZ-OE2 2.7Å; K799-E802 PolarHBondContact NZ-OE2 3.49Å; K799-E802 PolarHBondContact O-N 3.19Å; K799-C803 VanDerWaalsContact O-CB 3.31Å; K799-C803 WeakPolarHBondContact O-CB 3.16Å; K799-C803 PolarHBondContact O-N 3.04Å
800	A	93.6	Very high	86.6	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-65.8	-44.3	175.3	0	0	0	0	0	111.6	A756 V760 L773 L776 I796 A797 C803 Y804	A756-A800 HydrophobicContact CB-CB 4.15Å; V760-A800 HydrophobicContact CG2-CB 3.82Å; V760-A800 WeakPolarHBondContact CG2-O 3.44Å; L773-A800 HydrophobicContact CD2-CB 3.64Å; L776-A800 HydrophobicContact CD2-CB 3.92Å; I796-A800 VanDerWaalsContact O-CB 3.31Å; I796-A800 WeakPolarHBondContact O-CB 3.37Å; I796-A800 PolarHBondContact O-N 3.2Å; A797-A800 PolarHBondContact O-N 3.02Å; A800-C803 PolarHBondContact O-N 3.47Å; A800-Y804 PolarHBondContact O-N 2.82Å
801	V	93.7	Very high	86.9	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-67.8	-42.2	174.8	178.8	0	0	0	0	111.2	L773 V777 F791 A797 C803 Y804 V805 F911 C931	L773-V801 HydrophobicContact CD2-CG2 4.2Å; V777-V801 HydrophobicContact CG2-CG2 3.67Å; F791-V801 HydrophobicContact CE1-CB 3.82Å; F791-V801 HydrophobicContact CE1-CG1 4.07Å; F791-V801 HydrophobicContact CE1-CG2 3.88Å; F791-V801 HydrophobicContact CZ-CB 4.34Å; F791-V801 HydrophobicContact CZ-CG1 4.31Å; F791-V801 HydrophobicContact CZ-CG2 4.06Å; A797-V801 PolarHBondContact O-N 3.29Å; V801-C803 VanDerWaalsContact C-N 3.34Å; V801-C803 PolarHBondContact O-N 3.37Å; V801-Y804 PolarHBondContact O-N 2.74Å; V801-V805 HydrophobicContact CG1-CG2 3.96Å; V801-V805 VanDerWaalsContact O-CB 3.32Å; V801-V805 WeakPolarHBondContact O-CB 3.26Å; V801-V805 VanDerWaalsContact O-CG2 3.23Å; V801-V805 WeakPolarHBondContact O-CG2 3.41Å; V801-V805 PolarHBondContact O-N 3.4Å; V801-F911 HydrophobicContact CG1-CE2 4.19Å; V801-F911 HydrophobicContact CG1-CZ 4.44Å; V801-F911 HydrophobicContact CG2-CE2 4.3Å; V801-F911 HydrophobicContact CG2-CZ 3.89Å; V801-C931 HydrophobicContact CG1-CB 4.47Å
802	E	91.2	Very high	87.6	Confident	33 Å²	33	27.7 Å²	27.7	15%	0.154	14%	0.141	C	C	.	.	H	α-helix	trans	-59.7	-41.9	175.8	-174.8	178.3	179.4	0	0	112.2	T798 K799 K806 R935	T798-E802 WeakPolarHBondContact O-CB 3.3Å; T798-E802 PolarHBondContact O-N 3.38Å; K799-E802 WeakPolarHBondContact CD-OE2 3.49Å; K799-E802 IonicContact NZ-OE2 2.7Å; K799-E802 PolarHBondContact NZ-OE2 3.49Å; K799-E802 PolarHBondContact O-N 3.19Å; E802-K806 HydrophobicContact CG-CD 4.31Å; E802-K806 WeakPolarHBondContact O-CB 3.42Å; E802-K806 WeakPolarHBondContact O-CD 3.45Å; E802-K806 VanDerWaalsContact O-CG 3.23Å; E802-K806 WeakPolarHBondContact O-CG 3.44Å; E802-K806 PolarHBondContact O-N 2.88Å; E802-K806 WeakPolarHBondContact OE1-CE 3.38Å; E802-K806 IonicContact OE1-NZ 3.09Å; E802-K806 PolarHBondContact OE1-NZ 3.49Å; E802-R935 HydrophobicContact CG-CB 4.35Å; E802-R935 HydrophobicContact CG-CG 4.22Å
803	C	89.3	Confident	88.5	Confident	16 Å²	16	20.6 Å²	20.6	11%	0.108	11%	0.114	C	C	.	.	H	α-helix	trans	-61.4	-55.8	174.1	175.8	0	0	0	0	111.5	N757 K799 A800 V801 V805 K806 F807	N757-C803 WeakPolarHBondContact OD1-CB 3.32Å; N757-C803 PolarHBondContact OD1-SG 3.18Å; K799-C803 VanDerWaalsContact O-CB 3.31Å; K799-C803 WeakPolarHBondContact O-CB 3.16Å; K799-C803 PolarHBondContact O-N 3.04Å; A800-C803 PolarHBondContact O-N 3.47Å; V801-C803 VanDerWaalsContact C-N 3.34Å; V801-C803 PolarHBondContact O-N 3.37Å; C803-V805 PolarHBondContact O-N 2.84Å; C803-K806 PolarHBondContact O-N 3.43Å; C803-K806 VanDerWaalsContact O-N 3.17Å; C803-F807 WeakPolarHBondContact O-CB 3.27Å; C803-F807 PolarHBondContact O-N 3.05Å
804	Y	93.4	Very high	89.2	Confident	2 Å²	2	21 Å²	21	1%	0.008	11%	0.112	C	C	.	.	H	α-helix	trans	-66.3	-39.8	-173.4	-171.3	-118.1	0	0	0	113.3	V760 E764 L769 L773 A800 V801 K806 F807 V808 V903 L904 L907	V760-Y804 HydrophobicContact CG1-CD2 3.79Å; V760-Y804 HydrophobicContact CG1-CG 4.29Å; E764-Y804 VanDerWaalsContact OE2-CE2 3.31Å; E764-Y804 WeakPolarHBondContact OE2-CE2 3.36Å; E764-Y804 PolarHBondContact OE2-OH 3.42Å; L769-Y804 HydrophobicContact CD2-CD1 4.02Å; L769-Y804 HydrophobicContact CD2-CD2 3.33Å; L769-Y804 HydrophobicContact CD2-CE1 3.86Å; L769-Y804 HydrophobicContact CD2-CE2 3.13Å; L769-Y804 HydrophobicContact CD2-CG 3.73Å; L773-Y804 HydrophobicContact CD1-CD1 3.96Å; L773-Y804 HydrophobicContact CD1-CG 4.24Å; A800-Y804 PolarHBondContact O-N 2.82Å; V801-Y804 PolarHBondContact O-N 2.74Å; Y804-K806 VanDerWaalsContact C-N 3.28Å; Y804-K806 PolarHBondContact O-N 2.87Å; Y804-F807 HydrophobicContact CD2-CD1 4.07Å; Y804-F807 HydrophobicContact CE2-CD1 4.15Å; Y804-F807 PolarHBondContact O-N 2.9Å; Y804-V808 HydrophobicContact CD1-CG2 4.34Å; Y804-V808 HydrophobicContact CD2-CG2 4.02Å; Y804-V808 HydrophobicContact CE1-CG2 3.99Å; Y804-V808 HydrophobicContact CE2-CG2 3.64Å; Y804-V808 HydrophobicContact CG-CG2 4.4Å; Y804-V808 PolarHBondContact O-N 3.28Å; Y804-V903 HydrophobicContact CE1-CG1 4.09Å; Y804-V903 WeakPolarHBondContact OH-CG1 3.28Å; Y804-L904 HydrophobicContact CD1-CD2 4.37Å; Y804-L904 HydrophobicContact CE1-CD2 4.45Å; Y804-L907 HydrophobicContact CD1-CD2 3.9Å; Y804-L907 HydrophobicContact CE1-CD2 4.23Å
805	V	92.5	Very high	89.4	Confident	1 Å²	1	23.9 Å²	23.9	1%	0.006	12%	0.122	C	C	.	.	H	α-helix	trans	-63.9	-34.8	176.5	174.3	0	0	0	0	111	V801 C803 G809 L904 F908 I932 L936	V801-V805 HydrophobicContact CG1-CG2 3.96Å; V801-V805 VanDerWaalsContact O-CB 3.32Å; V801-V805 WeakPolarHBondContact O-CB 3.26Å; V801-V805 VanDerWaalsContact O-CG2 3.23Å; V801-V805 WeakPolarHBondContact O-CG2 3.41Å; V801-V805 PolarHBondContact O-N 3.4Å; C803-V805 PolarHBondContact O-N 2.84Å; V805-G809 VanDerWaalsContact O-CA 3.23Å; V805-G809 WeakPolarHBondContact O-CA 3.33Å; V805-G809 PolarHBondContact O-N 3.2Å; V805-L904 HydrophobicContact CG2-CD2 4.17Å; V805-F908 HydrophobicContact CG2-CE1 4.32Å; V805-F908 HydrophobicContact CG2-CZ 4.1Å; V805-I932 HydrophobicContact CG1-CD1 3.8Å; V805-L936 HydrophobicContact CG1-CB 3.97Å; V805-L936 HydrophobicContact CG1-CD1 4.49Å; V805-L936 HydrophobicContact CG1-CD2 3.95Å; V805-L936 HydrophobicContact CG1-CG 4.36Å
806	K	88	Confident	89.5	Confident	70 Å²	70	23.3 Å²	23.3	30%	0.304	12%	0.118	S	C	.	.	H	α-helix	trans	-70.9	-43.2	171.7	-71.5	173.7	-172	173.3	0	112.6	E802 C803 Y804 G809 S810 R935 L936 F947	E802-K806 HydrophobicContact CG-CD 4.31Å; E802-K806 WeakPolarHBondContact O-CB 3.42Å; E802-K806 WeakPolarHBondContact O-CD 3.45Å; E802-K806 VanDerWaalsContact O-CG 3.23Å; E802-K806 WeakPolarHBondContact O-CG 3.44Å; E802-K806 PolarHBondContact O-N 2.88Å; E802-K806 WeakPolarHBondContact OE1-CE 3.38Å; E802-K806 IonicContact OE1-NZ 3.09Å; E802-K806 PolarHBondContact OE1-NZ 3.49Å; C803-K806 PolarHBondContact O-N 3.43Å; C803-K806 VanDerWaalsContact O-N 3.17Å; Y804-K806 VanDerWaalsContact C-N 3.28Å; Y804-K806 PolarHBondContact O-N 2.87Å; K806-G809 PolarHBondContact O-N 2.97Å; K806-S810 WeakPolarHBondContact O-CB 3.5Å; K806-S810 PolarHBondContact O-N 2.85Å; K806-R935 VanDerWaalsContact CE-O 3.25Å; K806-R935 WeakPolarHBondContact CE-O 3.24Å; K806-L936 HydrophobicContact CG-CD1 4.21Å; K806-F947 HydrophobicContact CD-CE1 4.43Å; K806-F947 HydrophobicContact CG-CE1 4.19Å
807	F	85	Confident	89.4	Confident	28 Å²	28	23.3 Å²	23.3	12%	0.123	12%	0.118	C	C	.	.	H	α-helix	trans	-58.1	-52.9	179	174.7	-108.5	0	0	0	111.8	W501 Y761 C803 Y804	W501-F807 HydrophobicContact CH2-CD2 4.43Å; W501-F807 HydrophobicContact CH2-CE2 4.14Å; Y761-F807 AromaticContact CE1-CD2 3.91Å; Y761-F807 HydrophobicContact CE1-CD2 3.91Å; Y761-F807 AromaticContact CE1-CE2 3.93Å; Y761-F807 HydrophobicContact CE1-CE2 3.93Å; Y761-F807 HydrophobicContact CE1-CG 4.31Å; Y761-F807 HydrophobicContact CE1-CZ 4.35Å; C803-F807 WeakPolarHBondContact O-CB 3.27Å; C803-F807 PolarHBondContact O-N 3.05Å; Y804-F807 HydrophobicContact CD2-CD1 4.07Å; Y804-F807 HydrophobicContact CE2-CD1 4.15Å; Y804-F807 PolarHBondContact O-N 2.9Å
808	V	88.5	Confident	89	Confident	25 Å²	25	26.4 Å²	26.4	15%	0.152	13%	0.132	C	C	.	.	H	α-helix	trans	-76.1	-33.5	178.2	-176.4	0	0	0	0	111.9	Y804 P901 V903 L904	Y804-V808 HydrophobicContact CD1-CG2 4.34Å; Y804-V808 HydrophobicContact CD2-CG2 4.02Å; Y804-V808 HydrophobicContact CE1-CG2 3.99Å; Y804-V808 HydrophobicContact CE2-CG2 3.64Å; Y804-V808 HydrophobicContact CG-CG2 4.4Å; Y804-V808 PolarHBondContact O-N 3.28Å; V808-P901 HydrophobicContact CG1-CB 3.61Å; V808-P901 HydrophobicContact CG1-CG 4.22Å; V808-V903 HydrophobicContact CG1-CB 4.47Å; V808-L904 HydrophobicContact CB-CD1 4.33Å; V808-L904 HydrophobicContact CB-CD2 4.13Å; V808-L904 HydrophobicContact CB-CG 4.17Å; V808-L904 HydrophobicContact CG1-CD1 4.19Å; V808-L904 HydrophobicContact CG1-CD2 4.33Å; V808-L904 HydrophobicContact CG1-CG 3.88Å
809	G	88.5	Confident	88.6	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-76.5	-17.1	-176.3	0	0	0	0	0	115.4	V805 K806 S811 Y812 L813	V805-G809 VanDerWaalsContact O-CA 3.23Å; V805-G809 WeakPolarHBondContact O-CA 3.33Å; V805-G809 PolarHBondContact O-N 3.2Å; K806-G809 PolarHBondContact O-N 2.97Å; G809-S811 PolarHBondContact O-N 3.18Å; G809-Y812 WeakPolarHBondContact O-CB 3.33Å; G809-Y812 PolarHBondContact O-N 2.82Å; G809-L813 WeakPolarHBondContact O-CG 3.27Å; G809-L813 PolarHBondContact O-N 2.89Å
810	S	82.8	Confident	88.4	Confident	25 Å²	25	31.6 Å²	31.6	18%	0.175	16%	0.16	C	C	.	.	H	α-helix	trans	-55	-53.6	-176.2	-179.8	0	0	0	0	113.1	K806 Y812 L813 H814	K806-S810 WeakPolarHBondContact O-CB 3.5Å; K806-S810 PolarHBondContact O-N 2.85Å; S810-Y812 VanDerWaalsContact C-N 3.29Å; S810-Y812 PolarHBondContact O-N 3.37Å; S810-L813 PolarHBondContact O-N 3.36Å; S810-H814 PolarHBondContact O-N 2.84Å; S810-H814 VanDerWaalsContact O-N 3.08Å
811	S	81.5	Confident	88.1	Confident	44 Å²	44	31.6 Å²	31.6	31%	0.308	16%	0.16	S	C	.	.	H	α-helix	trans	-65.9	-33.3	-179	-28.4	0	0	0	0	111.8	E502 G809 H815	E502-S811 PolarHBondContact OE1-OG 2.74Å; G809-S811 PolarHBondContact O-N 3.18Å; S811-H815 PolarHBondContact O-N 3.22Å; S811-H815 PolarHBondContact O-ND1 3.36Å
812	Y	91.4	Very high	87.5	Confident	8 Å²	8	35.4 Å²	35.4	3%	0.031	18%	0.178	C	C	.	.	H	α-helix	trans	-67	-46.1	174.3	158.6	-92.2	0	0	0	111.9	G809 S810 H814 H815 L816 S896 Y899 F900 P901 I937	G809-Y812 WeakPolarHBondContact O-CB 3.33Å; G809-Y812 PolarHBondContact O-N 2.82Å; S810-Y812 VanDerWaalsContact C-N 3.29Å; S810-Y812 PolarHBondContact O-N 3.37Å; Y812-H814 VanDerWaalsContact C-N 3.29Å; Y812-H814 PolarHBondContact O-N 3.5Å; Y812-H815 PolarHBondContact O-N 3.13Å; Y812-L816 HydrophobicContact CE1-CD2 3.87Å; Y812-L816 VanDerWaalsContact O-CB 3.31Å; Y812-L816 WeakPolarHBondContact O-CB 3.45Å; Y812-L816 PolarHBondContact O-N 2.73Å; Y812-S896 PolarHBondContact OH-OG 2.96Å; Y812-Y899 AromaticContact CD2-CD2 3.92Å; Y812-Y899 HydrophobicContact CD2-CD2 3.92Å; Y812-Y899 AromaticContact CD2-CE2 3.82Å; Y812-Y899 HydrophobicContact CD2-CE2 3.82Å; Y812-Y899 HydrophobicContact CE2-CD2 4.36Å; Y812-Y899 HydrophobicContact CE2-CE2 4.05Å; Y812-F900 HydrophobicContact CD2-CD2 4.33Å; Y812-F900 HydrophobicContact CE1-CD2 4.43Å; Y812-F900 HydrophobicContact CE1-CE2 4.34Å; Y812-F900 HydrophobicContact CE2-CB 4.44Å; Y812-F900 AromaticContact CE2-CD2 3.6Å; Y812-F900 HydrophobicContact CE2-CD2 3.6Å; Y812-F900 HydrophobicContact CE2-CE2 4.3Å; Y812-F900 HydrophobicContact CE2-CG 4.39Å; Y812-F900 AromaticContact CZ-CD2 3.65Å; Y812-F900 AromaticContact CZ-CE2 3.93Å; Y812-P901 HydrophobicContact CG-CG 4.27Å; Y812-I937 HydrophobicContact CE1-CD1 4.42Å
813	L	91.4	Very high	87	Confident	0 Å²	0	42 Å²	42	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-59.6	-38.6	175.7	-75.9	176.7	0	0	0	112.2	G809 S810 L816 F817 L936 I937 A940 F947 L949	G809-L813 WeakPolarHBondContact O-CG 3.27Å; G809-L813 PolarHBondContact O-N 2.89Å; S810-L813 PolarHBondContact O-N 3.36Å; L813-L816 PolarHBondContact O-N 3.4Å; L813-F817 HydrophobicContact CD2-CD2 3.82Å; L813-F817 HydrophobicContact CD2-CE2 3.86Å; L813-F817 PolarHBondContact O-N 2.83Å; L813-L936 HydrophobicContact CD1-CD1 3.45Å; L813-L936 VanDerWaalsContact CD1-CD1 3.45Å; L813-L936 HydrophobicContact CD1-CG 3.77Å; L813-L936 HydrophobicContact CD2-CG 4.19Å; L813-L936 HydrophobicContact CG-CD1 4.1Å; L813-L936 HydrophobicContact CG-CD2 4.44Å; L813-L936 HydrophobicContact CG-CG 4.03Å; L813-I937 HydrophobicContact CD2-CG1 4.1Å; L813-A940 HydrophobicContact CD1-CB 3.66Å; L813-A940 HydrophobicContact CD2-CB 3.97Å; L813-A940 HydrophobicContact CG-CB 4.42Å; L813-F947 HydrophobicContact CD1-CD1 3.53Å; L813-F947 HydrophobicContact CD1-CE1 4.11Å; L813-F947 HydrophobicContact CD1-CG 4.34Å; L813-L949 HydrophobicContact CB-CD2 4.24Å
814	H	86.3	Confident	86.6	Confident	46 Å²	46	41.2 Å²	41.2	21%	0.213	20%	0.196	C	C	.	.	H	α-helix	trans	-59.8	-48	175.5	-100.9	-81.9	0	0	0	112.2	S810 Y812 H818 G948 L949	S810-H814 PolarHBondContact O-N 2.84Å; S810-H814 VanDerWaalsContact O-N 3.08Å; Y812-H814 VanDerWaalsContact C-N 3.29Å; Y812-H814 PolarHBondContact O-N 3.5Å; H814-H818 WeakPolarHBondContact O-CB 3.38Å; H814-H818 PolarHBondContact O-N 3.3Å; H814-G948 PolarHBondContact CE1-O 3.03Å; H814-G948 PolarHBondContact NE2-O 3.33Å; H814-L949 HydrophobicContact CB-CD2 4.32Å
815	H	86.3	Confident	85.8	Confident	153 Å²	153	43 Å²	43	71%	0.708	21%	0.206	S	C	*	.	H	α-helix	trans	-67.1	-37.5	177.4	-70.9	84.2	0	0	0	112.5	S811 Y812 Y899	S811-H815 PolarHBondContact O-N 3.22Å; S811-H815 PolarHBondContact O-ND1 3.36Å; Y812-H815 PolarHBondContact O-N 3.13Å; H815-Y899 HydrophobicContact CB-CE2 4.17Å
816	L	90.6	Very high	85	Confident	12 Å²	12	47.9 Å²	47.9	6%	0.063	24%	0.236	C	C	.	.	H	α-helix	trans	-72.2	-44.1	-177.8	177.3	64.7	0	0	0	113.4	Y812 L813 A892 I893	Y812-L816 HydrophobicContact CE1-CD2 3.87Å; Y812-L816 VanDerWaalsContact O-CB 3.31Å; Y812-L816 WeakPolarHBondContact O-CB 3.45Å; Y812-L816 PolarHBondContact O-N 2.73Å; L813-L816 PolarHBondContact O-N 3.4Å; L816-A892 HydrophobicContact CD1-CB 4.02Å; L816-I893 HydrophobicContact CD1-CG1 4.27Å; L816-I893 HydrophobicContact CD2-CG1 4.08Å
817	F	90.5	Very high	84.2	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-119.5	-15.9	-164.5	-71.7	-35.9	0	0	0	116.7	L813 L819 L820 I821 V889 I893 I937 L941 L949	L813-F817 HydrophobicContact CD2-CD2 3.82Å; L813-F817 HydrophobicContact CD2-CE2 3.86Å; L813-F817 PolarHBondContact O-N 2.83Å; F817-L819 PolarHBondContact O-N 3.41Å; F817-L820 PolarHBondContact O-N 3.01Å; F817-L820 VanDerWaalsContact O-N 3.12Å; F817-I821 HydrophobicContact CB-CD1 3.81Å; F817-I821 HydrophobicContact CB-CG1 4.15Å; F817-I821 HydrophobicContact CG-CD1 4.44Å; F817-I821 WeakPolarHBondContact O-CB 3.34Å; F817-I821 WeakPolarHBondContact O-CG1 3.45Å; F817-I821 PolarHBondContact O-N 3.42Å; F817-V889 HydrophobicContact CE1-CG1 4.19Å; F817-I893 HydrophobicContact CE1-CG1 4.39Å; F817-I893 HydrophobicContact CZ-CD1 4.15Å; F817-I893 HydrophobicContact CZ-CG1 4.24Å; F817-I937 HydrophobicContact CE2-CB 4.47Å; F817-I937 HydrophobicContact CE2-CG1 4.46Å; F817-I937 HydrophobicContact CE2-CG2 3.92Å; F817-I937 HydrophobicContact CZ-CG2 3.84Å; F817-L941 HydrophobicContact CD1-CD2 4.12Å; F817-L941 HydrophobicContact CD2-CD2 4.17Å; F817-L941 HydrophobicContact CD2-CG 4.42Å; F817-L941 HydrophobicContact CE1-CD2 4Å; F817-L941 HydrophobicContact CE2-CD1 4.38Å; F817-L941 HydrophobicContact CE2-CD2 4.03Å; F817-L941 HydrophobicContact CE2-CG 3.94Å; F817-L941 HydrophobicContact CG-CD2 4.23Å; F817-L941 HydrophobicContact CZ-CD1 4.04Å; F817-L941 HydrophobicContact CZ-CD2 3.96Å; F817-L941 HydrophobicContact CZ-CG 4.02Å; F817-L949 HydrophobicContact CB-CD1 4.11Å
818	H	82.8	Confident	83.5	Confident	66 Å²	66	50.4 Å²	50.4	31%	0.306	25%	0.249	S	C	.	.	H	α-helix	trans	-55.5	-50.1	-173.1	-179.4	70	0	0	0	112.8	H814 Q822 L949	H814-H818 WeakPolarHBondContact O-CB 3.38Å; H814-H818 PolarHBondContact O-N 3.3Å; H818-Q822 PolarHBondContact CE1-NE2 3.47Å; H818-Q822 PolarHBondContact NE2-NE2 3.45Å; H818-Q822 WeakPolarHBondContact O-CB 3.2Å; H818-Q822 VanDerWaalsContact O-CG 3.29Å; H818-Q822 WeakPolarHBondContact O-CG 3.46Å; H818-Q822 PolarHBondContact O-N 2.81Å; H818-Q822 VanDerWaalsContact O-N 3.11Å; H818-L949 PolarHBondContact ND1-O 3.38Å
819	L	83.2	Confident	83.1	Confident	115 Å²	115	51.6 Å²	51.6	60%	0.602	26%	0.257	S	S	*	.	H	α-helix	trans	-69.5	-36.1	177.1	-64	176.4	0	0	0	112.9	F817 R823	F817-L819 PolarHBondContact O-N 3.41Å; L819-R823 WeakPolarHBondContact O-CG 3.39Å; L819-R823 PolarHBondContact O-N 2.88Å; L819-R823 VanDerWaalsContact O-N 3.12Å
820	L	87	Confident	82.7	Confident	20 Å²	20	54.7 Å²	54.7	11%	0.105	28%	0.277	C	S	.	.	H	α-helix	trans	-66.2	-48.6	-179.6	-167.4	157.8	0	0	0	110.3	F817 Q822 R823 V824 V888 V889 A892	F817-L820 PolarHBondContact O-N 3.01Å; F817-L820 VanDerWaalsContact O-N 3.12Å; L820-Q822 PolarHBondContact O-N 2.99Å; L820-R823 PolarHBondContact O-N 3.4Å; L820-R823 VanDerWaalsContact O-N 3.13Å; L820-V824 HydrophobicContact CD2-CG2 4.1Å; L820-V824 WeakPolarHBondContact O-CG2 3.28Å; L820-V824 PolarHBondContact O-N 3.35Å; L820-V888 HydrophobicContact CD1-CG1 4.11Å; L820-V889 HydrophobicContact CD1-CB 4.41Å; L820-V889 HydrophobicContact CD1-CG2 3.68Å; L820-V889 HydrophobicContact CD2-CG2 3.64Å; L820-V889 HydrophobicContact CG-CG2 4.33Å; L820-A892 HydrophobicContact CD1-CB 4.47Å
821	I	85.9	Confident	83	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-65.6	-39.4	179.3	-66.3	177.6	0	0	0	110.5	F817 R823 V824 L825 L941 P944 L949 I950	F817-I821 HydrophobicContact CB-CD1 3.81Å; F817-I821 HydrophobicContact CB-CG1 4.15Å; F817-I821 HydrophobicContact CG-CD1 4.44Å; F817-I821 WeakPolarHBondContact O-CB 3.34Å; F817-I821 WeakPolarHBondContact O-CG1 3.45Å; F817-I821 PolarHBondContact O-N 3.42Å; I821-R823 VanDerWaalsContact C-N 3.3Å; I821-R823 PolarHBondContact O-N 3.16Å; I821-V824 PolarHBondContact O-N 3.02Å; I821-L825 HydrophobicContact CG2-CD1 3.98Å; I821-L825 HydrophobicContact CG2-CG 4.18Å; I821-L825 VanDerWaalsContact O-CG 3.32Å; I821-L825 WeakPolarHBondContact O-CG 3.4Å; I821-L825 PolarHBondContact O-N 3.28Å; I821-L941 HydrophobicContact CD1-CD2 4.27Å; I821-L941 HydrophobicContact CG1-CD2 4.4Å; I821-P944 HydrophobicContact CD1-CB 3.78Å; I821-P944 HydrophobicContact CD1-CG 3.82Å; I821-P944 HydrophobicContact CG2-CB 4.04Å; I821-P944 HydrophobicContact CG2-CG 3.91Å; I821-L949 HydrophobicContact CD1-CD1 3.69Å; I821-I950 HydrophobicContact CG2-CG2 4.05Å
822	Q	81.5	Confident	83.4	Confident	80 Å²	80	52.6 Å²	52.6	37%	0.374	26%	0.259	S	S	.	.	H	α-helix	trans	-54.8	-44.5	170.7	-78.5	172.6	-5.9	0	0	112.3	H818 L820 V824 L825 T826	H818-Q822 PolarHBondContact CE1-NE2 3.47Å; H818-Q822 PolarHBondContact NE2-NE2 3.45Å; H818-Q822 WeakPolarHBondContact O-CB 3.2Å; H818-Q822 VanDerWaalsContact O-CG 3.29Å; H818-Q822 WeakPolarHBondContact O-CG 3.46Å; H818-Q822 PolarHBondContact O-N 2.81Å; H818-Q822 VanDerWaalsContact O-N 3.11Å; L820-Q822 PolarHBondContact O-N 2.99Å; Q822-V824 VanDerWaalsContact C-N 3.29Å; Q822-V824 PolarHBondContact O-N 3.17Å; Q822-L825 PolarHBondContact O-N 3.05Å; Q822-T826 PolarHBondContact O-N 3.28Å; Q822-T826 PolarHBondContact O-OG1 3.12Å
823	R	79.9	Confident	83.4	Confident	170 Å²	170	52.2 Å²	52.2	64%	0.642	26%	0.258	S	S	*	.	H	α-helix	trans	-68.8	-21	176.2	-67.4	178.6	79.3	173.4	9.4	114.4	L819 L820 I821 T826 Y885	L819-R823 WeakPolarHBondContact O-CG 3.39Å; L819-R823 PolarHBondContact O-N 2.88Å; L819-R823 VanDerWaalsContact O-N 3.12Å; L820-R823 PolarHBondContact O-N 3.4Å; L820-R823 VanDerWaalsContact O-N 3.13Å; I821-R823 VanDerWaalsContact C-N 3.3Å; I821-R823 PolarHBondContact O-N 3.16Å; R823-T826 PolarHBondContact O-OG1 3.05Å; R823-Y885 PolarHBondContact O-OH 3.37Å
824	V	80.7	Confident	83.4	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-80.5	-37.8	170	179.3	0	0	0	0	110.5	L820 I821 Q822 C827 W831 Y885 N962 L963 L966	L820-V824 HydrophobicContact CD2-CG2 4.1Å; L820-V824 WeakPolarHBondContact O-CG2 3.28Å; L820-V824 PolarHBondContact O-N 3.35Å; I821-V824 PolarHBondContact O-N 3.02Å; Q822-V824 VanDerWaalsContact C-N 3.29Å; Q822-V824 PolarHBondContact O-N 3.17Å; V824-C827 WeakPolarHBondContact O-CB 3.45Å; V824-C827 PolarHBondContact O-N 3.28Å; V824-W831 HydrophobicContact CG1-CH2 4.03Å; V824-W831 HydrophobicContact CG2-CH2 4.15Å; V824-Y885 HydrophobicContact CG2-CD1 3.89Å; V824-Y885 HydrophobicContact CG2-CE1 3.77Å; V824-N962 HydrophobicContact CG1-CB 4.44Å; V824-L963 HydrophobicContact CB-CD2 4.34Å; V824-L963 HydrophobicContact CG1-CD2 3.9Å; V824-L963 HydrophobicContact CG1-CG 4.04Å; V824-L966 HydrophobicContact CG2-CD1 4.37Å
825	L	76.6	Confident	83.4	Confident	41 Å²	41	53.7 Å²	53.7	22%	0.215	27%	0.271	C	S	.	.	H	α-helix	trans	-74.5	-23.9	-179.1	-66.1	179.9	0	0	0	114.1	I821 Q822 C827 F828 I950 P954 C959 L963	I821-L825 HydrophobicContact CG2-CD1 3.98Å; I821-L825 HydrophobicContact CG2-CG 4.18Å; I821-L825 VanDerWaalsContact O-CG 3.32Å; I821-L825 WeakPolarHBondContact O-CG 3.4Å; I821-L825 PolarHBondContact O-N 3.28Å; Q822-L825 PolarHBondContact O-N 3.05Å; L825-C827 VanDerWaalsContact C-N 3.27Å; L825-F828 WeakPolarHBondContact O-CE1 3.32Å; L825-I950 HydrophobicContact CD1-CD1 3.81Å; L825-I950 HydrophobicContact CD1-CG2 3.78Å; L825-P954 HydrophobicContact CD2-CB 3.78Å; L825-C959 HydrophobicContact CD2-CB 4.01Å; L825-L963 HydrophobicContact CD2-CD1 4.26Å
826	T	76.2	Confident	83.5	Confident	103 Å²	103	54.9 Å²	54.9	63%	0.632	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-9.6	166.4	54.3	0	0	0	0	113.2	Q822 R823 F828	Q822-T826 PolarHBondContact O-N 3.28Å; Q822-T826 PolarHBondContact O-OG1 3.12Å; R823-T826 PolarHBondContact O-OG1 3.05Å; T826-F828 PolarHBondContact O-N 3.4Å
827	C	71.5	Confident	83.3	Confident	24 Å²	24	60.2 Å²	60.2	16%	0.162	30%	0.3	C	S	.	.			trans	-98.7	85.3	-177.4	-167	0	0	0	0	111.2	V824 L825 T829 W831	V824-C827 WeakPolarHBondContact O-CB 3.45Å; V824-C827 PolarHBondContact O-N 3.28Å; L825-C827 VanDerWaalsContact C-N 3.27Å; C827-T829 PolarHBondContact O-N 3.27Å; C827-T829 VanDerWaalsContact O-N 3.11Å; C827-T829 PolarHBondContact SG-OG1 3.17Å; C827-W831 HydrophobicContact CB-CZ2 4.43Å
828	F	71.2	Confident	83	Confident	126 Å²	126	61.3 Å²	61.3	55%	0.553	31%	0.305	S	S	*	.			trans	-74.2	7.4	-178.6	-52.3	-65.9	0	0	0	115	L825 T826 E956	L825-F828 WeakPolarHBondContact O-CE1 3.32Å; T826-F828 PolarHBondContact O-N 3.4Å; F828-E956 HydrophobicContact CD1-CG 4.11Å
829	T	78.3	Confident	83	Confident	50 Å²	50	60.7 Å²	60.7	31%	0.307	31%	0.309	S	S	.	.			trans	-78.3	125.7	176.4	54.7	0	0	0	0	109.8	C827 W831 N962	C827-T829 PolarHBondContact O-N 3.27Å; C827-T829 VanDerWaalsContact O-N 3.11Å; C827-T829 PolarHBondContact SG-OG1 3.17Å; T829-W831 PolarHBondContact O-N 2.88Å; T829-W831 PolarHBondContact O-NE1 3.44Å; T829-W831 VanDerWaalsContact O-NE1 3.16Å; T829-W831 PolarHBondContact OG1-NE1 3.11Å; T829-N962 PolarHBondContact O-ND2 2.87Å
830	P	81.5	Confident	82.5	Confident	65 Å²	65	59.9 Å²	59.9	42%	0.422	31%	0.313	S	S	.	.			trans	-75	121.9	175.9	29.2	-32.7	0	0	0	110	E832 N878 A958	P830-E832 PolarHBondContact O-N 3.48Å; P830-N878 PolarHBondContact O-ND2 3.07Å; P830-N878 PolarHBondContact O-OD1 3.06Å; P830-A958 HydrophobicContact CB-CB 4.04Å
831	W	88.7	Confident	81.9	Confident	1 Å²	1	63.8 Å²	63.8	0%	0.004	34%	0.338	C	S	.	.			trans	-90.8	45.7	175.9	-44	-22	0	0	0	110.2	V824 C827 T829 V833 M881 L882 Y885 N962 L965 L966	V824-W831 HydrophobicContact CG1-CH2 4.03Å; V824-W831 HydrophobicContact CG2-CH2 4.15Å; C827-W831 HydrophobicContact CB-CZ2 4.43Å; T829-W831 PolarHBondContact O-N 2.88Å; T829-W831 PolarHBondContact O-NE1 3.44Å; T829-W831 VanDerWaalsContact O-NE1 3.16Å; T829-W831 PolarHBondContact OG1-NE1 3.11Å; W831-V833 PolarHBondContact O-N 3.2Å; W831-M881 HydrophobicContact CD2-CB 4.5Å; W831-M881 HydrophobicContact CD2-CG 3.9Å; W831-M881 HydrophobicContact CG-CB 4.17Å; W831-M881 HydrophobicContact CG-CG 3.91Å; W831-M881 HydrophobicContact CZ2-CG 4.29Å; W831-L882 HydrophobicContact CE3-CD1 4.33Å; W831-Y885 AromaticContact CH2-CD1 3.59Å; W831-Y885 HydrophobicContact CH2-CD1 3.59Å; W831-Y885 AromaticContact CH2-CD2 3.43Å; W831-Y885 HydrophobicContact CH2-CD2 3.43Å; W831-Y885 VanDerWaalsContact CH2-CD2 3.43Å; W831-Y885 AromaticContact CH2-CE1 3.87Å; W831-Y885 HydrophobicContact CH2-CE1 3.87Å; W831-Y885 AromaticContact CH2-CE2 3.73Å; W831-Y885 HydrophobicContact CH2-CE2 3.73Å; W831-Y885 AromaticContact CH2-CG 3.33Å; W831-Y885 HydrophobicContact CH2-CG 3.33Å; W831-Y885 AromaticContact CH2-CZ 3.93Å; W831-Y885 HydrophobicContact CZ2-CD1 4.34Å; W831-Y885 AromaticContact CZ2-CD2 3.63Å; W831-Y885 HydrophobicContact CZ2-CD2 3.63Å; W831-Y885 HydrophobicContact CZ2-CE1 4.25Å; W831-Y885 AromaticContact CZ2-CE2 3.53Å; W831-Y885 HydrophobicContact CZ2-CE2 3.53Å; W831-Y885 HydrophobicContact CZ2-CG 4.03Å; W831-Y885 AromaticContact CZ2-CZ 3.84Å; W831-Y885 HydrophobicContact CZ3-CD1 4.33Å; W831-Y885 HydrophobicContact CZ3-CD2 4.04Å; W831-Y885 AromaticContact CZ3-CG 3.79Å; W831-Y885 HydrophobicContact CZ3-CG 3.79Å; W831-N962 HydrophobicContact CD2-CB 3.94Å; W831-N962 HydrophobicContact CE3-CB 3.73Å; W831-N962 HydrophobicContact CH2-CB 4.35Å; W831-N962 HydrophobicContact CZ3-CB 3.96Å; W831-N962 PolarHBondContact N-OD1 3.06Å; W831-N962 PolarHBondContact NE1-ND2 3.46Å; W831-L965 VanDerWaalsContact O-CD1 3.25Å; W831-L965 WeakPolarHBondContact O-CD1 3.28Å; W831-L966 HydrophobicContact CH2-CD1 4.41Å; W831-L966 HydrophobicContact CZ3-CD1 3.83Å; W831-L966 HydrophobicContact CZ3-CD2 4.35Å; W831-L966 HydrophobicContact CZ3-CG 4.01Å
832	E	90.4	Very high	81.5	Confident	24 Å²	24	66.5 Å²	66.5	11%	0.112	35%	0.35	C	S	.	.			trans	-70.2	124.5	-178.9	-173.9	57	-87	0	0	109.7	P830 D834 K837 L838 N878 R961	P830-E832 PolarHBondContact O-N 3.48Å; E832-D834 HydrophobicContact CG-CB 4.43Å; E832-D834 WeakPolarHBondContact OE1-CB 3.48Å; E832-D834 PolarHBondContact OE1-N 3.17Å; E832-K837 HydrophobicContact CG-CB 3.75Å; E832-L838 HydrophobicContact CB-CD2 4.1Å; E832-L838 HydrophobicContact CG-CD2 4.3Å; E832-L838 HydrophobicContact CG-CG 4.47Å; E832-N878 VanDerWaalsContact O-CB 3.27Å; E832-N878 WeakPolarHBondContact O-CB 3.38Å; E832-N878 PolarHBondContact O-ND2 3.04Å; E832-R961 VanDerWaalsContact CD-NH2 3.34Å; E832-R961 IonicContact OE1-CZ 3.43Å; E832-R961 IonicContact OE1-NE 3.66Å; E832-R961 PolarHBondContact OE1-NE 3.03Å; E832-R961 IonicContact OE1-NH2 3.28Å; E832-R961 PolarHBondContact OE1-NH2 3.48Å; E832-R961 IonicContact OE2-CZ 3.49Å; E832-R961 IonicContact OE2-NE 3.45Å; E832-R961 PolarHBondContact OE2-NE 3.06Å; E832-R961 IonicContact OE2-NH2 3.93Å; E832-R961 PolarHBondContact OE2-NH2 2.88Å
833	V	91.5	Very high	81.3	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	35%	0.345	C	S	.	.			trans	-113.9	-3.2	-174.4	-70.1	0	0	0	0	112.4	W831 P835 L875 N878 Q879 L882 L965 Y985 M986 F988	W831-V833 PolarHBondContact O-N 3.2Å; V833-P835 WeakPolarHBondContact O-CD 3.46Å; V833-L875 WeakPolarHBondContact O-CD1 3.29Å; V833-N878 HydrophobicContact CG1-CB 4.4Å; V833-Q879 HydrophobicContact CB-CG 4.15Å; V833-Q879 HydrophobicContact CG1-CB 4.3Å; V833-Q879 HydrophobicContact CG1-CG 3.62Å; V833-L882 HydrophobicContact CG1-CD2 4.05Å; V833-L882 HydrophobicContact CG2-CD2 4.07Å; V833-L965 HydrophobicContact CG2-CD1 4.17Å; V833-L965 HydrophobicContact CG2-CD2 3.96Å; V833-Y985 HydrophobicContact CG2-CD2 4.03Å; V833-M986 HydrophobicContact CG2-SD 4.1Å; V833-F988 HydrophobicContact CB-CE1 4.11Å; V833-F988 HydrophobicContact CG1-CE1 4.15Å; V833-F988 HydrophobicContact CG1-CZ 4.04Å; V833-F988 HydrophobicContact CG2-CE1 4.4Å
834	D	90.1	Very high	80.5	Confident	13 Å²	13	61.5 Å²	61.5	7%	0.07	35%	0.345	C	S	.	.			trans	-83.1	113.1	174.7	-171.8	-27.7	0	0	0	110.8	E832 E836 K837 Y985	E832-D834 HydrophobicContact CG-CB 4.43Å; E832-D834 WeakPolarHBondContact OE1-CB 3.48Å; E832-D834 PolarHBondContact OE1-N 3.17Å; D834-E836 PolarHBondContact O-N 3.42Å; D834-E836 WeakPolarHBondContact OD1-CB 3.41Å; D834-E836 PolarHBondContact OD1-N 3.06Å; D834-K837 HydrophobicContact CB-CB 4.28Å; D834-K837 HydrophobicContact CB-CD 4Å; D834-K837 HydrophobicContact CB-CG 4.23Å; D834-K837 PolarHBondContact O-N 3.41Å; D834-K837 IonicContact OD2-NZ 2.95Å; D834-K837 PolarHBondContact OD2-NZ 2.8Å; D834-Y985 HydrophobicContact CB-CD2 4.19Å; D834-Y985 HydrophobicContact CB-CG 4.19Å
835	P	87.3	Confident	80	Confident	65 Å²	65	64 Å²	64	42%	0.422	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-62.1	-25	-177.3	-22.9	34.8	0	0	0	114	V833 K837 L838 L875	V833-P835 WeakPolarHBondContact O-CD 3.46Å; P835-K837 PolarHBondContact O-N 3.07Å; P835-L838 PolarHBondContact O-N 3.21Å; P835-L875 HydrophobicContact CG-CD2 4.16Å
836	E	87.3	Confident	80.1	Confident	177 Å²	177	64 Å²	64	83%	0.827	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-75.3	-11.5	178.2	-59.2	-175.6	173.7	0	0	112.8	D834	D834-E836 PolarHBondContact O-N 3.42Å; D834-E836 WeakPolarHBondContact OD1-CB 3.41Å; D834-E836 PolarHBondContact OD1-N 3.06Å
837	K	86.1	Confident	80.4	Confident	124 Å²	124	62.2 Å²	62.2	54%	0.539	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-106.6	-0.5	179.9	-64.8	176.7	179.1	57.4	0	113	E832 D834 P835	E832-K837 HydrophobicContact CG-CB 3.75Å; D834-K837 HydrophobicContact CB-CB 4.28Å; D834-K837 HydrophobicContact CB-CD 4Å; D834-K837 HydrophobicContact CB-CG 4.23Å; D834-K837 PolarHBondContact O-N 3.41Å; D834-K837 IonicContact OD2-NZ 2.95Å; D834-K837 PolarHBondContact OD2-NZ 2.8Å; P835-K837 PolarHBondContact O-N 3.07Å
838	L	85.3	Confident	81.1	Confident	23 Å²	23	61.3 Å²	61.3	12%	0.12	37%	0.366	C	S	.	.	S	Bend	trans	-106.1	153.8	177.8	-67.1	176.6	0	0	0	110.4	E832 P835 Q842 L875	E832-L838 HydrophobicContact CB-CD2 4.1Å; E832-L838 HydrophobicContact CG-CD2 4.3Å; E832-L838 HydrophobicContact CG-CG 4.47Å; P835-L838 PolarHBondContact O-N 3.21Å; L838-Q842 HydrophobicContact CB-CB 4.12Å; L838-Q842 HydrophobicContact CD2-CB 4.37Å; L838-L875 HydrophobicContact CD1-CB 3.73Å; L838-L875 HydrophobicContact CD1-CD1 3.76Å; L838-L875 HydrophobicContact CD1-CG 4.28Å
839	S	82.5	Confident	81.9	Confident	54 Å²	54	57.2 Å²	57.2	38%	0.378	35%	0.353	S	S	.	.			trans	-72.7	156.1	168	62.8	0	0	0	0	111	T841 Q842 C843	S839-T841 PolarHBondContact O-N 3.16Å; S839-T841 PolarHBondContact OG-OG1 2.96Å; S839-Q842 WeakPolarHBondContact O-CB 3.43Å; S839-Q842 PolarHBondContact O-N 3.27Å; S839-Q842 WeakPolarHBondContact OG-CG 3.45Å; S839-Q842 PolarHBondContact OG-OE1 2.89Å; S839-C843 PolarHBondContact O-N 3.4Å
840	S	72.7	Confident	82.2	Confident	98 Å²	98	57 Å²	57	69%	0.685	36%	0.356	S	S	*	.	H	α-helix	trans	-55.9	-35.5	-179.8	51.1	0	0	0	0	113.1	Q842 C843 T844	S840-Q842 VanDerWaalsContact C-N 3.27Å; S840-Q842 PolarHBondContact O-N 3.29Å; S840-C843 PolarHBondContact O-N 3.02Å; S840-T844 PolarHBondContact O-N 3.03Å
841	T	73.5	Confident	82.5	Confident	102 Å²	102	59 Å²	59	63%	0.626	37%	0.368	S	S	*	.	H	α-helix	trans	-72.7	-11.2	175.7	48.6	0	0	0	0	114.6	S839 T844	S839-T841 PolarHBondContact O-N 3.16Å; S839-T841 PolarHBondContact OG-OG1 2.96Å; T841-T844 PolarHBondContact O-OG1 2.86Å
842	Q	77.5	Confident	82.4	Confident	57 Å²	57	61.6 Å²	61.6	27%	0.266	38%	0.382	S	S	.	.	H	α-helix	trans	-90	-23.4	169.4	-66.7	170.4	-82.3	0	0	111.7	L838 S839 S840 G873 T874 L875	L838-Q842 HydrophobicContact CB-CB 4.12Å; L838-Q842 HydrophobicContact CD2-CB 4.37Å; S839-Q842 WeakPolarHBondContact O-CB 3.43Å; S839-Q842 PolarHBondContact O-N 3.27Å; S839-Q842 WeakPolarHBondContact OG-CG 3.45Å; S839-Q842 PolarHBondContact OG-OE1 2.89Å; S840-Q842 VanDerWaalsContact C-N 3.27Å; S840-Q842 PolarHBondContact O-N 3.29Å; Q842-G873 WeakPolarHBondContact CB-O 3.34Å; Q842-G873 VanDerWaalsContact CG-O 3.28Å; Q842-G873 WeakPolarHBondContact CG-O 3.41Å; Q842-G873 PolarHBondContact NE2-O 3.01Å; Q842-T874 CarbonylContact O-C 3.5Å; Q842-T874 WeakPolarHBondContact O-CA 3.5Å; Q842-L875 PolarHBondContact O-N 2.65Å
843	C	78.6	Confident	82.4	Confident	39 Å²	39	60.5 Å²	60.5	26%	0.264	38%	0.376	S	S	.	.	H	α-helix	trans	-84.7	-15.1	176.6	-64.6	0	0	0	0	113.4	S839 S840 G845 G846	S839-C843 PolarHBondContact O-N 3.4Å; S840-C843 PolarHBondContact O-N 3.02Å; C843-G845 PolarHBondContact O-N 3.43Å; C843-G846 PolarHBondContact O-N 3.42Å
844	T	63.9	Low	82.3	Confident	105 Å²	105	61.8 Å²	61.8	64%	0.644	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	89.7	171.7	47.9	0	0	0	0	110.9	S840 T841	S840-T844 PolarHBondContact O-N 3.03Å; T841-T844 PolarHBondContact O-OG1 2.86Å
845	G	68.1	Low	82.1	Confident	52 Å²	52	63.3 Å²	63.3	54%	0.536	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	161.9	-13.4	-173.9	0	0	0	0	0	113.2	C843	C843-G845 PolarHBondContact O-N 3.43Å
846	G	79.1	Confident	82.1	Confident	41 Å²	41	60.9 Å²	60.9	42%	0.423	38%	0.384	S	S	.	.			trans	85	-163.7	178.2	0	0	0	0	0	113.3	C843	C843-G846 PolarHBondContact O-N 3.42Å
847	S	84	Confident	82.1	Confident	66 Å²	66	52.8 Å²	52.8	46%	0.462	35%	0.348	S	S	.	.			trans	-130.1	148.4	176.9	174.8	0	0	0	0	108.3	Q879	S847-Q879 PolarHBondContact OG-NE2 2.87Å; S847-Q879 PolarHBondContact OG-OE1 3.21Å
848	L	85.6	Confident	82.1	Confident	5 Å²	5	52.5 Å²	52.5	3%	0.026	35%	0.352	C	S	.	.			trans	-56.4	143	162.1	-63.9	-179.2	0	0	0	109.8	D852 T853 M863 I876 Q879 I880 L883 F988	L848-D852 HydrophobicContact CD2-CB 4.19Å; L848-T853 HydrophobicContact CB-CG2 4.21Å; L848-T853 HydrophobicContact CD1-CG2 4.01Å; L848-M863 HydrophobicContact CD2-CE 4.18Å; L848-I876 HydrophobicContact CD2-CD1 4.1Å; L848-I876 HydrophobicContact CD2-CG1 3.91Å; L848-I876 HydrophobicContact CG-CG1 4.11Å; L848-Q879 HydrophobicContact CD1-CB 4.02Å; L848-Q879 HydrophobicContact CG-CB 4.25Å; L848-I880 HydrophobicContact CD1-CG1 3.92Å; L848-I880 HydrophobicContact CD2-CG1 4.15Å; L848-I880 HydrophobicContact CG-CG1 4.38Å; L848-L883 HydrophobicContact CD1-CD2 4.26Å; L848-F988 HydrophobicContact CB-CB 4.21Å; L848-F988 HydrophobicContact CB-CD2 4.05Å; L848-F988 HydrophobicContact CD1-CD2 4.05Å; L848-F988 HydrophobicContact CD1-CE2 4.34Å; L848-F988 VanDerWaalsContact O-CB 3.27Å; L848-F988 WeakPolarHBondContact O-CB 3.45Å
849	S	86.9	Confident	82	Confident	41 Å²	41	53.5 Å²	53.5	29%	0.287	36%	0.36	S	S	.	.			trans	-89.1	165.5	168	71.3	0	0	0	0	111.1	T851 D852 T853	S849-T851 PolarHBondContact O-N 3.49Å; S849-T851 PolarHBondContact OG-N 3.28Å; S849-T851 PolarHBondContact OG-OG1 3.1Å; S849-D852 WeakPolarHBondContact CA-OD2 3.23Å; S849-D852 VanDerWaalsContact CB-OD2 3.29Å; S849-D852 WeakPolarHBondContact CB-OD2 3.1Å; S849-D852 PolarHBondContact N-OD2 3.48Å; S849-D852 PolarHBondContact O-N 3.44Å; S849-D852 PolarHBondContact OG-N 3.47Å; S849-D852 VanDerWaalsContact OG-N 3.16Å; S849-D852 PolarHBondContact OG-OD1 3.22Å; S849-D852 PolarHBondContact OG-OD2 3.31Å; S849-T853 PolarHBondContact O-N 2.91Å
850	A	86.4	Confident	81.7	Confident	45 Å²	45	52.5 Å²	52.5	37%	0.372	35%	0.352	S	S	.	.	H	α-helix	trans	-62.9	-29.6	171.1	0	0	0	0	0	112.1	T853 A854 G991	A850-T853 PolarHBondContact O-OG1 2.93Å; A850-A854 WeakPolarHBondContact O-CB 3.27Å; A850-A854 PolarHBondContact O-N 3.45Å; A850-G991 WeakPolarHBondContact O-CA 3.05Å
851	T	86.4	Confident	81.3	Confident	108 Å²	108	49.5 Å²	49.5	66%	0.663	34%	0.337	S	S	*	.	H	α-helix	trans	-65	-39.1	173.5	23.2	0	0	0	0	112.4	S849 A854 A855	S849-T851 PolarHBondContact O-N 3.49Å; S849-T851 PolarHBondContact OG-N 3.28Å; S849-T851 PolarHBondContact OG-OG1 3.1Å; T851-A854 PolarHBondContact O-N 2.9Å; T851-A855 WeakPolarHBondContact O-CB 3.14Å; T851-A855 PolarHBondContact O-N 2.89Å
852	D	87.5	Confident	80.7	Confident	55 Å²	55	48.9 Å²	48.9	29%	0.294	33%	0.33	S	S	.	.	H	α-helix	trans	-67.9	-39.6	178.6	-53.5	-44.1	0	0	0	111.8	L848 S849 A855 Y856 M863	L848-D852 HydrophobicContact CD2-CB 4.19Å; S849-D852 WeakPolarHBondContact CA-OD2 3.23Å; S849-D852 VanDerWaalsContact CB-OD2 3.29Å; S849-D852 WeakPolarHBondContact CB-OD2 3.1Å; S849-D852 PolarHBondContact N-OD2 3.48Å; S849-D852 PolarHBondContact O-N 3.44Å; S849-D852 PolarHBondContact OG-N 3.47Å; S849-D852 VanDerWaalsContact OG-N 3.16Å; S849-D852 PolarHBondContact OG-OD1 3.22Å; S849-D852 PolarHBondContact OG-OD2 3.31Å; D852-A855 PolarHBondContact O-N 3.45Å; D852-Y856 PolarHBondContact O-N 2.95Å; D852-M863 HydrophobicContact CB-CE 3.83Å; D852-M863 HydrophobicContact CB-SD 4.44Å
853	T	89.8	Confident	79.9	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-75.9	-28.6	178.9	69.7	0	0	0	0	112.7	L848 S849 A850 A857 L883 F988 G991 Y992	L848-T853 HydrophobicContact CB-CG2 4.21Å; L848-T853 HydrophobicContact CD1-CG2 4.01Å; S849-T853 PolarHBondContact O-N 2.91Å; A850-T853 PolarHBondContact O-OG1 2.93Å; T853-A857 PolarHBondContact O-N 2.97Å; T853-A857 VanDerWaalsContact O-N 3.08Å; T853-L883 HydrophobicContact CG2-CD2 3.91Å; T853-F988 WeakPolarHBondContact CB-O 3.33Å; T853-F988 HydrophobicContact CG2-CD2 3.99Å; T853-F988 WeakPolarHBondContact CG2-O 3.4Å; T853-F988 PolarHBondContact OG1-O 2.75Å; T853-G991 PolarHBondContact OG1-N 3.08Å; T853-Y992 PolarHBondContact OG1-N 2.87Å
854	A	88.9	Confident	78.7	Confident	27 Å²	27	47.7 Å²	47.7	22%	0.223	32%	0.323	C	S	.	.	H	α-helix	trans	-67.1	-41.9	167.3	0	0	0	0	0	111.9	A850 T851 Y856 A857 L858	A850-A854 WeakPolarHBondContact O-CB 3.27Å; A850-A854 PolarHBondContact O-N 3.45Å; T851-A854 PolarHBondContact O-N 2.9Å; A854-Y856 VanDerWaalsContact C-N 3.35Å; A854-Y856 PolarHBondContact O-N 3.46Å; A854-A857 WeakPolarHBondContact O-CB 3.5Å; A854-A857 PolarHBondContact O-N 3.23Å; A854-A857 VanDerWaalsContact O-N 3.14Å; A854-L858 PolarHBondContact O-N 2.91Å
855	A	86.5	Confident	78.3	Confident	46 Å²	46	48.6 Å²	48.6	38%	0.38	32%	0.318	S	S	.	.	H	α-helix	trans	-62.9	-39.7	174.6	0	0	0	0	0	112.2	T851 D852 A857 L858 S859 M863	T851-A855 WeakPolarHBondContact O-CB 3.14Å; T851-A855 PolarHBondContact O-N 2.89Å; D852-A855 PolarHBondContact O-N 3.45Å; A855-A857 VanDerWaalsContact C-N 3.33Å; A855-A857 PolarHBondContact O-N 3.04Å; A855-L858 PolarHBondContact O-N 2.89Å; A855-S859 PolarHBondContact O-N 2.84Å; A855-M863 HydrophobicContact CB-CG 4.46Å
856	Y	88.2	Confident	77.6	Confident	13 Å²	13	52.6 Å²	52.6	5%	0.051	33%	0.327	C	S	.	.	H	α-helix	trans	-60.8	-39.3	171.4	-177.5	-84.8	0	0	0	112.3	D852 A854 L858 S859 P860 M863 L864 L883 R884 D887 Y992	D852-Y856 PolarHBondContact O-N 2.95Å; A854-Y856 VanDerWaalsContact C-N 3.35Å; A854-Y856 PolarHBondContact O-N 3.46Å; Y856-L858 VanDerWaalsContact C-N 3.3Å; Y856-L858 PolarHBondContact O-N 2.88Å; Y856-S859 CarbonylContact O-C 3.55Å; Y856-S859 PolarHBondContact O-N 3.04Å; Y856-P860 HydrophobicContact CE1-CB 4.23Å; Y856-P860 HydrophobicContact CE1-CG 4.4Å; Y856-P860 HydrophobicContact CE2-CB 3.98Å; Y856-P860 WeakPolarHBondContact O-CA 3.41Å; Y856-P860 VanDerWaalsContact O-CD 3.31Å; Y856-P860 WeakPolarHBondContact O-CD 3.45Å; Y856-P860 WeakPolarHBondContact O-CG 3.36Å; Y856-P860 VanDerWaalsContact O-N 3.13Å; Y856-M863 HydrophobicContact CD2-CB 3.9Å; Y856-L864 HydrophobicContact CE2-CD2 4.1Å; Y856-L883 HydrophobicContact CD1-CD1 4.06Å; Y856-L883 HydrophobicContact CD1-CD2 3.8Å; Y856-L883 HydrophobicContact CD1-CG 3.76Å; Y856-L883 HydrophobicContact CD2-CD2 4.11Å; Y856-L883 HydrophobicContact CE1-CD1 4.45Å; Y856-L883 HydrophobicContact CE1-CD2 4.44Å; Y856-L883 HydrophobicContact CE1-CG 4.01Å; Y856-L883 HydrophobicContact CG-CD2 3.64Å; Y856-L883 HydrophobicContact CG-CG 4.11Å; Y856-R884 HydrophobicContact CE2-CG 4.47Å; Y856-D887 HydrophobicContact CE1-CB 3.79Å; Y856-D887 PolarHBondContact OH-OD2 3.22Å; Y856-Y992 HydrophobicContact CD1-CD2 4.01Å; Y856-Y992 HydrophobicContact CD1-CE2 4.08Å; Y856-Y992 HydrophobicContact CE1-CE2 4.28Å
857	A	86.8	Confident	76.6	Confident	8 Å²	8	53.2 Å²	53.2	7%	0.066	32%	0.318	C	S	.	.	H	α-helix	trans	-63.6	-35.5	178.5	0	0	0	0	0	112.9	T853 A854 A855 Y992 Y995	T853-A857 PolarHBondContact O-N 2.97Å; T853-A857 VanDerWaalsContact O-N 3.08Å; A854-A857 WeakPolarHBondContact O-CB 3.5Å; A854-A857 PolarHBondContact O-N 3.23Å; A854-A857 VanDerWaalsContact O-N 3.14Å; A855-A857 VanDerWaalsContact C-N 3.33Å; A855-A857 PolarHBondContact O-N 3.04Å; A857-Y992 HydrophobicContact CB-CD2 3.54Å; A857-Y992 HydrophobicContact CB-CE2 4.01Å; A857-Y992 HydrophobicContact CB-CG 4.3Å; A857-Y995 HydrophobicContact CB-CD1 3.59Å; A857-Y995 HydrophobicContact CB-CE1 4.29Å; A857-Y995 HydrophobicContact CB-CG 3.86Å
858	L	85.9	Confident	75.1	Confident	118 Å²	118	58.9 Å²	58.9	62%	0.618	33%	0.33	S	S	*	.	H	α-helix	trans	-73.6	-44.6	174.9	-79.5	157.2	0	0	0	112.6	A854 A855 Y856 Y995	A854-L858 PolarHBondContact O-N 2.91Å; A855-L858 PolarHBondContact O-N 2.89Å; Y856-L858 VanDerWaalsContact C-N 3.3Å; Y856-L858 PolarHBondContact O-N 2.88Å; L858-Y995 HydrophobicContact CD2-CE2 3.74Å; L858-Y995 VanDerWaalsContact CD2-OH 3.3Å; L858-Y995 WeakPolarHBondContact CD2-OH 3.36Å; L858-Y995 HydrophobicContact CG-CE2 3.86Å
859	S	82.9	Confident	73.6	Confident	44 Å²	44	63.9 Å²	63.9	31%	0.308	37%	0.365	S	S	.	.			trans	-147	92.5	-179.1	-172	0	0	0	0	111.8	A855 Y856 G861 N862	A855-S859 PolarHBondContact O-N 2.84Å; Y856-S859 CarbonylContact O-C 3.55Å; Y856-S859 PolarHBondContact O-N 3.04Å; S859-G861 VanDerWaalsContact C-N 3.26Å; S859-G861 PolarHBondContact O-N 3.12Å; S859-N862 PolarHBondContact O-N 3.26Å; S859-N862 PolarHBondContact OG-ND2 3.42Å
860	P	76	Confident	72.2	Confident	32 Å²	32	64.1 Å²	64.1	21%	0.208	36%	0.363	C	S	.	.	H	α-helix	trans	-56.5	-39.5	179.6	-27.1	33.8	0	0	0	112.9	Y856 N862 L864 R891	Y856-P860 HydrophobicContact CE1-CB 4.23Å; Y856-P860 HydrophobicContact CE1-CG 4.4Å; Y856-P860 HydrophobicContact CE2-CB 3.98Å; Y856-P860 WeakPolarHBondContact O-CA 3.41Å; Y856-P860 VanDerWaalsContact O-CD 3.31Å; Y856-P860 WeakPolarHBondContact O-CD 3.45Å; Y856-P860 WeakPolarHBondContact O-CG 3.36Å; Y856-P860 VanDerWaalsContact O-N 3.13Å; P860-N862 VanDerWaalsContact C-N 3.33Å; P860-N862 PolarHBondContact O-N 3.32Å; P860-L864 WeakPolarHBondContact O-CG 3.28Å; P860-R891 VanDerWaalsContact CG-NH2 3.27Å
861	G	65.2	Low	71	Confident	36 Å²	36	67.8 Å²	67.8	37%	0.371	38%	0.375	S	S	.	.	H	α-helix	trans	-68.1	-24.5	-175.5	0	0	0	0	0	115.1	S859	S859-G861 VanDerWaalsContact C-N 3.26Å; S859-G861 PolarHBondContact O-N 3.12Å
862	N	61.6	Low	70.1	Confident	89 Å²	89	67 Å²	67	48%	0.476	37%	0.369	S	S	.	.	H	α-helix	trans	-83.3	-40.6	-177.6	-77.4	-20	0	0	0	112.6	S859 P860 L864 K865	S859-N862 PolarHBondContact O-N 3.26Å; S859-N862 PolarHBondContact OG-ND2 3.42Å; P860-N862 VanDerWaalsContact C-N 3.33Å; P860-N862 PolarHBondContact O-N 3.32Å; N862-L864 PolarHBondContact O-N 3.2Å; N862-K865 WeakPolarHBondContact O-CB 3.37Å; N862-K865 PolarHBondContact O-N 3.47Å; N862-K865 VanDerWaalsContact O-N 3.09Å; N862-K865 PolarHBondContact OD1-NZ 3.05Å
863	M	59.4	Low	69.4	Low	19 Å²	19	65.3 Å²	65.3	9%	0.094	37%	0.366	C	S	.	.	H	α-helix	trans	-60.5	-28.8	177.3	-94.6	-68.5	-70.9	0	0	113.4	L848 D852 A855 Y856 K865	L848-M863 HydrophobicContact CD2-CE 4.18Å; D852-M863 HydrophobicContact CB-CE 3.83Å; D852-M863 HydrophobicContact CB-SD 4.44Å; A855-M863 HydrophobicContact CB-CG 4.46Å; Y856-M863 HydrophobicContact CD2-CB 3.9Å; M863-K865 VanDerWaalsContact C-N 3.28Å; M863-K865 PolarHBondContact O-N 3.19Å
864	L	54	Low	69.2	Low	52 Å²	52	66.3 Å²	66.3	27%	0.272	37%	0.371	S	S	.	.	H	α-helix	trans	-74.3	-16.4	179.1	-53.4	-169.4	0	0	0	113.6	Y856 P860 N862 I880	Y856-L864 HydrophobicContact CE2-CD2 4.1Å; P860-L864 WeakPolarHBondContact O-CG 3.28Å; N862-L864 PolarHBondContact O-N 3.2Å; L864-I880 HydrophobicContact CD2-CG2 4.42Å
865	K	55.9	Low	69.1	Low	124 Å²	124	65.5 Å²	65.5	54%	0.539	36%	0.363	S	S	.	.	H	α-helix	trans	-75.3	-45	176.5	-64.1	172.8	-177	168.7	0	110.9	N862 M863 H867 R868	N862-K865 WeakPolarHBondContact O-CB 3.37Å; N862-K865 PolarHBondContact O-N 3.47Å; N862-K865 VanDerWaalsContact O-N 3.09Å; N862-K865 PolarHBondContact OD1-NZ 3.05Å; M863-K865 VanDerWaalsContact C-N 3.28Å; M863-K865 PolarHBondContact O-N 3.19Å; K865-H867 VanDerWaalsContact C-N 3.31Å; K865-H867 PolarHBondContact O-N 3.29Å; K865-R868 WeakPolarHBondContact O-CB 3.32Å; K865-R868 PolarHBondContact O-N 3.38Å
866	N	52.7	Low	69.2	Low	136 Å²	136	64.8 Å²	64.8	73%	0.727	35%	0.353	S	S	*	.	H	α-helix	trans	-65.4	-32.5	-177.5	-66.9	0.9	0	0	0	113.1
867	H	58.2	Low	69.1	Low	54 Å²	54	64.3 Å²	64.3	25%	0.25	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	27.3	176.9	-65.4	-72.8	0	0	0	113.2	K865 S869 I870 I880	K865-H867 VanDerWaalsContact C-N 3.31Å; K865-H867 PolarHBondContact O-N 3.29Å; H867-S869 CarbonylContact O-C 3.52Å; H867-S869 PolarHBondContact O-N 2.98Å; H867-I870 HydrophobicContact CB-CG1 4.14Å; H867-I870 WeakPolarHBondContact O-CG1 3.07Å; H867-I870 PolarHBondContact O-N 2.9Å; H867-I870 VanDerWaalsContact O-N 3.08Å; H867-I880 HydrophobicContact CB-CD1 3.95Å
868	R	51.6	Low	69.2	Low	185 Å²	185	64.2 Å²	64.2	70%	0.698	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.3	-29.7	-172.9	-107.4	179.5	172.3	-165.9	-5.9	114.8	D19 K865 I870	D19-R868 IonicContact OD2-CZ 3.3Å; D19-R868 IonicContact OD2-NH2 2.84Å; D19-R868 PolarHBondContact OD2-NH2 3.43Å; K865-R868 WeakPolarHBondContact O-CB 3.32Å; K865-R868 PolarHBondContact O-N 3.38Å; R868-I870 PolarHBondContact O-N 2.65Å
869	S	54.4	Low	69.5	Low	109 Å²	109	58.8 Å²	58.8	76%	0.762	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	47.6	173.3	52.5	0	0	0	0	114.7	H867 I871	H867-S869 CarbonylContact O-C 3.52Å; H867-S869 PolarHBondContact O-N 2.98Å; S869-I871 PolarHBondContact O-N 3.41Å
870	I	59.1	Low	69.8	Low	47 Å²	47	57 Å²	57	24%	0.241	31%	0.309	C	S	.	.			trans	-63.9	102.8	179.1	-47.7	-173.6	0	0	0	111	H867 R868 T872 I880	H867-I870 HydrophobicContact CB-CG1 4.14Å; H867-I870 WeakPolarHBondContact O-CG1 3.07Å; H867-I870 PolarHBondContact O-N 2.9Å; H867-I870 VanDerWaalsContact O-N 3.08Å; R868-I870 PolarHBondContact O-N 2.65Å; I870-T872 PolarHBondContact O-N 3.26Å; I870-I880 HydrophobicContact CD1-CB 4.45Å; I870-I880 HydrophobicContact CD1-CD1 4.14Å; I870-I880 HydrophobicContact CD1-CG2 3.79Å
871	I	59.9	Low	70.5	Confident	122 Å²	122	57.4 Å²	57.4	63%	0.626	31%	0.309	S	S	*	.			trans	-74	105.6	167.5	-56	177.7	0	0	0	108	S869 T874	S869-I871 PolarHBondContact O-N 3.41Å; I871-T874 HydrophobicContact CB-CG2 3.88Å; I871-T874 HydrophobicContact CG2-CG2 3.9Å; I871-T874 PolarHBondContact O-N 3.03Å; I871-T874 PolarHBondContact O-OG1 3.2Å
872	T	67.7	Low	71.8	Confident	90 Å²	90	55.7 Å²	55.7	55%	0.552	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	139.3	176	43.5	0	0	0	0	110.9	I870 M881	I870-T872 PolarHBondContact O-N 3.26Å; T872-M881 HydrophobicContact CG2-CE 4.47Å
873	G	72	Confident	73.3	Confident	21 Å²	21	51.5 Å²	51.5	22%	0.216	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.6	-7.5	-174.9	0	0	0	0	0	115.2	Q842 N878	Q842-G873 WeakPolarHBondContact CB-O 3.34Å; Q842-G873 VanDerWaalsContact CG-O 3.28Å; Q842-G873 WeakPolarHBondContact CG-O 3.41Å; Q842-G873 PolarHBondContact NE2-O 3.01Å; G873-N878 VanDerWaalsContact CA-OD1 3.27Å; G873-N878 WeakPolarHBondContact CA-OD1 3.07Å; G873-N878 PolarHBondContact N-OD1 3.19Å
874	T	85.5	Confident	74.8	Confident	20 Å²	20	54.4 Å²	54.4	12%	0.123	28%	0.279	C	S	.	.	S	Bend	trans	-75.9	155	163.7	60.4	0	0	0	0	110.9	Q842 I871 I876 G877 N878	Q842-T874 CarbonylContact O-C 3.5Å; Q842-T874 WeakPolarHBondContact O-CA 3.5Å; I871-T874 HydrophobicContact CB-CG2 3.88Å; I871-T874 HydrophobicContact CG2-CG2 3.9Å; I871-T874 PolarHBondContact O-N 3.03Å; I871-T874 PolarHBondContact O-OG1 3.2Å; T874-I876 PolarHBondContact O-N 2.96Å; T874-G877 PolarHBondContact O-N 2.75Å; T874-G877 VanDerWaalsContact O-N 3.17Å; T874-G877 PolarHBondContact OG1-N 2.77Å; T874-G877 VanDerWaalsContact OG1-N 3.15Å; T874-N878 WeakPolarHBondContact O-CB 3.35Å; T874-N878 PolarHBondContact O-N 2.85Å; T874-N878 PolarHBondContact O-OD1 3.06Å
