A0A5K4F3G4_SCHMA Loading...

PDZ domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F3G4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,220 aa.

						>A0A5K4F3G4_SCHMA|A0A5K4F3G4
MCDSDSGLSISMNGSQNDSPTQGLVFIRVIMPDETSETFSFSPTDLIVDVKLTAIKRSNSCLKDELNYGLFLPPSKGKAGKFLQEDRMLLDYPFESSVGHLELKYKQRVYRVLKTNVNKLRKINTKANFRQFIEYVKVGDVDKVNKWLNKGLDPNFQWKPNGETPLTMAVQLEKPYEMVMALVAGGAHLDYRASDSMTPIHRASEKGNYEAIKVLLDLGQSPNTRDKADLTPLYYAVLNNTISLCVERLLFDHSPLGIADEAGLQEIHQACRFGRVQHLEILLAYGAEINVQTSKNGNTPLHICAYTGQESCARMLLFRGADKNIKNFNGHTTYEQAMISNHIEIADLIKGFHEQDVVPIRNYLKRNLRRRSFSRIRSQQRCSSMGRLNEFSKQNGTTEVDGLPEFEQDHCNTLKGNRMIRNNTWMNTSISGYQLNSMVSDSIDFDDNKNYAAMPDDQNNHLNQSRSAYNLNRLSNGMNQKCHNPNDIVYPNYSATMKPSQSRRTGRSSTPAAPRIASESFKTTNLQDRHSTYRPSLDPAWISQTNESGSETASIFSVSSSMRTPSTNSVRNGSAILQLLLANRDNIADLDTTNLPRMIALQRGPNGFGFVVRGKKGVSGNFTPSLECPASQYLEKVEPHSAASRAGLKAGDFILEVNNINVTTMSHEAVVSLIRGSSDILGLKVITVDSDQINSTPKLSHQSVNSNRFYESSDNIYSSKIKKSNYEDKFSNKYCVSVENDWPRNTENAYKTVCRDSFHRNQNNLSIQLDNSTNKSSTNDFICGEKLKSLRLEPSSSVSSMASPSYRTPAPPPLSSKPVLTTGTLSKSGFQNGPNDNKKAESNLPIILKSRPTHSEKIFDSVSKPENSLSFDHPPPPTAPPISSSSFNLIPSPPPLKKTPNKTSSNINSESPTGILKKTSHDKFSESTKPSKNLEDTRNQDIWSDQLLLPPPPPPEEFELNVTEPVTRQSNCQQNTNGYDINNHTSYKTFSSSQTAKKTSFEDNLRRAVAERRRLIEMASGEDDHDSESIPNKSYHSTTYTENNTRPLKQQEEIVLSNEKSFKTAPENPHVQALSGILPTNSTIPPPENFKDFDNSINKVPCNTEININDKVQIATKPKFPIIQSSFTKTLNKTQGSRNIEQGKCNSVNALTNYTTNISCNGTHKADVLREISTFKQNNVTESKMNSGKSIGYPRSTTPSSLHSSPYFISEVPKIMWSTK
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	26.8	Very low	28	Very low	244 Å²	244	127.7 Å²	127.7	100%	1.202	78%	0.779	S	S	*	*				0	140.2	0	-61.4	179.1	91.9	0	0	106.7
2	C	26.2	Very low	28	Very low	114 Å²	114	132.8 Å²	132.8	77%	0.77	79%	0.792	S	S	*	*			trans	-91	148.3	-158.8	-48.2	0	0	0	0	111.9
3	D	28.9	Very low	27.8	Very low	161 Å²	161	134.5 Å²	134.5	86%	0.861	80%	0.795	S	S	*	*			trans	-142.9	77.7	158.9	-89.9	-43.7	0	0	0	107
4	S	29.9	Very low	27.7	Very low	96 Å²	96	129.5 Å²	129.5	67%	0.671	79%	0.786	S	S	*	*			trans	-81.8	123.8	170.8	-56.8	0	0	0	0	108.6
5	D	31.7	Very low	27.6	Very low	143 Å²	143	127.6 Å²	127.6	77%	0.765	78%	0.78	S	S	*	*			trans	-123.3	64	160.5	-104.2	-26.1	0	0	0	107.8
6	S	30.1	Very low	27.5	Very low	73 Å²	73	131.2 Å²	131.2	51%	0.51	79%	0.786	S	S	.	*			trans	-54.3	153.7	161	45.4	0	0	0	0	110.5	L8	S6-L8 PolarHBondContact O-N 2.68Å
7	G	28.4	Very low	27.5	Very low	88 Å²	88	133.2 Å²	133.2	91%	0.907	79%	0.791	S	S	*	*	S	Bend	trans	-69.9	66.8	175.1	0	0	0	0	0	113.7
8	L	26.7	Very low	27.6	Very low	130 Å²	130	133.9 Å²	133.9	68%	0.681	79%	0.791	S	S	*	*			trans	-100.4	123.5	173.4	-74.4	173	0	0	0	110.1	S6 I10	S6-L8 PolarHBondContact O-N 2.68Å; L8-I10 PolarHBondContact O-N 3.35Å
9	S	27.5	Very low	27.7	Very low	121 Å²	121	130.7 Å²	130.7	85%	0.846	78%	0.776	S	S	*	*			trans	-71	89.3	164.7	50.3	0	0	0	0	109.5
10	I	27	Very low	28.2	Very low	152 Å²	152	130.1 Å²	130.1	78%	0.779	78%	0.775	S	S	*	*			trans	-73	131	169.4	-66.8	177.4	0	0	0	108.3	L8	L8-I10 PolarHBondContact O-N 3.35Å
11	S	25.1	Very low	29	Very low	83 Å²	83	127.3 Å²	127.3	58%	0.58	76%	0.76	S	S	*	*			trans	-76.5	136.6	-168.2	54.3	0	0	0	0	113.3	N13	S11-N13 WeakPolarHBondContact CB-OD1 3.11Å; S11-N13 PolarHBondContact O-N 2.79Å; S11-N13 PolarHBondContact OG-OD1 3.11Å
12	M	27.2	Very low	30.2	Very low	188 Å²	188	124.1 Å²	124.1	93%	0.926	74%	0.742	S	S	*	*			trans	-81.4	90.7	152.4	-71.3	-79.3	-94.8	0	0	107	G14	M12-G14 VanDerWaalsContact C-N 3.33Å; M12-G14 PolarHBondContact O-N 2.63Å
13	N	26.3	Very low	32.1	Very low	155 Å²	155	120.1 Å²	120.1	83%	0.829	72%	0.72	S	S	*	*			trans	-68.8	93.5	169.8	-81.6	14.1	0	0	0	108.7	S11	S11-N13 WeakPolarHBondContact CB-OD1 3.11Å; S11-N13 PolarHBondContact O-N 2.79Å; S11-N13 PolarHBondContact OG-OD1 3.11Å
14	G	25.7	Very low	34.7	Very low	65 Å²	65	116.4 Å²	116.4	67%	0.67	70%	0.699	S	S	*	*	S	Bend	trans	-174.3	95.2	-180	0	0	0	0	0	111.9	M12	M12-G14 VanDerWaalsContact C-N 3.33Å; M12-G14 PolarHBondContact O-N 2.63Å
15	S	27	Very low	37.2	Very low	101 Å²	101	113.6 Å²	113.6	71%	0.706	68%	0.678	S	S	*	*			trans	63.5	104.2	-178	-157.8	0	0	0	0	115.8	N17	S15-N17 PolarHBondContact O-N 3.1Å
16	Q	25.9	Very low	39.9	Very low	185 Å²	185	108.1 Å²	108.1	86%	0.864	65%	0.648	S	S	*	*	S	Bend	trans	-75.5	111.2	162.9	-68.2	172	-25.8	0	0	108.8
17	N	27.8	Very low	42.8	Very low	165 Å²	165	104.7 Å²	104.7	88%	0.882	62%	0.623	S	S	*	*			trans	170.7	-16.8	145	-90.7	-30.8	0	0	0	114.5	S15	S15-N17 PolarHBondContact O-N 3.1Å
18	D	28.1	Very low	45.8	Very low	146 Å²	146	104 Å²	104	78%	0.781	59%	0.593	S	S	*	*			trans	-79	140	-168.5	-74.3	-54.6	0	0	0	115.6
19	S	30.6	Very low	49	Very low	73 Å²	73	97.8 Å²	97.8	51%	0.51	56%	0.561	S	S	.	*			trans	-64.4	153.7	-177.8	70.6	0	0	0	0	113.6	T21	S19-T21 PolarHBondContact O-N 2.93Å
20	P	37.3	Very low	52.1	Low	118 Å²	118	94.1 Å²	94.1	77%	0.766	53%	0.531	S	S	*	.	S	Bend	trans	-64.4	102.9	-176	25.4	-34.9	0	0	0	113.2
21	T	45.2	Very low	55.1	Low	72 Å²	72	87 Å²	87	44%	0.442	50%	0.495	S	S	.	.			trans	47	71.4	153	58.7	0	0	0	0	116.5	S19	S19-T21 PolarHBondContact O-N 2.93Å
22	Q	50.8	Low	58	Low	178 Å²	178	85.6 Å²	85.6	83%	0.832	48%	0.484	S	S	*	.			trans	-88.1	-0.6	170.5	-61.4	-172.6	10.7	0	0	114.4
23	G	67.1	Low	60.7	Low	30 Å²	30	81 Å²	81	31%	0.309	46%	0.463	S	S	.	.	S	Bend	trans	-87.5	144.7	-179	0	0	0	0	0	113.6	P43	G23-P43 VanDerWaalsContact O-CD 3.23Å; G23-P43 WeakPolarHBondContact O-CD 3.33Å; G23-P43 WeakPolarHBondContact O-CG 3.26Å
24	L	82.7	Confident	63.4	Low	82 Å²	82	81.4 Å²	81.4	43%	0.429	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-70.9	142.3	174	-68.9	167.5	0	0	0	111.9	F41 M598	L24-F41 CarbonylContact C-O 3.59Å; L24-F41 WeakPolarHBondContact CA-O 3.27Å; L24-F41 WeakPolarHBondContact CD2-O 3.45Å; L24-M598 HydrophobicContact CD1-CB 4.45Å; L24-M598 HydrophobicContact CD1-CG 3.84Å
25	V	84.1	Confident	66.3	Low	37 Å²	37	81.5 Å²	81.5	22%	0.224	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	125.9	171.2	-176	0	0	0	0	109	I27 S40 F41 P43 L89 F94	V25-I27 HydrophobicContact CG1-CG1 4.24Å; V25-S40 WeakPolarHBondContact O-CA 3.24Å; V25-F41 PolarHBondContact N-O 2.82Å; V25-F41 PolarHBondContact O-N 3.43Å; V25-P43 HydrophobicContact CG2-CB 4.37Å; V25-P43 HydrophobicContact CG2-CG 3.87Å; V25-L89 HydrophobicContact CB-CD2 3.8Å; V25-L89 HydrophobicContact CG1-CD2 4.03Å; V25-L89 HydrophobicContact CG2-CD2 4.14Å; V25-F94 HydrophobicContact CG1-CD2 4Å; V25-F94 HydrophobicContact CG1-CE2 4.05Å
26	F	87.6	Confident	69.2	Low	29 Å²	29	79.9 Å²	79.9	13%	0.127	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	135.8	171.5	-65.4	-84.2	0	0	0	110.3	F39 V98 G99 M598 A600	F26-F39 CarbonylContact C-O 3.51Å; F26-F39 VanDerWaalsContact CA-O 3.3Å; F26-F39 WeakPolarHBondContact CA-O 3.24Å; F26-V98 HydrophobicContact CB-CB 4.46Å; F26-V98 HydrophobicContact CB-CG1 4.31Å; F26-V98 HydrophobicContact CB-CG2 4Å; F26-V98 CarbonylContact O-C 3.59Å; F26-V98 WeakPolarHBondContact O-CA 3.44Å; F26-G99 PolarHBondContact O-N 2.81Å; F26-M598 HydrophobicContact CE1-CB 4.35Å; F26-M598 HydrophobicContact CZ-CB 4.22Å; F26-M598 HydrophobicContact CZ-CE 4.27Å; F26-A600 HydrophobicContact CD1-CB 3.94Å; F26-A600 HydrophobicContact CD2-CB 4.13Å; F26-A600 HydrophobicContact CE1-CB 4.07Å; F26-A600 HydrophobicContact CE2-CB 4.25Å; F26-A600 HydrophobicContact CG-CB 3.97Å; F26-A600 HydrophobicContact CZ-CB 4.22Å
27	I	90.5	Very high	72.1	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	127.8	178.1	-47	177.4	0	0	0	109.3	V25 V29 T38 F39 F41 V50 L89 F94 G99 L101	V25-I27 HydrophobicContact CG1-CG1 4.24Å; I27-V29 HydrophobicContact CG2-CG2 4.06Å; I27-T38 CarbonylContact O-C 3.59Å; I27-T38 WeakPolarHBondContact O-CA 3.14Å; I27-F39 PolarHBondContact N-O 3.49Å; I27-F39 PolarHBondContact O-N 3.03Å; I27-F41 HydrophobicContact CD1-CD2 3.74Å; I27-F41 HydrophobicContact CD1-CE2 4.29Å; I27-F41 HydrophobicContact CG1-CD2 4.26Å; I27-V50 HydrophobicContact CD1-CG1 4.1Å; I27-L89 HydrophobicContact CD1-CD1 3.58Å; I27-L89 HydrophobicContact CD1-CD2 3.8Å; I27-L89 HydrophobicContact CD1-CG 4.34Å; I27-F94 HydrophobicContact CD1-CE2 4.28Å; I27-F94 HydrophobicContact CD1-CZ 4.36Å; I27-F94 HydrophobicContact CG1-CE2 4.12Å; I27-F94 HydrophobicContact CG1-CZ 4.4Å; I27-F94 HydrophobicContact CG2-CZ 4.46Å; I27-G99 CarbonylContact C-O 3.25Å; I27-G99 WeakPolarHBondContact CA-O 3.48Å; I27-L101 HydrophobicContact CD1-CD1 4.38Å; I27-L101 HydrophobicContact CG2-CB 4.24Å; I27-L101 HydrophobicContact CG2-CD1 3.93Å; I27-L101 HydrophobicContact CG2-CG 3.94Å