875	L	87.9	Confident	76.6	Confident	10 Å²	10	54.1 Å²	54.1	5%	0.052	27%	0.274	C	S	.	.	H	α-helix	trans	-52.3	-53.2	177.2	174.2	58	0	0	0	111.4	V833 P835 L838 Q842 G877 N878 Q879	V833-L875 WeakPolarHBondContact O-CD1 3.29Å; P835-L875 HydrophobicContact CG-CD2 4.16Å; L838-L875 HydrophobicContact CD1-CB 3.73Å; L838-L875 HydrophobicContact CD1-CD1 3.76Å; L838-L875 HydrophobicContact CD1-CG 4.28Å; Q842-L875 PolarHBondContact O-N 2.65Å; L875-G877 PolarHBondContact O-N 3.08Å; L875-N878 PolarHBondContact O-N 2.88Å; L875-Q879 HydrophobicContact CD1-CG 4.16Å; L875-Q879 WeakPolarHBondContact O-CB 3.37Å; L875-Q879 VanDerWaalsContact O-CG 3.28Å; L875-Q879 WeakPolarHBondContact O-CG 3.39Å; L875-Q879 PolarHBondContact O-N 2.68Å
876	I	87.6	Confident	78.4	Confident	31 Å²	31	48.3 Å²	48.3	16%	0.159	25%	0.249	C	C	.	.	H	α-helix	trans	-65.2	-36.4	180	-163.2	165.9	0	0	0	112.3	L848 T874 Q879 I880	L848-I876 HydrophobicContact CD2-CD1 4.1Å; L848-I876 HydrophobicContact CD2-CG1 3.91Å; L848-I876 HydrophobicContact CG-CG1 4.11Å; T874-I876 PolarHBondContact O-N 2.96Å; I876-Q879 PolarHBondContact O-N 2.72Å; I876-I880 HydrophobicContact CG1-CD1 4.33Å; I876-I880 VanDerWaalsContact O-CG1 3.25Å; I876-I880 WeakPolarHBondContact O-CG1 3.44Å; I876-I880 PolarHBondContact O-N 2.99Å
877	G	86.4	Confident	80.4	Confident	4 Å²	4	42.1 Å²	42.1	4%	0.041	22%	0.216	C	C	.	.	H	α-helix	trans	-65.3	-40	173.8	0	0	0	0	0	113.1	T874 L875 I880 M881	T874-G877 PolarHBondContact O-N 2.75Å; T874-G877 VanDerWaalsContact O-N 3.17Å; T874-G877 PolarHBondContact OG1-N 2.77Å; T874-G877 VanDerWaalsContact OG1-N 3.15Å; L875-G877 PolarHBondContact O-N 3.08Å; G877-I880 PolarHBondContact O-N 3.41Å; G877-M881 WeakPolarHBondContact O-CB 3.11Å; G877-M881 PolarHBondContact O-N 3.37Å
878	N	90.5	Very high	82	Confident	5 Å²	5	43.2 Å²	43.2	3%	0.027	23%	0.226	C	C	.	.	H	α-helix	trans	-67.8	-41	175.9	-66.5	-4.5	0	0	0	111.4	P830 E832 V833 G873 T874 L875 M881 L882	P830-N878 PolarHBondContact O-ND2 3.07Å; P830-N878 PolarHBondContact O-OD1 3.06Å; E832-N878 VanDerWaalsContact O-CB 3.27Å; E832-N878 WeakPolarHBondContact O-CB 3.38Å; E832-N878 PolarHBondContact O-ND2 3.04Å; V833-N878 HydrophobicContact CG1-CB 4.4Å; G873-N878 VanDerWaalsContact CA-OD1 3.27Å; G873-N878 WeakPolarHBondContact CA-OD1 3.07Å; G873-N878 PolarHBondContact N-OD1 3.19Å; T874-N878 WeakPolarHBondContact O-CB 3.35Å; T874-N878 PolarHBondContact O-N 2.85Å; T874-N878 PolarHBondContact O-OD1 3.06Å; L875-N878 PolarHBondContact O-N 2.88Å; N878-M881 PolarHBondContact O-N 3.17Å; N878-L882 PolarHBondContact O-N 3.39Å
879	Q	92.1	Very high	84	Confident	4 Å²	4	34.4 Å²	34.4	2%	0.019	19%	0.193	C	C	.	.	H	α-helix	trans	-61.7	-44.8	173.8	-74.1	179.9	-15.2	0	0	112.1	V833 S847 L848 L875 I876 M881 L882 L883 F988	V833-Q879 HydrophobicContact CB-CG 4.15Å; V833-Q879 HydrophobicContact CG1-CB 4.3Å; V833-Q879 HydrophobicContact CG1-CG 3.62Å; S847-Q879 PolarHBondContact OG-NE2 2.87Å; S847-Q879 PolarHBondContact OG-OE1 3.21Å; L848-Q879 HydrophobicContact CD1-CB 4.02Å; L848-Q879 HydrophobicContact CG-CB 4.25Å; L875-Q879 HydrophobicContact CD1-CG 4.16Å; L875-Q879 WeakPolarHBondContact O-CB 3.37Å; L875-Q879 VanDerWaalsContact O-CG 3.28Å; L875-Q879 WeakPolarHBondContact O-CG 3.39Å; L875-Q879 PolarHBondContact O-N 2.68Å; I876-Q879 PolarHBondContact O-N 2.72Å; Q879-M881 VanDerWaalsContact C-N 3.33Å; Q879-M881 PolarHBondContact O-N 3.49Å; Q879-L882 PolarHBondContact O-N 3.29Å; Q879-L883 WeakPolarHBondContact O-CB 3.4Å; Q879-L883 PolarHBondContact O-N 2.65Å; Q879-F988 HydrophobicContact CB-CD2 3.99Å; Q879-F988 HydrophobicContact CB-CE1 4.42Å; Q879-F988 HydrophobicContact CB-CE2 3.52Å; Q879-F988 HydrophobicContact CB-CZ 3.77Å; Q879-F988 HydrophobicContact CG-CD1 4.06Å; Q879-F988 HydrophobicContact CG-CD2 4.08Å; Q879-F988 HydrophobicContact CG-CE1 3.76Å; Q879-F988 HydrophobicContact CG-CE2 3.77Å; Q879-F988 HydrophobicContact CG-CG 4.22Å; Q879-F988 HydrophobicContact CG-CZ 3.6Å
880	I	89.2	Confident	86	Confident	8 Å²	8	29.2 Å²	29.2	4%	0.041	16%	0.157	C	C	.	.	H	α-helix	trans	-62.8	-40.4	174	-65.9	163.9	0	0	0	110.6	L848 L864 H867 I870 I876 G877 L883 R884	L848-I880 HydrophobicContact CD1-CG1 3.92Å; L848-I880 HydrophobicContact CD2-CG1 4.15Å; L848-I880 HydrophobicContact CG-CG1 4.38Å; L864-I880 HydrophobicContact CD2-CG2 4.42Å; H867-I880 HydrophobicContact CB-CD1 3.95Å; I870-I880 HydrophobicContact CD1-CB 4.45Å; I870-I880 HydrophobicContact CD1-CD1 4.14Å; I870-I880 HydrophobicContact CD1-CG2 3.79Å; I876-I880 HydrophobicContact CG1-CD1 4.33Å; I876-I880 VanDerWaalsContact O-CG1 3.25Å; I876-I880 WeakPolarHBondContact O-CG1 3.44Å; I876-I880 PolarHBondContact O-N 2.99Å; G877-I880 PolarHBondContact O-N 3.41Å; I880-L883 PolarHBondContact O-N 3.44Å; I880-R884 HydrophobicContact CG2-CG 4.28Å; I880-R884 WeakPolarHBondContact O-CB 3.36Å; I880-R884 VanDerWaalsContact O-CG 3.31Å; I880-R884 WeakPolarHBondContact O-CG 3.36Å; I880-R884 PolarHBondContact O-N 3.28Å
881	M	89.3	Confident	87.6	Confident	39 Å²	39	32.2 Å²	32.2	19%	0.192	17%	0.165	C	C	.	.	H	α-helix	trans	-65.4	-44.9	178.9	-164.9	65.4	79.1	0	0	112.1	W831 T872 G877 N878 Q879 R884 Y885	W831-M881 HydrophobicContact CD2-CB 4.5Å; W831-M881 HydrophobicContact CD2-CG 3.9Å; W831-M881 HydrophobicContact CG-CB 4.17Å; W831-M881 HydrophobicContact CG-CG 3.91Å; W831-M881 HydrophobicContact CZ2-CG 4.29Å; T872-M881 HydrophobicContact CG2-CE 4.47Å; G877-M881 WeakPolarHBondContact O-CB 3.11Å; G877-M881 PolarHBondContact O-N 3.37Å; N878-M881 PolarHBondContact O-N 3.17Å; Q879-M881 VanDerWaalsContact C-N 3.33Å; Q879-M881 PolarHBondContact O-N 3.49Å; M881-R884 PolarHBondContact O-N 3.01Å; M881-Y885 HydrophobicContact CG-CD2 4.14Å; M881-Y885 HydrophobicContact CG-CE2 4.28Å; M881-Y885 PolarHBondContact O-N 3.38Å; M881-Y885 HydrophobicContact SD-CD2 3.97Å; M881-Y885 HydrophobicContact SD-CE2 3.76Å
882	L	92.8	Very high	89.2	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-61.5	-43.6	174.9	179.6	58.4	0	0	0	111.4	W831 V833 N878 Q879 Y885 F886 L965 L966 F988 L989	W831-L882 HydrophobicContact CE3-CD1 4.33Å; V833-L882 HydrophobicContact CG1-CD2 4.05Å; V833-L882 HydrophobicContact CG2-CD2 4.07Å; N878-L882 PolarHBondContact O-N 3.39Å; Q879-L882 PolarHBondContact O-N 3.29Å; L882-Y885 PolarHBondContact O-N 2.87Å; L882-F886 WeakPolarHBondContact O-CB 3.5Å; L882-F886 PolarHBondContact O-N 3.06Å; L882-L965 HydrophobicContact CD1-CB 3.81Å; L882-L965 HydrophobicContact CD2-CB 3.96Å; L882-L966 HydrophobicContact CD1-CD2 3.89Å; L882-L966 HydrophobicContact CD1-CG 4.17Å; L882-F988 HydrophobicContact CD2-CZ 4.24Å; L882-L989 HydrophobicContact CD2-CD1 4.35Å
883	L	93.2	Very high	90.5	Very high	2 Å²	2	23.2 Å²	23.2	1%	0.01	12%	0.118	C	C	.	.	H	α-helix	trans	-61.9	-45.6	176.5	179.6	63.1	0	0	0	112.3	L848 T853 Y856 Q879 I880 F886 D887 L989 Y992	L848-L883 HydrophobicContact CD1-CD2 4.26Å; T853-L883 HydrophobicContact CG2-CD2 3.91Å; Y856-L883 HydrophobicContact CD1-CD1 4.06Å; Y856-L883 HydrophobicContact CD1-CD2 3.8Å; Y856-L883 HydrophobicContact CD1-CG 3.76Å; Y856-L883 HydrophobicContact CD2-CD2 4.11Å; Y856-L883 HydrophobicContact CE1-CD1 4.45Å; Y856-L883 HydrophobicContact CE1-CD2 4.44Å; Y856-L883 HydrophobicContact CE1-CG 4.01Å; Y856-L883 HydrophobicContact CG-CD2 3.64Å; Y856-L883 HydrophobicContact CG-CG 4.11Å; Q879-L883 WeakPolarHBondContact O-CB 3.4Å; Q879-L883 PolarHBondContact O-N 2.65Å; I880-L883 PolarHBondContact O-N 3.44Å; L883-F886 PolarHBondContact O-N 3.31Å; L883-D887 WeakPolarHBondContact O-CB 3.38Å; L883-D887 PolarHBondContact O-N 2.91Å; L883-L989 HydrophobicContact CB-CD2 4.26Å; L883-L989 HydrophobicContact CD1-CD2 3.85Å; L883-Y992 HydrophobicContact CD1-CD1 4.34Å; L883-Y992 HydrophobicContact CD1-CD2 3.72Å; L883-Y992 HydrophobicContact CD1-CE2 4.39Å; L883-Y992 HydrophobicContact CD1-CG 3.72Å
884	R	89.9	Confident	91.6	Very high	80 Å²	80	25 Å²	25	30%	0.302	12%	0.12	S	C	.	.	H	α-helix	trans	-58.6	-51.7	175.9	-76.8	177.7	-179.1	-157.6	6.9	111.7	Y856 I880 M881 F886 D887 V888	Y856-R884 HydrophobicContact CE2-CG 4.47Å; I880-R884 HydrophobicContact CG2-CG 4.28Å; I880-R884 WeakPolarHBondContact O-CB 3.36Å; I880-R884 VanDerWaalsContact O-CG 3.31Å; I880-R884 WeakPolarHBondContact O-CG 3.36Å; I880-R884 PolarHBondContact O-N 3.28Å; M881-R884 PolarHBondContact O-N 3.01Å; R884-F886 VanDerWaalsContact C-N 3.35Å; R884-F886 PolarHBondContact O-N 3.33Å; R884-D887 PolarHBondContact O-N 3.2Å; R884-V888 WeakPolarHBondContact O-CG2 3.25Å; R884-V888 PolarHBondContact O-N 3.46Å
885	Y	91.7	Very high	91.9	Very high	46 Å²	46	27 Å²	27	18%	0.18	14%	0.135	C	C	.	.	H	α-helix	trans	-69.8	-31.4	-179.2	-88.2	-94	0	0	0	112.5	R823 V824 W831 M881 L882 V888 V889	R823-Y885 PolarHBondContact O-OH 3.37Å; V824-Y885 HydrophobicContact CG2-CD1 3.89Å; V824-Y885 HydrophobicContact CG2-CE1 3.77Å; W831-Y885 AromaticContact CH2-CD1 3.59Å; W831-Y885 HydrophobicContact CH2-CD1 3.59Å; W831-Y885 AromaticContact CH2-CD2 3.43Å; W831-Y885 HydrophobicContact CH2-CD2 3.43Å; W831-Y885 VanDerWaalsContact CH2-CD2 3.43Å; W831-Y885 AromaticContact CH2-CE1 3.87Å; W831-Y885 HydrophobicContact CH2-CE1 3.87Å; W831-Y885 AromaticContact CH2-CE2 3.73Å; W831-Y885 HydrophobicContact CH2-CE2 3.73Å; W831-Y885 AromaticContact CH2-CG 3.33Å; W831-Y885 HydrophobicContact CH2-CG 3.33Å; W831-Y885 AromaticContact CH2-CZ 3.93Å; W831-Y885 HydrophobicContact CZ2-CD1 4.34Å; W831-Y885 AromaticContact CZ2-CD2 3.63Å; W831-Y885 HydrophobicContact CZ2-CD2 3.63Å; W831-Y885 HydrophobicContact CZ2-CE1 4.25Å; W831-Y885 AromaticContact CZ2-CE2 3.53Å; W831-Y885 HydrophobicContact CZ2-CE2 3.53Å; W831-Y885 HydrophobicContact CZ2-CG 4.03Å; W831-Y885 AromaticContact CZ2-CZ 3.84Å; W831-Y885 HydrophobicContact CZ3-CD1 4.33Å; W831-Y885 HydrophobicContact CZ3-CD2 4.04Å; W831-Y885 AromaticContact CZ3-CG 3.79Å; W831-Y885 HydrophobicContact CZ3-CG 3.79Å; M881-Y885 HydrophobicContact CG-CD2 4.14Å; M881-Y885 HydrophobicContact CG-CE2 4.28Å; M881-Y885 PolarHBondContact O-N 3.38Å; M881-Y885 HydrophobicContact SD-CD2 3.97Å; M881-Y885 HydrophobicContact SD-CE2 3.76Å; L882-Y885 PolarHBondContact O-N 2.87Å; Y885-V888 PolarHBondContact O-N 2.82Å; Y885-V889 WeakPolarHBondContact O-CB 3.4Å; Y885-V889 VanDerWaalsContact O-CG2 3.3Å; Y885-V889 WeakPolarHBondContact O-CG2 3.49Å; Y885-V889 PolarHBondContact O-N 2.85Å
886	F	94.7	Very high	92.2	Very high	1 Å²	1	26.5 Å²	26.5	0%	0.004	13%	0.133	C	C	.	.	H	α-helix	trans	-64.9	-44.3	173.2	177.7	-147.6	0	0	0	111.5	L882 L883 R884 V888 V889 W890 L966 S969 L970 L973 Y992 V993	L882-F886 WeakPolarHBondContact O-CB 3.5Å; L882-F886 PolarHBondContact O-N 3.06Å; L883-F886 PolarHBondContact O-N 3.31Å; R884-F886 VanDerWaalsContact C-N 3.35Å; R884-F886 PolarHBondContact O-N 3.33Å; F886-V888 PolarHBondContact O-N 3.19Å; F886-V889 PolarHBondContact O-N 2.92Å; F886-W890 WeakPolarHBondContact O-CB 3.21Å; F886-W890 PolarHBondContact O-N 3.23Å; F886-L966 HydrophobicContact CB-CD2 4.07Å; F886-S969 WeakPolarHBondContact CZ-O 3.48Å; F886-L970 HydrophobicContact CE2-CB 4.08Å; F886-L970 HydrophobicContact CE2-CD1 4.05Å; F886-L973 HydrophobicContact CE2-CD2 4.41Å; F886-L973 HydrophobicContact CZ-CB 4.2Å; F886-L973 HydrophobicContact CZ-CD2 4.05Å; F886-Y992 AromaticContact CD1-CD1 3.94Å; F886-Y992 HydrophobicContact CD1-CD1 3.94Å; F886-Y992 AromaticContact CD1-CE1 3.9Å; F886-Y992 HydrophobicContact CD1-CE1 3.9Å; F886-Y992 AromaticContact CE1-CD1 3.63Å; F886-Y992 HydrophobicContact CE1-CD1 3.63Å; F886-Y992 AromaticContact CE1-CE1 3.71Å; F886-Y992 HydrophobicContact CE1-CE1 3.71Å; F886-Y992 HydrophobicContact CZ-CD1 4.45Å; F886-Y992 HydrophobicContact CZ-CE1 4.23Å; F886-V993 HydrophobicContact CE1-CG2 4.09Å
887	D	93.7	Very high	92.4	Very high	6 Å²	6	27.4 Å²	27.4	3%	0.032	14%	0.138	C	C	.	.	H	α-helix	trans	-64.1	-38	175.1	-178.8	61.5	0	0	0	112.3	Y856 L883 R884 W890 R891 Y992	Y856-D887 HydrophobicContact CE1-CB 3.79Å; Y856-D887 PolarHBondContact OH-OD2 3.22Å; L883-D887 WeakPolarHBondContact O-CB 3.38Å; L883-D887 PolarHBondContact O-N 2.91Å; R884-D887 PolarHBondContact O-N 3.2Å; D887-W890 PolarHBondContact O-N 2.92Å; D887-R891 VanDerWaalsContact O-CB 3.32Å; D887-R891 WeakPolarHBondContact O-CB 3.44Å; D887-R891 WeakPolarHBondContact O-CG 3.39Å; D887-R891 PolarHBondContact O-N 2.95Å; D887-R891 IonicContact OD1-CZ 3.18Å; D887-R891 IonicContact OD1-NE 2.69Å; D887-R891 PolarHBondContact OD1-NE 3.47Å; D887-R891 IonicContact OD1-NH2 3.14Å; D887-R891 PolarHBondContact OD1-NH2 3.3Å; D887-R891 VanDerWaalsContact OD1-NH2 3.09Å; D887-R891 IonicContact OD2-CZ 3.19Å; D887-R891 IonicContact OD2-NE 2.66Å; D887-R891 PolarHBondContact OD2-NE 3.1Å; D887-R891 IonicContact OD2-NH2 2.71Å; D887-R891 PolarHBondContact OD2-NH2 3.08Å; D887-Y992 WeakPolarHBondContact CA-OH 3.45Å; D887-Y992 HydrophobicContact CB-CE2 4.05Å; D887-Y992 WeakPolarHBondContact CB-OH 3.42Å; D887-Y992 PolarHBondContact OD1-OH 3.23Å
888	V	92	Very high	92.5	Very high	77 Å²	77	33.5 Å²	33.5	47%	0.467	17%	0.169	S	C	.	.	H	α-helix	trans	-64.5	-45.1	172.1	171.1	0	0	0	0	112	L820 R884 Y885 F886 A892	L820-V888 HydrophobicContact CD1-CG1 4.11Å; R884-V888 WeakPolarHBondContact O-CG2 3.25Å; R884-V888 PolarHBondContact O-N 3.46Å; Y885-V888 PolarHBondContact O-N 2.82Å; F886-V888 PolarHBondContact O-N 3.19Å; V888-A892 WeakPolarHBondContact O-CB 3.27Å; V888-A892 PolarHBondContact O-N 2.59Å
889	V	94.4	Very high	92.6	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.006	19%	0.187	C	C	.	.	H	α-helix	trans	-60.6	-45.6	175.2	165.4	0	0	0	0	111	F817 L820 Y885 F886 A892 I893 L941 L966 L970	F817-V889 HydrophobicContact CE1-CG1 4.19Å; L820-V889 HydrophobicContact CD1-CB 4.41Å; L820-V889 HydrophobicContact CD1-CG2 3.68Å; L820-V889 HydrophobicContact CD2-CG2 3.64Å; L820-V889 HydrophobicContact CG-CG2 4.33Å; Y885-V889 WeakPolarHBondContact O-CB 3.4Å; Y885-V889 VanDerWaalsContact O-CG2 3.3Å; Y885-V889 WeakPolarHBondContact O-CG2 3.49Å; Y885-V889 PolarHBondContact O-N 2.85Å; F886-V889 PolarHBondContact O-N 2.92Å; V889-A892 PolarHBondContact O-N 2.98Å; V889-I893 HydrophobicContact CG1-CD1 3.92Å; V889-I893 WeakPolarHBondContact O-CD1 3.4Å; V889-I893 WeakPolarHBondContact O-CG1 3.46Å; V889-I893 PolarHBondContact O-N 3.42Å; V889-I893 VanDerWaalsContact O-N 3.12Å; V889-L941 HydrophobicContact CG1-CD1 4.23Å; V889-L966 HydrophobicContact CG2-CD1 4.4Å; V889-L970 HydrophobicContact CG1-CD2 4.04Å
890	W	95.4	Very high	92.7	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-68.3	-45.2	-177.6	179.7	-130.6	0	0	0	112.1	F886 D887 A892 I893 Q894 F933 L970 L973 M1000 F1003	F886-W890 WeakPolarHBondContact O-CB 3.21Å; F886-W890 PolarHBondContact O-N 3.23Å; D887-W890 PolarHBondContact O-N 2.92Å; W890-A892 VanDerWaalsContact C-N 3.31Å; W890-A892 PolarHBondContact O-N 2.99Å; W890-I893 HydrophobicContact CE3-CB 4.14Å; W890-I893 HydrophobicContact CE3-CD1 4.37Å; W890-I893 HydrophobicContact CE3-CG2 4.21Å; W890-I893 HydrophobicContact CZ3-CB 4.27Å; W890-I893 HydrophobicContact CZ3-CG2 3.84Å; W890-I893 WeakPolarHBondContact O-CB 3.35Å; W890-I893 PolarHBondContact O-N 2.97Å; W890-I893 VanDerWaalsContact O-N 3.15Å; W890-Q894 HydrophobicContact CD2-CG 4.04Å; W890-Q894 HydrophobicContact CE3-CG 4.39Å; W890-Q894 HydrophobicContact CH2-CG 3.97Å; W890-Q894 HydrophobicContact CZ2-CG 3.63Å; W890-Q894 HydrophobicContact CZ3-CG 4.35Å; W890-Q894 WeakPolarHBondContact O-CG 3.21Å; W890-Q894 PolarHBondContact O-N 3.45Å; W890-F933 HydrophobicContact CZ3-CZ 4.31Å; W890-L970 HydrophobicContact CE3-CD1 4.04Å; W890-L973 HydrophobicContact CD2-CD2 3.83Å; W890-L973 HydrophobicContact CE3-CD2 4.19Å; W890-L973 HydrophobicContact CG-CD2 4.16Å; W890-L973 HydrophobicContact CZ2-CD2 4.39Å; W890-M1000 HydrophobicContact CH2-CB 4.19Å; W890-M1000 HydrophobicContact CH2-CG 4.46Å; W890-M1000 HydrophobicContact CH2-SD 3.47Å; W890-M1000 WeakPolarHBondContact CH2-SD 3.49Å; W890-M1000 HydrophobicContact CZ2-CB 4.15Å; W890-M1000 HydrophobicContact CZ2-SD 4.26Å; W890-M1000 HydrophobicContact CZ3-SD 3.65Å; W890-F1003 HydrophobicContact CH2-CB 4.08Å; W890-F1003 HydrophobicContact CH2-CD1 4.49Å; W890-F1003 HydrophobicContact CH2-CG 4.3Å
891	R	93.4	Very high	92.8	Very high	110 Å²	110	39.1 Å²	39.1	42%	0.415	19%	0.193	S	C	.	.	H	α-helix	trans	-61.1	-37.9	174.1	-71.8	172.4	-167.9	-107.8	-11.7	112.7	P860 D887 Q894 S895	P860-R891 VanDerWaalsContact CG-NH2 3.27Å; D887-R891 VanDerWaalsContact O-CB 3.32Å; D887-R891 WeakPolarHBondContact O-CB 3.44Å; D887-R891 WeakPolarHBondContact O-CG 3.39Å; D887-R891 PolarHBondContact O-N 2.95Å; D887-R891 IonicContact OD1-CZ 3.18Å; D887-R891 IonicContact OD1-NE 2.69Å; D887-R891 PolarHBondContact OD1-NE 3.47Å; D887-R891 IonicContact OD1-NH2 3.14Å; D887-R891 PolarHBondContact OD1-NH2 3.3Å; D887-R891 VanDerWaalsContact OD1-NH2 3.09Å; D887-R891 IonicContact OD2-CZ 3.19Å; D887-R891 IonicContact OD2-NE 2.66Å; D887-R891 PolarHBondContact OD2-NE 3.1Å; D887-R891 IonicContact OD2-NH2 2.71Å; D887-R891 PolarHBondContact OD2-NH2 3.08Å; R891-Q894 PolarHBondContact O-N 3.26Å; R891-S895 WeakPolarHBondContact O-CB 3.41Å; R891-S895 PolarHBondContact O-N 2.93Å; R891-S895 PolarHBondContact O-OG 3.31Å
892	A	93.6	Very high	93	Very high	22 Å²	22	40.5 Å²	40.5	18%	0.182	21%	0.207	C	C	.	.	H	α-helix	trans	-59.4	-47.5	173.9	0	0	0	0	0	110.9	L816 L820 V888 V889 W890 S895 S896	L816-A892 HydrophobicContact CD1-CB 4.02Å; L820-A892 HydrophobicContact CD1-CB 4.47Å; V888-A892 WeakPolarHBondContact O-CB 3.27Å; V888-A892 PolarHBondContact O-N 2.59Å; V889-A892 PolarHBondContact O-N 2.98Å; W890-A892 VanDerWaalsContact C-N 3.31Å; W890-A892 PolarHBondContact O-N 2.99Å; A892-S895 PolarHBondContact O-N 3.15Å; A892-S895 PolarHBondContact O-OG 3.17Å; A892-S896 WeakPolarHBondContact O-CB 3.36Å; A892-S896 PolarHBondContact O-N 3.15Å
893	I	95.8	Very high	92.9	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-61.7	-47.1	176.3	-64.8	159.8	0	0	0	111.2	L816 F817 V889 W890 S895 S896 F933 I937 L970 F1003	L816-I893 HydrophobicContact CD1-CG1 4.27Å; L816-I893 HydrophobicContact CD2-CG1 4.08Å; F817-I893 HydrophobicContact CE1-CG1 4.39Å; F817-I893 HydrophobicContact CZ-CD1 4.15Å; F817-I893 HydrophobicContact CZ-CG1 4.24Å; V889-I893 HydrophobicContact CG1-CD1 3.92Å; V889-I893 WeakPolarHBondContact O-CD1 3.4Å; V889-I893 WeakPolarHBondContact O-CG1 3.46Å; V889-I893 PolarHBondContact O-N 3.42Å; V889-I893 VanDerWaalsContact O-N 3.12Å; W890-I893 HydrophobicContact CE3-CB 4.14Å; W890-I893 HydrophobicContact CE3-CD1 4.37Å; W890-I893 HydrophobicContact CE3-CG2 4.21Å; W890-I893 HydrophobicContact CZ3-CB 4.27Å; W890-I893 HydrophobicContact CZ3-CG2 3.84Å; W890-I893 WeakPolarHBondContact O-CB 3.35Å; W890-I893 PolarHBondContact O-N 2.97Å; W890-I893 VanDerWaalsContact O-N 3.15Å; I893-S895 VanDerWaalsContact C-N 3.33Å; I893-S895 PolarHBondContact O-N 2.73Å; I893-S896 WeakPolarHBondContact O-CB 3.25Å; I893-S896 PolarHBondContact O-N 3.17Å; I893-S896 PolarHBondContact O-OG 3.18Å; I893-F933 HydrophobicContact CD1-CE1 4.26Å; I893-F933 HydrophobicContact CG2-CE1 4.4Å; I893-F933 HydrophobicContact CG2-CZ 4.09Å; I893-I937 HydrophobicContact CD1-CG2 4.22Å; I893-L970 HydrophobicContact CD1-CD1 3.86Å; I893-L970 HydrophobicContact CD1-CD2 3.6Å; I893-L970 HydrophobicContact CD1-CG 4.38Å; I893-F1003 HydrophobicContact CG2-CE1 3.94Å; I893-F1003 HydrophobicContact CG2-CE2 4.11Å; I893-F1003 HydrophobicContact CG2-CZ 3.69Å; I893-F1003 WeakPolarHBondContact O-CE2 3.14Å
894	Q	94.2	Very high	93	Very high	58 Å²	58	40.6 Å²	40.6	27%	0.271	21%	0.207	S	C	.	.	H	α-helix	trans	-57.6	-44.9	176.1	-69.5	174.8	-48.3	0	0	111.8	W890 R891 S896	W890-Q894 HydrophobicContact CD2-CG 4.04Å; W890-Q894 HydrophobicContact CE3-CG 4.39Å; W890-Q894 HydrophobicContact CH2-CG 3.97Å; W890-Q894 HydrophobicContact CZ2-CG 3.63Å; W890-Q894 HydrophobicContact CZ3-CG 4.35Å; W890-Q894 WeakPolarHBondContact O-CG 3.21Å; W890-Q894 PolarHBondContact O-N 3.45Å; R891-Q894 PolarHBondContact O-N 3.26Å; Q894-S896 PolarHBondContact O-N 3.27Å
895	S	92	Very high	93.3	Very high	63 Å²	63	38.7 Å²	38.7	44%	0.441	20%	0.203	S	C	.	.	H	α-helix	trans	-68.3	-18	178	76.7	0	0	0	0	114.1	R891 A892 I893 L897	R891-S895 WeakPolarHBondContact O-CB 3.41Å; R891-S895 PolarHBondContact O-N 2.93Å; R891-S895 PolarHBondContact O-OG 3.31Å; A892-S895 PolarHBondContact O-N 3.15Å; A892-S895 PolarHBondContact O-OG 3.17Å; I893-S895 VanDerWaalsContact C-N 3.33Å; I893-S895 PolarHBondContact O-N 2.73Å; S895-L897 VanDerWaalsContact C-N 3.29Å; S895-L897 PolarHBondContact O-N 2.84Å
896	S	94	Very high	93.4	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-77.8	-10.8	-176.2	78.3	0	0	0	0	114.6	Y812 A892 I893 Q894 N898 Y899 F900	Y812-S896 PolarHBondContact OH-OG 2.96Å; A892-S896 WeakPolarHBondContact O-CB 3.36Å; A892-S896 PolarHBondContact O-N 3.15Å; I893-S896 WeakPolarHBondContact O-CB 3.25Å; I893-S896 PolarHBondContact O-N 3.17Å; I893-S896 PolarHBondContact O-OG 3.18Å; Q894-S896 PolarHBondContact O-N 3.27Å; S896-N898 PolarHBondContact O-N 2.84Å; S896-N898 VanDerWaalsContact O-N 3.09Å; S896-Y899 VanDerWaalsContact CB-CZ 3.44Å; S896-Y899 WeakPolarHBondContact CB-OH 3.32Å; S896-Y899 CarbonylContact O-C 3.52Å; S896-Y899 PolarHBondContact O-N 3.31Å; S896-F900 PolarHBondContact O-N 3.24Å
897	L	92.2	Very high	93.5	Very high	50 Å²	50	43 Å²	43	26%	0.262	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-49.8	-38.3	177.5	-176.7	62.6	0	0	0	112.1	S895 Y899 F900 F1003 I1007	S895-L897 VanDerWaalsContact C-N 3.29Å; S895-L897 PolarHBondContact O-N 2.84Å; L897-Y899 PolarHBondContact O-N 3.06Å; L897-F900 PolarHBondContact O-N 3.18Å; L897-F1003 HydrophobicContact CB-CE2 4.47Å; L897-I1007 HydrophobicContact CD1-CG2 3.65Å
898	N	89	Confident	93.6	Very high	132 Å²	132	42.7 Å²	42.7	71%	0.706	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-66.8	-15.4	-179.3	-64.4	8.6	0	0	0	114.5	S896	S896-N898 PolarHBondContact O-N 2.84Å; S896-N898 VanDerWaalsContact O-N 3.09Å
899	Y	91.5	Very high	93.8	Very high	102 Å²	102	40 Å²	40	40%	0.4	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-129.5	15.6	175	64.6	-97.5	0	0	0	112.9	Y812 H815 S896 L897	Y812-Y899 AromaticContact CD2-CD2 3.92Å; Y812-Y899 HydrophobicContact CD2-CD2 3.92Å; Y812-Y899 AromaticContact CD2-CE2 3.82Å; Y812-Y899 HydrophobicContact CD2-CE2 3.82Å; Y812-Y899 HydrophobicContact CE2-CD2 4.36Å; Y812-Y899 HydrophobicContact CE2-CE2 4.05Å; H815-Y899 HydrophobicContact CB-CE2 4.17Å; S896-Y899 VanDerWaalsContact CB-CZ 3.44Å; S896-Y899 WeakPolarHBondContact CB-OH 3.32Å; S896-Y899 CarbonylContact O-C 3.52Å; S896-Y899 PolarHBondContact O-N 3.31Å; L897-Y899 PolarHBondContact O-N 3.06Å
900	F	94.1	Very high	93.8	Very high	11 Å²	11	41.5 Å²	41.5	5%	0.048	21%	0.212	C	C	.	.	S	Bend	trans	-66	137.5	177.5	-168.5	-88.3	0	0	0	110.3	Y812 S896 L897 S902 L904 I905 F908 I932 I1007	Y812-F900 HydrophobicContact CD2-CD2 4.33Å; Y812-F900 HydrophobicContact CE1-CD2 4.43Å; Y812-F900 HydrophobicContact CE1-CE2 4.34Å; Y812-F900 HydrophobicContact CE2-CB 4.44Å; Y812-F900 AromaticContact CE2-CD2 3.6Å; Y812-F900 HydrophobicContact CE2-CD2 3.6Å; Y812-F900 HydrophobicContact CE2-CE2 4.3Å; Y812-F900 HydrophobicContact CE2-CG 4.39Å; Y812-F900 AromaticContact CZ-CD2 3.65Å; Y812-F900 AromaticContact CZ-CE2 3.93Å; S896-F900 PolarHBondContact O-N 3.24Å; L897-F900 PolarHBondContact O-N 3.18Å; F900-S902 PolarHBondContact O-N 2.92Å; F900-S902 VanDerWaalsContact O-N 3.13Å; F900-L904 HydrophobicContact CE1-CB 3.76Å; F900-L904 HydrophobicContact CZ-CB 4.34Å; F900-L904 HydrophobicContact CZ-CD1 4.48Å; F900-I905 HydrophobicContact CD1-CD1 4.19Å; F900-I905 HydrophobicContact CD1-CG1 3.69Å; F900-I905 HydrophobicContact CE1-CG1 4.16Å; F900-F908 HydrophobicContact CE1-CE2 4.41Å; F900-F908 HydrophobicContact CZ-CE2 4.26Å; F900-I932 HydrophobicContact CE2-CD1 4.36Å; F900-I932 HydrophobicContact CZ-CD1 3.82Å; F900-I932 HydrophobicContact CZ-CG1 4.26Å; F900-I1007 HydrophobicContact CD1-CB 4.21Å; F900-I1007 HydrophobicContact CD1-CG2 3.84Å; F900-I1007 HydrophobicContact CD2-CG2 4.13Å; F900-I1007 HydrophobicContact CE1-CB 3.94Å; F900-I1007 HydrophobicContact CE1-CD1 4.25Å; F900-I1007 HydrophobicContact CE1-CG2 3.95Å; F900-I1007 HydrophobicContact CE2-CD1 4.23Å; F900-I1007 HydrophobicContact CE2-CG2 4.24Å; F900-I1007 HydrophobicContact CG-CG2 3.93Å; F900-I1007 HydrophobicContact CZ-CB 4.27Å; F900-I1007 HydrophobicContact CZ-CD1 3.76Å; F900-I1007 HydrophobicContact CZ-CG2 4.16Å
901	P	93.1	Very high	93.8	Very high	22 Å²	22	41.5 Å²	41.5	14%	0.143	21%	0.212	C	C	.	.			trans	-61.1	118.2	-172	-25.7	35	0	0	0	113.3	V808 Y812 V903 L904 I905	V808-P901 HydrophobicContact CG1-CB 3.61Å; V808-P901 HydrophobicContact CG1-CG 4.22Å; Y812-P901 HydrophobicContact CG-CG 4.27Å; P901-V903 PolarHBondContact O-N 3.2Å; P901-V903 VanDerWaalsContact O-N 3.08Å; P901-L904 HydrophobicContact CB-CB 4.46Å; P901-L904 HydrophobicContact CB-CD1 4.17Å; P901-L904 HydrophobicContact CB-CG 4.15Å; P901-L904 HydrophobicContact CG-CD1 4.16Å; P901-L904 WeakPolarHBondContact O-CB 3.12Å; P901-L904 PolarHBondContact O-N 3.05Å; P901-I905 PolarHBondContact O-N 3.07Å
902	S	92.3	Very high	93.9	Very high	68 Å²	68	36.4 Å²	36.4	48%	0.476	19%	0.193	S	C	.	.	H	α-helix	trans	-60.6	-23.1	-176	61.7	0	0	0	0	114.1	F900 I905 R906	F900-S902 PolarHBondContact O-N 2.92Å; F900-S902 VanDerWaalsContact O-N 3.13Å; S902-I905 PolarHBondContact O-N 3.39Å; S902-R906 WeakPolarHBondContact O-CG 3.28Å; S902-R906 PolarHBondContact O-N 3.35Å
903	V	91.4	Very high	94	Very high	3 Å²	3	40.1 Å²	40.1	2%	0.018	21%	0.207	C	C	.	.	H	α-helix	trans	-68.8	-40.6	172.7	-164.7	0	0	0	0	112.1	I770 Y804 V808 P901 I905 R906 L907 N1057	I770-V903 HydrophobicContact CD1-CG1 4.38Å; Y804-V903 HydrophobicContact CE1-CG1 4.09Å; Y804-V903 WeakPolarHBondContact OH-CG1 3.28Å; V808-V903 HydrophobicContact CG1-CB 4.47Å; P901-V903 PolarHBondContact O-N 3.2Å; P901-V903 VanDerWaalsContact O-N 3.08Å; V903-I905 VanDerWaalsContact C-N 3.3Å; V903-R906 PolarHBondContact O-N 3.25Å; V903-L907 WeakPolarHBondContact O-CB 3.48Å; V903-L907 PolarHBondContact O-N 2.85Å; V903-N1057 HydrophobicContact CG2-CB 4.45Å; V903-N1057 WeakPolarHBondContact CG2-ND2 3.45Å; V903-N1057 WeakPolarHBondContact CG2-OD1 3.49Å
904	L	94.6	Very high	93.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-68.7	-34.3	177	-63.2	-178.4	0	0	0	110.5	Y804 V805 V808 F900 P901 L907 F908 I932	Y804-L904 HydrophobicContact CD1-CD2 4.37Å; Y804-L904 HydrophobicContact CE1-CD2 4.45Å; V805-L904 HydrophobicContact CG2-CD2 4.17Å; V808-L904 HydrophobicContact CB-CD1 4.33Å; V808-L904 HydrophobicContact CB-CD2 4.13Å; V808-L904 HydrophobicContact CB-CG 4.17Å; V808-L904 HydrophobicContact CG1-CD1 4.19Å; V808-L904 HydrophobicContact CG1-CD2 4.33Å; V808-L904 HydrophobicContact CG1-CG 3.88Å; F900-L904 HydrophobicContact CE1-CB 3.76Å; F900-L904 HydrophobicContact CZ-CB 4.34Å; F900-L904 HydrophobicContact CZ-CD1 4.48Å; P901-L904 HydrophobicContact CB-CB 4.46Å; P901-L904 HydrophobicContact CB-CD1 4.17Å; P901-L904 HydrophobicContact CB-CG 4.15Å; P901-L904 HydrophobicContact CG-CD1 4.16Å; P901-L904 WeakPolarHBondContact O-CB 3.12Å; P901-L904 PolarHBondContact O-N 3.05Å; L904-L907 HydrophobicContact CD2-CD2 4.28Å; L904-L907 PolarHBondContact O-N 3.13Å; L904-F908 HydrophobicContact CB-CD2 4.37Å; L904-F908 HydrophobicContact CB-CE2 3.84Å; L904-F908 HydrophobicContact CB-CZ 4.35Å; L904-F908 WeakPolarHBondContact O-CD2 3.37Å; L904-F908 VanDerWaalsContact O-CG 3.22Å; L904-F908 WeakPolarHBondContact O-CG 3.29Å; L904-F908 PolarHBondContact O-N 3.12Å; L904-I932 HydrophobicContact CD1-CD1 4.33Å
905	I	96.2	Very high	93.8	Very high	41 Å²	41	39 Å²	39	21%	0.21	21%	0.207	C	C	.	.	H	α-helix	trans	-59.7	-51.3	170.1	-53.5	-178.6	0	0	0	110.5	F900 P901 S902 V903 L907 F908 S909 I1007 P1009	F900-I905 HydrophobicContact CD1-CD1 4.19Å; F900-I905 HydrophobicContact CD1-CG1 3.69Å; F900-I905 HydrophobicContact CE1-CG1 4.16Å; P901-I905 PolarHBondContact O-N 3.07Å; S902-I905 PolarHBondContact O-N 3.39Å; V903-I905 VanDerWaalsContact C-N 3.3Å; I905-L907 VanDerWaalsContact C-N 3.31Å; I905-L907 PolarHBondContact O-N 3.49Å; I905-F908 PolarHBondContact O-N 3.49Å; I905-S909 WeakPolarHBondContact O-CB 3.38Å; I905-S909 PolarHBondContact O-N 2.73Å; I905-S909 PolarHBondContact O-OG 2.78Å; I905-I1007 WeakPolarHBondContact CA-O 3.04Å; I905-P1009 HydrophobicContact CG2-CG 4.3Å
906	R	94.6	Very high	93.8	Very high	136 Å²	136	38.1 Å²	38.1	51%	0.513	20%	0.196	S	C	.	.	H	α-helix	trans	-58.8	-40.8	176.8	-70.1	-173	-62	132.1	-0.6	112.7	I770 S902 V903 S910	I770-R906 HydrophobicContact CD1-CB 3.82Å; S902-R906 WeakPolarHBondContact O-CG 3.28Å; S902-R906 PolarHBondContact O-N 3.35Å; V903-R906 PolarHBondContact O-N 3.25Å; R906-S910 WeakPolarHBondContact O-CB 3.18Å; R906-S910 PolarHBondContact O-N 3.17Å
907	L	95.5	Very high	93.5	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-62.9	-49.2	177.3	-176.9	68.2	0	0	0	111.7	I770 L773 Y804 V903 L904 I905 S910 F911	I770-L907 HydrophobicContact CB-CD1 4.48Å; I770-L907 HydrophobicContact CG1-CD1 4.3Å; I770-L907 HydrophobicContact CG2-CD1 4.24Å; L773-L907 HydrophobicContact CB-CD1 4Å; L773-L907 HydrophobicContact CD1-CD1 3.96Å; L773-L907 HydrophobicContact CD1-CD2 4.3Å; Y804-L907 HydrophobicContact CD1-CD2 3.9Å; Y804-L907 HydrophobicContact CE1-CD2 4.23Å; V903-L907 WeakPolarHBondContact O-CB 3.48Å; V903-L907 PolarHBondContact O-N 2.85Å; L904-L907 HydrophobicContact CD2-CD2 4.28Å; L904-L907 PolarHBondContact O-N 3.13Å; I905-L907 VanDerWaalsContact C-N 3.31Å; I905-L907 PolarHBondContact O-N 3.49Å; L907-S910 PolarHBondContact O-N 3.32Å; L907-F911 HydrophobicContact CD1-CD1 4.24Å; L907-F911 HydrophobicContact CD1-CE1 3.46Å; L907-F911 VanDerWaalsContact CD1-CE1 3.46Å; L907-F911 HydrophobicContact CD1-CZ 3.64Å; L907-F911 HydrophobicContact CD2-CE2 4.43Å; L907-F911 HydrophobicContact CD2-CZ 4.09Å; L907-F911 HydrophobicContact CG-CD1 4.46Å; L907-F911 HydrophobicContact CG-CE1 3.89Å; L907-F911 HydrophobicContact CG-CE2 4.16Å; L907-F911 HydrophobicContact CG-CZ 3.72Å; L907-F911 WeakPolarHBondContact O-CD1 3.45Å; L907-F911 WeakPolarHBondContact O-CG 3.49Å; L907-F911 PolarHBondContact O-N 3.43Å
908	F	96.4	Very high	93.3	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-75	-29.6	-178.2	-56.5	-39.1	0	0	0	113.1	V805 F900 L904 I905 F911 R912 I928 C931 I932 I1007	V805-F908 HydrophobicContact CG2-CE1 4.32Å; V805-F908 HydrophobicContact CG2-CZ 4.1Å; F900-F908 HydrophobicContact CE1-CE2 4.41Å; F900-F908 HydrophobicContact CZ-CE2 4.26Å; L904-F908 HydrophobicContact CB-CD2 4.37Å; L904-F908 HydrophobicContact CB-CE2 3.84Å; L904-F908 HydrophobicContact CB-CZ 4.35Å; L904-F908 WeakPolarHBondContact O-CD2 3.37Å; L904-F908 VanDerWaalsContact O-CG 3.22Å; L904-F908 WeakPolarHBondContact O-CG 3.29Å; L904-F908 PolarHBondContact O-N 3.12Å; I905-F908 PolarHBondContact O-N 3.49Å; F908-F911 AromaticContact CD1-CD2 3.99Å; F908-F911 HydrophobicContact CD1-CD2 3.99Å; F908-F911 HydrophobicContact CD1-CE2 4.23Å; F908-F911 HydrophobicContact CE1-CE2 4.41Å; F908-R912 WeakPolarHBondContact O-CB 3.38Å; F908-R912 PolarHBondContact O-N 3.12Å; F908-I928 HydrophobicContact CB-CD1 4.07Å; F908-I928 HydrophobicContact CB-CG1 4.11Å; F908-I928 HydrophobicContact CB-CG2 3.93Å; F908-I928 HydrophobicContact CD1-CG1 4.35Å; F908-I928 HydrophobicContact CD1-CG2 4.18Å; F908-I928 HydrophobicContact CD2-CG2 3.92Å; F908-I928 HydrophobicContact CG-CG1 4.37Å; F908-I928 HydrophobicContact CG-CG2 3.75Å; F908-C931 HydrophobicContact CE1-CB 3.9Å; F908-C931 HydrophobicContact CZ-CB 4.28Å; F908-I932 HydrophobicContact CE2-CD1 3.66Å; F908-I932 HydrophobicContact CE2-CG1 3.45Å; F908-I932 VanDerWaalsContact CE2-CG1 3.45Å; F908-I932 HydrophobicContact CZ-CD1 3.7Å; F908-I932 HydrophobicContact CZ-CG1 3.57Å; F908-I1007 HydrophobicContact CD2-CD1 4.3Å; F908-I1007 HydrophobicContact CE2-CD1 4.44Å
909	S	96.1	Very high	93.3	Very high	22 Å²	22	43 Å²	43	15%	0.154	22%	0.22	C	C	.	.	H	α-helix	trans	-59.7	-45.7	164.7	-78.3	0	0	0	0	111.3	I905 R912 E913 P1009	I905-S909 WeakPolarHBondContact O-CB 3.38Å; I905-S909 PolarHBondContact O-N 2.73Å; I905-S909 PolarHBondContact O-OG 2.78Å; S909-R912 PolarHBondContact O-N 3.11Å; S909-E913 WeakPolarHBondContact O-CB 3.06Å; S909-E913 PolarHBondContact O-N 2.54Å; S909-P1009 WeakPolarHBondContact CB-O 3.4Å; S909-P1009 VanDerWaalsContact OG-CD 3.23Å; S909-P1009 WeakPolarHBondContact OG-CD 3.13Å; S909-P1009 WeakPolarHBondContact OG-CG 3.25Å; S909-P1009 PolarHBondContact OG-O 2.57Å
910	S	95.4	Very high	93.2	Very high	31 Å²	31	39.4 Å²	39.4	22%	0.217	21%	0.214	C	C	.	.	H	α-helix	trans	-65.5	-41.7	178.3	-162.6	0	0	0	0	112.2	T774 R906 L907 R912 E913 A914	T774-S910 PolarHBondContact OG1-OG 3.3Å; R906-S910 WeakPolarHBondContact O-CB 3.18Å; R906-S910 PolarHBondContact O-N 3.17Å; L907-S910 PolarHBondContact O-N 3.32Å; S910-R912 PolarHBondContact O-N 3.21Å; S910-E913 PolarHBondContact O-N 2.73Å; S910-A914 WeakPolarHBondContact O-CB 3.4Å; S910-A914 PolarHBondContact O-N 2.69Å
911	F	95.3	Very high	93	Very high	1 Å²	1	40.7 Å²	40.7	0%	0.004	22%	0.224	C	C	.	.	H	α-helix	trans	-59.4	-44.2	171.6	-69.4	1.2	0	0	0	111.8	L773 T774 V777 V801 L907 F908 L915 L927	L773-F911 HydrophobicContact CB-CE1 4.15Å; L773-F911 HydrophobicContact CB-CZ 4.29Å; T774-F911 HydrophobicContact CG2-CD1 4.26Å; T774-F911 WeakPolarHBondContact OG1-CD1 3.42Å; V777-F911 HydrophobicContact CB-CE1 4.45Å; V777-F911 HydrophobicContact CG2-CE1 4.21Å; V777-F911 HydrophobicContact CG2-CE2 4.35Å; V777-F911 HydrophobicContact CG2-CZ 3.9Å; V801-F911 HydrophobicContact CG1-CE2 4.19Å; V801-F911 HydrophobicContact CG1-CZ 4.44Å; V801-F911 HydrophobicContact CG2-CE2 4.3Å; V801-F911 HydrophobicContact CG2-CZ 3.89Å; L907-F911 HydrophobicContact CD1-CD1 4.24Å; L907-F911 HydrophobicContact CD1-CE1 3.46Å; L907-F911 VanDerWaalsContact CD1-CE1 3.46Å; L907-F911 HydrophobicContact CD1-CZ 3.64Å; L907-F911 HydrophobicContact CD2-CE2 4.43Å; L907-F911 HydrophobicContact CD2-CZ 4.09Å; L907-F911 HydrophobicContact CG-CD1 4.46Å; L907-F911 HydrophobicContact CG-CE1 3.89Å; L907-F911 HydrophobicContact CG-CE2 4.16Å; L907-F911 HydrophobicContact CG-CZ 3.72Å; L907-F911 WeakPolarHBondContact O-CD1 3.45Å; L907-F911 WeakPolarHBondContact O-CG 3.49Å; L907-F911 PolarHBondContact O-N 3.43Å; F908-F911 AromaticContact CD1-CD2 3.99Å; F908-F911 HydrophobicContact CD1-CD2 3.99Å; F908-F911 HydrophobicContact CD1-CE2 4.23Å; F908-F911 HydrophobicContact CE1-CE2 4.41Å; F911-L915 VanDerWaalsContact O-CB 3.26Å; F911-L915 WeakPolarHBondContact O-CB 3.13Å; F911-L915 VanDerWaalsContact O-CG 3.32Å; F911-L915 WeakPolarHBondContact O-CG 3.24Å; F911-L915 PolarHBondContact O-N 3.23Å; F911-L915 VanDerWaalsContact O-N 3.15Å; F911-L927 HydrophobicContact CB-CD2 4.43Å; F911-L927 HydrophobicContact CD2-CD2 3.88Å
912	R	95.9	Very high	92.9	Very high	2 Å²	2	42.2 Å²	42.2	1%	0.008	23%	0.23	C	C	.	.	H	α-helix	trans	-67.1	-48.6	179.1	-174.4	179.2	-65.7	-87.6	1.8	111.4	F908 S909 S910 A914 L915 E916 S921 C924 D925 I928 S1008 S1010	F908-R912 WeakPolarHBondContact O-CB 3.38Å; F908-R912 PolarHBondContact O-N 3.12Å; S909-R912 PolarHBondContact O-N 3.11Å; S910-R912 PolarHBondContact O-N 3.21Å; R912-A914 VanDerWaalsContact C-N 3.27Å; R912-A914 PolarHBondContact O-N 3.12Å; R912-L915 PolarHBondContact O-N 2.99Å; R912-L915 VanDerWaalsContact O-N 3.15Å; R912-E916 WeakPolarHBondContact CD-OE1 3.45Å; R912-E916 WeakPolarHBondContact CD-OE2 3.45Å; R912-E916 HydrophobicContact CG-CB 3.92Å; R912-E916 HydrophobicContact CG-CG 4.34Å; R912-E916 WeakPolarHBondContact CG-OE2 3.38Å; R912-E916 IonicContact CZ-OE1 2.93Å; R912-E916 IonicContact NH1-OE1 2.65Å; R912-E916 PolarHBondContact NH1-OE1 2.58Å; R912-E916 WeakPolarHBondContact O-CB 3.31Å; R912-E916 PolarHBondContact O-N 3.37Å; R912-S921 PolarHBondContact NH1-OG 2.88Å; R912-C924 HydrophobicContact CG-CB 4.08Å; R912-D925 IonicContact CZ-OD1 2.67Å; R912-D925 VanDerWaalsContact CZ-OD1 3.27Å; R912-D925 IonicContact NH1-OD1 3.69Å; R912-D925 PolarHBondContact NH1-OD1 3.02Å; R912-D925 IonicContact NH2-OD1 3.78Å; R912-D925 PolarHBondContact NH2-OD1 3.42Å; R912-I928 HydrophobicContact CB-CD1 4.23Å; R912-S1008 WeakPolarHBondContact CD-O 3.5Å; R912-S1008 PolarHBondContact NE-O 2.9Å; R912-S1008 PolarHBondContact NE-OG 3.15Å; R912-S1008 VanDerWaalsContact NE-OG 3.16Å; R912-S1008 PolarHBondContact NH2-OG 3.43Å; R912-S1010 WeakPolarHBondContact CD-OG 3.1Å
913	E	94	Very high	92.9	Very high	101 Å²	101	39.1 Å²	39.1	47%	0.472	21%	0.207	S	C	.	.	H	α-helix	trans	-57.5	-40.5	179.1	-177.6	166.8	-136.6	0	0	111.9	S909 S910 S1011	S909-E913 WeakPolarHBondContact O-CB 3.06Å; S909-E913 PolarHBondContact O-N 2.54Å; S910-E913 PolarHBondContact O-N 2.73Å; E913-S1011 VanDerWaalsContact OE1-CB 3.3Å; E913-S1011 WeakPolarHBondContact OE1-CB 3.46Å; E913-S1011 PolarHBondContact OE1-OG 3.46Å
914	A	93.4	Very high	93	Very high	31 Å²	31	39 Å²	39	26%	0.256	21%	0.207	S	C	.	.	H	α-helix	trans	-74.5	-24.5	178.3	0	0	0	0	0	114.7	T774 V778 S910 R912 I918	T774-A914 HydrophobicContact CG2-CB 3.67Å; V778-A914 HydrophobicContact CG2-CB 3.64Å; S910-A914 WeakPolarHBondContact O-CB 3.4Å; S910-A914 PolarHBondContact O-N 2.69Å; R912-A914 VanDerWaalsContact C-N 3.27Å; R912-A914 PolarHBondContact O-N 3.12Å; A914-I918 WeakPolarHBondContact O-CD1 3.4Å
915	L	93.2	Very high	92.9	Very high	3 Å²	3	39 Å²	39	2%	0.016	21%	0.207	C	C	.	.	H	α-helix	trans	-117.1	-24.8	-170	-64.4	174.1	0	0	0	115.2	V777 V778 V781 F911 R912 T917 I918 R919 F923 L927	V777-L915 HydrophobicContact CG1-CD1 4.23Å; V778-L915 HydrophobicContact CB-CD2 4.46Å; V778-L915 HydrophobicContact CG2-CD2 3.85Å; V778-L915 HydrophobicContact CG2-CG 4.21Å; V781-L915 HydrophobicContact CB-CD2 4.1Å; V781-L915 HydrophobicContact CG1-CD1 4.48Å; V781-L915 HydrophobicContact CG1-CD2 3.78Å; V781-L915 HydrophobicContact CG2-CD1 4.23Å; F911-L915 VanDerWaalsContact O-CB 3.26Å; F911-L915 WeakPolarHBondContact O-CB 3.13Å; F911-L915 VanDerWaalsContact O-CG 3.32Å; F911-L915 WeakPolarHBondContact O-CG 3.24Å; F911-L915 PolarHBondContact O-N 3.23Å; F911-L915 VanDerWaalsContact O-N 3.15Å; R912-L915 PolarHBondContact O-N 2.99Å; R912-L915 VanDerWaalsContact O-N 3.15Å; L915-T917 PolarHBondContact O-N 3.41Å; L915-I918 PolarHBondContact O-N 2.92Å; L915-R919 PolarHBondContact O-N 3.07Å; L915-F923 HydrophobicContact CD1-CE1 4.35Å; L915-L927 HydrophobicContact CD1-CD1 3.7Å
916	E	92.7	Very high	92.8	Very high	44 Å²	44	39 Å²	39	21%	0.206	21%	0.207	C	C	.	.	H	α-helix	trans	-65.7	-26.8	-175.7	-173.8	157.6	-106.1	0	0	111.9	R912 G920 S921 C924 S1010	R912-E916 WeakPolarHBondContact CD-OE1 3.45Å; R912-E916 WeakPolarHBondContact CD-OE2 3.45Å; R912-E916 HydrophobicContact CG-CB 3.92Å; R912-E916 HydrophobicContact CG-CG 4.34Å; R912-E916 WeakPolarHBondContact CG-OE2 3.38Å; R912-E916 IonicContact CZ-OE1 2.93Å; R912-E916 IonicContact NH1-OE1 2.65Å; R912-E916 PolarHBondContact NH1-OE1 2.58Å; R912-E916 WeakPolarHBondContact O-CB 3.31Å; R912-E916 PolarHBondContact O-N 3.37Å; E916-G920 WeakPolarHBondContact O-CA 3.41Å; E916-G920 PolarHBondContact O-N 3.38Å; E916-G920 VanDerWaalsContact O-N 3.16Å; E916-S921 WeakPolarHBondContact OE1-CA 3.43Å; E916-S921 WeakPolarHBondContact OE1-CB 3.45Å; E916-S921 PolarHBondContact OE1-OG 3.37Å; E916-C924 VanDerWaalsContact CA-SG 3.6Å; E916-C924 PolarHBondContact N-SG 3.13Å; E916-C924 VanDerWaalsContact N-SG 3.44Å; E916-S1010 WeakPolarHBondContact OE2-CB 3.43Å; E916-S1010 PolarHBondContact OE2-OG 3.46Å
917	T	87.6	Confident	92.7	Very high	110 Å²	110	32.8 Å²	32.8	68%	0.675	18%	0.184	S	C	*	.	H	α-helix	trans	-79.4	-16.8	172.6	57.5	0	0	0	0	114.1	L915	L915-T917 PolarHBondContact O-N 3.41Å
918	I	87	Confident	92.7	Very high	102 Å²	102	32.8 Å²	32.8	52%	0.523	18%	0.184	S	C	.	.	H	α-helix	trans	-105.9	-40.9	-173.7	-53.9	-179.5	0	0	0	111.8	A914 L915	A914-I918 WeakPolarHBondContact O-CD1 3.4Å; L915-I918 PolarHBondContact O-N 2.92Å
919	R	88.1	Confident	92.6	Very high	72 Å²	72	32.9 Å²	32.9	27%	0.272	19%	0.185	S	C	.	.	H	α-helix	trans	-122.2	-4.5	-175.9	-56.6	-63	-168.2	-173.3	5.3	113.7	V781 L915 F923	V781-R919 HydrophobicContact CG1-CG 3.88Å; V781-R919 PolarHBondContact O-NE 2.69Å; V781-R919 PolarHBondContact O-NH2 2.98Å; L915-R919 PolarHBondContact O-N 3.07Å; R919-F923 HydrophobicContact CB-CB 3.71Å; R919-F923 HydrophobicContact CB-CD1 3.4Å; R919-F923 VanDerWaalsContact CB-CD1 3.4Å; R919-F923 HydrophobicContact CB-CD2 4.31Å; R919-F923 HydrophobicContact CB-CE1 4.1Å; R919-F923 HydrophobicContact CB-CG 3.52Å; R919-F923 HydrophobicContact CG-CD1 3.91Å; R919-F923 HydrophobicContact CG-CE1 4.08Å; R919-F923 HydrophobicContact CG-CG 4.26Å; R919-F923 WeakPolarHBondContact O-CB 3.49Å
920	G	90.1	Very high	92.4	Very high	27 Å²	27	32.6 Å²	32.6	28%	0.278	19%	0.185	S	C	.	.			trans	82.6	166.1	177.5	0	0	0	0	0	115.2	E916 E922 F923 C924	E916-G920 WeakPolarHBondContact O-CA 3.41Å; E916-G920 PolarHBondContact O-N 3.38Å; E916-G920 VanDerWaalsContact O-N 3.16Å; G920-E922 PolarHBondContact O-N 3.14Å; G920-F923 PolarHBondContact O-N 3.34Å; G920-C924 PolarHBondContact O-N 3.13Å
921	S	90.6	Very high	92.3	Very high	39 Å²	39	31.1 Å²	31.1	27%	0.273	18%	0.175	S	C	.	.	H	α-helix	trans	-67.1	-36.5	-172.5	-158.6	0	0	0	0	113.5	R912 E916 F923 C924 D925	R912-S921 PolarHBondContact NH1-OG 2.88Å; E916-S921 WeakPolarHBondContact OE1-CA 3.43Å; E916-S921 WeakPolarHBondContact OE1-CB 3.45Å; E916-S921 PolarHBondContact OE1-OG 3.37Å; S921-F923 VanDerWaalsContact C-N 3.29Å; S921-F923 PolarHBondContact O-N 3.45Å; S921-C924 PolarHBondContact O-N 3.46Å; S921-D925 PolarHBondContact O-N 3.33Å
922	E	90.5	Very high	92.2	Very high	54 Å²	54	31 Å²	31	25%	0.252	18%	0.175	S	C	.	.	H	α-helix	trans	-59.8	-38.3	175.2	-69.8	-64.4	121.7	0	0	112.2	G920 N926 R1001 R1005 K1535	G920-E922 PolarHBondContact O-N 3.14Å; E922-N926 PolarHBondContact O-N 3.19Å; E922-N926 PolarHBondContact O-ND2 2.86Å; E922-R1001 VanDerWaalsContact CD-NH1 3.34Å; E922-R1001 IonicContact OE1-CZ 3.83Å; E922-R1001 IonicContact OE1-NH1 2.88Å; E922-R1001 PolarHBondContact OE1-NH1 3.49Å; E922-R1001 IonicContact OE1-NH2 2.98Å; E922-R1001 IonicContact OE2-CZ 3.2Å; E922-R1001 IonicContact OE2-NH1 2.7Å; E922-R1001 PolarHBondContact OE2-NH1 3.41Å; E922-R1001 IonicContact OE2-NH2 2.86Å; E922-R1001 PolarHBondContact OE2-NH2 3.28Å; E922-R1005 IonicContact OE1-NH2 3Å; E922-K1535 HydrophobicContact CB-CB 4.46Å
923	F	91.5	Very high	92.1	Very high	2 Å²	2	31 Å²	31	1%	0.009	17%	0.174	C	C	.	.	H	α-helix	trans	-66.1	-48.5	176.5	177.4	-97.3	0	0	0	111	V781 L784 E787 A790 L915 R919 G920 S921 D925 N926 L927	V781-F923 HydrophobicContact CB-CZ 4.48Å; V781-F923 HydrophobicContact CG1-CE1 3.61Å; V781-F923 HydrophobicContact CG1-CZ 3.67Å; V781-F923 HydrophobicContact CG2-CE1 4.11Å; V781-F923 HydrophobicContact CG2-CZ 3.91Å; L784-F923 HydrophobicContact CD1-CZ 4.46Å; E787-F923 HydrophobicContact CB-CD2 3.79Å; E787-F923 HydrophobicContact CB-CE2 3.8Å; E787-F923 HydrophobicContact CG-CD2 3.87Å; E787-F923 HydrophobicContact CG-CE2 3.96Å; E787-F923 WeakPolarHBondContact OE2-CD2 3.28Å; A790-F923 HydrophobicContact CB-CE2 3.82Å; A790-F923 HydrophobicContact CB-CZ 3.81Å; L915-F923 HydrophobicContact CD1-CE1 4.35Å; R919-F923 HydrophobicContact CB-CB 3.71Å; R919-F923 HydrophobicContact CB-CD1 3.4Å; R919-F923 VanDerWaalsContact CB-CD1 3.4Å; R919-F923 HydrophobicContact CB-CD2 4.31Å; R919-F923 HydrophobicContact CB-CE1 4.1Å; R919-F923 HydrophobicContact CB-CG 3.52Å; R919-F923 HydrophobicContact CG-CD1 3.91Å; R919-F923 HydrophobicContact CG-CE1 4.08Å; R919-F923 HydrophobicContact CG-CG 4.26Å; R919-F923 WeakPolarHBondContact O-CB 3.49Å; G920-F923 PolarHBondContact O-N 3.34Å; S921-F923 VanDerWaalsContact C-N 3.29Å; S921-F923 PolarHBondContact O-N 3.45Å; F923-D925 VanDerWaalsContact C-N 3.33Å; F923-D925 PolarHBondContact O-N 3.21Å; F923-N926 WeakPolarHBondContact O-CB 3.39Å; F923-N926 PolarHBondContact O-N 2.86Å; F923-N926 VanDerWaalsContact O-N 3.13Å; F923-L927 HydrophobicContact CD1-CD1 4.37Å; F923-L927 HydrophobicContact CE1-CB 4.38Å; F923-L927 HydrophobicContact CE1-CD1 3.47Å; F923-L927 VanDerWaalsContact CE1-CD1 3.47Å; F923-L927 HydrophobicContact CZ-CD1 3.83Å; F923-L927 WeakPolarHBondContact O-CB 3.09Å; F923-L927 PolarHBondContact O-N 2.98Å
924	C	93.7	Very high	92	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.007	17%	0.17	C	C	.	.	H	α-helix	trans	-60	-40.8	177.8	-64.3	0	0	0	0	112.4	R912 E916 G920 S921 N926 L927 I928	R912-C924 HydrophobicContact CG-CB 4.08Å; E916-C924 VanDerWaalsContact CA-SG 3.6Å; E916-C924 PolarHBondContact N-SG 3.13Å; E916-C924 VanDerWaalsContact N-SG 3.44Å; G920-C924 PolarHBondContact O-N 3.13Å; S921-C924 PolarHBondContact O-N 3.46Å; C924-N926 VanDerWaalsContact C-N 3.34Å; C924-N926 PolarHBondContact O-N 3.4Å; C924-L927 PolarHBondContact O-N 3.17Å; C924-I928 WeakPolarHBondContact O-CB 3.36Å; C924-I928 WeakPolarHBondContact O-CD1 3.44Å; C924-I928 WeakPolarHBondContact O-CG1 3.39Å; C924-I928 PolarHBondContact O-N 3.3Å
925	D	94	Very high	91.9	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.5	-43	174.5	-73.3	-6.1	0	0	0	111.8	R912 S921 F923 S929 F976 I1004 R1005	R912-D925 IonicContact CZ-OD1 2.67Å; R912-D925 VanDerWaalsContact CZ-OD1 3.27Å; R912-D925 IonicContact NH1-OD1 3.69Å; R912-D925 PolarHBondContact NH1-OD1 3.02Å; R912-D925 IonicContact NH2-OD1 3.78Å; R912-D925 PolarHBondContact NH2-OD1 3.42Å; S921-D925 PolarHBondContact O-N 3.33Å; F923-D925 VanDerWaalsContact C-N 3.33Å; F923-D925 PolarHBondContact O-N 3.21Å; D925-S929 WeakPolarHBondContact O-CB 3.33Å; D925-S929 PolarHBondContact O-N 3.17Å; D925-S929 VanDerWaalsContact O-N 3.11Å; D925-F976 HydrophobicContact CB-CE2 4.16Å; D925-F976 HydrophobicContact CB-CZ 4.18Å; D925-I1004 HydrophobicContact CB-CG2 4.34Å; D925-R1005 WeakPolarHBondContact OD1-CG 3.24Å; D925-R1005 IonicContact OD1-NE 3.59Å; D925-R1005 PolarHBondContact OD1-NE 3.12Å; D925-R1005 IonicContact OD2-CZ 2.63Å; D925-R1005 IonicContact OD2-NE 3.37Å; D925-R1005 PolarHBondContact OD2-NE 3.05Å; D925-R1005 IonicContact OD2-NH2 3.18Å; D925-R1005 PolarHBondContact OD2-NH2 2.62Å
926	N	92.9	Very high	91.9	Very high	40 Å²	40	29.1 Å²	29.1	21%	0.214	16%	0.162	C	C	.	.	H	α-helix	trans	-66.8	-44.5	176.3	-58	-39.7	0	0	0	112.1	E922 F923 C924 S929 G930 F976 K1535	E922-N926 PolarHBondContact O-N 3.19Å; E922-N926 PolarHBondContact O-ND2 2.86Å; F923-N926 WeakPolarHBondContact O-CB 3.39Å; F923-N926 PolarHBondContact O-N 2.86Å; F923-N926 VanDerWaalsContact O-N 3.13Å; C924-N926 VanDerWaalsContact C-N 3.34Å; C924-N926 PolarHBondContact O-N 3.4Å; N926-S929 PolarHBondContact O-N 3.03Å; N926-G930 PolarHBondContact O-N 2.87Å; N926-F976 WeakPolarHBondContact OD1-CD2 3.19Å; N926-K1535 WeakPolarHBondContact ND2-CD 3.4Å; N926-K1535 WeakPolarHBondContact ND2-CE 3.45Å; N926-K1535 VanDerWaalsContact OD1-CE 3.23Å; N926-K1535 WeakPolarHBondContact OD1-CE 3.37Å; N926-K1535 PolarHBondContact OD1-NZ 3.38Å