28	R	92.5	Very high	75	Confident	73 Å²	73	69 Å²	69	28%	0.275	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	123	161.7	-167.2	177.7	-60.7	160.3	1.5	109.3	E37 V98 G99 L101	R28-E37 CarbonylContact C-O 3.5Å; R28-E37 WeakPolarHBondContact CA-O 3.42Å; R28-V98 HydrophobicContact CB-CG1 4.19Å; R28-G99 PolarHBondContact N-O 2.64Å; R28-L101 PolarHBondContact O-N 3.17Å
29	V	93.2	Very high	77.9	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	121.2	174.5	-175.3	0	0	0	0	108.1	I27 M31 S36 E37 F39 A54 L70 L101 L103	I27-V29 HydrophobicContact CG2-CG2 4.06Å; V29-M31 HydrophobicContact CG1-SD 4.03Å; V29-S36 WeakPolarHBondContact O-CA 3.35Å; V29-E37 PolarHBondContact N-O 2.99Å; V29-E37 PolarHBondContact O-N 3.39Å; V29-E37 VanDerWaalsContact O-N 3.09Å; V29-F39 HydrophobicContact CB-CD2 4.26Å; V29-F39 HydrophobicContact CB-CE2 4Å; V29-F39 HydrophobicContact CG2-CD2 3.87Å; V29-F39 HydrophobicContact CG2-CE2 4.04Å; V29-A54 HydrophobicContact CG1-CB 4.43Å; V29-A54 HydrophobicContact CG2-CB 4.47Å; V29-L70 HydrophobicContact CG1-CD2 4.07Å; V29-L101 WeakPolarHBondContact CA-O 3.33Å; V29-L103 HydrophobicContact CG1-CB 4.13Å
30	I	92.2	Very high	80.7	Confident	44 Å²	44	61.5 Å²	61.5	23%	0.226	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	127.5	170.3	-57.5	173.6	0	0	0	108	T35 L101 E102 L103	I30-T35 WeakPolarHBondContact CA-O 3.49Å; I30-L101 PolarHBondContact N-O 2.82Å; I30-E102 HydrophobicContact CB-CG 4.28Å; I30-E102 HydrophobicContact CD1-CG 4.34Å; I30-E102 CarbonylContact O-C 3.55Å; I30-L103 PolarHBondContact O-N 3.13Å
31	M	89.6	Confident	83.2	Confident	4 Å²	4	56.5 Å²	56.5	2%	0.02	31%	0.309	C	S	.	.			trans	-93.8	164.5	-174.4	-63.2	-59.4	-63.4	0	0	111.9	V29 D33 E34 T35 S58 L103	V29-M31 HydrophobicContact CG1-SD 4.03Å; M31-D33 VanDerWaalsContact CB-OD1 3.31Å; M31-D33 WeakPolarHBondContact CB-OD1 3.43Å; M31-D33 PolarHBondContact O-N 3.04Å; M31-E34 PolarHBondContact O-N 3.01Å; M31-T35 WeakPolarHBondContact CB-OG1 3.32Å; M31-T35 PolarHBondContact N-O 3.41Å; M31-S58 VanDerWaalsContact CE-OG 3.24Å; M31-S58 WeakPolarHBondContact CE-OG 3.44Å; M31-L103 HydrophobicContact CE-CD2 3.55Å; M31-L103 HydrophobicContact SD-CB 4.28Å; M31-L103 HydrophobicContact SD-CD2 4.07Å
32	P	86.8	Confident	85.3	Confident	53 Å²	53	54.6 Å²	54.6	34%	0.344	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-6.5	-176.7	-22.9	35.2	0	0	0	116	L62 Y68 L103	P32-L62 HydrophobicContact CB-CD2 4.11Å; P32-L62 HydrophobicContact CG-CD1 4.04Å; P32-L62 HydrophobicContact CG-CD2 3.79Å; P32-Y68 HydrophobicContact CB-CE1 4.01Å; P32-Y68 HydrophobicContact CG-CD1 3.94Å; P32-Y68 HydrophobicContact CG-CE1 3.43Å; P32-Y68 VanDerWaalsContact CG-CE1 3.43Å; P32-L103 HydrophobicContact CG-CD2 4.36Å
33	D	84.9	Confident	87.1	Confident	90 Å²	90	46.4 Å²	46.4	48%	0.481	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	13.4	174.4	58.6	6.6	0	0	0	112.7	M31 T35	M31-D33 VanDerWaalsContact CB-OD1 3.31Å; M31-D33 WeakPolarHBondContact CB-OD1 3.43Å; M31-D33 PolarHBondContact O-N 3.04Å; D33-T35 PolarHBondContact O-N 3.46Å; D33-T35 WeakPolarHBondContact OD1-CB 3.17Å; D33-T35 WeakPolarHBondContact OD1-CG2 3.23Å; D33-T35 PolarHBondContact OD1-N 3.15Å; D33-T35 VanDerWaalsContact OD1-N 3.1Å; D33-T35 PolarHBondContact OD1-OG1 3.26Å
34	E	82.7	Confident	88.1	Confident	165 Å²	165	47.9 Å²	47.9	77%	0.771	26%	0.264	S	S	*	.	S	Bend	trans	63	10.9	-175.4	-49.9	-66.5	162.4	0	0	114.4	M31	M31-E34 PolarHBondContact O-N 3.01Å
35	T	86.6	Confident	88.4	Confident	66 Å²	66	46.4 Å²	46.4	41%	0.405	26%	0.257	S	S	.	.			trans	-72.5	155.1	166.3	67.4	0	0	0	0	110.6	I30 M31 D33	I30-T35 WeakPolarHBondContact CA-O 3.49Å; M31-T35 WeakPolarHBondContact CB-OG1 3.32Å; M31-T35 PolarHBondContact N-O 3.41Å; D33-T35 PolarHBondContact O-N 3.46Å; D33-T35 WeakPolarHBondContact OD1-CB 3.17Å; D33-T35 WeakPolarHBondContact OD1-CG2 3.23Å; D33-T35 PolarHBondContact OD1-N 3.15Å; D33-T35 VanDerWaalsContact OD1-N 3.1Å; D33-T35 PolarHBondContact OD1-OG1 3.26Å
36	S	86.5	Confident	88.7	Confident	68 Å²	68	45.7 Å²	45.7	48%	0.476	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	113.5	177.5	76.9	0	0	0	0	112	V29	V29-S36 WeakPolarHBondContact O-CA 3.35Å
37	E	86.6	Confident	88.9	Confident	53 Å²	53	44.4 Å²	44.4	25%	0.248	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	149.9	174.4	-76.7	-172.7	-143.6	0	0	110.6	R28 V29 F39 R57 S58	R28-E37 CarbonylContact C-O 3.5Å; R28-E37 WeakPolarHBondContact CA-O 3.42Å; V29-E37 PolarHBondContact N-O 2.99Å; V29-E37 PolarHBondContact O-N 3.39Å; V29-E37 VanDerWaalsContact O-N 3.09Å; E37-F39 HydrophobicContact CB-CD2 4.28Å; E37-F39 HydrophobicContact CB-CE2 3.43Å; E37-F39 VanDerWaalsContact CB-CE2 3.43Å; E37-F39 HydrophobicContact CB-CZ 3.81Å; E37-R57 WeakPolarHBondContact OE2-CD 3.08Å; E37-R57 WeakPolarHBondContact OE2-CG 3.42Å; E37-R57 IonicContact OE2-NE 2.74Å; E37-S58 WeakPolarHBondContact OE1-CA 3.39Å
38	T	89.2	Confident	88.8	Confident	67 Å²	67	46.2 Å²	46.2	41%	0.411	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	127.6	175.6	-54.3	0	0	0	0	110.1	I27 V98	I27-T38 CarbonylContact O-C 3.59Å; I27-T38 WeakPolarHBondContact O-CA 3.14Å; T38-V98 HydrophobicContact CG2-CG1 4.2Å
39	F	89.8	Confident	88.8	Confident	8 Å²	8	46 Å²	46	4%	0.035	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	164.3	-172.6	-62.7	-99.7	0	0	0	110.7	F26 I27 V29 E37 F41 A54 R57	F26-F39 CarbonylContact C-O 3.51Å; F26-F39 VanDerWaalsContact CA-O 3.3Å; F26-F39 WeakPolarHBondContact CA-O 3.24Å; I27-F39 PolarHBondContact N-O 3.49Å; I27-F39 PolarHBondContact O-N 3.03Å; V29-F39 HydrophobicContact CB-CD2 4.26Å; V29-F39 HydrophobicContact CB-CE2 4Å; V29-F39 HydrophobicContact CG2-CD2 3.87Å; V29-F39 HydrophobicContact CG2-CE2 4.04Å; E37-F39 HydrophobicContact CB-CD2 4.28Å; E37-F39 HydrophobicContact CB-CE2 3.43Å; E37-F39 VanDerWaalsContact CB-CE2 3.43Å; E37-F39 HydrophobicContact CB-CZ 3.81Å; F39-F41 HydrophobicContact CB-CD2 3.9Å; F39-F41 HydrophobicContact CB-CE2 3.26Å; F39-F41 HydrophobicContact CB-CZ 3.89Å; F39-F41 HydrophobicContact CD1-CE2 4.18Å; F39-F41 AromaticContact CD1-CZ 3.98Å; F39-F41 HydrophobicContact CD1-CZ 3.98Å; F39-F41 AromaticContact CG-CE2 3.85Å; F39-F41 HydrophobicContact CG-CE2 3.85Å; F39-F41 HydrophobicContact CG-CZ 4.14Å; F39-A54 HydrophobicContact CE1-CB 4.27Å; F39-A54 HydrophobicContact CE2-CB 4.23Å; F39-A54 HydrophobicContact CZ-CB 3.92Å; F39-R57 HydrophobicContact CE1-CB 3.76Å; F39-R57 HydrophobicContact CE1-CG 4.16Å; F39-R57 HydrophobicContact CZ-CB 4.23Å
40	S	89.3	Confident	88.7	Confident	54 Å²	54	46 Å²	46	38%	0.378	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	124.9	171.5	58	0	0	0	0	109.8	V25	V25-S40 WeakPolarHBondContact O-CA 3.24Å
41	F	90.1	Very high	88.7	Confident	13 Å²	13	44 Å²	44	6%	0.057	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	159.6	-176.5	-67.8	-73.8	0	0	0	111.3	L24 V25 I27 F39 V50 T53 L89	L24-F41 CarbonylContact C-O 3.59Å; L24-F41 WeakPolarHBondContact CA-O 3.27Å; L24-F41 WeakPolarHBondContact CD2-O 3.45Å; V25-F41 PolarHBondContact N-O 2.82Å; V25-F41 PolarHBondContact O-N 3.43Å; I27-F41 HydrophobicContact CD1-CD2 3.74Å; I27-F41 HydrophobicContact CD1-CE2 4.29Å; I27-F41 HydrophobicContact CG1-CD2 4.26Å; F39-F41 HydrophobicContact CB-CD2 3.9Å; F39-F41 HydrophobicContact CB-CE2 3.26Å; F39-F41 HydrophobicContact CB-CZ 3.89Å; F39-F41 HydrophobicContact CD1-CE2 4.18Å; F39-F41 AromaticContact CD1-CZ 3.98Å; F39-F41 HydrophobicContact CD1-CZ 3.98Å; F39-F41 AromaticContact CG-CE2 3.85Å; F39-F41 HydrophobicContact CG-CE2 3.85Å; F39-F41 HydrophobicContact CG-CZ 4.14Å; F41-V50 HydrophobicContact CB-CG2 4.39Å; F41-V50 HydrophobicContact CD1-CG2 3.9Å; F41-V50 HydrophobicContact CD2-CG1 3.98Å; F41-V50 HydrophobicContact CD2-CG2 4.18Å; F41-V50 HydrophobicContact CE1-CB 4.33Å; F41-V50 HydrophobicContact CE1-CG1 4.44Å; F41-V50 HydrophobicContact CE1-CG2 4.16Å; F41-V50 HydrophobicContact CE2-CB 4.36Å; F41-V50 HydrophobicContact CE2-CG1 3.62Å; F41-V50 HydrophobicContact CE2-CG2 4.4Å; F41-V50 HydrophobicContact CG-CG2 3.91Å; F41-V50 HydrophobicContact CZ-CB 4.22Å; F41-V50 HydrophobicContact CZ-CG1 3.88Å; F41-V50 HydrophobicContact CZ-CG2 4.4Å; F41-T53 HydrophobicContact CE1-CG2 3.78Å; F41-T53 HydrophobicContact CZ-CG2 3.96Å; F41-L89 HydrophobicContact CB-CD2 3.88Å
42	S	89.3	Confident	88.7	Confident	33 Å²	33	46.2 Å²	46.2	23%	0.231	26%	0.262	C	S	.	.			trans	-71.5	145	165.8	-174.8	0	0	0	0	110.2	T44 D45	S42-T44 PolarHBondContact O-N 2.93Å; S42-T44 VanDerWaalsContact O-N 3.1Å; S42-T44 PolarHBondContact OG-N 2.93Å; S42-T44 PolarHBondContact OG-OG1 3.1Å; S42-D45 WeakPolarHBondContact CB-OD1 3.45Å; S42-D45 PolarHBondContact N-OD2 2.83Å; S42-D45 WeakPolarHBondContact O-CB 3.4Å; S42-D45 PolarHBondContact O-N 2.9Å
43	P	87.4	Confident	88.8	Confident	6 Å²	6	46.6 Å²	46.6	4%	0.039	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-26.1	166.1	-20.9	28.8	0	0	0	113.1	G23 V25 L89 L90	G23-P43 VanDerWaalsContact O-CD 3.23Å; G23-P43 WeakPolarHBondContact O-CD 3.33Å; G23-P43 WeakPolarHBondContact O-CG 3.26Å; V25-P43 HydrophobicContact CG2-CB 4.37Å; V25-P43 HydrophobicContact CG2-CG 3.87Å; P43-L89 PolarHBondContact O-N 2.93Å; P43-L90 HydrophobicContact CB-CB 4.08Å; P43-L90 HydrophobicContact CB-CD1 4.29Å; P43-L90 WeakPolarHBondContact O-CB 3.12Å; P43-L90 PolarHBondContact O-N 2.87Å
44	T	88.2	Confident	89.1	Confident	60 Å²	60	42.3 Å²	42.3	37%	0.368	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-4.6	179.8	63.9	0	0	0	0	114.6	S42 M88	S42-T44 PolarHBondContact O-N 2.93Å; S42-T44 VanDerWaalsContact O-N 3.1Å; S42-T44 PolarHBondContact OG-N 2.93Å; S42-T44 PolarHBondContact OG-OG1 3.1Å; T44-M88 WeakPolarHBondContact O-CE 3.48Å
45	D	89.6	Confident	89.4	Confident	52 Å²	52	34.9 Å²	34.9	28%	0.278	21%	0.207	S	C	.	.	S	Bend	trans	-71.4	145.6	179.3	-67.3	-19.6	0	0	0	110.3	S42 V50 M88 L89	S42-D45 WeakPolarHBondContact CB-OD1 3.45Å; S42-D45 PolarHBondContact N-OD2 2.83Å; S42-D45 WeakPolarHBondContact O-CB 3.4Å; S42-D45 PolarHBondContact O-N 2.9Å; D45-V50 HydrophobicContact CB-CG2 4.15Å; D45-M88 CarbonylContact O-C 3.51Å; D45-M88 WeakPolarHBondContact O-CA 3.21Å; D45-L89 PolarHBondContact O-N 2.88Å
46	L	90.2	Very high	89.4	Confident	22 Å²	22	40 Å²	40	12%	0.115	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-77.4	149.5	178.8	-54.3	177.6	0	0	0	111.2	V48 D49 V50 R87 M88 F373	L46-V48 HydrophobicContact CB-CG1 3.82Å; L46-V48 HydrophobicContact CD1-CG1 3.95Å; L46-V48 PolarHBondContact O-N 3.3Å; L46-D49 HydrophobicContact CB-CB 4.38Å; L46-D49 WeakPolarHBondContact CB-OD2 3.3Å; L46-D49 WeakPolarHBondContact CG-OD2 3.39Å; L46-D49 PolarHBondContact O-N 3.01Å; L46-V50 WeakPolarHBondContact O-CG2 3.39Å; L46-V50 PolarHBondContact O-N 3.49Å; L46-R87 WeakPolarHBondContact CA-O 3.34Å; L46-M88 HydrophobicContact CD2-CE 4.4Å; L46-M88 HydrophobicContact CD2-CG 3.95Å; L46-F373 HydrophobicContact CD1-CE2 4.07Å; L46-F373 HydrophobicContact CD1-CZ 3.81Å; L46-F373 HydrophobicContact CD2-CE2 3.63Å; L46-F373 HydrophobicContact CD2-CZ 3.78Å; L46-F373 HydrophobicContact CG-CE2 4.49Å; L46-F373 HydrophobicContact CG-CZ 4.35Å
47	I	92.2	Very high	89.3	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-59	-31.9	173.5	-63.8	-49.7	0	0	0	111.8	K51 L70 L83 Q84 R87 L89 Y92	I47-K51 VanDerWaalsContact O-CB 3.22Å; I47-K51 WeakPolarHBondContact O-CB 3.47Å; I47-K51 PolarHBondContact O-N 2.97Å; I47-L70 HydrophobicContact CG2-CD1 4.2Å; I47-L83 HydrophobicContact CD1-CD2 3.6Å; I47-L83 HydrophobicContact CG1-CB 4.19Å; I47-L83 HydrophobicContact CG1-CD2 4.16Å; I47-L83 HydrophobicContact CG2-CB 3.61Å; I47-L83 HydrophobicContact CG2-CD2 4.45Å; I47-Q84 WeakPolarHBondContact CB-O 3.41Å; I47-R87 PolarHBondContact N-O 3.4Å; I47-L89 HydrophobicContact CD1-CB 4.49Å; I47-L89 HydrophobicContact CD1-CD1 4.06Å; I47-Y92 HydrophobicContact CD1-CD2 3.97Å; I47-Y92 HydrophobicContact CD1-CE2 4.2Å; I47-Y92 HydrophobicContact CG1-CD2 4.07Å; I47-Y92 HydrophobicContact CG1-CE2 3.77Å
48	V	88.9	Confident	88.7	Confident	39 Å²	39	42.6 Å²	42.6	24%	0.236	22%	0.222	C	C	.	.	H	α-helix	trans	-64.1	-41.5	171.1	68.9	0	0	0	0	112.8	L46 K51 L52 E85	L46-V48 HydrophobicContact CB-CG1 3.82Å; L46-V48 HydrophobicContact CD1-CG1 3.95Å; L46-V48 PolarHBondContact O-N 3.3Å; V48-K51 PolarHBondContact O-N 3.18Å; V48-L52 HydrophobicContact CG2-CD1 4Å; V48-L52 HydrophobicContact CG2-CG 4.41Å; V48-L52 WeakPolarHBondContact O-CB 3.31Å; V48-L52 VanDerWaalsContact O-CG 3.29Å; V48-L52 WeakPolarHBondContact O-CG 3.4Å; V48-L52 PolarHBondContact O-N 3.4Å; V48-E85 HydrophobicContact CB-CB 4.13Å; V48-E85 WeakPolarHBondContact CB-O 3.5Å; V48-E85 PolarHBondContact N-O 3.42Å
49	D	90.5	Very high	87.5	Confident	68 Å²	68	47.7 Å²	47.7	36%	0.364	25%	0.247	S	C	.	.	H	α-helix	trans	-71.9	-41.5	-178.9	-62.3	-38.2	0	0	0	110.9	L46 L52 T53	L46-D49 HydrophobicContact CB-CB 4.38Å; L46-D49 WeakPolarHBondContact CB-OD2 3.3Å; L46-D49 WeakPolarHBondContact CG-OD2 3.39Å; L46-D49 PolarHBondContact O-N 3.01Å; D49-L52 PolarHBondContact O-N 2.93Å; D49-T53 VanDerWaalsContact O-CB 3.26Å; D49-T53 WeakPolarHBondContact O-CB 3.3Å; D49-T53 PolarHBondContact O-N 3.29Å; D49-T53 PolarHBondContact O-OG1 3.16Å
50	V	91.7	Very high	86.5	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-57.7	-47	170.7	175.9	0	0	0	0	110.3	I27 F41 D45 L46 T53 A54 L70	I27-V50 HydrophobicContact CD1-CG1 4.1Å; F41-V50 HydrophobicContact CB-CG2 4.39Å; F41-V50 HydrophobicContact CD1-CG2 3.9Å; F41-V50 HydrophobicContact CD2-CG1 3.98Å; F41-V50 HydrophobicContact CD2-CG2 4.18Å; F41-V50 HydrophobicContact CE1-CB 4.33Å; F41-V50 HydrophobicContact CE1-CG1 4.44Å; F41-V50 HydrophobicContact CE1-CG2 4.16Å; F41-V50 HydrophobicContact CE2-CB 4.36Å; F41-V50 HydrophobicContact CE2-CG1 3.62Å; F41-V50 HydrophobicContact CE2-CG2 4.4Å; F41-V50 HydrophobicContact CG-CG2 3.91Å; F41-V50 HydrophobicContact CZ-CB 4.22Å; F41-V50 HydrophobicContact CZ-CG1 3.88Å; F41-V50 HydrophobicContact CZ-CG2 4.4Å; D45-V50 HydrophobicContact CB-CG2 4.15Å; L46-V50 WeakPolarHBondContact O-CG2 3.39Å; L46-V50 PolarHBondContact O-N 3.49Å; V50-T53 PolarHBondContact O-N 2.98Å; V50-A54 WeakPolarHBondContact O-CB 3.18Å; V50-A54 PolarHBondContact O-N 3.32Å; V50-L70 HydrophobicContact CB-CD1 4.04Å; V50-L70 HydrophobicContact CG1-CD1 3.55Å
51	K	92.4	Very high	85.6	Confident	3 Å²	3	51.7 Å²	51.7	1%	0.013	27%	0.274	C	S	.	.	H	α-helix	trans	-61.6	-51.3	178.1	-177	-175.6	72.8	169.5	0	111.8	I47 V48 T53 A54 I55 L66 Y68 L70 E85 L103	I47-K51 VanDerWaalsContact O-CB 3.22Å; I47-K51 WeakPolarHBondContact O-CB 3.47Å; I47-K51 PolarHBondContact O-N 2.97Å; V48-K51 PolarHBondContact O-N 3.18Å; K51-T53 VanDerWaalsContact C-N 3.3Å; K51-T53 PolarHBondContact O-N 3.16Å; K51-A54 PolarHBondContact O-N 3.31Å; K51-I55 HydrophobicContact CG-CD1 4Å; K51-I55 WeakPolarHBondContact O-CG1 3.36Å; K51-I55 PolarHBondContact O-N 2.91Å; K51-L66 PolarHBondContact NZ-O 3Å; K51-Y68 VanDerWaalsContact CD-O 3.29Å; K51-Y68 WeakPolarHBondContact CD-O 3.31Å; K51-Y68 PolarHBondContact NZ-O 2.85Å; K51-Y68 VanDerWaalsContact NZ-O 3.1Å; K51-L70 HydrophobicContact CB-CD1 3.96Å; K51-L70 HydrophobicContact CB-CG 4.08Å; K51-L70 HydrophobicContact CG-CG 4.39Å; K51-E85 IonicContact NZ-OE1 3.73Å; K51-E85 PolarHBondContact NZ-OE1 3.14Å; K51-E85 IonicContact NZ-OE2 2.63Å; K51-E85 PolarHBondContact NZ-OE2 3.45Å; K51-L103 HydrophobicContact CG-CD1 3.99Å
52	L	89.2	Confident	85.2	Confident	49 Å²	49	52.2 Å²	52.2	26%	0.257	28%	0.277	S	S	.	.	H	α-helix	trans	-66.6	-33.5	-177.9	-70.3	173.4	0	0	0	111.8	V48 D49 K56	V48-L52 HydrophobicContact CG2-CD1 4Å; V48-L52 HydrophobicContact CG2-CG 4.41Å; V48-L52 WeakPolarHBondContact O-CB 3.31Å; V48-L52 VanDerWaalsContact O-CG 3.29Å; V48-L52 WeakPolarHBondContact O-CG 3.4Å; V48-L52 PolarHBondContact O-N 3.4Å; D49-L52 PolarHBondContact O-N 2.93Å; L52-K56 VanDerWaalsContact O-CB 3.28Å; L52-K56 WeakPolarHBondContact O-CB 3.39Å; L52-K56 WeakPolarHBondContact O-CD 3.42Å; L52-K56 WeakPolarHBondContact O-CG 3.25Å; L52-K56 PolarHBondContact O-N 3.13Å
53	T	90.3	Very high	84.9	Confident	62 Å²	62	59 Å²	59	38%	0.38	30%	0.303	S	S	.	.	H	α-helix	trans	-68.6	-41.4	174.4	-57.2	0	0	0	0	111.7	F41 D49 V50 K51 K56 R57	F41-T53 HydrophobicContact CE1-CG2 3.78Å; F41-T53 HydrophobicContact CZ-CG2 3.96Å; D49-T53 VanDerWaalsContact O-CB 3.26Å; D49-T53 WeakPolarHBondContact O-CB 3.3Å; D49-T53 PolarHBondContact O-N 3.29Å; D49-T53 PolarHBondContact O-OG1 3.16Å; V50-T53 PolarHBondContact O-N 2.98Å; K51-T53 VanDerWaalsContact C-N 3.3Å; K51-T53 PolarHBondContact O-N 3.16Å; T53-K56 PolarHBondContact O-N 3.02Å; T53-R57 WeakPolarHBondContact O-CB 3.4Å; T53-R57 PolarHBondContact O-N 3.38Å
54	A	89.7	Confident	84.8	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-61.2	-47.8	174.3	0	0	0	0	0	112.3	V29 F39 V50 K51 R57 S58	V29-A54 HydrophobicContact CG1-CB 4.43Å; V29-A54 HydrophobicContact CG2-CB 4.47Å; F39-A54 HydrophobicContact CE1-CB 4.27Å; F39-A54 HydrophobicContact CE2-CB 4.23Å; F39-A54 HydrophobicContact CZ-CB 3.92Å; V50-A54 WeakPolarHBondContact O-CB 3.18Å; V50-A54 PolarHBondContact O-N 3.32Å; K51-A54 PolarHBondContact O-N 3.31Å; A54-R57 PolarHBondContact O-N 3.26Å; A54-S58 PolarHBondContact O-N 3.34Å; A54-S58 VanDerWaalsContact O-N 3.17Å