927	L	93.2	Very high	92	Very high	6 Å²	6	27 Å²	27	3%	0.031	15%	0.152	C	C	.	.	H	α-helix	trans	-61.2	-50.7	-177.6	-179.3	151.3	0	0	0	110.6	V777 V781 F791 F911 L915 F923 C924 G930 C931	V777-L927 HydrophobicContact CG1-CD1 4.33Å; V781-L927 HydrophobicContact CG2-CD1 3.96Å; F791-L927 HydrophobicContact CD2-CD1 4.3Å; F791-L927 HydrophobicContact CD2-CG 3.87Å; F791-L927 HydrophobicContact CE2-CD1 3.87Å; F791-L927 HydrophobicContact CE2-CD2 3.85Å; F791-L927 HydrophobicContact CE2-CG 3.6Å; F911-L927 HydrophobicContact CB-CD2 4.43Å; F911-L927 HydrophobicContact CD2-CD2 3.88Å; L915-L927 HydrophobicContact CD1-CD1 3.7Å; F923-L927 HydrophobicContact CD1-CD1 4.37Å; F923-L927 HydrophobicContact CE1-CB 4.38Å; F923-L927 HydrophobicContact CE1-CD1 3.47Å; F923-L927 VanDerWaalsContact CE1-CD1 3.47Å; F923-L927 HydrophobicContact CZ-CD1 3.83Å; F923-L927 WeakPolarHBondContact O-CB 3.09Å; F923-L927 PolarHBondContact O-N 2.98Å; C924-L927 PolarHBondContact O-N 3.17Å; L927-G930 CarbonylContact O-C 3.1Å; L927-G930 WeakPolarHBondContact O-CA 3.31Å; L927-G930 PolarHBondContact O-N 2.86Å; L927-G930 VanDerWaalsContact O-N 3.14Å; L927-C931 PolarHBondContact O-N 3.47Å; L927-C931 PolarHBondContact O-SG 3.44Å; L927-C931 VanDerWaalsContact O-SG 3.33Å
928	I	94.8	Very high	92.3	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-69.7	-36.8	-177.7	-65.2	161.6	0	0	0	110.6	F908 R912 C924 C931 I932 I1004 I1007	F908-I928 HydrophobicContact CB-CD1 4.07Å; F908-I928 HydrophobicContact CB-CG1 4.11Å; F908-I928 HydrophobicContact CB-CG2 3.93Å; F908-I928 HydrophobicContact CD1-CG1 4.35Å; F908-I928 HydrophobicContact CD1-CG2 4.18Å; F908-I928 HydrophobicContact CD2-CG2 3.92Å; F908-I928 HydrophobicContact CG-CG1 4.37Å; F908-I928 HydrophobicContact CG-CG2 3.75Å; R912-I928 HydrophobicContact CB-CD1 4.23Å; C924-I928 WeakPolarHBondContact O-CB 3.36Å; C924-I928 WeakPolarHBondContact O-CD1 3.44Å; C924-I928 WeakPolarHBondContact O-CG1 3.39Å; C924-I928 PolarHBondContact O-N 3.3Å; I928-C931 PolarHBondContact O-N 2.97Å; I928-I932 PolarHBondContact O-N 3.06Å; I928-I1004 HydrophobicContact CB-CG2 4.24Å; I928-I1004 HydrophobicContact CG2-CG2 4.16Å; I928-I1007 HydrophobicContact CG2-CD1 4.35Å
929	S	94.5	Very high	92.6	Very high	2 Å²	2	19.1 Å²	19.1	1%	0.014	11%	0.109	C	C	.	.	H	α-helix	trans	-62.4	-40.2	169.9	-169	0	0	0	0	112.4	D925 N926 C931 I932 F933 A974	D925-S929 WeakPolarHBondContact O-CB 3.33Å; D925-S929 PolarHBondContact O-N 3.17Å; D925-S929 VanDerWaalsContact O-N 3.11Å; N926-S929 PolarHBondContact O-N 3.03Å; S929-C931 VanDerWaalsContact C-N 3.29Å; S929-C931 PolarHBondContact O-N 2.69Å; S929-I932 PolarHBondContact O-N 3.14Å; S929-F933 WeakPolarHBondContact O-CB 3.22Å; S929-F933 PolarHBondContact O-N 3.44Å; S929-A974 WeakPolarHBondContact CB-O 3.37Å; S929-A974 PolarHBondContact OG-O 2.81Å
930	G	92.1	Very high	92.8	Very high	16 Å²	16	15.7 Å²	15.7	17%	0.165	10%	0.096	C	C	.	.	H	α-helix	trans	-67.8	-22.6	174	0	0	0	0	0	114.7	N926 L927 R935	N926-G930 PolarHBondContact O-N 2.87Å; L927-G930 CarbonylContact O-C 3.1Å; L927-G930 WeakPolarHBondContact O-CA 3.31Å; L927-G930 PolarHBondContact O-N 2.86Å; L927-G930 VanDerWaalsContact O-N 3.14Å; G930-R935 PolarHBondContact O-NH1 3.25Å; G930-R935 VanDerWaalsContact O-NH1 3.15Å
931	C	92.3	Very high	92.9	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-80	-39.7	171.7	-69.6	0	0	0	0	112.6	V801 F908 L927 I928 S929 R935	V801-C931 HydrophobicContact CG1-CB 4.47Å; F908-C931 HydrophobicContact CE1-CB 3.9Å; F908-C931 HydrophobicContact CZ-CB 4.28Å; L927-C931 PolarHBondContact O-N 3.47Å; L927-C931 PolarHBondContact O-SG 3.44Å; L927-C931 VanDerWaalsContact O-SG 3.33Å; I928-C931 PolarHBondContact O-N 2.97Å; S929-C931 VanDerWaalsContact C-N 3.29Å; S929-C931 PolarHBondContact O-N 2.69Å; C931-R935 WeakPolarHBondContact O-CB 3.37Å
932	I	93.9	Very high	92.9	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-92.1	-49.2	-177.1	-74	-68.9	0	0	0	113.3	V805 F900 L904 F908 I928 S929 L936 I937 I1007	V805-I932 HydrophobicContact CG1-CD1 3.8Å; F900-I932 HydrophobicContact CE2-CD1 4.36Å; F900-I932 HydrophobicContact CZ-CD1 3.82Å; F900-I932 HydrophobicContact CZ-CG1 4.26Å; L904-I932 HydrophobicContact CD1-CD1 4.33Å; F908-I932 HydrophobicContact CE2-CD1 3.66Å; F908-I932 HydrophobicContact CE2-CG1 3.45Å; F908-I932 VanDerWaalsContact CE2-CG1 3.45Å; F908-I932 HydrophobicContact CZ-CD1 3.7Å; F908-I932 HydrophobicContact CZ-CG1 3.57Å; I928-I932 PolarHBondContact O-N 3.06Å; S929-I932 PolarHBondContact O-N 3.14Å; I932-L936 HydrophobicContact CD1-CD2 4Å; I932-L936 VanDerWaalsContact O-CB 3.27Å; I932-L936 WeakPolarHBondContact O-CB 3.27Å; I932-L936 PolarHBondContact O-N 2.84Å; I932-I937 HydrophobicContact CG2-CD1 3.58Å; I932-I937 HydrophobicContact CG2-CG1 4.17Å; I932-I937 PolarHBondContact O-N 3.48Å; I932-I1007 HydrophobicContact CG1-CD1 4.23Å
933	F	94.9	Very high	92.6	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.087	C	C	.	.	I	π-helix	trans	-79.4	-51.6	-173.4	-71	-94.3	0	0	0	111.6	W890 I893 S929 R935 I937 C938 P939 L970 A974 M1000 F1003 I1004	W890-F933 HydrophobicContact CZ3-CZ 4.31Å; I893-F933 HydrophobicContact CD1-CE1 4.26Å; I893-F933 HydrophobicContact CG2-CE1 4.4Å; I893-F933 HydrophobicContact CG2-CZ 4.09Å; S929-F933 WeakPolarHBondContact O-CB 3.22Å; S929-F933 PolarHBondContact O-N 3.44Å; F933-R935 VanDerWaalsContact C-N 3.32Å; F933-R935 PolarHBondContact O-N 3Å; F933-I937 HydrophobicContact CD1-CB 4.34Å; F933-I937 HydrophobicContact CD1-CD1 4.44Å; F933-I937 HydrophobicContact CD1-CG2 4.03Å; F933-I937 HydrophobicContact CE1-CD1 4.09Å; F933-I937 HydrophobicContact CE1-CG2 4.25Å; F933-I937 HydrophobicContact CZ-CD1 4.19Å; F933-C938 WeakPolarHBondContact O-CB 3.47Å; F933-C938 PolarHBondContact O-N 3.32Å; F933-C938 PolarHBondContact O-SG 3.1Å; F933-P939 WeakPolarHBondContact O-CD 3.35Å; F933-L970 HydrophobicContact CD1-CD1 4.4Å; F933-L970 HydrophobicContact CD1-CD2 4.17Å; F933-L970 HydrophobicContact CD1-CG 4.01Å; F933-L970 HydrophobicContact CE1-CD1 4.08Å; F933-L970 HydrophobicContact CE1-CD2 4.26Å; F933-L970 HydrophobicContact CE1-CG 4.15Å; F933-A974 HydrophobicContact CB-CB 3.48Å; F933-A974 VanDerWaalsContact CB-CB 3.48Å; F933-A974 HydrophobicContact CD1-CB 3.78Å; F933-A974 HydrophobicContact CD2-CB 4.06Å; F933-A974 HydrophobicContact CG-CB 3.47Å; F933-A974 VanDerWaalsContact CG-CB 3.47Å; F933-M1000 HydrophobicContact CD1-CE 4.38Å; F933-M1000 HydrophobicContact CD2-CE 3.57Å; F933-M1000 HydrophobicContact CE1-CE 4.07Å; F933-M1000 HydrophobicContact CE1-SD 4.49Å; F933-M1000 HydrophobicContact CE2-CE 3.23Å; F933-M1000 HydrophobicContact CE2-SD 4.42Å; F933-M1000 HydrophobicContact CG-CE 4.15Å; F933-M1000 HydrophobicContact CZ-CE 3.51Å; F933-M1000 HydrophobicContact CZ-SD 4.13Å; F933-F1003 HydrophobicContact CE2-CD1 4.36Å; F933-F1003 HydrophobicContact CE2-CE1 4.08Å; F933-F1003 HydrophobicContact CZ-CD1 4.24Å; F933-F1003 AromaticContact CZ-CE1 3.93Å; F933-F1003 HydrophobicContact CZ-CE1 3.93Å; F933-I1004 HydrophobicContact CD2-CD1 4.25Å; F933-I1004 HydrophobicContact CE2-CD1 3.84Å
934	L	91.8	Very high	92.4	Very high	74 Å²	74	15 Å²	15	39%	0.387	9%	0.087	S	C	.	.	I	π-helix	trans	-71.4	-21.9	-175.2	-172.9	61	0	0	0	114.2	P939	L934-P939 WeakPolarHBondContact O-CD 3.48Å; L934-P939 WeakPolarHBondContact O-CG 3.4Å
935	R	90.8	Very high	91.6	Very high	23 Å²	23	16.2 Å²	16.2	9%	0.087	10%	0.095	C	C	.	.	I	π-helix	trans	-114.8	-23.5	-173.8	-75.5	172.8	169.1	68.3	11.4	116	F791 E802 K806 G930 C931 F933	F791-R935 VanDerWaalsContact O-CZ 3.24Å; F791-R935 PolarHBondContact O-NH1 3.24Å; F791-R935 PolarHBondContact O-NH2 3.37Å; E802-R935 HydrophobicContact CG-CB 4.35Å; E802-R935 HydrophobicContact CG-CG 4.22Å; K806-R935 VanDerWaalsContact CE-O 3.25Å; K806-R935 WeakPolarHBondContact CE-O 3.24Å; G930-R935 PolarHBondContact O-NH1 3.25Å; G930-R935 VanDerWaalsContact O-NH1 3.15Å; C931-R935 WeakPolarHBondContact O-CB 3.37Å; F933-R935 VanDerWaalsContact C-N 3.32Å; F933-R935 PolarHBondContact O-N 3Å
936	L	93	Very high	90.8	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.126	C	C	.	.	I	π-helix	trans	-116.5	-66.7	-178.7	-174.6	72.5	0	0	0	110.9	V805 K806 L813 I932 A940 F947	V805-L936 HydrophobicContact CG1-CB 3.97Å; V805-L936 HydrophobicContact CG1-CD1 4.49Å; V805-L936 HydrophobicContact CG1-CD2 3.95Å; V805-L936 HydrophobicContact CG1-CG 4.36Å; K806-L936 HydrophobicContact CG-CD1 4.21Å; L813-L936 HydrophobicContact CD1-CD1 3.45Å; L813-L936 VanDerWaalsContact CD1-CD1 3.45Å; L813-L936 HydrophobicContact CD1-CG 3.77Å; L813-L936 HydrophobicContact CD2-CG 4.19Å; L813-L936 HydrophobicContact CG-CD1 4.1Å; L813-L936 HydrophobicContact CG-CD2 4.44Å; L813-L936 HydrophobicContact CG-CG 4.03Å; I932-L936 HydrophobicContact CD1-CD2 4Å; I932-L936 VanDerWaalsContact O-CB 3.27Å; I932-L936 WeakPolarHBondContact O-CB 3.27Å; I932-L936 PolarHBondContact O-N 2.84Å; L936-A940 WeakPolarHBondContact O-CB 3.44Å; L936-A940 PolarHBondContact O-N 3.1Å; L936-A940 VanDerWaalsContact O-N 3.1Å; L936-F947 HydrophobicContact CD1-CE1 4.37Å
937	I	94.9	Very high	90.3	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.123	C	C	.	.	I	π-helix	trans	-71.4	-53.2	-167.9	-74	178	0	0	0	113	Y812 L813 F817 I893 I932 F933 A940 L941 L970	Y812-I937 HydrophobicContact CE1-CD1 4.42Å; L813-I937 HydrophobicContact CD2-CG1 4.1Å; F817-I937 HydrophobicContact CE2-CB 4.47Å; F817-I937 HydrophobicContact CE2-CG1 4.46Å; F817-I937 HydrophobicContact CE2-CG2 3.92Å; F817-I937 HydrophobicContact CZ-CG2 3.84Å; I893-I937 HydrophobicContact CD1-CG2 4.22Å; I932-I937 HydrophobicContact CG2-CD1 3.58Å; I932-I937 HydrophobicContact CG2-CG1 4.17Å; I932-I937 PolarHBondContact O-N 3.48Å; F933-I937 HydrophobicContact CD1-CB 4.34Å; F933-I937 HydrophobicContact CD1-CD1 4.44Å; F933-I937 HydrophobicContact CD1-CG2 4.03Å; F933-I937 HydrophobicContact CE1-CD1 4.09Å; F933-I937 HydrophobicContact CE1-CG2 4.25Å; F933-I937 HydrophobicContact CZ-CD1 4.19Å; I937-A940 PolarHBondContact O-N 3.21Å; I937-L941 HydrophobicContact CG2-CD1 4.39Å; I937-L941 PolarHBondContact O-N 3.13Å; I937-L970 HydrophobicContact CG2-CD2 3.49Å; I937-L970 VanDerWaalsContact CG2-CD2 3.49Å
938	C	94.7	Very high	89.4	Confident	9 Å²	9	23.4 Å²	23.4	6%	0.061	14%	0.141	C	C	.	.	H	α-helix	trans	-69.6	-39.5	-177.2	-60.6	0	0	0	0	112.5	F933 A940 L941 L942 Q971	F933-C938 WeakPolarHBondContact O-CB 3.47Å; F933-C938 PolarHBondContact O-N 3.32Å; F933-C938 PolarHBondContact O-SG 3.1Å; C938-A940 VanDerWaalsContact C-N 3.34Å; C938-A940 PolarHBondContact O-N 2.99Å; C938-L941 PolarHBondContact O-N 3.27Å; C938-L942 WeakPolarHBondContact O-CB 3.24Å; C938-L942 PolarHBondContact O-N 2.94Å; C938-Q971 PolarHBondContact SG-OE1 3.43Å
939	P	92.4	Very high	88.7	Confident	36 Å²	36	23.5 Å²	23.5	23%	0.234	14%	0.141	C	C	.	.	H	α-helix	trans	-59.9	-38.7	169.4	-28.7	38.6	0	0	0	113.8	F933 L934 L942 S943 F947	F933-P939 WeakPolarHBondContact O-CD 3.35Å; L934-P939 WeakPolarHBondContact O-CD 3.48Å; L934-P939 WeakPolarHBondContact O-CG 3.4Å; P939-L942 PolarHBondContact O-N 3.39Å; P939-S943 PolarHBondContact O-N 2.59Å; P939-F947 HydrophobicContact CB-CE2 3.77Å; P939-F947 HydrophobicContact CB-CZ 3.68Å
940	A	91.4	Very high	87.8	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-67	-33.6	176.7	0	0	0	0	0	113.1	L813 L936 I937 C938 P944 F947 L949	L813-A940 HydrophobicContact CD1-CB 3.66Å; L813-A940 HydrophobicContact CD2-CB 3.97Å; L813-A940 HydrophobicContact CG-CB 4.42Å; L936-A940 WeakPolarHBondContact O-CB 3.44Å; L936-A940 PolarHBondContact O-N 3.1Å; L936-A940 VanDerWaalsContact O-N 3.1Å; I937-A940 PolarHBondContact O-N 3.21Å; C938-A940 VanDerWaalsContact C-N 3.34Å; C938-A940 PolarHBondContact O-N 2.99Å; A940-P944 WeakPolarHBondContact O-CA 3.47Å; A940-P944 WeakPolarHBondContact O-CB 3.46Å; A940-P944 WeakPolarHBondContact O-CG 3.47Å; A940-F947 HydrophobicContact CB-CB 4.11Å; A940-F947 HydrophobicContact CB-CD1 3.87Å; A940-F947 HydrophobicContact CB-CD2 3.93Å; A940-F947 HydrophobicContact CB-CE1 4.25Å; A940-F947 HydrophobicContact CB-CE2 4.32Å; A940-F947 HydrophobicContact CB-CG 3.69Å; A940-F947 HydrophobicContact CB-CZ 4.47Å; A940-L949 HydrophobicContact CB-CD1 4.14Å
941	L	92.2	Very high	86.5	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-70.7	-40.6	170.3	-69.7	170.3	0	0	0	112	F817 I821 V889 I937 C938 A967 L970	F817-L941 HydrophobicContact CD1-CD2 4.12Å; F817-L941 HydrophobicContact CD2-CD2 4.17Å; F817-L941 HydrophobicContact CD2-CG 4.42Å; F817-L941 HydrophobicContact CE1-CD2 4Å; F817-L941 HydrophobicContact CE2-CD1 4.38Å; F817-L941 HydrophobicContact CE2-CD2 4.03Å; F817-L941 HydrophobicContact CE2-CG 3.94Å; F817-L941 HydrophobicContact CG-CD2 4.23Å; F817-L941 HydrophobicContact CZ-CD1 4.04Å; F817-L941 HydrophobicContact CZ-CD2 3.96Å; F817-L941 HydrophobicContact CZ-CG 4.02Å; I821-L941 HydrophobicContact CD1-CD2 4.27Å; I821-L941 HydrophobicContact CG1-CD2 4.4Å; V889-L941 HydrophobicContact CG1-CD1 4.23Å; I937-L941 HydrophobicContact CG2-CD1 4.39Å; I937-L941 PolarHBondContact O-N 3.13Å; C938-L941 PolarHBondContact O-N 3.27Å; L941-A967 HydrophobicContact CB-CB 4.21Å; L941-L970 HydrophobicContact CD1-CD2 3.69Å
942	L	90.7	Very high	85.1	Confident	78 Å²	78	30.7 Å²	30.7	41%	0.408	19%	0.191	S	C	.	.	H	α-helix	trans	-73.2	-30.2	-177	-174	65.4	0	0	0	113.5	C938 P939 T964 A967	C938-L942 WeakPolarHBondContact O-CB 3.24Å; C938-L942 PolarHBondContact O-N 2.94Å; P939-L942 PolarHBondContact O-N 3.39Å; L942-T964 HydrophobicContact CD1-CG2 4.07Å; L942-A967 HydrophobicContact CB-CB 4.46Å
943	S	85.7	Confident	83.7	Confident	31 Å²	31	36.1 Å²	36.1	22%	0.217	22%	0.215	C	C	.	.			trans	-145.4	72.1	-179.7	-70.8	0	0	0	0	111.7	P939 S945 L946	P939-S943 PolarHBondContact O-N 2.59Å; S943-S945 PolarHBondContact O-N 3.06Å; S943-S945 VanDerWaalsContact O-N 3.12Å; S943-L946 PolarHBondContact O-N 3.29Å
944	P	85.7	Confident	82.3	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-65.7	-22.8	-168	-18.2	30.6	0	0	0	114.4	I821 A940 F947 G948 L949 I950 L963	I821-P944 HydrophobicContact CD1-CB 3.78Å; I821-P944 HydrophobicContact CD1-CG 3.82Å; I821-P944 HydrophobicContact CG2-CB 4.04Å; I821-P944 HydrophobicContact CG2-CG 3.91Å; A940-P944 WeakPolarHBondContact O-CA 3.47Å; A940-P944 WeakPolarHBondContact O-CB 3.46Å; A940-P944 WeakPolarHBondContact O-CG 3.47Å; P944-F947 CarbonylContact O-C 3.58Å; P944-F947 PolarHBondContact O-N 3.2Å; P944-G948 PolarHBondContact O-N 2.72Å; P944-L949 HydrophobicContact CB-CB 4.01Å; P944-L949 HydrophobicContact CB-CD1 4.29Å; P944-L949 WeakPolarHBondContact O-CB 3.14Å; P944-L949 PolarHBondContact O-N 3.47Å; P944-I950 HydrophobicContact CB-CD1 3.88Å; P944-I950 HydrophobicContact CB-CG1 4Å; P944-I950 HydrophobicContact CG-CD1 4.24Å; P944-L963 HydrophobicContact CG-CD1 4.13Å
945	S	77.7	Confident	81.1	Confident	25 Å²	25	39.6 Å²	39.6	18%	0.175	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-65.2	-35.2	174.3	44.3	0	0	0	0	113	S943 F947 G948 F953	S943-S945 PolarHBondContact O-N 3.06Å; S943-S945 VanDerWaalsContact O-N 3.12Å; S945-F947 PolarHBondContact O-N 3.36Å; S945-G948 PolarHBondContact O-N 3.36Å; S945-F953 WeakPolarHBondContact OG-CD1 3.21Å; S945-F953 WeakPolarHBondContact OG-CE1 3.38Å; S945-F953 WeakPolarHBondContact OG-CG 3.47Å
946	L	77.2	Confident	80.4	Confident	124 Å²	124	41.3 Å²	41.3	65%	0.649	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-70.5	-15	177.2	-62.6	179.6	0	0	0	112.8	S943 F953	S943-L946 PolarHBondContact O-N 3.29Å; L946-F953 HydrophobicContact CD2-CZ 3.98Å; L946-F953 HydrophobicContact CG-CE1 4.45Å; L946-F953 HydrophobicContact CG-CZ 4.26Å
947	F	81.6	Confident	79.8	Confident	33 Å²	33	45.2 Å²	45.2	15%	0.145	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-110.1	14.7	178.7	-70.6	-98.1	0	0	0	112.3	K806 L813 L936 P939 A940 P944 S945 L949	K806-F947 HydrophobicContact CD-CE1 4.43Å; K806-F947 HydrophobicContact CG-CE1 4.19Å; L813-F947 HydrophobicContact CD1-CD1 3.53Å; L813-F947 HydrophobicContact CD1-CE1 4.11Å; L813-F947 HydrophobicContact CD1-CG 4.34Å; L936-F947 HydrophobicContact CD1-CE1 4.37Å; P939-F947 HydrophobicContact CB-CE2 3.77Å; P939-F947 HydrophobicContact CB-CZ 3.68Å; A940-F947 HydrophobicContact CB-CB 4.11Å; A940-F947 HydrophobicContact CB-CD1 3.87Å; A940-F947 HydrophobicContact CB-CD2 3.93Å; A940-F947 HydrophobicContact CB-CE1 4.25Å; A940-F947 HydrophobicContact CB-CE2 4.32Å; A940-F947 HydrophobicContact CB-CG 3.69Å; A940-F947 HydrophobicContact CB-CZ 4.47Å; P944-F947 CarbonylContact O-C 3.58Å; P944-F947 PolarHBondContact O-N 3.2Å; S945-F947 PolarHBondContact O-N 3.36Å; F947-L949 HydrophobicContact CB-CD1 4.31Å; F947-L949 HydrophobicContact CB-CG 4.11Å; F947-L949 PolarHBondContact O-N 3.37Å; F947-L949 VanDerWaalsContact O-N 3.07Å
948	G	75.3	Confident	79.2	Confident	41 Å²	41	46.1 Å²	46.1	42%	0.423	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	72	-5.6	177.8	0	0	0	0	0	115.8	H814 P944 S945 I950	H814-G948 PolarHBondContact CE1-O 3.03Å; H814-G948 PolarHBondContact NE2-O 3.33Å; P944-G948 PolarHBondContact O-N 2.72Å; S945-G948 PolarHBondContact O-N 3.36Å; G948-I950 PolarHBondContact O-N 2.84Å; G948-I950 VanDerWaalsContact O-N 3.17Å
949	L	80.8	Confident	78.7	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.005	28%	0.284	C	S	.	.	S	Bend	trans	-64.3	-25.7	-172.5	-55.5	179.3	0	0	0	112.9	L813 H814 F817 H818 I821 A940 P944 F947	L813-L949 HydrophobicContact CB-CD2 4.24Å; H814-L949 HydrophobicContact CB-CD2 4.32Å; F817-L949 HydrophobicContact CB-CD1 4.11Å; H818-L949 PolarHBondContact ND1-O 3.38Å; I821-L949 HydrophobicContact CD1-CD1 3.69Å; A940-L949 HydrophobicContact CB-CD1 4.14Å; P944-L949 HydrophobicContact CB-CB 4.01Å; P944-L949 HydrophobicContact CB-CD1 4.29Å; P944-L949 WeakPolarHBondContact O-CB 3.14Å; P944-L949 PolarHBondContact O-N 3.47Å; F947-L949 HydrophobicContact CB-CD1 4.31Å; F947-L949 HydrophobicContact CB-CG 4.11Å; F947-L949 PolarHBondContact O-N 3.37Å; F947-L949 VanDerWaalsContact O-N 3.07Å
950	I	74.9	Confident	78.4	Confident	24 Å²	24	48.6 Å²	48.6	12%	0.123	29%	0.294	C	S	.	.	S	Bend	trans	-141.5	148.9	174.9	64.1	-177	0	0	0	110.3	I821 L825 P944 G948 A952	I821-I950 HydrophobicContact CG2-CG2 4.05Å; L825-I950 HydrophobicContact CD1-CD1 3.81Å; L825-I950 HydrophobicContact CD1-CG2 3.78Å; P944-I950 HydrophobicContact CB-CD1 3.88Å; P944-I950 HydrophobicContact CB-CG1 4Å; P944-I950 HydrophobicContact CG-CD1 4.24Å; G948-I950 PolarHBondContact O-N 2.84Å; G948-I950 VanDerWaalsContact O-N 3.17Å; I950-A952 WeakPolarHBondContact CD1-O 3.31Å; I950-A952 WeakPolarHBondContact CG1-O 3.19Å; I950-A952 PolarHBondContact O-N 2.9Å
951	S	63.9	Low	78.3	Confident	91 Å²	91	51.3 Å²	51.3	64%	0.636	30%	0.304	S	S	*	.	S	Bend	trans	-78.1	-12.7	-174.4	53.5	0	0	0	0	115.4
952	A	63.5	Low	78.3	Confident	55 Å²	55	51.3 Å²	51.3	46%	0.455	30%	0.304	S	S	.	.	S	Bend	trans	-148.4	152.5	179.1	0	0	0	0	0	111.2	I950	I950-A952 WeakPolarHBondContact CD1-O 3.31Å; I950-A952 WeakPolarHBondContact CG1-O 3.19Å; I950-A952 PolarHBondContact O-N 2.9Å
953	F	64.9	Low	78.3	Confident	114 Å²	114	47.7 Å²	47.7	50%	0.5	29%	0.285	S	S	.	.			trans	-57.5	144.1	172.3	-73.9	-88	0	0	0	111.7	S945 L946 S955	S945-F953 WeakPolarHBondContact OG-CD1 3.21Å; S945-F953 WeakPolarHBondContact OG-CE1 3.38Å; S945-F953 WeakPolarHBondContact OG-CG 3.47Å; L946-F953 HydrophobicContact CD2-CZ 3.98Å; L946-F953 HydrophobicContact CG-CE1 4.45Å; L946-F953 HydrophobicContact CG-CZ 4.26Å; F953-S955 PolarHBondContact O-N 3.04Å; F953-S955 VanDerWaalsContact O-N 3.12Å
954	P	66.4	Low	78.7	Confident	24 Å²	24	48 Å²	48	16%	0.156	29%	0.285	C	S	.	.			trans	-61.1	116.3	175.7	25.9	-33.9	0	0	0	110.3	L825 E956 Q960	L825-P954 HydrophobicContact CD2-CB 3.78Å; P954-E956 VanDerWaalsContact C-N 3.32Å; P954-Q960 HydrophobicContact CG-CB 4.33Å; P954-Q960 HydrophobicContact CG-CG 4.5Å
955	S	65.1	Low	79.1	Confident	122 Å²	122	48 Å²	48	85%	0.853	29%	0.285	S	S	*	.			trans	-78.4	-15.5	-179	52.1	0	0	0	0	113.9	F953	F953-S955 PolarHBondContact O-N 3.04Å; F953-S955 VanDerWaalsContact O-N 3.12Å
956	E	77.3	Confident	79.9	Confident	60 Å²	60	46.8 Å²	46.8	28%	0.28	28%	0.277	S	S	.	.			trans	-94.1	116.3	-179.9	-171.2	99.1	-178.3	0	0	110.2	F828 P954 A958 C959 Q960	F828-E956 HydrophobicContact CD1-CG 4.11Å; P954-E956 VanDerWaalsContact C-N 3.32Å; E956-A958 HydrophobicContact CG-CB 4.12Å; E956-A958 PolarHBondContact O-N 3.17Å; E956-C959 HydrophobicContact CB-CB 4.31Å; E956-C959 PolarHBondContact O-N 3.5Å; E956-Q960 PolarHBondContact O-N 2.98Å
957	P	78.7	Confident	80.7	Confident	81 Å²	81	41.3 Å²	41.3	53%	0.526	25%	0.25	S	C	.	.	H	α-helix	trans	-59.8	-30.6	-179.9	-26.4	35.6	0	0	0	114.1	Q960 R961	P957-Q960 PolarHBondContact O-N 3.31Å; P957-R961 WeakPolarHBondContact O-CB 3.19Å; P957-R961 PolarHBondContact O-N 3.47Å
958	A	82.7	Confident	81.4	Confident	20 Å²	20	42.7 Å²	42.7	17%	0.165	26%	0.256	C	S	.	.	H	α-helix	trans	-61.4	-50.3	175.8	0	0	0	0	0	111.4	P830 E956 Q960 R961 N962	P830-A958 HydrophobicContact CB-CB 4.04Å; E956-A958 HydrophobicContact CG-CB 4.12Å; E956-A958 PolarHBondContact O-N 3.17Å; A958-Q960 VanDerWaalsContact C-N 3.3Å; A958-Q960 PolarHBondContact O-N 3.44Å; A958-R961 PolarHBondContact O-N 3.18Å; A958-R961 VanDerWaalsContact O-N 3.13Å; A958-N962 PolarHBondContact O-N 3.4Å; A958-N962 PolarHBondContact O-OD1 3.32Å
959	C	85.3	Confident	82.3	Confident	2 Å²	2	40.7 Å²	40.7	1%	0.014	24%	0.235	C	C	.	.	H	α-helix	trans	-62.3	-37.3	178	-57.2	0	0	0	0	112	L825 E956 N962 L963	L825-C959 HydrophobicContact CD2-CB 4.01Å; E956-C959 HydrophobicContact CB-CB 4.31Å; E956-C959 PolarHBondContact O-N 3.5Å; C959-N962 PolarHBondContact O-N 2.98Å; C959-L963 WeakPolarHBondContact O-CG 3.26Å; C959-L963 PolarHBondContact O-N 3.15Å
960	Q	84.8	Confident	83.1	Confident	95 Å²	95	40.7 Å²	40.7	44%	0.444	24%	0.235	S	C	.	.	H	α-helix	trans	-66	-40.1	174.3	-167.4	179.9	19.9	0	0	112.2	P954 E956 P957 A958 T964	P954-Q960 HydrophobicContact CG-CB 4.33Å; P954-Q960 HydrophobicContact CG-CG 4.5Å; E956-Q960 PolarHBondContact O-N 2.98Å; P957-Q960 PolarHBondContact O-N 3.31Å; A958-Q960 VanDerWaalsContact C-N 3.3Å; A958-Q960 PolarHBondContact O-N 3.44Å; Q960-T964 WeakPolarHBondContact O-CB 3.45Å; Q960-T964 PolarHBondContact O-N 2.97Å; Q960-T964 PolarHBondContact O-OG1 2.99Å
961	R	90.1	Very high	84	Confident	57 Å²	57	40.8 Å²	40.8	22%	0.215	24%	0.235	C	C	.	.	H	α-helix	trans	-64.8	-42.6	174.5	179.5	57.6	169.5	158.7	3.8	111.7	E832 P957 A958 T964 L965	E832-R961 VanDerWaalsContact CD-NH2 3.34Å; E832-R961 IonicContact OE1-CZ 3.43Å; E832-R961 IonicContact OE1-NE 3.66Å; E832-R961 PolarHBondContact OE1-NE 3.03Å; E832-R961 IonicContact OE1-NH2 3.28Å; E832-R961 PolarHBondContact OE1-NH2 3.48Å; E832-R961 IonicContact OE2-CZ 3.49Å; E832-R961 IonicContact OE2-NE 3.45Å; E832-R961 PolarHBondContact OE2-NE 3.06Å; E832-R961 IonicContact OE2-NH2 3.93Å; E832-R961 PolarHBondContact OE2-NH2 2.88Å; P957-R961 WeakPolarHBondContact O-CB 3.19Å; P957-R961 PolarHBondContact O-N 3.47Å; A958-R961 PolarHBondContact O-N 3.18Å; A958-R961 VanDerWaalsContact O-N 3.13Å; R961-T964 WeakPolarHBondContact O-CB 3.38Å; R961-T964 PolarHBondContact O-N 2.87Å; R961-L965 HydrophobicContact CG-CD1 4.12Å; R961-L965 WeakPolarHBondContact O-CG 3.42Å; R961-L965 PolarHBondContact O-N 3.39Å
962	N	91.8	Very high	85.4	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-59.2	-49.2	175.9	-65.7	-3.1	0	0	0	111.5	V824 T829 W831 A958 C959 T964 L965 L966	V824-N962 HydrophobicContact CG1-CB 4.44Å; T829-N962 PolarHBondContact O-ND2 2.87Å; W831-N962 HydrophobicContact CD2-CB 3.94Å; W831-N962 HydrophobicContact CE3-CB 3.73Å; W831-N962 HydrophobicContact CH2-CB 4.35Å; W831-N962 HydrophobicContact CZ3-CB 3.96Å; W831-N962 PolarHBondContact N-OD1 3.06Å; W831-N962 PolarHBondContact NE1-ND2 3.46Å; A958-N962 PolarHBondContact O-N 3.4Å; A958-N962 PolarHBondContact O-OD1 3.32Å; C959-N962 PolarHBondContact O-N 2.98Å; N962-T964 VanDerWaalsContact C-N 3.31Å; N962-T964 PolarHBondContact O-N 3.32Å; N962-L965 PolarHBondContact O-N 2.89Å; N962-L966 PolarHBondContact O-N 3.44Å
963	L	91.9	Very high	87	Confident	2 Å²	2	34.3 Å²	34.3	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-60.6	-39	174.8	-73.3	171.8	0	0	0	112.3	V824 L825 P944 C959 L966 A967	V824-L963 HydrophobicContact CB-CD2 4.34Å; V824-L963 HydrophobicContact CG1-CD2 3.9Å; V824-L963 HydrophobicContact CG1-CG 4.04Å; L825-L963 HydrophobicContact CD2-CD1 4.26Å; P944-L963 HydrophobicContact CG-CD1 4.13Å; C959-L963 WeakPolarHBondContact O-CG 3.26Å; C959-L963 PolarHBondContact O-N 3.15Å; L963-L966 PolarHBondContact O-N 2.86Å; L963-A967 WeakPolarHBondContact O-CB 3.38Å; L963-A967 PolarHBondContact O-N 3.22Å
964	T	93	Very high	88.4	Confident	36 Å²	36	28.9 Å²	28.9	22%	0.221	16%	0.163	C	C	.	.	H	α-helix	trans	-63.5	-41.9	175.7	-55.8	0	0	0	0	111.9	L942 Q960 R961 N962 A967 K968	L942-T964 HydrophobicContact CD1-CG2 4.07Å; Q960-T964 WeakPolarHBondContact O-CB 3.45Å; Q960-T964 PolarHBondContact O-N 2.97Å; Q960-T964 PolarHBondContact O-OG1 2.99Å; R961-T964 WeakPolarHBondContact O-CB 3.38Å; R961-T964 PolarHBondContact O-N 2.87Å; N962-T964 VanDerWaalsContact C-N 3.31Å; N962-T964 PolarHBondContact O-N 3.32Å; T964-A967 PolarHBondContact O-N 3.05Å; T964-K968 WeakPolarHBondContact O-CG 3.47Å; T964-K968 PolarHBondContact O-N 3.45Å
965	L	94.4	Very high	89.6	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-69.1	-38.5	178.3	-72.2	167.6	0	0	0	112.1	W831 V833 L882 R961 N962 S969 Y985 M986	W831-L965 VanDerWaalsContact O-CD1 3.25Å; W831-L965 WeakPolarHBondContact O-CD1 3.28Å; V833-L965 HydrophobicContact CG2-CD1 4.17Å; V833-L965 HydrophobicContact CG2-CD2 3.96Å; L882-L965 HydrophobicContact CD1-CB 3.81Å; L882-L965 HydrophobicContact CD2-CB 3.96Å; R961-L965 HydrophobicContact CG-CD1 4.12Å; R961-L965 WeakPolarHBondContact O-CG 3.42Å; R961-L965 PolarHBondContact O-N 3.39Å; N962-L965 PolarHBondContact O-N 2.89Å; L965-S969 WeakPolarHBondContact O-CB 3.29Å; L965-S969 PolarHBondContact O-N 3.25Å; L965-S969 PolarHBondContact O-OG 3.18Å; L965-Y985 HydrophobicContact CD2-CE2 4.29Å; L965-M986 HydrophobicContact CD2-CE 4.49Å; L965-M986 HydrophobicContact CD2-SD 3.89Å
966	L	94.5	Very high	91	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-61.6	-49	170.6	-75	175.2	0	0	0	111.8	V824 W831 L882 F886 V889 N962 L963 K968 S969 L970	V824-L966 HydrophobicContact CG2-CD1 4.37Å; W831-L966 HydrophobicContact CH2-CD1 4.41Å; W831-L966 HydrophobicContact CZ3-CD1 3.83Å; W831-L966 HydrophobicContact CZ3-CD2 4.35Å; W831-L966 HydrophobicContact CZ3-CG 4.01Å; L882-L966 HydrophobicContact CD1-CD2 3.89Å; L882-L966 HydrophobicContact CD1-CG 4.17Å; F886-L966 HydrophobicContact CB-CD2 4.07Å; V889-L966 HydrophobicContact CG2-CD1 4.4Å; N962-L966 PolarHBondContact O-N 3.44Å; L963-L966 PolarHBondContact O-N 2.86Å; L966-K968 VanDerWaalsContact C-N 3.33Å; L966-K968 PolarHBondContact O-N 2.99Å; L966-S969 PolarHBondContact O-N 2.91Å; L966-L970 PolarHBondContact O-N 2.73Å
967	A	95.1	Very high	91.7	Very high	8 Å²	8	25.6 Å²	25.6	7%	0.066	14%	0.139	C	C	.	.	H	α-helix	trans	-60.9	-40.1	179	0	0	0	0	0	112	L941 L942 L963 T964 Q971	L941-A967 HydrophobicContact CB-CB 4.21Å; L942-A967 HydrophobicContact CB-CB 4.46Å; L963-A967 WeakPolarHBondContact O-CB 3.38Å; L963-A967 PolarHBondContact O-N 3.22Å; T964-A967 PolarHBondContact O-N 3.05Å; A967-Q971 VanDerWaalsContact O-CB 3.24Å; A967-Q971 WeakPolarHBondContact O-CB 3.21Å; A967-Q971 PolarHBondContact O-N 2.98Å
968	K	94.5	Very high	92.3	Very high	62 Å²	62	24.9 Å²	24.9	27%	0.27	13%	0.133	S	C	.	.	H	α-helix	trans	-62	-46.1	172.2	-80.4	-168.3	172.9	-162.6	0	112.9	T964 L966 L970 Q971 S972 E983 Y985 M986	T964-K968 WeakPolarHBondContact O-CG 3.47Å; T964-K968 PolarHBondContact O-N 3.45Å; L966-K968 VanDerWaalsContact C-N 3.33Å; L966-K968 PolarHBondContact O-N 2.99Å; K968-L970 VanDerWaalsContact C-N 3.35Å; K968-L970 PolarHBondContact O-N 3.18Å; K968-Q971 PolarHBondContact O-N 3.41Å; K968-S972 PolarHBondContact O-N 2.89Å; K968-E983 IonicContact NZ-OE1 3.65Å; K968-E983 PolarHBondContact NZ-OE1 2.97Å; K968-E983 IonicContact NZ-OE2 2.8Å; K968-E983 PolarHBondContact NZ-OE2 3.44Å; K968-Y985 PolarHBondContact NZ-OH 2.86Å; K968-Y985 VanDerWaalsContact NZ-OH 3.08Å; K968-M986 HydrophobicContact CB-CE 4.34Å
969	S	95.4	Very high	92.7	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-58.9	-47.4	179.9	-56.1	0	0	0	0	111.2	F886 L965 L966 L973 L989	F886-S969 WeakPolarHBondContact CZ-O 3.48Å; L965-S969 WeakPolarHBondContact O-CB 3.29Å; L965-S969 PolarHBondContact O-N 3.25Å; L965-S969 PolarHBondContact O-OG 3.18Å; L966-S969 PolarHBondContact O-N 2.91Å; S969-L973 PolarHBondContact O-N 2.93Å; S969-L989 WeakPolarHBondContact OG-CD1 3.41Å
970	L	96.5	Very high	92.8	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-68.1	-39.8	177.1	-171.1	65.6	0	0	0	112.8	F886 V889 W890 I893 F933 I937 L941 L966 K968 S972 L973 A974	F886-L970 HydrophobicContact CE2-CB 4.08Å; F886-L970 HydrophobicContact CE2-CD1 4.05Å; V889-L970 HydrophobicContact CG1-CD2 4.04Å; W890-L970 HydrophobicContact CE3-CD1 4.04Å; I893-L970 HydrophobicContact CD1-CD1 3.86Å; I893-L970 HydrophobicContact CD1-CD2 3.6Å; I893-L970 HydrophobicContact CD1-CG 4.38Å; F933-L970 HydrophobicContact CD1-CD1 4.4Å; F933-L970 HydrophobicContact CD1-CD2 4.17Å; F933-L970 HydrophobicContact CD1-CG 4.01Å; F933-L970 HydrophobicContact CE1-CD1 4.08Å; F933-L970 HydrophobicContact CE1-CD2 4.26Å; F933-L970 HydrophobicContact CE1-CG 4.15Å; I937-L970 HydrophobicContact CG2-CD2 3.49Å; I937-L970 VanDerWaalsContact CG2-CD2 3.49Å; L941-L970 HydrophobicContact CD1-CD2 3.69Å; L966-L970 PolarHBondContact O-N 2.73Å; K968-L970 VanDerWaalsContact C-N 3.35Å; K968-L970 PolarHBondContact O-N 3.18Å; L970-S972 VanDerWaalsContact C-N 3.35Å; L970-S972 PolarHBondContact O-N 2.95Å; L970-L973 PolarHBondContact O-N 3.45Å; L970-A974 VanDerWaalsContact O-CB 3.32Å; L970-A974 WeakPolarHBondContact O-CB 3.44Å; L970-A974 PolarHBondContact O-N 3.16Å
971	Q	94.6	Very high	92.5	Very high	26 Å²	26	29.2 Å²	29.2	12%	0.121	16%	0.156	C	C	.	.	H	α-helix	trans	-66.5	-34.7	178.4	-168.7	61.1	57.4	0	0	112.4	C938 A967 K968 A974 N975	C938-Q971 PolarHBondContact SG-OE1 3.43Å; A967-Q971 VanDerWaalsContact O-CB 3.24Å; A967-Q971 WeakPolarHBondContact O-CB 3.21Å; A967-Q971 PolarHBondContact O-N 2.98Å; K968-Q971 PolarHBondContact O-N 3.41Å; Q971-A974 PolarHBondContact O-N 3.17Å; Q971-N975 PolarHBondContact NE2-OD1 3.25Å; Q971-N975 WeakPolarHBondContact O-CB 3.16Å; Q971-N975 PolarHBondContact O-N 3.27Å; Q971-N975 PolarHBondContact O-ND2 3.49Å; Q971-N975 PolarHBondContact O-OD1 3.39Å
972	S	93.6	Very high	92.2	Very high	10 Å²	10	34.3 Å²	34.3	7%	0.07	18%	0.179	C	C	.	.	H	α-helix	trans	-65.9	-45.3	176.1	-161.5	0	0	0	0	111.5	K968 L970 A974 N975 F976 S977	K968-S972 PolarHBondContact O-N 2.89Å; L970-S972 VanDerWaalsContact C-N 3.35Å; L970-S972 PolarHBondContact O-N 2.95Å; S972-A974 VanDerWaalsContact C-N 3.32Å; S972-A974 PolarHBondContact O-N 2.68Å; S972-N975 PolarHBondContact O-N 3.38Å; S972-F976 PolarHBondContact O-N 2.87Å; S972-S977 CarbonylContact C-O 3.58Å; S972-S977 PolarHBondContact O-N 2.94Å; S972-S977 VanDerWaalsContact O-N 3.12Å; S972-S977 PolarHBondContact O-OG 3.43Å; S972-S977 PolarHBondContact OG-O 3.43Å
973	L	96.2	Very high	92	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-57.2	-45.9	172.2	179	62.8	0	0	0	111.1	F886 W890 S969 L970 N975 F976 V993 Q996 L997 M1000	F886-L973 HydrophobicContact CE2-CD2 4.41Å; F886-L973 HydrophobicContact CZ-CB 4.2Å; F886-L973 HydrophobicContact CZ-CD2 4.05Å; W890-L973 HydrophobicContact CD2-CD2 3.83Å; W890-L973 HydrophobicContact CE3-CD2 4.19Å; W890-L973 HydrophobicContact CG-CD2 4.16Å; W890-L973 HydrophobicContact CZ2-CD2 4.39Å; S969-L973 PolarHBondContact O-N 2.93Å; L970-L973 PolarHBondContact O-N 3.45Å; L973-N975 PolarHBondContact O-N 3.02Å; L973-F976 WeakPolarHBondContact O-CA 3.23Å; L973-F976 PolarHBondContact O-N 3.44Å; L973-V993 HydrophobicContact CB-CG1 4.46Å; L973-V993 HydrophobicContact CD1-CG1 4.28Å; L973-Q996 HydrophobicContact CD1-CB 3.73Å; L973-Q996 HydrophobicContact CD2-CB 4.15Å; L973-L997 HydrophobicContact CD1-CD2 4.27Å; L973-M1000 HydrophobicContact CD1-CB 4Å; L973-M1000 HydrophobicContact CD1-CG 4.43Å; L973-M1000 HydrophobicContact CD2-SD 4.46Å; L973-M1000 HydrophobicContact CG-CB 4.09Å; L973-M1000 HydrophobicContact CG-CG 4.1Å; L973-M1000 HydrophobicContact CG-SD 4.15Å
974	A	94.6	Very high	91.8	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.008	22%	0.215	C	C	.	.	H	α-helix	trans	-68.4	-30.1	-179.2	0	0	0	0	0	114.6	S929 F933 L970 Q971 S972 F976 M1000	S929-A974 WeakPolarHBondContact CB-O 3.37Å; S929-A974 PolarHBondContact OG-O 2.81Å; F933-A974 HydrophobicContact CB-CB 3.48Å; F933-A974 VanDerWaalsContact CB-CB 3.48Å; F933-A974 HydrophobicContact CD1-CB 3.78Å; F933-A974 HydrophobicContact CD2-CB 4.06Å; F933-A974 HydrophobicContact CG-CB 3.47Å; F933-A974 VanDerWaalsContact CG-CB 3.47Å; L970-A974 VanDerWaalsContact O-CB 3.32Å; L970-A974 WeakPolarHBondContact O-CB 3.44Å; L970-A974 PolarHBondContact O-N 3.16Å; Q971-A974 PolarHBondContact O-N 3.17Å; S972-A974 VanDerWaalsContact C-N 3.32Å; S972-A974 PolarHBondContact O-N 2.68Å; A974-F976 PolarHBondContact O-N 3.48Å; A974-M1000 HydrophobicContact CB-CE 3.73Å
975	N	92.5	Very high	91.7	Very high	70 Å²	70	40.7 Å²	40.7	37%	0.374	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-10.5	171.7	-69.7	-13.4	0	0	0	112.8	Q971 S972 L973 S977 K1535	Q971-N975 PolarHBondContact NE2-OD1 3.25Å; Q971-N975 WeakPolarHBondContact O-CB 3.16Å; Q971-N975 PolarHBondContact O-N 3.27Å; Q971-N975 PolarHBondContact O-ND2 3.49Å; Q971-N975 PolarHBondContact O-OD1 3.39Å; S972-N975 PolarHBondContact O-N 3.38Å; L973-N975 PolarHBondContact O-N 3.02Å; N975-S977 WeakPolarHBondContact CB-OG 3.27Å; N975-K1535 PolarHBondContact O-NZ 2.95Å
976	F	93.6	Very high	91.6	Very high	21 Å²	21	40.7 Å²	40.7	9%	0.092	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	46.5	-166.9	-43.7	-80.1	0	0	0	112.6	D925 N926 S972 L973 A974 L997 M1000 R1001 I1004	D925-F976 HydrophobicContact CB-CE2 4.16Å; D925-F976 HydrophobicContact CB-CZ 4.18Å; N926-F976 WeakPolarHBondContact OD1-CD2 3.19Å; S972-F976 PolarHBondContact O-N 2.87Å; L973-F976 WeakPolarHBondContact O-CA 3.23Å; L973-F976 PolarHBondContact O-N 3.44Å; A974-F976 PolarHBondContact O-N 3.48Å; F976-L997 HydrophobicContact CB-CD2 4.04Å; F976-L997 HydrophobicContact CD1-CD2 4.42Å; F976-M1000 HydrophobicContact CD1-CG 4.08Å; F976-M1000 HydrophobicContact CE1-CB 4.23Å; F976-M1000 HydrophobicContact CE1-CG 3.6Å; F976-M1000 HydrophobicContact CZ-CG 4.44Å; F976-R1001 HydrophobicContact CD1-CG 3.68Å; F976-R1001 HydrophobicContact CE1-CB 4.33Å; F976-R1001 HydrophobicContact CE1-CG 3.39Å; F976-R1001 HydrophobicContact CZ-CG 4.2Å; F976-I1004 HydrophobicContact CZ-CG1 4.17Å
977	S	91.2	Very high	91.5	Very high	45 Å²	45	45 Å²	45	32%	0.315	23%	0.229	S	C	.	.			trans	-135.7	147.2	-177.4	57.8	0	0	0	0	112.7	S972 N975	S972-S977 CarbonylContact C-O 3.58Å; S972-S977 PolarHBondContact O-N 2.94Å; S972-S977 VanDerWaalsContact O-N 3.12Å; S972-S977 PolarHBondContact O-OG 3.43Å; S972-S977 PolarHBondContact OG-O 3.43Å; N975-S977 WeakPolarHBondContact CB-OG 3.27Å
978	T	91.4	Very high	91.4	Very high	67 Å²	67	45.1 Å²	45.1	41%	0.411	23%	0.227	S	C	.	.			trans	-85.2	163.1	165.4	43.7	0	0	0	0	111.4	N990 S994	T978-N990 WeakPolarHBondContact CB-OD1 3.47Å; T978-N990 HydrophobicContact CG2-CB 4.14Å; T978-S994 WeakPolarHBondContact CG2-OG 3.47Å
979	F	92.4	Very high	91.4	Very high	20 Å²	20	42.1 Å²	42.1	9%	0.088	21%	0.214	C	C	.	.			trans	-71.8	127.3	175	-66.4	-76.9	0	0	0	111.4	M986 R987 L989 N990 V993	F979-M986 HydrophobicContact CB-CB 4.04Å; F979-M986 HydrophobicContact CD1-CB 3.49Å; F979-M986 VanDerWaalsContact CD1-CB 3.49Å; F979-M986 HydrophobicContact CD1-CG 4.05Å; F979-M986 HydrophobicContact CD2-CB 3.72Å; F979-M986 HydrophobicContact CE1-CB 3.78Å; F979-M986 HydrophobicContact CE1-CE 3.99Å; F979-M986 HydrophobicContact CE1-CG 3.98Å; F979-M986 HydrophobicContact CE2-CB 4Å; F979-M986 HydrophobicContact CE2-CE 4.12Å; F979-M986 HydrophobicContact CG-CB 3.46Å; F979-M986 VanDerWaalsContact CG-CB 3.46Å; F979-M986 HydrophobicContact CG-CG 4.49Å; F979-M986 HydrophobicContact CZ-CB 4.02Å; F979-M986 HydrophobicContact CZ-CE 3.57Å; F979-M986 HydrophobicContact CZ-CG 4.36Å; F979-R987 HydrophobicContact CB-CG 4.34Å; F979-L989 HydrophobicContact CD2-CB 4.48Å; F979-L989 HydrophobicContact CE2-CB 4.22Å; F979-L989 HydrophobicContact CE2-CD1 4.27Å; F979-N990 WeakPolarHBondContact CB-OD1 3.23Å; F979-N990 WeakPolarHBondContact CD2-OD1 3.32Å; F979-N990 PolarHBondContact N-OD1 3.47Å; F979-N990 PolarHBondContact O-ND2 2.9Å; F979-V993 HydrophobicContact CE2-CG2 4.46Å
980	D	87.3	Confident	91.3	Very high	66 Å²	66	43.3 Å²	43.3	35%	0.353	22%	0.221	S	C	.	.			trans	-91.4	-172.5	-179.2	72.2	-1.8	0	0	0	112.5	K982 E983	D980-K982 PolarHBondContact O-N 3.38Å; D980-K982 VanDerWaalsContact O-N 3.17Å; D980-K982 VanDerWaalsContact OD1-CB 3.28Å; D980-K982 WeakPolarHBondContact OD1-CB 3.4Å; D980-K982 WeakPolarHBondContact OD1-CG 3.45Å; D980-K982 PolarHBondContact OD1-N 3.02Å; D980-K982 IonicContact OD2-NZ 2.84Å; D980-K982 PolarHBondContact OD2-NZ 2.9Å; D980-E983 PolarHBondContact O-N 3.41Å
981	D	77.9	Confident	91.1	Very high	121 Å²	121	43.9 Å²	43.9	65%	0.647	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-4.9	-179.9	-61.8	-86.8	0	0	0	114.4	R987	D981-R987 IonicContact OD1-CZ 2.67Å; D981-R987 VanDerWaalsContact OD1-CZ 3.23Å; D981-R987 IonicContact OD1-NH1 3.16Å; D981-R987 PolarHBondContact OD1-NH1 3.24Å; D981-R987 IonicContact OD1-NH2 3.33Å; D981-R987 PolarHBondContact OD1-NH2 3Å; D981-R987 IonicContact OD2-CZ 3.39Å; D981-R987 IonicContact OD2-NH1 2.65Å; D981-R987 IonicContact OD2-NH2 2.69Å; D981-R987 PolarHBondContact OD2-NH2 3.02Å
982	K	83.7	Confident	91.1	Very high	165 Å²	165	42.6 Å²	42.6	72%	0.717	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-28.2	175.8	-54.3	-172.1	-167.3	80.6	0	112.6	D980 P984	D980-K982 PolarHBondContact O-N 3.38Å; D980-K982 VanDerWaalsContact O-N 3.17Å; D980-K982 VanDerWaalsContact OD1-CB 3.28Å; D980-K982 WeakPolarHBondContact OD1-CB 3.4Å; D980-K982 WeakPolarHBondContact OD1-CG 3.45Å; D980-K982 PolarHBondContact OD1-N 3.02Å; D980-K982 IonicContact OD2-NZ 2.84Å; D980-K982 PolarHBondContact OD2-NZ 2.9Å; K982-P984 VanDerWaalsContact C-CD 3.47Å
983	E	86.8	Confident	91.2	Very high	52 Å²	52	42.1 Å²	42.1	24%	0.243	22%	0.217	C	C	.	.	S	Bend	trans	-128.6	63.8	178.6	-60.3	-158.8	-173.5	0	0	110.7	K968 D980 Y985 M986	K968-E983 IonicContact NZ-OE1 3.65Å; K968-E983 PolarHBondContact NZ-OE1 2.97Å; K968-E983 IonicContact NZ-OE2 2.8Å; K968-E983 PolarHBondContact NZ-OE2 3.44Å; D980-E983 PolarHBondContact O-N 3.41Å; E983-Y985 HydrophobicContact CB-CD1 4.33Å; E983-Y985 HydrophobicContact CB-CE1 3.75Å; E983-Y985 VanDerWaalsContact CD-OH 3.26Å; E983-Y985 HydrophobicContact CG-CE1 4.02Å; E983-Y985 PolarHBondContact O-N 3.43Å; E983-Y985 VanDerWaalsContact O-N 3.13Å; E983-Y985 PolarHBondContact OE2-OH 2.87Å; E983-M986 HydrophobicContact CB-CB 4.43Å; E983-M986 HydrophobicContact CB-CG 4.16Å; E983-M986 PolarHBondContact O-N 2.96Å
984	P	88	Confident	91.1	Very high	80 Å²	80	45 Å²	45	52%	0.519	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-60	-30.2	-173.6	25.1	-34.6	0	0	0	112.4	K982 M986 R987	K982-P984 VanDerWaalsContact C-CD 3.47Å; P984-M986 PolarHBondContact O-N 3.49Å; P984-R987 WeakPolarHBondContact O-CB 3.48Å; P984-R987 PolarHBondContact O-N 2.89Å; P984-R987 VanDerWaalsContact O-N 3.1Å
985	Y	91.2	Very high	91	Very high	40 Å²	40	49.9 Å²	49.9	16%	0.157	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-62.8	-18.2	175.4	68.7	-89.9	0	0	0	114.3	V833 D834 L965 K968 E983 F988	V833-Y985 HydrophobicContact CG2-CD2 4.03Å; D834-Y985 HydrophobicContact CB-CD2 4.19Å; D834-Y985 HydrophobicContact CB-CG 4.19Å; L965-Y985 HydrophobicContact CD2-CE2 4.29Å; K968-Y985 PolarHBondContact NZ-OH 2.86Å; K968-Y985 VanDerWaalsContact NZ-OH 3.08Å; E983-Y985 HydrophobicContact CB-CD1 4.33Å; E983-Y985 HydrophobicContact CB-CE1 3.75Å; E983-Y985 VanDerWaalsContact CD-OH 3.26Å; E983-Y985 HydrophobicContact CG-CE1 4.02Å; E983-Y985 PolarHBondContact O-N 3.43Å; E983-Y985 VanDerWaalsContact O-N 3.13Å; E983-Y985 PolarHBondContact OE2-OH 2.87Å; Y985-F988 WeakPolarHBondContact O-CD1 3.45Å; Y985-F988 WeakPolarHBondContact O-CE1 3.25Å
986	M	93	Very high	91.1	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-92.2	-12.1	175.4	-63.4	-63.4	-74	0	0	113.4	V833 L965 K968 F979 E983 P984 F988 L989	V833-M986 HydrophobicContact CG2-SD 4.1Å; L965-M986 HydrophobicContact CD2-CE 4.49Å; L965-M986 HydrophobicContact CD2-SD 3.89Å; K968-M986 HydrophobicContact CB-CE 4.34Å; F979-M986 HydrophobicContact CB-CB 4.04Å; F979-M986 HydrophobicContact CD1-CB 3.49Å; F979-M986 VanDerWaalsContact CD1-CB 3.49Å; F979-M986 HydrophobicContact CD1-CG 4.05Å; F979-M986 HydrophobicContact CD2-CB 3.72Å; F979-M986 HydrophobicContact CE1-CB 3.78Å; F979-M986 HydrophobicContact CE1-CE 3.99Å; F979-M986 HydrophobicContact CE1-CG 3.98Å; F979-M986 HydrophobicContact CE2-CB 4Å; F979-M986 HydrophobicContact CE2-CE 4.12Å; F979-M986 HydrophobicContact CG-CB 3.46Å; F979-M986 VanDerWaalsContact CG-CB 3.46Å; F979-M986 HydrophobicContact CG-CG 4.49Å; F979-M986 HydrophobicContact CZ-CB 4.02Å; F979-M986 HydrophobicContact CZ-CE 3.57Å; F979-M986 HydrophobicContact CZ-CG 4.36Å; E983-M986 HydrophobicContact CB-CB 4.43Å; E983-M986 HydrophobicContact CB-CG 4.16Å; E983-M986 PolarHBondContact O-N 2.96Å; P984-M986 PolarHBondContact O-N 3.49Å; M986-F988 PolarHBondContact O-N 2.68Å; M986-F988 VanDerWaalsContact O-N 3.07Å; M986-L989 HydrophobicContact CE-CD1 3.84Å; M986-L989 PolarHBondContact O-N 3.08Å; M986-L989 VanDerWaalsContact O-N 3.07Å
987	R	92.5	Very high	91.2	Very high	92 Å²	92	47.8 Å²	47.8	35%	0.347	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-60.7	-23.4	-170.8	-80.1	-174.6	148	163.1	-1.8	115	F979 D981 P984 L989 N990	F979-R987 HydrophobicContact CB-CG 4.34Å; D981-R987 IonicContact OD1-CZ 2.67Å; D981-R987 VanDerWaalsContact OD1-CZ 3.23Å; D981-R987 IonicContact OD1-NH1 3.16Å; D981-R987 PolarHBondContact OD1-NH1 3.24Å; D981-R987 IonicContact OD1-NH2 3.33Å; D981-R987 PolarHBondContact OD1-NH2 3Å; D981-R987 IonicContact OD2-CZ 3.39Å; D981-R987 IonicContact OD2-NH1 2.65Å; D981-R987 IonicContact OD2-NH2 2.69Å; D981-R987 PolarHBondContact OD2-NH2 3.02Å; P984-R987 WeakPolarHBondContact O-CB 3.48Å; P984-R987 PolarHBondContact O-N 2.89Å; P984-R987 VanDerWaalsContact O-N 3.1Å; R987-L989 PolarHBondContact O-N 3.37Å; R987-N990 VanDerWaalsContact O-CB 3.25Å; R987-N990 WeakPolarHBondContact O-CB 3.31Å; R987-N990 PolarHBondContact O-N 2.95Å
988	F	92.8	Very high	91.3	Very high	9 Å²	9	48.9 Å²	48.9	4%	0.039	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-57.3	-32.6	175.6	75.8	-82.7	0	0	0	112.2	V833 L848 T853 Q879 L882 Y985 M986 N990	V833-F988 HydrophobicContact CB-CE1 4.11Å; V833-F988 HydrophobicContact CG1-CE1 4.15Å; V833-F988 HydrophobicContact CG1-CZ 4.04Å; V833-F988 HydrophobicContact CG2-CE1 4.4Å; L848-F988 HydrophobicContact CB-CB 4.21Å; L848-F988 HydrophobicContact CB-CD2 4.05Å; L848-F988 HydrophobicContact CD1-CD2 4.05Å; L848-F988 HydrophobicContact CD1-CE2 4.34Å; L848-F988 VanDerWaalsContact O-CB 3.27Å; L848-F988 WeakPolarHBondContact O-CB 3.45Å; T853-F988 WeakPolarHBondContact CB-O 3.33Å; T853-F988 HydrophobicContact CG2-CD2 3.99Å; T853-F988 WeakPolarHBondContact CG2-O 3.4Å; T853-F988 PolarHBondContact OG1-O 2.75Å; Q879-F988 HydrophobicContact CB-CD2 3.99Å; Q879-F988 HydrophobicContact CB-CE1 4.42Å; Q879-F988 HydrophobicContact CB-CE2 3.52Å; Q879-F988 HydrophobicContact CB-CZ 3.77Å; Q879-F988 HydrophobicContact CG-CD1 4.06Å; Q879-F988 HydrophobicContact CG-CD2 4.08Å; Q879-F988 HydrophobicContact CG-CE1 3.76Å; Q879-F988 HydrophobicContact CG-CE2 3.77Å; Q879-F988 HydrophobicContact CG-CG 4.22Å; Q879-F988 HydrophobicContact CG-CZ 3.6Å; L882-F988 HydrophobicContact CD2-CZ 4.24Å; Y985-F988 WeakPolarHBondContact O-CD1 3.45Å; Y985-F988 WeakPolarHBondContact O-CE1 3.25Å; M986-F988 PolarHBondContact O-N 2.68Å; M986-F988 VanDerWaalsContact O-N 3.07Å; F988-N990 PolarHBondContact O-N 2.92Å
989	L	93.5	Very high	91.4	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-71.9	-11.6	177.4	-65.5	175.8	0	0	0	114	L882 L883 S969 F979 M986 R987 G991 Y992 V993	L882-L989 HydrophobicContact CD2-CD1 4.35Å; L883-L989 HydrophobicContact CB-CD2 4.26Å; L883-L989 HydrophobicContact CD1-CD2 3.85Å; S969-L989 WeakPolarHBondContact OG-CD1 3.41Å; F979-L989 HydrophobicContact CD2-CB 4.48Å; F979-L989 HydrophobicContact CE2-CB 4.22Å; F979-L989 HydrophobicContact CE2-CD1 4.27Å; M986-L989 HydrophobicContact CE-CD1 3.84Å; M986-L989 PolarHBondContact O-N 3.08Å; M986-L989 VanDerWaalsContact O-N 3.07Å; R987-L989 PolarHBondContact O-N 3.37Å; L989-G991 PolarHBondContact O-N 3.38Å; L989-G991 VanDerWaalsContact O-N 3.13Å; L989-Y992 PolarHBondContact O-N 2.93Å; L989-V993 HydrophobicContact CB-CG2 4.33Å; L989-V993 WeakPolarHBondContact O-CG2 3.19Å; L989-V993 PolarHBondContact O-N 3.44Å
990	N	94.2	Very high	91.6	Very high	25 Å²	25	47.9 Å²	47.9	13%	0.134	25%	0.246	C	C	.	.	H	α-helix	trans	-60.7	-28	-172.6	-78.8	-13.7	0	0	0	113.6	T978 F979 R987 F988 S994	T978-N990 WeakPolarHBondContact CB-OD1 3.47Å; T978-N990 HydrophobicContact CG2-CB 4.14Å; F979-N990 WeakPolarHBondContact CB-OD1 3.23Å; F979-N990 WeakPolarHBondContact CD2-OD1 3.32Å; F979-N990 PolarHBondContact N-OD1 3.47Å; F979-N990 PolarHBondContact O-ND2 2.9Å; R987-N990 VanDerWaalsContact O-CB 3.25Å; R987-N990 WeakPolarHBondContact O-CB 3.31Å; R987-N990 PolarHBondContact O-N 2.95Å; F988-N990 PolarHBondContact O-N 2.92Å; N990-S994 WeakPolarHBondContact O-CB 3.47Å; N990-S994 PolarHBondContact O-N 2.89Å; N990-S994 PolarHBondContact O-OG 3.36Å
991	G	92.1	Very high	92	Very high	11 Å²	11	47.1 Å²	47.1	11%	0.113	24%	0.238	C	C	.	.	H	α-helix	trans	-66.1	-54.7	173.6	0	0	0	0	0	112.5	A850 T853 L989 V993 S994 Y995	A850-G991 WeakPolarHBondContact O-CA 3.05Å; T853-G991 PolarHBondContact OG1-N 3.08Å; L989-G991 PolarHBondContact O-N 3.38Å; L989-G991 VanDerWaalsContact O-N 3.13Å; G991-V993 PolarHBondContact O-N 3.47Å; G991-S994 PolarHBondContact O-N 3.31Å; G991-Y995 PolarHBondContact O-N 3.27Å
992	Y	94.7	Very high	92.8	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-57.6	-47.2	174.8	-176.6	-85.7	0	0	0	112	T853 Y856 A857 L883 F886 D887 L989 S994 Y995 Q996	T853-Y992 PolarHBondContact OG1-N 2.87Å; Y856-Y992 HydrophobicContact CD1-CD2 4.01Å; Y856-Y992 HydrophobicContact CD1-CE2 4.08Å; Y856-Y992 HydrophobicContact CE1-CE2 4.28Å; A857-Y992 HydrophobicContact CB-CD2 3.54Å; A857-Y992 HydrophobicContact CB-CE2 4.01Å; A857-Y992 HydrophobicContact CB-CG 4.3Å; L883-Y992 HydrophobicContact CD1-CD1 4.34Å; L883-Y992 HydrophobicContact CD1-CD2 3.72Å; L883-Y992 HydrophobicContact CD1-CE2 4.39Å; L883-Y992 HydrophobicContact CD1-CG 3.72Å; F886-Y992 AromaticContact CD1-CD1 3.94Å; F886-Y992 HydrophobicContact CD1-CD1 3.94Å; F886-Y992 AromaticContact CD1-CE1 3.9Å; F886-Y992 HydrophobicContact CD1-CE1 3.9Å; F886-Y992 AromaticContact CE1-CD1 3.63Å; F886-Y992 HydrophobicContact CE1-CD1 3.63Å; F886-Y992 AromaticContact CE1-CE1 3.71Å; F886-Y992 HydrophobicContact CE1-CE1 3.71Å; F886-Y992 HydrophobicContact CZ-CD1 4.45Å; F886-Y992 HydrophobicContact CZ-CE1 4.23Å; D887-Y992 WeakPolarHBondContact CA-OH 3.45Å; D887-Y992 HydrophobicContact CB-CE2 4.05Å; D887-Y992 WeakPolarHBondContact CB-OH 3.42Å; D887-Y992 PolarHBondContact OD1-OH 3.23Å; L989-Y992 PolarHBondContact O-N 2.93Å; Y992-S994 PolarHBondContact O-N 2.92Å; Y992-Y995 PolarHBondContact O-N 3.23Å; Y992-Q996 HydrophobicContact CD1-CG 4.04Å; Y992-Q996 HydrophobicContact CE1-CG 3.6Å; Y992-Q996 HydrophobicContact CE2-CG 4.36Å; Y992-Q996 WeakPolarHBondContact O-CG 3.23Å; Y992-Q996 PolarHBondContact O-N 3.35Å
993	V	95	Very high	93.4	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-59.4	-49.9	178.7	172.3	0	0	0	0	110.6	F886 L973 F979 L989 G991 Y995 Q996 L997	F886-V993 HydrophobicContact CE1-CG2 4.09Å; L973-V993 HydrophobicContact CB-CG1 4.46Å; L973-V993 HydrophobicContact CD1-CG1 4.28Å; F979-V993 HydrophobicContact CE2-CG2 4.46Å; L989-V993 HydrophobicContact CB-CG2 4.33Å; L989-V993 WeakPolarHBondContact O-CG2 3.19Å; L989-V993 PolarHBondContact O-N 3.44Å; G991-V993 PolarHBondContact O-N 3.47Å; V993-Y995 VanDerWaalsContact C-N 3.29Å; V993-Y995 PolarHBondContact O-N 3.33Å; V993-Q996 PolarHBondContact O-N 3.45Å; V993-Q996 VanDerWaalsContact O-N 3.11Å; V993-L997 WeakPolarHBondContact O-CG 3.3Å; V993-L997 PolarHBondContact O-N 2.63Å
994	S	94.2	Very high	93.8	Very high	60 Å²	60	37.5 Å²	37.5	42%	0.42	19%	0.193	S	C	.	.	H	α-helix	trans	-61	-37.8	-179.1	-58.5	0	0	0	0	112.5	T978 N990 G991 Y992	T978-S994 WeakPolarHBondContact CG2-OG 3.47Å; N990-S994 WeakPolarHBondContact O-CB 3.47Å; N990-S994 PolarHBondContact O-N 2.89Å; N990-S994 PolarHBondContact O-OG 3.36Å; G991-S994 PolarHBondContact O-N 3.31Å; Y992-S994 PolarHBondContact O-N 2.92Å
995	Y	93.6	Very high	94.2	Very high	104 Å²	104	38.5 Å²	38.5	41%	0.408	19%	0.186	S	C	.	.	H	α-helix	trans	-66.2	-39.4	175.5	-170	-91.4	0	0	0	112.3	A857 L858 G991 Y992 V993 S998	A857-Y995 HydrophobicContact CB-CD1 3.59Å; A857-Y995 HydrophobicContact CB-CE1 4.29Å; A857-Y995 HydrophobicContact CB-CG 3.86Å; L858-Y995 HydrophobicContact CD2-CE2 3.74Å; L858-Y995 VanDerWaalsContact CD2-OH 3.3Å; L858-Y995 WeakPolarHBondContact CD2-OH 3.36Å; L858-Y995 HydrophobicContact CG-CE2 3.86Å; G991-Y995 PolarHBondContact O-N 3.27Å; Y992-Y995 PolarHBondContact O-N 3.23Å; V993-Y995 VanDerWaalsContact C-N 3.29Å; V993-Y995 PolarHBondContact O-N 3.33Å; Y995-S998 PolarHBondContact O-OG 2.79Å
996	Q	94.3	Very high	94.4	Very high	7 Å²	7	38.9 Å²	38.9	3%	0.033	20%	0.195	C	C	.	.	H	α-helix	trans	-80.8	-10.9	-179.3	-65.6	-64	-24.7	0	0	114.4	L973 Y992 V993 S998 L999 M1000	L973-Q996 HydrophobicContact CD1-CB 3.73Å; L973-Q996 HydrophobicContact CD2-CB 4.15Å; Y992-Q996 HydrophobicContact CD1-CG 4.04Å; Y992-Q996 HydrophobicContact CE1-CG 3.6Å; Y992-Q996 HydrophobicContact CE2-CG 4.36Å; Y992-Q996 WeakPolarHBondContact O-CG 3.23Å; Y992-Q996 PolarHBondContact O-N 3.35Å; V993-Q996 PolarHBondContact O-N 3.45Å; V993-Q996 VanDerWaalsContact O-N 3.11Å; Q996-S998 VanDerWaalsContact C-N 3.27Å; Q996-S998 PolarHBondContact O-N 3.24Å; Q996-L999 PolarHBondContact O-N 3.45Å; Q996-L999 VanDerWaalsContact O-N 3.16Å; Q996-L999 VanDerWaalsContact OE1-CD1 3.29Å; Q996-M1000 WeakPolarHBondContact O-CB 2.95Å; Q996-M1000 PolarHBondContact O-N 2.91Å
997	L	94.5	Very high	94.5	Very high	40 Å²	40	38.9 Å²	38.9	21%	0.209	20%	0.195	C	C	.	.	H	α-helix	trans	-55.4	-37.9	-178.6	-78.8	175.8	0	0	0	113.6	L973 F976 V993 R1001	L973-L997 HydrophobicContact CD1-CD2 4.27Å; F976-L997 HydrophobicContact CB-CD2 4.04Å; F976-L997 HydrophobicContact CD1-CD2 4.42Å; V993-L997 WeakPolarHBondContact O-CG 3.3Å; V993-L997 PolarHBondContact O-N 2.63Å; L997-R1001 WeakPolarHBondContact O-CD 3.47Å; L997-R1001 VanDerWaalsContact O-CG 3.31Å; L997-R1001 WeakPolarHBondContact O-CG 3.36Å; L997-R1001 PolarHBondContact O-N 3.3Å; L997-R1001 VanDerWaalsContact O-N 3.15Å
998	S	93.6	Very high	94.7	Very high	68 Å²	68	34.6 Å²	34.6	48%	0.476	18%	0.179	S	C	.	.	H	α-helix	trans	-67.3	-46.7	177.7	53.1	0	0	0	0	111.5	Y995 Q996 M1000 R1001 M1002	Y995-S998 PolarHBondContact O-OG 2.79Å; Q996-S998 VanDerWaalsContact C-N 3.27Å; Q996-S998 PolarHBondContact O-N 3.24Å; S998-M1000 VanDerWaalsContact C-N 3.33Å; S998-M1000 PolarHBondContact O-N 3.23Å; S998-R1001 WeakPolarHBondContact O-CB 3.42Å; S998-R1001 PolarHBondContact O-N 3.37Å; S998-M1002 WeakPolarHBondContact O-CG 3.31Å; S998-M1002 PolarHBondContact O-N 3.3Å
999	L	95	Very high	94.7	Very high	65 Å²	65	37.1 Å²	37.1	34%	0.34	20%	0.196	S	C	.	.	H	α-helix	trans	-67.2	-33.3	178.4	-66.2	170.3	0	0	0	112	Q996 M1002 F1003	Q996-L999 PolarHBondContact O-N 3.45Å; Q996-L999 VanDerWaalsContact O-N 3.16Å; Q996-L999 VanDerWaalsContact OE1-CD1 3.29Å; L999-M1002 HydrophobicContact CD2-SD 4.21Å; L999-M1002 PolarHBondContact O-N 3.43Å; L999-F1003 WeakPolarHBondContact O-CB 3.44Å; L999-F1003 PolarHBondContact O-N 3.11Å
1000	M	95.8	Very high	94	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-61.8	-44.6	170.5	-178.4	70.9	-156.5	0	0	111.6	W890 F933 L973 A974 F976 Q996 S998 F1003 I1004	W890-M1000 HydrophobicContact CH2-CB 4.19Å; W890-M1000 HydrophobicContact CH2-CG 4.46Å; W890-M1000 HydrophobicContact CH2-SD 3.47Å; W890-M1000 WeakPolarHBondContact CH2-SD 3.49Å; W890-M1000 HydrophobicContact CZ2-CB 4.15Å; W890-M1000 HydrophobicContact CZ2-SD 4.26Å; W890-M1000 HydrophobicContact CZ3-SD 3.65Å; F933-M1000 HydrophobicContact CD1-CE 4.38Å; F933-M1000 HydrophobicContact CD2-CE 3.57Å; F933-M1000 HydrophobicContact CE1-CE 4.07Å; F933-M1000 HydrophobicContact CE1-SD 4.49Å; F933-M1000 HydrophobicContact CE2-CE 3.23Å; F933-M1000 HydrophobicContact CE2-SD 4.42Å; F933-M1000 HydrophobicContact CG-CE 4.15Å; F933-M1000 HydrophobicContact CZ-CE 3.51Å; F933-M1000 HydrophobicContact CZ-SD 4.13Å; L973-M1000 HydrophobicContact CD1-CB 4Å; L973-M1000 HydrophobicContact CD1-CG 4.43Å; L973-M1000 HydrophobicContact CD2-SD 4.46Å; L973-M1000 HydrophobicContact CG-CB 4.09Å; L973-M1000 HydrophobicContact CG-CG 4.1Å; L973-M1000 HydrophobicContact CG-SD 4.15Å; A974-M1000 HydrophobicContact CB-CE 3.73Å; F976-M1000 HydrophobicContact CD1-CG 4.08Å; F976-M1000 HydrophobicContact CE1-CB 4.23Å; F976-M1000 HydrophobicContact CE1-CG 3.6Å; F976-M1000 HydrophobicContact CZ-CG 4.44Å; Q996-M1000 WeakPolarHBondContact O-CB 2.95Å; Q996-M1000 PolarHBondContact O-N 2.91Å; S998-M1000 VanDerWaalsContact C-N 3.33Å; S998-M1000 PolarHBondContact O-N 3.23Å; M1000-F1003 PolarHBondContact O-N 2.99Å; M1000-I1004 HydrophobicContact CE-CD1 3.91Å; M1000-I1004 HydrophobicContact CE-CG1 3.77Å; M1000-I1004 WeakPolarHBondContact O-CG1 3.48Å; M1000-I1004 PolarHBondContact O-N 2.97Å
1001	R	95.5	Very high	92.7	Very high	51 Å²	51	39.7 Å²	39.7	19%	0.192	22%	0.216	C	C	.	.	H	α-helix	trans	-64.6	-42.1	175.7	-71	163.7	167.9	-107	-14.2	111.8	E922 F976 L997 S998 I1004 R1005	E922-R1001 VanDerWaalsContact CD-NH1 3.34Å; E922-R1001 IonicContact OE1-CZ 3.83Å; E922-R1001 IonicContact OE1-NH1 2.88Å; E922-R1001 PolarHBondContact OE1-NH1 3.49Å; E922-R1001 IonicContact OE1-NH2 2.98Å; E922-R1001 IonicContact OE2-CZ 3.2Å; E922-R1001 IonicContact OE2-NH1 2.7Å; E922-R1001 PolarHBondContact OE2-NH1 3.41Å; E922-R1001 IonicContact OE2-NH2 2.86Å; E922-R1001 PolarHBondContact OE2-NH2 3.28Å; F976-R1001 HydrophobicContact CD1-CG 3.68Å; F976-R1001 HydrophobicContact CE1-CB 4.33Å; F976-R1001 HydrophobicContact CE1-CG 3.39Å; F976-R1001 HydrophobicContact CZ-CG 4.2Å; L997-R1001 WeakPolarHBondContact O-CD 3.47Å; L997-R1001 VanDerWaalsContact O-CG 3.31Å; L997-R1001 WeakPolarHBondContact O-CG 3.36Å; L997-R1001 PolarHBondContact O-N 3.3Å; L997-R1001 VanDerWaalsContact O-N 3.15Å; S998-R1001 WeakPolarHBondContact O-CB 3.42Å; S998-R1001 PolarHBondContact O-N 3.37Å; R1001-I1004 PolarHBondContact O-N 3.35Å; R1001-R1005 WeakPolarHBondContact O-CB 3.41Å; R1001-R1005 WeakPolarHBondContact O-CG 3.25Å; R1001-R1005 PolarHBondContact O-N 3.04Å
1002	M	94.4	Very high	90.6	Very high	126 Å²	126	45.4 Å²	45.4	62%	0.621	24%	0.244	S	C	*	.	H	α-helix	trans	-60.6	-45.1	174.9	-70.7	178.7	70.6	0	0	111.6	S998 L999 R1005 S1006	S998-M1002 WeakPolarHBondContact O-CG 3.31Å; S998-M1002 PolarHBondContact O-N 3.3Å; L999-M1002 HydrophobicContact CD2-SD 4.21Å; L999-M1002 PolarHBondContact O-N 3.43Å; M1002-R1005 PolarHBondContact O-N 2.67Å; M1002-S1006 PolarHBondContact O-N 2.83Å; M1002-S1006 PolarHBondContact O-OG 3.5Å
1003	F	96.4	Very high	88.2	Confident	9 Å²	9	50.4 Å²	50.4	4%	0.039	27%	0.27	C	S	.	.	H	α-helix	trans	-59.5	-47.7	176.1	177.3	-96.8	0	0	0	112.3	W890 I893 L897 F933 L999 M1000 R1005 S1006 I1007	W890-F1003 HydrophobicContact CH2-CB 4.08Å; W890-F1003 HydrophobicContact CH2-CD1 4.49Å; W890-F1003 HydrophobicContact CH2-CG 4.3Å; I893-F1003 HydrophobicContact CG2-CE1 3.94Å; I893-F1003 HydrophobicContact CG2-CE2 4.11Å; I893-F1003 HydrophobicContact CG2-CZ 3.69Å; I893-F1003 WeakPolarHBondContact O-CE2 3.14Å; L897-F1003 HydrophobicContact CB-CE2 4.47Å; F933-F1003 HydrophobicContact CE2-CD1 4.36Å; F933-F1003 HydrophobicContact CE2-CE1 4.08Å; F933-F1003 HydrophobicContact CZ-CD1 4.24Å; F933-F1003 AromaticContact CZ-CE1 3.93Å; F933-F1003 HydrophobicContact CZ-CE1 3.93Å; L999-F1003 WeakPolarHBondContact O-CB 3.44Å; L999-F1003 PolarHBondContact O-N 3.11Å; M1000-F1003 PolarHBondContact O-N 2.99Å; F1003-R1005 VanDerWaalsContact C-N 3.32Å; F1003-R1005 PolarHBondContact O-N 2.73Å; F1003-S1006 WeakPolarHBondContact CA-OG 3.2Å; F1003-S1006 PolarHBondContact O-N 3.13Å; F1003-S1006 PolarHBondContact O-OG 2.87Å; F1003-I1007 HydrophobicContact CE1-CD1 4.17Å; F1003-I1007 HydrophobicContact CE1-CG2 4.49Å; F1003-I1007 HydrophobicContact CE2-CG2 4.39Å; F1003-I1007 HydrophobicContact CZ-CG2 4.19Å; F1003-I1007 PolarHBondContact O-N 3.02Å; F1003-I1007 VanDerWaalsContact O-N 3.1Å
1004	I	96.5	Very high	85.3	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-59.9	-41.8	177.1	-70.3	-64.6	0	0	0	111.4	D925 I928 F933 F976 M1000 R1001 I1007 S1008	D925-I1004 HydrophobicContact CB-CG2 4.34Å; I928-I1004 HydrophobicContact CB-CG2 4.24Å; I928-I1004 HydrophobicContact CG2-CG2 4.16Å; F933-I1004 HydrophobicContact CD2-CD1 4.25Å; F933-I1004 HydrophobicContact CE2-CD1 3.84Å; F976-I1004 HydrophobicContact CZ-CG1 4.17Å; M1000-I1004 HydrophobicContact CE-CD1 3.91Å; M1000-I1004 HydrophobicContact CE-CG1 3.77Å; M1000-I1004 WeakPolarHBondContact O-CG1 3.48Å; M1000-I1004 PolarHBondContact O-N 2.97Å; R1001-I1004 PolarHBondContact O-N 3.35Å; I1004-I1007 HydrophobicContact CD1-CD1 4.27Å; I1004-I1007 VanDerWaalsContact O-CG1 3.25Å; I1004-I1007 WeakPolarHBondContact O-CG1 3.45Å; I1004-I1007 PolarHBondContact O-N 2.96Å; I1004-S1008 PolarHBondContact O-N 3.18Å; I1004-S1008 PolarHBondContact O-OG 3.46Å
1005	R	95.5	Very high	82.4	Confident	101 Å²	101	57.7 Å²	57.7	38%	0.381	31%	0.307	S	S	.	.	H	α-helix	trans	-71.2	-33.4	177.6	-68.1	175.6	-172.7	-166.3	2.5	112.7	E922 D925 R1001 M1002 F1003 I1007 S1008	E922-R1005 IonicContact OE1-NH2 3Å; D925-R1005 WeakPolarHBondContact OD1-CG 3.24Å; D925-R1005 IonicContact OD1-NE 3.59Å; D925-R1005 PolarHBondContact OD1-NE 3.12Å; D925-R1005 IonicContact OD2-CZ 2.63Å; D925-R1005 IonicContact OD2-NE 3.37Å; D925-R1005 PolarHBondContact OD2-NE 3.05Å; D925-R1005 IonicContact OD2-NH2 3.18Å; D925-R1005 PolarHBondContact OD2-NH2 2.62Å; R1001-R1005 WeakPolarHBondContact O-CB 3.41Å; R1001-R1005 WeakPolarHBondContact O-CG 3.25Å; R1001-R1005 PolarHBondContact O-N 3.04Å; M1002-R1005 PolarHBondContact O-N 2.67Å; F1003-R1005 VanDerWaalsContact C-N 3.32Å; F1003-R1005 PolarHBondContact O-N 2.73Å; R1005-I1007 PolarHBondContact O-N 3.39Å; R1005-S1008 CarbonylContact O-C 3.18Å; R1005-S1008 PolarHBondContact O-N 3.42Å; R1005-S1008 VanDerWaalsContact O-N 3.09Å
1006	S	95.3	Very high	79.4	Confident	49 Å²	49	58.9 Å²	58.9	34%	0.343	32%	0.32	S	S	.	.	H	α-helix	trans	-70.3	-27.4	174.8	57.7	0	0	0	0	113.9	M1002 F1003 S1008	M1002-S1006 PolarHBondContact O-N 2.83Å; M1002-S1006 PolarHBondContact O-OG 3.5Å; F1003-S1006 WeakPolarHBondContact CA-OG 3.2Å; F1003-S1006 PolarHBondContact O-N 3.13Å; F1003-S1006 PolarHBondContact O-OG 2.87Å; S1006-S1008 VanDerWaalsContact C-N 3.28Å
1007	I	95.5	Very high	76.4	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	6.3	169.6	68.9	169.6	0	0	0	113.1	L897 F900 I905 F908 I928 I932 F1003 I1004 R1005	L897-I1007 HydrophobicContact CD1-CG2 3.65Å; F900-I1007 HydrophobicContact CD1-CB 4.21Å; F900-I1007 HydrophobicContact CD1-CG2 3.84Å; F900-I1007 HydrophobicContact CD2-CG2 4.13Å; F900-I1007 HydrophobicContact CE1-CB 3.94Å; F900-I1007 HydrophobicContact CE1-CD1 4.25Å; F900-I1007 HydrophobicContact CE1-CG2 3.95Å; F900-I1007 HydrophobicContact CE2-CD1 4.23Å; F900-I1007 HydrophobicContact CE2-CG2 4.24Å; F900-I1007 HydrophobicContact CG-CG2 3.93Å; F900-I1007 HydrophobicContact CZ-CB 4.27Å; F900-I1007 HydrophobicContact CZ-CD1 3.76Å; F900-I1007 HydrophobicContact CZ-CG2 4.16Å; I905-I1007 WeakPolarHBondContact CA-O 3.04Å; F908-I1007 HydrophobicContact CD2-CD1 4.3Å; F908-I1007 HydrophobicContact CE2-CD1 4.44Å; I928-I1007 HydrophobicContact CG2-CD1 4.35Å; I932-I1007 HydrophobicContact CG1-CD1 4.23Å; F1003-I1007 HydrophobicContact CE1-CD1 4.17Å; F1003-I1007 HydrophobicContact CE1-CG2 4.49Å; F1003-I1007 HydrophobicContact CE2-CG2 4.39Å; F1003-I1007 HydrophobicContact CZ-CG2 4.19Å; F1003-I1007 PolarHBondContact O-N 3.02Å; F1003-I1007 VanDerWaalsContact O-N 3.1Å; I1004-I1007 HydrophobicContact CD1-CD1 4.27Å; I1004-I1007 VanDerWaalsContact O-CG1 3.25Å; I1004-I1007 WeakPolarHBondContact O-CG1 3.45Å; I1004-I1007 PolarHBondContact O-N 2.96Å; R1005-I1007 PolarHBondContact O-N 3.39Å
1008	S	96.1	Very high	73.3	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.007	36%	0.363	C	S	.	.	S	Bend	trans	-152.3	56.6	179.3	60.6	0	0	0	0	113.7	R912 I1004 R1005 S1006 S1010	R912-S1008 WeakPolarHBondContact CD-O 3.5Å; R912-S1008 PolarHBondContact NE-O 2.9Å; R912-S1008 PolarHBondContact NE-OG 3.15Å; R912-S1008 VanDerWaalsContact NE-OG 3.16Å; R912-S1008 PolarHBondContact NH2-OG 3.43Å; I1004-S1008 PolarHBondContact O-N 3.18Å; I1004-S1008 PolarHBondContact O-OG 3.46Å; R1005-S1008 CarbonylContact O-C 3.18Å; R1005-S1008 PolarHBondContact O-N 3.42Å; R1005-S1008 VanDerWaalsContact O-N 3.09Å; S1006-S1008 VanDerWaalsContact C-N 3.28Å; S1008-S1010 PolarHBondContact O-N 3.07Å
1009	P	92.3	Very high	70.4	Confident	63 Å²	63	72.4 Å²	72.4	41%	0.409	38%	0.384	S	S	.	.			trans	-62.5	130.3	-179.4	25.7	-34.4	0	0	0	112.3	I905 S909	I905-P1009 HydrophobicContact CG2-CG 4.3Å; S909-P1009 WeakPolarHBondContact CB-O 3.4Å; S909-P1009 VanDerWaalsContact OG-CD 3.23Å; S909-P1009 WeakPolarHBondContact OG-CD 3.13Å; S909-P1009 WeakPolarHBondContact OG-CG 3.25Å; S909-P1009 PolarHBondContact OG-O 2.57Å
1010	S	80.1	Confident	67.5	Low	17 Å²	17	75.2 Å²	75.2	12%	0.119	40%	0.398	C	S	.	.			trans	-79.8	135.5	171.5	-27.8	0	0	0	0	111.2	R912 E916 S1008 L1012 N1013	R912-S1010 WeakPolarHBondContact CD-OG 3.1Å; E916-S1010 WeakPolarHBondContact OE2-CB 3.43Å; E916-S1010 PolarHBondContact OE2-OG 3.46Å; S1008-S1010 PolarHBondContact O-N 3.07Å; S1010-L1012 PolarHBondContact O-N 2.81Å; S1010-N1013 PolarHBondContact O-N 2.74Å
1011	S	66.2	Low	64.5	Low	61 Å²	61	80.8 Å²	80.8	43%	0.427	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-53.9	-34.5	174.2	54.5	0	0	0	0	113.8	E913 N1013 S1014	E913-S1011 VanDerWaalsContact OE1-CB 3.3Å; E913-S1011 WeakPolarHBondContact OE1-CB 3.46Å; E913-S1011 PolarHBondContact OE1-OG 3.46Å; S1011-N1013 PolarHBondContact O-N 3.19Å; S1011-N1013 VanDerWaalsContact O-N 3.14Å; S1011-S1014 PolarHBondContact O-N 3.43Å
1012	L	47.8	Very low	61.3	Low	132 Å²	132	85.9 Å²	85.9	69%	0.691	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-62.8	-18.1	-177.4	-87.3	74.1	0	0	0	115.2	S1010 S1014	S1010-L1012 PolarHBondContact O-N 2.81Å; L1012-S1014 VanDerWaalsContact C-N 3.33Å; L1012-S1014 PolarHBondContact O-N 2.97Å
1013	N	44	Very low	58.2	Low	104 Å²	104	84.2 Å²	84.2	56%	0.556	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-87	3.7	-176.7	-76.5	-43.1	0	0	0	114.5	S1010 S1011 H1015	S1010-N1013 PolarHBondContact O-N 2.74Å; S1011-N1013 PolarHBondContact O-N 3.19Å; S1011-N1013 VanDerWaalsContact O-N 3.14Å; N1013-H1015 PolarHBondContact O-N 3.5Å
1014	S	35.3	Very low	55.1	Low	87 Å²	87	88.4 Å²	88.4	61%	0.608	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	27.5	-178.9	-168.2	0	0	0	0	115.3	S1011 L1012	S1011-S1014 PolarHBondContact O-N 3.43Å; L1012-S1014 VanDerWaalsContact C-N 3.33Å; L1012-S1014 PolarHBondContact O-N 2.97Å
1015	H	32.9	Very low	51.9	Low	127 Å²	127	92.7 Å²	92.7	59%	0.588	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.6	9.6	-173	-103.6	27	0	0	0	115.2	N1013	N1013-H1015 PolarHBondContact O-N 3.5Å
1016	N	29.7	Very low	48.5	Very low	128 Å²	128	92 Å²	92	68%	0.684	54%	0.538	S	S	*	.	S	Bend	trans	-154.2	22.7	174.5	-93.8	-57.4	0	0	0	114.5	Q196	Q196-N1016 PolarHBondContact OE1-ND2 3.04Å; Q196-N1016 VanDerWaalsContact OE1-ND2 3.12Å
1017	N	32.1	Very low	45.1	Very low	85 Å²	85	94 Å²	94	46%	0.455	55%	0.552	S	S	.	*			trans	-140.1	24.6	-173.8	-93.5	-49.3	0	0	0	115.9	M1019 I1020	N1017-M1019 PolarHBondContact O-N 3.04Å; N1017-I1020 PolarHBondContact O-N 2.8Å; N1017-I1020 VanDerWaalsContact O-N 3.09Å
1018	D	29.1	Very low	41.9	Very low	127 Å²	127	99 Å²	99	68%	0.679	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	1.2	-176.8	-63.9	-25.4	0	0	0	114.9
1019	M	32	Very low	38.7	Very low	188 Å²	188	103.3 Å²	103.3	93%	0.926	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	-3.9	172.8	-66.8	-158.6	74.2	0	0	115.1	N1017	N1017-M1019 PolarHBondContact O-N 3.04Å
1020	I	35.4	Very low	35.5	Very low	124 Å²	124	107.1 Å²	107.1	64%	0.636	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.9	-24.5	180	-63.5	-179.2	0	0	0	112.5	N1017 N1022	N1017-I1020 PolarHBondContact O-N 2.8Å; N1017-I1020 VanDerWaalsContact O-N 3.09Å; I1020-N1022 PolarHBondContact O-N 3.37Å
1021	H	33	Very low	33.1	Very low	117 Å²	117	112.9 Å²	112.9	54%	0.542	65%	0.654	S	S	.	*	G	3₁₀ helix	trans	-76.7	-15.4	-171.5	-125.8	-67.8	0	0	0	115.8	A1023	H1021-A1023 VanDerWaalsContact C-N 3.26Å; H1021-A1023 PolarHBondContact O-N 3.33Å
1022	N	28.8	Very low	31.3	Very low	157 Å²	157	116.8 Å²	116.8	84%	0.84	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-77.5	2	-174.7	-77.8	-25.8	0	0	0	115.6	I1020	I1020-N1022 PolarHBondContact O-N 3.37Å
1023	A	28.1	Very low	30.4	Very low	92 Å²	92	119.8 Å²	119.8	76%	0.76	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-101.6	-12.2	177.1	0	0	0	0	0	114.7	H1021	H1021-A1023 VanDerWaalsContact C-N 3.26Å; H1021-A1023 PolarHBondContact O-N 3.33Å
1024	V	31.4	Very low	29.5	Very low	96 Å²	96	122.9 Å²	122.9	58%	0.582	69%	0.693	S	S	*	*	S	Bend	trans	-134.1	30.1	-168.5	-155.8	0	0	0	0	113.7
1025	T	29	Very low	29	Very low	90 Å²	90	126.2 Å²	126.2	55%	0.552	70%	0.704	S	S	*	*			trans	-143.6	90.2	168.5	37.3	0	0	0	0	112.8	S1027	T1025-S1027 PolarHBondContact O-N 2.93Å
1026	G	24.4	Very low	28.8	Very low	87 Å²	87	127.5 Å²	127.5	90%	0.897	71%	0.714	S	S	*	*	S	Bend	trans	-76.3	66.8	169.1	0	0	0	0	0	113
1027	S	23.5	Very low	28.5	Very low	91 Å²	91	130.1 Å²	130.1	64%	0.636	73%	0.727	S	S	*	*			trans	60.1	102.5	177.9	-164.3	0	0	0	0	116.6	T1025	T1025-S1027 PolarHBondContact O-N 2.93Å
1028	V	28.7	Very low	28.2	Very low	105 Å²	105	130.8 Å²	130.8	64%	0.636	74%	0.739	S	S	*	*			trans	-124.3	123.5	153.4	177.3	0	0	0	0	106.7
1029	T	28.1	Very low	28.4	Very low	92 Å²	92	130.8 Å²	130.8	56%	0.564	75%	0.746	S	S	*	*			trans	-73.3	141.3	177	43.2	0	0	0	0	111.1	D1031	T1029-D1031 PolarHBondContact O-N 3.24Å
1030	I	26.4	Very low	28	Very low	142 Å²	142	128 Å²	128	73%	0.728	74%	0.739	S	S	*	*			trans	-86.4	94.9	-178.6	-54.7	172	0	0	0	109.4	N1032	I1030-N1032 PolarHBondContact O-N 2.9Å
1031	D	30.3	Very low	27.6	Very low	138 Å²	138	129 Å²	129	74%	0.738	75%	0.746	S	S	*	*			trans	-86.5	106.7	170.6	-67.3	-36.2	0	0	0	109.8	T1029	T1029-D1031 PolarHBondContact O-N 3.24Å
1032	N	26.9	Very low	27.2	Very low	144 Å²	144	130.7 Å²	130.7	77%	0.77	76%	0.759	S	S	*	*			trans	-87	103.4	-179.2	-72	-83.5	0	0	0	110.9	I1030	I1030-N1032 PolarHBondContact O-N 2.9Å
1033	E	29.3	Very low	27.2	Very low	195 Å²	195	129.2 Å²	129.2	91%	0.911	76%	0.761	S	S	*	*			trans	-148.6	79.4	167.1	-143	165.7	-125.9	0	0	113.8
1034	M	24.8	Very low	27.2	Very low	168 Å²	168	133.7 Å²	133.7	83%	0.828	77%	0.766	S	S	*	*			trans	-139.8	67.3	166.2	-166	-179.3	74.3	0	0	111.3
1035	L	25.1	Very low	27.3	Very low	157 Å²	157	133.9 Å²	133.9	82%	0.822	77%	0.769	S	S	*	*			trans	-148.4	141.1	170.9	-99.2	177.9	0	0	0	111.9
1036	L	28.7	Very low	27.1	Very low	154 Å²	154	135.4 Å²	135.4	81%	0.806	78%	0.778	S	S	*	*			trans	74.8	71.9	166.9	-56.9	172.3	0	0	0	118.5
1037	L	23.7	Very low	27.2	Very low	183 Å²	183	140.3 Å²	140.3	96%	0.958	78%	0.775	S	S	*	*			trans	-79	117.6	142.6	-85.7	168.2	0	0	0	110.3
1038	S	25.5	Very low	27.3	Very low	100 Å²	100	144.3 Å²	144.3	70%	0.699	79%	0.787	S	S	*	*			trans	-158.8	128.7	158.7	55.2	0	0	0	0	110.2
1039	P	32.7	Very low	27	Very low	127 Å²	127	144.5 Å²	144.5	83%	0.825	79%	0.793	S	S	*	*			trans	-109.6	139.6	-159.6	38.1	-32.5	0	0	0	116.1
1040	T	25.2	Very low	26.8	Very low	130 Å²	130	146 Å²	146	80%	0.798	80%	0.803	S	S	*	*			trans	-155.3	126.1	155.7	47.4	0	0	0	0	113.3
1041	N	26.9	Very low	26.7	Very low	144 Å²	144	147 Å²	147	77%	0.77	81%	0.809	S	S	*	*			trans	50.1	109.4	145.1	-59.6	-2.9	0	0	0	122.4
1042	N	25	Very low	26.5	Very low	152 Å²	152	147.3 Å²	147.3	81%	0.813	82%	0.815	S	S	*	*				49	92	126	-58.9	3	0	0	0	120.6
1043	S	27.2	Very low	26.4	Very low	126 Å²	126	150.1 Å²	150.1	88%	0.881	82%	0.82	S	S	*	*				-163.7	147.9	115.5	14.7	0	0	0	0	111.6
1044	H	28	Very low	26.1	Very low	187 Å²	187	147.5 Å²	147.5	87%	0.866	82%	0.818	S	S	*	*			trans	-97.8	169.4	-177.9	-83.8	-69	0	0	0	111.4
1045	P	34.8	Very low	26.1	Very low	100 Å²	100	145.9 Å²	145.9	65%	0.649	81%	0.808	S	S	*	*			cis	-141.3	-163.6	-35.8	36.3	-15.9	0	0	0	113.4
1046	T	23.9	Very low	26.1	Very low	122 Å²	122	145.9 Å²	145.9	75%	0.748	81%	0.809	S	S	*	*			trans	86.2	153.4	164.5	76.1	0	0	0	0	119.8
1047	K	26.1	Very low	26	Very low	190 Å²	190	142.2 Å²	142.2	83%	0.826	79%	0.79	S	S	*	*	S	Bend	trans	70.1	34.8	168.8	-63.6	-174.2	178.8	176.4	0	119.5
1048	I	25.5	Very low	26.4	Very low	174 Å²	174	137 Å²	137	89%	0.892	77%	0.766	S	S	*	*			trans	-132.8	87.8	148.5	-52.8	-179.9	0	0	0	109.3
1049	S	23.5	Very low	26.8	Very low	109 Å²	109	136.2 Å²	136.2	76%	0.762	75%	0.75	S	S	*	*	S	Bend	trans	-155.2	9.4	178.4	56.8	0	0	0	0	115.2
1050	T	24.4	Very low	26.9	Very low	125 Å²	125	134.1 Å²	134.1	77%	0.767	73%	0.731	S	S	*	*	S	Bend	trans	-133.8	25.2	-162.3	55.7	0	0	0	0	114.9
1051	L	22.5	Very low	27.8	Very low	163 Å²	163	129 Å²	129	85%	0.853	70%	0.7	S	S	*	*	S	Bend	trans	-140.7	11.8	-174.3	-113.2	166.1	0	0	0	117.8
1052	V	26.7	Very low	29	Very low	143 Å²	143	124.4 Å²	124.4	87%	0.867	68%	0.675	S	S	*	*			trans	-138.2	82.6	169.2	-171.1	0	0	0	0	111
1053	K	25	Very low	31.1	Very low	204 Å²	204	118.6 Å²	118.6	89%	0.887	64%	0.644	S	S	*	*			trans	-145.4	20.1	174.1	-91.6	-156.8	175.9	-171.2	0	115.4
1054	T	23.1	Very low	33.5	Very low	139 Å²	139	114.4 Å²	114.4	85%	0.853	61%	0.611	S	S	*	*			trans	-130.4	55.8	-175.6	52.6	0	0	0	0	114.1
1055	Q	24.8	Very low	36.2	Very low	134 Å²	134	105.6 Å²	105.6	63%	0.626	57%	0.57	S	S	*	*	S	Bend	trans	-134.5	126.1	150.1	-81.9	-165.9	11.5	0	0	110.4	N1057	Q1055-N1057 PolarHBondContact O-N 3.45Å
1056	N	24.8	Very low	38.4	Very low	157 Å²	157	101.1 Å²	101.1	84%	0.84	54%	0.541	S	S	*	.			trans	-34.8	111.5	-177.8	-51.8	-38.4	0	0	0	114.9
1057	N	27.2	Very low	41.2	Very low	78 Å²	78	96.4 Å²	96.4	42%	0.417	51%	0.51	S	S	.	.			trans	-165.9	162.7	148.2	-92.6	-53.7	0	0	0	111.2	V903 Q1055 K1059	V903-N1057 HydrophobicContact CG2-CB 4.45Å; V903-N1057 WeakPolarHBondContact CG2-ND2 3.45Å; V903-N1057 WeakPolarHBondContact CG2-OD1 3.49Å; Q1055-N1057 PolarHBondContact O-N 3.45Å; N1057-K1059 VanDerWaalsContact C-N 3.33Å; N1057-K1059 PolarHBondContact O-N 3.22Å
1058	V	32.2	Very low	44.2	Very low	72 Å²	72	87.4 Å²	87.4	44%	0.436	47%	0.471	S	S	.	.			trans	-81.9	68.4	-164	-171.1	0	0	0	0	112.5	D1060 T1061	V1058-D1060 PolarHBondContact O-N 3.07Å; V1058-T1061 HydrophobicContact CG1-CG2 3.58Å
1059	K	32.8	Very low	47.1	Very low	84 Å²	84	79.1 Å²	79.1	37%	0.365	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	38	-170.7	-147.1	-172.5	177.8	-174.1	0	115.7	E764 N765 N767 N1057	E764-K1059 WeakPolarHBondContact O-CE 3.43Å; N765-K1059 WeakPolarHBondContact O-CE 3.47Å; N765-K1059 PolarHBondContact O-NZ 3.03Å; N767-K1059 VanDerWaalsContact CG-NZ 3.28Å; N767-K1059 VanDerWaalsContact OD1-CE 3.28Å; N767-K1059 WeakPolarHBondContact OD1-CE 3.37Å; N767-K1059 PolarHBondContact OD1-NZ 2.91Å; N1057-K1059 VanDerWaalsContact C-N 3.33Å; N1057-K1059 PolarHBondContact O-N 3.22Å
1060	D	36.5	Very low	50	Low	83 Å²	83	76.7 Å²	76.7	44%	0.444	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-152.9	15.9	-170.8	-127.2	-44.9	0	0	0	116.3	K509 R513 V1058	K509-D1060 WeakPolarHBondContact CD-O 3.41Å; K509-D1060 PolarHBondContact NZ-O 2.86Å; K509-D1060 IonicContact NZ-OD1 2.87Å; K509-D1060 PolarHBondContact NZ-OD1 2.99Å; R513-D1060 IonicContact NH1-OD1 3.18Å; V1058-D1060 PolarHBondContact O-N 3.07Å
1061	T	43.3	Very low	53.1	Low	24 Å²	24	70.8 Å²	70.8	15%	0.147	37%	0.371	C	S	.	.	S	Bend	trans	-92.5	-14.8	-166.2	37.7	0	0	0	0	118.3	V1058	V1058-T1061 HydrophobicContact CG1-CG2 3.58Å
1062	I	52.7	Low	56.3	Low	47 Å²	47	63.3 Å²	63.3	24%	0.241	33%	0.332	C	S	.	.	S	Bend	trans	-131.5	156.3	-179.4	-56.5	-176	0	0	0	110	K509 Y761 E1067	K509-I1062 PolarHBondContact NZ-O 3.22Å; Y761-I1062 HydrophobicContact CD1-CD1 3.74Å; Y761-I1062 HydrophobicContact CD2-CD1 3.69Å; Y761-I1062 HydrophobicContact CE1-CD1 3.58Å; Y761-I1062 HydrophobicContact CE2-CD1 3.52Å; Y761-I1062 HydrophobicContact CG-CD1 3.8Å; Y761-I1062 VanDerWaalsContact CZ-CD1 3.47Å; I1062-E1067 HydrophobicContact CG2-CG 3.68Å
1063	D	68.7	Low	59.1	Low	30 Å²	30	59.2 Å²	59.2	16%	0.16	31%	0.305	C	S	.	.			trans	-83.8	123.1	172.2	-171.3	-22.2	0	0	0	110.2	N1065 C1066 E1067	D1063-N1065 VanDerWaalsContact C-N 3.29Å; D1063-N1065 PolarHBondContact O-N 3.07Å; D1063-N1065 WeakPolarHBondContact OD1-CB 3.28Å; D1063-N1065 PolarHBondContact OD1-N 3Å; D1063-C1066 HydrophobicContact CB-CB 4.16Å; D1063-C1066 PolarHBondContact O-N 3.46Å; D1063-E1067 PolarHBondContact O-N 2.89Å
1064	E	78	Confident	62	Low	38 Å²	38	50 Å²	50	18%	0.178	27%	0.265	C	S	.	.	H	α-helix	trans	-67.3	-29.4	-178.5	-172.8	171	-174	0	0	112.5	R728 L762 L1068	R728-E1064 IonicContact CZ-OE1 3.4Å; R728-E1064 IonicContact NE-OE1 3.27Å; R728-E1064 PolarHBondContact NE-OE1 3.41Å; R728-E1064 IonicContact NH2-OE1 3.24Å; R728-E1064 PolarHBondContact NH2-OE1 3.41Å; R728-E1064 IonicContact NH2-OE2 2.71Å; L762-E1064 HydrophobicContact CD1-CG 4.47Å; E1064-L1068 HydrophobicContact CG-CD1 3.92Å; E1064-L1068 WeakPolarHBondContact O-CB 3.48Å; E1064-L1068 WeakPolarHBondContact O-CD1 3.19Å; E1064-L1068 VanDerWaalsContact O-CG 3.29Å; E1064-L1068 WeakPolarHBondContact O-CG 3.44Å; E1064-L1068 PolarHBondContact O-N 2.83Å
1065	N	83.4	Confident	65	Low	2 Å²	2	43.4 Å²	43.4	1%	0.011	23%	0.225	C	C	.	.	H	α-helix	trans	-67	-39.6	174.7	-67.6	-9.3	0	0	0	111.2	E520 V718 L721 Y724 D1063 L1068 A1069	E520-N1065 WeakPolarHBondContact CA-ND2 3.31Å; E520-N1065 PolarHBondContact O-ND2 2.76Å; V718-N1065 HydrophobicContact CG1-CB 3.48Å; V718-N1065 VanDerWaalsContact CG1-CB 3.48Å; L721-N1065 WeakPolarHBondContact CA-OD1 3.21Å; L721-N1065 WeakPolarHBondContact CB-OD1 3.18Å; L721-N1065 VanDerWaalsContact CD1-OD1 3.25Å; L721-N1065 WeakPolarHBondContact CD1-OD1 3.27Å; Y724-N1065 HydrophobicContact CE2-CB 4.48Å; D1063-N1065 VanDerWaalsContact C-N 3.29Å; D1063-N1065 PolarHBondContact O-N 3.07Å; D1063-N1065 WeakPolarHBondContact OD1-CB 3.28Å; D1063-N1065 PolarHBondContact OD1-N 3Å; N1065-L1068 PolarHBondContact O-N 3.34Å; N1065-A1069 VanDerWaalsContact O-CB 3.24Å; N1065-A1069 WeakPolarHBondContact O-CB 3.39Å; N1065-A1069 PolarHBondContact O-N 3.14Å
1066	C	81	Confident	67.9	Low	5 Å²	5	37.6 Å²	37.6	3%	0.034	20%	0.199	C	C	.	.	H	α-helix	trans	-68.9	-39.5	179.7	-60.2	0	0	0	0	111.6	E526 D1063 A1069 N1070	E526-C1066 PolarHBondContact OE2-SG 3.05Å; D1063-C1066 HydrophobicContact CB-CB 4.16Å; D1063-C1066 PolarHBondContact O-N 3.46Å; C1066-A1069 PolarHBondContact O-N 3.35Å; C1066-N1070 WeakPolarHBondContact O-CB 3.37Å; C1066-N1070 VanDerWaalsContact O-CG 3.32Å; C1066-N1070 PolarHBondContact O-N 2.8Å; C1066-N1070 PolarHBondContact O-ND2 3.4Å
1067	E	83.7	Confident	70.6	Confident	23 Å²	23	33.5 Å²	33.5	11%	0.107	18%	0.177	C	C	.	.	H	α-helix	trans	-68.5	-37.9	173.2	-69.6	-56.2	139.8	0	0	112.5	S758 I1062 D1063 A1069 N1070 L1071	S758-E1067 WeakPolarHBondContact CA-OE2 3.25Å; S758-E1067 WeakPolarHBondContact CB-OE2 3.44Å; S758-E1067 PolarHBondContact OG-OE2 2.86Å; I1062-E1067 HydrophobicContact CG2-CG 3.68Å; D1063-E1067 PolarHBondContact O-N 2.89Å; E1067-A1069 VanDerWaalsContact C-N 3.32Å; E1067-A1069 PolarHBondContact O-N 3.32Å; E1067-N1070 PolarHBondContact O-N 3.36Å; E1067-L1071 WeakPolarHBondContact O-CB 3.5Å; E1067-L1071 PolarHBondContact O-N 3.33Å
1068	L	88.4	Confident	73.2	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-69.3	-29.5	173.7	-72	165.6	0	0	0	112.5	L721 Y724 R728 L762 E1064 N1065 H1072	L721-L1068 HydrophobicContact CD1-CD1 4.02Å; Y724-L1068 HydrophobicContact CD1-CB 3.97Å; Y724-L1068 HydrophobicContact CD2-CB 4.17Å; Y724-L1068 HydrophobicContact CG-CB 3.72Å; R728-L1068 HydrophobicContact CB-CD1 4.01Å; R728-L1068 HydrophobicContact CB-CD2 3.9Å; R728-L1068 HydrophobicContact CG-CD1 4.12Å; R728-L1068 HydrophobicContact CG-CD2 4.34Å; L762-L1068 HydrophobicContact CD1-CD2 4.04Å; L762-L1068 HydrophobicContact CD1-CG 4.38Å; L762-L1068 HydrophobicContact CD2-CD2 4.37Å; E1064-L1068 HydrophobicContact CG-CD1 3.92Å; E1064-L1068 WeakPolarHBondContact O-CB 3.48Å; E1064-L1068 WeakPolarHBondContact O-CD1 3.19Å; E1064-L1068 VanDerWaalsContact O-CG 3.29Å; E1064-L1068 WeakPolarHBondContact O-CG 3.44Å; E1064-L1068 PolarHBondContact O-N 2.83Å; N1065-L1068 PolarHBondContact O-N 3.34Å; L1068-H1072 VanDerWaalsContact O-CB 3.27Å; L1068-H1072 WeakPolarHBondContact O-CB 3.21Å; L1068-H1072 PolarHBondContact O-N 2.95Å
1069	A	86.2	Confident	75.6	Confident	1 Å²	1	27.5 Å²	27.5	1%	0.008	14%	0.143	C	C	.	.	H	α-helix	trans	-72.2	-42.3	171.2	0	0	0	0	0	112.2	L716 V718 Y724 N1065 C1066 E1067 H1072 L1073	L716-A1069 HydrophobicContact CD1-CB 3.98Å; L716-A1069 HydrophobicContact CD2-CB 3.98Å; L716-A1069 HydrophobicContact CG-CB 4.08Å; V718-A1069 HydrophobicContact CG2-CB 4.06Å; Y724-A1069 HydrophobicContact CE1-CB 4.31Å; Y724-A1069 HydrophobicContact CE2-CB 4.42Å; Y724-A1069 WeakPolarHBondContact OH-CB 3.39Å; N1065-A1069 VanDerWaalsContact O-CB 3.24Å; N1065-A1069 WeakPolarHBondContact O-CB 3.39Å; N1065-A1069 PolarHBondContact O-N 3.14Å; C1066-A1069 PolarHBondContact O-N 3.35Å; E1067-A1069 VanDerWaalsContact C-N 3.32Å; E1067-A1069 PolarHBondContact O-N 3.32Å; A1069-H1072 PolarHBondContact O-N 3.23Å; A1069-L1073 WeakPolarHBondContact O-CB 3.32Å; A1069-L1073 PolarHBondContact O-N 3.37Å
1070	N	84.9	Confident	77.7	Confident	57 Å²	57	24.2 Å²	24.2	31%	0.305	13%	0.129	S	C	.	.	H	α-helix	trans	-60.4	-45	171.4	-76.8	-28.8	0	0	0	111.2	L716 C1066 E1067 L1073 I1074	L716-N1070 WeakPolarHBondContact CD2-OD1 3.19Å; C1066-N1070 WeakPolarHBondContact O-CB 3.37Å; C1066-N1070 VanDerWaalsContact O-CG 3.32Å; C1066-N1070 PolarHBondContact O-N 2.8Å; C1066-N1070 PolarHBondContact O-ND2 3.4Å; E1067-N1070 PolarHBondContact O-N 3.36Å; N1070-L1073 WeakPolarHBondContact O-CB 3.36Å; N1070-L1073 PolarHBondContact O-N 2.98Å; N1070-I1074 VanDerWaalsContact O-CG1 3.3Å; N1070-I1074 WeakPolarHBondContact O-CG1 3.23Å; N1070-I1074 PolarHBondContact O-N 3.17Å
1071	L	89	Confident	78.7	Confident	2 Å²	2	22.3 Å²	22.3	1%	0.01	12%	0.122	C	C	.	.	H	α-helix	trans	-69.1	-38.5	179.6	-164.8	154.4	0	0	0	111.4	L727 V731 L759 E1067 I1074 L1075	L727-L1071 HydrophobicContact CD1-CD2 4.23Å; L727-L1071 HydrophobicContact CD2-CD2 4.19Å; L727-L1071 HydrophobicContact CG-CD2 4.31Å; V731-L1071 HydrophobicContact CG1-CD1 4.1Å; V731-L1071 HydrophobicContact CG2-CD2 3.75Å; L759-L1071 HydrophobicContact CD2-CD1 4.1Å; E1067-L1071 WeakPolarHBondContact O-CB 3.5Å; E1067-L1071 PolarHBondContact O-N 3.33Å; L1071-I1074 PolarHBondContact O-N 3.29Å; L1071-L1075 HydrophobicContact CD2-CD1 3.49Å; L1071-L1075 VanDerWaalsContact CD2-CD1 3.49Å; L1071-L1075 HydrophobicContact CD2-CG 4.05Å; L1071-L1075 WeakPolarHBondContact O-CB 3.39Å; L1071-L1075 WeakPolarHBondContact O-CG 3.44Å; L1071-L1075 PolarHBondContact O-N 3.05Å
1072	H	89.2	Confident	78.3	Confident	5 Å²	5	24.6 Å²	24.6	2%	0.023	13%	0.133	C	C	.	.	H	α-helix	trans	-56.6	-48.5	166.7	167.7	-100.6	0	0	0	111.3	Y724 L727 L1068 A1069 I1074 S1076 L1171 I1174 S1175	Y724-H1072 HydrophobicContact CE1-CB 4.31Å; L727-H1072 HydrophobicContact CD2-CB 3.94Å; L1068-H1072 VanDerWaalsContact O-CB 3.27Å; L1068-H1072 WeakPolarHBondContact O-CB 3.21Å; L1068-H1072 PolarHBondContact O-N 2.95Å; A1069-H1072 PolarHBondContact O-N 3.23Å; H1072-I1074 PolarHBondContact O-N 2.82Å; H1072-S1076 PolarHBondContact CD2-OG 3.46Å; H1072-S1076 PolarHBondContact NE2-OG 3.04Å; H1072-S1076 VanDerWaalsContact NE2-OG 3.16Å; H1072-S1076 WeakPolarHBondContact O-CB 3.33Å; H1072-S1076 PolarHBondContact O-N 3.46Å; H1072-S1076 PolarHBondContact O-OG 3.5Å; H1072-L1171 PolarHBondContact NE2-O 2.83Å; H1072-I1174 HydrophobicContact CB-CG2 4.44Å; H1072-I1174 WeakPolarHBondContact CD2-CG2 3.33Å; H1072-I1174 WeakPolarHBondContact NE2-CG2 3.34Å; H1072-S1175 PolarHBondContact CE1-OG 3.33Å; H1072-S1175 PolarHBondContact NE2-OG 2.86Å; H1072-S1175 VanDerWaalsContact NE2-OG 3.14Å
1073	L	85.8	Confident	77	Confident	57 Å²	57	27.3 Å²	27.3	30%	0.298	16%	0.157	S	C	.	.	H	α-helix	trans	-63.5	-39.2	178.1	-82	-163.3	0	0	0	113.2	R634 L716 A1069 N1070 D1077	R634-L1073 PolarHBondContact NH1-O 3.14Å; R634-L1073 PolarHBondContact NH2-O 3.42Å; L716-L1073 HydrophobicContact CD1-CD1 3.4Å; L716-L1073 VanDerWaalsContact CD1-CD1 3.4Å; L716-L1073 HydrophobicContact CD1-CG 3.92Å; A1069-L1073 WeakPolarHBondContact O-CB 3.32Å; A1069-L1073 PolarHBondContact O-N 3.37Å; N1070-L1073 WeakPolarHBondContact O-CB 3.36Å; N1070-L1073 PolarHBondContact O-N 2.98Å; L1073-D1077 PolarHBondContact O-N 3.15Å
1074	I	85.5	Confident	75.1	Confident	12 Å²	12	31.1 Å²	31.1	6%	0.062	18%	0.183	C	C	.	.	H	α-helix	trans	-67.4	-49.3	178.8	-69.8	163.1	0	0	0	110	E754 N1070 L1071 H1072 S1076 D1077 V1078	E754-I1074 HydrophobicContact CB-CD1 4.1Å; N1070-I1074 VanDerWaalsContact O-CG1 3.3Å; N1070-I1074 WeakPolarHBondContact O-CG1 3.23Å; N1070-I1074 PolarHBondContact O-N 3.17Å; L1071-I1074 PolarHBondContact O-N 3.29Å; H1072-I1074 PolarHBondContact O-N 2.82Å; I1074-S1076 VanDerWaalsContact C-N 3.34Å; I1074-S1076 PolarHBondContact O-N 3.35Å; I1074-D1077 PolarHBondContact O-N 3.25Å; I1074-V1078 WeakPolarHBondContact O-CG2 3.49Å; I1074-V1078 PolarHBondContact O-N 3.4Å
1075	L	87.5	Confident	72.8	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-68.5	-33.7	179.3	-63.5	-177.4	0	0	0	112.2	L727 L738 L742 L1071 V1078 M1079 L1167 L1171	L727-L1075 HydrophobicContact CD1-CD1 4.2Å; L738-L1075 HydrophobicContact CD1-CD2 4.35Å; L742-L1075 HydrophobicContact CD1-CD2 3.75Å; L742-L1075 HydrophobicContact CD2-CD2 4.09Å; L1071-L1075 HydrophobicContact CD2-CD1 3.49Å; L1071-L1075 VanDerWaalsContact CD2-CD1 3.49Å; L1071-L1075 HydrophobicContact CD2-CG 4.05Å; L1071-L1075 WeakPolarHBondContact O-CB 3.39Å; L1071-L1075 WeakPolarHBondContact O-CG 3.44Å; L1071-L1075 PolarHBondContact O-N 3.05Å; L1075-V1078 PolarHBondContact O-N 3.39Å; L1075-M1079 WeakPolarHBondContact O-CB 3.36Å; L1075-M1079 VanDerWaalsContact O-CG 3.24Å; L1075-M1079 WeakPolarHBondContact O-CG 3.47Å; L1075-M1079 PolarHBondContact O-N 3.5Å; L1075-L1167 HydrophobicContact CD1-CD1 3.87Å; L1075-L1167 HydrophobicContact CD1-CD2 4.15Å; L1075-L1171 HydrophobicContact CB-CD1 3.8Å; L1075-L1171 HydrophobicContact CB-CD2 3.99Å
1076	S	85.6	Confident	70.1	Confident	11 Å²	11	39.3 Å²	39.3	8%	0.077	24%	0.235	C	C	.	.	H	α-helix	trans	-66.7	-37	177.5	-68.2	0	0	0	0	112.5	H1072 I1074 V1078 F1080	H1072-S1076 PolarHBondContact CD2-OG 3.46Å; H1072-S1076 PolarHBondContact NE2-OG 3.04Å; H1072-S1076 VanDerWaalsContact NE2-OG 3.16Å; H1072-S1076 WeakPolarHBondContact O-CB 3.33Å; H1072-S1076 PolarHBondContact O-N 3.46Å; H1072-S1076 PolarHBondContact O-OG 3.5Å; I1074-S1076 VanDerWaalsContact C-N 3.34Å; I1074-S1076 PolarHBondContact O-N 3.35Å; S1076-V1078 VanDerWaalsContact C-N 3.35Å; S1076-F1080 CarbonylContact O-C 3.51Å; S1076-F1080 WeakPolarHBondContact O-CA 3.13Å; S1076-F1080 VanDerWaalsContact O-CB 3.29Å; S1076-F1080 WeakPolarHBondContact O-CB 3.31Å; S1076-F1080 WeakPolarHBondContact O-CD2 3.12Å; S1076-F1080 PolarHBondContact O-N 3.29Å
1077	D	80.3	Confident	67.4	Low	71 Å²	71	41.2 Å²	41.2	38%	0.38	25%	0.251	S	S	.	.	H	α-helix	trans	-67.9	-34.1	173.7	-87.1	28.9	0	0	0	112.4	R634 L1073 I1074 S1081	R634-D1077 VanDerWaalsContact CD-OD2 3.29Å; R634-D1077 WeakPolarHBondContact CD-OD2 3.4Å; R634-D1077 IonicContact CZ-OD1 2.67Å; R634-D1077 VanDerWaalsContact CZ-OD1 3.27Å; R634-D1077 IonicContact CZ-OD2 3.71Å; R634-D1077 IonicContact NE-OD1 2.82Å; R634-D1077 IonicContact NE-OD2 3.75Å; R634-D1077 PolarHBondContact NE-OD2 2.78Å; R634-D1077 IonicContact NH1-OD2 3.55Å; R634-D1077 PolarHBondContact NH1-OD2 2.92Å; R634-D1077 IonicContact NH2-OD1 3.66Å; R634-D1077 PolarHBondContact NH2-OD1 2.9Å; R634-D1077 IonicContact NH2-OD2 3.87Å; R634-D1077 PolarHBondContact NH2-OD2 2.96Å; L1073-D1077 PolarHBondContact O-N 3.15Å; I1074-D1077 PolarHBondContact O-N 3.25Å; D1077-S1081 PolarHBondContact O-N 2.85Å
1078	V	81.9	Confident	64.6	Low	24 Å²	24	41.5 Å²	41.5	15%	0.145	25%	0.254	C	S	.	.	H	α-helix	trans	-71.8	-39.6	177.1	174.4	0	0	0	0	111.7	W741 L742 L745 L747 I1074 L1075 S1076 V1156	W741-V1078 HydrophobicContact CH2-CG1 4.39Å; L742-V1078 HydrophobicContact CD2-CG1 4.16Å; L745-V1078 HydrophobicContact CD1-CG1 3.91Å; L747-V1078 HydrophobicContact CD2-CG2 3.97Å; I1074-V1078 WeakPolarHBondContact O-CG2 3.49Å; I1074-V1078 PolarHBondContact O-N 3.4Å; L1075-V1078 PolarHBondContact O-N 3.39Å; S1076-V1078 VanDerWaalsContact C-N 3.35Å; V1078-V1156 HydrophobicContact CG1-CG1 4.4Å
1079	M	83	Confident	61.5	Low	1 Å²	1	46.2 Å²	46.2	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-84.8	-32.1	-177.6	-67.5	-65.6	-68.3	0	0	113.6	W741 L1075 L1152 N1153 V1156 M1157 L1160 P1168 L1171	W741-M1079 HydrophobicContact CH2-CG 4.46Å; W741-M1079 HydrophobicContact CH2-SD 3.53Å; W741-M1079 VanDerWaalsContact CH2-SD 3.53Å; W741-M1079 HydrophobicContact CZ2-SD 3.85Å; L1075-M1079 WeakPolarHBondContact O-CB 3.36Å; L1075-M1079 VanDerWaalsContact O-CG 3.24Å; L1075-M1079 WeakPolarHBondContact O-CG 3.47Å; L1075-M1079 PolarHBondContact O-N 3.5Å; M1079-L1152 HydrophobicContact CE-CD2 4.13Å; M1079-N1153 PolarHBondContact O-N 3.12Å; M1079-N1153 VanDerWaalsContact O-N 3.14Å; M1079-V1156 HydrophobicContact SD-CG1 3.61Å; M1079-M1157 HydrophobicContact CE-SD 3.61Å; M1079-L1160 HydrophobicContact CE-CD2 4.24Å; M1079-P1168 HydrophobicContact CE-CB 3.67Å; M1079-P1168 HydrophobicContact CE-CG 3.94Å; M1079-L1171 HydrophobicContact CB-CD1 4.28Å; M1079-L1171 HydrophobicContact CG-CD1 3.85Å
1080	F	76.4	Confident	58.6	Low	15 Å²	15	50.6 Å²	50.6	7%	0.066	31%	0.309	C	S	.	.	S	Bend	trans	-135	58.2	-170.4	-48.9	-85.2	0	0	0	110.8	S1076 D1082 K1150 L1152 P1168 L1171 D1172	S1076-F1080 CarbonylContact O-C 3.51Å; S1076-F1080 WeakPolarHBondContact O-CA 3.13Å; S1076-F1080 VanDerWaalsContact O-CB 3.29Å; S1076-F1080 WeakPolarHBondContact O-CB 3.31Å; S1076-F1080 WeakPolarHBondContact O-CD2 3.12Å; S1076-F1080 PolarHBondContact O-N 3.29Å; F1080-D1082 PolarHBondContact O-N 3.5Å; F1080-K1150 HydrophobicContact CB-CB 4Å; F1080-K1150 HydrophobicContact CB-CD 3.81Å; F1080-K1150 HydrophobicContact CB-CG 4.03Å; F1080-K1150 HydrophobicContact CD1-CB 4.11Å; F1080-K1150 HydrophobicContact CG-CB 4.41Å; F1080-K1150 PolarHBondContact O-NZ 3.01Å; F1080-L1152 HydrophobicContact CD1-CD2 3.82Å; F1080-L1152 HydrophobicContact CD1-CG 4.26Å; F1080-L1152 HydrophobicContact CE1-CD2 3.28Å; F1080-L1152 HydrophobicContact CE1-CG 3.8Å; F1080-L1152 HydrophobicContact CZ-CD2 3.77Å; F1080-P1168 HydrophobicContact CZ-CB 4.32Å; F1080-L1171 HydrophobicContact CE2-CB 3.78Å; F1080-L1171 HydrophobicContact CE2-CD1 4.15Å; F1080-L1171 HydrophobicContact CZ-CB 4.48Å; F1080-D1172 HydrophobicContact CZ-CB 4.47Å
1081	S	57.3	Low	55.8	Low	43 Å²	43	52.1 Å²	52.1	30%	0.301	32%	0.318	S	S	.	.			trans	-58.2	128.3	174.1	52.3	0	0	0	0	111.6	D1077	D1077-S1081 PolarHBondContact O-N 2.85Å
1082	D	36.4	Very low	52.6	Low	71 Å²	71	59.5 Å²	59.5	38%	0.38	36%	0.357	S	S	.	.			trans	-83.6	124.6	165.7	-61.8	-41	0	0	0	109.3	F1080 P1084 Y1148 K1150	F1080-D1082 PolarHBondContact O-N 3.5Å; D1082-P1084 WeakPolarHBondContact O-CD 3.36Å; D1082-P1084 VanDerWaalsContact O-N 3.15Å; D1082-Y1148 VanDerWaalsContact OD1-CE1 3.26Å; D1082-Y1148 WeakPolarHBondContact OD1-CE1 3.28Å; D1082-K1150 WeakPolarHBondContact OD1-CE 3Å; D1082-K1150 IonicContact OD1-NZ 3.38Å; D1082-K1150 PolarHBondContact OD1-NZ 2.9Å; D1082-K1150 WeakPolarHBondContact OD2-CE 3.45Å; D1082-K1150 IonicContact OD2-NZ 3.94Å; D1082-K1150 PolarHBondContact OD2-NZ 3.42Å
1083	S	25.8	Very low	49.6	Very low	105 Å²	105	64.5 Å²	64.5	73%	0.734	39%	0.388	S	S	*	.	S	Bend	trans	-66.5	109.2	169.3	-54.6	0	0	0	0	108.8
1084	P	27.9	Very low	46.6	Very low	110 Å²	110	69 Å²	69	71%	0.714	41%	0.411	S	S	*	.				-117.3	76.1	96.1	35.4	-34	0	0	0	111.6	D1082 S1086	D1082-P1084 WeakPolarHBondContact O-CD 3.36Å; D1082-P1084 VanDerWaalsContact O-N 3.15Å; P1084-S1086 PolarHBondContact O-OG 3.47Å
1085	I	29.9	Very low	43.6	Very low	110 Å²	110	75.3 Å²	75.3	56%	0.564	44%	0.444	S	S	*	.			trans	-105	120.8	150	-63.6	176.3	0	0	0	102.1	A1087	I1085-A1087 CarbonylContact C-O 3.44Å; I1085-A1087 HydrophobicContact CG2-CB 3.74Å; I1085-A1087 VanDerWaalsContact CG2-N 3.27Å; I1085-A1087 WeakPolarHBondContact CG2-O 3.2Å
1086	S	26.6	Very low	40.5	Very low	101 Å²	101	80.3 Å²	80.3	71%	0.706	48%	0.479	S	S	*	.			cis	37.5	65.4	4.8	64.5	0	0	0	0	115.6	P1084	P1084-S1086 PolarHBondContact O-OG 3.47Å
1087	A	24.7	Very low	37.6	Very low	45 Å²	45	83.8 Å²	83.8	37%	0.372	52%	0.517	S	S	.	.	S	Bend	cis	-48.7	128.6	24.8	0	0	0	0	0	118.7	I1085 C1089	I1085-A1087 CarbonylContact C-O 3.44Å; I1085-A1087 HydrophobicContact CG2-CB 3.74Å; I1085-A1087 VanDerWaalsContact CG2-N 3.27Å; I1085-A1087 WeakPolarHBondContact CG2-O 3.2Å; A1087-C1089 PolarHBondContact O-N 2.66Å
1088	T	24.1	Very low	34.9	Very low	30 Å²	30	86.7 Å²	86.7	18%	0.184	54%	0.537	C	S	.	.			trans	-58.8	131.1	175.6	49.2	0	0	0	0	113.6	R1720 D1724	T1088-R1720 HydrophobicContact CG2-CB 3.74Å; T1088-R1720 HydrophobicContact CG2-CG 4.38Å; T1088-R1720 VanDerWaalsContact OG1-CB 3.24Å; T1088-R1720 WeakPolarHBondContact OG1-CB 3.32Å; T1088-R1720 WeakPolarHBondContact OG1-CD 3.49Å; T1088-R1720 VanDerWaalsContact OG1-CG 3.24Å; T1088-R1720 WeakPolarHBondContact OG1-CG 3.5Å; T1088-D1724 WeakPolarHBondContact CB-OD2 3.41Å; T1088-D1724 WeakPolarHBondContact CG2-OD2 3.38Å
1089	C	24.2	Very low	32	Very low	99 Å²	99	90.3 Å²	90.3	67%	0.669	56%	0.56	S	S	*	*				-138.1	123.4	120.9	-98.6	0	0	0	0	107	A1087	A1087-C1089 PolarHBondContact O-N 2.66Å
1090	N	23.9	Very low	29.4	Very low	93 Å²	93	97.4 Å²	97.4	50%	0.497	60%	0.597	S	S	.	*			trans	-81.5	158.6	169.3	-81.6	-73.4	0	0	0	111.9	D1724	N1090-D1724 HydrophobicContact CB-CB 4.36Å; N1090-D1724 PolarHBondContact N-OD1 3.46Å; N1090-D1724 PolarHBondContact ND2-OD2 3.01Å
1091	D	25.8	Very low	26.9	Very low	90 Å²	90	101.8 Å²	101.8	48%	0.481	63%	0.626	S	S	.	*			trans	74	91.2	159.4	-57.7	-14.4	0	0	0	120.1	N1728 K1731	D1091-N1728 PolarHBondContact OD2-ND2 3.19Å; D1091-N1728 PolarHBondContact OD2-OD1 3.13Å; D1091-K1731 PolarHBondContact O-NZ 3.21Å
1092	D	23.5	Very low	25.4	Very low	157 Å²	157	104.5 Å²	104.5	84%	0.84	65%	0.65	S	S	*	*			trans	-31.3	136.6	130.1	-75.8	-56	0	0	0	112.4
1093	T	26.3	Very low	25	Very low	109 Å²	109	106.7 Å²	106.7	67%	0.669	67%	0.667	S	S	*	*				-176.1	118.2	123.2	18.9	0	0	0	0	112.5
1094	L	22.7	Very low	25.2	Very low	151 Å²	151	108.3 Å²	108.3	79%	0.791	67%	0.667	S	S	*	*				42.8	139.1	127.1	-73.7	171.8	0	0	0	123.2
1095	L	22.8	Very low	25.1	Very low	145 Å²	145	108.4 Å²	108.4	76%	0.759	67%	0.67	S	S	*	*			trans	86.3	107	142.2	-71.9	162.3	0	0	0	121.4
1096	S	21.5	Very low	25.1	Very low	105 Å²	105	108.7 Å²	108.7	73%	0.734	68%	0.677	S	S	*	*				32.2	122.8	126.3	62	0	0	0	0	121
1097	G	24.4	Very low	25.2	Very low	84 Å²	84	109.8 Å²	109.8	87%	0.866	68%	0.68	S	S	*	*			trans	-158.7	95.6	163.2	0	0	0	0	0	111.7
1098	T	22.9	Very low	25.4	Very low	132 Å²	132	112.4 Å²	112.4	81%	0.81	70%	0.696	S	S	*	*			trans	-89	161.6	-169.5	-7	0	0	0	0	114.3
1099	V	22.7	Very low	25.6	Very low	101 Å²	101	116.8 Å²	116.8	61%	0.612	72%	0.723	S	S	*	*			trans	74.3	114.8	151.6	168.8	0	0	0	0	119.5	T1101	V1099-T1101 HydrophobicContact CG1-CG2 4.06Å
1100	N	28	Very low	25.8	Very low	149 Å²	149	118.8 Å²	118.8	80%	0.797	73%	0.725	S	S	*	*				-176.4	92.4	118.2	-90.3	-46.5	0	0	0	107.8
1101	T	24	Very low	25.9	Very low	108 Å²	108	119.6 Å²	119.6	66%	0.663	73%	0.734	S	S	*	*				65.7	132.1	72	66.4	0	0	0	0	116.6	V1099	V1099-T1101 HydrophobicContact CG1-CG2 4.06Å
1102	A	25	Very low	25.9	Very low	99 Å²	99	123.3 Å²	123.3	82%	0.818	75%	0.753	S	S	*	*			trans	75.4	138.4	170.1	0	0	0	0	0	115.9
1103	T	28.9	Very low	26	Very low	118 Å²	118	122 Å²	122	72%	0.724	75%	0.752	S	S	*	*			cis	-138.8	151.4	10.3	49.3	0	0	0	0	114.5
1104	N	30	Very low	25.9	Very low	138 Å²	138	122.9 Å²	122.9	74%	0.738	76%	0.756	S	S	*	*			trans	68.1	102.1	146.5	-60.9	-5.7	0	0	0	121.9
1105	S	26	Very low	25.9	Very low	112 Å²	112	123.9 Å²	123.9	78%	0.783	76%	0.762	S	S	*	*				71.5	139	126	74.4	0	0	0	0	119.9
1106	T	28.8	Very low	26.2	Very low	116 Å²	116	126.1 Å²	126.1	71%	0.712	77%	0.766	S	S	*	*			cis	-138.3	150.9	14	48	0	0	0	0	114.7
1107	T	29.6	Very low	26.4	Very low	124 Å²	124	130.2 Å²	130.2	76%	0.761	77%	0.773	S	S	*	*			trans	65.7	119.7	148.7	48.6	0	0	0	0	122.7
1108	S	28.7	Very low	26.6	Very low	100 Å²	100	132.8 Å²	132.8	70%	0.699	77%	0.767	S	S	*	*			trans	66.7	106.5	151.3	49.8	0	0	0	0	120
1109	T	27.2	Very low	26.9	Very low	123 Å²	123	132 Å²	132	76%	0.755	76%	0.758	S	S	*	*				79.5	140.2	51.2	67.5	0	0	0	0	114.3
1110	I	29.3	Very low	27.2	Very low	141 Å²	141	133.4 Å²	133.4	72%	0.723	76%	0.762	S	S	*	*			cis	-153.4	129.4	4.1	-110.7	150.4	0	0	0	104.5
1111	T	26.2	Very low	27.2	Very low	110 Å²	110	134.3 Å²	134.3	68%	0.675	77%	0.767	S	S	*	*			cis	90.2	120.4	47.4	60.9	0	0	0	0	116
1112	N	25.1	Very low	27.2	Very low	167 Å²	167	136.4 Å²	136.4	89%	0.893	77%	0.773	S	S	*	*			trans	-99	127.6	158.4	-81.8	-18	0	0	0	108.9
1113	T	25.5	Very low	27.3	Very low	131 Å²	131	139.6 Å²	139.6	80%	0.804	77%	0.773	S	S	*	*			trans	-166.4	138	166.1	37.7	0	0	0	0	111.7
1114	V	24.2	Very low	27	Very low	127 Å²	127	139.4 Å²	139.4	77%	0.77	77%	0.772	S	S	*	*			trans	-144.1	130.2	147.7	-178	0	0	0	0	108.5	F1116	V1114-F1116 HydrophobicContact CG1-CD2 4.25Å; V1114-F1116 HydrophobicContact CG1-CE2 4.47Å