55	I	88.9	Confident	84.8	Confident	9 Å²	9	62.6 Å²	62.6	5%	0.046	32%	0.316	C	S	.	.	H	α-helix	trans	-59.8	-51	176.5	-67.3	168.9	0	0	0	110.8	K51 R57 S58 L62 E65 L103	K51-I55 HydrophobicContact CG-CD1 4Å; K51-I55 WeakPolarHBondContact O-CG1 3.36Å; K51-I55 PolarHBondContact O-N 2.91Å; I55-R57 VanDerWaalsContact C-N 3.33Å; I55-R57 PolarHBondContact O-N 2.94Å; I55-S58 PolarHBondContact O-N 3.45Å; I55-S58 PolarHBondContact O-OG 2.81Å; I55-L62 HydrophobicContact CG1-CD1 4.48Å; I55-E65 HydrophobicContact CD1-CB 4.4Å; I55-E65 HydrophobicContact CG2-CG 4.18Å; I55-L103 HydrophobicContact CD1-CD1 4.47Å; I55-L103 HydrophobicContact CD1-CD2 4.32Å; I55-L103 HydrophobicContact CG1-CD1 4.42Å; I55-L103 HydrophobicContact CG1-CD2 3.66Å
56	K	87.2	Confident	84.7	Confident	172 Å²	172	62.5 Å²	62.5	75%	0.748	32%	0.316	S	S	*	.	H	α-helix	trans	-65.1	-28.2	-176.6	-75	171.2	-178.2	177.9	0	114.7	L52 T53	L52-K56 VanDerWaalsContact O-CB 3.28Å; L52-K56 WeakPolarHBondContact O-CB 3.39Å; L52-K56 WeakPolarHBondContact O-CD 3.42Å; L52-K56 WeakPolarHBondContact O-CG 3.25Å; L52-K56 PolarHBondContact O-N 3.13Å; T53-K56 PolarHBondContact O-N 3.02Å
57	R	84.4	Confident	84.9	Confident	166 Å²	166	61.4 Å²	61.4	63%	0.626	31%	0.31	S	S	*	.	H	α-helix	trans	-82	-39.5	179	-169	-176.5	-176	118	-0.4	111.7	E37 F39 T53 A54 I55	E37-R57 WeakPolarHBondContact OE2-CD 3.08Å; E37-R57 WeakPolarHBondContact OE2-CG 3.42Å; E37-R57 IonicContact OE2-NE 2.74Å; F39-R57 HydrophobicContact CE1-CB 3.76Å; F39-R57 HydrophobicContact CE1-CG 4.16Å; F39-R57 HydrophobicContact CZ-CB 4.23Å; T53-R57 WeakPolarHBondContact O-CB 3.4Å; T53-R57 PolarHBondContact O-N 3.38Å; A54-R57 PolarHBondContact O-N 3.26Å; I55-R57 VanDerWaalsContact C-N 3.33Å; I55-R57 PolarHBondContact O-N 2.94Å
58	S	74.8	Confident	85	Confident	10 Å²	10	63.1 Å²	63.1	7%	0.07	32%	0.317	C	S	.	.	S	Bend	trans	-63.8	136.2	172.1	78.2	0	0	0	0	109.9	M31 E37 A54 I55 S60	M31-S58 VanDerWaalsContact CE-OG 3.24Å; M31-S58 WeakPolarHBondContact CE-OG 3.44Å; E37-S58 WeakPolarHBondContact OE1-CA 3.39Å; A54-S58 PolarHBondContact O-N 3.34Å; A54-S58 VanDerWaalsContact O-N 3.17Å; I55-S58 PolarHBondContact O-N 3.45Å; I55-S58 PolarHBondContact O-OG 2.81Å; S58-S60 PolarHBondContact O-N 3.27Å; S58-S60 PolarHBondContact OG-OG 3.15Å
59	N	63.5	Low	85.2	Confident	175 Å²	175	61.3 Å²	61.3	94%	0.936	31%	0.306	S	S	*	.			trans	-77.1	28.8	171.1	-74.2	-50.9	0	0	0	112.3
60	S	68.1	Low	85.4	Confident	20 Å²	20	58.1 Å²	58.1	14%	0.14	29%	0.289	C	S	.	.			trans	-89.9	112	-173.8	73.3	0	0	0	0	111.3	S58 L62	S58-S60 PolarHBondContact O-N 3.27Å; S58-S60 PolarHBondContact OG-OG 3.15Å; S60-L62 PolarHBondContact O-N 2.84Å
61	C	71.1	Confident	85.5	Confident	126 Å²	126	59.2 Å²	59.2	85%	0.851	29%	0.294	S	S	*	.			trans	-77.5	73.7	176.2	-171.5	0	0	0	0	110.6
62	L	81.2	Confident	85.6	Confident	23 Å²	23	61 Å²	61	12%	0.12	30%	0.303	C	S	.	.			trans	-72.2	141.4	178.2	-58.1	-178.3	0	0	0	110.7	P32 I55 S60 E65 Y68 L103	P32-L62 HydrophobicContact CB-CD2 4.11Å; P32-L62 HydrophobicContact CG-CD1 4.04Å; P32-L62 HydrophobicContact CG-CD2 3.79Å; I55-L62 HydrophobicContact CG1-CD1 4.48Å; S60-L62 PolarHBondContact O-N 2.84Å; L62-E65 HydrophobicContact CB-CG 4.08Å; L62-Y68 HydrophobicContact CB-CE2 4.08Å; L62-Y68 HydrophobicContact CD1-CD1 4.38Å; L62-Y68 HydrophobicContact CD1-CD2 4.3Å; L62-Y68 HydrophobicContact CD1-CE1 4.37Å; L62-Y68 HydrophobicContact CD1-CE2 4.28Å; L62-Y68 HydrophobicContact CD1-CG 4.35Å; L62-L103 HydrophobicContact CD1-CD2 3.75Å
63	K	83.4	Confident	85.6	Confident	177 Å²	177	60.2 Å²	60.2	77%	0.77	30%	0.301	S	S	*	.	S	Bend	trans	-96.5	133.9	172.5	-67.3	175.4	-177.7	172.3	0	108.2
64	D	85.8	Confident	85.5	Confident	54 Å²	54	61.8 Å²	61.8	29%	0.289	31%	0.313	S	S	.	.	S	Bend	trans	64.4	44.8	-179.1	-164.9	36.9	0	0	0	112.6	L66 N67 Y105 Q157	D64-L66 PolarHBondContact O-N 3.39Å; D64-L66 VanDerWaalsContact O-N 3.09Å; D64-N67 PolarHBondContact O-N 2.94Å; D64-N67 PolarHBondContact OD1-ND2 3.19Å; D64-N67 VanDerWaalsContact OD2-CB 3.29Å; D64-N67 WeakPolarHBondContact OD2-CB 3.4Å; D64-N67 PolarHBondContact OD2-ND2 3.29Å; D64-Y105 HydrophobicContact CB-CE2 4.15Å; D64-Y105 WeakPolarHBondContact OD2-CE2 3.46Å; D64-Y105 PolarHBondContact OD2-OH 3.43Å; D64-Q157 PolarHBondContact OD1-NE2 2.85Å; D64-Q157 VanDerWaalsContact OD1-NE2 3.13Å; D64-Q157 PolarHBondContact OD2-NE2 3.37Å
65	E	87.1	Confident	85.4	Confident	86 Å²	86	64.1 Å²	64.1	40%	0.402	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-43.4	-41.2	-179.7	-69.3	168.8	-143.7	0	0	114.3	I55 L62 N67 Y68	I55-E65 HydrophobicContact CD1-CB 4.4Å; I55-E65 HydrophobicContact CG2-CG 4.18Å; L62-E65 HydrophobicContact CB-CG 4.08Å; E65-N67 PolarHBondContact O-N 3.28Å; E65-Y68 WeakPolarHBondContact O-CB 3.29Å; E65-Y68 PolarHBondContact O-N 3.44Å
66	L	88.4	Confident	85	Confident	50 Å²	50	71.5 Å²	71.5	26%	0.262	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-66.1	-22.5	-177	-59.6	178.1	0	0	0	113.2	K51 D64	K51-L66 PolarHBondContact NZ-O 3Å; D64-L66 PolarHBondContact O-N 3.39Å; D64-L66 VanDerWaalsContact O-N 3.09Å
67	N	93.9	Very high	84.7	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-95.9	5.1	175.8	-80.5	-32.1	0	0	0	113.7	D64 E65 Y105 K106 Q157 Y191 R192	D64-N67 PolarHBondContact O-N 2.94Å; D64-N67 PolarHBondContact OD1-ND2 3.19Å; D64-N67 VanDerWaalsContact OD2-CB 3.29Å; D64-N67 WeakPolarHBondContact OD2-CB 3.4Å; D64-N67 PolarHBondContact OD2-ND2 3.29Å; E65-N67 PolarHBondContact O-N 3.28Å; N67-Y105 HydrophobicContact CB-CD2 4.29Å; N67-Y105 HydrophobicContact CB-CE2 3.54Å; N67-K106 WeakPolarHBondContact O-CB 3.36Å; N67-K106 VanDerWaalsContact O-CG 3.28Å; N67-K106 WeakPolarHBondContact O-CG 3.44Å; N67-K106 PolarHBondContact O-N 2.93Å; N67-Q157 PolarHBondContact ND2-NE2 2.66Å; N67-Y191 HydrophobicContact CB-CD2 4.14Å; N67-Y191 HydrophobicContact CB-CE2 3.8Å; N67-Y191 VanDerWaalsContact CG-CE2 3.45Å; N67-Y191 WeakPolarHBondContact OD1-CD2 3.1Å; N67-R192 PolarHBondContact ND2-O 3.23Å; N67-R192 PolarHBondContact OD1-N 2.87Å
68	Y	93.9	Very high	84.7	Confident	37 Å²	37	66.7 Å²	66.7	15%	0.145	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	149.7	153.8	-72.2	-100.5	0	0	0	109.7	P32 K51 L62 E65 L103 K104 Y105	P32-Y68 HydrophobicContact CB-CE1 4.01Å; P32-Y68 HydrophobicContact CG-CD1 3.94Å; P32-Y68 HydrophobicContact CG-CE1 3.43Å; P32-Y68 VanDerWaalsContact CG-CE1 3.43Å; K51-Y68 VanDerWaalsContact CD-O 3.29Å; K51-Y68 WeakPolarHBondContact CD-O 3.31Å; K51-Y68 PolarHBondContact NZ-O 2.85Å; K51-Y68 VanDerWaalsContact NZ-O 3.1Å; L62-Y68 HydrophobicContact CB-CE2 4.08Å; L62-Y68 HydrophobicContact CD1-CD1 4.38Å; L62-Y68 HydrophobicContact CD1-CD2 4.3Å; L62-Y68 HydrophobicContact CD1-CE1 4.37Å; L62-Y68 HydrophobicContact CD1-CE2 4.28Å; L62-Y68 HydrophobicContact CD1-CG 4.35Å; E65-Y68 WeakPolarHBondContact O-CB 3.29Å; E65-Y68 PolarHBondContact O-N 3.44Å; Y68-L103 HydrophobicContact CD1-CG 4.12Å; Y68-L103 HydrophobicContact CG-CG 4.48Å; Y68-K104 WeakPolarHBondContact CA-O 3.39Å; Y68-Y105 AromaticContact CD2-CD2 3.83Å; Y68-Y105 HydrophobicContact CD2-CD2 3.83Å; Y68-Y105 HydrophobicContact CE1-CD2 4.49Å; Y68-Y105 AromaticContact CE2-CD2 3.66Å; Y68-Y105 HydrophobicContact CE2-CD2 3.66Å; Y68-Y105 HydrophobicContact CE2-CE2 4.39Å; Y68-Y105 HydrophobicContact CG-CD2 4.33Å
69	G	93.8	Very high	85.2	Confident	1 Å²	1	69.5 Å²	69.5	1%	0.01	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	151.7	173.7	0	0	0	0	0	110.3	K104	G69-K104 PolarHBondContact N-O 3.38Å; G69-K104 PolarHBondContact O-N 3.26Å
70	L	94.7	Very high	86.4	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.005	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	132.2	168.7	-68.6	169.6	0	0	0	108.8	V29 I47 V50 K51 F82 L83 L101 L103	V29-L70 HydrophobicContact CG1-CD2 4.07Å; I47-L70 HydrophobicContact CG2-CD1 4.2Å; V50-L70 HydrophobicContact CB-CD1 4.04Å; V50-L70 HydrophobicContact CG1-CD1 3.55Å; K51-L70 HydrophobicContact CB-CD1 3.96Å; K51-L70 HydrophobicContact CB-CG 4.08Å; K51-L70 HydrophobicContact CG-CG 4.39Å; L70-F82 WeakPolarHBondContact O-CA 3.42Å; L70-L83 HydrophobicContact CB-CD1 4.36Å; L70-L83 WeakPolarHBondContact O-CD1 3.33Å; L70-L83 PolarHBondContact O-N 2.93Å; L70-L101 HydrophobicContact CB-CD1 4.28Å; L70-L101 HydrophobicContact CD1-CD1 4.19Å; L70-L101 HydrophobicContact CD2-CB 4.43Å; L70-L101 HydrophobicContact CD2-CD1 4.35Å; L70-L103 HydrophobicContact CD2-CD1 4.17Å