1115	L	24.2	Very low	26.8	Very low	172 Å²	172	139.2 Å²	139.2	90%	0.901	78%	0.775	S	S	*	*			trans	-144.2	160.6	161.2	-82.6	176.7	0	0	0	107.4
1116	F	27.9	Very low	26.7	Very low	192 Å²	192	141 Å²	141	84%	0.842	78%	0.776	S	S	*	*			trans	-140.2	141.7	177.7	-99.2	-84.3	0	0	0	110.9	V1114	V1114-F1116 HydrophobicContact CG1-CD2 4.25Å; V1114-F1116 HydrophobicContact CG1-CE2 4.47Å
1117	E	25.1	Very low	26.8	Very low	190 Å²	190	140.4 Å²	140.4	89%	0.888	77%	0.774	S	S	*	*			trans	-123	171.4	164.3	-71.2	-172.4	135.3	0	0	108.9
1118	N	28.3	Very low	26.7	Very low	139 Å²	139	140.1 Å²	140.1	74%	0.743	77%	0.773	S	S	*	*			trans	-150.4	155.4	-161.7	-149.5	14.1	0	0	0	114.7
1119	N	29.4	Very low	26.5	Very low	116 Å²	116	140.4 Å²	140.4	62%	0.62	77%	0.773	S	S	*	*			trans	70.7	146.7	162.2	-61.3	-16.1	0	0	0	118.2
1120	N	29	Very low	26.4	Very low	130 Å²	130	140.7 Å²	140.7	70%	0.695	77%	0.77	S	S	*	*			cis	-162	153.4	-7.1	-113.4	-15.7	0	0	0	112.2
1121	N	29.5	Very low	26.4	Very low	168 Å²	168	140.4 Å²	140.4	90%	0.898	78%	0.775	S	S	*	*			trans	-167.4	153	137.5	-106.5	-27.8	0	0	0	111.8
1122	L	23.6	Very low	26.4	Very low	151 Å²	151	139.1 Å²	139.1	79%	0.791	76%	0.764	S	S	*	*			trans	-150.4	143.2	-157.7	-173.5	87.4	0	0	0	113.5
1123	M	26.1	Very low	26.5	Very low	167 Å²	167	135.6 Å²	135.6	82%	0.823	75%	0.745	S	S	*	*			trans	-161.3	151.1	153	-78	-55.3	169.5	0	0	107.1
1124	T	24	Very low	26.6	Very low	114 Å²	114	136.3 Å²	136.3	70%	0.699	74%	0.743	S	S	*	*			cis	-164	179.4	-27.5	20.7	0	0	0	0	105.1
1125	V	26	Very low	26.5	Very low	133 Å²	133	131.6 Å²	131.6	81%	0.806	72%	0.716	S	S	*	*			cis	-141.9	155.7	22.4	167.7	0	0	0	0	108.2
1126	N	23.7	Very low	26.5	Very low	150 Å²	150	127.8 Å²	127.8	80%	0.802	70%	0.696	S	S	*	*			trans	-99.1	169.9	-179.7	-113.2	-6.5	0	0	0	111.8
1127	P	31.1	Very low	26.2	Very low	103 Å²	103	123.1 Å²	123.1	67%	0.669	69%	0.687	S	S	*	*			cis	-154.8	179.6	46.3	42.3	-20	0	0	0	119.7
1128	T	27.4	Very low	26.1	Very low	119 Å²	119	119.9 Å²	119.9	73%	0.73	68%	0.681	S	S	*	*			trans	57.5	115.1	154.7	45.3	0	0	0	0	119.8
1129	C	24.9	Very low	25.8	Very low	106 Å²	106	118.2 Å²	118.2	72%	0.716	68%	0.676	S	S	*	*				72.3	126	79.9	-71.8	0	0	0	0	114.5
1130	D	23.6	Very low	25.5	Very low	129 Å²	129	120.6 Å²	120.6	69%	0.69	69%	0.685	S	S	*	*			cis	-153.9	140.8	-0.3	-76.2	-46.4	0	0	0	112.1
1131	T	29.3	Very low	25.4	Very low	135 Å²	135	122.7 Å²	122.7	83%	0.828	70%	0.695	S	S	*	*			trans	-156	73.1	157.2	40.1	0	0	0	0	115.2
1132	N	27.7	Very low	24.9	Very low	82 Å²	82	125.1 Å²	125.1	44%	0.439	69%	0.692	S	S	.	*				49.2	93.3	113.8	-74.8	6.2	0	0	0	122.3	N1209 S1210	N1132-N1209 HydrophobicContact CB-CB 4.23Å; N1132-N1209 WeakPolarHBondContact O-CB 3.35Å; N1132-N1209 PolarHBondContact O-ND2 2.73Å; N1132-S1210 WeakPolarHBondContact CB-OG 3.32Å; N1132-S1210 PolarHBondContact ND2-OG 3.24Å; N1132-S1210 WeakPolarHBondContact O-CB 3.04Å; N1132-S1210 PolarHBondContact OD1-OG 2.88Å
1133	L	27.2	Very low	24.9	Very low	93 Å²	93	126.2 Å²	126.2	49%	0.487	69%	0.69	S	S	.	*			trans	-159.7	136.7	140.7	-127.2	178.4	0	0	0	116.7	N1209 N1211	L1133-N1209 WeakPolarHBondContact CD1-OD1 3.31Å; L1133-N1209 HydrophobicContact CG-CB 4.39Å; L1133-N1209 WeakPolarHBondContact CG-OD1 3.33Å; L1133-N1211 VanDerWaalsContact C-OD1 3.27Å; L1133-N1211 PolarHBondContact N-ND2 3.28Å; L1133-N1211 PolarHBondContact O-ND2 3.21Å; L1133-N1211 PolarHBondContact O-OD1 3.35Å
1134	L	25.6	Very low	24.9	Very low	147 Å²	147	124.4 Å²	124.4	77%	0.77	69%	0.694	S	S	*	*			trans	83.8	73	158.8	-112.6	155.9	0	0	0	121.6	N1211	L1134-N1211 PolarHBondContact N-OD1 3.36Å; L1134-N1211 PolarHBondContact O-OD1 3.18Å
1135	S	23.4	Very low	24.8	Very low	28 Å²	28	123.5 Å²	123.5	20%	0.196	69%	0.693	C	S	.	*			trans	-114.3	152.8	163.1	55.5	0	0	0	0	114.9	S1210 N1211 N1212	S1135-S1210 PolarHBondContact OG-O 3.45Å; S1135-N1211 PolarHBondContact N-OD1 3.17Å; S1135-N1211 VanDerWaalsContact OG-C 3.29Å; S1135-N1211 WeakPolarHBondContact OG-CA 3.29Å; S1135-N1212 VanDerWaalsContact CB-CA 3.48Å; S1135-N1212 PolarHBondContact OG-N 2.89Å; S1135-N1212 PolarHBondContact OG-O 2.7Å
1136	N	24.1	Very low	24.8	Very low	91 Å²	91	122.4 Å²	122.4	49%	0.487	69%	0.686	S	S	.	*			trans	66	135.8	164	-49	-44.1	0	0	0	113.4	N1212	N1136-N1212 PolarHBondContact ND2-O 3.47Å
1137	S	20.6	Very low	24.9	Very low	94 Å²	94	120 Å²	120	66%	0.657	69%	0.688	S	S	*	*			cis	-139.5	-170.9	9.4	-54.7	0	0	0	0	108.5
1138	T	24.5	Very low	24.9	Very low	122 Å²	122	122.3 Å²	122.3	75%	0.748	68%	0.684	S	S	*	*			cis	-172	152.7	40.7	-13.2	0	0	0	0	111.5
1139	T	22.2	Very low	25	Very low	104 Å²	104	124.8 Å²	124.8	64%	0.638	69%	0.692	S	S	*	*			trans	3.2	157	148.8	61	0	0	0	0	122.6
1140	M	22.5	Very low	26.2	Very low	167 Å²	167	123 Å²	123	82%	0.823	67%	0.672	S	S	*	*			trans	97.2	101.1	159.6	-62.2	-71.7	-171.1	0	0	117.1
1141	L	25.6	Very low	27.5	Very low	173 Å²	173	122.3 Å²	122.3	91%	0.906	67%	0.672	S	S	*	*				-150.3	93.5	129.4	-115.7	171.1	0	0	0	111.1
1142	R	20.9	Very low	29	Very low	219 Å²	219	119.6 Å²	119.6	83%	0.826	65%	0.652	S	S	*	*			trans	-75.4	152.6	159.4	-88.7	176.6	163	167.4	-5.5	108.8
1143	K	23.5	Very low	31.3	Very low	175 Å²	175	118 Å²	118	76%	0.761	64%	0.644	S	S	*	*			trans	73	86.3	173	-52.7	179.7	179.2	-178.3	0	115.9	S1145	K1143-S1145 PolarHBondContact O-N 3.37Å
1144	S	24.3	Very low	33.2	Very low	129 Å²	129	117.6 Å²	117.6	90%	0.902	65%	0.649	S	S	*	*			trans	-80.7	68.5	150.2	42.9	0	0	0	0	110.3
1145	S	23.2	Very low	35.4	Very low	95 Å²	95	116.9 Å²	116.9	66%	0.664	65%	0.646	S	S	*	*			trans	-115.1	38.5	171.7	67.9	0	0	0	0	111.3	K1143	K1143-S1145 PolarHBondContact O-N 3.37Å
1146	T	25.4	Very low	37.9	Very low	109 Å²	109	116.1 Å²	116.1	67%	0.669	64%	0.64	S	S	*	*			trans	-150.2	80.3	-178	48.4	0	0	0	0	108.7
1147	A	25.1	Very low	40.3	Very low	101 Å²	101	114.9 Å²	114.9	84%	0.835	63%	0.632	S	S	*	*			trans	-128.7	56.5	177.6	0	0	0	0	0	110.2
1148	Y	31.4	Very low	42.8	Very low	151 Å²	151	114.9 Å²	114.9	59%	0.592	64%	0.638	S	S	*	*			trans	-106.5	68	174	-101.1	-51.1	0	0	0	111.2	D1082 K1150	D1082-Y1148 VanDerWaalsContact OD1-CE1 3.26Å; D1082-Y1148 WeakPolarHBondContact OD1-CE1 3.28Å; Y1148-K1150 HydrophobicContact CD1-CD 4.25Å; Y1148-K1150 HydrophobicContact CD1-CG 3.83Å; Y1148-K1150 HydrophobicContact CE1-CG 4.2Å; Y1148-K1150 PolarHBondContact O-N 3.35Å
1149	L	30.2	Very low	45.4	Very low	171 Å²	171	111.4 Å²	111.4	90%	0.895	62%	0.618	S	S	*	*			trans	-80.9	74.6	152.4	-70.8	178.7	0	0	0	107.7	T1151	L1149-T1151 PolarHBondContact O-N 3.01Å
1150	K	50	Low	48.3	Very low	69 Å²	69	107.2 Å²	107.2	30%	0.3	59%	0.592	S	S	.	*			trans	-55.9	105.9	170.8	-103.7	164	179.1	-61.2	0	108.4	F1080 D1082 Y1148 L1152	F1080-K1150 HydrophobicContact CB-CB 4Å; F1080-K1150 HydrophobicContact CB-CD 3.81Å; F1080-K1150 HydrophobicContact CB-CG 4.03Å; F1080-K1150 HydrophobicContact CD1-CB 4.11Å; F1080-K1150 HydrophobicContact CG-CB 4.41Å; F1080-K1150 PolarHBondContact O-NZ 3.01Å; D1082-K1150 WeakPolarHBondContact OD1-CE 3Å; D1082-K1150 IonicContact OD1-NZ 3.38Å; D1082-K1150 PolarHBondContact OD1-NZ 2.9Å; D1082-K1150 WeakPolarHBondContact OD2-CE 3.45Å; D1082-K1150 IonicContact OD2-NZ 3.94Å; D1082-K1150 PolarHBondContact OD2-NZ 3.42Å; Y1148-K1150 HydrophobicContact CD1-CD 4.25Å; Y1148-K1150 HydrophobicContact CD1-CG 3.83Å; Y1148-K1150 HydrophobicContact CE1-CG 4.2Å; Y1148-K1150 PolarHBondContact O-N 3.35Å; K1150-L1152 PolarHBondContact O-N 3.39Å
1151	T	50.7	Low	51.4	Low	114 Å²	114	100.5 Å²	100.5	70%	0.699	56%	0.561	S	S	*	*			trans	-64.7	126.3	176.6	40.3	0	0	0	0	109.7	L1149 N1153	L1149-T1151 PolarHBondContact O-N 3.01Å; T1151-N1153 PolarHBondContact O-N 3.15Å
1152	L	60.5	Low	54.2	Low	77 Å²	77	98.8 Å²	98.8	40%	0.403	55%	0.553	S	S	.	*			trans	-57.2	131.2	172.6	-81.7	165.5	0	0	0	109.8	M1079 F1080 K1150 S1154 M1157 P1168	M1079-L1152 HydrophobicContact CE-CD2 4.13Å; F1080-L1152 HydrophobicContact CD1-CD2 3.82Å; F1080-L1152 HydrophobicContact CD1-CG 4.26Å; F1080-L1152 HydrophobicContact CE1-CD2 3.28Å; F1080-L1152 HydrophobicContact CE1-CG 3.8Å; F1080-L1152 HydrophobicContact CZ-CD2 3.77Å; K1150-L1152 PolarHBondContact O-N 3.39Å; L1152-S1154 PolarHBondContact O-N 2.73Å; L1152-M1157 HydrophobicContact CB-CG 4.03Å; L1152-M1157 HydrophobicContact CD1-CG 4.38Å; L1152-M1157 HydrophobicContact CD1-SD 4.25Å; L1152-M1157 HydrophobicContact CD2-CG 4.24Å; L1152-M1157 HydrophobicContact CD2-SD 4.05Å; L1152-M1157 HydrophobicContact CG-CG 4.47Å; L1152-P1168 HydrophobicContact CD2-CB 3.79Å
1153	N	76.9	Confident	57.3	Low	48 Å²	48	93.7 Å²	93.7	26%	0.257	54%	0.538	S	S	.	.			trans	-65.2	111.1	174.9	-177.7	-36.3	0	0	0	109.2	M1079 T1151 N1155 V1156 M1157	M1079-N1153 PolarHBondContact O-N 3.12Å; M1079-N1153 VanDerWaalsContact O-N 3.14Å; T1151-N1153 PolarHBondContact O-N 3.15Å; N1153-N1155 PolarHBondContact O-N 2.96Å; N1153-N1155 PolarHBondContact OD1-N 3.03Å; N1153-V1156 HydrophobicContact CB-CB 3.94Å; N1153-V1156 HydrophobicContact CB-CG2 3.92Å; N1153-V1156 VanDerWaalsContact CG-CG2 3.43Å; N1153-V1156 PolarHBondContact O-N 3.08Å; N1153-V1156 PolarHBondContact OD1-N 3.07Å; N1153-M1157 PolarHBondContact O-N 3.48Å
1154	S	67.3	Low	60.4	Low	86 Å²	86	85.4 Å²	85.4	60%	0.601	50%	0.502	S	S	*	.	H	α-helix	trans	-64.2	-38	-171.8	51.4	0	0	0	0	113	L1152 M1157 A1158	L1152-S1154 PolarHBondContact O-N 2.73Å; S1154-M1157 PolarHBondContact O-N 3.28Å; S1154-A1158 WeakPolarHBondContact O-CB 3.47Å; S1154-A1158 PolarHBondContact O-N 2.87Å
1155	N	70.3	Confident	63.4	Low	131 Å²	131	82.3 Å²	82.3	70%	0.701	48%	0.48	S	S	*	.	H	α-helix	trans	-65.7	-41.1	176.4	-63.8	-23.8	0	0	0	111	N1153 A1158 S1159	N1153-N1155 PolarHBondContact O-N 2.96Å; N1153-N1155 PolarHBondContact OD1-N 3.03Å; N1155-A1158 PolarHBondContact O-N 3.01Å; N1155-S1159 PolarHBondContact O-N 3.13Å
1156	V	76.2	Confident	66.5	Low	13 Å²	13	81.7 Å²	81.7	8%	0.079	47%	0.472	C	S	.	.	H	α-helix	trans	-66.7	-44	176.3	173.7	0	0	0	0	110.6	W741 L745 V1078 M1079 N1153 A1158 S1159 L1160	W741-V1156 HydrophobicContact CH2-CG1 4.27Å; W741-V1156 HydrophobicContact CZ2-CG1 3.61Å; L745-V1156 HydrophobicContact CD1-CG1 4.16Å; L745-V1156 HydrophobicContact CD2-CG2 4.2Å; V1078-V1156 HydrophobicContact CG1-CG1 4.4Å; M1079-V1156 HydrophobicContact SD-CG1 3.61Å; N1153-V1156 HydrophobicContact CB-CB 3.94Å; N1153-V1156 HydrophobicContact CB-CG2 3.92Å; N1153-V1156 VanDerWaalsContact CG-CG2 3.43Å; N1153-V1156 PolarHBondContact O-N 3.08Å; N1153-V1156 PolarHBondContact OD1-N 3.07Å; V1156-A1158 PolarHBondContact O-N 2.99Å; V1156-S1159 PolarHBondContact O-N 3.47Å; V1156-S1159 PolarHBondContact O-OG 3.48Å; V1156-L1160 PolarHBondContact O-N 2.86Å
1157	M	75.4	Confident	69.6	Low	65 Å²	65	76.5 Å²	76.5	32%	0.32	44%	0.44	S	S	.	.	H	α-helix	trans	-62	-39.2	174	-78.2	-64.3	-60.5	0	0	113.2	M1079 L1152 N1153 S1154 S1159 L1160 P1168	M1079-M1157 HydrophobicContact CE-SD 3.61Å; L1152-M1157 HydrophobicContact CB-CG 4.03Å; L1152-M1157 HydrophobicContact CD1-CG 4.38Å; L1152-M1157 HydrophobicContact CD1-SD 4.25Å; L1152-M1157 HydrophobicContact CD2-CG 4.24Å; L1152-M1157 HydrophobicContact CD2-SD 4.05Å; L1152-M1157 HydrophobicContact CG-CG 4.47Å; N1153-M1157 PolarHBondContact O-N 3.48Å; S1154-M1157 PolarHBondContact O-N 3.28Å; M1157-S1159 PolarHBondContact O-N 2.81Å; M1157-L1160 HydrophobicContact CE-CD2 4.3Å; M1157-L1160 WeakPolarHBondContact O-CB 3.26Å; M1157-L1160 PolarHBondContact O-N 2.88Å; M1157-L1160 HydrophobicContact SD-CD2 3.96Å; M1157-P1168 HydrophobicContact CE-CG 4.31Å; M1157-P1168 HydrophobicContact SD-CB 4.35Å; M1157-P1168 HydrophobicContact SD-CG 3.98Å
1158	A	72.3	Confident	72.6	Confident	93 Å²	93	72.3 Å²	72.3	77%	0.769	40%	0.404	S	S	*	.	H	α-helix	trans	-65.5	-25.1	177.1	0	0	0	0	0	113	S1154 N1155 V1156	S1154-A1158 WeakPolarHBondContact O-CB 3.47Å; S1154-A1158 PolarHBondContact O-N 2.87Å; N1155-A1158 PolarHBondContact O-N 3.01Å; V1156-A1158 PolarHBondContact O-N 2.99Å
1159	S	79.3	Confident	75.3	Confident	49 Å²	49	71.7 Å²	71.7	34%	0.343	41%	0.405	S	S	.	.	H	α-helix	trans	-87.5	-10.9	175.8	75.6	0	0	0	0	114.7	W741 N1155 V1156 M1157 P1161	W741-S1159 PolarHBondContact NE1-O 2.88Å; W741-S1159 PolarHBondContact NE1-OG 2.85Å; N1155-S1159 PolarHBondContact O-N 3.13Å; V1156-S1159 PolarHBondContact O-N 3.47Å; V1156-S1159 PolarHBondContact O-OG 3.48Å; M1157-S1159 PolarHBondContact O-N 2.81Å; S1159-P1161 WeakPolarHBondContact O-CD 3.4Å
1160	L	84.1	Confident	78.2	Confident	17 Å²	17	64.7 Å²	64.7	9%	0.089	37%	0.368	C	S	.	.			trans	-73.5	123.6	-167.9	-172.7	70.3	0	0	0	111.8	W741 M1079 V1156 M1157 L1164 P1168	W741-L1160 HydrophobicContact CD2-CD1 4.16Å; W741-L1160 HydrophobicContact CE3-CD1 4.42Å; W741-L1160 HydrophobicContact CH2-CD1 3.86Å; W741-L1160 HydrophobicContact CZ2-CD1 3.49Å; W741-L1160 VanDerWaalsContact CZ2-CD1 3.49Å; W741-L1160 HydrophobicContact CZ3-CD1 4.3Å; M1079-L1160 HydrophobicContact CE-CD2 4.24Å; V1156-L1160 PolarHBondContact O-N 2.86Å; M1157-L1160 HydrophobicContact CE-CD2 4.3Å; M1157-L1160 WeakPolarHBondContact O-CB 3.26Å; M1157-L1160 PolarHBondContact O-N 2.88Å; M1157-L1160 HydrophobicContact SD-CD2 3.96Å; L1160-L1164 HydrophobicContact CD1-CB 3.79Å; L1160-L1164 HydrophobicContact CG-CB 4.17Å; L1160-P1168 HydrophobicContact CD2-CG 4.29Å
1161	P	85.8	Confident	80.2	Confident	25 Å²	25	61.4 Å²	61.4	16%	0.162	35%	0.354	C	S	.	.			trans	-58	145.3	173.9	-27	34.9	0	0	0	113.4	L737 W741 S1159 E1163 L1164 C1165	L737-P1161 HydrophobicContact CD1-CB 4Å; L737-P1161 HydrophobicContact CD1-CG 3.88Å; L737-P1161 HydrophobicContact CD2-CB 3.79Å; L737-P1161 HydrophobicContact CD2-CG 4.37Å; L737-P1161 HydrophobicContact CG-CB 4Å; L737-P1161 HydrophobicContact CG-CG 4.02Å; W741-P1161 HydrophobicContact CB-CG 4.06Å; W741-P1161 HydrophobicContact CG-CG 4.25Å; S1159-P1161 WeakPolarHBondContact O-CD 3.4Å; P1161-E1163 PolarHBondContact O-N 3.42Å; P1161-L1164 HydrophobicContact CB-CD1 4.35Å; P1161-L1164 HydrophobicContact CB-CG 4.38Å; P1161-L1164 HydrophobicContact CG-CD1 4.08Å; P1161-L1164 CarbonylContact O-C 3.1Å; P1161-L1164 WeakPolarHBondContact O-CA 3.44Å; P1161-L1164 WeakPolarHBondContact O-CB 3.29Å; P1161-L1164 PolarHBondContact O-N 3.08Å; P1161-C1165 PolarHBondContact O-N 3.46Å
1162	N	84.5	Confident	81.9	Confident	138 Å²	138	58.9 Å²	58.9	74%	0.738	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-57.8	-34.7	-177.2	-72.9	-61.6	0	0	0	113.1	L1164 C1165	N1162-L1164 PolarHBondContact O-N 3.18Å; N1162-C1165 WeakPolarHBondContact O-CB 3.38Å; N1162-C1165 PolarHBondContact O-N 3.01Å
1163	E	86.7	Confident	83.3	Confident	112 Å²	112	58.3 Å²	58.3	52%	0.523	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-68.8	-16.7	177.5	-59.3	71.8	-160.6	0	0	112.6	N734 L737 P1161	N734-E1163 PolarHBondContact ND2-O 2.9Å; N734-E1163 VanDerWaalsContact ND2-O 3.1Å; L737-E1163 HydrophobicContact CD2-CB 3.71Å; L737-E1163 HydrophobicContact CD2-CG 4.09Å; P1161-E1163 PolarHBondContact O-N 3.42Å
1164	L	88.5	Confident	83.9	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-105.8	-0	177.2	-60.4	178.2	0	0	0	112.9	L730 N734 L737 L738 W741 L1160 P1161 N1162 T1166 L1167	L730-L1164 HydrophobicContact CD2-CD2 3.65Å; L730-L1164 HydrophobicContact CG-CD2 4.26Å; N734-L1164 HydrophobicContact CB-CD2 3.78Å; L737-L1164 HydrophobicContact CD2-CG 4.4Å; L737-L1164 HydrophobicContact CG-CD1 4.39Å; L738-L1164 HydrophobicContact CB-CD1 4.42Å; L738-L1164 HydrophobicContact CD1-CD1 4.01Å; L738-L1164 HydrophobicContact CD1-CD2 4.47Å; W741-L1164 HydrophobicContact CE3-CD1 4.27Å; L1160-L1164 HydrophobicContact CD1-CB 3.79Å; L1160-L1164 HydrophobicContact CG-CB 4.17Å; P1161-L1164 HydrophobicContact CB-CD1 4.35Å; P1161-L1164 HydrophobicContact CB-CG 4.38Å; P1161-L1164 HydrophobicContact CG-CD1 4.08Å; P1161-L1164 CarbonylContact O-C 3.1Å; P1161-L1164 WeakPolarHBondContact O-CA 3.44Å; P1161-L1164 WeakPolarHBondContact O-CB 3.29Å; P1161-L1164 PolarHBondContact O-N 3.08Å; N1162-L1164 PolarHBondContact O-N 3.18Å; L1164-T1166 PolarHBondContact O-N 3.25Å; L1164-L1167 WeakPolarHBondContact O-CB 3.46Å; L1164-L1167 PolarHBondContact O-N 3.32Å
1165	C	86.6	Confident	84.9	Confident	64 Å²	64	53.7 Å²	53.7	43%	0.432	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-16	-178.8	-77.7	0	0	0	0	115.5	P1161 N1162	P1161-C1165 PolarHBondContact O-N 3.46Å; N1162-C1165 WeakPolarHBondContact O-CB 3.38Å; N1162-C1165 PolarHBondContact O-N 3.01Å
1166	T	88.6	Confident	85.6	Confident	83 Å²	83	52.6 Å²	52.6	51%	0.509	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-16.6	172	50.6	0	0	0	0	113.7	L730 L1164 K1169 I1170	L730-T1166 VanDerWaalsContact CD1-OG1 3.27Å; L730-T1166 WeakPolarHBondContact CD1-OG1 3.41Å; L1164-T1166 PolarHBondContact O-N 3.25Å; T1166-K1169 PolarHBondContact O-N 3.47Å; T1166-I1170 WeakPolarHBondContact O-CG1 3.22Å; T1166-I1170 PolarHBondContact O-N 3.21Å
1167	L	90.8	Very high	86.1	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-54.2	-52.7	179.7	179.9	62.5	0	0	0	113.7	L727 L730 L738 W741 L1075 L1164 K1169 I1170 L1171	L727-L1167 HydrophobicContact CD1-CD1 3.67Å; L730-L1167 HydrophobicContact CD1-CB 4.24Å; L730-L1167 HydrophobicContact CD2-CB 4.47Å; L730-L1167 HydrophobicContact CD2-CD1 4.14Å; L738-L1167 HydrophobicContact CD1-CD2 4.31Å; W741-L1167 HydrophobicContact CZ3-CD2 4.32Å; L1075-L1167 HydrophobicContact CD1-CD1 3.87Å; L1075-L1167 HydrophobicContact CD1-CD2 4.15Å; L1164-L1167 WeakPolarHBondContact O-CB 3.46Å; L1164-L1167 PolarHBondContact O-N 3.32Å; L1167-K1169 VanDerWaalsContact C-N 3.25Å; L1167-K1169 PolarHBondContact O-N 2.84Å; L1167-I1170 PolarHBondContact O-N 3.09Å; L1167-I1170 VanDerWaalsContact O-N 3.07Å; L1167-L1171 HydrophobicContact CD1-CD1 3.95Å; L1167-L1171 HydrophobicContact CD1-CD2 4.12Å; L1167-L1171 HydrophobicContact CD1-CG 3.83Å; L1167-L1171 HydrophobicContact CG-CD1 3.87Å; L1167-L1171 HydrophobicContact CG-CG 4.2Å; L1167-L1171 WeakPolarHBondContact O-CG 3.32Å; L1167-L1171 PolarHBondContact O-N 3.41Å
1168	P	88.6	Confident	86.5	Confident	12 Å²	12	51.5 Å²	51.5	8%	0.078	29%	0.288	C	S	.	.	H	α-helix	trans	-56	-40.1	179.5	17	-30	0	0	0	112.6	M1079 F1080 L1152 M1157 L1160 L1171 D1172	M1079-P1168 HydrophobicContact CE-CB 3.67Å; M1079-P1168 HydrophobicContact CE-CG 3.94Å; F1080-P1168 HydrophobicContact CZ-CB 4.32Å; L1152-P1168 HydrophobicContact CD2-CB 3.79Å; M1157-P1168 HydrophobicContact CE-CG 4.31Å; M1157-P1168 HydrophobicContact SD-CB 4.35Å; M1157-P1168 HydrophobicContact SD-CG 3.98Å; L1160-P1168 HydrophobicContact CD2-CG 4.29Å; P1168-L1171 PolarHBondContact O-N 2.91Å; P1168-D1172 WeakPolarHBondContact O-CB 3.37Å; P1168-D1172 PolarHBondContact O-N 2.98Å
1169	K	88.4	Confident	86.8	Confident	138 Å²	138	51.5 Å²	51.5	60%	0.6	27%	0.273	S	S	*	.	H	α-helix	trans	-65.8	-43.2	176.6	-175.5	177.9	176.4	-178.5	0	112	T1166 L1167 L1171 D1172 D1173	T1166-K1169 PolarHBondContact O-N 3.47Å; L1167-K1169 VanDerWaalsContact C-N 3.25Å; L1167-K1169 PolarHBondContact O-N 2.84Å; K1169-L1171 VanDerWaalsContact C-N 3.34Å; K1169-L1171 PolarHBondContact O-N 2.7Å; K1169-D1172 PolarHBondContact O-N 3.34Å; K1169-D1173 WeakPolarHBondContact O-CB 3.3Å; K1169-D1173 PolarHBondContact O-N 2.9Å
1170	I	91.6	Very high	86.4	Confident	24 Å²	24	52.8 Å²	52.8	12%	0.123	28%	0.281	C	S	.	.	H	α-helix	trans	-62.7	-42.1	178	-70	163.7	0	0	0	111	P726 L727 L730 T1166 L1167 D1173 I1174	P726-I1170 HydrophobicContact CB-CD1 4.08Å; P726-I1170 HydrophobicContact CB-CG1 4.09Å; P726-I1170 HydrophobicContact CB-CG2 4.13Å; L727-I1170 HydrophobicContact CB-CG2 3.77Å; L727-I1170 HydrophobicContact CD1-CG2 4.45Å; L730-I1170 HydrophobicContact CD1-CD1 3.9Å; T1166-I1170 WeakPolarHBondContact O-CG1 3.22Å; T1166-I1170 PolarHBondContact O-N 3.21Å; L1167-I1170 PolarHBondContact O-N 3.09Å; L1167-I1170 VanDerWaalsContact O-N 3.07Å; I1170-D1173 PolarHBondContact O-N 3.32Å; I1170-I1174 HydrophobicContact CG2-CD1 3.91Å; I1170-I1174 WeakPolarHBondContact O-CD1 3.01Å; I1170-I1174 VanDerWaalsContact O-CG1 3.26Å; I1170-I1174 WeakPolarHBondContact O-CG1 3.07Å; I1170-I1174 PolarHBondContact O-N 2.99Å
1171	L	90.4	Very high	85.5	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-66.2	-37.4	177.5	-64.5	174.2	0	0	0	112.2	L727 H1072 L1075 M1079 F1080 L1167 P1168 K1169 S1175	L727-L1171 HydrophobicContact CD1-CD2 4.14Å; L727-L1171 HydrophobicContact CD2-CD2 4.43Å; H1072-L1171 PolarHBondContact NE2-O 2.83Å; L1075-L1171 HydrophobicContact CB-CD1 3.8Å; L1075-L1171 HydrophobicContact CB-CD2 3.99Å; M1079-L1171 HydrophobicContact CB-CD1 4.28Å; M1079-L1171 HydrophobicContact CG-CD1 3.85Å; F1080-L1171 HydrophobicContact CE2-CB 3.78Å; F1080-L1171 HydrophobicContact CE2-CD1 4.15Å; F1080-L1171 HydrophobicContact CZ-CB 4.48Å; L1167-L1171 HydrophobicContact CD1-CD1 3.95Å; L1167-L1171 HydrophobicContact CD1-CD2 4.12Å; L1167-L1171 HydrophobicContact CD1-CG 3.83Å; L1167-L1171 HydrophobicContact CG-CD1 3.87Å; L1167-L1171 HydrophobicContact CG-CG 4.2Å; L1167-L1171 WeakPolarHBondContact O-CG 3.32Å; L1167-L1171 PolarHBondContact O-N 3.41Å; P1168-L1171 PolarHBondContact O-N 2.91Å; K1169-L1171 VanDerWaalsContact C-N 3.34Å; K1169-L1171 PolarHBondContact O-N 2.7Å; L1171-S1175 WeakPolarHBondContact O-CB 3.35Å; L1171-S1175 PolarHBondContact O-N 3.08Å; L1171-S1175 PolarHBondContact O-OG 2.72Å
1172	D	87.7	Confident	83.9	Confident	61 Å²	61	54.6 Å²	54.6	33%	0.326	30%	0.295	S	S	.	.	H	α-helix	trans	-69.9	-44	173.2	173.3	54.3	0	0	0	112.5	F1080 P1168 K1169 I1174 S1175 R1176	F1080-D1172 HydrophobicContact CZ-CB 4.47Å; P1168-D1172 WeakPolarHBondContact O-CB 3.37Å; P1168-D1172 PolarHBondContact O-N 2.98Å; K1169-D1172 PolarHBondContact O-N 3.34Å; D1172-I1174 VanDerWaalsContact C-N 3.28Å; D1172-I1174 PolarHBondContact O-N 3.04Å; D1172-S1175 PolarHBondContact O-N 2.84Å; D1172-S1175 VanDerWaalsContact O-N 3.07Å; D1172-R1176 WeakPolarHBondContact O-CB 3.32Å; D1172-R1176 PolarHBondContact O-N 3.38Å; D1172-R1176 IonicContact OD1-NE 3.04Å; D1172-R1176 PolarHBondContact OD1-NE 3.47Å; D1172-R1176 IonicContact OD2-CZ 3.28Å; D1172-R1176 IonicContact OD2-NE 3.81Å; D1172-R1176 PolarHBondContact OD2-NE 2.65Å; D1172-R1176 IonicContact OD2-NH2 2.77Å; D1172-R1176 PolarHBondContact OD2-NH2 3.31Å
1173	D	88.2	Confident	81.6	Confident	66 Å²	66	52.9 Å²	52.9	35%	0.353	29%	0.285	S	S	.	.	H	α-helix	trans	-56.7	-41.7	174.3	-78.1	-34.5	0	0	0	111.2	K1169 I1170 R1176 A1177	K1169-D1173 WeakPolarHBondContact O-CB 3.3Å; K1169-D1173 PolarHBondContact O-N 2.9Å; I1170-D1173 PolarHBondContact O-N 3.32Å; D1173-R1176 IonicContact OD1-CZ 2.94Å; D1173-R1176 IonicContact OD1-NH1 2.66Å; D1173-R1176 PolarHBondContact OD1-NH1 2.94Å; D1173-R1176 IonicContact OD1-NH2 2.67Å; D1173-R1176 PolarHBondContact OD1-NH2 3.12Å; D1173-A1177 WeakPolarHBondContact O-CB 3.45Å; D1173-A1177 PolarHBondContact O-N 3.44Å
1174	I	89.8	Confident	79.3	Confident	4 Å²	4	51.3 Å²	51.3	2%	0.021	28%	0.284	C	S	.	.	H	α-helix	trans	-66.8	-43.2	173.3	-67.9	163.7	0	0	0	111.4	L719 Y724 L727 H1072 I1170 D1172 R1176 A1177 L1178	L719-I1174 HydrophobicContact CD1-CG2 3.94Å; Y724-I1174 HydrophobicContact CD1-CD1 4.01Å; Y724-I1174 HydrophobicContact CD1-CG2 4.35Å; Y724-I1174 HydrophobicContact CE1-CD1 4.48Å; Y724-I1174 HydrophobicContact CE1-CG2 3.8Å; L727-I1174 HydrophobicContact CB-CD1 3.96Å; L727-I1174 HydrophobicContact CD2-CD1 3.99Å; H1072-I1174 HydrophobicContact CB-CG2 4.44Å; H1072-I1174 WeakPolarHBondContact CD2-CG2 3.33Å; H1072-I1174 WeakPolarHBondContact NE2-CG2 3.34Å; I1170-I1174 HydrophobicContact CG2-CD1 3.91Å; I1170-I1174 WeakPolarHBondContact O-CD1 3.01Å; I1170-I1174 VanDerWaalsContact O-CG1 3.26Å; I1170-I1174 WeakPolarHBondContact O-CG1 3.07Å; I1170-I1174 PolarHBondContact O-N 2.99Å; D1172-I1174 VanDerWaalsContact C-N 3.28Å; D1172-I1174 PolarHBondContact O-N 3.04Å; I1174-R1176 PolarHBondContact O-N 3.13Å; I1174-A1177 PolarHBondContact O-N 3.44Å; I1174-L1178 HydrophobicContact CG2-CD1 4.24Å; I1174-L1178 WeakPolarHBondContact O-CG 3.3Å; I1174-L1178 PolarHBondContact O-N 2.92Å
1175	S	89.5	Confident	76.7	Confident	32 Å²	32	58.2 Å²	58.2	22%	0.224	31%	0.31	C	S	.	.	H	α-helix	trans	-64.1	-41.4	-180	-59	0	0	0	0	112.2	H1072 L1171 D1172 L1178 Q1179	H1072-S1175 PolarHBondContact CE1-OG 3.33Å; H1072-S1175 PolarHBondContact NE2-OG 2.86Å; H1072-S1175 VanDerWaalsContact NE2-OG 3.14Å; L1171-S1175 WeakPolarHBondContact O-CB 3.35Å; L1171-S1175 PolarHBondContact O-N 3.08Å; L1171-S1175 PolarHBondContact O-OG 2.72Å; D1172-S1175 PolarHBondContact O-N 2.84Å; D1172-S1175 VanDerWaalsContact O-N 3.07Å; S1175-L1178 PolarHBondContact O-N 3.04Å; S1175-Q1179 WeakPolarHBondContact O-CG 3.41Å; S1175-Q1179 PolarHBondContact O-N 3.47Å; S1175-Q1179 VanDerWaalsContact O-N 3.09Å
1176	R	85.4	Confident	73.9	Confident	109 Å²	109	60 Å²	60	41%	0.411	32%	0.322	S	S	.	.	H	α-helix	trans	-66.5	-38	173.3	-73.1	-171.4	-83.7	105.2	-1.6	111.8	D1172 D1173 I1174 Q1179 C1180	D1172-R1176 WeakPolarHBondContact O-CB 3.32Å; D1172-R1176 PolarHBondContact O-N 3.38Å; D1172-R1176 IonicContact OD1-NE 3.04Å; D1172-R1176 PolarHBondContact OD1-NE 3.47Å; D1172-R1176 IonicContact OD2-CZ 3.28Å; D1172-R1176 IonicContact OD2-NE 3.81Å; D1172-R1176 PolarHBondContact OD2-NE 2.65Å; D1172-R1176 IonicContact OD2-NH2 2.77Å; D1172-R1176 PolarHBondContact OD2-NH2 3.31Å; D1173-R1176 IonicContact OD1-CZ 2.94Å; D1173-R1176 IonicContact OD1-NH1 2.66Å; D1173-R1176 PolarHBondContact OD1-NH1 2.94Å; D1173-R1176 IonicContact OD1-NH2 2.67Å; D1173-R1176 PolarHBondContact OD1-NH2 3.12Å; I1174-R1176 PolarHBondContact O-N 3.13Å; R1176-Q1179 PolarHBondContact O-N 3.45Å; R1176-C1180 PolarHBondContact O-N 3.34Å; R1176-C1180 PolarHBondContact O-SG 3.47Å; R1176-C1180 VanDerWaalsContact O-SG 3.36Å
1177	A	85.8	Confident	71.1	Confident	24 Å²	24	63 Å²	63	20%	0.198	33%	0.334	C	S	.	.	H	α-helix	trans	-63.1	-40.1	173.8	0	0	0	0	0	112.8	L719 D1173 I1174 C1180 S1181	L719-A1177 HydrophobicContact CD1-CB 3.66Å; L719-A1177 HydrophobicContact CD2-CB 4.3Å; D1173-A1177 WeakPolarHBondContact O-CB 3.45Å; D1173-A1177 PolarHBondContact O-N 3.44Å; I1174-A1177 PolarHBondContact O-N 3.44Å; A1177-C1180 PolarHBondContact O-N 3.29Å; A1177-S1181 PolarHBondContact O-N 3.11Å; A1177-S1181 PolarHBondContact O-OG 2.95Å
1178	L	83.5	Confident	68	Low	30 Å²	30	69.2 Å²	69.2	16%	0.157	37%	0.367	C	S	.	.	H	α-helix	trans	-63.1	-38.7	173.1	-74.5	167.4	0	0	0	112.8	Y523 G717 L719 I1174 S1175 S1181 S1182	Y523-L1178 HydrophobicContact CD2-CD2 4.27Å; Y523-L1178 HydrophobicContact CE2-CD2 3.82Å; G717-L1178 WeakPolarHBondContact O-CD2 3.29Å; L719-L1178 HydrophobicContact CD1-CD2 4.4Å; L719-L1178 HydrophobicContact CD1-CG 4.13Å; L719-L1178 HydrophobicContact CD2-CD2 3.87Å; L719-L1178 HydrophobicContact CD2-CG 4.22Å; L719-L1178 HydrophobicContact CG-CD2 3.71Å; L719-L1178 HydrophobicContact CG-CG 3.99Å; I1174-L1178 HydrophobicContact CG2-CD1 4.24Å; I1174-L1178 WeakPolarHBondContact O-CG 3.3Å; I1174-L1178 PolarHBondContact O-N 2.92Å; S1175-L1178 PolarHBondContact O-N 3.04Å; L1178-S1181 PolarHBondContact O-OG 3.24Å; L1178-S1181 VanDerWaalsContact O-OG 3.07Å; L1178-S1182 PolarHBondContact O-N 2.94Å
1179	Q	78.3	Confident	65	Low	94 Å²	94	78.2 Å²	78.2	44%	0.439	40%	0.401	S	S	.	.	H	α-helix	trans	-64.8	-47.5	173.9	-69.7	175.9	15.5	0	0	111.1	S1175 R1176 S1181 S1182 L1183	S1175-Q1179 WeakPolarHBondContact O-CG 3.41Å; S1175-Q1179 PolarHBondContact O-N 3.47Å; S1175-Q1179 VanDerWaalsContact O-N 3.09Å; R1176-Q1179 PolarHBondContact O-N 3.45Å; Q1179-S1181 PolarHBondContact O-N 3.32Å; Q1179-S1182 PolarHBondContact O-N 3.19Å; Q1179-S1182 PolarHBondContact O-OG 2.94Å; Q1179-L1183 PolarHBondContact O-N 3.39Å
1180	C	72.3	Confident	62	Low	76 Å²	76	78.5 Å²	78.5	51%	0.514	41%	0.409	S	S	.	.	H	α-helix	trans	-61.8	-40.4	178.9	-70.9	0	0	0	0	113.4	R1176 A1177 L1183 T1184	R1176-C1180 PolarHBondContact O-N 3.34Å; R1176-C1180 PolarHBondContact O-SG 3.47Å; R1176-C1180 VanDerWaalsContact O-SG 3.36Å; A1177-C1180 PolarHBondContact O-N 3.29Å; C1180-L1183 PolarHBondContact O-N 2.99Å; C1180-T1184 PolarHBondContact O-N 2.78Å; C1180-T1184 VanDerWaalsContact O-N 3.1Å; C1180-T1184 PolarHBondContact O-OG1 2.65Å
1181	S	64	Low	58.8	Low	24 Å²	24	85 Å²	85	17%	0.168	44%	0.436	C	S	.	.	H	α-helix	trans	-66.5	-38	176.7	67.9	0	0	0	0	111.9	Y523 A1177 L1178 Q1179 T1184	Y523-S1181 WeakPolarHBondContact CD1-OG 3.42Å; Y523-S1181 VanDerWaalsContact CD2-OG 3.23Å; Y523-S1181 WeakPolarHBondContact CD2-OG 3.11Å; Y523-S1181 VanDerWaalsContact CE2-OG 3.29Å; Y523-S1181 WeakPolarHBondContact CE2-OG 3.17Å; A1177-S1181 PolarHBondContact O-N 3.11Å; A1177-S1181 PolarHBondContact O-OG 2.95Å; L1178-S1181 PolarHBondContact O-OG 3.24Å; L1178-S1181 VanDerWaalsContact O-OG 3.07Å; Q1179-S1181 PolarHBondContact O-N 3.32Å; S1181-T1184 PolarHBondContact O-N 3.45Å
1182	S	53.6	Low	55.5	Low	55 Å²	55	89.4 Å²	89.4	39%	0.385	47%	0.467	S	S	.	.	H	α-helix	trans	-65.2	-42	175	78.9	0	0	0	0	112.7	L1178 Q1179 T1184 R1185	L1178-S1182 PolarHBondContact O-N 2.94Å; Q1179-S1182 PolarHBondContact O-N 3.19Å; Q1179-S1182 PolarHBondContact O-OG 2.94Å; S1182-T1184 PolarHBondContact O-N 2.75Å; S1182-R1185 VanDerWaalsContact O-CB 3.3Å; S1182-R1185 WeakPolarHBondContact O-CB 3.42Å; S1182-R1185 PolarHBondContact O-N 2.69Å
1183	L	36	Very low	52.6	Low	102 Å²	102	91.2 Å²	91.2	53%	0.534	48%	0.481	S	S	.	.	H	α-helix	trans	-63.4	-38.8	177.7	-87	158.8	0	0	0	112.5	Q1179 C1180 R1185 C1186	Q1179-L1183 PolarHBondContact O-N 3.39Å; C1180-L1183 PolarHBondContact O-N 2.99Å; L1183-R1185 PolarHBondContact O-N 3.35Å; L1183-C1186 WeakPolarHBondContact O-CB 3.46Å; L1183-C1186 PolarHBondContact O-N 2.59Å
1184	T	38.5	Very low	49.8	Very low	79 Å²	79	98 Å²	98	49%	0.485	50%	0.503	S	S	.	.	H	α-helix	trans	-60.1	-29.4	179	-54.5	0	0	0	0	111.9	C1180 S1181 S1182 C1186 L1187	C1180-T1184 PolarHBondContact O-N 2.78Å; C1180-T1184 VanDerWaalsContact O-N 3.1Å; C1180-T1184 PolarHBondContact O-OG1 2.65Å; S1181-T1184 PolarHBondContact O-N 3.45Å; S1182-T1184 PolarHBondContact O-N 2.75Å; T1184-C1186 PolarHBondContact O-N 3.16Å; T1184-L1187 PolarHBondContact O-N 3.39Å
1185	R	33.4	Very low	46.5	Very low	145 Å²	145	98.9 Å²	98.9	55%	0.547	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-21.9	176.3	-147.8	175	-163.9	161.2	4.2	113.4	S1182 L1183 L1187	S1182-R1185 VanDerWaalsContact O-CB 3.3Å; S1182-R1185 WeakPolarHBondContact O-CB 3.42Å; S1182-R1185 PolarHBondContact O-N 2.69Å; L1183-R1185 PolarHBondContact O-N 3.35Å; R1185-L1187 VanDerWaalsContact C-N 3.34Å
1186	C	27.9	Very low	43.7	Very low	102 Å²	102	104 Å²	104	69%	0.689	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-4.2	177	-62.6	0	0	0	0	114.1	L1183 T1184	L1183-C1186 WeakPolarHBondContact O-CB 3.46Å; L1183-C1186 PolarHBondContact O-N 2.59Å; T1184-C1186 PolarHBondContact O-N 3.16Å
1187	L	28.8	Very low	41	Very low	146 Å²	146	103.1 Å²	103.1	76%	0.764	54%	0.543	S	S	*	.	S	Bend	trans	-111.1	-5.3	-178.4	-68.6	174.4	0	0	0	114.3	T1184 R1185	T1184-L1187 PolarHBondContact O-N 3.39Å; R1185-L1187 VanDerWaalsContact C-N 3.34Å
1188	N	26.5	Very low	38.1	Very low	131 Å²	131	106.8 Å²	106.8	70%	0.701	57%	0.566	S	S	*	*	S	Bend	trans	-104.9	11.7	-178.6	-77.4	-26.5	0	0	0	114.2	D1190	N1188-D1190 PolarHBondContact O-N 3.03Å
1189	Y	25.8	Very low	35.3	Very low	200 Å²	200	112.3 Å²	112.3	78%	0.784	60%	0.596	S	S	*	*	S	Bend	trans	-97	51	171.7	-108.6	-77.2	0	0	0	111.8
1190	D	24.5	Very low	33	Very low	144 Å²	144	114.3 Å²	114.3	77%	0.77	61%	0.61	S	S	*	*			trans	-177.7	93.1	155.7	-109	-27.7	0	0	0	110.2	N1188	N1188-D1190 PolarHBondContact O-N 3.03Å
1191	K	24.8	Very low	31	Very low	160 Å²	160	116.1 Å²	116.1	70%	0.696	62%	0.615	S	S	*	*			trans	-162.8	63.9	165.1	-120.7	164.9	-169.3	176.1	0	114.9
1192	S	21.7	Very low	29.3	Very low	93 Å²	93	121 Å²	121	65%	0.65	64%	0.639	S	S	*	*			trans	-133.8	155.9	160.9	67.4	0	0	0	0	111.5	Y398	Y398-S1192 WeakPolarHBondContact OH-CA 3.38Å
1193	V	27.3	Very low	28.2	Very low	100 Å²	100	125.8 Å²	125.8	61%	0.606	66%	0.655	S	S	*	*	S	Bend	trans	80.9	128.3	171.1	-175.6	0	0	0	0	116.8
1194	Y	28.4	Very low	27.9	Very low	207 Å²	207	126.9 Å²	126.9	81%	0.812	66%	0.661	S	S	*	*			trans	58.5	103.9	176.7	-62.7	-55.8	0	0	0	121.5
1195	S	21.1	Very low	27.3	Very low	23 Å²	23	127.4 Å²	127.4	16%	0.161	67%	0.668	C	S	.	*			trans	-84	154.3	140.5	54.4	0	0	0	0	112.1	N399 P400	N399-S1195 WeakPolarHBondContact CA-OG 3.26Å; N399-S1195 WeakPolarHBondContact CB-OG 3.39Å; P400-S1195 WeakPolarHBondContact CD-OG 3.17Å
1196	V	30.9	Very low	27	Very low	140 Å²	140	127.1 Å²	127.1	85%	0.848	68%	0.678	S	S	*	*			trans	-135.1	151.1	146.9	178.3	0	0	0	0	108.1
1197	N	27.8	Very low	27	Very low	91 Å²	91	128 Å²	128	49%	0.487	68%	0.676	S	S	.	*			trans	-62.1	158.3	-164.9	-64.8	-13.6	0	0	0	117.2
1198	S	25.9	Very low	27	Very low	100 Å²	100	126.4 Å²	126.4	70%	0.699	67%	0.668	S	S	*	*			trans	59.7	118.1	137.3	60.2	0	0	0	0	121.2
1199	N	24.1	Very low	27.1	Very low	147 Å²	147	124.2 Å²	124.2	79%	0.786	66%	0.656	S	S	*	*				17	132.1	127.3	-54.5	4.3	0	0	0	118.2
1200	D	30.3	Very low	27.2	Very low	136 Å²	136	116.7 Å²	116.7	73%	0.727	63%	0.633	S	S	*	*				-159.3	141.8	99.9	-114.4	-1.6	0	0	0	115.6
1201	N	29.1	Very low	27.4	Very low	114 Å²	114	113.2 Å²	113.2	61%	0.61	61%	0.614	S	S	*	*			trans	56.7	122	141.8	-66	-38.1	0	0	0	124.1
1202	N	29.9	Very low	27.6	Very low	127 Å²	127	111.6 Å²	111.6	68%	0.679	61%	0.613	S	S	*	*				91.8	104.3	125.4	-68.8	-10.4	0	0	0	122.9
1203	H	29.6	Very low	27.8	Very low	154 Å²	154	111 Å²	111	71%	0.713	61%	0.605	S	S	*	*				82.3	133.4	119.4	-84.6	-65.6	0	0	0	122.9
1204	N	29.4	Very low	27.9	Very low	126 Å²	126	113.8 Å²	113.8	67%	0.674	62%	0.617	S	S	*	*			trans	77.3	84.3	136.6	-68.1	5	0	0	0	120.8
1205	S	26.7	Very low	27.9	Very low	90 Å²	90	109.5 Å²	109.5	63%	0.629	61%	0.608	S	S	*	*				66.1	133.5	101.3	71.9	0	0	0	0	121.2
1206	N	27.7	Very low	28.2	Very low	139 Å²	139	115.4 Å²	115.4	74%	0.743	63%	0.633	S	S	*	*			trans	86.2	107.4	147.8	-62.6	4.7	0	0	0	119.2
1207	N	27.5	Very low	27.9	Very low	121 Å²	121	116.4 Å²	116.4	65%	0.647	63%	0.632	S	S	*	*				101.7	127.5	119	-84	52.4	0	0	0	121.2
1208	D	28.7	Very low	27.7	Very low	112 Å²	112	119 Å²	119	60%	0.599	64%	0.644	S	S	*	*			trans	82.5	110.8	135.7	-56.5	-12.4	0	0	0	121.5
1209	N	27.6	Very low	27.7	Very low	85 Å²	85	125.3 Å²	125.3	46%	0.455	66%	0.655	S	S	.	*			trans	75.2	123.5	133	-53.2	8.1	0	0	0	117.7	N1132 L1133	N1132-N1209 HydrophobicContact CB-CB 4.23Å; N1132-N1209 WeakPolarHBondContact O-CB 3.35Å; N1132-N1209 PolarHBondContact O-ND2 2.73Å; L1133-N1209 WeakPolarHBondContact CD1-OD1 3.31Å; L1133-N1209 HydrophobicContact CG-CB 4.39Å; L1133-N1209 WeakPolarHBondContact CG-OD1 3.33Å
1210	S	28.8	Very low	27.6	Very low	42 Å²	42	123.8 Å²	123.8	29%	0.294	65%	0.651	S	S	.	*			cis	177.7	-170	18.1	58	0	0	0	0	118.8	N1132 S1135	N1132-S1210 WeakPolarHBondContact CB-OG 3.32Å; N1132-S1210 PolarHBondContact ND2-OG 3.24Å; N1132-S1210 WeakPolarHBondContact O-CB 3.04Å; N1132-S1210 PolarHBondContact OD1-OG 2.88Å; S1135-S1210 PolarHBondContact OG-O 3.45Å
1211	N	27.7	Very low	27.3	Very low	70 Å²	70	121.9 Å²	121.9	37%	0.374	65%	0.648	S	S	.	*			trans	-27.5	156	154.6	-70.1	-26.1	0	0	0	116.9	L1133 L1134 S1135	L1133-N1211 VanDerWaalsContact C-OD1 3.27Å; L1133-N1211 PolarHBondContact N-ND2 3.28Å; L1133-N1211 PolarHBondContact O-ND2 3.21Å; L1133-N1211 PolarHBondContact O-OD1 3.35Å; L1134-N1211 PolarHBondContact N-OD1 3.36Å; L1134-N1211 PolarHBondContact O-OD1 3.18Å; S1135-N1211 PolarHBondContact N-OD1 3.17Å; S1135-N1211 VanDerWaalsContact OG-C 3.29Å; S1135-N1211 WeakPolarHBondContact OG-CA 3.29Å
1212	N	28.9	Very low	27.2	Very low	126 Å²	126	123.4 Å²	123.4	67%	0.674	66%	0.662	S	S	*	*			cis	-136	178.6	11.7	-151.5	-7.9	0	0	0	114.6	S1135 N1136	S1135-N1212 VanDerWaalsContact CB-CA 3.48Å; S1135-N1212 PolarHBondContact OG-N 2.89Å; S1135-N1212 PolarHBondContact OG-O 2.7Å; N1136-N1212 PolarHBondContact ND2-O 3.47Å
1213	V	26.7	Very low	27.1	Very low	82 Å²	82	122.2 Å²	122.2	50%	0.497	66%	0.664	S	S	.	*			trans	-81.8	134.1	-178.9	175.8	0	0	0	0	112.9
1214	N	28.7	Very low	26.9	Very low	158 Å²	158	126.4 Å²	126.4	85%	0.845	67%	0.673	S	S	*	*			trans	-166.8	133.1	131.6	-101	-30.8	0	0	0	110.4
1215	N	28	Very low	26.7	Very low	116 Å²	116	126.1 Å²	126.1	62%	0.62	68%	0.68	S	S	*	*			trans	-156.4	166.5	-173.4	-156.4	-13.9	0	0	0	111
1216	H	27.3	Very low	26.7	Very low	148 Å²	148	129.6 Å²	129.6	69%	0.685	69%	0.686	S	S	*	*			trans	75.9	146.7	-179.8	-57.3	-50.6	0	0	0	115.5
1217	L	24.6	Very low	26.7	Very low	160 Å²	160	130.5 Å²	130.5	84%	0.838	69%	0.686	S	S	*	*			cis	-128.9	-177.9	21.1	-117.3	112.4	0	0	0	115.2
1218	I	24.5	Very low	26.6	Very low	145 Å²	145	130.3 Å²	130.3	74%	0.744	69%	0.694	S	S	*	*			trans	74.8	108.9	172.1	-43.6	179.7	0	0	0	115.9
1219	Y	25	Very low	26.5	Very low	234 Å²	234	131.4 Å²	131.4	92%	0.918	70%	0.7	S	S	*	*			trans	-153.3	145.6	142.9	-113.4	-72.9	0	0	0	111.5
1220	T	23	Very low	26.4	Very low	114 Å²	114	133.7 Å²	133.7	70%	0.699	72%	0.717	S	S	*	*			trans	-119.1	146.5	174	47.7	0	0	0	0	111.3
1221	S	23.6	Very low	26.2	Very low	96 Å²	96	139.2 Å²	139.2	67%	0.671	74%	0.742	S	S	*	*	S	Bend	trans	55.6	112.5	151.2	57.7	0	0	0	0	120.9
1222	T	27.9	Very low	26.2	Very low	146 Å²	146	143.5 Å²	143.5	90%	0.896	76%	0.763	S	S	*	*			trans	69.3	171.1	141.5	48	0	0	0	0	118.7
1223	S	28	Very low	26.1	Very low	103 Å²	103	142.4 Å²	142.4	72%	0.72	77%	0.766	S	S	*	*			trans	-143.8	146.6	-145.6	59.1	0	0	0	0	115.5
1224	R	24.9	Very low	26.2	Very low	242 Å²	242	143.7 Å²	143.7	91%	0.913	78%	0.778	S	S	*	*			trans	71.5	150.4	174.4	-59.9	-180	176.3	176.8	-2.5	113.4
1225	C	26	Very low	26.2	Very low	120 Å²	120	140.4 Å²	140.4	81%	0.811	77%	0.768	S	S	*	*			cis	-123.4	-163.4	18.7	-123.5	0	0	0	0	115
1226	Q	26.4	Very low	26.1	Very low	162 Å²	162	141.8 Å²	141.8	76%	0.757	78%	0.775	S	S	*	*			trans	-104	178.4	-160	-51.5	169.7	-86.7	0	0	115.7
1227	Q	27.6	Very low	26.2	Very low	159 Å²	159	140.9 Å²	140.9	74%	0.743	78%	0.775	S	S	*	*			trans	94.9	144.1	141.6	-83.7	167	-4	0	0	121.6
1228	S	23.8	Very low	26.3	Very low	117 Å²	117	139.7 Å²	139.7	82%	0.818	77%	0.77	S	S	*	*			trans	-151.9	137.3	172.2	54.4	0	0	0	0	108.1
1229	N	26.7	Very low	26.6	Very low	135 Å²	135	139.1 Å²	139.1	72%	0.722	77%	0.767	S	S	*	*			trans	-127.1	155.4	-160.5	-64.8	-29.5	0	0	0	114.8
1230	T	26.1	Very low	26.7	Very low	133 Å²	133	134.1 Å²	134.1	82%	0.816	76%	0.756	S	S	*	*			trans	-149.8	114.9	156.1	50.3	0	0	0	0	107.4
1231	L	25	Very low	26.8	Very low	158 Å²	158	135.2 Å²	135.2	83%	0.827	76%	0.758	S	S	*	*			cis	107	122.5	47.3	-96.8	174.3	0	0	0	111.1
1232	I	28.6	Very low	26.8	Very low	159 Å²	159	136.3 Å²	136.3	82%	0.815	76%	0.76	S	S	*	*			trans	178.8	138.3	148.9	-97.1	156.6	0	0	0	110
1233	S	25.5	Very low	26.7	Very low	104 Å²	104	136 Å²	136	73%	0.727	75%	0.753	S	S	*	*			trans	14.4	147.9	163.3	66.2	0	0	0	0	122.2
1234	S	28.3	Very low	26.5	Very low	108 Å²	108	137.3 Å²	137.3	76%	0.755	75%	0.75	S	S	*	*			cis	170.8	166.3	2.2	47.5	0	0	0	0	108.4
1235	S	29.4	Very low	26.5	Very low	90 Å²	90	131.2 Å²	131.2	63%	0.629	74%	0.74	S	S	*	*			cis	-179.6	157.2	-20.4	54.5	0	0	0	0	109.6
1236	N	25.8	Very low	26.5	Very low	144 Å²	144	132.3 Å²	132.3	77%	0.77	74%	0.738	S	S	*	*			trans	70.7	148	164.3	-60.1	6.2	0	0	0	117
1237	N	29.1	Very low	26.4	Very low	129 Å²	129	129.5 Å²	129.5	69%	0.69	73%	0.732	S	S	*	*			cis	-142.2	155.1	14.8	-85.4	-50.9	0	0	0	112.2
1238	N	28	Very low	26.4	Very low	136 Å²	136	131 Å²	131	73%	0.727	74%	0.738	S	S	*	*			trans	61.7	159.2	144.6	-63.7	3.2	0	0	0	120.3
1239	I	29.5	Very low	26.6	Very low	133 Å²	133	128.1 Å²	128.1	68%	0.682	73%	0.727	S	S	*	*			cis	-158.6	151.5	-20.9	-108.9	168	0	0	0	108.5
1240	D	27.7	Very low	26.6	Very low	128 Å²	128	127.3 Å²	127.3	68%	0.684	73%	0.732	S	S	*	*			trans	34.6	133.5	157.1	-57	-6.7	0	0	0	125.8
1241	N	25.8	Very low	26.5	Very low	137 Å²	137	128.6 Å²	128.6	73%	0.733	73%	0.729	S	S	*	*				40.2	126.9	128.2	-57	-34.6	0	0	0	124.5
1242	V	23.1	Very low	26.5	Very low	120 Å²	120	128.4 Å²	128.4	73%	0.727	72%	0.724	S	S	*	*				52.1	144.2	118.3	-174.8	0	0	0	0	121.2
1243	D	25.3	Very low	26.2	Very low	138 Å²	138	125.4 Å²	125.4	74%	0.738	72%	0.717	S	S	*	*			trans	69.4	153.1	172.4	-74.4	-7.6	0	0	0	116.1
1244	I	24	Very low	26.4	Very low	131 Å²	131	127.2 Å²	127.2	67%	0.672	72%	0.717	S	S	*	*			cis	-178.2	163.6	-28.3	-111.3	173.3	0	0	0	104.2
1245	T	25.1	Very low	26.2	Very low	114 Å²	114	129.2 Å²	129.2	70%	0.699	72%	0.719	S	S	*	*			trans	69	140.3	170.9	35.8	0	0	0	0	120.6
1246	D	26.5	Very low	26.1	Very low	143 Å²	143	130.2 Å²	130.2	77%	0.765	73%	0.726	S	S	*	*			trans	65.3	153.8	140.4	-66.3	4.1	0	0	0	122.3
1247	V	24.4	Very low	26.3	Very low	104 Å²	104	129.9 Å²	129.9	63%	0.63	72%	0.723	S	S	*	*			cis	-172.5	160.6	-38.5	117.6	0	0	0	0	106.9
1248	H	27.6	Very low	26.4	Very low	190 Å²	190	134 Å²	134	88%	0.88	73%	0.73	S	S	*	*			trans	67.5	156.1	-173.1	-55.4	-64.3	0	0	0	114.6
1249	G	26.5	Very low	26.5	Very low	56 Å²	56	130.8 Å²	130.8	58%	0.577	72%	0.723	S	S	*	*			cis	163.4	163.4	-7.2	0	0	0	0	0	111.7
1250	S	27.6	Very low	26.6	Very low	119 Å²	119	131.7 Å²	131.7	83%	0.832	72%	0.724	S	S	*	*			trans	58.6	127.4	-175	37	0	0	0	0	115.3
1251	E	23.6	Very low	26.7	Very low	159 Å²	159	133.2 Å²	133.2	74%	0.743	73%	0.727	S	S	*	*				74.8	134.8	55.7	-80	-155.2	-155.4	0	0	116.1
1252	Q	25.1	Very low	26.9	Very low	155 Å²	155	132.1 Å²	132.1	72%	0.724	73%	0.725	S	S	*	*			trans	60.4	97.8	156.8	-64.8	180	55.5	0	0	117.7
1253	S	22.7	Very low	27.2	Very low	95 Å²	95	133 Å²	133	66%	0.664	73%	0.725	S	S	*	*				92.6	-164.2	80.6	81.7	0	0	0	0	113.4
1254	I	29.4	Very low	27.4	Very low	143 Å²	143	130.3 Å²	130.3	73%	0.733	72%	0.718	S	S	*	*			trans	71.8	94.5	-175.7	-51.6	170.8	0	0	0	112.4
1255	N	23.5	Very low	27.7	Very low	150 Å²	150	133.1 Å²	133.1	80%	0.802	73%	0.728	S	S	*	*				60.3	104.6	63.4	-68	-30.4	0	0	0	115.8
1256	S	27.5	Very low	27.6	Very low	111 Å²	111	135.4 Å²	135.4	78%	0.776	74%	0.735	S	S	*	*			trans	-167.2	142.4	145.3	23.1	0	0	0	0	109.7
1257	I	30.2	Very low	27.4	Very low	137 Å²	137	134.5 Å²	134.5	70%	0.703	74%	0.735	S	S	*	*			cis	-155.6	151.1	-5	-119.4	162.7	0	0	0	109.9
1258	Y	30.8	Very low	27.6	Very low	214 Å²	214	136.3 Å²	136.3	84%	0.839	75%	0.747	S	S	*	*			trans	70.4	138.8	170.6	-67.8	-38.8	0	0	0	120.6
1259	A	30.7	Very low	27.7	Very low	70 Å²	70	132.3 Å²	132.3	58%	0.579	74%	0.737	S	S	*	*			cis	-159.2	157.7	-12.1	0	0	0	0	0	114.1
1260	H	31.5	Very low	27.7	Very low	152 Å²	152	140.4 Å²	140.4	70%	0.704	75%	0.752	S	S	*	*			trans	58.8	109	162.2	-65.9	-56.4	0	0	0	119.1
1261	H	29.4	Very low	27.6	Very low	160 Å²	160	144.2 Å²	144.2	74%	0.741	75%	0.749	S	S	*	*				69.7	132.6	74.8	-75.7	-131.4	0	0	0	112.2
1262	T	30.2	Very low	27.8	Very low	113 Å²	113	142.4 Å²	142.4	69%	0.693	75%	0.749	S	S	*	*			cis	-162.9	174.8	-0.3	13.8	0	0	0	0	106.6
1263	N	29.6	Very low	27.9	Very low	138 Å²	138	143.1 Å²	143.1	74%	0.738	76%	0.757	S	S	*	*			cis	-161	171.6	14	-122	6.1	0	0	0	105.9
1264	S	28.8	Very low	28	Very low	83 Å²	83	147 Å²	147	58%	0.58	77%	0.765	S	S	*	*			cis	-178.6	174.1	-21.4	47.7	0	0	0	0	108.3
1265	Q	30.8	Very low	27.9	Very low	190 Å²	190	150.7 Å²	150.7	89%	0.888	77%	0.771	S	S	*	*			trans	66.8	83.1	165.5	-63	-167	-16.9	0	0	118
1266	L	22.4	Very low	28	Very low	162 Å²	162	150.7 Å²	150.7	85%	0.848	77%	0.771	S	S	*	*			trans	-78.2	177.9	135.3	-104.9	162.4	0	0	0	110.2
1267	T	24	Very low	28.3	Very low	123 Å²	123	151.3 Å²	151.3	76%	0.755	77%	0.772	S	S	*	*			trans	83.9	107.4	166.4	72.8	0	0	0	0	119.4
1268	T	27.1	Very low	28.1	Very low	143 Å²	143	148.1 Å²	148.1	88%	0.877	77%	0.774	S	S	*	*				-162.3	153.3	115.9	16.3	0	0	0	0	108.8
1269	P	30.7	Very low	28.2	Very low	105 Å²	105	147.4 Å²	147.4	68%	0.682	78%	0.775	S	S	*	*			trans	-121	171.4	-146.9	41.9	-32.2	0	0	0	116.2
1270	Y	25.7	Very low	27.8	Very low	226 Å²	226	151.9 Å²	151.9	89%	0.886	78%	0.783	S	S	*	*			trans	-131.7	96.3	161.3	-95.4	-82.2	0	0	0	112.8
1271	Y	26.3	Very low	28.1	Very low	199 Å²	199	151.5 Å²	151.5	78%	0.78	79%	0.787	S	S	*	*			trans	37	104.3	150.2	-81	-89.6	0	0	0	121.7
1272	T	27.7	Very low	27.9	Very low	121 Å²	121	148.6 Å²	148.6	74%	0.742	78%	0.782	S	S	*	*			trans	-55.9	151.4	135.1	-40.2	0	0	0	0	110.7
1273	L	27.5	Very low	27.5	Very low	171 Å²	171	150 Å²	150	90%	0.895	79%	0.785	S	S	*	*			trans	-61.4	134	166.3	-73.1	163.2	0	0	0	110.9
1274	H	24.4	Very low	27.3	Very low	176 Å²	176	150.1 Å²	150.1	82%	0.815	78%	0.784	S	S	*	*			trans	-117.7	138.2	167.2	-122.1	-94.6	0	0	0	110.2
1275	Y	27.4	Very low	27.2	Very low	220 Å²	220	153 Å²	153	86%	0.863	79%	0.791	S	S	*	*			trans	-73.9	147.5	175.2	-105.8	-99	0	0	0	111.3
1276	N	26.5	Very low	27	Very low	151 Å²	151	149.4 Å²	149.4	81%	0.807	78%	0.777	S	S	*	*	S	Bend	trans	-67.2	150.6	147.5	-85.5	-25.9	0	0	0	108.8
1277	P	32.2	Very low	27.3	Very low	123 Å²	123	147.3 Å²	147.3	80%	0.799	77%	0.767	S	S	*	*			cis	-126.6	-163.3	-1	39.9	-21.9	0	0	0	112.4
1278	G	26.2	Very low	27.7	Very low	71 Å²	71	149.3 Å²	149.3	73%	0.732	77%	0.768	S	S	*	*			trans	-118.4	175.9	177.8	0	0	0	0	0	115.3
1279	F	32.4	Very low	27.8	Very low	199 Å²	199	151 Å²	151	87%	0.873	76%	0.763	S	S	*	*	S	Bend	trans	-79.2	144.4	164.8	-67.8	-92	0	0	0	109.5
1280	H	23.6	Very low	27.5	Very low	163 Å²	163	153.1 Å²	153.1	76%	0.755	77%	0.768	S	S	*	*			cis	-141.1	151.5	7.4	-131.5	-82.1	0	0	0	109.3
1281	N	36.6	Very low	27.6	Very low	145 Å²	145	146.4 Å²	146.4	78%	0.775	75%	0.754	S	S	*	*			trans	-67.2	154.7	155.5	-81.7	-29.9	0	0	0	109.3
1282	P	25.4	Very low	27.7	Very low	99 Å²	99	144.9 Å²	144.9	64%	0.643	75%	0.754	S	S	*	*			cis	-134.3	-155.2	-7.6	25.7	1.1	0	0	0	111.8
1283	L	22.9	Very low	27.7	Very low	143 Å²	143	149.8 Å²	149.8	75%	0.749	76%	0.759	S	S	*	*			trans	71.1	111.9	159.9	-49.4	-179.6	0	0	0	115.8
1284	L	25.2	Very low	27.5	Very low	139 Å²	139	149 Å²	149	73%	0.728	76%	0.755	S	S	*	*				75.5	123	85.4	-91	161.5	0	0	0	115
1285	M	26.5	Very low	27.5	Very low	144 Å²	144	147.7 Å²	147.7	71%	0.709	75%	0.753	S	S	*	*			trans	73.3	147.6	152.8	-47.4	-89.4	63.8	0	0	115.8
1286	D	25.5	Very low	27.3	Very low	114 Å²	114	144.4 Å²	144.4	61%	0.61	75%	0.749	S	S	*	*			cis	-155.4	-179.1	-1.2	-138.1	-28.7	0	0	0	113.9
1287	N	29.4	Very low	27.3	Very low	119 Å²	119	142.1 Å²	142.1	64%	0.636	74%	0.742	S	S	*	*			trans	82.2	121.5	161.2	-63.8	-55	0	0	0	118.3
1288	H	32.6	Very low	27.2	Very low	165 Å²	165	144.2 Å²	144.2	76%	0.764	74%	0.742	S	S	*	*	S	Bend	trans	58	110.4	165	-49	-46.5	0	0	0	117.3
1289	K	29.4	Very low	27.1	Very low	178 Å²	178	144.7 Å²	144.7	77%	0.774	73%	0.727	S	S	*	*			cis	-166.1	124.4	-10.6	-128	167.2	-179.3	179.4	0	103.4
1290	N	24.1	Very low	27	Very low	149 Å²	149	144.5 Å²	144.5	80%	0.797	73%	0.726	S	S	*	*				34.9	121.5	94.3	-66.1	-27.9	0	0	0	112.5
1291	S	27.9	Very low	27.5	Very low	85 Å²	85	145.9 Å²	145.9	59%	0.594	73%	0.732	S	S	*	*			cis	-175.8	165	46.5	53.7	0	0	0	0	113.7
1292	H	28.2	Very low	27.2	Very low	168 Å²	168	143.6 Å²	143.6	78%	0.778	73%	0.728	S	S	*	*			trans	68	140.4	153.5	-57.7	-36.6	0	0	0	118.5
1293	R	27.1	Very low	27.2	Very low	223 Å²	223	144.4 Å²	144.4	84%	0.842	73%	0.731	S	S	*	*			cis	-158.7	165.6	-17.9	-147	179.4	-172.6	-179.8	1.9	109.3
1294	L	23.7	Very low	27.3	Very low	155 Å²	155	142 Å²	142	81%	0.812	73%	0.726	S	S	*	*	S	Bend	trans	-64.6	145.8	154.9	-70.4	154.8	0	0	0	109.6
1295	L	23.9	Very low	27.4	Very low	148 Å²	148	143.1 Å²	143.1	78%	0.775	73%	0.732	S	S	*	*	S	Bend	trans	71.7	136.4	-179.8	-56.5	153.7	0	0	0	115.6
1296	I	23.5	Very low	27.5	Very low	151 Å²	151	143.4 Å²	143.4	77%	0.774	74%	0.742	S	S	*	*				41	130.3	127.3	-58.4	177.3	0	0	0	117.5
1297	P	27.7	Very low	27.5	Very low	103 Å²	103	141.7 Å²	141.7	67%	0.669	75%	0.751	S	S	*	*			cis	-143.1	-166.6	3.6	43.4	-23.6	0	0	0	116.3
1298	Q	30.2	Very low	27.8	Very low	168 Å²	168	144.2 Å²	144.2	79%	0.785	76%	0.764	S	S	*	*			trans	66.9	131.6	158.8	-64.5	-173.6	20.5	0	0	118
1299	L	24.5	Very low	28.1	Very low	81 Å²	81	141.4 Å²	141.4	42%	0.424	76%	0.76	S	S	.	*			cis	75.8	80.5	24.1	-48.3	-179.3	0	0	0	116.6	T1303	L1299-T1303 HydrophobicContact CD1-CG2 4.23Å
1300	K	29.8	Very low	27.8	Very low	195 Å²	195	138 Å²	138	85%	0.848	76%	0.758	S	S	*	*	S	Bend		-161.4	141.5	109.1	-98.7	152.9	-175	178	0	107.8
1301	Q	34.6	Very low	27.8	Very low	192 Å²	192	137.4 Å²	137.4	90%	0.897	76%	0.755	S	S	*	*	S	Bend	cis	-131.7	127.3	14.1	-56.1	164.4	1.1	0	0	108.5
1302	S	29.2	Very low	27.6	Very low	97 Å²	97	140.4 Å²	140.4	68%	0.678	76%	0.763	S	S	*	*	S	Bend	cis	-155	117.4	0.5	52.8	0	0	0	0	114.3
1303	T	25.9	Very low	27.4	Very low	115 Å²	115	137.1 Å²	137.1	71%	0.706	76%	0.759	S	S	*	*			trans	67.2	150.7	152.2	38.9	0	0	0	0	121	L1299	L1299-T1303 HydrophobicContact CD1-CG2 4.23Å
1304	S	24.8	Very low	27.4	Very low	93 Å²	93	137.8 Å²	137.8	65%	0.65	76%	0.762	S	S	*	*			trans	-150.5	169.8	-155.3	59.7	0	0	0	0	115.3
1305	L	26.6	Very low	27.5	Very low	162 Å²	162	135.6 Å²	135.6	85%	0.848	76%	0.757	S	S	*	*			trans	-77	144.7	176.4	-76.5	156.9	0	0	0	114.5
1306	T	28.6	Very low	28.3	Very low	151 Å²	151	134.9 Å²	134.9	93%	0.926	75%	0.754	S	S	*	*				166.5	142.7	126.9	32.5	0	0	0	0	111.2
1307	G	26.2	Very low	28.8	Very low	77 Å²	77	132 Å²	132	79%	0.794	75%	0.745	S	S	*	*			trans	150.7	123.9	168.6	0	0	0	0	0	116.3
1308	L	36.1	Very low	28.6	Very low	173 Å²	173	131.8 Å²	131.8	91%	0.906	74%	0.738	S	S	*	*			trans	-161.2	158.3	171	-91.3	169.1	0	0	0	106.9
1309	P	37.5	Very low	28.4	Very low	105 Å²	105	129 Å²	129	68%	0.682	73%	0.729	S	S	*	*			cis	-125.6	-168.5	-6.8	42.6	-27.5	0	0	0	113
1310	S	24.5	Very low	28.5	Very low	106 Å²	106	134.5 Å²	134.5	74%	0.741	75%	0.745	S	S	*	*			trans	62.1	146.7	167.3	58.9	0	0	0	0	117.2
1311	D	23.1	Very low	28.6	Very low	137 Å²	137	131.7 Å²	131.7	73%	0.733	74%	0.739	S	S	*	*			cis	-155.9	169.3	-16.4	-126	-50.9	0	0	0	109.4
1312	I	23.6	Very low	28.7	Very low	149 Å²	149	129.5 Å²	129.5	76%	0.764	73%	0.729	S	S	*	*			trans	41.6	87.9	159.8	-54.5	157.8	0	0	0	114.8
1313	S	25	Very low	29.1	Very low	99 Å²	99	131 Å²	131	69%	0.692	74%	0.737	S	S	*	*				-172.2	146.1	77.2	-58.7	0	0	0	0	108.4
1314	R	26.5	Very low	29	Very low	236 Å²	236	133.3 Å²	133.3	89%	0.891	73%	0.734	S	S	*	*				35.6	127.6	82.9	-75.3	-170.5	-177.2	-165.6	1.2	113.3
1315	P	25.6	Very low	29	Very low	109 Å²	109	135 Å²	135	71%	0.708	73%	0.734	S	S	*	*				-137.5	140.6	57.9	45.6	-32.3	0	0	0	114
1316	N	41	Very low	28.9	Very low	134 Å²	134	131.9 Å²	131.9	72%	0.717	73%	0.725	S	S	*	*				-54.5	121.4	115.5	-157.2	73	0	0	0	112	N1318	N1316-N1318 PolarHBondContact ND2-OD1 3.03Å
1317	P	33.1	Very low	28.7	Very low	91 Å²	91	129.8 Å²	129.8	59%	0.591	71%	0.709	S	S	*	*				-128.5	154	102.6	40	-25.1	0	0	0	109
1318	N	23.7	Very low	28.9	Very low	97 Å²	97	132.1 Å²	132.1	52%	0.519	70%	0.703	S	S	.	*				48.5	85.2	69.9	-68.6	85.1	0	0	0	110	N1316	N1316-N1318 PolarHBondContact ND2-OD1 3.03Å
1319	D	26.7	Very low	28.8	Very low	110 Å²	110	132 Å²	132	59%	0.588	70%	0.698	S	S	*	*				103.5	173.6	96.5	-69.3	-29.4	0	0	0	107.8
1320	Y	26.8	Very low	28.2	Very low	197 Å²	197	131.7 Å²	131.7	77%	0.773	70%	0.698	S	S	*	*			trans	69.2	118.6	173.6	-49.5	-71.2	0	0	0	114.4
1321	D	31.5	Very low	28.5	Very low	135 Å²	135	131.5 Å²	131.5	72%	0.722	69%	0.689	S	S	*	*			cis	-130.2	128.9	9.5	-77.2	-52.8	0	0	0	113.5	P1323	D1321-P1323 WeakPolarHBondContact O-CD 3.5Å
1322	E	37.4	Very low	28.9	Very low	146 Å²	146	134.3 Å²	134.3	68%	0.682	69%	0.691	S	S	*	*			trans	-54.7	136.5	141.5	-98.5	-166.5	171.1	0	0	109.5	Y1324	E1322-Y1324 WeakPolarHBondContact O-CB 3.2Å
1323	P	36.4	Very low	29.2	Very low	129 Å²	129	130.5 Å²	130.5	84%	0.838	69%	0.688	S	S	*	*				-88	90.4	122.1	30.6	-23.9	0	0	0	106.2	D1321	D1321-P1323 WeakPolarHBondContact O-CD 3.5Å
1324	Y	24.3	Very low	29.6	Very low	164 Å²	164	133 Å²	133	64%	0.643	69%	0.692	S	S	*	*			cis	62.1	134.9	47.2	-143.6	-20.2	0	0	0	110.1	E1322	E1322-Y1324 WeakPolarHBondContact O-CB 3.2Å
1325	I	24.5	Very low	29.4	Very low	129 Å²	129	128.4 Å²	128.4	66%	0.662	69%	0.685	S	S	*	*			trans	67.9	63.4	176.8	-44.2	-174.1	0	0	0	109.6
1326	S	23.9	Very low	29.5	Very low	95 Å²	95	130 Å²	130	66%	0.664	69%	0.688	S	S	*	*				62.3	-162	56.4	84	0	0	0	0	112
1327	N	26.2	Very low	28.8	Very low	107 Å²	107	128.7 Å²	128.7	57%	0.572	68%	0.684	S	S	*	*			trans	73.2	146	170.7	-68.9	39	0	0	0	115.1
1328	D	29.4	Very low	28.6	Very low	126 Å²	126	130.5 Å²	130.5	67%	0.674	69%	0.694	S	S	*	*			cis	-147.2	-169.7	-1.1	-119.4	-28.5	0	0	0	110.9
1329	E	34.5	Very low	28.6	Very low	172 Å²	172	132.8 Å²	132.8	80%	0.804	71%	0.706	S	S	*	*			trans	76.3	98.2	166.8	-44.3	-169	165.1	0	0	112.8
1330	S	25.4	Very low	28.6	Very low	98 Å²	98	132.1 Å²	132.1	69%	0.685	71%	0.706	S	S	*	*				64	156.4	51.7	99	0	0	0	0	111.6
1331	D	30.7	Very low	28.6	Very low	102 Å²	102	129.4 Å²	129.4	55%	0.545	70%	0.704	S	S	.	*			cis	-155.6	161.8	30.1	-144.9	-11.6	0	0	0	114.2
1332	Y	31	Very low	28.3	Very low	196 Å²	196	128.7 Å²	128.7	77%	0.769	71%	0.709	S	S	*	*			trans	58.1	133.7	175.4	-48	-74.2	0	0	0	118.7
1333	G	29.8	Very low	27.6	Very low	68 Å²	68	128.7 Å²	128.7	70%	0.701	71%	0.713	S	S	*	*			cis	148.2	-174.1	-7	0	0	0	0	0	113.6
1334	I	32.5	Very low	26.9	Very low	153 Å²	153	129 Å²	129	79%	0.785	71%	0.708	S	S	*	*			trans	73.5	88.9	161.2	-53.3	177.3	0	0	0	116.5
1335	N	22.5	Very low	26.9	Very low	138 Å²	138	127.9 Å²	127.9	74%	0.738	71%	0.712	S	S	*	*			trans	-5.5	133.5	130.1	-50.2	-30.7	0	0	0	117.7	T1337	N1335-T1337 HydrophobicContact CB-CG2 4.45Å
1336	D	29.1	Very low	26.9	Very low	144 Å²	144	129.8 Å²	129.8	77%	0.77	72%	0.719	S	S	*	*				-149.1	128.8	108.8	-95.8	-34.4	0	0	0	107.5
1337	T	24.3	Very low	27	Very low	106 Å²	106	131.5 Å²	131.5	65%	0.65	72%	0.719	S	S	*	*				72.3	158.1	59.4	90.3	0	0	0	0	114.3	N1335	N1335-T1337 HydrophobicContact CB-CG2 4.45Å
1338	V	29.9	Very low	26.9	Very low	129 Å²	129	132.2 Å²	132.2	78%	0.782	72%	0.721	S	S	*	*			trans	65.5	91.8	-163.5	-166.8	0	0	0	0	112.5
1339	N	23.2	Very low	26.7	Very low	144 Å²	144	131 Å²	131	77%	0.77	72%	0.715	S	S	*	*			cis	79.1	153.4	47	-158.3	13.8	0	0	0	114.2
1340	T	27.5	Very low	26.5	Very low	96 Å²	96	130.8 Å²	130.8	59%	0.589	71%	0.711	S	S	*	*			trans	85	98.3	169.2	65	0	0	0	0	120.8
1341	N	25.8	Very low	26.4	Very low	140 Å²	140	131.7 Å²	131.7	75%	0.749	71%	0.708	S	S	*	*				80.9	150	111.7	-59.9	-7.7	0	0	0	123.3
1342	C	26.3	Very low	26.2	Very low	120 Å²	120	135.4 Å²	135.4	81%	0.811	72%	0.72	S	S	*	*			trans	65.4	123.3	154.3	-69.7	0	0	0	0	117.3
1343	L	22	Very low	25.8	Very low	146 Å²	146	132.6 Å²	132.6	76%	0.764	72%	0.715	S	S	*	*			cis	57.4	116	20.8	-82.4	172.9	0	0	0	115.8
1344	D	22.2	Very low	25.5	Very low	137 Å²	137	136.8 Å²	136.8	73%	0.733	71%	0.714	S	S	*	*			trans	56.4	82.9	150	-51.5	-16.1	0	0	0	119.4
1345	D	25.2	Very low	25.2	Very low	139 Å²	139	134 Å²	134	74%	0.743	70%	0.701	S	S	*	*				-142.7	122.1	112.8	-94.5	-40.9	0	0	0	104.2
1346	E	24.3	Very low	25.3	Very low	170 Å²	170	133.1 Å²	133.1	79%	0.794	70%	0.696	S	S	*	*			cis	56.5	171.3	49	-130.6	-167	-134.3	0	0	113.6
1347	I	25.3	Very low	25.1	Very low	131 Å²	131	131.7 Å²	131.7	67%	0.672	69%	0.689	S	S	*	*			trans	68.5	123.7	-174.3	-53.3	-179.4	0	0	0	115.4
1348	I	24.7	Very low	25.2	Very low	121 Å²	121	131.2 Å²	131.2	62%	0.621	68%	0.682	S	S	*	*			cis	-174.7	151.9	-27.6	-119.2	164	0	0	0	106.7
1349	N	24.9	Very low	25	Very low	101 Å²	101	134 Å²	134	54%	0.54	68%	0.68	S	S	.	*			trans	62	165.6	166.8	-82.4	-45.6	0	0	0	116.4	N1351	N1349-N1351 PolarHBondContact OD1-ND2 3.33Å
1350	K	29.6	Very low	25	Very low	168 Å²	168	131.1 Å²	131.1	73%	0.73	67%	0.671	S	S	*	*			cis	-128.8	127.3	-7.5	-125.3	133.4	-160.2	163.5	0	105.8
1351	N	23.6	Very low	24.8	Very low	116 Å²	116	130.7 Å²	130.7	62%	0.62	66%	0.664	S	S	*	*				36.7	91.8	83	-66.4	-56.1	0	0	0	111.7	N1349	N1349-N1351 PolarHBondContact OD1-ND2 3.33Å
1352	K	26.6	Very low	24.7	Very low	180 Å²	180	127.8 Å²	127.8	78%	0.783	65%	0.646	S	S	*	*				-165.5	123.4	98.6	-94	168.6	178.9	-174.3	0	108.2
1353	M	22.8	Very low	24.8	Very low	138 Å²	138	128.9 Å²	128.9	68%	0.68	64%	0.639	S	S	*	*				62.3	139.4	72.1	-77.1	-173.8	156.5	0	0	111.5
1354	K	23.8	Very low	24.9	Very low	155 Å²	155	126.8 Å²	126.8	67%	0.674	63%	0.626	S	S	*	*			trans	69.9	145.9	144.1	-71.5	-176.5	151.7	-65.8	0	115.1
1355	D	24.9	Very low	25	Very low	96 Å²	96	125.8 Å²	125.8	51%	0.513	63%	0.629	S	S	.	*			cis	-158.6	-176	0.1	-119.8	-9.6	0	0	0	107.2
1356	N	25.3	Very low	24.9	Very low	118 Å²	118	124.4 Å²	124.4	63%	0.631	63%	0.631	S	S	*	*			trans	31.8	133	130.6	-49.3	-6.2	0	0	0	118.6
1357	N	25.6	Very low	24.9	Very low	115 Å²	115	124.3 Å²	124.3	62%	0.615	64%	0.635	S	S	*	*			cis	-179.3	-177.2	9.5	-123.8	17.9	0	0	0	111.3
1358	D	25.1	Very low	24.9	Very low	95 Å²	95	123.6 Å²	123.6	51%	0.508	64%	0.642	S	S	.	*			trans	57.2	125.4	133.5	-64.6	-11.6	0	0	0	122.5
1359	Y	26.3	Very low	24.9	Very low	189 Å²	189	121.4 Å²	121.4	74%	0.741	64%	0.642	S	S	*	*			trans	64.5	118.2	133.2	-52.8	-38.9	0	0	0	118.2
1360	S	23.4	Very low	24.9	Very low	83 Å²	83	123.1 Å²	123.1	58%	0.58	66%	0.656	S	S	*	*				65.1	145.9	53.3	99	0	0	0	0	112.2
1361	L	23.3	Very low	24.8	Very low	86 Å²	86	122.2 Å²	122.2	45%	0.45	65%	0.652	S	S	.	*			cis	-163.8	167.7	2.5	-125.7	159.7	0	0	0	106.9	S1615 K1616	L1361-S1615 WeakPolarHBondContact CA-OG 3.33Å; L1361-S1615 VanDerWaalsContact CD2-OG 3.25Å; L1361-S1615 WeakPolarHBondContact CD2-OG 3.45Å; L1361-K1616 WeakPolarHBondContact CD2-O 3.04Å
1362	Q	23.7	Very low	25	Very low	79 Å²	79	122.8 Å²	122.8	37%	0.369	65%	0.654	S	S	.	*			trans	70.7	157.2	155.6	-67.6	147	-13.7	0	0	116.7	N1617 T1618	Q1362-N1617 VanDerWaalsContact CD-O 3.3Å; Q1362-N1617 VanDerWaalsContact CG-N 3.3Å; Q1362-N1617 WeakPolarHBondContact CG-O 3.22Å; Q1362-N1617 PolarHBondContact NE2-O 2.93Å; Q1362-T1618 PolarHBondContact NE2-OG1 3.41Å
1363	H	28.1	Very low	24.9	Very low	143 Å²	143	122.9 Å²	122.9	66%	0.662	66%	0.659	S	S	*	*			cis	-122.3	172.6	15.3	-104.2	-94.6	0	0	0	115.1	T1618	H1363-T1618 PolarHBondContact CE1-O 3.28Å
1364	Q	23.4	Very low	25	Very low	102 Å²	102	121.5 Å²	121.5	48%	0.477	65%	0.651	S	S	.	*			trans	-107	-170.6	171	-57.1	-178.5	-89.3	0	0	111.5	K1616	Q1364-K1616 HydrophobicContact CG-CB 4.3Å; Q1364-K1616 HydrophobicContact CG-CG 3.57Å
1365	S	24.4	Very low	25.1	Very low	116 Å²	116	119.9 Å²	119.9	81%	0.811	65%	0.649	S	S	*	*			trans	89.3	143	166.8	79.1	0	0	0	0	115.8
1366	S	25	Very low	25.1	Very low	111 Å²	111	123.3 Å²	123.3	78%	0.776	66%	0.659	S	S	*	*			cis	-159.1	167.6	-9	30.6	0	0	0	0	112.7
1367	L	23.9	Very low	25.2	Very low	167 Å²	167	126 Å²	126	87%	0.874	67%	0.665	S	S	*	*			trans	-72.3	137.9	170.5	-84.7	64.1	0	0	0	112.6
1368	S	25.7	Very low	25	Very low	117 Å²	117	125.5 Å²	125.5	82%	0.818	67%	0.67	S	S	*	*			trans	-162.5	114.6	137.2	56.6	0	0	0	0	107.8
1369	A	23.9	Very low	25	Very low	75 Å²	75	127.8 Å²	127.8	62%	0.62	68%	0.682	S	S	*	*			cis	86	91.3	29.4	0	0	0	0	0	115.4
1370	T	24.8	Very low	25	Very low	137 Å²	137	128.2 Å²	128.2	84%	0.84	68%	0.684	S	S	*	*			trans	72.6	171	156.6	71.3	0	0	0	0	115.7
1371	K	26.5	Very low	25	Very low	149 Å²	149	128.7 Å²	128.7	65%	0.648	69%	0.687	S	S	*	*			cis	-165.7	-179.9	26.8	-158.2	-173.9	168.1	-149.4	0	113.2	E1374	K1371-E1374 WeakPolarHBondContact CE-OE1 3.48Å; K1371-E1374 IonicContact NZ-OE1 3.21Å; K1371-E1374 PolarHBondContact NZ-OE1 3.31Å
1372	I	27.7	Very low	25.2	Very low	128 Å²	128	133.6 Å²	133.6	66%	0.656	71%	0.708	S	S	*	*			trans	79.4	107.3	162.8	-50.5	171.6	0	0	0	113.8	E1374	I1372-E1374 HydrophobicContact CG2-CB 4.48Å
1373	M	25.7	Very low	25.1	Very low	182 Å²	182	136.2 Å²	136.2	90%	0.897	72%	0.724	S	S	*	*				-117	137.6	50.2	-92.8	175.8	-87.2	0	0	111.8
1374	E	25.1	Very low	24.8	Very low	108 Å²	108	137.3 Å²	137.3	51%	0.505	73%	0.73	S	S	.	*			cis	52.6	117.6	30	-65.1	-162	-159.3	0	0	113	K1371 I1372	K1371-E1374 WeakPolarHBondContact CE-OE1 3.48Å; K1371-E1374 IonicContact NZ-OE1 3.21Å; K1371-E1374 PolarHBondContact NZ-OE1 3.31Å; I1372-E1374 HydrophobicContact CG2-CB 4.48Å
1375	L	26	Very low	24.8	Very low	121 Å²	121	142.3 Å²	142.3	63%	0.634	75%	0.75	S	S	*	*				-159.8	145	59.3	-72.6	164.4	0	0	0	112.8
1376	K	25.2	Very low	24.6	Very low	169 Å²	169	145.7 Å²	145.7	74%	0.735	75%	0.75	S	S	*	*			trans	55.7	147.8	134	-63.5	168.9	-174.1	161.5	0	119.1
1377	K	26.2	Very low	24.4	Very low	173 Å²	173	148.2 Å²	148.2	75%	0.752	74%	0.744	S	S	*	*			cis	-154.6	131	-0.2	-114.7	170	174.8	-171.1	0	105.8
1378	C	22.3	Very low	24.3	Very low	106 Å²	106	145.5 Å²	145.5	72%	0.716	73%	0.726	S	S	*	*				73.2	149.7	87.6	-59.6	0	0	0	0	116
1379	N	25.6	Very low	24.3	Very low	142 Å²	142	148.9 Å²	148.9	76%	0.759	73%	0.729	S	S	*	*			trans	94.5	130.1	172.2	-54.8	3.4	0	0	0	115.4
1380	Y	25.5	Very low	24.2	Very low	198 Å²	198	154.7 Å²	154.7	78%	0.776	74%	0.741	S	S	*	*			cis	-159	154	-5.4	-137.5	-110.8	0	0	0	109.5
1381	S	24.2	Very low	24	Very low	94 Å²	94	152.8 Å²	152.8	66%	0.657	73%	0.733	S	S	*	*			trans	49.4	146.1	152.8	57.2	0	0	0	0	121.1
1382	E	26.1	Very low	23.9	Very low	189 Å²	189	153.5 Å²	153.5	88%	0.883	74%	0.742	S	S	*	*			cis	-157.3	-166.9	6.1	-133.4	168.9	-163.7	0	0	113.6
1383	N	21.8	Very low	23.6	Very low	133 Å²	133	152.1 Å²	152.1	71%	0.711	74%	0.744	S	S	*	*			trans	-104.6	152.7	-162.1	-91	-61.6	0	0	0	116.3
1384	Q	21.4	Very low	23.6	Very low	166 Å²	166	149.8 Å²	149.8	78%	0.776	73%	0.734	S	S	*	*			trans	47.7	112.7	139.2	-59.2	171.5	25.2	0	0	121.6
1385	K	24.7	Very low	23.4	Very low	207 Å²	207	150.6 Å²	150.6	90%	0.9	74%	0.742	S	S	*	*			trans	-170.8	124	133.8	-96.1	144.9	-174.8	176.7	0	106
1386	K	20.3	Very low	23.3	Very low	187 Å²	187	153.9 Å²	153.9	81%	0.813	75%	0.751	S	S	*	*			cis	69	105.8	43	-121.7	-146.3	-179.5	-177.2	0	113.9
1387	Y	20.6	Very low	23.3	Very low	164 Å²	164	153 Å²	153	64%	0.643	75%	0.754	S	S	*	*			trans	67.8	146.3	161.2	-83.7	-108.7	0	0	0	120.7
1388	E	20.6	Very low	23.4	Very low	110 Å²	110	151.2 Å²	151.2	51%	0.514	75%	0.753	S	S	.	*			trans	46.6	112.3	153.8	-71.5	167.8	-152.7	0	0	120.2
1389	Q	25.8	Very low	23.5	Very low	188 Å²	188	153.2 Å²	153.2	88%	0.879	76%	0.756	S	S	*	*				-156.4	95.1	128.7	-113.3	165.9	21.2	0	0	113.1
1390	K	21.3	Very low	23.6	Very low	198 Å²	198	153.6 Å²	153.6	86%	0.861	76%	0.757	S	S	*	*			trans	-94.2	98.5	146.7	-101.8	-169	175.2	-175.4	0	106.8
1391	S	21.5	Very low	23.7	Very low	96 Å²	96	150.6 Å²	150.6	67%	0.671	76%	0.755	S	S	*	*			trans	-172.9	138.4	149.4	53.2	0	0	0	0	113.1
1392	I	24.2	Very low	23.6	Very low	164 Å²	164	152.8 Å²	152.8	84%	0.841	76%	0.759	S	S	*	*			trans	-50.8	148.2	161.9	-65	147.9	0	0	0	111.7
1393	S	22.5	Very low	23.4	Very low	99 Å²	99	151.3 Å²	151.3	69%	0.692	75%	0.752	S	S	*	*			trans	-166.8	142.5	151.9	-87.9	0	0	0	0	113.1
1394	L	25	Very low	23.5	Very low	133 Å²	133	152.1 Å²	152.1	70%	0.696	75%	0.751	S	S	*	*			trans	60.1	150.6	158.1	-84	55	0	0	0	120
1395	D	21.6	Very low	23.6	Very low	126 Å²	126	150.5 Å²	150.5	67%	0.674	75%	0.747	S	S	*	*			cis	-164.6	177.2	-45.6	-127.5	-60.8	0	0	0	111.7
1396	K	23.8	Very low	23.5	Very low	189 Å²	189	150.8 Å²	150.8	82%	0.822	74%	0.743	S	S	*	*			trans	-49.8	138.6	178.4	-61.6	159.6	-177.2	178.1	0	115.5
1397	L	24.6	Very low	23.6	Very low	152 Å²	152	148.4 Å²	148.4	80%	0.796	74%	0.74	S	S	*	*			trans	-159.5	107.3	144.3	-117.7	171.3	0	0	0	111.5
1398	N	28.5	Very low	23.9	Very low	135 Å²	135	144.5 Å²	144.5	72%	0.722	73%	0.733	S	S	*	*			trans	59.7	122.3	169.9	-53.9	-14.2	0	0	0	116.3
1399	D	24.1	Very low	24.1	Very low	147 Å²	147	143.5 Å²	143.5	79%	0.786	73%	0.734	S	S	*	*			cis	60.6	102.5	40	-57.8	-38.5	0	0	0	115
1400	L	27.2	Very low	24.1	Very low	151 Å²	151	139.1 Å²	139.1	79%	0.791	72%	0.722	S	S	*	*				171.9	129.5	110.2	-89.6	165.2	0	0	0	113
1401	N	26.8	Very low	24.2	Very low	134 Å²	134	137.9 Å²	137.9	72%	0.717	72%	0.717	S	S	*	*			trans	45.4	113.1	154.8	-52.7	-12.2	0	0	0	119.2
1402	N	23.6	Very low	24.4	Very low	141 Å²	141	138.3 Å²	138.3	75%	0.754	72%	0.72	S	S	*	*				69.3	99.2	65.3	-70.7	14.4	0	0	0	116.2
1403	E	22.2	Very low	24.4	Very low	158 Å²	158	134.9 Å²	134.9	74%	0.738	71%	0.71	S	S	*	*			trans	65.5	145.3	130.4	-58.2	-161.7	114.8	0	0	124.2
1404	H	24	Very low	24.5	Very low	149 Å²	149	134.3 Å²	134.3	69%	0.69	71%	0.707	S	S	*	*			trans	86.1	111.5	149.1	-73.2	-27.9	0	0	0	122.9
1405	I	22.5	Very low	24.4	Very low	133 Å²	133	132.9 Å²	132.9	68%	0.682	71%	0.708	S	S	*	*				96.6	114.3	124.2	-71.3	171	0	0	0	118.8
1406	Y	23.3	Very low	24.5	Very low	212 Å²	212	130.6 Å²	130.6	83%	0.831	70%	0.701	S	S	*	*			trans	22.1	130.3	146.8	-62.5	-103.2	0	0	0	120.1
1407	D	21.9	Very low	24.5	Very low	138 Å²	138	132.8 Å²	132.8	74%	0.738	71%	0.705	S	S	*	*				-168	170.5	97.5	-140.6	-22.7	0	0	0	115
1408	T	26.1	Very low	24.4	Very low	82 Å²	82	129.8 Å²	129.8	50%	0.503	70%	0.696	S	S	.	*			trans	70.9	112.5	167.3	58	0	0	0	0	118	K251	K251-T1408 VanDerWaalsContact CE-OG1 3.22Å; K251-T1408 WeakPolarHBondContact CE-OG1 3.25Å; K251-T1408 PolarHBondContact NZ-OG1 3.06Å
1409	V	25.4	Very low	24.1	Very low	89 Å²	89	129.5 Å²	129.5	54%	0.539	71%	0.705	S	S	.	*			cis	64.8	122.3	40	-166.7	0	0	0	0	109.9	F1411	V1409-F1411 HydrophobicContact CG1-CD2 4.03Å
1410	P	27.1	Very low	24.1	Very low	96 Å²	96	125.8 Å²	125.8	62%	0.623	69%	0.69	S	S	*	*			cis	-102.2	153	47.9	-8	29.4	0	0	0	117.8
1411	F	23.3	Very low	23.8	Very low	172 Å²	172	124.5 Å²	124.5	75%	0.754	69%	0.694	S	S	*	*			trans	-76.8	160.3	-178.4	-96	-89.1	0	0	0	115	V1409	V1409-F1411 HydrophobicContact CG1-CD2 4.03Å
1412	S	24.5	Very low	23.7	Very low	104 Å²	104	122.4 Å²	122.4	73%	0.727	69%	0.69	S	S	*	*			trans	65.6	142.2	143.2	61.4	0	0	0	0	118.3
1413	S	24.5	Very low	23.6	Very low	92 Å²	92	123.6 Å²	123.6	64%	0.643	70%	0.695	S	S	*	*			cis	-175.1	157.7	-2.2	37.3	0	0	0	0	107.6
1414	S	24	Very low	23.7	Very low	88 Å²	88	121.1 Å²	121.1	62%	0.615	69%	0.692	S	S	*	*			cis	-173.1	151.8	-4.4	41.5	0	0	0	0	110.3
1415	S	23	Very low	23.7	Very low	102 Å²	102	122.6 Å²	122.6	71%	0.713	70%	0.696	S	S	*	*			trans	65.1	177.4	161.7	84.3	0	0	0	0	116.4
1416	S	24.2	Very low	23.7	Very low	78 Å²	78	123.7 Å²	123.7	55%	0.545	70%	0.702	S	S	.	*			trans	54.1	97.8	-166.9	27.7	0	0	0	0	114.1
1417	R	23.9	Very low	23.7	Very low	235 Å²	235	118.7 Å²	118.7	89%	0.887	70%	0.698	S	S	*	*				61.5	132.1	71.3	-64.1	169.9	149.9	172.5	-8.6	113.4
1418	S	23.3	Very low	23.8	Very low	89 Å²	89	116.3 Å²	116.3	62%	0.622	69%	0.692	S	S	*	*			trans	40.5	115.1	140.4	68	0	0	0	0	118.8	S1420	S1418-S1420 PolarHBondContact O-N 2.91Å
1419	S	22.4	Very low	23.7	Very low	130 Å²	130	123.2 Å²	123.2	91%	0.909	71%	0.708	S	S	*	*				-67.6	86	128	55.6	0	0	0	0	107.9
1420	S	22.4	Very low	23.6	Very low	68 Å²	68	123.6 Å²	123.6	48%	0.476	72%	0.715	S	S	.	*			trans	-54	148.8	155.2	41.5	0	0	0	0	108.7	S1418 S1422	S1418-S1420 PolarHBondContact O-N 2.91Å; S1420-S1422 PolarHBondContact O-N 3.22Å
1421	S	22.2	Very low	23.5	Very low	124 Å²	124	127.6 Å²	127.6	87%	0.867	73%	0.726	S	S	*	*	S	Bend	trans	-71.1	76.9	152.1	56.2	0	0	0	0	108.2
1422	S	23.2	Very low	23.4	Very low	90 Å²	90	126.5 Å²	126.5	63%	0.629	73%	0.727	S	S	*	*			trans	71.1	151.3	171	-54.3	0	0	0	0	118.2	S1420	S1420-S1422 PolarHBondContact O-N 3.22Å
1423	L	22.2	Very low	23.4	Very low	166 Å²	166	125.7 Å²	125.7	87%	0.869	72%	0.721	S	S	*	*			trans	-115.4	76.6	168.1	-151.8	-178.4	0	0	0	108.4
1424	T	24.9	Very low	23.5	Very low	107 Å²	107	127.8 Å²	127.8	66%	0.656	73%	0.725	S	S	*	*			trans	-168	138.1	174.4	41.3	0	0	0	0	106.9
1425	K	23.9	Very low	23.5	Very low	179 Å²	179	132.4 Å²	132.4	78%	0.778	74%	0.735	S	S	*	*			cis	-136.4	156.1	2.3	-103.5	161.6	-176.7	175.5	0	107.2
1426	I	22.6	Very low	23.6	Very low	157 Å²	157	135.3 Å²	135.3	81%	0.805	74%	0.742	S	S	*	*				35.2	131.4	95.5	-52.1	177.2	0	0	0	114
1427	S	22.5	Very low	23.8	Very low	107 Å²	107	139 Å²	139	75%	0.748	75%	0.751	S	S	*	*			trans	91.8	139.6	165.7	-146.9	0	0	0	0	118.5
1428	S	24.1	Very low	23.9	Very low	88 Å²	88	132.8 Å²	132.8	62%	0.615	74%	0.743	S	S	*	*			trans	-35	174.3	162.9	64.3	0	0	0	0	119.3
1429	R	23.5	Very low	24.2	Very low	226 Å²	226	134.7 Å²	134.7	85%	0.853	75%	0.751	S	S	*	*			trans	72.9	115.5	157.1	-77.4	176.8	166.4	161.6	-4.1	117.7
1430	S	24.5	Very low	24.4	Very low	98 Å²	98	135.1 Å²	135.1	69%	0.685	73%	0.734	S	S	*	*				8.9	138.2	120.1	60.2	0	0	0	0	119.3
1431	Q	23.7	Very low	24.8	Very low	179 Å²	179	137.7 Å²	137.7	84%	0.836	74%	0.742	S	S	*	*			trans	111.9	121.3	151.9	-63.7	-162.5	-16.1	0	0	118.7
1432	L	22.3	Very low	25.2	Very low	149 Å²	149	137 Å²	137	78%	0.78	73%	0.729	S	S	*	*			trans	34.6	115.8	131.8	-93.4	73.7	0	0	0	121.6
1433	S	24.4	Very low	25.5	Very low	88 Å²	88	142.4 Å²	142.4	62%	0.615	74%	0.737	S	S	*	*				77.7	132.1	114.2	80.5	0	0	0	0	122.5
1434	N	25.9	Very low	25.7	Very low	135 Å²	135	140.4 Å²	140.4	72%	0.722	73%	0.727	S	S	*	*			trans	87.3	119.9	131.8	-73.1	-0.9	0	0	0	122.7
1435	F	25.5	Very low	26	Very low	186 Å²	186	142.9 Å²	142.9	82%	0.816	73%	0.731	S	S	*	*			trans	71.1	137.2	137.5	-87.4	-97.7	0	0	0	121.7
1436	N	24.8	Very low	26.2	Very low	163 Å²	163	139.5 Å²	139.5	87%	0.872	73%	0.726	S	S	*	*			trans	-72.3	153.2	164.2	-63.3	-14.8	0	0	0	110.8
1437	Q	28.9	Very low	26.3	Very low	156 Å²	156	139.3 Å²	139.3	73%	0.729	73%	0.725	S	S	*	*			trans	-131.4	165.5	173.5	-76.2	-169.4	-26.8	0	0	111.3
1438	S	25.7	Very low	26.5	Very low	104 Å²	104	141.8 Å²	141.8	73%	0.727	73%	0.725	S	S	*	*				-168.5	152.4	125.6	15.4	0	0	0	0	111.6
1439	T	28.7	Very low	26.7	Very low	128 Å²	128	144.8 Å²	144.8	79%	0.785	73%	0.734	S	S	*	*			trans	60.5	112.2	170.8	60	0	0	0	0	117.6
1440	Y	26.2	Very low	27	Very low	139 Å²	139	136.5 Å²	136.5	55%	0.545	72%	0.718	S	S	.	*			cis	86.3	141	30.5	-65.2	-151.4	0	0	0	113
1441	N	30.3	Very low	27	Very low	122 Å²	122	138.1 Å²	138.1	65%	0.652	73%	0.725	S	S	*	*			cis	-158.9	-168.4	-8.3	-101.5	16.6	0	0	0	107.3
1442	N	31.5	Very low	27	Very low	110 Å²	110	136.2 Å²	136.2	59%	0.588	72%	0.72	S	S	*	*			cis	-156	-156.9	6.3	-128.6	23.8	0	0	0	107.1
1443	Y	28.8	Very low	27.1	Very low	203 Å²	203	135.5 Å²	135.5	80%	0.796	72%	0.717	S	S	*	*			cis	-162.1	-161.1	0.8	-132.2	-27.7	0	0	0	112.3
1444	D	28.1	Very low	26.9	Very low	124 Å²	124	140.1 Å²	140.1	66%	0.663	73%	0.726	S	S	*	*			trans	66.4	116.6	156.9	-71.3	15.1	0	0	0	126.5
1445	H	30	Very low	26.8	Very low	159 Å²	159	138.2 Å²	138.2	74%	0.736	72%	0.723	S	S	*	*			trans	54.6	144.5	149.5	-63.5	-61.9	0	0	0	123.6
1446	T	28.5	Very low	26.6	Very low	109 Å²	109	137.3 Å²	137.3	67%	0.669	72%	0.719	S	S	*	*			cis	95.9	139.7	5.9	75	0	0	0	0	119
1447	L	25.6	Very low	26.7	Very low	152 Å²	152	135.7 Å²	135.7	80%	0.796	71%	0.706	S	S	*	*			cis	-169.6	153.4	-8.7	-111.8	172.8	0	0	0	115.1
1448	H	25.4	Very low	26.3	Very low	159 Å²	159	136.2 Å²	136.2	74%	0.736	71%	0.708	S	S	*	*			trans	59.4	143.1	146.3	-126	-30.6	0	0	0	127.3
1449	N	29.3	Very low	26.3	Very low	152 Å²	152	137 Å²	137	81%	0.813	71%	0.713	S	S	*	*			trans	-154.6	176.4	146	-118	-105.6	0	0	0	110.5
1450	G	28.4	Very low	26.1	Very low	51 Å²	51	136.8 Å²	136.8	53%	0.526	71%	0.708	S	S	.	*			cis	-169.9	7.1	4.9	0	0	0	0	0	119.6
1451	T	25.8	Very low	26	Very low	133 Å²	133	137.2 Å²	137.2	82%	0.816	71%	0.712	S	S	*	*			trans	67.6	141.3	165	37.1	0	0	0	0	124.8
1452	L	22.8	Very low	25.9	Very low	139 Å²	139	138.7 Å²	138.7	73%	0.728	72%	0.717	S	S	*	*			trans	60.3	123.6	141.2	-69.2	166.6	0	0	0	123.4
1453	N	24.1	Very low	25.6	Very low	134 Å²	134	139 Å²	139	72%	0.717	72%	0.719	S	S	*	*				176.9	145.5	93.7	-100.1	-37.3	0	0	0	118
1454	F	21.2	Very low	25.7	Very low	184 Å²	184	136.3 Å²	136.3	81%	0.807	72%	0.718	S	S	*	*			trans	15.3	121.5	143.5	-86.8	-88.9	0	0	0	123.4
1455	S	22.4	Very low	25.6	Very low	96 Å²	96	136.8 Å²	136.8	67%	0.671	72%	0.719	S	S	*	*				128.6	148.4	100	71.3	0	0	0	0	121.1
1456	K	23.2	Very low	25.3	Very low	167 Å²	167	133.2 Å²	133.2	73%	0.726	71%	0.712	S	S	*	*			trans	76.6	142.2	132.3	-92.3	177.2	163	-162.5	0	123.8
1457	H	25	Very low	25.3	Very low	128 Å²	128	133.9 Å²	133.9	59%	0.593	72%	0.716	S	S	*	*			trans	59.7	121.1	152	-64.6	-57	0	0	0	118.5
1458	Q	20.8	Very low	25.4	Very low	168 Å²	168	131.9 Å²	131.9	79%	0.785	71%	0.71	S	S	*	*				65.7	85.6	75.1	-75.7	-175.8	-51.5	0	0	114.5
1459	S	25.9	Very low	25.5	Very low	119 Å²	119	129.7 Å²	129.7	83%	0.832	70%	0.704	S	S	*	*			trans	-153.6	105.9	132.3	-34.6	0	0	0	0	106.2
1460	D	25.7	Very low	25.4	Very low	125 Å²	125	130.1 Å²	130.1	67%	0.668	70%	0.701	S	S	*	*				73.9	126.2	78.4	-103.2	-4.7	0	0	0	115.8
1461	K	23.8	Very low	25.4	Very low	147 Å²	147	132.6 Å²	132.6	64%	0.639	71%	0.71	S	S	*	*			trans	40	130.1	140.3	-54	175.2	-172.7	77.2	0	117.6
1462	M	28.1	Very low	25.5	Very low	154 Å²	154	133.7 Å²	133.7	76%	0.759	71%	0.708	S	S	*	*			cis	-131.5	142.9	41.1	-72.9	-73.3	-99.3	0	0	110.5
1463	N	25.1	Very low	25.8	Very low	115 Å²	115	134.1 Å²	134.1	62%	0.615	71%	0.709	S	S	*	*				49.9	125.6	76	-61.8	-28	0	0	0	111.2
1464	L	30	Very low	25.8	Very low	148 Å²	148	136.7 Å²	136.7	78%	0.775	71%	0.714	S	S	*	*			cis	-141.3	162.4	38.2	-64	164.5	0	0	0	109.3
1465	L	27.4	Very low	26	Very low	134 Å²	134	132.6 Å²	132.6	70%	0.702	71%	0.708	S	S	*	*			cis	-158.4	119	-15.8	-99.1	166.9	0	0	0	103.1
1466	S	23.8	Very low	26.1	Very low	83 Å²	83	133.6 Å²	133.6	58%	0.58	71%	0.711	S	S	*	*				81.5	135.6	82.7	83.2	0	0	0	0	115.9
1467	V	27	Very low	26.1	Very low	123 Å²	123	129.1 Å²	129.1	75%	0.745	70%	0.7	S	S	*	*				75.2	128.9	127.3	160.9	0	0	0	0	116.4
1468	T	28.1	Very low	26.1	Very low	110 Å²	110	132.6 Å²	132.6	68%	0.675	71%	0.71	S	S	*	*			cis	-173.3	168	3.3	21.4	0	0	0	0	109
1469	D	26.8	Very low	26.3	Very low	114 Å²	114	132.7 Å²	132.7	61%	0.61	71%	0.707	S	S	*	*			cis	-158.1	175.5	-17.7	-133	-33.3	0	0	0	111.1
1470	Q	28.6	Very low	26.1	Very low	161 Å²	161	131.4 Å²	131.4	75%	0.752	70%	0.698	S	S	*	*			trans	23.2	139.9	144.1	-70.5	157.3	57.3	0	0	120.8
1471	S	27.2	Very low	26	Very low	102 Å²	102	134.2 Å²	134.2	71%	0.713	71%	0.71	S	S	*	*			cis	-160.2	163.5	23.2	75.2	0	0	0	0	110.8
1472	M	28	Very low	25.9	Very low	157 Å²	157	130 Å²	130	77%	0.773	70%	0.699	S	S	*	*			cis	-134.9	151.8	0.6	-81.2	-164.6	-174.9	0	0	111.4
1473	I	28.6	Very low	25.9	Very low	147 Å²	147	130.3 Å²	130.3	75%	0.754	70%	0.703	S	S	*	*			trans	34.7	94.9	133.4	-50.1	174.1	0	0	0	114.8
1474	K	24.8	Very low	25.9	Very low	188 Å²	188	127.3 Å²	127.3	82%	0.817	69%	0.689	S	S	*	*			cis	60.7	107.7	36.2	-120.8	-178.1	-175	175.1	0	111.2
1475	S	24.8	Very low	25.7	Very low	99 Å²	99	124.1 Å²	124.1	69%	0.692	67%	0.672	S	S	*	*				130.7	-180	93.3	68.4	0	0	0	0	107.6
1476	T	26.2	Very low	25.7	Very low	117 Å²	117	122 Å²	122	72%	0.718	66%	0.662	S	S	*	*			cis	-169.5	156.5	7.6	5.1	0	0	0	0	105
1477	S	22.5	Very low	25.8	Very low	73 Å²	73	127.9 Å²	127.9	51%	0.51	67%	0.671	S	S	.	*			cis	169.3	167	-15.5	50.5	0	0	0	0	109
1478	Y	24.5	Very low	25.8	Very low	200 Å²	200	128.7 Å²	128.7	78%	0.784	67%	0.671	S	S	*	*			trans	70.8	151.5	148.8	-65	-31.8	0	0	0	119.5
1479	K	24.7	Very low	25.7	Very low	170 Å²	170	128.9 Å²	128.9	74%	0.739	67%	0.672	S	S	*	*			cis	-166.1	147.4	-26	-141.9	179.5	-176	-179.1	0	111.3
1480	S	21.4	Very low	25.6	Very low	92 Å²	92	127.4 Å²	127.4	64%	0.643	67%	0.67	S	S	*	*			trans	47	139.9	140.4	61	0	0	0	0	124.6
1481	M	23.6	Very low	25.5	Very low	184 Å²	184	123.7 Å²	123.7	91%	0.906	66%	0.662	S	S	*	*			trans	92.8	151.5	144.7	-79.9	179.6	72.5	0	0	121
1482	S	23.3	Very low	25.4	Very low	60 Å²	60	126.6 Å²	126.6	42%	0.42	67%	0.665	S	S	.	*			trans	-117.3	162.2	-161.7	45.1	0	0	0	0	112.4	N1571 E1572	S1482-N1571 PolarHBondContact OG-O 3.22Å; S1482-E1572 PolarHBondContact OG-O 3.36Å
1483	L	28.4	Very low	25.5	Very low	160 Å²	160	128.3 Å²	128.3	84%	0.838	67%	0.673	S	S	*	*			trans	-170.5	99.4	156.2	-104.9	167.7	0	0	0	113.1
1484	T	24.9	Very low	25.2	Very low	51 Å²	51	126.5 Å²	126.5	31%	0.313	67%	0.669	S	S	.	*			trans	33.1	90.5	132.9	73.7	0	0	0	0	123	D1569 V1570	T1484-D1569 WeakPolarHBondContact CG2-O 3.47Å; T1484-V1570 HydrophobicContact CG2-CB 3.93Å; T1484-V1570 HydrophobicContact CG2-CG1 4.17Å
1485	N	25.9	Very low	25.5	Very low	81 Å²	81	123.2 Å²	123.2	43%	0.433	67%	0.667	S	S	.	*				51	147	123.5	-96.1	13.7	0	0	0	127.3	D1569 V1570	N1485-D1569 HydrophobicContact CB-CB 3.65Å; N1485-D1569 VanDerWaalsContact CB-CG 3.41Å; N1485-D1569 WeakPolarHBondContact CB-OD2 3.43Å; N1485-D1569 VanDerWaalsContact ND2-CG 3.28Å; N1485-D1569 PolarHBondContact ND2-OD1 3.08Å; N1485-V1570 HydrophobicContact CB-CG2 4.19Å; N1485-V1570 VanDerWaalsContact ND2-CG2 3.31Å; N1485-V1570 WeakPolarHBondContact ND2-CG2 3.18Å
1486	N	26.9	Very low	25.5	Very low	91 Å²	91	123.5 Å²	123.5	49%	0.487	66%	0.664	S	S	.	*			trans	72.6	146.9	143	-73.1	-35.9	0	0	0	122.2	D1569	N1486-D1569 PolarHBondContact ND2-OD1 2.65Å; N1486-D1569 PolarHBondContact ND2-OD2 3.5Å
1487	R	26	Very low	25.6	Very low	206 Å²	206	124 Å²	124	78%	0.777	66%	0.662	S	S	*	*			cis	-177	166.6	-25.7	-153.7	-178.7	179.7	-169.3	1.3	110.2
1488	L	26.9	Very low	25.7	Very low	139 Å²	139	127.7 Å²	127.7	73%	0.728	67%	0.671	S	S	*	*			trans	71.4	165.5	163.2	-52.9	174.7	0	0	0	116
1489	T	25.5	Very low	25.9	Very low	115 Å²	115	123.2 Å²	123.2	71%	0.706	67%	0.665	S	S	*	*			cis	-167.3	167	-16.8	20	0	0	0	0	107.5
1490	S	24.1	Very low	25.9	Very low	82 Å²	82	122.5 Å²	122.5	57%	0.573	66%	0.664	S	S	*	*			cis	-140.4	-145.6	-8.3	51.6	0	0	0	0	106.8
1491	S	27.7	Very low	26.2	Very low	83 Å²	83	123.5 Å²	123.5	58%	0.58	66%	0.662	S	S	*	*			cis	-159.9	148	-0.3	-100.4	0	0	0	0	105.1
1492	E	24.9	Very low	26.3	Very low	163 Å²	163	121.3 Å²	121.3	76%	0.762	66%	0.655	S	S	*	*			cis	88.4	114.5	46.4	-170.5	179.1	-129	0	0	114.6
1493	M	29.5	Very low	26.5	Very low	193 Å²	193	123.3 Å²	123.3	95%	0.951	67%	0.668	S	S	*	*			trans	-161.5	153.6	155.9	-128.5	-176.3	-175.6	0	0	111.7
1494	V	23.6	Very low	26.3	Very low	110 Å²	110	120.4 Å²	120.4	67%	0.667	66%	0.662	S	S	*	*			trans	-145.2	146.4	-173.5	-161.5	0	0	0	0	109.4	V1496	V1494-V1496 HydrophobicContact CG1-CG2 4.11Å
1495	P	30.6	Very low	26.3	Very low	119 Å²	119	123.5 Å²	123.5	77%	0.773	68%	0.681	S	S	*	*				-133.9	142.2	121	35.8	-25.5	0	0	0	111.2
1496	V	24.7	Very low	26.4	Very low	104 Å²	104	126.8 Å²	126.8	63%	0.63	70%	0.698	S	S	*	*			cis	72.1	103.2	42.6	-176.6	0	0	0	0	113.2	V1494	V1494-V1496 HydrophobicContact CG1-CG2 4.11Å
1497	N	27.9	Very low	26.3	Very low	129 Å²	129	126.7 Å²	126.7	69%	0.69	71%	0.705	S	S	*	*				-161.8	130.5	128.3	-92.4	-14.3	0	0	0	106.9
1498	Q	24.6	Very low	26.2	Very low	149 Å²	149	123.3 Å²	123.3	70%	0.696	70%	0.701	S	S	*	*				63.7	136.3	76.6	-62.2	175.6	10.6	0	0	110.9
1499	T	28.2	Very low	26.1	Very low	107 Å²	107	123.9 Å²	123.9	66%	0.656	70%	0.7	S	S	*	*			cis	-147.2	146.9	27.7	4.4	0	0	0	0	108.9
1500	E	24.8	Very low	26	Very low	155 Å²	155	125.2 Å²	125.2	72%	0.724	70%	0.703	S	S	*	*				57.7	146.6	97.1	-67.7	179.2	-143.1	0	0	115.7
1501	N	27.3	Very low	26.2	Very low	112 Å²	112	128.7 Å²	128.7	60%	0.599	72%	0.715	S	S	*	*			cis	-159.1	169.3	12.7	-130.4	-24.2	0	0	0	112.9
1502	N	27.2	Very low	26.1	Very low	139 Å²	139	131.2 Å²	131.2	74%	0.743	72%	0.722	S	S	*	*			trans	66.2	148	153.4	-66.8	-25.7	0	0	0	119.3
1503	S	26.1	Very low	26.2	Very low	101 Å²	101	130.3 Å²	130.3	71%	0.706	72%	0.722	S	S	*	*			cis	-164.9	176.2	-11.6	50.4	0	0	0	0	112.2
1504	S	26.2	Very low	26	Very low	100 Å²	100	127.9 Å²	127.9	70%	0.699	71%	0.712	S	S	*	*			trans	66.2	107.8	178.1	65.6	0	0	0	0	115.9
1505	T	24.5	Very low	26.1	Very low	116 Å²	116	129.9 Å²	129.9	71%	0.712	72%	0.719	S	S	*	*			cis	85.2	143.3	40.5	72.4	0	0	0	0	114.8
1506	N	26.8	Very low	25.7	Very low	149 Å²	149	129 Å²	129	80%	0.797	72%	0.716	S	S	*	*			trans	79	143.5	163.4	-60.5	-14.8	0	0	0	117.1
1507	S	25.1	Very low	25.7	Very low	90 Å²	90	131.7 Å²	131.7	63%	0.629	73%	0.725	S	S	*	*			cis	-171.2	154.3	-15.5	49.7	0	0	0	0	112.5
1508	L	23.7	Very low	25.5	Very low	134 Å²	134	130.6 Å²	130.6	70%	0.702	73%	0.727	S	S	*	*			trans	50.3	135.9	135.3	-65.6	167	0	0	0	122
1509	Q	26.1	Very low	26	Very low	152 Å²	152	128.5 Å²	128.5	71%	0.71	73%	0.727	S	S	*	*			trans	70.7	126.7	135.1	-71.9	166.7	-21	0	0	118.1
1510	N	23.3	Very low	25.8	Very low	142 Å²	142	133.8 Å²	133.8	76%	0.759	73%	0.734	S	S	*	*				46.3	101.1	84.7	-72.1	-1.2	0	0	0	113
1511	N	27.5	Very low	25.7	Very low	155 Å²	155	132.6 Å²	132.6	83%	0.829	73%	0.733	S	S	*	*				-159.6	164	98.7	-101.9	-35.1	0	0	0	113.7
1512	N	26.5	Very low	25.6	Very low	136 Å²	136	136.3 Å²	136.3	73%	0.727	74%	0.744	S	S	*	*			trans	-80.3	161.2	-169.5	-57.7	-68.9	0	0	0	113.8
1513	N	26.1	Very low	26.2	Very low	144 Å²	144	134.7 Å²	134.7	77%	0.77	74%	0.741	S	S	*	*			trans	86.1	126.3	141.4	-75.3	-7.8	0	0	0	121.9
1514	I	26.1	Very low	26.1	Very low	142 Å²	142	138.2 Å²	138.2	73%	0.728	74%	0.743	S	S	*	*			trans	92.4	127.5	149.6	-64.2	155.1	0	0	0	116.7
1515	N	24	Very low	26.1	Very low	153 Å²	153	141.2 Å²	141.2	82%	0.818	75%	0.747	S	S	*	*			trans	67.7	126.4	-175.7	-56.9	-27.9	0	0	0	114.2
1516	S	22.7	Very low	26.2	Very low	101 Å²	101	141.4 Å²	141.4	71%	0.706	75%	0.747	S	S	*	*			cis	-156.7	175.7	4.6	60.7	0	0	0	0	113
1517	I	25.2	Very low	26.1	Very low	159 Å²	159	140.3 Å²	140.3	82%	0.815	75%	0.746	S	S	*	*			trans	76.9	137.2	171.2	-55.9	174.7	0	0	0	115.7
1518	S	23.4	Very low	26.1	Very low	106 Å²	106	142.3 Å²	142.3	74%	0.741	75%	0.754	S	S	*	*			trans	-154.2	176.8	-170.8	-69	0	0	0	0	108.7
1519	P	34.5	Very low	26.1	Very low	106 Å²	106	140.2 Å²	140.2	69%	0.688	76%	0.757	S	S	*	*				-141.4	168.7	-58.9	43.3	-28.5	0	0	0	114.9
1520	R	24.2	Very low	26.1	Very low	217 Å²	217	137.2 Å²	137.2	82%	0.819	75%	0.746	S	S	*	*			trans	47.9	126.3	134.1	-74.7	180	168.3	-177.7	-3	124.1
1521	L	24.4	Very low	26.1	Very low	131 Å²	131	134.2 Å²	134.2	69%	0.686	73%	0.732	S	S	*	*				72.6	120.5	127.8	-56.3	166.7	0	0	0	121.9
1522	F	24.2	Very low	25.9	Very low	189 Å²	189	130.3 Å²	130.3	83%	0.829	71%	0.71	S	S	*	*				41	163.5	127.5	-72.5	-60.6	0	0	0	123.3
1523	P	39.2	Very low	26	Very low	106 Å²	106	130.8 Å²	130.8	69%	0.688	71%	0.712	S	S	*	*			cis	-140.2	-166.3	-20.2	37.1	-16.1	0	0	0	115.1
1524	K	25	Very low	25.9	Very low	174 Å²	174	126.7 Å²	126.7	76%	0.757	69%	0.693	S	S	*	*			trans	77.9	126.9	153.1	-81.3	-174	173.2	-172.9	0	122.1
1525	Q	26.2	Very low	25.8	Very low	164 Å²	164	124.2 Å²	124.2	77%	0.766	68%	0.677	S	S	*	*			trans	63.4	156.9	139.8	-66	-177.7	-60.5	0	0	118.2
1526	V	25.3	Very low	26.2	Very low	119 Å²	119	121.1 Å²	121.1	72%	0.721	67%	0.665	S	S	*	*			cis	-159.7	141.6	-21.4	127.8	0	0	0	0	104.8
1527	T	25.5	Very low	26.2	Very low	127 Å²	127	122.2 Å²	122.2	78%	0.779	67%	0.672	S	S	*	*				179.7	163	95.4	-43.7	0	0	0	0	110.2
1528	T	26.1	Very low	26.1	Very low	131 Å²	131	119.9 Å²	119.9	80%	0.804	67%	0.666	S	S	*	*			trans	-72.6	134	175.9	50.1	0	0	0	0	114.4
1529	A	23	Very low	26.2	Very low	91 Å²	91	123 Å²	123	75%	0.752	67%	0.671	S	S	*	*				-129.9	-179.4	116.9	0	0	0	0	0	108.8
1530	N	25	Very low	25.5	Very low	89 Å²	89	124.1 Å²	124.1	48%	0.476	68%	0.679	S	S	.	*			trans	-61.3	165.5	170.4	-51	-57.2	0	0	0	109.3	N786 M789	N786-N1530 HydrophobicContact CB-CB 4.47Å; M789-N1530 WeakPolarHBondContact CE-OD1 3.32Å; M789-N1530 HydrophobicContact CG-CB 4.19Å; M789-N1530 PolarHBondContact SD-ND2 3.36Å; M789-N1530 VanDerWaalsContact SD-ND2 3.42Å
1531	V	24.4	Very low	25.6	Very low	79 Å²	79	119.5 Å²	119.5	48%	0.479	68%	0.68	S	S	.	*				-167.3	-171.3	67	-78.8	0	0	0	0	113.5	E785 N786	E785-V1531 HydrophobicContact CB-CB 3.79Å; E785-V1531 HydrophobicContact CB-CG1 3.48Å; E785-V1531 VanDerWaalsContact CB-CG1 3.48Å; E785-V1531 HydrophobicContact CB-CG2 4.18Å; E785-V1531 WeakPolarHBondContact O-CB 3.37Å; E785-V1531 WeakPolarHBondContact OE2-CG1 3.42Å; N786-V1531 HydrophobicContact CB-CB 4.03Å; N786-V1531 HydrophobicContact CB-CG1 4.03Å; N786-V1531 WeakPolarHBondContact ND2-CA 3.41Å
1532	I	23.5	Very low	25.5	Very low	72 Å²	72	118.1 Å²	118.1	37%	0.369	68%	0.682	S	S	.	*			trans	-8.6	123.2	-165.7	-108.2	159.2	0	0	0	120.9	E785 N786 E787	E785-I1532 WeakPolarHBondContact O-CA 3.43Å; E785-I1532 WeakPolarHBondContact O-CB 3.43Å; E785-I1532 VanDerWaalsContact O-CD1 3.3Å; E785-I1532 WeakPolarHBondContact O-CD1 3.29Å; E785-I1532 WeakPolarHBondContact O-CG1 3.44Å; E785-I1532 PolarHBondContact O-N 2.88Å; N786-I1532 VanDerWaalsContact CG-N 3.34Å; N786-I1532 WeakPolarHBondContact OD1-CA 3.2Å; N786-I1532 PolarHBondContact OD1-N 3.4Å; E787-I1532 HydrophobicContact CG-CG1 4.06Å
1533	L	27.7	Very low	25.4	Very low	147 Å²	147	113.8 Å²	113.8	77%	0.77	68%	0.675	S	S	*	*				-178.8	153.8	112.7	-105.2	-177.9	0	0	0	113
1534	T	24.5	Very low	24.7	Very low	58 Å²	58	116 Å²	116	36%	0.356	68%	0.681	S	S	.	*			trans	-92	129.7	-173.3	16.7	0	0	0	0	116.2	E787	E787-T1534 HydrophobicContact CB-CG2 4.16Å; E787-T1534 VanDerWaalsContact CD-OG1 3.29Å; E787-T1534 HydrophobicContact CG-CG2 4.41Å; E787-T1534 WeakPolarHBondContact OE1-CB 3.07Å; E787-T1534 WeakPolarHBondContact OE1-CG2 3.38Å; E787-T1534 PolarHBondContact OE1-N 3.46Å; E787-T1534 PolarHBondContact OE1-OG1 3.19Å; E787-T1534 WeakPolarHBondContact OE2-CG2 3.34Å; E787-T1534 PolarHBondContact OE2-OG1 2.95Å
1535	K	23.5	Very low	24.7	Very low	89 Å²	89	112.3 Å²	112.3	39%	0.387	68%	0.677	S	S	.	*				48.9	157.7	125.1	-74.4	-124.4	171.3	178.5	0	122.4	E922 N926 N975	E922-K1535 HydrophobicContact CB-CB 4.46Å; N926-K1535 WeakPolarHBondContact ND2-CD 3.4Å; N926-K1535 WeakPolarHBondContact ND2-CE 3.45Å; N926-K1535 VanDerWaalsContact OD1-CE 3.23Å; N926-K1535 WeakPolarHBondContact OD1-CE 3.37Å; N926-K1535 PolarHBondContact OD1-NZ 3.38Å; N975-K1535 PolarHBondContact O-NZ 2.95Å
1536	P	32.2	Very low	24.7	Very low	88 Å²	88	108.3 Å²	108.3	57%	0.571	67%	0.672	S	S	*	*			trans	-125.8	170.7	-147.7	43.3	-30.3	0	0	0	116.1
1537	S	24.2	Very low	24.9	Very low	124 Å²	124	112 Å²	112	87%	0.867	68%	0.678	S	S	*	*			trans	-112.5	90.2	170.5	-63.2	0	0	0	0	112.7
1538	V	23	Very low	24.8	Very low	111 Å²	111	113.4 Å²	113.4	67%	0.673	68%	0.68	S	S	*	*			trans	12.7	111.9	132.4	-176.5	0	0	0	0	117
1539	M	24.7	Very low	24.7	Very low	172 Å²	172	111.3 Å²	111.3	85%	0.847	67%	0.67	S	S	*	*				-173.4	156.9	110.2	-98.5	-146	168.3	0	0	112.9
1540	C	20.7	Very low	24.8	Very low	128 Å²	128	117 Å²	117	87%	0.865	68%	0.678	S	S	*	*			trans	-118.6	134.8	165.3	-68.4	0	0	0	0	108.7
1541	S	25	Very low	24.9	Very low	120 Å²	120	118.1 Å²	118.1	84%	0.839	69%	0.688	S	S	*	*			trans	-151.3	139.2	149.8	40.8	0	0	0	0	110.9
1542	S	22.9	Very low	24.9	Very low	103 Å²	103	121.9 Å²	121.9	72%	0.72	70%	0.7	S	S	*	*			trans	-59.4	167.9	-176.5	49	0	0	0	0	116
1543	S	23	Very low	25	Very low	98 Å²	98	127.9 Å²	127.9	69%	0.685	72%	0.718	S	S	*	*			trans	67	138.3	153	43.6	0	0	0	0	117.5
1544	D	24.4	Very low	24.9	Very low	151 Å²	151	127.8 Å²	127.8	81%	0.807	71%	0.714	S	S	*	*			cis	-149.7	170	6.3	-131.5	-39.4	0	0	0	115.5
1545	S	23.8	Very low	25	Very low	97 Å²	97	132.7 Å²	132.7	68%	0.678	73%	0.731	S	S	*	*			trans	-16.3	161.9	174.3	73	0	0	0	0	122.5
1546	A	26.4	Very low	25	Very low	81 Å²	81	136 Å²	136	67%	0.669	75%	0.751	S	S	*	*			trans	73	128.3	160.1	0	0	0	0	0	117.6
1547	K	29.4	Very low	24.7	Very low	196 Å²	196	135.6 Å²	135.6	85%	0.852	75%	0.751	S	S	*	*			cis	-147.5	129.8	3.8	-109.4	149.1	-170.8	164	0	111.9
1548	I	23.5	Very low	24.8	Very low	157 Å²	157	136.4 Å²	136.4	81%	0.805	75%	0.745	S	S	*	*			trans	-65.9	144.9	152.8	-70.8	171.3	0	0	0	108.3
1549	S	23.2	Very low	25	Very low	87 Å²	87	138 Å²	138	61%	0.608	75%	0.75	S	S	*	*			trans	60.5	119.8	166.6	65.5	0	0	0	0	119.1
1550	K	26.7	Very low	25	Very low	209 Å²	209	134.3 Å²	134.3	91%	0.909	74%	0.742	S	S	*	*				-111.2	105.6	114.9	-81.6	-171.8	173.1	-177.4	0	106.9
1551	V	26.3	Very low	25.2	Very low	114 Å²	114	133.1 Å²	133.1	69%	0.691	74%	0.735	S	S	*	*				79.8	110.5	72	168.8	0	0	0	0	110.4
1552	Q	23.7	Very low	25.1	Very low	157 Å²	157	137.9 Å²	137.9	73%	0.734	73%	0.734	S	S	*	*	S	Bend	trans	-86.1	151	167.6	-173.8	-177.9	10.4	0	0	109.3
1553	R	27.1	Very low	25.4	Very low	199 Å²	199	142.4 Å²	142.4	75%	0.751	74%	0.744	S	S	*	*			trans	75	106.5	169.1	-99.2	173.1	-83.9	-152.7	-5	117.3
1554	Q	25.6	Very low	25.5	Very low	145 Å²	145	144.4 Å²	144.4	68%	0.678	75%	0.747	S	S	*	*			trans	-46.5	159.7	135.8	-54.5	132.4	-52	0	0	110
1555	F	25.2	Very low	25.7	Very low	161 Å²	161	146 Å²	146	71%	0.706	75%	0.752	S	S	*	*			cis	-159.3	152	45	-91.2	-85	0	0	0	112.4
1556	L	25	Very low	25.8	Very low	157 Å²	157	150.7 Å²	150.7	82%	0.822	76%	0.76	S	S	*	*			trans	62.3	146.7	149.1	-62.3	163.1	0	0	0	118.3
1557	S	25.5	Very low	25.9	Very low	80 Å²	80	152.4 Å²	152.4	56%	0.559	76%	0.758	S	S	*	*			cis	-170.5	164.4	-14.3	47.1	0	0	0	0	110.6
1558	N	26.5	Very low	25.9	Very low	141 Å²	141	150.4 Å²	150.4	75%	0.754	75%	0.746	S	S	*	*			trans	73.9	137.8	163.7	-58.1	-6.9	0	0	0	115.5
1559	N	26.2	Very low	26	Very low	144 Å²	144	146.3 Å²	146.3	77%	0.77	73%	0.725	S	S	*	*			cis	-133	152	8.5	-100	-25.7	0	0	0	114.7
1560	S	25.5	Very low	26.3	Very low	96 Å²	96	145.2 Å²	145.2	67%	0.671	72%	0.715	S	S	*	*			trans	-53.9	165.8	153.8	30.4	0	0	0	0	113.5
1561	S	24.8	Very low	26.3	Very low	103 Å²	103	140.5 Å²	140.5	72%	0.72	70%	0.699	S	S	*	*			cis	-169.6	161.6	-7	-101.9	0	0	0	0	110.8
1562	R	23.2	Very low	26.3	Very low	219 Å²	219	142.3 Å²	142.3	83%	0.826	70%	0.7	S	S	*	*			trans	43.4	120.7	148.4	-61.7	172.1	98.1	144.5	4.3	119.6
1563	E	28	Very low	26.4	Very low	198 Å²	198	140.1 Å²	140.1	93%	0.925	69%	0.694	S	S	*	*				-149.8	164.9	124.7	-121.6	165.6	-151.7	0	0	110.1
1564	N	24.8	Very low	26.4	Very low	140 Å²	140	138 Å²	138	75%	0.749	69%	0.69	S	S	*	*			trans	-117.4	151.3	-170.6	-52	-44.3	0	0	0	111.5
1565	M	30.3	Very low	26.2	Very low	186 Å²	186	140.7 Å²	140.7	92%	0.916	70%	0.7	S	S	*	*			trans	-170.1	170.6	139.7	-107.8	165.1	73.2	0	0	113.4
1566	F	25.3	Very low	26.1	Very low	194 Å²	194	138.1 Å²	138.1	85%	0.851	70%	0.697	S	S	*	*			trans	-81.8	-179.6	-177	-64.3	-105.2	0	0	0	111.7
1567	D	28.6	Very low	26	Very low	117 Å²	117	140.2 Å²	140.2	63%	0.626	70%	0.7	S	S	*	*			cis	-156.7	-179	14.3	-149.7	-4.3	0	0	0	114.1
1568	R	28.7	Very low	26	Very low	155 Å²	155	138.9 Å²	138.9	59%	0.585	70%	0.699	S	S	*	*			trans	-8	121.8	168.8	-71.1	156.2	-141.9	-114.9	4.9	124.1
1569	D	25.8	Very low	25.9	Very low	71 Å²	71	138.9 Å²	138.9	38%	0.38	70%	0.704	S	S	.	*				63.4	137.3	108.8	-64.8	-60.7	0	0	0	126.9	T1484 N1485 N1486	T1484-D1569 WeakPolarHBondContact CG2-O 3.47Å; N1485-D1569 HydrophobicContact CB-CB 3.65Å; N1485-D1569 VanDerWaalsContact CB-CG 3.41Å; N1485-D1569 WeakPolarHBondContact CB-OD2 3.43Å; N1485-D1569 VanDerWaalsContact ND2-CG 3.28Å; N1485-D1569 PolarHBondContact ND2-OD1 3.08Å; N1486-D1569 PolarHBondContact ND2-OD1 2.65Å; N1486-D1569 PolarHBondContact ND2-OD2 3.5Å
1570	V	29.4	Very low	25.7	Very low	63 Å²	63	136.3 Å²	136.3	38%	0.382	70%	0.697	S	S	.	*			trans	77.5	116.1	133.4	164.1	0	0	0	0	126.3	T1484 N1485	T1484-V1570 HydrophobicContact CG2-CB 3.93Å; T1484-V1570 HydrophobicContact CG2-CG1 4.17Å; N1485-V1570 HydrophobicContact CB-CG2 4.19Å; N1485-V1570 VanDerWaalsContact ND2-CG2 3.31Å; N1485-V1570 WeakPolarHBondContact ND2-CG2 3.18Å
1571	N	27.1	Very low	25.6	Very low	111 Å²	111	137.6 Å²	137.6	59%	0.594	70%	0.702	S	S	*	*			trans	31.1	130.8	143	-54.5	17.3	0	0	0	125.6	S1482	S1482-N1571 PolarHBondContact OG-O 3.22Å
1572	E	26.6	Very low	25.7	Very low	152 Å²	152	139.7 Å²	139.7	71%	0.71	70%	0.704	S	S	*	*			trans	57.4	140.8	134.1	-61.2	179.6	166.7	0	0	119.6	S1482	S1482-E1572 PolarHBondContact OG-O 3.36Å
1573	D	24.8	Very low	25.8	Very low	111 Å²	111	134.7 Å²	134.7	59%	0.594	70%	0.699	S	S	*	*			cis	-151.7	157.5	17.8	-161.6	14.8	0	0	0	113.8
1574	K	27.3	Very low	25.6	Very low	153 Å²	153	131.2 Å²	131.2	67%	0.665	69%	0.69	S	S	*	*			trans	28.1	123.6	162.9	-72.5	160.1	-162.2	75.2	0	122.8
1575	F	22.1	Very low	25.7	Very low	202 Å²	202	132.7 Å²	132.7	89%	0.886	69%	0.693	S	S	*	*				30.9	143.4	118.8	-66.9	-64.7	0	0	0	120.7
1576	V	23.4	Very low	25.5	Very low	107 Å²	107	128.1 Å²	128.1	65%	0.648	68%	0.679	S	S	*	*			cis	-164.5	160.5	21.3	84	0	0	0	0	113.5
1577	F	22.3	Very low	25.5	Very low	201 Å²	201	125.6 Å²	125.6	88%	0.882	68%	0.675	S	S	*	*			trans	55	146.9	164.8	-69.6	-54.1	0	0	0	120.9
1578	G	25.4	Very low	25.3	Very low	53 Å²	53	127.3 Å²	127.3	55%	0.546	68%	0.683	S	S	.	*			cis	168.4	-178.3	-5.8	0	0	0	0	0	114.4
1579	T	24.4	Very low	25.1	Very low	140 Å²	140	126.6 Å²	126.6	86%	0.859	69%	0.69	S	S	*	*			trans	59.7	145.8	161	53.5	0	0	0	0	120.3
1580	S	22.3	Very low	25.1	Very low	90 Å²	90	130.6 Å²	130.6	63%	0.629	71%	0.706	S	S	*	*			cis	-174.6	163.8	-18.6	51.1	0	0	0	0	110.7
1581	T	23.6	Very low	25	Very low	124 Å²	124	132.7 Å²	132.7	76%	0.761	72%	0.715	S	S	*	*			trans	69.4	157	170.1	78.4	0	0	0	0	115.3
1582	N	27.2	Very low	25.1	Very low	146 Å²	146	135.3 Å²	135.3	78%	0.781	72%	0.718	S	S	*	*			cis	-131.8	160.7	24.6	-96.7	-35.4	0	0	0	116.5
1583	T	24.2	Very low	25.1	Very low	115 Å²	115	136.8 Å²	136.8	71%	0.706	72%	0.718	S	S	*	*			trans	-64.9	157.9	-179.4	48.7	0	0	0	0	119.5
1584	V	24.3	Very low	25.2	Very low	124 Å²	124	138 Å²	138	75%	0.752	72%	0.72	S	S	*	*			trans	73.7	138.4	140.6	167.1	0	0	0	0	116
1585	Q	26.8	Very low	25.2	Very low	172 Å²	172	137.3 Å²	137.3	80%	0.804	72%	0.719	S	S	*	*			cis	-163.1	158.2	43.5	-150.1	156.7	-26.5	0	0	115.4
1586	S	25.7	Very low	25.6	Very low	89 Å²	89	134.8 Å²	134.8	62%	0.622	71%	0.71	S	S	*	*			trans	23.7	122.6	152.6	65.5	0	0	0	0	125.9
1587	N	26.1	Very low	25.8	Very low	142 Å²	142	136.9 Å²	136.9	76%	0.759	71%	0.712	S	S	*	*				47.9	119.4	119.9	-59.7	-2.9	0	0	0	124.4
1588	L	24.1	Very low	25.9	Very low	152 Å²	152	137.2 Å²	137.2	80%	0.796	71%	0.709	S	S	*	*				59.4	155.9	121.1	-64.8	161.1	0	0	0	120.4
1589	L	23.4	Very low	26.5	Very low	140 Å²	140	140 Å²	140	73%	0.733	72%	0.717	S	S	*	*			cis	-153.3	-173.7	20.1	-157	123.8	0	0	0	111.7
1590	Q	27.2	Very low	26.3	Very low	155 Å²	155	137.9 Å²	137.9	72%	0.724	71%	0.708	S	S	*	*			trans	86.2	138	170.7	-62.4	-171.2	9.8	0	0	116.1
1591	N	27.4	Very low	26.4	Very low	107 Å²	107	140.7 Å²	140.7	57%	0.572	72%	0.716	S	S	*	*			cis	-145.5	148.2	14.6	-114.3	-23.9	0	0	0	116.4
1592	Y	28	Very low	26.5	Very low	166 Å²	166	141.9 Å²	141.9	65%	0.651	72%	0.717	S	S	*	*			trans	62.9	121.6	153	-66.9	-57	0	0	0	126.1
1593	Y	26.8	Very low	26.4	Very low	183 Å²	183	139.6 Å²	139.6	72%	0.718	71%	0.713	S	S	*	*			trans	60.6	142.5	137.1	-63.6	-40.9	0	0	0	121.7
1594	H	27.3	Very low	26.3	Very low	136 Å²	136	141.4 Å²	141.4	63%	0.63	72%	0.718	S	S	*	*			cis	-168.4	138.2	-15.1	-130	-29.6	0	0	0	108.8
1595	H	28.2	Very low	26.3	Very low	139 Å²	139	141.2 Å²	141.2	64%	0.644	71%	0.713	S	S	*	*			trans	47.9	147.1	162.6	-60.5	-74.3	0	0	0	119.1
1596	H	28.9	Very low	26.3	Very low	150 Å²	150	143.4 Å²	143.4	69%	0.694	72%	0.715	S	S	*	*			cis	-164.4	168.9	-8.9	-107.5	-35.9	0	0	0	106
1597	H	28.1	Very low	26.1	Very low	151 Å²	151	144 Å²	144	70%	0.699	72%	0.72	S	S	*	*			cis	-140.5	-179.7	2.8	-154.6	-91	0	0	0	109.8
1598	Y	25.7	Very low	26.1	Very low	207 Å²	207	146.1 Å²	146.1	81%	0.812	72%	0.722	S	S	*	*			trans	-131.5	170.6	-178.4	-97.2	-117.3	0	0	0	110.4
1599	P	36.2	Very low	26.2	Very low	111 Å²	111	145.7 Å²	145.7	72%	0.721	72%	0.721	S	S	*	*			cis	-145.8	-164.7	-43.4	42.2	-24.9	0	0	0	112.7
1600	S	21.1	Very low	26.1	Very low	96 Å²	96	146 Å²	146	67%	0.671	72%	0.723	S	S	*	*			trans	-150.6	132.6	147.6	67.8	0	0	0	0	112.5
1601	N	25.1	Very low	26	Very low	149 Å²	149	143.9 Å²	143.9	80%	0.797	72%	0.721	S	S	*	*			trans	66.4	160	167.2	-55.9	-35.6	0	0	0	115.9
1602	L	25.3	Very low	25.7	Very low	149 Å²	149	149.5 Å²	149.5	78%	0.78	74%	0.735	S	S	*	*			cis	-148.6	158.4	10.9	-142.1	152.2	0	0	0	111.2