71	F	94.4	Very high	87.5	Confident	22 Å²	22	65.1 Å²	65.1	10%	0.096	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	127.3	-177.2	-176.6	-90.5	0	0	0	109.4	P73 G80 K81 F82 L101 E102 K104 V109	F71-P73 WeakPolarHBondContact O-CD 3.28Å; F71-G80 VanDerWaalsContact CZ-C 3.46Å; F71-K81 WeakPolarHBondContact CA-O 3.31Å; F71-F82 HydrophobicContact CB-CD1 3.94Å; F71-F82 HydrophobicContact CB-CE1 3.95Å; F71-F82 AromaticContact CD2-CD1 3.95Å; F71-F82 HydrophobicContact CD2-CD1 3.95Å; F71-F82 AromaticContact CD2-CD2 3.96Å; F71-F82 HydrophobicContact CD2-CD2 3.96Å; F71-F82 AromaticContact CD2-CE1 3.97Å; F71-F82 HydrophobicContact CD2-CE1 3.97Å; F71-F82 AromaticContact CD2-CE2 3.97Å; F71-F82 HydrophobicContact CD2-CE2 3.97Å; F71-F82 AromaticContact CD2-CG 3.95Å; F71-F82 HydrophobicContact CD2-CG 3.95Å; F71-F82 AromaticContact CD2-CZ 3.97Å; F71-F82 HydrophobicContact CD2-CZ 3.97Å; F71-F82 HydrophobicContact CE2-CD2 4.46Å; F71-F82 HydrophobicContact CE2-CE2 4.4Å; F71-F82 HydrophobicContact CG-CD1 4.46Å; F71-F82 HydrophobicContact CG-CE1 4.41Å; F71-L101 WeakPolarHBondContact O-CA 3.41Å; F71-E102 HydrophobicContact CB-CB 4.45Å; F71-E102 WeakPolarHBondContact CB-O 3.23Å; F71-E102 WeakPolarHBondContact CD1-OE2 3.42Å; F71-E102 PolarHBondContact N-O 3.32Å; F71-E102 PolarHBondContact O-N 2.93Å; F71-K104 HydrophobicContact CB-CB 4.38Å; F71-K104 HydrophobicContact CB-CD 4.47Å; F71-K104 HydrophobicContact CD1-CD 4.3Å; F71-K104 HydrophobicContact CG-CD 4.39Å; F71-V109 HydrophobicContact CE2-CG2 4.26Å
72	L	93.1	Very high	88.6	Confident	40 Å²	40	60.1 Å²	60.1	21%	0.209	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	119.2	169.8	-174.6	67.8	0	0	0	107.9	G80 K81 L83 F94 L101	L72-G80 CarbonylContact O-C 3.59Å; L72-G80 WeakPolarHBondContact O-CA 3.06Å; L72-K81 HydrophobicContact CB-CG 4.24Å; L72-K81 PolarHBondContact N-O 3.46Å; L72-K81 PolarHBondContact O-N 3.15Å; L72-L83 HydrophobicContact CB-CD1 3.89Å; L72-F94 HydrophobicContact CD1-CD1 4.46Å; L72-F94 HydrophobicContact CD1-CE1 4.18Å; L72-L101 HydrophobicContact CB-CD2 4.27Å; L72-L101 HydrophobicContact CD1-CD2 3.98Å
73	P	90.4	Very high	89.1	Confident	34 Å²	34	59.3 Å²	59.3	22%	0.221	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-59.6	156.5	177.1	-24.4	35.3	0	0	0	112.5	F71 S75 H100 E102	F71-P73 WeakPolarHBondContact O-CD 3.28Å; P73-S75 PolarHBondContact O-N 2.81Å; P73-H100 WeakPolarHBondContact CD-O 3.2Å; P73-E102 HydrophobicContact CG-CG 3.95Å
74	P	88.4	Confident	89.3	Confident	95 Å²	95	51.8 Å²	51.8	62%	0.617	29%	0.293	S	S	*	.	P	Polyproline II helix	trans	-63.2	127.3	172.8	-15.1	28.7	0	0	0	110.9	K78	P74-K78 WeakPolarHBondContact CA-O 3.23Å
75	S	86.1	Confident	89.4	Confident	49 Å²	49	50.3 Å²	50.3	34%	0.343	28%	0.284	S	S	.	.	B	Isolated β-bridge	trans	-140	142.6	-179.4	64.5	0	0	0	0	111.2	P73 G77 K78	P73-S75 PolarHBondContact O-N 2.81Å; S75-G77 PolarHBondContact O-N 3.24Å; S75-K78 PolarHBondContact N-O 3.07Å; S75-K78 WeakPolarHBondContact O-CA 3.21Å; S75-K78 WeakPolarHBondContact O-CB 3.18Å; S75-K78 PolarHBondContact O-N 3.04Å
76	K	81.9	Confident	89.2	Confident	164 Å²	164	49 Å²	49	71%	0.713	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	42.8	44	178.7	-61.4	-176	-174.4	164.6	0	114.6	K78 E95	K76-K78 PolarHBondContact O-N 3.31Å; K76-E95 WeakPolarHBondContact CD-OE1 3.36Å; K76-E95 WeakPolarHBondContact CD-OE2 3.47Å; K76-E95 WeakPolarHBondContact CE-OE1 3.46Å; K76-E95 WeakPolarHBondContact CE-OE2 3.43Å; K76-E95 IonicContact NZ-OE1 3.87Å; K76-E95 PolarHBondContact NZ-OE1 3.28Å; K76-E95 IonicContact NZ-OE2 3.83Å; K76-E95 PolarHBondContact NZ-OE2 3.45Å
77	G	80.6	Confident	89.1	Confident	88 Å²	88	50.8 Å²	50.8	91%	0.907	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	-14.2	-178.6	0	0	0	0	0	115.8	S75 A79	S75-G77 PolarHBondContact O-N 3.24Å; G77-A79 PolarHBondContact O-N 3.22Å
78	K	85.1	Confident	88.8	Confident	149 Å²	149	51.7 Å²	51.7	65%	0.648	29%	0.288	S	S	*	.	B	Isolated β-bridge	trans	-69.7	129.5	171.9	-60.1	-174.7	177.7	-174.5	0	109.3	P74 S75 K76	P74-K78 WeakPolarHBondContact CA-O 3.23Å; S75-K78 PolarHBondContact N-O 3.07Å; S75-K78 WeakPolarHBondContact O-CA 3.21Å; S75-K78 WeakPolarHBondContact O-CB 3.18Å; S75-K78 PolarHBondContact O-N 3.04Å; K76-K78 PolarHBondContact O-N 3.31Å
79	A	85.4	Confident	88.6	Confident	69 Å²	69	50.1 Å²	50.1	57%	0.57	28%	0.282	S	S	*	.	P	Polyproline II helix	trans	-69	137.6	178.2	0	0	0	0	0	111.1	G77	G77-A79 PolarHBondContact O-N 3.22Å
80	G	88.4	Confident	88.3	Confident	10 Å²	10	54.9 Å²	54.9	10%	0.103	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-61.6	144.4	176.9	0	0	0	0	0	112.3	F71 L72	F71-G80 VanDerWaalsContact CZ-C 3.46Å; L72-G80 CarbonylContact O-C 3.59Å; L72-G80 WeakPolarHBondContact O-CA 3.06Å
81	K	91.5	Very high	88	Confident	92 Å²	92	57.2 Å²	57.2	40%	0.4	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	145	-170.5	63.5	-179.6	-178.7	179.7	0	111.6	F71 L72	F71-K81 WeakPolarHBondContact CA-O 3.31Å; L72-K81 HydrophobicContact CB-CG 4.24Å; L72-K81 PolarHBondContact N-O 3.46Å; L72-K81 PolarHBondContact O-N 3.15Å
82	F	93.4	Very high	87.7	Confident	22 Å²	22	56.9 Å²	56.9	10%	0.096	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	142	162.1	-70.9	-75.5	0	0	0	110	L70 F71 K104 K106 V109 H188	L70-F82 WeakPolarHBondContact O-CA 3.42Å; F71-F82 HydrophobicContact CB-CD1 3.94Å; F71-F82 HydrophobicContact CB-CE1 3.95Å; F71-F82 AromaticContact CD2-CD1 3.95Å; F71-F82 HydrophobicContact CD2-CD1 3.95Å; F71-F82 AromaticContact CD2-CD2 3.96Å; F71-F82 HydrophobicContact CD2-CD2 3.96Å; F71-F82 AromaticContact CD2-CE1 3.97Å; F71-F82 HydrophobicContact CD2-CE1 3.97Å; F71-F82 AromaticContact CD2-CE2 3.97Å; F71-F82 HydrophobicContact CD2-CE2 3.97Å; F71-F82 AromaticContact CD2-CG 3.95Å; F71-F82 HydrophobicContact CD2-CG 3.95Å; F71-F82 AromaticContact CD2-CZ 3.97Å; F71-F82 HydrophobicContact CD2-CZ 3.97Å; F71-F82 HydrophobicContact CE2-CD2 4.46Å; F71-F82 HydrophobicContact CE2-CE2 4.4Å; F71-F82 HydrophobicContact CG-CD1 4.46Å; F71-F82 HydrophobicContact CG-CE1 4.41Å; F82-K104 HydrophobicContact CE1-CB 3.94Å; F82-K104 WeakPolarHBondContact CE1-O 3.36Å; F82-K104 HydrophobicContact CZ-CB 4.12Å; F82-K106 HydrophobicContact CD1-CG 4.46Å; F82-K106 HydrophobicContact CE1-CG 4.29Å; F82-K106 HydrophobicContact CZ-CG 4.44Å; F82-V109 HydrophobicContact CD2-CG2 3.99Å; F82-V109 HydrophobicContact CE2-CG2 3.77Å; F82-H188 AromaticContact CD2-CE1 3.59Å; F82-H188 AromaticContact CE2-CE1 3.86Å; F82-H188 AromaticContact CE2-NE2 3.87Å
83	L	92.5	Very high	87.3	Confident	6 Å²	6	60.6 Å²	60.6	3%	0.031	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-81.7	141.1	173.5	-70.1	73.4	0	0	0	108.9	I47 L70 L72 Y92 L101	I47-L83 HydrophobicContact CD1-CD2 3.6Å; I47-L83 HydrophobicContact CG1-CB 4.19Å; I47-L83 HydrophobicContact CG1-CD2 4.16Å; I47-L83 HydrophobicContact CG2-CB 3.61Å; I47-L83 HydrophobicContact CG2-CD2 4.45Å; L70-L83 HydrophobicContact CB-CD1 4.36Å; L70-L83 WeakPolarHBondContact O-CD1 3.33Å; L70-L83 PolarHBondContact O-N 2.93Å; L72-L83 HydrophobicContact CB-CD1 3.89Å; L83-Y92 HydrophobicContact CB-CE1 4.14Å; L83-Y92 HydrophobicContact CB-CE2 4.11Å; L83-Y92 HydrophobicContact CD2-CD1 3.99Å; L83-Y92 HydrophobicContact CD2-CD2 3.75Å; L83-Y92 HydrophobicContact CD2-CE1 4.34Å; L83-Y92 HydrophobicContact CD2-CE2 4.1Å; L83-Y92 HydrophobicContact CD2-CG 3.68Å; L83-Y92 HydrophobicContact CG-CD1 3.81Å; L83-Y92 HydrophobicContact CG-CD2 4.21Å; L83-Y92 HydrophobicContact CG-CE1 3.78Å; L83-Y92 HydrophobicContact CG-CE2 4.18Å; L83-Y92 HydrophobicContact CG-CG 4.03Å; L83-L101 HydrophobicContact CD1-CD2 3.74Å; L83-L101 HydrophobicContact CD2-CD1 4.19Å; L83-L101 HydrophobicContact CD2-CD2 4.11Å
84	Q	87.5	Confident	87	Confident	19 Å²	19	61.1 Å²	61.1	9%	0.089	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-74.4	125.5	177.1	-68.7	179.1	-13.6	0	0	108.7	I47 D86 R87 Y92 S431 Y433	I47-Q84 WeakPolarHBondContact CB-O 3.41Å; Q84-D86 VanDerWaalsContact C-N 3.26Å; Q84-D86 PolarHBondContact O-N 3.2Å; Q84-R87 HydrophobicContact CB-CG 4.14Å; Q84-R87 PolarHBondContact O-N 3.16Å; Q84-R87 VanDerWaalsContact OE1-CZ 3.25Å; Q84-Y92 PolarHBondContact N-OH 3.01Å; Q84-S431 PolarHBondContact NE2-O 3.36Å; Q84-Y433 PolarHBondContact NE2-OH 3.35Å
85	E	87.6	Confident	86.4	Confident	22 Å²	22	62.8 Å²	62.8	10%	0.103	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-23.3	-168.7	-72.8	-173.5	-161.2	0	0	114.5	V48 K51 K106	V48-E85 HydrophobicContact CB-CB 4.13Å; V48-E85 WeakPolarHBondContact CB-O 3.5Å; V48-E85 PolarHBondContact N-O 3.42Å; K51-E85 IonicContact NZ-OE1 3.73Å; K51-E85 PolarHBondContact NZ-OE1 3.14Å; K51-E85 IonicContact NZ-OE2 2.63Å; K51-E85 PolarHBondContact NZ-OE2 3.45Å; E85-K106 WeakPolarHBondContact OE1-CE 3.26Å; E85-K106 IonicContact OE1-NZ 2.72Å; E85-K106 PolarHBondContact OE1-NZ 3.33Å
86	D	81.5	Confident	85.8	Confident	58 Å²	58	63.6 Å²	63.6	31%	0.31	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-3.3	-178.8	66	-32.9	0	0	0	114.5	Q84 S221	Q84-D86 VanDerWaalsContact C-N 3.26Å; Q84-D86 PolarHBondContact O-N 3.2Å; D86-S221 WeakPolarHBondContact OD2-CB 3.41Å; D86-S221 PolarHBondContact OD2-OG 3.4Å