1603	S	23.8	Very low	25.6	Very low	98 Å²	98	145.2 Å²	145.2	69%	0.685	74%	0.735	S	S	*	*			trans	50.5	113	159	57.3	0	0	0	0	120.3
1604	N	23.6	Very low	25.4	Very low	153 Å²	153	147.2 Å²	147.2	82%	0.818	74%	0.743	S	S	*	*				-158.6	171.2	121.3	-135.5	-22.1	0	0	0	113.3
1605	N	24.7	Very low	25.2	Very low	120 Å²	120	143.7 Å²	143.7	64%	0.642	73%	0.733	S	S	*	*			trans	95.2	118	151.2	-68.3	-12.1	0	0	0	123.9
1606	Y	26.6	Very low	25.3	Very low	218 Å²	218	142.1 Å²	142.1	86%	0.855	72%	0.724	S	S	*	*				89.3	163.8	129	-83.9	-124.3	0	0	0	121.3
1607	S	20.9	Very low	25.2	Very low	102 Å²	102	137.9 Å²	137.9	71%	0.713	71%	0.707	S	S	*	*			trans	-142.4	175.9	-164.6	65.6	0	0	0	0	112.4
1608	K	26.7	Very low	25.2	Very low	186 Å²	186	134.6 Å²	134.6	81%	0.809	70%	0.697	S	S	*	*			trans	93.3	117.4	177.4	-58.8	-178.4	177.1	179.7	0	117.6
1609	N	24.5	Very low	25.2	Very low	143 Å²	143	132 Å²	132	77%	0.765	70%	0.697	S	S	*	*			trans	60.5	100.4	132.3	-56.5	11.2	0	0	0	121.7
1610	N	22.2	Very low	24.6	Very low	148 Å²	148	131.2 Å²	131.2	79%	0.791	69%	0.694	S	S	*	*				63	129.7	123.5	-71.2	7.8	0	0	0	124.4
1611	T	24.3	Very low	24.7	Very low	109 Å²	109	132.1 Å²	132.1	67%	0.669	70%	0.7	S	S	*	*			trans	80.2	107.8	138	49	0	0	0	0	123.4
1612	Y	22.8	Very low	24.7	Very low	225 Å²	225	128.9 Å²	128.9	88%	0.882	70%	0.695	S	S	*	*			trans	59.7	149.3	135.5	-61.9	-56.2	0	0	0	121.5
1613	A	24.7	Very low	24.7	Very low	77 Å²	77	126.7 Å²	126.7	64%	0.636	69%	0.692	S	S	*	*			cis	-170.4	149.3	-9.8	0	0	0	0	0	114.4
1614	Y	23.8	Very low	24.9	Very low	225 Å²	225	127.5 Å²	127.5	88%	0.882	69%	0.693	S	S	*	*			trans	60.7	148.1	155.1	-84.6	-105.7	0	0	0	120.5
1615	S	23	Very low	25	Very low	62 Å²	62	128.3 Å²	128.3	43%	0.434	69%	0.692	S	S	.	*			cis	-155.5	-154.8	42.8	59.3	0	0	0	0	115.6	L1361	L1361-S1615 WeakPolarHBondContact CA-OG 3.33Å; L1361-S1615 VanDerWaalsContact CD2-OG 3.25Å; L1361-S1615 WeakPolarHBondContact CD2-OG 3.45Å
1616	K	28.6	Very low	25	Very low	105 Å²	105	130.3 Å²	130.3	46%	0.457	70%	0.697	S	S	.	*			trans	-170.2	137.3	-152.5	175.1	-129.1	178.1	-139	0	117.1	L1361 Q1364	L1361-K1616 WeakPolarHBondContact CD2-O 3.04Å; Q1364-K1616 HydrophobicContact CG-CB 4.3Å; Q1364-K1616 HydrophobicContact CG-CG 3.57Å
1617	N	27.4	Very low	25.1	Very low	62 Å²	62	126.1 Å²	126.1	33%	0.332	69%	0.689	S	S	.	*			trans	148.9	160.4	151.4	-83.6	-13.1	0	0	0	120.9	Q1362	Q1362-N1617 VanDerWaalsContact CD-O 3.3Å; Q1362-N1617 VanDerWaalsContact CG-N 3.3Å; Q1362-N1617 WeakPolarHBondContact CG-O 3.22Å; Q1362-N1617 PolarHBondContact NE2-O 2.93Å
1618	T	27.6	Very low	25.5	Very low	81 Å²	81	128.7 Å²	128.7	50%	0.497	69%	0.689	S	S	.	*			trans	63.2	135.3	144.9	45.1	0	0	0	0	124.4	Q1362 H1363	Q1362-T1618 PolarHBondContact NE2-OG1 3.41Å; H1363-T1618 PolarHBondContact CE1-O 3.28Å
1619	L	25.9	Very low	25.5	Very low	153 Å²	153	124.3 Å²	124.3	80%	0.801	68%	0.682	S	S	*	*			cis	-169.4	161.8	-19.2	-147.5	70.7	0	0	0	115
1620	S	23.1	Very low	25.6	Very low	94 Å²	94	125.3 Å²	125.3	66%	0.657	68%	0.682	S	S	*	*			trans	85.1	132.2	140.2	55	0	0	0	0	126.2
1621	S	23.5	Very low	25.7	Very low	115 Å²	115	123.1 Å²	123.1	80%	0.804	68%	0.678	S	S	*	*			trans	68.8	149.5	144.1	49.9	0	0	0	0	123
1622	A	26.7	Very low	25.7	Very low	82 Å²	82	124.7 Å²	124.7	68%	0.678	68%	0.682	S	S	*	*			cis	-169.7	146.9	-24.3	0	0	0	0	0	113.9
1623	S	23.6	Very low	26.1	Very low	103 Å²	103	117.9 Å²	117.9	72%	0.72	67%	0.672	S	S	*	*			trans	68.5	166.6	130.2	64.1	0	0	0	0	125.2
1624	T	29.1	Very low	26.1	Very low	115 Å²	115	121 Å²	121	71%	0.706	68%	0.679	S	S	*	*			trans	77.7	143	171.3	72.8	0	0	0	0	116.4
1625	E	26.1	Very low	26.4	Very low	170 Å²	170	115.4 Å²	115.4	79%	0.794	67%	0.672	S	S	*	*			cis	-152.7	177.1	-12.4	-128.4	146.7	-136.5	0	0	114.3
1626	E	24.1	Very low	26.7	Very low	162 Å²	162	122.3 Å²	122.3	76%	0.757	69%	0.69	S	S	*	*			trans	-61.3	173.8	-170.5	-51.9	174	144.2	0	0	117.7
1627	L	29	Very low	26.7	Very low	130 Å²	130	124.5 Å²	124.5	68%	0.681	71%	0.707	S	S	*	*				178.1	144.5	103.8	-91.9	175	0	0	0	114.4
1628	H	29	Very low	26.6	Very low	156 Å²	156	129.3 Å²	129.3	72%	0.722	73%	0.73	S	S	*	*			trans	60.1	146.5	162.5	-58.3	-47.4	0	0	0	118.9
1629	S	27.7	Very low	26.4	Very low	93 Å²	93	129.9 Å²	129.9	65%	0.65	73%	0.728	S	S	*	*			cis	-155.4	138.7	-4.6	38.7	0	0	0	0	107.3
1630	Q	25.1	Very low	26.3	Very low	165 Å²	165	130.6 Å²	130.6	77%	0.771	72%	0.72	S	S	*	*				46.9	138.3	94	-60.1	168	-52.1	0	0	113.1
1631	S	24.9	Very low	26.3	Very low	101 Å²	101	129.5 Å²	129.5	71%	0.706	71%	0.706	S	S	*	*			cis	175.7	172.9	8.6	47.9	0	0	0	0	106.2
1632	D	25.2	Very low	26.4	Very low	142 Å²	142	132.9 Å²	132.9	76%	0.759	71%	0.709	S	S	*	*			cis	-162.3	-165.4	-0.5	-135	-48.6	0	0	0	110.5
1633	A	29.5	Very low	26.3	Very low	82 Å²	82	138.2 Å²	138.2	68%	0.678	72%	0.72	S	S	*	*			trans	85.1	68.8	150.5	0	0	0	0	0	119.8
1634	N	25.3	Very low	26.3	Very low	143 Å²	143	138.1 Å²	138.1	77%	0.765	71%	0.711	S	S	*	*				36.3	126.5	112.9	-55.7	-33.1	0	0	0	120.4
1635	S	29.2	Very low	26.2	Very low	107 Å²	107	139 Å²	139	75%	0.748	71%	0.712	S	S	*	*				-166.5	152.5	117.5	-83.4	0	0	0	0	113.1
1636	Y	30.2	Very low	26.1	Very low	207 Å²	207	135.8 Å²	135.8	81%	0.812	71%	0.708	S	S	*	*			trans	62.6	81.2	170.6	-64.8	-70.8	0	0	0	119.9
1637	N	29.1	Very low	26.2	Very low	151 Å²	151	131 Å²	131	81%	0.807	69%	0.692	S	S	*	*				50.7	126.1	118.7	-61.6	-5.3	0	0	0	121.5
1638	M	24.5	Very low	26.1	Very low	164 Å²	164	133.9 Å²	133.9	81%	0.808	70%	0.695	S	S	*	*			trans	-74.2	179.2	158.3	-155.8	-150.1	-58.7	0	0	111.5
1639	M	23.4	Very low	25.8	Very low	92 Å²	92	128.5 Å²	128.5	45%	0.453	68%	0.675	S	S	.	*			trans	84.5	142.1	155.9	-82.8	-163.6	-76.5	0	0	117.9	S1649	M1639-S1649 VanDerWaalsContact SD-CB 3.56Å
1640	R	23.3	Very low	25.7	Very low	168 Å²	168	131.7 Å²	131.7	63%	0.634	68%	0.684	S	S	*	*			cis	-175.2	-177.2	-9.9	-155.1	-171.1	-158.2	178.6	6	109.5
1641	I	24.8	Very low	25.6	Very low	71 Å²	71	126.9 Å²	126.9	36%	0.364	67%	0.673	S	S	.	*			trans	74.5	136	164.3	-43	130.8	0	0	0	107.7
1642	E	24.7	Very low	25.5	Very low	186 Å²	186	129.1 Å²	129.1	87%	0.869	68%	0.677	S	S	*	*	S	Bend		55.2	162.9	55.7	-62.3	173.2	142.6	0	0	110.6
1643	E	23.9	Very low	25.6	Very low	195 Å²	195	129.7 Å²	129.7	91%	0.911	68%	0.68	S	S	*	*	S	Bend	trans	-81.5	130.1	164.2	-76.8	-175.2	145.6	0	0	108.4	N1645	E1643-N1645 PolarHBondContact O-N 3.09Å; E1643-N1645 VanDerWaalsContact O-N 3.11Å
1644	D	23.9	Very low	25.5	Very low	101 Å²	101	131.5 Å²	131.5	54%	0.54	68%	0.683	S	S	.	*			trans	-62.2	114.1	-179.3	-106.7	-38.2	0	0	0	110.4	S1647	D1644-S1647 PolarHBondContact OD1-N 3.21Å
1645	N	26.4	Very low	25.6	Very low	134 Å²	134	132.1 Å²	132.1	72%	0.717	69%	0.686	S	S	*	*	S	Bend		-104.9	105.6	127	-96.9	-56.7	0	0	0	106.4	E1643	E1643-N1645 PolarHBondContact O-N 3.09Å; E1643-N1645 VanDerWaalsContact O-N 3.11Å
1646	S	26	Very low	25.4	Very low	102 Å²	102	134.9 Å²	134.9	71%	0.713	69%	0.691	S	S	*	*	S	Bend	trans	60.3	73.9	166.8	63.3	0	0	0	0	117
1647	S	26	Very low	25.1	Very low	61 Å²	61	130.7 Å²	130.7	43%	0.427	69%	0.687	S	S	.	*				62	148.4	102	72.1	0	0	0	0	119.5	D1644	D1644-S1647 PolarHBondContact OD1-N 3.21Å
1648	Y	25.7	Very low	24.9	Very low	191 Å²	191	129.4 Å²	129.4	75%	0.749	68%	0.684	S	S	*	*			trans	77.1	92.8	166.3	-64.9	-71.1	0	0	0	118.1
1649	S	22.5	Very low	25	Very low	42 Å²	42	128.1 Å²	128.1	29%	0.294	69%	0.686	S	S	.	*				-40.3	132.4	120.3	51.6	0	0	0	0	114.4	M1639	M1639-S1649 VanDerWaalsContact SD-CB 3.56Å
1650	L	25.2	Very low	25.2	Very low	161 Å²	161	128.4 Å²	128.4	84%	0.843	70%	0.703	S	S	*	*				-171.3	105.2	120.4	-119.9	67.8	0	0	0	105.9
1651	A	23.9	Very low	25.5	Very low	64 Å²	64	124 Å²	124	53%	0.529	70%	0.703	S	S	.	*				75.3	116.6	56.3	0	0	0	0	0	113.4
1652	N	23.7	Very low	25.7	Very low	148 Å²	148	127.3 Å²	127.3	79%	0.791	72%	0.721	S	S	*	*			trans	56.6	114.8	159.6	-54.4	-5	0	0	0	118.4
1653	N	27.3	Very low	25.9	Very low	153 Å²	153	124.4 Å²	124.4	82%	0.818	72%	0.716	S	S	*	*				-160.3	152.7	99.2	-103.7	-15.7	0	0	0	115.6
1654	T	27	Very low	25.9	Very low	121 Å²	121	120 Å²	120	74%	0.742	71%	0.707	S	S	*	*			trans	-14.2	142.2	161.8	52.9	0	0	0	0	119.5
1655	N	26.4	Very low	26.2	Very low	155 Å²	155	119.5 Å²	119.5	83%	0.829	72%	0.717	S	S	*	*			trans	-53.6	142.1	154.9	-57.2	-35.2	0	0	0	111
1656	I	25.6	Very low	26.3	Very low	166 Å²	166	120.7 Å²	120.7	85%	0.851	72%	0.718	S	S	*	*				-154.8	138.9	123.6	-105.4	158	0	0	0	109.7
1657	T	23.8	Very low	26.4	Very low	119 Å²	119	121.6 Å²	121.6	73%	0.73	72%	0.715	S	S	*	*			trans	-74.4	157.6	-179.9	44.3	0	0	0	0	112.6
1658	T	24.8	Very low	26.7	Very low	124 Å²	124	124.7 Å²	124.7	76%	0.761	73%	0.726	S	S	*	*				-169	142.2	123.5	12.2	0	0	0	0	111.9
1659	T	26.7	Very low	26.8	Very low	137 Å²	137	121.9 Å²	121.9	84%	0.84	72%	0.724	S	S	*	*			trans	52.7	128.9	159.4	55.5	0	0	0	0	118.9
1660	A	27.4	Very low	27.1	Very low	98 Å²	98	126.8 Å²	126.8	81%	0.81	75%	0.747	S	S	*	*			cis	-160.5	-165.2	-3.8	0	0	0	0	0	107.1
1661	A	30.7	Very low	27.5	Very low	76 Å²	76	126 Å²	126	63%	0.628	74%	0.744	S	S	*	*			cis	-157.6	178.7	5.7	0	0	0	0	0	110.9
1662	D	28	Very low	27.8	Very low	139 Å²	139	130.4 Å²	130.4	74%	0.743	76%	0.759	S	S	*	*			trans	33.2	106	136.4	-58.2	3.2	0	0	0	118.8
1663	T	28.9	Very low	28.2	Very low	125 Å²	125	130.7 Å²	130.7	77%	0.767	76%	0.76	S	S	*	*				67.1	139.4	78.2	63.1	0	0	0	0	115.1
1664	S	24.8	Very low	28.4	Very low	104 Å²	104	131.3 Å²	131.3	73%	0.727	76%	0.764	S	S	*	*			cis	-175.1	169	-5	46.4	0	0	0	0	110.2
1665	A	28.5	Very low	28.6	Very low	90 Å²	90	132 Å²	132	74%	0.744	76%	0.763	S	S	*	*			trans	70.5	156.8	164	0	0	0	0	0	115.8
1666	E	28.6	Very low	28.8	Very low	159 Å²	159	131.9 Å²	131.9	74%	0.743	76%	0.762	S	S	*	*			cis	-155.8	157.2	-2.7	-139.1	179.6	-131	0	0	112.7
1667	N	30	Very low	28.9	Very low	120 Å²	120	131.3 Å²	131.3	64%	0.642	76%	0.761	S	S	*	*			trans	62.6	130.9	147.7	-80.4	-36.5	0	0	0	124.8
1668	N	31.3	Very low	29.2	Very low	126 Å²	126	132.8 Å²	132.8	67%	0.674	76%	0.764	S	S	*	*			trans	81.6	88.2	144.6	-66	-31.8	0	0	0	123.3
1669	N	28.6	Very low	29.6	Very low	132 Å²	132	135.3 Å²	135.3	71%	0.706	77%	0.768	S	S	*	*				56	102.1	112.4	-59	-11.1	0	0	0	120.7
1670	N	28.1	Very low	30.2	Very low	145 Å²	145	137 Å²	137	78%	0.775	77%	0.766	S	S	*	*				176.5	134.2	93.9	-90.4	-25.4	0	0	0	113.1
1671	N	32.6	Very low	30.8	Very low	145 Å²	145	135.6 Å²	135.6	78%	0.775	75%	0.748	S	S	*	*			trans	152.6	110.6	135.6	-78	-14	0	0	0	113.3
1672	D	31.8	Very low	31.5	Very low	156 Å²	156	140.1 Å²	140.1	83%	0.834	75%	0.754	S	S	*	*			trans	33.4	92.6	138.2	-58.2	-6.2	0	0	0	119.7
1673	N	30.7	Very low	32.5	Very low	154 Å²	154	140.6 Å²	140.6	82%	0.824	75%	0.752	S	S	*	*			trans	-92.4	102.4	158.3	-105.9	-55.3	0	0	0	110.3
1674	N	33.2	Very low	33.6	Very low	166 Å²	166	138.2 Å²	138.2	89%	0.888	73%	0.734	S	S	*	*			trans	-122.5	98.5	175.2	-142.1	-16	0	0	0	109.5
1675	N	30.7	Very low	35.5	Very low	136 Å²	136	140.8 Å²	140.8	73%	0.727	73%	0.732	S	S	*	*			trans	-127.7	93.8	-160.8	-140.5	-13.7	0	0	0	111.6
1676	N	29.2	Very low	37.5	Very low	153 Å²	153	139.9 Å²	139.9	82%	0.818	72%	0.72	S	S	*	*			trans	-169.4	163.6	154.5	-102.3	-40.2	0	0	0	111.3
1677	N	28.6	Very low	39.5	Very low	153 Å²	153	135.2 Å²	135.2	82%	0.818	70%	0.698	S	S	*	*			trans	67.4	80.6	178.4	-60.3	-21.6	0	0	0	116.9
1678	N	31	Very low	41.5	Very low	151 Å²	151	130.9 Å²	130.9	81%	0.807	68%	0.677	S	S	*	*			trans	-151.9	64.4	158.1	-124	-32.2	0	0	0	113.3
1679	Q	33.1	Very low	43.6	Very low	177 Å²	177	127.7 Å²	127.7	83%	0.827	67%	0.667	S	S	*	*			trans	-106.4	-16.4	-177	-121	173.2	-5.6	0	0	115.2
1680	Q	38.6	Very low	46.3	Very low	171 Å²	171	126.5 Å²	126.5	80%	0.799	65%	0.653	S	S	*	*	H	α-helix	trans	-67.3	-21.8	179.7	-72.8	-171.5	-19	0	0	117.7	K1682	Q1680-K1682 VanDerWaalsContact C-N 3.27Å; Q1680-K1682 PolarHBondContact O-N 3.36Å
1681	P	39.2	Very low	48.8	Very low	69 Å²	69	119.7 Å²	119.7	45%	0.448	62%	0.617	S	S	.	*	H	α-helix	trans	-78.7	0.1	-176.2	31.1	-34.9	0	0	0	114.9	F1685	P1681-F1685 WeakPolarHBondContact O-CD2 3.43Å
1682	K	47	Very low	51.1	Low	171 Å²	171	119.8 Å²	119.8	74%	0.743	61%	0.606	S	S	*	*	H	α-helix	trans	-92.8	-48.1	179.9	-70.4	-173	176.7	-178.9	0	113.4	Q1680 L1684 F1685 S1686	Q1680-K1682 VanDerWaalsContact C-N 3.27Å; Q1680-K1682 PolarHBondContact O-N 3.36Å; K1682-L1684 VanDerWaalsContact C-N 3.34Å; K1682-L1684 PolarHBondContact O-N 3.43Å; K1682-F1685 PolarHBondContact O-N 3.09Å; K1682-S1686 PolarHBondContact O-N 2.87Å; K1682-S1686 PolarHBondContact O-OG 2.89Å
1683	E	48.9	Very low	53.6	Low	150 Å²	150	117.8 Å²	117.8	70%	0.701	59%	0.588	S	S	*	*	H	α-helix	trans	-62.2	-39.8	-176.2	-63.9	-177.2	146.9	0	0	112.7	F1685 S1686 E1687	E1683-F1685 VanDerWaalsContact C-N 3.29Å; E1683-F1685 PolarHBondContact O-N 2.94Å; E1683-S1686 VanDerWaalsContact CA-OG 3.31Å; E1683-S1686 WeakPolarHBondContact CA-OG 3.43Å; E1683-S1686 PolarHBondContact O-N 3.31Å; E1683-S1686 PolarHBondContact O-OG 3.4Å; E1683-E1687 PolarHBondContact O-N 3.41Å
1684	L	51.8	Low	55.9	Low	74 Å²	74	113 Å²	113	39%	0.387	56%	0.561	S	S	.	*	H	α-helix	trans	-63.7	-34.3	179.5	-156.9	75.1	0	0	0	112.4	K1682 V1688 P1849	K1682-L1684 VanDerWaalsContact C-N 3.34Å; K1682-L1684 PolarHBondContact O-N 3.43Å; L1684-V1688 WeakPolarHBondContact O-CB 3.49Å; L1684-V1688 VanDerWaalsContact O-CG2 3.28Å; L1684-V1688 WeakPolarHBondContact O-CG2 3.48Å; L1684-V1688 PolarHBondContact O-N 3.04Å; L1684-P1849 HydrophobicContact CD2-CG 4.21Å
1685	F	65.3	Low	58.3	Low	159 Å²	159	106.8 Å²	106.8	70%	0.697	53%	0.527	S	S	*	.	H	α-helix	trans	-73.5	-37	175	-85.7	-103.2	0	0	0	111.8	P1681 K1682 E1683 A1689	P1681-F1685 WeakPolarHBondContact O-CD2 3.43Å; K1682-F1685 PolarHBondContact O-N 3.09Å; E1683-F1685 VanDerWaalsContact C-N 3.29Å; E1683-F1685 PolarHBondContact O-N 2.94Å; F1685-A1689 VanDerWaalsContact O-CB 3.31Å; F1685-A1689 WeakPolarHBondContact O-CB 3.31Å; F1685-A1689 PolarHBondContact O-N 3.38Å
1686	S	70.5	Confident	60.7	Low	70 Å²	70	105.8 Å²	105.8	49%	0.49	52%	0.521	S	S	.	.	H	α-helix	trans	-66.3	-41.9	174.7	42.5	0	0	0	0	113.3	K1682 E1683 A1689 R1690	K1682-S1686 PolarHBondContact O-N 2.87Å; K1682-S1686 PolarHBondContact O-OG 2.89Å; E1683-S1686 VanDerWaalsContact CA-OG 3.31Å; E1683-S1686 WeakPolarHBondContact CA-OG 3.43Å; E1683-S1686 PolarHBondContact O-N 3.31Å; E1683-S1686 PolarHBondContact O-OG 3.4Å; S1686-A1689 PolarHBondContact O-N 3.31Å; S1686-R1690 WeakPolarHBondContact O-CB 3.35Å; S1686-R1690 PolarHBondContact O-N 3.09Å
1687	E	69.2	Low	63	Low	61 Å²	61	101.4 Å²	101.4	29%	0.285	50%	0.497	S	S	.	.	H	α-helix	trans	-69.6	-37.4	177.7	-176.9	68.4	-178.9	0	0	111.2	E1683 A1689 R1690 L1691 R1843	E1683-E1687 PolarHBondContact O-N 3.41Å; E1687-A1689 VanDerWaalsContact C-N 3.35Å; E1687-A1689 PolarHBondContact O-N 2.61Å; E1687-R1690 PolarHBondContact O-N 2.93Å; E1687-R1690 IonicContact OE1-NH1 2.67Å; E1687-R1690 WeakPolarHBondContact OE2-CD 3.37Å; E1687-R1690 IonicContact OE2-CZ 2.69Å; E1687-R1690 IonicContact OE2-NE 3.6Å; E1687-R1690 IonicContact OE2-NH1 3.25Å; E1687-R1690 PolarHBondContact OE2-NH1 2.99Å; E1687-L1691 HydrophobicContact CG-CD1 4.07Å; E1687-L1691 HydrophobicContact CG-CG 4.45Å; E1687-L1691 WeakPolarHBondContact O-CB 3.35Å; E1687-L1691 VanDerWaalsContact O-CG 3.27Å; E1687-L1691 WeakPolarHBondContact O-CG 3.35Å; E1687-L1691 PolarHBondContact O-N 2.88Å; E1687-R1843 IonicContact OE1-NH2 3.08Å; E1687-R1843 PolarHBondContact OE1-NH2 3.06Å
1688	V	72.7	Confident	65.5	Low	30 Å²	30	94.5 Å²	94.5	18%	0.182	46%	0.461	C	S	.	.	H	α-helix	trans	-65.7	-35.3	172.5	170.4	0	0	0	0	112.1	L1684 R1692 A1847	L1684-V1688 WeakPolarHBondContact O-CB 3.49Å; L1684-V1688 VanDerWaalsContact O-CG2 3.28Å; L1684-V1688 WeakPolarHBondContact O-CG2 3.48Å; L1684-V1688 PolarHBondContact O-N 3.04Å; V1688-R1692 WeakPolarHBondContact O-CD 3.49Å; V1688-R1692 VanDerWaalsContact O-CG 3.26Å; V1688-R1692 WeakPolarHBondContact O-CG 3.45Å; V1688-R1692 PolarHBondContact O-N 3.28Å; V1688-A1847 HydrophobicContact CG2-CB 3.73Å
1689	A	75.5	Confident	67.6	Low	58 Å²	58	94.8 Å²	94.8	48%	0.479	45%	0.451	S	S	.	.	H	α-helix	trans	-68.3	-44.7	173.9	0	0	0	0	0	111.8	F1685 S1686 E1687 R1692 Y1693	F1685-A1689 VanDerWaalsContact O-CB 3.31Å; F1685-A1689 WeakPolarHBondContact O-CB 3.31Å; F1685-A1689 PolarHBondContact O-N 3.38Å; S1686-A1689 PolarHBondContact O-N 3.31Å; E1687-A1689 VanDerWaalsContact C-N 3.35Å; E1687-A1689 PolarHBondContact O-N 2.61Å; A1689-R1692 WeakPolarHBondContact O-CB 3.42Å; A1689-R1692 PolarHBondContact O-N 2.78Å; A1689-Y1693 PolarHBondContact O-N 3.43Å; A1689-Y1693 VanDerWaalsContact O-N 3.11Å
1690	R	84.9	Confident	69.9	Low	107 Å²	107	91.4 Å²	91.4	40%	0.404	44%	0.435	S	S	.	.	H	α-helix	trans	-59.2	-50.7	175.6	178	-166.3	154.2	-168.9	3.4	112	S1686 E1687 R1692 Y1693 E1694	S1686-R1690 WeakPolarHBondContact O-CB 3.35Å; S1686-R1690 PolarHBondContact O-N 3.09Å; E1687-R1690 PolarHBondContact O-N 2.93Å; E1687-R1690 IonicContact OE1-NH1 2.67Å; E1687-R1690 WeakPolarHBondContact OE2-CD 3.37Å; E1687-R1690 IonicContact OE2-CZ 2.69Å; E1687-R1690 IonicContact OE2-NE 3.6Å; E1687-R1690 IonicContact OE2-NH1 3.25Å; E1687-R1690 PolarHBondContact OE2-NH1 2.99Å; R1690-R1692 PolarHBondContact O-N 3.13Å; R1690-Y1693 WeakPolarHBondContact O-CA 3.12Å; R1690-Y1693 WeakPolarHBondContact O-CB 3.49Å; R1690-Y1693 PolarHBondContact O-N 3.28Å; R1690-E1694 IonicContact CZ-OE1 3.79Å; R1690-E1694 VanDerWaalsContact CZ-OE1 3.28Å; R1690-E1694 IonicContact NE-OE1 3.63Å; R1690-E1694 PolarHBondContact NE-OE1 2.88Å; R1690-E1694 IonicContact NH2-OE1 2.68Å; R1690-E1694 PolarHBondContact NH2-OE1 3.11Å; R1690-E1694 PolarHBondContact O-N 2.78Å
1691	L	81.3	Confident	71.7	Confident	3 Å²	3	85.8 Å²	85.8	2%	0.016	41%	0.41	C	S	.	.	H	α-helix	trans	-62.1	-30.4	179	-69.7	168.1	0	0	0	112.2	E1687 L1695 I1840 R1843 I1844	E1687-L1691 HydrophobicContact CG-CD1 4.07Å; E1687-L1691 HydrophobicContact CG-CG 4.45Å; E1687-L1691 WeakPolarHBondContact O-CB 3.35Å; E1687-L1691 VanDerWaalsContact O-CG 3.27Å; E1687-L1691 WeakPolarHBondContact O-CG 3.35Å; E1687-L1691 PolarHBondContact O-N 2.88Å; L1691-L1695 WeakPolarHBondContact O-CB 3.48Å; L1691-L1695 PolarHBondContact O-N 3.11Å; L1691-L1695 VanDerWaalsContact O-N 3.08Å; L1691-I1840 HydrophobicContact CB-CG2 4.38Å; L1691-I1840 HydrophobicContact CD2-CG2 4.41Å; L1691-I1840 WeakPolarHBondContact O-CG2 3.42Å; L1691-R1843 HydrophobicContact CD1-CB 3.93Å; L1691-R1843 HydrophobicContact CD2-CB 4.08Å; L1691-I1844 HydrophobicContact CB-CD1 4.16Å; L1691-I1844 HydrophobicContact CB-CG1 3.56Å; L1691-I1844 HydrophobicContact CD1-CG1 4.35Å
1692	R	80	Confident	73.2	Confident	146 Å²	146	83 Å²	83	55%	0.551	39%	0.393	S	S	*	.	H	α-helix	trans	-67.9	-36	171.4	-77.4	170.1	167.3	-160	-5.7	112.9	V1688 A1689 R1690 L1696 I1844	V1688-R1692 WeakPolarHBondContact O-CD 3.49Å; V1688-R1692 VanDerWaalsContact O-CG 3.26Å; V1688-R1692 WeakPolarHBondContact O-CG 3.45Å; V1688-R1692 PolarHBondContact O-N 3.28Å; A1689-R1692 WeakPolarHBondContact O-CB 3.42Å; A1689-R1692 PolarHBondContact O-N 2.78Å; R1690-R1692 PolarHBondContact O-N 3.13Å; R1692-L1696 PolarHBondContact O-N 3.16Å; R1692-I1844 HydrophobicContact CG-CD1 4.16Å
1693	Y	83.5	Confident	74.5	Confident	114 Å²	114	78.7 Å²	78.7	45%	0.447	38%	0.378	S	S	.	.	H	α-helix	trans	-69.7	-45.7	174.7	-178.3	-93.5	0	0	0	111.6	A1689 R1690 L1695 L1696 L1697	A1689-Y1693 PolarHBondContact O-N 3.43Å; A1689-Y1693 VanDerWaalsContact O-N 3.11Å; R1690-Y1693 WeakPolarHBondContact O-CA 3.12Å; R1690-Y1693 WeakPolarHBondContact O-CB 3.49Å; R1690-Y1693 PolarHBondContact O-N 3.28Å; Y1693-L1695 VanDerWaalsContact C-N 3.26Å; Y1693-L1695 PolarHBondContact O-N 3.08Å; Y1693-L1696 WeakPolarHBondContact O-CA 3.47Å; Y1693-L1696 WeakPolarHBondContact O-CB 3.3Å; Y1693-L1696 PolarHBondContact O-N 3.44Å; Y1693-L1697 HydrophobicContact CD1-CD1 4.28Å; Y1693-L1697 HydrophobicContact CE1-CD1 3.69Å; Y1693-L1697 HydrophobicContact CE1-CD2 4.03Å; Y1693-L1697 HydrophobicContact CE1-CG 4.5Å; Y1693-L1697 HydrophobicContact CE2-CD1 4.03Å; Y1693-L1697 PolarHBondContact O-N 3.22Å
1694	E	80.6	Confident	75.9	Confident	55 Å²	55	78.1 Å²	78.1	26%	0.257	37%	0.369	S	S	.	.	H	α-helix	trans	-56.2	-39.9	173.8	-68.7	178.4	-176.2	0	0	111.6	R1690 L1696 S1698 I1840	R1690-E1694 IonicContact CZ-OE1 3.79Å; R1690-E1694 VanDerWaalsContact CZ-OE1 3.28Å; R1690-E1694 IonicContact NE-OE1 3.63Å; R1690-E1694 PolarHBondContact NE-OE1 2.88Å; R1690-E1694 IonicContact NH2-OE1 2.68Å; R1690-E1694 PolarHBondContact NH2-OE1 3.11Å; R1690-E1694 PolarHBondContact O-N 2.78Å; E1694-L1696 VanDerWaalsContact C-N 3.32Å; E1694-L1696 PolarHBondContact O-N 3.37Å; E1694-S1698 WeakPolarHBondContact O-CB 3.22Å; E1694-S1698 PolarHBondContact O-N 3.44Å; E1694-S1698 VanDerWaalsContact O-N 3.12Å; E1694-I1840 HydrophobicContact CB-CD1 4.19Å; E1694-I1840 HydrophobicContact CB-CG2 4.45Å
1695	L	83.4	Confident	76.7	Confident	35 Å²	35	74.6 Å²	74.6	18%	0.183	35%	0.351	C	S	.	.	H	α-helix	trans	-67.3	-29.4	174.9	-176.4	60	0	0	0	113.5	L1691 Y1693 R1699 Q1837 I1840 R1841 I1844	L1691-L1695 WeakPolarHBondContact O-CB 3.48Å; L1691-L1695 PolarHBondContact O-N 3.11Å; L1691-L1695 VanDerWaalsContact O-N 3.08Å; Y1693-L1695 VanDerWaalsContact C-N 3.26Å; Y1693-L1695 PolarHBondContact O-N 3.08Å; L1695-R1699 WeakPolarHBondContact O-CB 3.35Å; L1695-R1699 PolarHBondContact O-N 3.26Å; L1695-R1699 VanDerWaalsContact O-N 3.15Å; L1695-Q1837 HydrophobicContact CD1-CB 3.91Å; L1695-Q1837 HydrophobicContact CD1-CG 4.06Å; L1695-I1840 HydrophobicContact CB-CG2 3.8Å; L1695-I1840 HydrophobicContact CD1-CB 4.4Å; L1695-R1841 HydrophobicContact CD1-CG 3.95Å; L1695-R1841 HydrophobicContact CD2-CG 3.72Å; L1695-I1844 HydrophobicContact CD2-CD1 3.97Å
1696	L	80.4	Confident	76.9	Confident	114 Å²	114	68.5 Å²	68.5	60%	0.597	33%	0.33	S	S	*	.	H	α-helix	trans	-75.5	-45.7	-179.9	-116.8	159.5	0	0	0	111.3	R1692 Y1693 E1694 R1699 Q1700	R1692-L1696 PolarHBondContact O-N 3.16Å; Y1693-L1696 WeakPolarHBondContact O-CA 3.47Å; Y1693-L1696 WeakPolarHBondContact O-CB 3.3Å; Y1693-L1696 PolarHBondContact O-N 3.44Å; E1694-L1696 VanDerWaalsContact C-N 3.32Å; E1694-L1696 PolarHBondContact O-N 3.37Å; L1696-R1699 PolarHBondContact O-N 3.32Å; L1696-Q1700 PolarHBondContact O-N 3.15Å; L1696-Q1700 VanDerWaalsContact O-N 3.09Å
1697	L	78.7	Confident	77.1	Confident	61 Å²	61	70.2 Å²	70.2	32%	0.319	33%	0.334	S	S	.	.	H	α-helix	trans	-57.4	-53	171.1	-100.3	62.1	0	0	0	111	Y1693 R1699 Q1700 D1701	Y1693-L1697 HydrophobicContact CD1-CD1 4.28Å; Y1693-L1697 HydrophobicContact CE1-CD1 3.69Å; Y1693-L1697 HydrophobicContact CE1-CD2 4.03Å; Y1693-L1697 HydrophobicContact CE1-CG 4.5Å; Y1693-L1697 HydrophobicContact CE2-CD1 4.03Å; Y1693-L1697 PolarHBondContact O-N 3.22Å; L1697-R1699 PolarHBondContact O-N 3.4Å; L1697-R1699 VanDerWaalsContact O-N 3.1Å; L1697-Q1700 WeakPolarHBondContact O-CA 3.39Å; L1697-Q1700 WeakPolarHBondContact O-CB 3.46Å; L1697-Q1700 PolarHBondContact O-N 2.97Å; L1697-D1701 VanDerWaalsContact O-CG 3.32Å; L1697-D1701 PolarHBondContact O-N 3.28Å
1698	S	79.3	Confident	77.4	Confident	9 Å²	9	73.6 Å²	73.6	6%	0.063	34%	0.344	C	S	.	.	H	α-helix	trans	-61.5	-23.2	-179.8	-179.2	0	0	0	0	113.7	E1694 A1702 Q1837	E1694-S1698 WeakPolarHBondContact O-CB 3.22Å; E1694-S1698 PolarHBondContact O-N 3.44Å; E1694-S1698 VanDerWaalsContact O-N 3.12Å; S1698-A1702 PolarHBondContact O-N 3.22Å; S1698-Q1837 PolarHBondContact O-NE2 2.98Å; S1698-Q1837 VanDerWaalsContact OG-CG 3.32Å; S1698-Q1837 WeakPolarHBondContact OG-CG 3.48Å
1699	R	76.9	Confident	77.5	Confident	156 Å²	156	72.8 Å²	72.8	59%	0.589	34%	0.339	S	S	*	.	H	α-helix	trans	-74.4	-43.3	168.9	179.7	176.6	174.2	166	-1.2	112.2	L1695 L1696 L1697 D1701 A1702 L1703	L1695-R1699 WeakPolarHBondContact O-CB 3.35Å; L1695-R1699 PolarHBondContact O-N 3.26Å; L1695-R1699 VanDerWaalsContact O-N 3.15Å; L1696-R1699 PolarHBondContact O-N 3.32Å; L1697-R1699 PolarHBondContact O-N 3.4Å; L1697-R1699 VanDerWaalsContact O-N 3.1Å; R1699-D1701 VanDerWaalsContact C-N 3.33Å; R1699-A1702 PolarHBondContact O-N 2.76Å; R1699-L1703 HydrophobicContact CG-CD1 4.49Å; R1699-L1703 WeakPolarHBondContact O-CG 3.35Å; R1699-L1703 PolarHBondContact O-N 3.32Å
1700	Q	80.7	Confident	77.4	Confident	107 Å²	107	73.1 Å²	73.1	50%	0.5	34%	0.337	S	S	.	.	H	α-helix	trans	-67.2	-35.7	178.9	-162	64.2	15.6	0	0	111.8	L1696 L1697 L1703 R1704	L1696-Q1700 PolarHBondContact O-N 3.15Å; L1696-Q1700 VanDerWaalsContact O-N 3.09Å; L1697-Q1700 WeakPolarHBondContact O-CA 3.39Å; L1697-Q1700 WeakPolarHBondContact O-CB 3.46Å; L1697-Q1700 PolarHBondContact O-N 2.97Å; Q1700-L1703 PolarHBondContact O-N 3.31Å; Q1700-R1704 WeakPolarHBondContact O-CG 3.14Å; Q1700-R1704 PolarHBondContact O-N 3.08Å
1701	D	76.3	Confident	77	Confident	52 Å²	52	75 Å²	75	28%	0.278	35%	0.348	S	S	.	.	H	α-helix	trans	-63.7	-45.9	174.2	-62.8	-28.2	0	0	0	111.8	L1697 R1699 L1703 R1704 A1705 L1833	L1697-D1701 VanDerWaalsContact O-CG 3.32Å; L1697-D1701 PolarHBondContact O-N 3.28Å; R1699-D1701 VanDerWaalsContact C-N 3.33Å; D1701-L1703 VanDerWaalsContact C-N 3.27Å; D1701-L1703 PolarHBondContact O-N 2.82Å; D1701-R1704 PolarHBondContact O-N 2.64Å; D1701-R1704 VanDerWaalsContact O-N 3.15Å; D1701-R1704 IonicContact OD1-CZ 2.98Å; D1701-R1704 IonicContact OD1-NE 3.76Å; D1701-R1704 IonicContact OD1-NH2 2.72Å; D1701-R1704 PolarHBondContact OD1-NH2 3.26Å; D1701-A1705 PolarHBondContact O-N 2.72Å; D1701-L1833 HydrophobicContact CB-CD1 3.98Å; D1701-L1833 HydrophobicContact CB-CD2 3.88Å
1702	A	70.7	Confident	76.6	Confident	11 Å²	11	77.2 Å²	77.2	9%	0.091	36%	0.358	C	S	.	.	H	α-helix	trans	-63	-32.4	178.4	0	0	0	0	0	113	S1698 R1699 A1706 L1833	S1698-A1702 PolarHBondContact O-N 3.22Å; R1699-A1702 PolarHBondContact O-N 2.76Å; A1702-A1706 PolarHBondContact O-N 2.83Å; A1702-A1706 VanDerWaalsContact O-N 3.12Å; A1702-L1833 HydrophobicContact CB-CB 4.1Å
1703	L	74.5	Confident	76.2	Confident	80 Å²	80	75.1 Å²	75.1	42%	0.419	36%	0.355	S	S	.	.	H	α-helix	trans	-70.3	-45.7	172.3	-69.5	170	0	0	0	111.3	R1699 Q1700 D1701 A1705 A1706 D1707	R1699-L1703 HydrophobicContact CG-CD1 4.49Å; R1699-L1703 WeakPolarHBondContact O-CG 3.35Å; R1699-L1703 PolarHBondContact O-N 3.32Å; Q1700-L1703 PolarHBondContact O-N 3.31Å; D1701-L1703 VanDerWaalsContact C-N 3.27Å; D1701-L1703 PolarHBondContact O-N 2.82Å; L1703-A1705 VanDerWaalsContact C-N 3.28Å; L1703-A1705 PolarHBondContact O-N 3.11Å; L1703-A1706 WeakPolarHBondContact O-CB 3.41Å; L1703-A1706 PolarHBondContact O-N 2.98Å; L1703-A1706 VanDerWaalsContact O-N 3.11Å; L1703-D1707 PolarHBondContact O-N 2.88Å
1704	R	77.5	Confident	75.8	Confident	138 Å²	138	73.1 Å²	73.1	52%	0.521	36%	0.355	S	S	.	.	H	α-helix	trans	-61.6	-34.1	175.6	-71.2	-170.9	-69.8	-178	-1.3	112.8	Q1700 D1701 R1708	Q1700-R1704 WeakPolarHBondContact O-CG 3.14Å; Q1700-R1704 PolarHBondContact O-N 3.08Å; D1701-R1704 PolarHBondContact O-N 2.64Å; D1701-R1704 VanDerWaalsContact O-N 3.15Å; D1701-R1704 IonicContact OD1-CZ 2.98Å; D1701-R1704 IonicContact OD1-NE 3.76Å; D1701-R1704 IonicContact OD1-NH2 2.72Å; D1701-R1704 PolarHBondContact OD1-NH2 3.26Å; R1704-R1708 WeakPolarHBondContact O-CG 3.34Å; R1704-R1708 PolarHBondContact O-N 3.27Å
1705	A	68.5	Low	75.3	Confident	1 Å²	1	75.6 Å²	75.6	1%	0.008	37%	0.366	C	S	.	.	H	α-helix	trans	-66.7	-44.5	172.1	0	0	0	0	0	111.7	D1701 L1703 R1708 L1709 Q1830 L1833	D1701-A1705 PolarHBondContact O-N 2.72Å; L1703-A1705 VanDerWaalsContact C-N 3.28Å; L1703-A1705 PolarHBondContact O-N 3.11Å; A1705-R1708 PolarHBondContact O-N 3.19Å; A1705-L1709 PolarHBondContact O-N 3.32Å; A1705-Q1830 HydrophobicContact CB-CB 4.35Å; A1705-L1833 HydrophobicContact CB-CD1 4.17Å
1706	A	69.2	Low	74.8	Confident	31 Å²	31	74.4 Å²	74.4	26%	0.256	36%	0.36	S	S	.	.	H	α-helix	trans	-60.9	-44.1	176	0	0	0	0	0	112.8	A1702 L1703 R1708 L1709 S1710	A1702-A1706 PolarHBondContact O-N 2.83Å; A1702-A1706 VanDerWaalsContact O-N 3.12Å; L1703-A1706 WeakPolarHBondContact O-CB 3.41Å; L1703-A1706 PolarHBondContact O-N 2.98Å; L1703-A1706 VanDerWaalsContact O-N 3.11Å; A1706-R1708 VanDerWaalsContact C-N 3.3Å; A1706-R1708 PolarHBondContact O-N 3.44Å; A1706-L1709 PolarHBondContact O-N 3.13Å; A1706-S1710 PolarHBondContact O-N 3.4Å
1707	D	75.7	Confident	74.4	Confident	105 Å²	105	75.9 Å²	75.9	56%	0.561	36%	0.359	S	S	*	.	H	α-helix	trans	-64.1	-32.1	178.2	-71.2	-13.7	0	0	0	112.7	L1703 K1711	L1703-D1707 PolarHBondContact O-N 2.88Å; D1707-K1711 WeakPolarHBondContact O-CG 3.39Å; D1707-K1711 PolarHBondContact O-N 3.38Å
1708	R	76.1	Confident	74	Confident	132 Å²	132	79 Å²	79	50%	0.498	37%	0.372	S	S	.	.	H	α-helix	trans	-68.7	-46.4	172.1	-73.6	169.2	177.6	169.4	-0.6	111.3	R1704 A1705 A1706 K1711 Q1712 L1826 E1829	R1704-R1708 WeakPolarHBondContact O-CG 3.34Å; R1704-R1708 PolarHBondContact O-N 3.27Å; A1705-R1708 PolarHBondContact O-N 3.19Å; A1706-R1708 VanDerWaalsContact C-N 3.3Å; A1706-R1708 PolarHBondContact O-N 3.44Å; R1708-K1711 PolarHBondContact O-N 3.28Å; R1708-Q1712 PolarHBondContact O-N 3.44Å; R1708-L1826 HydrophobicContact CB-CD1 4.2Å; R1708-L1826 HydrophobicContact CB-CD2 4.47Å; R1708-E1829 IonicContact NH1-OE1 3.44Å; R1708-E1829 IonicContact NH1-OE2 3.57Å
1709	L	73.8	Confident	73.6	Confident	14 Å²	14	82.5 Å²	82.5	7%	0.073	39%	0.389	C	S	.	.	H	α-helix	trans	-61.4	-50.3	-176.9	-143.1	164.3	0	0	0	110.3	A1705 A1706 K1711 Q1712 E1713 L1826 E1827	A1705-L1709 PolarHBondContact O-N 3.32Å; A1706-L1709 PolarHBondContact O-N 3.13Å; L1709-K1711 VanDerWaalsContact C-N 3.28Å; L1709-K1711 PolarHBondContact O-N 3.15Å; L1709-Q1712 PolarHBondContact O-N 3.32Å; L1709-Q1712 VanDerWaalsContact O-N 3.1Å; L1709-E1713 HydrophobicContact CD2-CG 4.04Å; L1709-E1713 WeakPolarHBondContact O-CG 3.43Å; L1709-E1713 PolarHBondContact O-N 2.71Å; L1709-L1826 HydrophobicContact CD1-CB 4.07Å; L1709-L1826 HydrophobicContact CG-CB 3.96Å; L1709-E1827 HydrophobicContact CD1-CB 4.48Å; L1709-E1827 HydrophobicContact CD1-CG 3.91Å
1710	S	73	Confident	73	Confident	64 Å²	64	76.5 Å²	76.5	45%	0.448	37%	0.367	S	S	.	.	H	α-helix	trans	-58.2	-36.4	176	-179.4	0	0	0	0	113.3	A1706 E1713 T1714	A1706-S1710 PolarHBondContact O-N 3.4Å; S1710-E1713 WeakPolarHBondContact CA-OE2 3.35Å; S1710-T1714 WeakPolarHBondContact O-CG2 3.32Å; S1710-T1714 PolarHBondContact O-N 2.92Å; S1710-T1714 VanDerWaalsContact O-N 3.15Å; S1710-T1714 PolarHBondContact O-OG1 3.46Å
1711	K	76.2	Confident	72.5	Confident	146 Å²	146	75 Å²	75	64%	0.635	36%	0.36	S	S	*	.	H	α-helix	trans	-67	-46.4	174.2	-76.9	178.3	178.9	-173.5	0	112.2	D1707 R1708 L1709 E1713 T1714 E1715	D1707-K1711 WeakPolarHBondContact O-CG 3.39Å; D1707-K1711 PolarHBondContact O-N 3.38Å; R1708-K1711 PolarHBondContact O-N 3.28Å; L1709-K1711 VanDerWaalsContact C-N 3.28Å; L1709-K1711 PolarHBondContact O-N 3.15Å; K1711-E1713 PolarHBondContact O-N 3.15Å; K1711-T1714 PolarHBondContact O-N 3.49Å; K1711-T1714 VanDerWaalsContact O-N 3.13Å; K1711-T1714 PolarHBondContact O-OG1 2.91Å; K1711-E1715 PolarHBondContact O-N 3.36Å
1712	Q	73.8	Confident	72	Confident	50 Å²	50	77.3 Å²	77.3	23%	0.234	37%	0.372	C	S	.	.	H	α-helix	trans	-65.5	-37.1	178	-67.1	-151.9	-53.3	0	0	112.4	R1708 L1709 T1714 E1715 I1716 L1826	R1708-Q1712 PolarHBondContact O-N 3.44Å; L1709-Q1712 PolarHBondContact O-N 3.32Å; L1709-Q1712 VanDerWaalsContact O-N 3.1Å; Q1712-T1714 VanDerWaalsContact C-N 3.3Å; Q1712-T1714 PolarHBondContact O-N 3.24Å; Q1712-E1715 PolarHBondContact O-N 3.04Å; Q1712-I1716 WeakPolarHBondContact O-CB 3.27Å; Q1712-I1716 WeakPolarHBondContact O-CD1 3.38Å; Q1712-I1716 VanDerWaalsContact O-CG1 3.23Å; Q1712-I1716 WeakPolarHBondContact O-CG1 3.23Å; Q1712-I1716 PolarHBondContact O-N 2.94Å; Q1712-L1826 HydrophobicContact CG-CD1 4.33Å
1713	E	72.3	Confident	71.8	Confident	103 Å²	103	78.7 Å²	78.7	48%	0.481	38%	0.377	S	S	.	.	H	α-helix	trans	-55.3	-45.4	169.8	-71.8	177.3	130.4	0	0	111.3	L1709 S1710 K1711 Y1717 M1823	L1709-E1713 HydrophobicContact CD2-CG 4.04Å; L1709-E1713 WeakPolarHBondContact O-CG 3.43Å; L1709-E1713 PolarHBondContact O-N 2.71Å; S1710-E1713 WeakPolarHBondContact CA-OE2 3.35Å; K1711-E1713 PolarHBondContact O-N 3.15Å; E1713-Y1717 WeakPolarHBondContact O-CB 3.44Å; E1713-Y1717 PolarHBondContact O-N 3.11Å; E1713-M1823 HydrophobicContact CG-SD 3.99Å
1714	T	74.1	Confident	71.1	Confident	72 Å²	72	75.4 Å²	75.4	44%	0.442	36%	0.36	S	S	.	.	H	α-helix	trans	-69.1	-36.7	177.8	57.9	0	0	0	0	113.8	S1710 K1711 Q1712 Y1717 Q1718	S1710-T1714 WeakPolarHBondContact O-CG2 3.32Å; S1710-T1714 PolarHBondContact O-N 2.92Å; S1710-T1714 VanDerWaalsContact O-N 3.15Å; S1710-T1714 PolarHBondContact O-OG1 3.46Å; K1711-T1714 PolarHBondContact O-N 3.49Å; K1711-T1714 VanDerWaalsContact O-N 3.13Å; K1711-T1714 PolarHBondContact O-OG1 2.91Å; Q1712-T1714 VanDerWaalsContact C-N 3.3Å; Q1712-T1714 PolarHBondContact O-N 3.24Å; T1714-Y1717 PolarHBondContact O-N 2.91Å; T1714-Q1718 WeakPolarHBondContact O-CB 3.31Å; T1714-Q1718 VanDerWaalsContact O-CG 3.31Å; T1714-Q1718 WeakPolarHBondContact O-CG 3.47Å; T1714-Q1718 PolarHBondContact O-N 3.45Å
1715	E	70.9	Confident	70.5	Confident	107 Å²	107	74.2 Å²	74.2	50%	0.5	36%	0.358	S	S	.	.	H	α-helix	trans	-65.9	-44.4	174.3	-72.9	-177.2	143.8	0	0	111.2	K1711 Q1712 Y1717 Q1718 L1719	K1711-E1715 PolarHBondContact O-N 3.36Å; Q1712-E1715 PolarHBondContact O-N 3.04Å; E1715-Y1717 VanDerWaalsContact C-N 3.34Å; E1715-Y1717 PolarHBondContact O-N 3.49Å; E1715-Q1718 PolarHBondContact O-N 2.94Å; E1715-L1719 WeakPolarHBondContact O-CB 3.43Å; E1715-L1719 VanDerWaalsContact O-CG 3.29Å; E1715-L1719 WeakPolarHBondContact O-CG 3.34Å; E1715-L1719 PolarHBondContact O-N 3.04Å
1716	I	72.6	Confident	69.9	Low	10 Å²	10	79.1 Å²	79.1	5%	0.051	38%	0.384	C	S	.	.	H	α-helix	trans	-59.6	-45.9	174.8	-70.8	160.2	0	0	0	110.4	Q1712 Q1718 L1719 R1720 L1819 M1823	Q1712-I1716 WeakPolarHBondContact O-CB 3.27Å; Q1712-I1716 WeakPolarHBondContact O-CD1 3.38Å; Q1712-I1716 VanDerWaalsContact O-CG1 3.23Å; Q1712-I1716 WeakPolarHBondContact O-CG1 3.23Å; Q1712-I1716 PolarHBondContact O-N 2.94Å; I1716-Q1718 PolarHBondContact O-N 3.34Å; I1716-L1719 PolarHBondContact O-N 3.47Å; I1716-R1720 HydrophobicContact CG2-CG 4.26Å; I1716-R1720 WeakPolarHBondContact O-CB 3.45Å; I1716-R1720 WeakPolarHBondContact O-CG 3.35Å; I1716-R1720 PolarHBondContact O-N 3.23Å; I1716-L1819 HydrophobicContact CD1-CD2 4.37Å; I1716-L1819 HydrophobicContact CD1-CG 3.92Å; I1716-L1819 HydrophobicContact CG1-CD2 3.46Å; I1716-L1819 VanDerWaalsContact CG1-CD2 3.46Å; I1716-L1819 HydrophobicContact CG1-CG 3.56Å; I1716-M1823 HydrophobicContact CD1-CE 3.73Å; I1716-M1823 HydrophobicContact CD1-CG 3.5Å; I1716-M1823 VanDerWaalsContact CD1-CG 3.5Å; I1716-M1823 HydrophobicContact CD1-SD 3.31Å; I1716-M1823 WeakPolarHBondContact CD1-SD 3.26Å
1717	Y	70.8	Confident	69.6	Low	145 Å²	145	80.3 Å²	80.3	57%	0.569	39%	0.386	S	S	*	.	H	α-helix	trans	-63.7	-39.5	179.5	-166.6	-103.1	0	0	0	112.2	E1713 T1714 E1715 Q1721	E1713-Y1717 WeakPolarHBondContact O-CB 3.44Å; E1713-Y1717 PolarHBondContact O-N 3.11Å; T1714-Y1717 PolarHBondContact O-N 2.91Å; E1715-Y1717 VanDerWaalsContact C-N 3.34Å; E1715-Y1717 PolarHBondContact O-N 3.49Å; Y1717-Q1721 HydrophobicContact CE1-CG 4.41Å; Y1717-Q1721 WeakPolarHBondContact O-CG 3.45Å; Y1717-Q1721 PolarHBondContact O-N 3.39Å
1718	Q	71.2	Confident	68.3	Low	126 Å²	126	77.3 Å²	77.3	59%	0.589	37%	0.369	S	S	*	.	H	α-helix	trans	-68.7	-43.5	174.6	-72.3	178.4	21.5	0	0	112.8	T1714 E1715 I1716 R1720 Q1721 L1722	T1714-Q1718 WeakPolarHBondContact O-CB 3.31Å; T1714-Q1718 VanDerWaalsContact O-CG 3.31Å; T1714-Q1718 WeakPolarHBondContact O-CG 3.47Å; T1714-Q1718 PolarHBondContact O-N 3.45Å; E1715-Q1718 PolarHBondContact O-N 2.94Å; I1716-Q1718 PolarHBondContact O-N 3.34Å; Q1718-R1720 VanDerWaalsContact C-N 3.33Å; Q1718-R1720 PolarHBondContact O-N 3.06Å; Q1718-Q1721 PolarHBondContact O-N 2.87Å; Q1718-L1722 WeakPolarHBondContact O-CB 3.25Å; Q1718-L1722 WeakPolarHBondContact O-CG 3.38Å; Q1718-L1722 PolarHBondContact O-N 3.18Å
1719	L	69.9	Low	66.7	Low	83 Å²	83	76.1 Å²	76.1	44%	0.435	37%	0.373	S	S	.	.	H	α-helix	trans	-62.7	-40.3	175.9	-74.3	168.6	0	0	0	111.7	E1715 I1716 L1722 L1723 F1816 L1819	E1715-L1719 WeakPolarHBondContact O-CB 3.43Å; E1715-L1719 VanDerWaalsContact O-CG 3.29Å; E1715-L1719 WeakPolarHBondContact O-CG 3.34Å; E1715-L1719 PolarHBondContact O-N 3.04Å; I1716-L1719 PolarHBondContact O-N 3.47Å; L1719-L1722 PolarHBondContact O-N 3.39Å; L1719-L1723 PolarHBondContact O-N 3.16Å; L1719-F1816 HydrophobicContact CB-CE1 4.08Å; L1719-F1816 HydrophobicContact CB-CZ 3.99Å; L1719-L1819 HydrophobicContact CD1-CD2 3.77Å
1720	R	65.5	Low	65	Low	29 Å²	29	82 Å²	82	11%	0.109	41%	0.405	C	S	.	.	H	α-helix	trans	-63.4	-45.8	174	-77.9	-176.9	-175	-77.2	2	111.8	T1088 I1716 Q1718 L1722 L1723 D1724 F1816 D1820	T1088-R1720 HydrophobicContact CG2-CB 3.74Å; T1088-R1720 HydrophobicContact CG2-CG 4.38Å; T1088-R1720 VanDerWaalsContact OG1-CB 3.24Å; T1088-R1720 WeakPolarHBondContact OG1-CB 3.32Å; T1088-R1720 WeakPolarHBondContact OG1-CD 3.49Å; T1088-R1720 VanDerWaalsContact OG1-CG 3.24Å; T1088-R1720 WeakPolarHBondContact OG1-CG 3.5Å; I1716-R1720 HydrophobicContact CG2-CG 4.26Å; I1716-R1720 WeakPolarHBondContact O-CB 3.45Å; I1716-R1720 WeakPolarHBondContact O-CG 3.35Å; I1716-R1720 PolarHBondContact O-N 3.23Å; Q1718-R1720 VanDerWaalsContact C-N 3.33Å; Q1718-R1720 PolarHBondContact O-N 3.06Å; R1720-L1722 VanDerWaalsContact C-N 3.33Å; R1720-L1722 PolarHBondContact O-N 3.04Å; R1720-L1723 PolarHBondContact O-N 3.28Å; R1720-D1724 PolarHBondContact O-N 3.35Å; R1720-F1816 HydrophobicContact CG-CD1 4.31Å; R1720-F1816 HydrophobicContact CG-CE1 3.58Å; R1720-F1816 HydrophobicContact CG-CZ 4.08Å; R1720-D1820 IonicContact NH2-OD1 3.3Å; R1720-D1820 PolarHBondContact NH2-OD1 3.15Å; R1720-D1820 IonicContact NH2-OD2 2.91Å; R1720-D1820 PolarHBondContact NH2-OD2 2.97Å; R1720-D1820 VanDerWaalsContact NH2-OD2 3.09Å
1721	Q	69.4	Low	63.2	Low	77 Å²	77	84.4 Å²	84.4	36%	0.36	41%	0.407	S	S	.	.	H	α-helix	trans	-63	-34.8	172.6	-77.6	-162.7	9	0	0	113.7	Y1717 Q1718 K1725	Y1717-Q1721 HydrophobicContact CE1-CG 4.41Å; Y1717-Q1721 WeakPolarHBondContact O-CG 3.45Å; Y1717-Q1721 PolarHBondContact O-N 3.39Å; Q1718-Q1721 PolarHBondContact O-N 2.87Å; Q1721-K1725 WeakPolarHBondContact O-CB 3.48Å; Q1721-K1725 WeakPolarHBondContact O-CD 3.49Å; Q1721-K1725 VanDerWaalsContact O-CG 3.25Å; Q1721-K1725 WeakPolarHBondContact O-CG 3.38Å; Q1721-K1725 PolarHBondContact O-N 2.64Å; Q1721-K1725 VanDerWaalsContact O-N 3.07Å
1722	L	67.3	Low	61.1	Low	100 Å²	100	82.2 Å²	82.2	52%	0.524	41%	0.406	S	S	.	.	H	α-helix	trans	-69.5	-36.7	174.8	-78	169.6	0	0	0	111.6	Q1718 L1719 R1720 K1725 L1726	Q1718-L1722 WeakPolarHBondContact O-CB 3.25Å; Q1718-L1722 WeakPolarHBondContact O-CG 3.38Å; Q1718-L1722 PolarHBondContact O-N 3.18Å; L1719-L1722 PolarHBondContact O-N 3.39Å; R1720-L1722 VanDerWaalsContact C-N 3.33Å; R1720-L1722 PolarHBondContact O-N 3.04Å; L1722-K1725 PolarHBondContact O-N 3.41Å; L1722-L1726 WeakPolarHBondContact O-CB 3.23Å; L1722-L1726 WeakPolarHBondContact O-CG 3.48Å; L1722-L1726 PolarHBondContact O-N 2.99Å
1723	L	65.8	Low	58.8	Low	40 Å²	40	86.3 Å²	86.3	21%	0.209	43%	0.429	C	S	.	.	H	α-helix	trans	-64.6	-49.4	174.1	-173.3	69.9	0	0	0	111.4	L1719 R1720 K1725 L1726 I1727 V1812 F1816	L1719-L1723 PolarHBondContact O-N 3.16Å; R1720-L1723 PolarHBondContact O-N 3.28Å; L1723-K1725 VanDerWaalsContact C-N 3.29Å; L1723-K1725 PolarHBondContact O-N 2.89Å; L1723-L1726 PolarHBondContact O-N 2.85Å; L1723-L1726 VanDerWaalsContact O-N 3.08Å; L1723-I1727 HydrophobicContact CD1-CD1 4.39Å; L1723-I1727 HydrophobicContact CD2-CD1 4.3Å; L1723-I1727 HydrophobicContact CG-CD1 3.86Å; L1723-I1727 HydrophobicContact CG-CG1 4.45Å; L1723-I1727 WeakPolarHBondContact O-CG1 3.36Å; L1723-I1727 PolarHBondContact O-N 2.99Å; L1723-V1812 HydrophobicContact CD1-CG1 3.83Å; L1723-V1812 HydrophobicContact CD2-CG1 4.2Å; L1723-F1816 HydrophobicContact CD2-CD2 4.5Å; L1723-F1816 HydrophobicContact CD2-CE2 3.83Å; L1723-F1816 HydrophobicContact CD2-CZ 4.46Å
1724	D	60.4	Low	56.6	Low	10 Å²	10	88.3 Å²	88.3	5%	0.053	45%	0.449	C	S	.	.	H	α-helix	trans	-56.7	-43.4	175.9	-72.7	-34.1	0	0	0	111.1	T1088 N1090 R1720 L1726 I1727 N1728	T1088-D1724 WeakPolarHBondContact CB-OD2 3.41Å; T1088-D1724 WeakPolarHBondContact CG2-OD2 3.38Å; N1090-D1724 HydrophobicContact CB-CB 4.36Å; N1090-D1724 PolarHBondContact N-OD1 3.46Å; N1090-D1724 PolarHBondContact ND2-OD2 3.01Å; R1720-D1724 PolarHBondContact O-N 3.35Å; D1724-L1726 PolarHBondContact O-N 3.48Å; D1724-I1727 PolarHBondContact O-N 3.33Å; D1724-N1728 WeakPolarHBondContact O-CB 3.46Å; D1724-N1728 PolarHBondContact O-N 3.47Å
1725	K	65.2	Low	54.2	Low	113 Å²	113	91.2 Å²	91.2	49%	0.491	47%	0.467	S	S	.	.	H	α-helix	trans	-62.7	-37.7	175.2	-76.3	167.9	-178.6	165.9	0	113.2	Q1721 L1722 L1723 N1729	Q1721-K1725 WeakPolarHBondContact O-CB 3.48Å; Q1721-K1725 WeakPolarHBondContact O-CD 3.49Å; Q1721-K1725 VanDerWaalsContact O-CG 3.25Å; Q1721-K1725 WeakPolarHBondContact O-CG 3.38Å; Q1721-K1725 PolarHBondContact O-N 2.64Å; Q1721-K1725 VanDerWaalsContact O-N 3.07Å; L1722-K1725 PolarHBondContact O-N 3.41Å; L1723-K1725 VanDerWaalsContact C-N 3.29Å; L1723-K1725 PolarHBondContact O-N 2.89Å; K1725-N1729 VanDerWaalsContact O-CB 3.29Å; K1725-N1729 WeakPolarHBondContact O-CB 3.42Å; K1725-N1729 PolarHBondContact O-N 3.16Å; K1725-N1729 PolarHBondContact O-ND2 3.42Å
1726	L	55.5	Low	52.1	Low	105 Å²	105	93.2 Å²	93.2	55%	0.55	48%	0.479	S	S	.	.	H	α-helix	trans	-71.1	-40.5	176	-76.1	166.1	0	0	0	112.1	L1722 L1723 D1724 N1728 N1730	L1722-L1726 WeakPolarHBondContact O-CB 3.23Å; L1722-L1726 WeakPolarHBondContact O-CG 3.48Å; L1722-L1726 PolarHBondContact O-N 2.99Å; L1723-L1726 PolarHBondContact O-N 2.85Å; L1723-L1726 VanDerWaalsContact O-N 3.08Å; D1724-L1726 PolarHBondContact O-N 3.48Å; L1726-N1728 VanDerWaalsContact C-N 3.34Å; L1726-N1730 PolarHBondContact O-N 3.14Å
1727	I	61.8	Low	49.8	Very low	56 Å²	56	100.2 Å²	100.2	29%	0.287	52%	0.517	S	S	.	.	H	α-helix	trans	-61.5	-44	175.1	-70.8	169.7	0	0	0	110.3	L1723 D1724	L1723-I1727 HydrophobicContact CD1-CD1 4.39Å; L1723-I1727 HydrophobicContact CD2-CD1 4.3Å; L1723-I1727 HydrophobicContact CG-CD1 3.86Å; L1723-I1727 HydrophobicContact CG-CG1 4.45Å; L1723-I1727 WeakPolarHBondContact O-CG1 3.36Å; L1723-I1727 PolarHBondContact O-N 2.99Å; D1724-I1727 PolarHBondContact O-N 3.33Å
1728	N	49.2	Very low	47.7	Very low	41 Å²	41	98.2 Å²	98.2	22%	0.219	52%	0.524	C	S	.	.	H	α-helix	trans	-74.3	-38.4	-178.7	-73.8	-15.8	0	0	0	113.7	D1091 D1724 L1726 N1730 K1731	D1091-N1728 PolarHBondContact OD2-ND2 3.19Å; D1091-N1728 PolarHBondContact OD2-OD1 3.13Å; D1724-N1728 WeakPolarHBondContact O-CB 3.46Å; D1724-N1728 PolarHBondContact O-N 3.47Å; L1726-N1728 VanDerWaalsContact C-N 3.34Å; N1728-N1730 PolarHBondContact O-N 2.93Å; N1728-K1731 PolarHBondContact O-N 2.84Å; N1728-K1731 VanDerWaalsContact O-N 3.08Å
1729	N	41.4	Very low	45.5	Very low	108 Å²	108	99.2 Å²	99.2	58%	0.578	53%	0.533	S	S	*	.	H	α-helix	trans	-65.1	-23.4	176.1	-74.9	-15.3	0	0	0	113	K1725 T1732	K1725-N1729 VanDerWaalsContact O-CB 3.29Å; K1725-N1729 WeakPolarHBondContact O-CB 3.42Å; K1725-N1729 PolarHBondContact O-N 3.16Å; K1725-N1729 PolarHBondContact O-ND2 3.42Å; N1729-T1732 PolarHBondContact O-OG1 3.25Å
1730	N	39	Very low	43.4	Very low	138 Å²	138	103.2 Å²	103.2	74%	0.738	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-10.3	174.7	-73.8	-11.7	0	0	0	113.9	L1726 N1728	L1726-N1730 PolarHBondContact O-N 3.14Å; N1728-N1730 PolarHBondContact O-N 2.93Å
1731	K	36	Very low	41.5	Very low	114 Å²	114	109.5 Å²	109.5	50%	0.496	59%	0.591	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.6	-11.6	176	-73.8	177.8	179.1	169.7	0	113.8	D1091 N1728	D1091-K1731 PolarHBondContact O-NZ 3.21Å; N1728-K1731 PolarHBondContact O-N 2.84Å; N1728-K1731 VanDerWaalsContact O-N 3.08Å
1732	T	30.7	Very low	39.4	Very low	100 Å²	100	114.5 Å²	114.5	61%	0.613	61%	0.614	S	S	*	*	S	Bend	trans	-106.8	1	-164.4	52.9	0	0	0	0	116.2	N1729	N1729-T1732 PolarHBondContact O-OG1 3.25Å
1733	N	25.5	Very low	37.3	Very low	135 Å²	135	115.1 Å²	115.1	72%	0.722	63%	0.627	S	S	*	*			trans	-139.3	91.6	178.8	-77.9	-67.9	0	0	0	113
1734	T	27.3	Very low	35.4	Very low	146 Å²	146	120.8 Å²	120.8	90%	0.896	66%	0.656	S	S	*	*			trans	-175.1	111.5	132.3	32.8	0	0	0	0	110.9
1735	T	22.5	Very low	33.6	Very low	132 Å²	132	128.1 Å²	128.1	81%	0.81	69%	0.69	S	S	*	*			trans	-125.7	172.8	146.8	50	0	0	0	0	107.7
1736	I	26.5	Very low	31.7	Very low	150 Å²	150	130.6 Å²	130.6	77%	0.769	71%	0.707	S	S	*	*	S	Bend	trans	86.7	108.9	177.9	-52.4	169.4	0	0	0	115.7
1737	N	26	Very low	30.1	Very low	157 Å²	157	134.6 Å²	134.6	84%	0.84	72%	0.72	S	S	*	*			trans	41.9	139.8	144.5	-60.1	-8	0	0	0	123
1738	S	26.2	Very low	28.3	Very low	102 Å²	102	137.6 Å²	137.6	71%	0.713	74%	0.741	S	S	*	*			trans	-72.7	172.6	166.8	47.5	0	0	0	0	113.6
1739	N	24.4	Very low	27.1	Very low	148 Å²	148	141.7 Å²	141.7	79%	0.791	77%	0.77	S	S	*	*			trans	75	82.9	175.1	-58.9	-12.9	0	0	0	116.8
1740	N	26.6	Very low	26.1	Very low	167 Å²	167	145.2 Å²	145.2	89%	0.893	78%	0.78	S	S	*	*				-156.7	149.6	115.1	-108.3	-39.9	0	0	0	113.2	Q1742	N1740-Q1742 PolarHBondContact O-N 2.85Å
1741	N	24.1	Very low	25.4	Very low	160 Å²	160	143.3 Å²	143.3	86%	0.856	78%	0.778	S	S	*	*			trans	-77.8	109.9	173.6	-77.9	-35.7	0	0	0	110.2
1742	Q	25.7	Very low	24.8	Very low	183 Å²	183	143.7 Å²	143.7	86%	0.855	79%	0.785	S	S	*	*			trans	-153.5	138	155.7	-116.9	166.3	41.7	0	0	112.5	N1740 I1744	N1740-Q1742 PolarHBondContact O-N 2.85Å; Q1742-I1744 PolarHBondContact O-N 3.1Å
1743	S	23.7	Very low	24.6	Very low	113 Å²	113	145.6 Å²	145.6	79%	0.79	79%	0.791	S	S	*	*			trans	-79.5	96.2	-176.4	38.6	0	0	0	0	111.4	H1745	S1743-H1745 PolarHBondContact O-N 3.49Å
1744	I	25.2	Very low	24.5	Very low	158 Å²	158	150.7 Å²	150.7	81%	0.81	80%	0.802	S	S	*	*			trans	-73.5	93.3	171.6	-58.9	-177.3	0	0	0	109.2	Q1742 L1746	Q1742-I1744 PolarHBondContact O-N 3.1Å; I1744-L1746 PolarHBondContact O-N 3.09Å
1745	H	23.5	Very low	24.3	Very low	165 Å²	165	150.9 Å²	150.9	76%	0.764	79%	0.791	S	S	*	*			trans	-54.9	118	164.3	-119.1	-76.8	0	0	0	109.1	S1743 K1747	S1743-H1745 PolarHBondContact O-N 3.49Å; H1745-K1747 PolarHBondContact O-N 3.32Å
1746	L	24.1	Very low	24.4	Very low	165 Å²	165	151.8 Å²	151.8	86%	0.864	79%	0.791	S	S	*	*			trans	-69.1	83.8	165.2	-93.8	170	0	0	0	109.1	I1744 V1748	I1744-L1746 PolarHBondContact O-N 3.09Å; L1746-V1748 VanDerWaalsContact C-N 3.32Å; L1746-V1748 PolarHBondContact O-N 3.07Å
1747	K	23.5	Very low	24.3	Very low	188 Å²	188	155.9 Å²	155.9	82%	0.817	80%	0.798	S	S	*	*			trans	-75.6	83.2	-177.9	-166.6	178.5	-174.4	-178.5	0	108.8	H1745 P1749	H1745-K1747 PolarHBondContact O-N 3.32Å; K1747-P1749 WeakPolarHBondContact O-CD 3.19Å; K1747-P1749 VanDerWaalsContact O-N 3.12Å
1748	V	23.6	Very low	24.1	Very low	120 Å²	120	153 Å²	153	73%	0.727	79%	0.789	S	S	*	*			trans	-45.8	119.3	171.9	176.5	0	0	0	0	108.7	L1746 K1750	L1746-V1748 VanDerWaalsContact C-N 3.32Å; L1746-V1748 PolarHBondContact O-N 3.07Å; V1748-K1750 PolarHBondContact O-N 3.3Å
1749	P	23.3	Very low	24.1	Very low	126 Å²	126	154.5 Å²	154.5	82%	0.818	80%	0.795	S	S	*	*			trans	-73.3	90.5	-171.8	27.9	-34.4	0	0	0	110.8	K1747	K1747-P1749 WeakPolarHBondContact O-CD 3.19Å; K1747-P1749 VanDerWaalsContact O-N 3.12Å
1750	K	21.3	Very low	24.1	Very low	182 Å²	182	155.4 Å²	155.4	79%	0.791	80%	0.799	S	S	*	*			trans	-78.7	147.9	154.6	-73.3	-178.3	179.1	173.8	0	109.2	V1748	V1748-K1750 PolarHBondContact O-N 3.3Å
1751	S	23.5	Very low	24.2	Very low	99 Å²	99	155.2 Å²	155.2	69%	0.692	80%	0.797	S	S	*	*	S	Bend	trans	59.3	108.9	170.9	54.1	0	0	0	0	117.9