87	R	86.2	Confident	85.6	Confident	88 Å²	88	59.6 Å²	59.6	33%	0.332	34%	0.34	S	S	.	.	S	Bend	trans	-85.6	163.6	172.4	-70.5	-158.5	-161.5	-154.9	2.9	112.5	L46 I47 Q84 D91 Y92	L46-R87 WeakPolarHBondContact CA-O 3.34Å; I47-R87 PolarHBondContact N-O 3.4Å; Q84-R87 HydrophobicContact CB-CG 4.14Å; Q84-R87 PolarHBondContact O-N 3.16Å; Q84-R87 VanDerWaalsContact OE1-CZ 3.25Å; R87-D91 HydrophobicContact CB-CB 4.3Å; R87-Y92 HydrophobicContact CB-CE2 3.84Å
88	M	88.4	Confident	85.7	Confident	20 Å²	20	56.2 Å²	56.2	10%	0.099	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-86.4	158.5	171.7	-70.9	-178.3	174.4	0	0	111.5	T44 D45 L46 L90 D91 I376	T44-M88 WeakPolarHBondContact O-CE 3.48Å; D45-M88 CarbonylContact O-C 3.51Å; D45-M88 WeakPolarHBondContact O-CA 3.21Å; L46-M88 HydrophobicContact CD2-CE 4.4Å; L46-M88 HydrophobicContact CD2-CG 3.95Å; M88-L90 PolarHBondContact O-N 2.79Å; M88-D91 WeakPolarHBondContact O-CB 3.43Å; M88-D91 PolarHBondContact O-N 3.37Å; M88-D91 VanDerWaalsContact O-N 3.1Å; M88-I376 HydrophobicContact CE-CB 3.82Å; M88-I376 HydrophobicContact CE-CD1 4.21Å; M88-I376 HydrophobicContact CE-CG2 3.67Å; M88-I376 HydrophobicContact SD-CB 4.28Å; M88-I376 HydrophobicContact SD-CD1 4.04Å; M88-I376 HydrophobicContact SD-CG2 3.61Å
89	L	88.9	Confident	85.8	Confident	4 Å²	4	49.1 Å²	49.1	2%	0.021	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-57	-36.5	175.9	-174.5	62.1	0	0	0	112.6	V25 I27 F41 P43 D45 I47 D91 Y92 F94	V25-L89 HydrophobicContact CB-CD2 3.8Å; V25-L89 HydrophobicContact CG1-CD2 4.03Å; V25-L89 HydrophobicContact CG2-CD2 4.14Å; I27-L89 HydrophobicContact CD1-CD1 3.58Å; I27-L89 HydrophobicContact CD1-CD2 3.8Å; I27-L89 HydrophobicContact CD1-CG 4.34Å; F41-L89 HydrophobicContact CB-CD2 3.88Å; P43-L89 PolarHBondContact O-N 2.93Å; D45-L89 PolarHBondContact O-N 2.88Å; I47-L89 HydrophobicContact CD1-CB 4.49Å; I47-L89 HydrophobicContact CD1-CD1 4.06Å; L89-D91 PolarHBondContact O-N 3.28Å; L89-Y92 PolarHBondContact O-N 3.26Å; L89-F94 HydrophobicContact CD1-CE2 3.94Å; L89-F94 HydrophobicContact CD1-CZ 4.17Å
90	L	89.4	Confident	86	Confident	100 Å²	100	49.3 Å²	49.3	52%	0.524	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-61.8	-22.2	177.2	-172.5	62.7	0	0	0	114.2	P43 M88 Y92	P43-L90 HydrophobicContact CB-CB 4.08Å; P43-L90 HydrophobicContact CB-CD1 4.29Å; P43-L90 WeakPolarHBondContact O-CB 3.12Å; P43-L90 PolarHBondContact O-N 2.87Å; M88-L90 PolarHBondContact O-N 2.79Å; L90-Y92 PolarHBondContact O-N 3.41Å
91	D	87.3	Confident	86.3	Confident	51 Å²	51	48.9 Å²	48.9	27%	0.273	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-69.8	-5.4	171.7	-75.7	-61.9	0	0	0	112.7	R87 M88 L89 R371	R87-D91 HydrophobicContact CB-CB 4.3Å; M88-D91 WeakPolarHBondContact O-CB 3.43Å; M88-D91 PolarHBondContact O-N 3.37Å; M88-D91 VanDerWaalsContact O-N 3.1Å; L89-D91 PolarHBondContact O-N 3.28Å; D91-R371 IonicContact OD1-CZ 3.71Å; D91-R371 IonicContact OD1-NH1 3.85Å; D91-R371 PolarHBondContact OD1-NH1 3.22Å; D91-R371 IonicContact OD2-NH1 2.72Å
92	Y	88.1	Confident	86.4	Confident	15 Å²	15	46.2 Å²	46.2	6%	0.059	25%	0.245	C	C	.	.	S	Bend	trans	-128.4	71	-178.6	-58.4	-83.3	0	0	0	111.7	I47 L83 Q84 R87 L89 L90 F94	I47-Y92 HydrophobicContact CD1-CD2 3.97Å; I47-Y92 HydrophobicContact CD1-CE2 4.2Å; I47-Y92 HydrophobicContact CG1-CD2 4.07Å; I47-Y92 HydrophobicContact CG1-CE2 3.77Å; L83-Y92 HydrophobicContact CB-CE1 4.14Å; L83-Y92 HydrophobicContact CB-CE2 4.11Å; L83-Y92 HydrophobicContact CD2-CD1 3.99Å; L83-Y92 HydrophobicContact CD2-CD2 3.75Å; L83-Y92 HydrophobicContact CD2-CE1 4.34Å; L83-Y92 HydrophobicContact CD2-CE2 4.1Å; L83-Y92 HydrophobicContact CD2-CG 3.68Å; L83-Y92 HydrophobicContact CG-CD1 3.81Å; L83-Y92 HydrophobicContact CG-CD2 4.21Å; L83-Y92 HydrophobicContact CG-CE1 3.78Å; L83-Y92 HydrophobicContact CG-CE2 4.18Å; L83-Y92 HydrophobicContact CG-CG 4.03Å; Q84-Y92 PolarHBondContact N-OH 3.01Å; R87-Y92 HydrophobicContact CB-CE2 3.84Å; L89-Y92 PolarHBondContact O-N 3.26Å; L90-Y92 PolarHBondContact O-N 3.41Å; Y92-F94 PolarHBondContact O-N 2.95Å
93	P	84.7	Confident	86.4	Confident	117 Å²	117	45.2 Å²	45.2	76%	0.76	24%	0.241	S	C	*	.			trans	-60.7	133.1	179.5	25.2	-34.6	0	0	0	111.9
94	F	83.8	Confident	86.5	Confident	46 Å²	46	48.9 Å²	48.9	20%	0.202	26%	0.256	C	S	.	.			trans	-94.6	144.6	174.4	-58.4	-71.8	0	0	0	110.9	V25 I27 L72 L89 Y92 G99 L101	V25-F94 HydrophobicContact CG1-CD2 4Å; V25-F94 HydrophobicContact CG1-CE2 4.05Å; I27-F94 HydrophobicContact CD1-CE2 4.28Å; I27-F94 HydrophobicContact CD1-CZ 4.36Å; I27-F94 HydrophobicContact CG1-CE2 4.12Å; I27-F94 HydrophobicContact CG1-CZ 4.4Å; I27-F94 HydrophobicContact CG2-CZ 4.46Å; L72-F94 HydrophobicContact CD1-CD1 4.46Å; L72-F94 HydrophobicContact CD1-CE1 4.18Å; L89-F94 HydrophobicContact CD1-CE2 3.94Å; L89-F94 HydrophobicContact CD1-CZ 4.17Å; Y92-F94 PolarHBondContact O-N 2.95Å; F94-G99 VanDerWaalsContact CD1-CA 3.41Å; F94-L101 HydrophobicContact CE1-CD2 3.98Å; F94-L101 HydrophobicContact CE1-CG 4.11Å; F94-L101 HydrophobicContact CZ-CD1 4.19Å; F94-L101 HydrophobicContact CZ-CD2 4.29Å; F94-L101 HydrophobicContact CZ-CG 4.11Å
95	E	76.1	Confident	86.8	Confident	129 Å²	129	51 Å²	51	60%	0.603	26%	0.264	S	S	*	.	S	Bend	trans	-83.1	-17	179.4	-48.7	-170	117.7	0	0	112.9	K76	K76-E95 WeakPolarHBondContact CD-OE1 3.36Å; K76-E95 WeakPolarHBondContact CD-OE2 3.47Å; K76-E95 WeakPolarHBondContact CE-OE1 3.46Å; K76-E95 WeakPolarHBondContact CE-OE2 3.43Å; K76-E95 IonicContact NZ-OE1 3.87Å; K76-E95 PolarHBondContact NZ-OE1 3.28Å; K76-E95 IonicContact NZ-OE2 3.83Å; K76-E95 PolarHBondContact NZ-OE2 3.45Å
96	S	74.6	Confident	87.1	Confident	66 Å²	66	50 Å²	50	46%	0.462	26%	0.259	S	S	.	.	S	Bend	trans	-112.8	145.5	176.9	49.3	0	0	0	0	110	V98	S96-V98 WeakPolarHBondContact CB-O 3.29Å; S96-V98 CarbonylContact O-C 3.6Å; S96-V98 PolarHBondContact O-N 2.91Å; S96-V98 VanDerWaalsContact O-N 3.07Å; S96-V98 PolarHBondContact OG-O 3.43Å
97	S	75.7	Confident	87.6	Confident	80 Å²	80	52.9 Å²	52.9	56%	0.559	27%	0.271	S	S	*	.	S	Bend	trans	-65.4	-10.5	-179.6	53.3	0	0	0	0	114.7	I680	S97-I680 VanDerWaalsContact OG-CD1 3.24Å; S97-I680 WeakPolarHBondContact OG-CD1 3.48Å
98	V	83.8	Confident	88	Confident	18 Å²	18	50.8 Å²	50.8	11%	0.109	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	117.8	156.6	-177.1	0	0	0	0	107.8	F26 R28 T38 S96 A600 I680	F26-V98 HydrophobicContact CB-CB 4.46Å; F26-V98 HydrophobicContact CB-CG1 4.31Å; F26-V98 HydrophobicContact CB-CG2 4Å; F26-V98 CarbonylContact O-C 3.59Å; F26-V98 WeakPolarHBondContact O-CA 3.44Å; R28-V98 HydrophobicContact CB-CG1 4.19Å; T38-V98 HydrophobicContact CG2-CG1 4.2Å; S96-V98 WeakPolarHBondContact CB-O 3.29Å; S96-V98 CarbonylContact O-C 3.6Å; S96-V98 PolarHBondContact O-N 2.91Å; S96-V98 VanDerWaalsContact O-N 3.07Å; S96-V98 PolarHBondContact OG-O 3.43Å; V98-A600 HydrophobicContact CG2-CB 4.45Å; V98-I680 HydrophobicContact CG2-CD1 4.4Å
99	G	86.6	Confident	88	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	151.7	173.6	0	0	0	0	0	112	F26 I27 R28 F94	F26-G99 PolarHBondContact O-N 2.81Å; I27-G99 CarbonylContact C-O 3.25Å; I27-G99 WeakPolarHBondContact CA-O 3.48Å; R28-G99 PolarHBondContact N-O 2.64Å; F94-G99 VanDerWaalsContact CD1-CA 3.41Å
100	H	90.5	Very high	87.8	Confident	73 Å²	73	54.8 Å²	54.8	34%	0.338	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	124.5	172.2	-103	72.2	0	0	0	110.2	P73	P73-H100 WeakPolarHBondContact CD-O 3.2Å
101	L	94	Very high	87.2	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.005	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	157.5	172.5	-65.1	-179.8	0	0	0	110	I27 R28 V29 I30 L70 F71 L72 L83 F94	I27-L101 HydrophobicContact CD1-CD1 4.38Å; I27-L101 HydrophobicContact CG2-CB 4.24Å; I27-L101 HydrophobicContact CG2-CD1 3.93Å; I27-L101 HydrophobicContact CG2-CG 3.94Å; R28-L101 PolarHBondContact O-N 3.17Å; V29-L101 WeakPolarHBondContact CA-O 3.33Å; I30-L101 PolarHBondContact N-O 2.82Å; L70-L101 HydrophobicContact CB-CD1 4.28Å; L70-L101 HydrophobicContact CD1-CD1 4.19Å; L70-L101 HydrophobicContact CD2-CB 4.43Å; L70-L101 HydrophobicContact CD2-CD1 4.35Å; F71-L101 WeakPolarHBondContact O-CA 3.41Å; L72-L101 HydrophobicContact CB-CD2 4.27Å; L72-L101 HydrophobicContact CD1-CD2 3.98Å; L83-L101 HydrophobicContact CD1-CD2 3.74Å; L83-L101 HydrophobicContact CD2-CD1 4.19Å; L83-L101 HydrophobicContact CD2-CD2 4.11Å; F94-L101 HydrophobicContact CE1-CD2 3.98Å; F94-L101 HydrophobicContact CE1-CG 4.11Å; F94-L101 HydrophobicContact CZ-CD1 4.19Å; F94-L101 HydrophobicContact CZ-CD2 4.29Å; F94-L101 HydrophobicContact CZ-CG 4.11Å