1752	N	24	Very low	24.2	Very low	121 Å²	121	157.1 Å²	157.1	65%	0.647	80%	0.801	S	S	*	*				57.4	104.6	124	-50.5	5.6	0	0	0	118.2
1753	N	25.5	Very low	24.3	Very low	141 Å²	141	151.3 Å²	151.3	75%	0.754	79%	0.791	S	S	*	*				-166.5	89	97.6	-93.8	-5.2	0	0	0	111.8
1754	Y	24	Very low	24.6	Very low	242 Å²	242	153.6 Å²	153.6	95%	0.949	79%	0.794	S	S	*	*			trans	-132.4	73.9	147.7	-109.4	-87.5	0	0	0	106.2
1755	F	23.8	Very low	24.6	Very low	149 Å²	149	155.5 Å²	155.5	65%	0.654	80%	0.8	S	S	*	*			trans	-102.9	75.8	-175.6	-131.6	-73.5	0	0	0	108.2
1756	D	24	Very low	24.6	Very low	152 Å²	152	155.1 Å²	155.1	81%	0.813	80%	0.802	S	S	*	*			trans	-162.3	79.1	163.2	-103.2	-26.3	0	0	0	110.1
1757	Y	23.5	Very low	24.8	Very low	235 Å²	235	156.5 Å²	156.5	92%	0.922	80%	0.801	S	S	*	*	S	Bend	trans	-176.4	67.2	136.8	-106.6	-70.2	0	0	0	108.2
1758	C	23.3	Very low	24.9	Very low	97 Å²	97	151.1 Å²	151.1	66%	0.655	79%	0.787	S	S	*	*			trans	-138.2	130.6	174.9	-86.9	0	0	0	0	110.8
1759	T	25.4	Very low	25.2	Very low	134 Å²	134	155 Å²	155	82%	0.822	79%	0.79	S	S	*	*			trans	51.1	78.4	157.4	57.3	0	0	0	0	116.9
1760	N	24.5	Very low	25.3	Very low	167 Å²	167	154.4 Å²	154.4	89%	0.893	78%	0.78	S	S	*	*			trans	-108.5	90.1	139.6	-136.5	-3.4	0	0	0	107.6
1761	L	28.2	Very low	25.6	Very low	162 Å²	162	151 Å²	151	85%	0.848	77%	0.771	S	S	*	*			trans	177.2	84	160.3	-101.3	165.2	0	0	0	109.4
1762	Q	24	Very low	26	Very low	200 Å²	200	153.1 Å²	153.1	94%	0.935	77%	0.767	S	S	*	*			trans	-87	148.9	153.9	-66.3	177.1	-52.4	0	0	108.2
1763	G	28.3	Very low	26.2	Very low	62 Å²	62	154.8 Å²	154.8	64%	0.639	77%	0.771	S	S	*	*			trans	117.1	104.8	166.7	0	0	0	0	0	114.7
1764	N	29.2	Very low	26	Very low	161 Å²	161	155 Å²	155	86%	0.861	77%	0.771	S	S	*	*			trans	37.1	135.7	138.9	-50.5	-11.4	0	0	0	119.6
1765	E	25.9	Very low	26.1	Very low	198 Å²	198	153.9 Å²	153.9	93%	0.925	77%	0.767	S	S	*	*			cis	-117.9	152	24.9	-62.5	-162.3	117.5	0	0	115.3
1766	L	23.8	Very low	26.3	Very low	157 Å²	157	152.5 Å²	152.5	82%	0.822	78%	0.776	S	S	*	*			trans	-148.5	118.8	173.6	-140.1	179.1	0	0	0	109.8
1767	K	28.2	Very low	26.3	Very low	194 Å²	194	154.9 Å²	154.9	84%	0.843	77%	0.774	S	S	*	*			trans	-139.4	115.3	156.3	-68.9	-178.5	-179.3	169.3	0	105.5
1768	S	26.6	Very low	26.4	Very low	74 Å²	74	151.9 Å²	151.9	52%	0.517	77%	0.765	S	S	.	*				58.9	130.6	62.7	82.2	0	0	0	0	112.1
1769	Y	28	Very low	26.7	Very low	201 Å²	201	156.1 Å²	156.1	79%	0.788	78%	0.775	S	S	*	*			cis	-119.8	141.2	20.8	-85.1	-102.6	0	0	0	112
1770	D	26.3	Very low	26.7	Very low	115 Å²	115	154.8 Å²	154.8	62%	0.615	77%	0.772	S	S	*	*				52.5	131.2	96.6	-60.7	-44	0	0	0	113.9
1771	D	28.3	Very low	26.7	Very low	110 Å²	110	154.5 Å²	154.5	59%	0.588	77%	0.769	S	S	*	*			cis	-158.3	166.3	42	-130.4	-0.7	0	0	0	111.6
1772	K	31.2	Very low	27	Very low	144 Å²	144	152.5 Å²	152.5	63%	0.626	77%	0.765	S	S	*	*			cis	-152.4	115.7	-3	-160.9	161.7	-144.3	74.3	0	112.9
1773	Q	27.9	Very low	27.2	Very low	155 Å²	155	149.7 Å²	149.7	72%	0.724	76%	0.762	S	S	*	*			trans	40.3	135.5	134.8	-53	-179.6	-2	0	0	123.5
1774	L	21.7	Very low	27	Very low	145 Å²	145	152.6 Å²	152.6	76%	0.759	77%	0.767	S	S	*	*			trans	-138.4	106.9	156	-145.8	-178.1	0	0	0	109.9
1775	Y	26.7	Very low	26.8	Very low	220 Å²	220	150.1 Å²	150.1	86%	0.863	76%	0.758	S	S	*	*			trans	-154	151.9	169.9	-94.5	-83.9	0	0	0	105.8
1776	S	26.3	Very low	27	Very low	120 Å²	120	147 Å²	147	84%	0.839	75%	0.748	S	S	*	*			cis	-157.6	-162.4	44.7	-144.1	0	0	0	0	113.6
1777	R	24.4	Very low	27.2	Very low	202 Å²	202	145 Å²	145	76%	0.762	74%	0.743	S	S	*	*			trans	-141.1	145.3	-155.1	177.7	-174.5	-170.9	-165.2	9.8	114.8
1778	K	25.4	Very low	27.3	Very low	171 Å²	171	142 Å²	142	74%	0.743	74%	0.74	S	S	*	*			trans	79.3	162.5	160	-88.2	169.9	177.3	-176.9	0	120.4
1779	Q	29.9	Very low	27.3	Very low	186 Å²	186	141.6 Å²	141.6	87%	0.869	75%	0.748	S	S	*	*			trans	80.6	146.6	170	-58.1	-174.8	3.8	0	0	117.2
1780	S	25.3	Very low	27.3	Very low	106 Å²	106	137.6 Å²	137.6	74%	0.741	74%	0.744	S	S	*	*			cis	-165	167.9	-33.9	46.3	0	0	0	0	111.5
1781	I	25.3	Very low	27.3	Very low	162 Å²	162	139.1 Å²	139.1	83%	0.831	75%	0.752	S	S	*	*			trans	-40.7	143.8	179.7	-69.1	170.6	0	0	0	114.7
1782	P	33.8	Very low	27.2	Very low	119 Å²	119	138.2 Å²	138.2	77%	0.773	75%	0.754	S	S	*	*			trans	-90.9	168.5	-159.1	37	-39.2	0	0	0	116
1783	T	27.9	Very low	26.8	Very low	142 Å²	142	138 Å²	138	87%	0.871	76%	0.758	S	S	*	*			trans	-124.2	149.9	166.4	44.6	0	0	0	0	111.6
1784	T	24.5	Very low	26.5	Very low	123 Å²	123	138.9 Å²	138.9	76%	0.755	76%	0.763	S	S	*	*			trans	-87.5	-165.2	178.9	49.5	0	0	0	0	110.1
1785	T	26.2	Very low	26.6	Very low	108 Å²	108	136.6 Å²	136.6	66%	0.663	76%	0.759	S	S	*	*			cis	-175.5	177.3	33.5	-22.3	0	0	0	0	111.4
1786	N	29.8	Very low	26.4	Very low	132 Å²	132	130.9 Å²	130.9	71%	0.706	75%	0.751	S	S	*	*			trans	87.6	136.1	152	-63.6	-13.9	0	0	0	118.5
1787	T	28.4	Very low	26.2	Very low	117 Å²	117	130.8 Å²	130.8	72%	0.718	75%	0.745	S	S	*	*			cis	-163	161.4	-11.5	17.7	0	0	0	0	109.5
1788	T	30.2	Very low	26.2	Very low	130 Å²	130	127.7 Å²	127.7	80%	0.798	74%	0.744	S	S	*	*			cis	-100.5	-140.8	4.7	57.9	0	0	0	0	110.7
1789	G	25.7	Very low	26.2	Very low	65 Å²	65	127 Å²	127	67%	0.67	75%	0.749	S	S	*	*			cis	156.4	158.6	-3.8	0	0	0	0	0	111.1
1790	V	27.6	Very low	26.1	Very low	117 Å²	117	124.3 Å²	124.3	71%	0.709	75%	0.745	S	S	*	*			cis	-140.8	128.2	-7.1	166.8	0	0	0	0	108
1791	N	27.3	Very low	26.2	Very low	147 Å²	147	126.6 Å²	126.6	79%	0.786	75%	0.749	S	S	*	*			trans	65.2	148.4	167	-61.7	-3.1	0	0	0	118.1
1792	C	25.8	Very low	26.5	Very low	92 Å²	92	126.2 Å²	126.2	62%	0.622	75%	0.748	S	S	*	*			cis	-158.1	132.6	-13.5	-105	0	0	0	0	108
1793	L	22.2	Very low	26.4	Very low	138 Å²	138	126.9 Å²	126.9	72%	0.723	75%	0.746	S	S	*	*				65.5	125.4	92.3	-75.1	174.7	0	0	0	117.4
1794	Q	22.8	Very low	26.9	Very low	175 Å²	175	127.3 Å²	127.3	82%	0.818	74%	0.737	S	S	*	*			trans	47.8	145.6	135.9	-72.1	172.9	-10.4	0	0	120.5
1795	S	22.3	Very low	27.7	Very low	97 Å²	97	127.6 Å²	127.6	68%	0.678	73%	0.734	S	S	*	*			cis	-166.9	178.4	7.5	49	0	0	0	0	111.5
1796	S	22.5	Very low	28.4	Very low	100 Å²	100	125.4 Å²	125.4	70%	0.699	73%	0.727	S	S	*	*			trans	66.4	147.7	156.2	44.3	0	0	0	0	118.7
1797	T	23.8	Very low	29.1	Very low	117 Å²	117	123.2 Å²	123.2	72%	0.718	72%	0.715	S	S	*	*			cis	-162.6	148.1	-4.5	12.8	0	0	0	0	112.3
1798	N	23.9	Very low	30.2	Very low	138 Å²	138	122 Å²	122	74%	0.738	71%	0.708	S	S	*	*			trans	64.4	150.9	146.3	-62.2	-5.6	0	0	0	123
1799	N	24.8	Very low	31.2	Very low	157 Å²	157	121.4 Å²	121.4	84%	0.84	70%	0.699	S	S	*	*			trans	71.8	133.6	166.2	-64.1	-8.3	0	0	0	117.1
1800	T	27.2	Very low	32.4	Very low	129 Å²	129	124.8 Å²	124.8	79%	0.791	70%	0.697	S	S	*	*			cis	-130.8	155.5	0.7	47	0	0	0	0	113
1801	N	27.3	Very low	34.1	Very low	153 Å²	153	123.5 Å²	123.5	82%	0.818	69%	0.69	S	S	*	*			trans	-80.4	142.4	166.4	-69.8	-27.9	0	0	0	110.7
1802	N	31.5	Very low	36	Very low	154 Å²	154	118.5 Å²	118.5	82%	0.824	66%	0.664	S	S	*	*			trans	178.9	8.3	149.4	-97.1	-3.3	0	0	0	115.2
1803	N	33.2	Very low	37.8	Very low	134 Å²	134	118 Å²	118	72%	0.717	66%	0.662	S	S	*	*			trans	-113.3	46.4	-171	-73.4	-9.8	0	0	0	114.8
1804	H	37.2	Very low	39.9	Very low	150 Å²	150	113.9 Å²	113.9	69%	0.694	65%	0.648	S	S	*	*	S	Bend	trans	-112.5	-45.8	174.7	-104.8	33.3	0	0	0	114.5	A1806 N1807 V1808	H1804-A1806 VanDerWaalsContact C-N 3.34Å; H1804-A1806 PolarHBondContact O-N 3.3Å; H1804-N1807 PolarHBondContact O-N 3.25Å; H1804-V1808 PolarHBondContact O-N 3.2Å
1805	D	41	Very low	42.1	Very low	130 Å²	130	109 Å²	109	70%	0.695	63%	0.63	S	S	*	*	H	α-helix	trans	-68	-33.6	-175.2	-53.6	-59.2	0	0	0	113.1	N1807 V1808 L1809	D1805-N1807 PolarHBondContact O-N 3.4Å; D1805-V1808 PolarHBondContact O-N 2.76Å; D1805-L1809 PolarHBondContact O-N 3.45Å
1806	A	42	Very low	44.7	Very low	61 Å²	61	105.6 Å²	105.6	50%	0.504	60%	0.603	S	S	.	*	H	α-helix	trans	-59.7	-42.4	174.6	0	0	0	0	0	112.5	H1804 V1808 L1809 Q1810	H1804-A1806 VanDerWaalsContact C-N 3.34Å; H1804-A1806 PolarHBondContact O-N 3.3Å; A1806-V1808 VanDerWaalsContact C-N 3.34Å; A1806-V1808 PolarHBondContact O-N 3.06Å; A1806-L1809 PolarHBondContact O-N 3.47Å; A1806-Q1810 VanDerWaalsContact O-CB 3.29Å; A1806-Q1810 WeakPolarHBondContact O-CB 3.45Å; A1806-Q1810 PolarHBondContact O-N 3.39Å
1807	N	43.7	Very low	47	Very low	87 Å²	87	107.2 Å²	107.2	47%	0.465	60%	0.598	S	S	.	*	H	α-helix	trans	-67.7	-33.3	-180	-80.4	-21.1	0	0	0	112.2	H1804 D1805 T1811	H1804-N1807 PolarHBondContact O-N 3.25Å; D1805-N1807 PolarHBondContact O-N 3.4Å; N1807-T1811 WeakPolarHBondContact O-CB 3.46Å; N1807-T1811 PolarHBondContact O-N 3.39Å; N1807-T1811 PolarHBondContact O-OG1 2.96Å
1808	V	51.2	Low	49.2	Very low	91 Å²	91	108.5 Å²	108.5	55%	0.552	60%	0.595	S	S	*	*	H	α-helix	trans	-66.8	-49.9	176.6	179.2	0	0	0	0	110.2	H1804 D1805 A1806 Q1810 T1811 V1812	H1804-V1808 PolarHBondContact O-N 3.2Å; D1805-V1808 PolarHBondContact O-N 2.76Å; A1806-V1808 VanDerWaalsContact C-N 3.34Å; A1806-V1808 PolarHBondContact O-N 3.06Å; V1808-Q1810 VanDerWaalsContact C-N 3.33Å; V1808-Q1810 PolarHBondContact O-N 3.04Å; V1808-T1811 PolarHBondContact O-N 3.29Å; V1808-V1812 WeakPolarHBondContact O-CG2 3.04Å; V1808-V1812 PolarHBondContact O-N 3.26Å
1809	L	52.4	Low	51.5	Low	118 Å²	118	103.8 Å²	103.8	62%	0.618	57%	0.57	S	S	*	*	H	α-helix	trans	-61.4	-39.9	176.4	-82.9	164.9	0	0	0	112.6	D1805 A1806 V1812 S1813	D1805-L1809 PolarHBondContact O-N 3.45Å; A1806-L1809 PolarHBondContact O-N 3.47Å; L1809-V1812 PolarHBondContact O-N 3.45Å; L1809-S1813 VanDerWaalsContact O-CB 3.31Å; L1809-S1813 WeakPolarHBondContact O-CB 3.44Å; L1809-S1813 PolarHBondContact O-N 2.94Å
1810	Q	51.2	Low	53.7	Low	135 Å²	135	99.2 Å²	99.2	63%	0.631	55%	0.546	S	S	*	.	H	α-helix	trans	-67.6	-37.6	177.7	-163.5	168.3	19.5	0	0	112.1	A1806 V1808 A1814	A1806-Q1810 VanDerWaalsContact O-CB 3.29Å; A1806-Q1810 WeakPolarHBondContact O-CB 3.45Å; A1806-Q1810 PolarHBondContact O-N 3.39Å; V1808-Q1810 VanDerWaalsContact C-N 3.33Å; V1808-Q1810 PolarHBondContact O-N 3.04Å; Q1810-A1814 WeakPolarHBondContact O-CB 3.34Å; Q1810-A1814 PolarHBondContact O-N 3.18Å
1811	T	62.5	Low	55.8	Low	90 Å²	90	96.9 Å²	96.9	55%	0.552	53%	0.528	S	S	*	.	H	α-helix	trans	-66.3	-45.8	173.8	-55.4	0	0	0	0	111.3	N1807 V1808 S1813 A1814 T1815	N1807-T1811 WeakPolarHBondContact O-CB 3.46Å; N1807-T1811 PolarHBondContact O-N 3.39Å; N1807-T1811 PolarHBondContact O-OG1 2.96Å; V1808-T1811 PolarHBondContact O-N 3.29Å; T1811-S1813 PolarHBondContact O-N 3.36Å; T1811-A1814 WeakPolarHBondContact O-CB 2.85Å; T1811-A1814 PolarHBondContact O-N 3.32Å; T1811-T1815 PolarHBondContact O-N 3.25Å; T1811-T1815 PolarHBondContact O-OG1 3.02Å
1812	V	66.6	Low	57.9	Low	42 Å²	42	90.9 Å²	90.9	26%	0.255	50%	0.5	S	S	.	.	H	α-helix	trans	-60.2	-46.5	176.9	169	0	0	0	0	110.8	L1723 V1808 L1809 A1814 T1815 F1816	L1723-V1812 HydrophobicContact CD1-CG1 3.83Å; L1723-V1812 HydrophobicContact CD2-CG1 4.2Å; V1808-V1812 WeakPolarHBondContact O-CG2 3.04Å; V1808-V1812 PolarHBondContact O-N 3.26Å; L1809-V1812 PolarHBondContact O-N 3.45Å; V1812-A1814 VanDerWaalsContact C-N 3.33Å; V1812-A1814 PolarHBondContact O-N 3.42Å; V1812-T1815 WeakPolarHBondContact CA-OG1 3.35Å; V1812-T1815 PolarHBondContact O-N 3.3Å; V1812-T1815 VanDerWaalsContact O-N 3.16Å; V1812-T1815 PolarHBondContact O-OG1 3.13Å; V1812-F1816 HydrophobicContact CG1-CD2 3.87Å; V1812-F1816 HydrophobicContact CG1-CE2 3.84Å; V1812-F1816 WeakPolarHBondContact O-CD2 3.19Å; V1812-F1816 PolarHBondContact O-N 3.44Å
1813	S	64.6	Low	59.9	Low	82 Å²	82	85.7 Å²	85.7	57%	0.573	47%	0.471	S	S	*	.	H	α-helix	trans	-60	-41.1	176.9	-171	0	0	0	0	112.3	L1809 T1811 F1816 K1817	L1809-S1813 VanDerWaalsContact O-CB 3.31Å; L1809-S1813 WeakPolarHBondContact O-CB 3.44Å; L1809-S1813 PolarHBondContact O-N 2.94Å; T1811-S1813 PolarHBondContact O-N 3.36Å; S1813-F1816 PolarHBondContact O-N 2.83Å; S1813-K1817 PolarHBondContact O-N 2.7Å
1814	A	66.4	Low	61.7	Low	51 Å²	51	81.7 Å²	81.7	42%	0.421	46%	0.457	S	S	.	.	H	α-helix	trans	-61.6	-45.2	173.1	0	0	0	0	0	112.3	Q1810 T1811 V1812 F1816 K1817 E1818	Q1810-A1814 WeakPolarHBondContact O-CB 3.34Å; Q1810-A1814 PolarHBondContact O-N 3.18Å; T1811-A1814 WeakPolarHBondContact O-CB 2.85Å; T1811-A1814 PolarHBondContact O-N 3.32Å; V1812-A1814 VanDerWaalsContact C-N 3.33Å; V1812-A1814 PolarHBondContact O-N 3.42Å; A1814-F1816 PolarHBondContact O-N 3.24Å; A1814-K1817 WeakPolarHBondContact O-CB 3.32Å; A1814-K1817 PolarHBondContact O-N 3.49Å; A1814-K1817 VanDerWaalsContact O-N 3.15Å; A1814-E1818 PolarHBondContact O-N 3.48Å
1815	T	69.3	Low	63.5	Low	72 Å²	72	83.4 Å²	83.4	44%	0.442	46%	0.457	S	S	.	.	H	α-helix	trans	-65	-35.1	178.8	54.9	0	0	0	0	113.5	T1811 V1812 L1819	T1811-T1815 PolarHBondContact O-N 3.25Å; T1811-T1815 PolarHBondContact O-OG1 3.02Å; V1812-T1815 WeakPolarHBondContact CA-OG1 3.35Å; V1812-T1815 PolarHBondContact O-N 3.3Å; V1812-T1815 VanDerWaalsContact O-N 3.16Å; V1812-T1815 PolarHBondContact O-OG1 3.13Å; T1815-L1819 WeakPolarHBondContact O-CB 3.41Å; T1815-L1819 PolarHBondContact O-N 3.35Å
1816	F	75.6	Confident	64.9	Low	26 Å²	26	78.3 Å²	78.3	11%	0.114	43%	0.43	C	S	.	.	H	α-helix	trans	-68.1	-37.9	172.2	-84	-70.2	0	0	0	112.1	L1719 R1720 L1723 V1812 S1813 A1814 L1819 D1820	L1719-F1816 HydrophobicContact CB-CE1 4.08Å; L1719-F1816 HydrophobicContact CB-CZ 3.99Å; R1720-F1816 HydrophobicContact CG-CD1 4.31Å; R1720-F1816 HydrophobicContact CG-CE1 3.58Å; R1720-F1816 HydrophobicContact CG-CZ 4.08Å; L1723-F1816 HydrophobicContact CD2-CD2 4.5Å; L1723-F1816 HydrophobicContact CD2-CE2 3.83Å; L1723-F1816 HydrophobicContact CD2-CZ 4.46Å; V1812-F1816 HydrophobicContact CG1-CD2 3.87Å; V1812-F1816 HydrophobicContact CG1-CE2 3.84Å; V1812-F1816 WeakPolarHBondContact O-CD2 3.19Å; V1812-F1816 PolarHBondContact O-N 3.44Å; S1813-F1816 PolarHBondContact O-N 2.83Å; A1814-F1816 PolarHBondContact O-N 3.24Å; F1816-L1819 PolarHBondContact O-N 3.16Å; F1816-D1820 PolarHBondContact O-N 2.7Å
1817	K	72	Confident	66.4	Low	135 Å²	135	81.1 Å²	81.1	59%	0.587	43%	0.433	S	S	*	.	H	α-helix	trans	-62.6	-44.9	175.7	-173.3	-176.3	174.3	-173	0	112.4	S1813 A1814 L1819 D1820 D1821	S1813-K1817 PolarHBondContact O-N 2.7Å; A1814-K1817 WeakPolarHBondContact O-CB 3.32Å; A1814-K1817 PolarHBondContact O-N 3.49Å; A1814-K1817 VanDerWaalsContact O-N 3.15Å; K1817-L1819 PolarHBondContact O-N 2.95Å; K1817-D1820 PolarHBondContact O-N 2.86Å; K1817-D1821 VanDerWaalsContact O-CB 3.32Å; K1817-D1821 WeakPolarHBondContact O-CB 3.47Å; K1817-D1821 PolarHBondContact O-N 2.67Å
1818	E	70.3	Confident	68.1	Low	144 Å²	144	82.2 Å²	82.2	67%	0.673	44%	0.438	S	S	*	.	H	α-helix	trans	-59.8	-32.3	175.5	-71	-171.4	155.8	0	0	112.5	A1814 A1822	A1814-E1818 PolarHBondContact O-N 3.48Å; E1818-A1822 WeakPolarHBondContact O-CB 3.18Å; E1818-A1822 PolarHBondContact O-N 3.46Å
1819	L	71.3	Confident	69.4	Low	38 Å²	38	81.6 Å²	81.6	20%	0.199	43%	0.429	C	S	.	.	H	α-helix	trans	-81.1	-38.3	-177.5	-158.5	59.5	0	0	0	112.2	I1716 L1719 T1815 F1816 K1817 A1822 M1823	I1716-L1819 HydrophobicContact CD1-CD2 4.37Å; I1716-L1819 HydrophobicContact CD1-CG 3.92Å; I1716-L1819 HydrophobicContact CG1-CD2 3.46Å; I1716-L1819 VanDerWaalsContact CG1-CD2 3.46Å; I1716-L1819 HydrophobicContact CG1-CG 3.56Å; L1719-L1819 HydrophobicContact CD1-CD2 3.77Å; T1815-L1819 WeakPolarHBondContact O-CB 3.41Å; T1815-L1819 PolarHBondContact O-N 3.35Å; F1816-L1819 PolarHBondContact O-N 3.16Å; K1817-L1819 PolarHBondContact O-N 2.95Å; L1819-A1822 WeakPolarHBondContact O-CB 3.47Å; L1819-A1822 PolarHBondContact O-N 3.25Å; L1819-M1823 PolarHBondContact O-N 2.77Å; L1819-M1823 VanDerWaalsContact O-N 3.15Å
1820	D	72.1	Confident	70.6	Confident	62 Å²	62	78.9 Å²	78.9	33%	0.332	41%	0.413	S	S	.	.	H	α-helix	trans	-66.1	-40.6	169.3	-66.5	-29.3	0	0	0	110.5	R1720 F1816 K1817 A1822 M1823 A1824	R1720-D1820 IonicContact NH2-OD1 3.3Å; R1720-D1820 PolarHBondContact NH2-OD1 3.15Å; R1720-D1820 IonicContact NH2-OD2 2.91Å; R1720-D1820 PolarHBondContact NH2-OD2 2.97Å; R1720-D1820 VanDerWaalsContact NH2-OD2 3.09Å; F1816-D1820 PolarHBondContact O-N 2.7Å; K1817-D1820 PolarHBondContact O-N 2.86Å; D1820-A1822 PolarHBondContact O-N 2.61Å; D1820-M1823 PolarHBondContact O-N 2.64Å; D1820-A1824 PolarHBondContact O-N 2.82Å
1821	D	71.2	Confident	71.7	Confident	79 Å²	79	74.2 Å²	74.2	42%	0.422	40%	0.396	S	S	.	.	H	α-helix	trans	-64.4	-24.3	172.1	-87.2	-29.8	0	0	0	112.9	K1817 R1825	K1817-D1821 VanDerWaalsContact O-CB 3.32Å; K1817-D1821 WeakPolarHBondContact O-CB 3.47Å; K1817-D1821 PolarHBondContact O-N 2.67Å; D1821-R1825 WeakPolarHBondContact O-CD 3.39Å; D1821-R1825 WeakPolarHBondContact O-CG 3.43Å; D1821-R1825 PolarHBondContact O-NE 3.42Å
1822	A	70	Confident	72.5	Confident	28 Å²	28	75.4 Å²	75.4	23%	0.231	40%	0.395	C	S	.	.	H	α-helix	trans	-77.3	-43.2	174.7	0	0	0	0	0	112	E1818 L1819 D1820 A1824 R1825 L1826	E1818-A1822 WeakPolarHBondContact O-CB 3.18Å; E1818-A1822 PolarHBondContact O-N 3.46Å; L1819-A1822 WeakPolarHBondContact O-CB 3.47Å; L1819-A1822 PolarHBondContact O-N 3.25Å; D1820-A1822 PolarHBondContact O-N 2.61Å; A1822-A1824 VanDerWaalsContact C-N 3.35Å; A1822-A1824 PolarHBondContact O-N 2.93Å; A1822-R1825 WeakPolarHBondContact O-CB 3.46Å; A1822-R1825 PolarHBondContact O-N 3.34Å; A1822-R1825 VanDerWaalsContact O-N 3.17Å; A1822-L1826 PolarHBondContact O-N 3.41Å
1823	M	74	Confident	73	Confident	44 Å²	44	74.9 Å²	74.9	22%	0.217	39%	0.391	C	S	.	.	H	α-helix	trans	-57.5	-46.8	174.2	-72.7	-157	-61	0	0	111.8	E1713 I1716 L1819 D1820 R1825 L1826 E1827	E1713-M1823 HydrophobicContact CG-SD 3.99Å; I1716-M1823 HydrophobicContact CD1-CE 3.73Å; I1716-M1823 HydrophobicContact CD1-CG 3.5Å; I1716-M1823 VanDerWaalsContact CD1-CG 3.5Å; I1716-M1823 HydrophobicContact CD1-SD 3.31Å; I1716-M1823 WeakPolarHBondContact CD1-SD 3.26Å; L1819-M1823 PolarHBondContact O-N 2.77Å; L1819-M1823 VanDerWaalsContact O-N 3.15Å; D1820-M1823 PolarHBondContact O-N 2.64Å; M1823-R1825 PolarHBondContact O-N 2.88Å; M1823-R1825 VanDerWaalsContact O-N 3.1Å; M1823-L1826 PolarHBondContact O-N 2.94Å; M1823-E1827 PolarHBondContact O-N 3.32Å
1824	A	71.8	Confident	73.6	Confident	51 Å²	51	75.5 Å²	75.5	42%	0.421	39%	0.387	S	S	.	.	H	α-helix	trans	-58.2	-27.3	179.9	0	0	0	0	0	113.3	D1820 A1822 L1828	D1820-A1824 PolarHBondContact O-N 2.82Å; A1822-A1824 VanDerWaalsContact C-N 3.35Å; A1822-A1824 PolarHBondContact O-N 2.93Å; A1824-L1828 PolarHBondContact O-N 2.72Å
1825	R	73.4	Confident	74.2	Confident	185 Å²	185	80.3 Å²	80.3	70%	0.698	39%	0.394	S	S	*	.	H	α-helix	trans	-77.5	-37.5	174.4	-65.8	167.9	-170.1	-126.6	4	112.4	D1821 A1822 M1823 L1828 E1829	D1821-R1825 WeakPolarHBondContact O-CD 3.39Å; D1821-R1825 WeakPolarHBondContact O-CG 3.43Å; D1821-R1825 PolarHBondContact O-NE 3.42Å; A1822-R1825 WeakPolarHBondContact O-CB 3.46Å; A1822-R1825 PolarHBondContact O-N 3.34Å; A1822-R1825 VanDerWaalsContact O-N 3.17Å; M1823-R1825 PolarHBondContact O-N 2.88Å; M1823-R1825 VanDerWaalsContact O-N 3.1Å; R1825-L1828 WeakPolarHBondContact O-CB 3.05Å; R1825-L1828 PolarHBondContact O-N 2.55Å; R1825-E1829 PolarHBondContact O-N 3.48Å
1826	L	72.1	Confident	74.5	Confident	23 Å²	23	79.8 Å²	79.8	12%	0.12	39%	0.387	C	S	.	.	H	α-helix	trans	-70.1	-38.3	175.6	-69.9	178	0	0	0	112.2	R1708 L1709 Q1712 A1822 M1823 L1828 E1829 Q1830	R1708-L1826 HydrophobicContact CB-CD1 4.2Å; R1708-L1826 HydrophobicContact CB-CD2 4.47Å; L1709-L1826 HydrophobicContact CD1-CB 4.07Å; L1709-L1826 HydrophobicContact CG-CB 3.96Å; Q1712-L1826 HydrophobicContact CG-CD1 4.33Å; A1822-L1826 PolarHBondContact O-N 3.41Å; M1823-L1826 PolarHBondContact O-N 2.94Å; L1826-L1828 VanDerWaalsContact C-N 3.29Å; L1826-L1828 PolarHBondContact O-N 3.29Å; L1826-E1829 PolarHBondContact O-N 2.97Å; L1826-Q1830 WeakPolarHBondContact O-CB 3.21Å; L1826-Q1830 PolarHBondContact O-N 3.48Å
1827	E	72.5	Confident	74.7	Confident	121 Å²	121	79.2 Å²	79.2	57%	0.565	38%	0.384	S	S	*	.	H	α-helix	trans	-58	-43.8	170.1	-72.9	-167.4	134.7	0	0	111.2	L1709 M1823 Q1830 S1831	L1709-E1827 HydrophobicContact CD1-CB 4.48Å; L1709-E1827 HydrophobicContact CD1-CG 3.91Å; M1823-E1827 PolarHBondContact O-N 3.32Å; E1827-Q1830 PolarHBondContact O-N 2.84Å; E1827-S1831 WeakPolarHBondContact O-CB 3.32Å; E1827-S1831 PolarHBondContact O-N 3.14Å
1828	L	80.1	Confident	74.9	Confident	109 Å²	109	75.6 Å²	75.6	57%	0.571	38%	0.38	S	S	*	.	H	α-helix	trans	-62.2	-48.5	177.3	-167.2	74.6	0	0	0	111.5	A1824 R1825 L1826 Q1830 S1831 E1832	A1824-L1828 PolarHBondContact O-N 2.72Å; R1825-L1828 WeakPolarHBondContact O-CB 3.05Å; R1825-L1828 PolarHBondContact O-N 2.55Å; L1826-L1828 VanDerWaalsContact C-N 3.29Å; L1826-L1828 PolarHBondContact O-N 3.29Å; L1828-Q1830 PolarHBondContact O-N 2.78Å; L1828-S1831 PolarHBondContact O-N 3.31Å; L1828-S1831 VanDerWaalsContact O-N 3.14Å; L1828-S1831 PolarHBondContact O-OG 3.4Å; L1828-E1832 WeakPolarHBondContact O-CG 2.99Å; L1828-E1832 PolarHBondContact O-N 3.35Å
1829	E	78.5	Confident	75.3	Confident	79 Å²	79	75.8 Å²	75.8	37%	0.369	37%	0.374	S	S	.	.	H	α-helix	trans	-55.7	-48.5	176.2	-174.5	-177.8	-171.4	0	0	111.2	R1708 R1825 L1826 S1831 E1832 L1833	R1708-E1829 IonicContact NH1-OE1 3.44Å; R1708-E1829 IonicContact NH1-OE2 3.57Å; R1825-E1829 PolarHBondContact O-N 3.48Å; L1826-E1829 PolarHBondContact O-N 2.97Å; E1829-S1831 VanDerWaalsContact C-N 3.32Å; E1829-S1831 PolarHBondContact O-N 3.39Å; E1829-E1832 PolarHBondContact O-N 3.45Å; E1829-L1833 HydrophobicContact CG-CD1 4.15Å; E1829-L1833 WeakPolarHBondContact O-CG 3.22Å; E1829-L1833 PolarHBondContact O-N 3.17Å; E1829-L1833 VanDerWaalsContact O-N 3.08Å
1830	Q	78.1	Confident	75.5	Confident	60 Å²	60	74.4 Å²	74.4	28%	0.28	37%	0.367	S	S	.	.	H	α-helix	trans	-60.4	-41.4	176.8	-166.4	-167	56.7	0	0	111.7	A1705 L1826 E1827 L1828 L1833 L1834	A1705-Q1830 HydrophobicContact CB-CB 4.35Å; L1826-Q1830 WeakPolarHBondContact O-CB 3.21Å; L1826-Q1830 PolarHBondContact O-N 3.48Å; E1827-Q1830 PolarHBondContact O-N 2.84Å; L1828-Q1830 PolarHBondContact O-N 2.78Å; Q1830-L1833 PolarHBondContact O-N 3.47Å; Q1830-L1834 WeakPolarHBondContact O-CG 3.48Å; Q1830-L1834 PolarHBondContact O-N 3.24Å; Q1830-L1834 VanDerWaalsContact O-N 3.13Å
1831	S	73	Confident	75.8	Confident	38 Å²	38	76.8 Å²	76.8	27%	0.266	37%	0.371	S	S	.	.	H	α-helix	trans	-66.8	-36.5	179.1	86.1	0	0	0	0	113.1	E1827 L1828 E1829 R1835	E1827-S1831 WeakPolarHBondContact O-CB 3.32Å; E1827-S1831 PolarHBondContact O-N 3.14Å; L1828-S1831 PolarHBondContact O-N 3.31Å; L1828-S1831 VanDerWaalsContact O-N 3.14Å; L1828-S1831 PolarHBondContact O-OG 3.4Å; E1829-S1831 VanDerWaalsContact C-N 3.32Å; E1829-S1831 PolarHBondContact O-N 3.39Å; S1831-R1835 WeakPolarHBondContact O-CG 3.43Å; S1831-R1835 PolarHBondContact O-N 3.21Å; S1831-R1835 VanDerWaalsContact O-N 3.16Å
1832	E	78.9	Confident	76.1	Confident	114 Å²	114	75.7 Å²	75.7	53%	0.533	37%	0.373	S	S	.	.	H	α-helix	trans	-69.2	-43.2	176.8	-69.6	-123.1	118.5	0	0	111.4	L1828 E1829 L1834 R1835 E1836	L1828-E1832 WeakPolarHBondContact O-CG 2.99Å; L1828-E1832 PolarHBondContact O-N 3.35Å; E1829-E1832 PolarHBondContact O-N 3.45Å; E1832-L1834 VanDerWaalsContact C-N 3.32Å; E1832-L1834 PolarHBondContact O-N 3.26Å; E1832-R1835 WeakPolarHBondContact O-CB 3.3Å; E1832-R1835 PolarHBondContact O-N 3.22Å; E1832-R1835 VanDerWaalsContact O-N 3.12Å; E1832-E1836 PolarHBondContact O-N 3.32Å
1833	L	78.3	Confident	76.3	Confident	32 Å²	32	80.1 Å²	80.1	17%	0.168	38%	0.384	C	S	.	.	H	α-helix	trans	-61.4	-40	176.9	-70	166.5	0	0	0	111.7	D1701 A1702 A1705 E1829 Q1830 R1835 E1836 Q1837	D1701-L1833 HydrophobicContact CB-CD1 3.98Å; D1701-L1833 HydrophobicContact CB-CD2 3.88Å; A1702-L1833 HydrophobicContact CB-CB 4.1Å; A1705-L1833 HydrophobicContact CB-CD1 4.17Å; E1829-L1833 HydrophobicContact CG-CD1 4.15Å; E1829-L1833 WeakPolarHBondContact O-CG 3.22Å; E1829-L1833 PolarHBondContact O-N 3.17Å; E1829-L1833 VanDerWaalsContact O-N 3.08Å; Q1830-L1833 PolarHBondContact O-N 3.47Å; L1833-R1835 PolarHBondContact O-N 2.86Å; L1833-E1836 PolarHBondContact O-N 3.09Å; L1833-Q1837 WeakPolarHBondContact O-CG 3.3Å; L1833-Q1837 PolarHBondContact O-N 2.92Å
1834	L	76.7	Confident	76.4	Confident	95 Å²	95	79.2 Å²	79.2	50%	0.497	38%	0.38	S	S	.	.	H	α-helix	trans	-65.1	-36.1	174	-71.5	170.7	0	0	0	112.9	Q1830 E1832 A1838	Q1830-L1834 WeakPolarHBondContact O-CG 3.48Å; Q1830-L1834 PolarHBondContact O-N 3.24Å; Q1830-L1834 VanDerWaalsContact O-N 3.13Å; E1832-L1834 VanDerWaalsContact C-N 3.32Å; E1832-L1834 PolarHBondContact O-N 3.26Å; L1834-A1838 PolarHBondContact O-N 3Å
1835	R	79	Confident	76.4	Confident	152 Å²	152	80.5 Å²	80.5	57%	0.574	38%	0.382	S	S	*	.	H	α-helix	trans	-66.8	-38.5	172.9	-70.9	167.7	178.3	-178.5	1.4	111.8	S1831 E1832 L1833 A1838 R1839	S1831-R1835 WeakPolarHBondContact O-CG 3.43Å; S1831-R1835 PolarHBondContact O-N 3.21Å; S1831-R1835 VanDerWaalsContact O-N 3.16Å; E1832-R1835 WeakPolarHBondContact O-CB 3.3Å; E1832-R1835 PolarHBondContact O-N 3.22Å; E1832-R1835 VanDerWaalsContact O-N 3.12Å; L1833-R1835 PolarHBondContact O-N 2.86Å; R1835-A1838 WeakPolarHBondContact O-CB 3.44Å; R1835-A1838 PolarHBondContact O-N 3.47Å; R1835-R1839 PolarHBondContact O-N 3.18Å; R1835-R1839 VanDerWaalsContact O-N 3.12Å
1836	E	75.8	Confident	76.2	Confident	61 Å²	61	75.1 Å²	75.1	29%	0.285	38%	0.377	S	S	.	.	H	α-helix	trans	-68.3	-41.4	178.6	-161.9	60.4	-156.2	0	0	111.9	E1832 L1833 A1838 R1839 I1840	E1832-E1836 PolarHBondContact O-N 3.32Å; L1833-E1836 PolarHBondContact O-N 3.09Å; E1836-A1838 PolarHBondContact O-N 3.12Å; E1836-R1839 WeakPolarHBondContact O-CB 3.44Å; E1836-R1839 PolarHBondContact O-N 3.31Å; E1836-R1839 VanDerWaalsContact O-N 3.1Å; E1836-R1839 WeakPolarHBondContact OE2-CD 3.42Å; E1836-R1839 IonicContact OE2-CZ 3.09Å; E1836-R1839 IonicContact OE2-NE 3.56Å; E1836-R1839 IonicContact OE2-NH1 3.2Å; E1836-R1839 PolarHBondContact OE2-NH1 3.12Å; E1836-I1840 HydrophobicContact CG-CD1 4.15Å; E1836-I1840 WeakPolarHBondContact O-CG1 3.44Å; E1836-I1840 PolarHBondContact O-N 2.96Å
1837	Q	80.1	Confident	76.1	Confident	13 Å²	13	75 Å²	75	6%	0.061	38%	0.38	C	S	.	.	H	α-helix	trans	-55.8	-38.2	171.1	-69.7	-178.7	36	0	0	112.5	L1695 S1698 L1833 R1841	L1695-Q1837 HydrophobicContact CD1-CB 3.91Å; L1695-Q1837 HydrophobicContact CD1-CG 4.06Å; S1698-Q1837 PolarHBondContact O-NE2 2.98Å; S1698-Q1837 VanDerWaalsContact OG-CG 3.32Å; S1698-Q1837 WeakPolarHBondContact OG-CG 3.48Å; L1833-Q1837 WeakPolarHBondContact O-CG 3.3Å; L1833-Q1837 PolarHBondContact O-N 2.92Å; Q1837-R1841 WeakPolarHBondContact O-CB 3.37Å; Q1837-R1841 WeakPolarHBondContact O-CG 3.5Å; Q1837-R1841 PolarHBondContact O-N 3.12Å
1838	A	75.9	Confident	75.3	Confident	60 Å²	60	76.5 Å²	76.5	50%	0.496	38%	0.38	S	S	.	.	H	α-helix	trans	-66.7	-42	176.6	0	0	0	0	0	112.1	L1834 R1835 E1836 R1841 A1842	L1834-A1838 PolarHBondContact O-N 3Å; R1835-A1838 WeakPolarHBondContact O-CB 3.44Å; R1835-A1838 PolarHBondContact O-N 3.47Å; E1836-A1838 PolarHBondContact O-N 3.12Å; A1838-R1841 PolarHBondContact O-N 3.45Å; A1838-A1842 PolarHBondContact O-N 3.3Å
1839	R	78.5	Confident	73.4	Confident	148 Å²	148	76.2 Å²	76.2	56%	0.558	39%	0.385	S	S	*	.	H	α-helix	trans	-60.7	-47.9	174.4	-69.6	167.5	176.7	157.5	-0.2	111.9	R1835 E1836 R1841 A1842 R1843	R1835-R1839 PolarHBondContact O-N 3.18Å; R1835-R1839 VanDerWaalsContact O-N 3.12Å; E1836-R1839 WeakPolarHBondContact O-CB 3.44Å; E1836-R1839 PolarHBondContact O-N 3.31Å; E1836-R1839 VanDerWaalsContact O-N 3.1Å; E1836-R1839 WeakPolarHBondContact OE2-CD 3.42Å; E1836-R1839 IonicContact OE2-CZ 3.09Å; E1836-R1839 IonicContact OE2-NE 3.56Å; E1836-R1839 IonicContact OE2-NH1 3.2Å; E1836-R1839 PolarHBondContact OE2-NH1 3.12Å; R1839-R1841 PolarHBondContact O-N 3.15Å; R1839-A1842 WeakPolarHBondContact O-CB 3.44Å; R1839-A1842 PolarHBondContact O-N 2.9Å; R1839-R1843 PolarHBondContact O-N 3.42Å
1840	I	75.7	Confident	71.4	Confident	8 Å²	8	81 Å²	81	4%	0.041	41%	0.405	C	S	.	.	H	α-helix	trans	-64.7	-42.1	-179.2	-59.3	162.9	0	0	0	110.6	L1691 E1694 L1695 E1836 A1842 R1843 I1844	L1691-I1840 HydrophobicContact CB-CG2 4.38Å; L1691-I1840 HydrophobicContact CD2-CG2 4.41Å; L1691-I1840 WeakPolarHBondContact O-CG2 3.42Å; E1694-I1840 HydrophobicContact CB-CD1 4.19Å; E1694-I1840 HydrophobicContact CB-CG2 4.45Å; L1695-I1840 HydrophobicContact CB-CG2 3.8Å; L1695-I1840 HydrophobicContact CD1-CB 4.4Å; E1836-I1840 HydrophobicContact CG-CD1 4.15Å; E1836-I1840 WeakPolarHBondContact O-CG1 3.44Å; E1836-I1840 PolarHBondContact O-N 2.96Å; I1840-A1842 VanDerWaalsContact C-N 3.31Å; I1840-A1842 PolarHBondContact O-N 2.99Å; I1840-R1843 PolarHBondContact O-N 3.32Å; I1840-R1843 VanDerWaalsContact O-N 3.17Å; I1840-I1844 HydrophobicContact CG2-CD1 4.24Å; I1840-I1844 WeakPolarHBondContact O-CG1 3.4Å; I1840-I1844 PolarHBondContact O-N 3.37Å
1841	R	78.4	Confident	69.1	Low	113 Å²	113	87.2 Å²	87.2	43%	0.426	43%	0.433	S	S	.	.	H	α-helix	trans	-58.6	-40.5	173.3	-71.9	172.9	-156.8	-167.9	11.5	112.1	L1695 Q1837 A1838 R1839 I1844 V1845	L1695-R1841 HydrophobicContact CD1-CG 3.95Å; L1695-R1841 HydrophobicContact CD2-CG 3.72Å; Q1837-R1841 WeakPolarHBondContact O-CB 3.37Å; Q1837-R1841 WeakPolarHBondContact O-CG 3.5Å; Q1837-R1841 PolarHBondContact O-N 3.12Å; A1838-R1841 PolarHBondContact O-N 3.45Å; R1839-R1841 PolarHBondContact O-N 3.15Å; R1841-I1844 PolarHBondContact O-N 2.86Å; R1841-V1845 WeakPolarHBondContact O-CG2 3.02Å; R1841-V1845 PolarHBondContact O-N 3.01Å; R1841-V1845 VanDerWaalsContact O-N 3.15Å
1842	A	76.7	Confident	67.1	Low	56 Å²	56	93.3 Å²	93.3	46%	0.463	46%	0.462	S	S	.	.	H	α-helix	trans	-63.7	-40.9	175.7	0	0	0	0	0	112.4	A1838 R1839 I1840 V1845 A1846	A1838-A1842 PolarHBondContact O-N 3.3Å; R1839-A1842 WeakPolarHBondContact O-CB 3.44Å; R1839-A1842 PolarHBondContact O-N 2.9Å; I1840-A1842 VanDerWaalsContact C-N 3.31Å; I1840-A1842 PolarHBondContact O-N 2.99Å; A1842-V1845 PolarHBondContact O-N 3.39Å; A1842-A1846 PolarHBondContact O-N 3.01Å
1843	R	75.2	Confident	64.6	Low	120 Å²	120	94.3 Å²	94.3	45%	0.453	48%	0.476	S	S	.	.	H	α-helix	trans	-62	-42.3	174.5	-67.5	-179.6	70.1	-167.5	-4.4	112.3	E1687 L1691 R1839 I1840 V1845 A1846 A1847	E1687-R1843 IonicContact OE1-NH2 3.08Å; E1687-R1843 PolarHBondContact OE1-NH2 3.06Å; L1691-R1843 HydrophobicContact CD1-CB 3.93Å; L1691-R1843 HydrophobicContact CD2-CB 4.08Å; R1839-R1843 PolarHBondContact O-N 3.42Å; I1840-R1843 PolarHBondContact O-N 3.32Å; I1840-R1843 VanDerWaalsContact O-N 3.17Å; R1843-V1845 VanDerWaalsContact C-N 3.27Å; R1843-V1845 PolarHBondContact O-N 3.37Å; R1843-A1846 PolarHBondContact O-N 2.87Å; R1843-A1847 WeakPolarHBondContact O-CB 3.31Å; R1843-A1847 PolarHBondContact O-N 3.28Å
1844	I	76.1	Confident	62.2	Low	26 Å²	26	98.1 Å²	98.1	13%	0.133	51%	0.506	C	S	.	.	H	α-helix	trans	-61.7	-34.2	175.4	-64.7	167.5	0	0	0	112	L1691 R1692 L1695 I1840 R1841	L1691-I1844 HydrophobicContact CB-CD1 4.16Å; L1691-I1844 HydrophobicContact CB-CG1 3.56Å; L1691-I1844 HydrophobicContact CD1-CG1 4.35Å; R1692-I1844 HydrophobicContact CG-CD1 4.16Å; L1695-I1844 HydrophobicContact CD2-CD1 3.97Å; I1840-I1844 HydrophobicContact CG2-CD1 4.24Å; I1840-I1844 WeakPolarHBondContact O-CG1 3.4Å; I1840-I1844 PolarHBondContact O-N 3.37Å; R1841-I1844 PolarHBondContact O-N 2.86Å
1845	V	70.5	Confident	59.8	Low	77 Å²	77	99.4 Å²	99.4	47%	0.467	52%	0.523	S	S	.	.	H	α-helix	trans	-72.4	-42.3	175.8	173.2	0	0	0	0	111.3	A565 R1841 A1842 R1843 A1847 R1848	A565-V1845 HydrophobicContact CB-CG2 3.7Å; R1841-V1845 WeakPolarHBondContact O-CG2 3.02Å; R1841-V1845 PolarHBondContact O-N 3.01Å; R1841-V1845 VanDerWaalsContact O-N 3.15Å; A1842-V1845 PolarHBondContact O-N 3.39Å; R1843-V1845 VanDerWaalsContact C-N 3.27Å; R1843-V1845 PolarHBondContact O-N 3.37Å; V1845-A1847 VanDerWaalsContact C-N 3.31Å; V1845-A1847 PolarHBondContact O-N 3.45Å; V1845-R1848 PolarHBondContact O-N 3.42Å
1846	A	71	Confident	57.2	Low	72 Å²	72	97.6 Å²	97.6	60%	0.595	53%	0.532	S	S	*	.	H	α-helix	trans	-65.1	-31.9	177.8	0	0	0	0	0	113.1	A1842 R1843 R1848	A1842-A1846 PolarHBondContact O-N 3.01Å; R1843-A1846 PolarHBondContact O-N 2.87Å; A1846-R1848 PolarHBondContact O-N 2.93Å
1847	A	68.2	Low	54.9	Low	21 Å²	21	103.3 Å²	103.3	17%	0.174	56%	0.556	C	S	.	*	T	Hydrogen-bonded Turn	trans	-75.8	7.6	-179.1	0	0	0	0	0	115.2	V1688 R1843 V1845	V1688-A1847 HydrophobicContact CG2-CB 3.73Å; R1843-A1847 WeakPolarHBondContact O-CB 3.31Å; R1843-A1847 PolarHBondContact O-N 3.28Å; V1845-A1847 VanDerWaalsContact C-N 3.31Å; V1845-A1847 PolarHBondContact O-N 3.45Å
1848	R	57.3	Low	52.5	Low	153 Å²	153	111.9 Å²	111.9	58%	0.577	60%	0.596	S	S	*	*	S	Bend	trans	-93.4	131.5	175.7	-76.3	-176.7	167.3	179	-3.6	111.6	V1845 A1846 K1850	V1845-R1848 PolarHBondContact O-N 3.42Å; A1846-R1848 PolarHBondContact O-N 2.93Å; R1848-K1850 PolarHBondContact O-N 2.8Å
1849	P	39.6	Very low	50	Low	102 Å²	102	113.5 Å²	113.5	66%	0.662	60%	0.603	S	S	*	*			trans	-71.2	128.6	-179.5	29.2	-32.4	0	0	0	111.1	L1684 Q1851	L1684-P1849 HydrophobicContact CD2-CG 4.21Å; P1849-Q1851 PolarHBondContact O-N 2.65Å
1850	K	35.7	Very low	47.5	Very low	181 Å²	181	113.8 Å²	113.8	79%	0.787	62%	0.616	S	S	*	*			trans	-75.1	97.4	173.6	-66.4	175.7	-178.1	171.7	0	109.4	R1848 L1852	R1848-K1850 PolarHBondContact O-N 2.8Å; K1850-L1852 PolarHBondContact O-N 3.26Å
1851	Q	31	Very low	45.2	Very low	190 Å²	190	118.1 Å²	118.1	89%	0.888	65%	0.647	S	S	*	*			trans	-68.7	121	167.5	-82	-170.4	-20.5	0	0	110.4	P1849	P1849-Q1851 PolarHBondContact O-N 2.65Å
1852	L	29.7	Very low	42.7	Very low	166 Å²	166	119.7 Å²	119.7	87%	0.869	66%	0.664	S	S	*	*			trans	-139.8	134.9	167.1	-98.5	170.3	0	0	0	109.6	K1850	K1850-L1852 PolarHBondContact O-N 3.26Å
1853	T	26.7	Very low	40.2	Very low	135 Å²	135	121.7 Å²	121.7	83%	0.828	67%	0.674	S	S	*	*			trans	-106.7	128.2	-175.4	51.7	0	0	0	0	111.7
1854	S	28.8	Very low	37.9	Very low	112 Å²	112	123 Å²	123	78%	0.783	69%	0.69	S	S	*	*			trans	-170.8	98.7	146.9	54.9	0	0	0	0	114.6
1855	S	26.4	Very low	35.5	Very low	122 Å²	122	130 Å²	130	85%	0.853	73%	0.726	S	S	*	*				36.6	122.4	127.4	-43.8	0	0	0	0	122.7
1856	C	24.5	Very low	33.3	Very low	114 Å²	114	130.5 Å²	130.5	77%	0.77	73%	0.734	S	S	*	*			trans	-157.3	150.6	147.5	-102.7	0	0	0	0	107.6
1857	K	27.1	Very low	31.3	Very low	180 Å²	180	138.3 Å²	138.3	78%	0.783	75%	0.748	S	S	*	*			cis	-173.8	132.6	-18.2	-130.5	-174.6	-168.3	179.7	0	108.3
1858	Q	28.9	Very low	29.2	Very low	193 Å²	193	141.8 Å²	141.8	90%	0.902	77%	0.771	S	S	*	*				166.7	165.6	127.7	-95.5	175.7	-68.4	0	0	112.1
1859	S	23.7	Very low	27.7	Very low	94 Å²	94	139.4 Å²	139.4	66%	0.657	78%	0.778	S	S	*	*			trans	-97.2	163.6	-178.9	52.4	0	0	0	0	111.4
1860	D	26.9	Very low	27.1	Very low	155 Å²	155	143.9 Å²	143.9	83%	0.829	79%	0.787	S	S	*	*				-165.8	173	103	-88.2	-4.8	0	0	0	110.5
1861	S	26.8	Very low	26.5	Very low	98 Å²	98	140.9 Å²	140.9	69%	0.685	79%	0.789	S	S	*	*			trans	-136.9	145.4	-158.1	56.9	0	0	0	0	114.8
1862	N	26.1	Very low	26.3	Very low	146 Å²	146	136 Å²	136	78%	0.781	78%	0.781	S	S	*	*			trans	64.2	118.4	154.3	-60.5	-15.7	0	0	0	119.4
1863	S	24.7	Very low	26.1	Very low	98 Å²	98	135.7 Å²	135.7	69%	0.685	78%	0.778	S	S	*	*			trans	40.4	129.8	131.6	70.8	0	0	0	0	119.3
1864	L	25.4	Very low	26.6	Very low	148 Å²	148	139.1 Å²	139.1	78%	0.775	78%	0.776	S	S	*	*				-163.3	149.2	56.7	-81.5	164.2	0	0	0	111.1
1865	L	26.5	Very low	26.8	Very low	172 Å²	172	139.7 Å²	139.7	90%	0.901	78%	0.777	S	S	*	*				-165.1	158.3	111.9	-103.5	164.8	0	0	0	110.1
1866	S	24.5	Very low	26.7	Very low	89 Å²	89	143.7 Å²	143.7	62%	0.622	77%	0.773	S	S	*	*			trans	-150.7	157.8	-161.7	62.6	0	0	0	0	112.5
1867	R	28.4	Very low	26.6	Very low	235 Å²	235	144.1 Å²	144.1	89%	0.887	76%	0.764	S	S	*	*			trans	-168.5	111.5	133.9	-107.5	161.9	-176.1	-176.4	-0.1	115.6
1868	S	25.6	Very low	26.6	Very low	95 Å²	95	142.8 Å²	142.8	66%	0.664	76%	0.759	S	S	*	*				57.9	120.6	126.7	64.7	0	0	0	0	123.1
1869	S	25.8	Very low	26.5	Very low	103 Å²	103	140.4 Å²	140.4	72%	0.72	75%	0.752	S	S	*	*				76.7	108	123.6	66.8	0	0	0	0	123
1870	K	25.8	Very low	26.4	Very low	195 Å²	195	139.9 Å²	139.9	85%	0.848	75%	0.749	S	S	*	*				55.1	121.3	125.6	-68.5	-174.7	175.3	-179.2	0	121.3
1871	S	24	Very low	26.3	Very low	119 Å²	119	137.5 Å²	137.5	83%	0.832	74%	0.744	S	S	*	*			trans	77.8	174.9	134.4	74.7	0	0	0	0	119.4
1872	A	26.5	Very low	26.3	Very low	87 Å²	87	141.7 Å²	141.7	72%	0.719	76%	0.758	S	S	*	*			trans	68.9	62	177.1	0	0	0	0	0	118.6
1873	I	25	Very low	26.2	Very low	159 Å²	159	139.1 Å²	139.1	82%	0.815	75%	0.751	S	S	*	*				43.6	108.4	124.5	-54.4	171	0	0	0	118.6
1874	R	38.1	Very low	26.2	Very low	207 Å²	207	144 Å²	144	78%	0.781	76%	0.76	S	S	*	*			trans	18.2	127.3	139.1	-66.2	-178.3	176.3	179.4	-2.7	119.5	R1876	R1874-R1876 PolarHBondContact O-N 2.77Å
1875	P	33.2	Very low	26.5	Very low	125 Å²	125	145.5 Å²	145.5	81%	0.812	77%	0.765	S	S	*	*				-61.5	114.5	129.8	-5.5	23.2	0	0	0	109.4
1876	R	22.4	Very low	26.6	Very low	205 Å²	205	142.6 Å²	142.6	77%	0.774	76%	0.757	S	S	*	*				15.1	145.2	113.8	-65.7	168.9	170.7	-113.5	9.4	117.1	R1874	R1874-R1876 PolarHBondContact O-N 2.77Å
1877	Q	24.1	Very low	26.8	Very low	124 Å²	124	144.4 Å²	144.4	58%	0.579	76%	0.759	S	S	*	*			cis	-155.1	161.7	1	-113.2	163.7	-94.7	0	0	107.8
1878	F	26.8	Very low	26.8	Very low	152 Å²	152	139.9 Å²	139.9	67%	0.667	75%	0.753	S	S	*	*			cis	65.1	62.4	28.3	-97.9	-72.3	0	0	0	114.9	S1880	F1878-S1880 PolarHBondContact O-OG 2.97Å
1879	D	26	Very low	26.9	Very low	143 Å²	143	141.8 Å²	141.8	77%	0.765	76%	0.755	S	S	*	*				-102.4	125.5	126.3	-72.2	-53.6	0	0	0	106.3
1880	S	22.3	Very low	27.3	Very low	83 Å²	83	142.4 Å²	142.4	58%	0.58	75%	0.754	S	S	*	*			cis	69.8	53.4	7.7	68.5	0	0	0	0	118.8	F1878	F1878-S1880 PolarHBondContact O-OG 2.97Å
1881	S	25	Very low	27.6	Very low	105 Å²	105	138.3 Å²	138.3	73%	0.734	74%	0.742	S	S	*	*			trans	-160	78	145	41.6	0	0	0	0	114.8
1882	L	25.4	Very low	28.1	Very low	185 Å²	185	141.1 Å²	141.1	97%	0.969	74%	0.741	S	S	*	*			trans	-143.9	122.3	148.1	-117.4	149.1	0	0	0	108.1
1883	S	24.6	Very low	28.4	Very low	92 Å²	92	140 Å²	140	64%	0.643	74%	0.738	S	S	*	*			trans	-114.4	134.9	-152	69.4	0	0	0	0	114.1
1884	K	25.3	Very low	28.6	Very low	201 Å²	201	140.4 Å²	140.4	87%	0.874	74%	0.741	S	S	*	*			trans	71.9	174.4	160.6	-56.6	163.3	-178.4	173.3	0	115
1885	M	31.2	Very low	27.9	Very low	179 Å²	179	135 Å²	135	88%	0.882	74%	0.735	S	S	*	*			trans	-44.2	146.6	169.3	-56.9	153.4	74.7	0	0	110.9
1886	P	29.3	Very low	28.4	Very low	111 Å²	111	134.7 Å²	134.7	72%	0.721	74%	0.736	S	S	*	*			cis	-142.8	-169.1	34.3	43.8	-25.3	0	0	0	115.5
1887	N	28.1	Very low	28.8	Very low	127 Å²	127	129.6 Å²	129.6	68%	0.679	73%	0.729	S	S	*	*			trans	22.1	119.9	137.4	-67.1	-3.3	0	0	0	119.7
1888	N	27.7	Very low	28.8	Very low	140 Å²	140	129.9 Å²	129.9	75%	0.749	74%	0.735	S	S	*	*				70.1	162.5	120.4	-69.5	-6.3	0	0	0	119.1
1889	L	28.8	Very low	28.7	Very low	135 Å²	135	128.1 Å²	128.1	71%	0.707	73%	0.733	S	S	*	*			cis	-157.3	-170.8	7.1	-134.1	166	0	0	0	109.9
1890	V	32.8	Very low	29	Very low	117 Å²	117	129 Å²	129	71%	0.709	73%	0.731	S	S	*	*			trans	73.2	128	155.6	164.8	0	0	0	0	116.3
1891	N	33.4	Very low	29.4	Very low	109 Å²	109	130.9 Å²	130.9	58%	0.583	73%	0.734	S	S	*	*	S	Bend	cis	-169.9	154.3	-18.9	-103.4	-9.3	0	0	0	105.9
1892	H	34	Very low	29.5	Very low	178 Å²	178	133.4 Å²	133.4	82%	0.824	73%	0.732	S	S	*	*	S	Bend	cis	-132.5	157.7	-1.5	-60.3	-95.6	0	0	0	108.2
1893	G	32.6	Very low	29.3	Very low	64 Å²	64	131 Å²	131	66%	0.66	73%	0.729	S	S	*	*			cis	173.9	142.2	-7.7	0	0	0	0	0	111.8
1894	L	29.2	Very low	29.4	Very low	166 Å²	166	131.1 Å²	131.1	87%	0.869	73%	0.726	S	S	*	*			trans	61.5	115	171.5	-49.8	176.8	0	0	0	116.1
1895	S	23.5	Very low	29.4	Very low	95 Å²	95	128.8 Å²	128.8	66%	0.664	72%	0.723	S	S	*	*			cis	71.2	107.9	33.8	91.4	0	0	0	0	115.6
1896	S	43.5	Very low	29	Very low	118 Å²	118	125.6 Å²	125.6	83%	0.825	72%	0.718	S	S	*	*			trans	-65.3	145.3	150	174.8	0	0	0	0	108.7
1897	P	31.8	Very low	29.4	Very low	98 Å²	98	125.9 Å²	125.9	64%	0.636	72%	0.72	S	S	*	*				-143.1	159.3	119	40.3	-29	0	0	0	114.7
1898	N	23	Very low	29.3	Very low	130 Å²	130	130.9 Å²	130.9	70%	0.695	73%	0.729	S	S	*	*			trans	71.8	147.8	138.1	-88.9	39.7	0	0	0	123.8
1899	D	25.9	Very low	29.2	Very low	115 Å²	115	129.4 Å²	129.4	62%	0.615	73%	0.726	S	S	*	*			trans	77	121.8	142.2	-74.9	-49.4	0	0	0	122.5
1900	H	31.7	Very low	29.3	Very low	160 Å²	160	130.9 Å²	130.9	74%	0.741	73%	0.732	S	S	*	*			trans	81.6	128.4	153.5	-57.9	-2.8	0	0	0	117.4
1901	I	30.1	Very low	29.1	Very low	124 Å²	124	131.8 Å²	131.8	64%	0.636	73%	0.733	S	S	*	*			cis	-151.7	138.5	-2.7	-128.7	163.6	0	0	0	113.7
1902	K	27.1	Very low	28.9	Very low	158 Å²	158	130 Å²	130	69%	0.687	73%	0.73	S	S	*	*			trans	51.9	116.2	155.5	-68.5	165.4	-174.5	175	0	120.6	T1904	K1902-T1904 HydrophobicContact CB-CG2 4.26Å; K1902-T1904 HydrophobicContact CD-CG2 4.14Å; K1902-T1904 HydrophobicContact CG-CG2 4.19Å
1903	C	21.4	Very low	28.7	Very low	134 Å²	134	128.1 Å²	128.1	91%	0.905	73%	0.726	S	S	*	*				-63	124.9	122.9	-56.7	0	0	0	0	109.6
1904	T	26.6	Very low	28.5	Very low	94 Å²	94	131 Å²	131	58%	0.577	73%	0.726	S	S	*	*			trans	-148.6	116.5	155	41.5	0	0	0	0	111.4	K1902	K1902-T1904 HydrophobicContact CB-CG2 4.26Å; K1902-T1904 HydrophobicContact CD-CG2 4.14Å; K1902-T1904 HydrophobicContact CG-CG2 4.19Å
1905	N	26.5	Very low	28.4	Very low	152 Å²	152	130 Å²	130	81%	0.813	72%	0.718	S	S	*	*			trans	57.9	102.2	139.1	-53.7	-1.7	0	0	0	119.7
1906	S	23.1	Very low	28.5	Very low	112 Å²	112	133.9 Å²	133.9	78%	0.783	72%	0.72	S	S	*	*				-59.3	162.7	128.4	-36.6	0	0	0	0	110.4
1907	P	36	Very low	27.7	Very low	118 Å²	118	134.1 Å²	134.1	77%	0.766	72%	0.717	S	S	*	*			cis	-128.4	164.9	-22.1	39.1	-25.9	0	0	0	112.8
1908	R	26.8	Very low	27.5	Very low	231 Å²	231	135.6 Å²	135.6	87%	0.872	72%	0.718	S	S	*	*			trans	-171.7	106.9	144	-106.3	168.1	-170.6	-143.5	-0.4	109.4
1909	T	26.3	Very low	27.8	Very low	109 Å²	109	135.4 Å²	135.4	67%	0.669	72%	0.717	S	S	*	*				82.8	140	89	55.5	0	0	0	0	114.3
1910	I	30.7	Very low	28	Very low	166 Å²	166	135.9 Å²	135.9	85%	0.851	72%	0.719	S	S	*	*			trans	73.1	141.6	163	-63.6	151.4	0	0	0	115
1911	N	28.3	Very low	28	Very low	136 Å²	136	133.5 Å²	133.5	73%	0.727	71%	0.712	S	S	*	*			cis	-163.1	168.5	-35.8	-163.9	12.7	0	0	0	108.1
1912	S	29.3	Very low	28.1	Very low	73 Å²	73	134.2 Å²	134.2	51%	0.51	71%	0.712	S	S	.	*			trans	48	114.3	142.4	63.3	0	0	0	0	121.2
1913	N	29.2	Very low	28.2	Very low	138 Å²	138	132.6 Å²	132.6	74%	0.738	71%	0.711	S	S	*	*				91.1	128.6	116.4	-66.6	6.4	0	0	0	122.3
1914	N	29.4	Very low	28.5	Very low	125 Å²	125	132.4 Å²	132.4	67%	0.668	70%	0.701	S	S	*	*				83.7	92.7	127	-65.9	7.4	0	0	0	122.1
1915	M	25.5	Very low	28.3	Very low	143 Å²	143	135.2 Å²	135.2	70%	0.704	71%	0.712	S	S	*	*				70.9	131	100.8	-76.6	-160.2	167.9	0	0	121.9
1916	Y	25.3	Very low	28.2	Very low	177 Å²	177	135.8 Å²	135.8	69%	0.694	71%	0.71	S	S	*	*			trans	58.2	125.8	137	-70	-128.4	0	0	0	117.1
1917	T	27.5	Very low	28.4	Very low	124 Å²	124	139.5 Å²	139.5	76%	0.761	71%	0.708	S	S	*	*				-162.5	133	80.6	20.4	0	0	0	0	110.4
1918	I	28.5	Very low	27.7	Very low	129 Å²	129	141.7 Å²	141.7	66%	0.662	71%	0.708	S	S	*	*				64.9	121.7	91.1	-65	-177.1	0	0	0	111
1919	N	28.8	Very low	27.9	Very low	125 Å²	125	138.2 Å²	138.2	67%	0.668	71%	0.705	S	S	*	*				-166.7	144.7	58	-140.5	-4.4	0	0	0	115
1920	N	30.4	Very low	28	Very low	126 Å²	126	139.5 Å²	139.5	67%	0.674	71%	0.712	S	S	*	*			trans	53.9	156.9	136.7	-74.5	4	0	0	0	122.9
1921	N	31	Very low	27.9	Very low	110 Å²	110	134.8 Å²	134.8	59%	0.588	71%	0.705	S	S	*	*			cis	-156.3	162.4	19.9	-139.5	-8.9	0	0	0	116.8
1922	H	31.9	Very low	27.9	Very low	138 Å²	138	135.8 Å²	135.8	64%	0.639	71%	0.71	S	S	*	*			trans	68.4	102.5	150.9	-68.5	-35.7	0	0	0	125.3
1923	N	29.9	Very low	27.8	Very low	124 Å²	124	139.7 Å²	139.7	66%	0.663	72%	0.724	S	S	*	*				69	118.6	106.3	-63.9	10.2	0	0	0	124.3
1924	N	26.9	Very low	28.1	Very low	131 Å²	131	138.2 Å²	138.2	70%	0.701	72%	0.722	S	S	*	*				70	129.4	125.4	-69.1	-1.3	0	0	0	123.5
1925	L	22.9	Very low	27.9	Very low	152 Å²	152	141.3 Å²	141.3	80%	0.796	73%	0.729	S	S	*	*			trans	48.3	117.1	133	-57.8	167.6	0	0	0	118.6
1926	Q	25.2	Very low	27.9	Very low	165 Å²	165	142.7 Å²	142.7	77%	0.771	74%	0.738	S	S	*	*				-177	144.9	102.1	-97.5	-155.3	-4.4	0	0	114.5
1927	Y	27.1	Very low	27.9	Very low	190 Å²	190	138.6 Å²	138.6	75%	0.745	74%	0.741	S	S	*	*			trans	63.5	153.9	147.8	-81.1	-107.5	0	0	0	123.2
1928	E	21.9	Very low	27.8	Very low	163 Å²	163	142.3 Å²	142.3	76%	0.762	75%	0.747	S	S	*	*			trans	-70.9	162.1	173.4	-53.2	148.1	114.6	0	0	111.8
1929	I	29.3	Very low	27.7	Very low	159 Å²	159	141.3 Å²	141.3	82%	0.815	75%	0.751	S	S	*	*				-176.5	126.2	127.8	-98.7	157.3	0	0	0	111.2
1930	V	29.2	Very low	27.7	Very low	135 Å²	135	140.2 Å²	140.2	82%	0.818	75%	0.753	S	S	*	*			trans	45.6	139.8	147.4	-176.3	0	0	0	0	120.7
1931	G	27.6	Very low	27.7	Very low	68 Å²	68	140.5 Å²	140.5	70%	0.701	76%	0.759	S	S	*	*			trans	164.3	38.6	159.6	0	0	0	0	0	122.5
1932	D	28.6	Very low	27.7	Very low	156 Å²	156	146.4 Å²	146.4	83%	0.834	77%	0.774	S	S	*	*			trans	65.7	163.6	151.2	-59.1	-22	0	0	0	123.9
1933	I	27.7	Very low	27.7	Very low	155 Å²	155	146 Å²	146	80%	0.795	78%	0.781	S	S	*	*			trans	-155.3	155.5	-160.9	-73.6	172.6	0	0	0	105
1934	P	35.3	Very low	27.7	Very low	107 Å²	107	145.2 Å²	145.2	70%	0.695	79%	0.785	S	S	*	*			cis	-133.9	170	10.6	25.9	-1.5	0	0	0	118.1
1935	K	26.2	Very low	27.8	Very low	191 Å²	191	144.5 Å²	144.5	83%	0.83	79%	0.79	S	S	*	*			trans	-5.2	141.1	138.1	-43.3	165.4	-174.9	171.4	0	118.7
1936	I	24.1	Very low	28.8	Very low	171 Å²	171	143.2 Å²	143.2	88%	0.877	79%	0.791	S	S	*	*				176.6	165.2	109.3	-91.6	161.8	0	0	0	110.6
1937	A	26.6	Very low	29.1	Very low	92 Å²	92	144.3 Å²	144.3	76%	0.76	80%	0.796	S	S	*	*			trans	109.2	160	166.3	0	0	0	0	0	117
1938	F	25.2	Very low	29.4	Very low	202 Å²	202	147 Å²	147	89%	0.886	82%	0.82	S	S	*	*			trans	-135.9	156.1	-160.6	-109.9	-97.2	0	0	0	112.9
1939	S	26.1	Very low	29.8	Very low	108 Å²	108	146.2 Å²	146.2	76%	0.755	82%	0.823	S	S	*	*			trans	59	126.7	155.6	59.3	0	0	0	0	121.1
1940	S	29.5	Very low	29.8	Very low	101 Å²	101	145.5 Å²	145.5	71%	0.706	82%	0.824	S	S	*	*			trans	-150.2	160.9	140.6	65.4	0	0	0	0	109.3
1941	T	29.3	Very low	29.8	Very low	132 Å²	132	146.1 Å²	146.1	81%	0.81	82%	0.824	S	S	*	*			trans	-145.7	123.5	174.6	56.1	0	0	0	0	111.2
1942	R	30.3	Very low	30	Very low	235 Å²	235	150.6 Å²	150.6	89%	0.887	83%	0.831	S	S	*	*			trans	-176.6	139	138	-106.1	167.1	-173.3	-163.3	1.5	112.5
1943	T	33.4	Very low	30	Very low	128 Å²	128	150.3 Å²	150.3	79%	0.785	83%	0.831	S	S	*	*			trans	23.5	129.4	147.3	56.2	0	0	0	0	119
1944	S	30.1	Very low	30.2	Very low	109 Å²	109	150 Å²	150	76%	0.762	83%	0.834	S	S	*	*				-153.4	135.7	53.6	56.9	0	0	0	0	116
1945	S	29.4	Very low	29.8	Very low	115 Å²	115	153.1 Å²	153.1	80%	0.804	84%	0.843	S	S	*	*			trans	64.3	137.8	166.6	-61.7	0	0	0	0	117.5	H1947	S1945-H1947 PolarHBondContact O-N 3.39Å
1946	P	43.1	Very low	30.1	Very low	126 Å²	126	150.2 Å²	150.2	82%	0.818	85%	0.845	S	S	*	*	S	Bend	trans	-99	76.5	-154.6	38.4	-35.4	0	0	0	113.7
1947	H	31.6	Very low	30.6	Very low	187 Å²	187	148.4 Å²	148.4	87%	0.866	84%	0.842	S	S	*	*			trans	-147.1	81	164.7	-106.8	-59.6	0	0	0	112.6	S1945	S1945-H1947 PolarHBondContact O-N 3.39Å
1948	I	33.1	Very low	31	Very low	246 Å²	246	153.5 Å²	153.5	100%	1.262	85%	0.849	S	S	*	*			trans	-166	0	142.6	-95.8	152.2	0	0	0	106.4

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