102	E	93.9	Very high	86.7	Confident	35 Å²	35	59.5 Å²	59.5	16%	0.164	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	133.4	173.2	-59	167.9	124	0	0	108.6	I30 F71 P73 K104	I30-E102 HydrophobicContact CB-CG 4.28Å; I30-E102 HydrophobicContact CD1-CG 4.34Å; I30-E102 CarbonylContact O-C 3.55Å; F71-E102 HydrophobicContact CB-CB 4.45Å; F71-E102 WeakPolarHBondContact CB-O 3.23Å; F71-E102 WeakPolarHBondContact CD1-OE2 3.42Å; F71-E102 PolarHBondContact N-O 3.32Å; F71-E102 PolarHBondContact O-N 2.93Å; P73-E102 HydrophobicContact CG-CG 3.95Å; E102-K104 HydrophobicContact CB-CD 4.06Å; E102-K104 HydrophobicContact CB-CG 4.12Å; E102-K104 VanDerWaalsContact CD-CE 3.49Å; E102-K104 PolarHBondContact O-N 2.85Å; E102-K104 IonicContact OE1-NZ 3.05Å; E102-K104 PolarHBondContact OE1-NZ 2.87Å; E102-K104 WeakPolarHBondContact OE2-CE 3.4Å; E102-K104 IonicContact OE2-NZ 2.83Å; E102-K104 PolarHBondContact OE2-NZ 2.94Å
103	L	94.1	Very high	86.1	Confident	2 Å²	2	63.7 Å²	63.7	1%	0.01	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	102.6	171	-174.4	71.6	0	0	0	108.7	V29 I30 M31 P32 K51 I55 L62 Y68 L70	V29-L103 HydrophobicContact CG1-CB 4.13Å; I30-L103 PolarHBondContact O-N 3.13Å; M31-L103 HydrophobicContact CE-CD2 3.55Å; M31-L103 HydrophobicContact SD-CB 4.28Å; M31-L103 HydrophobicContact SD-CD2 4.07Å; P32-L103 HydrophobicContact CG-CD2 4.36Å; K51-L103 HydrophobicContact CG-CD1 3.99Å; I55-L103 HydrophobicContact CD1-CD1 4.47Å; I55-L103 HydrophobicContact CD1-CD2 4.32Å; I55-L103 HydrophobicContact CG1-CD1 4.42Å; I55-L103 HydrophobicContact CG1-CD2 3.66Å; L62-L103 HydrophobicContact CD1-CD2 3.75Å; Y68-L103 HydrophobicContact CD1-CG 4.12Å; Y68-L103 HydrophobicContact CG-CG 4.48Å; L70-L103 HydrophobicContact CD2-CD1 4.17Å
104	K	93.1	Very high	85.6	Confident	83 Å²	83	66.2 Å²	66.2	36%	0.361	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	144.6	-175.2	-77.1	178.7	173.6	168.2	0	111.9	Y68 G69 F71 F82 E102	Y68-K104 WeakPolarHBondContact CA-O 3.39Å; G69-K104 PolarHBondContact N-O 3.38Å; G69-K104 PolarHBondContact O-N 3.26Å; F71-K104 HydrophobicContact CB-CB 4.38Å; F71-K104 HydrophobicContact CB-CD 4.47Å; F71-K104 HydrophobicContact CD1-CD 4.3Å; F71-K104 HydrophobicContact CG-CD 4.39Å; F82-K104 HydrophobicContact CE1-CB 3.94Å; F82-K104 WeakPolarHBondContact CE1-O 3.36Å; F82-K104 HydrophobicContact CZ-CB 4.12Å; E102-K104 HydrophobicContact CB-CD 4.06Å; E102-K104 HydrophobicContact CB-CG 4.12Å; E102-K104 VanDerWaalsContact CD-CE 3.49Å; E102-K104 PolarHBondContact O-N 2.85Å; E102-K104 IonicContact OE1-NZ 3.05Å; E102-K104 PolarHBondContact OE1-NZ 2.87Å; E102-K104 WeakPolarHBondContact OE2-CE 3.4Å; E102-K104 IonicContact OE2-NZ 2.83Å; E102-K104 PolarHBondContact OE2-NZ 2.94Å
105	Y	93.9	Very high	85.3	Confident	62 Å²	62	65.2 Å²	65.2	24%	0.243	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	138.4	171.2	-166.1	-100.6	0	0	0	109.4	D64 N67 Y68 Q107 Y191	D64-Y105 HydrophobicContact CB-CE2 4.15Å; D64-Y105 WeakPolarHBondContact OD2-CE2 3.46Å; D64-Y105 PolarHBondContact OD2-OH 3.43Å; N67-Y105 HydrophobicContact CB-CD2 4.29Å; N67-Y105 HydrophobicContact CB-CE2 3.54Å; Y68-Y105 AromaticContact CD2-CD2 3.83Å; Y68-Y105 HydrophobicContact CD2-CD2 3.83Å; Y68-Y105 HydrophobicContact CE1-CD2 4.49Å; Y68-Y105 AromaticContact CE2-CD2 3.66Å; Y68-Y105 HydrophobicContact CE2-CD2 3.66Å; Y68-Y105 HydrophobicContact CE2-CE2 4.39Å; Y68-Y105 HydrophobicContact CG-CD2 4.33Å; Y105-Q107 HydrophobicContact CD1-CG 4.02Å; Y105-Q107 PolarHBondContact O-N 2.77Å; Y105-Y191 HydrophobicContact CE1-CE2 4Å; Y105-Y191 AromaticContact CZ-CE2 3.94Å; Y105-Y191 PolarHBondContact OH-OH 3.05Å
106	K	94.8	Very high	85.5	Confident	3 Å²	3	64.2 Å²	64.2	1%	0.013	32%	0.319	C	S	.	.			trans	-72.2	66.5	-172.3	-70.7	178.2	-170.7	-175.9	0	113.5	N67 F82 E85 N155 H188 D190 Y191	N67-K106 WeakPolarHBondContact O-CB 3.36Å; N67-K106 VanDerWaalsContact O-CG 3.28Å; N67-K106 WeakPolarHBondContact O-CG 3.44Å; N67-K106 PolarHBondContact O-N 2.93Å; F82-K106 HydrophobicContact CD1-CG 4.46Å; F82-K106 HydrophobicContact CE1-CG 4.29Å; F82-K106 HydrophobicContact CZ-CG 4.44Å; E85-K106 WeakPolarHBondContact OE1-CE 3.26Å; E85-K106 IonicContact OE1-NZ 2.72Å; E85-K106 PolarHBondContact OE1-NZ 3.33Å; K106-N155 WeakPolarHBondContact O-CB 3.07Å; K106-H188 PolarHBondContact O-CD2 3.2Å; K106-H188 VanDerWaalsContact O-CD2 3.31Å; K106-D190 IonicContact NZ-OD1 2.94Å; K106-D190 PolarHBondContact NZ-OD1 3.1Å; K106-D190 IonicContact NZ-OD2 2.97Å; K106-D190 PolarHBondContact NZ-OD2 2.81Å; K106-Y191 HydrophobicContact CB-CD2 3.99Å
107	Q	92.6	Very high	86	Confident	118 Å²	118	65.3 Å²	65.3	55%	0.551	32%	0.322	S	S	*	.			trans	-82.8	163.8	171.1	-63.4	-173.5	-3.7	0	0	111.4	Y105 V109 D153 H188	Y105-Q107 HydrophobicContact CD1-CG 4.02Å; Y105-Q107 PolarHBondContact O-N 2.77Å; Q107-V109 PolarHBondContact O-N 2.74Å; Q107-D153 WeakPolarHBondContact CB-OD2 3.42Å; Q107-H188 PolarHBondContact O-NE2 2.82Å
108	R	93	Very high	86.5	Confident	44 Å²	44	65.1 Å²	65.1	17%	0.166	32%	0.315	C	S	.	.			trans	-60.2	123.1	177.1	176.2	173.1	-175.8	-176.8	10	111.3	Y110 L148 L152 D153 N155 G185	R108-Y110 HydrophobicContact CB-CE2 3.98Å; R108-Y110 HydrophobicContact CG-CD2 4.46Å; R108-Y110 HydrophobicContact CG-CE1 4.14Å; R108-Y110 HydrophobicContact CG-CE2 4.05Å; R108-Y110 WeakPolarHBondContact O-CD2 3.23Å; R108-Y110 WeakPolarHBondContact O-CE2 3.38Å; R108-Y110 PolarHBondContact O-N 3.1Å; R108-L148 PolarHBondContact NH1-O 3.24Å; R108-L148 PolarHBondContact NH2-O 3.27Å; R108-L152 PolarHBondContact NH1-O 3.33Å; R108-D153 HydrophobicContact CB-CB 4.22Å; R108-D153 VanDerWaalsContact CB-CG 3.42Å; R108-D153 WeakPolarHBondContact CB-OD1 3.24Å; R108-D153 WeakPolarHBondContact CB-OD2 3.1Å; R108-D153 PolarHBondContact N-OD1 3.38Å; R108-D153 PolarHBondContact N-OD2 3.42Å; R108-N155 PolarHBondContact N-ND2 3Å; R108-G185 WeakPolarHBondContact CD-O 3.24Å; R108-G185 PolarHBondContact NE-O 2.99Å; R108-G185 PolarHBondContact NH2-O 3.43Å
109	V	88.7	Confident	86.7	Confident	40 Å²	40	70.4 Å²	70.4	24%	0.242	34%	0.336	C	S	.	.			trans	-82.5	106.2	177.8	-177.1	0	0	0	0	110.3	F71 F82 Q107 R111	F71-V109 HydrophobicContact CE2-CG2 4.26Å; F82-V109 HydrophobicContact CD2-CG2 3.99Å; F82-V109 HydrophobicContact CE2-CG2 3.77Å; Q107-V109 PolarHBondContact O-N 2.74Å; V109-R111 PolarHBondContact O-N 3.47Å
110	Y	85.8	Confident	86.7	Confident	67 Å²	67	71.3 Å²	71.3	26%	0.263	34%	0.341	S	S	.	.			trans	-85.7	96.8	-179.7	-61.6	-91	0	0	0	111.6	R108 V112 L113 L120 G151	R108-Y110 HydrophobicContact CB-CE2 3.98Å; R108-Y110 HydrophobicContact CG-CD2 4.46Å; R108-Y110 HydrophobicContact CG-CE1 4.14Å; R108-Y110 HydrophobicContact CG-CE2 4.05Å; R108-Y110 WeakPolarHBondContact O-CD2 3.23Å; R108-Y110 WeakPolarHBondContact O-CE2 3.38Å; R108-Y110 PolarHBondContact O-N 3.1Å; Y110-V112 PolarHBondContact O-N 2.82Å; Y110-L113 HydrophobicContact CD1-CD2 4.23Å; Y110-L113 HydrophobicContact CD2-CD2 4.13Å; Y110-L113 HydrophobicContact CG-CD2 3.72Å; Y110-L120 HydrophobicContact CE1-CD2 4.31Å; Y110-G151 PolarHBondContact OH-O 2.92Å
111	R	76.5	Confident	86.6	Confident	140 Å²	140	76 Å²	76	53%	0.528	36%	0.356	S	S	.	.	S	Bend	trans	-55	-37.2	173.4	-70.1	-175.9	177.5	177.1	-1.3	113.5	V109 N427 S429	V109-R111 PolarHBondContact O-N 3.47Å; R111-N427 PolarHBondContact NH1-O 2.74Å; R111-S429 VanDerWaalsContact NH2-C 3.29Å; R111-S429 PolarHBondContact NH2-O 3.49Å; R111-S429 PolarHBondContact NH2-OG 3.21Å
112	V	76.9	Confident	86.4	Confident	110 Å²	110	83.9 Å²	83.9	67%	0.667	39%	0.39	S	S	*	.	S	Bend	trans	-139	116.2	175.9	-179.3	0	0	0	0	109.1	Y110 K114	Y110-V112 PolarHBondContact O-N 2.82Å; V112-K114 VanDerWaalsContact C-N 3.3Å; V112-K114 HydrophobicContact CG1-CG 4.32Å; V112-K114 PolarHBondContact O-N 3.23Å
113	L	75.1	Confident	86.3	Confident	103 Å²	103	82.8 Å²	82.8	54%	0.539	39%	0.385	S	S	.	.			trans	-77.4	74.4	179	-73.8	167.4	0	0	0	111.6	Y110 T115 L120	Y110-L113 HydrophobicContact CD1-CD2 4.23Å; Y110-L113 HydrophobicContact CD2-CD2 4.13Å; Y110-L113 HydrophobicContact CG-CD2 3.72Å; L113-T115 PolarHBondContact O-N 3.04Å; L113-T115 VanDerWaalsContact O-N 3.1Å; L113-L120 HydrophobicContact CD2-CD1 3.79Å
114	K	74.1	Confident	86.1	Confident	171 Å²	171	84.8 Å²	84.8	74%	0.743	40%	0.396	S	S	*	.			trans	-58.9	-18.1	174	-63.2	-177.6	-178.2	177.8	0	113.8	V112	V112-K114 VanDerWaalsContact C-N 3.3Å; V112-K114 HydrophobicContact CG1-CG 4.32Å; V112-K114 PolarHBondContact O-N 3.23Å
115	T	77.2	Confident	86.1	Confident	24 Å²	24	83.2 Å²	83.2	15%	0.147	39%	0.393	C	S	.	.	S	Bend	trans	-122	127.4	-174.5	-63.4	0	0	0	0	109.9	L113 K119 L120 I123 K150	L113-T115 PolarHBondContact O-N 3.04Å; L113-T115 VanDerWaalsContact O-N 3.1Å; T115-K119 HydrophobicContact CG2-CB 3.68Å; T115-K119 HydrophobicContact CG2-CD 3.85Å; T115-K119 HydrophobicContact CG2-CG 3.61Å; T115-L120 HydrophobicContact CG2-CD2 3.74Å; T115-L120 HydrophobicContact CG2-CG 3.79Å; T115-I123 HydrophobicContact CG2-CD1 4.28Å; T115-K150 PolarHBondContact OG1-O 2.66Å; T115-K150 VanDerWaalsContact OG1-O 3.11Å
116	N	81.4	Confident	85.9	Confident	109 Å²	109	87.2 Å²	87.2	58%	0.583	41%	0.412	S	S	*	.			trans	-55.5	140.6	175.4	-178.5	-73.8	0	0	0	111.7	N118 K119 L120	N116-N118 PolarHBondContact O-N 3.18Å; N116-N118 VanDerWaalsContact O-N 3.1Å; N116-N118 WeakPolarHBondContact OD1-CB 3.42Å; N116-N118 PolarHBondContact OD1-N 2.97Å; N116-K119 WeakPolarHBondContact O-CA 3.5Å; N116-K119 WeakPolarHBondContact O-CB 3.3Å; N116-K119 PolarHBondContact O-N 2.67Å; N116-L120 PolarHBondContact O-N 3.23Å
117	V	85	Confident	85.8	Confident	88 Å²	88	90.5 Å²	90.5	53%	0.533	44%	0.44	S	S	.	.	H	α-helix	trans	-51.2	-37.3	-177.7	-176.5	0	0	0	0	113.1	K119 L120 R121	V117-K119 VanDerWaalsContact C-N 3.32Å; V117-K119 PolarHBondContact O-N 2.78Å; V117-L120 PolarHBondContact O-N 3.35Å; V117-R121 WeakPolarHBondContact O-CB 3.32Å; V117-R121 PolarHBondContact O-N 3.24Å
118	N	86.2	Confident	85.9	Confident	76 Å²	76	86.7 Å²	86.7	41%	0.406	42%	0.423	S	S	.	.	H	α-helix	trans	-69.4	-27.5	177.3	-68	-49.4	0	0	0	113.2	N116 K122	N116-N118 PolarHBondContact O-N 3.18Å; N116-N118 VanDerWaalsContact O-N 3.1Å; N116-N118 WeakPolarHBondContact OD1-CB 3.42Å; N116-N118 PolarHBondContact OD1-N 2.97Å; N118-K122 WeakPolarHBondContact O-CG 3.28Å; N118-K122 PolarHBondContact O-N 3.12Å
119	K	87	Confident	86	Confident	129 Å²	129	86.2 Å²	86.2	56%	0.561	42%	0.422	S	S	*	.	H	α-helix	trans	-81.5	-37.9	173.8	-178.5	172.6	167.3	-173.4	0	110.9	T115 N116 V117 R121 K122 I123	T115-K119 HydrophobicContact CG2-CB 3.68Å; T115-K119 HydrophobicContact CG2-CD 3.85Å; T115-K119 HydrophobicContact CG2-CG 3.61Å; N116-K119 WeakPolarHBondContact O-CA 3.5Å; N116-K119 WeakPolarHBondContact O-CB 3.3Å; N116-K119 PolarHBondContact O-N 2.67Å; V117-K119 VanDerWaalsContact C-N 3.32Å; V117-K119 PolarHBondContact O-N 2.78Å; K119-R121 VanDerWaalsContact C-N 3.34Å; K119-R121 PolarHBondContact O-N 3.46Å; K119-K122 PolarHBondContact O-N 3.07Å; K119-K122 VanDerWaalsContact O-N 3.15Å; K119-I123 HydrophobicContact CG-CD1 4.12Å; K119-I123 WeakPolarHBondContact O-CD1 3.26Å; K119-I123 WeakPolarHBondContact O-CG1 3.41Å; K119-I123 PolarHBondContact O-N 2.96Å
120	L	87.4	Confident	86.2	Confident	19 Å²	19	92 Å²	92	10%	0.099	44%	0.44	C	S	.	.	H	α-helix	trans	-57.1	-45.8	169	-67.9	175.4	0	0	0	111.3	Y110 L113 T115 N116 V117 K122 I123 N124 G151	Y110-L120 HydrophobicContact CE1-CD2 4.31Å; L113-L120 HydrophobicContact CD2-CD1 3.79Å; T115-L120 HydrophobicContact CG2-CD2 3.74Å; T115-L120 HydrophobicContact CG2-CG 3.79Å; N116-L120 PolarHBondContact O-N 3.23Å; V117-L120 PolarHBondContact O-N 3.35Å; L120-K122 VanDerWaalsContact C-N 3.26Å; L120-K122 PolarHBondContact O-N 3.32Å; L120-I123 PolarHBondContact O-N 3.02Å; L120-N124 PolarHBondContact O-N 2.92Å; L120-G151 VanDerWaalsContact CD2-O 3.3Å; L120-G151 WeakPolarHBondContact CD2-O 3.4Å
121	R	88.4	Confident	86.6	Confident	173 Å²	173	92.8 Å²	92.8	65%	0.653	45%	0.446	S	S	*	.	H	α-helix	trans	-60.9	-29.8	176.3	-161.7	-173.4	-57.4	-169.9	2.1	113.7	V117 K119 T125	V117-R121 WeakPolarHBondContact O-CB 3.32Å; V117-R121 PolarHBondContact O-N 3.24Å; K119-R121 VanDerWaalsContact C-N 3.34Å; K119-R121 PolarHBondContact O-N 3.46Å; R121-T125 WeakPolarHBondContact O-CG2 3.21Å
122	K	90.2	Very high	87.5	Confident	165 Å²	165	86.1 Å²	86.1	72%	0.717	42%	0.421	S	S	*	.	H	α-helix	trans	-79	-26	173.6	-73.1	178.6	178.9	-172.6	0	113	N118 K119 L120 T125 N128	N118-K122 WeakPolarHBondContact O-CG 3.28Å; N118-K122 PolarHBondContact O-N 3.12Å; K119-K122 PolarHBondContact O-N 3.07Å; K119-K122 VanDerWaalsContact O-N 3.15Å; L120-K122 VanDerWaalsContact C-N 3.26Å; L120-K122 PolarHBondContact O-N 3.32Å; K122-T125 WeakPolarHBondContact O-CG2 3.33Å; K122-N128 PolarHBondContact O-ND2 2.93Å
123	I	90.6	Very high	88.4	Confident	13 Å²	13	80.9 Å²	80.9	7%	0.067	39%	0.389	C	S	.	.	H	α-helix	trans	-79	-47.3	176.2	-67	158.8	0	0	0	110.1	T115 K119 L120 T125 N128 W147 K150 L152	T115-I123 HydrophobicContact CG2-CD1 4.28Å; K119-I123 HydrophobicContact CG-CD1 4.12Å; K119-I123 WeakPolarHBondContact O-CD1 3.26Å; K119-I123 WeakPolarHBondContact O-CG1 3.41Å; K119-I123 PolarHBondContact O-N 2.96Å; L120-I123 PolarHBondContact O-N 3.02Å; I123-T125 VanDerWaalsContact C-N 3.27Å; I123-T125 PolarHBondContact O-N 3.13Å; I123-N128 VanDerWaalsContact O-CB 3.25Å; I123-N128 WeakPolarHBondContact O-CB 3.07Å; I123-N128 PolarHBondContact O-ND2 3.35Å; I123-W147 HydrophobicContact CG2-CE3 4.2Å; I123-W147 HydrophobicContact CG2-CZ3 4.26Å; I123-K150 HydrophobicContact CD1-CB 3.9Å; I123-K150 VanDerWaalsContact CD1-O 3.26Å; I123-K150 WeakPolarHBondContact CD1-O 3.41Å; I123-L152 HydrophobicContact CG2-CB 3.73Å; I123-L152 HydrophobicContact CG2-CD1 4.33Å; I123-L152 HydrophobicContact CG2-CG 4.33Å
124	N	90.4	Very high	89.3	Confident	43 Å²	43	78.8 Å²	78.8	23%	0.23	38%	0.377	C	S	.	.	S	Bend	trans	-82.3	68.9	-178.3	-65.8	-36.9	0	0	0	111.4	L120 F129 G151 L152 D153	L120-N124 PolarHBondContact O-N 2.92Å; N124-F129 HydrophobicContact CB-CE1 4.3Å; N124-F129 HydrophobicContact CB-CZ 3.78Å; N124-G151 PolarHBondContact ND2-O 3.2Å; N124-L152 VanDerWaalsContact OD1-CA 3.31Å; N124-L152 WeakPolarHBondContact OD1-CA 3.48Å; N124-D153 PolarHBondContact OD1-N 2.86Å
125	T	92.6	Very high	90.4	Very high	50 Å²	50	73.4 Å²	73.4	31%	0.307	35%	0.352	S	S	.	.	S	Bend	trans	-124.4	151.8	178.3	66.2	0	0	0	0	111.2	R121 K122 I123 A127 N128 F129	R121-T125 WeakPolarHBondContact O-CG2 3.21Å; K122-T125 WeakPolarHBondContact O-CG2 3.33Å; I123-T125 VanDerWaalsContact C-N 3.27Å; I123-T125 PolarHBondContact O-N 3.13Å; T125-A127 PolarHBondContact O-N 2.79Å; T125-A127 VanDerWaalsContact O-N 3.07Å; T125-N128 PolarHBondContact O-N 2.83Å; T125-N128 PolarHBondContact OG1-ND2 2.87Å; T125-F129 WeakPolarHBondContact O-CD2 3.45Å; T125-F129 WeakPolarHBondContact O-CG 3.27Å; T125-F129 PolarHBondContact O-N 3.4Å
126	K	90.8	Very high	91.3	Very high	146 Å²	146	72.2 Å²	72.2	64%	0.635	35%	0.345	S	S	*	.	H	α-helix	trans	-53.8	-31.9	-178.9	-169.5	-175.2	177.5	-169.5	0	113.6	R130 W158	K126-R130 PolarHBondContact O-N 2.95Å; K126-R130 VanDerWaalsContact O-N 3.12Å; K126-W158 HydrophobicContact CG-CZ3 4.34Å
127	A	91.7	Very high	91.9	Very high	72 Å²	72	71.6 Å²	71.6	60%	0.595	34%	0.337	S	S	*	.	H	α-helix	trans	-69.1	-47.1	177.1	0	0	0	0	0	112.1	T125 R130 Q131	T125-A127 PolarHBondContact O-N 2.79Å; T125-A127 VanDerWaalsContact O-N 3.07Å; A127-R130 WeakPolarHBondContact O-CB 3.24Å; A127-R130 PolarHBondContact O-N 3.33Å; A127-Q131 PolarHBondContact O-N 3.32Å
128	N	94.4	Very high	92.4	Very high	38 Å²	38	72.8 Å²	72.8	20%	0.203	34%	0.344	C	S	.	.	H	α-helix	trans	-68.2	-37.2	177.1	-62.9	-22.2	0	0	0	111.5	K122 I123 T125 R130 Q131 F132 W147	K122-N128 PolarHBondContact O-ND2 2.93Å; I123-N128 VanDerWaalsContact O-CB 3.25Å; I123-N128 WeakPolarHBondContact O-CB 3.07Å; I123-N128 PolarHBondContact O-ND2 3.35Å; T125-N128 PolarHBondContact O-N 2.83Å; T125-N128 PolarHBondContact OG1-ND2 2.87Å; N128-R130 VanDerWaalsContact C-N 3.32Å; N128-R130 PolarHBondContact O-N 3.49Å; N128-Q131 PolarHBondContact O-N 2.83Å; N128-F132 WeakPolarHBondContact O-CB 3.33Å; N128-F132 PolarHBondContact O-N 3.32Å; N128-W147 HydrophobicContact CB-CH2 3.89Å; N128-W147 HydrophobicContact CB-CZ3 3.91Å
129	F	94.5	Very high	92.8	Very high	34 Å²	34	70.8 Å²	70.8	15%	0.149	34%	0.341	C	S	.	.	H	α-helix	trans	-60.5	-38.8	173.6	-66.5	-36.1	0	0	0	112.4	N124 T125 F132 I133 L152 F156 W158	N124-F129 HydrophobicContact CB-CE1 4.3Å; N124-F129 HydrophobicContact CB-CZ 3.78Å; T125-F129 WeakPolarHBondContact O-CD2 3.45Å; T125-F129 WeakPolarHBondContact O-CG 3.27Å; T125-F129 PolarHBondContact O-N 3.4Å; F129-F132 PolarHBondContact O-N 2.94Å; F129-I133 WeakPolarHBondContact O-CB 3.34Å; F129-I133 VanDerWaalsContact O-CG1 3.29Å; F129-I133 WeakPolarHBondContact O-CG1 3.42Å; F129-I133 PolarHBondContact O-N 3.44Å; F129-L152 HydrophobicContact CD1-CD1 4.2Å; F129-L152 HydrophobicContact CD1-CD2 4.5Å; F129-L152 HydrophobicContact CD1-CG 4.4Å; F129-L152 HydrophobicContact CE1-CD1 4.4Å; F129-L152 HydrophobicContact CE1-CD2 4.4Å; F129-L152 HydrophobicContact CE1-CG 4.17Å; F129-F156 HydrophobicContact CB-CD2 4.36Å; F129-F156 HydrophobicContact CB-CE1 4.35Å; F129-F156 HydrophobicContact CB-CE2 3.77Å; F129-F156 HydrophobicContact CB-CZ 3.75Å; F129-F156 AromaticContact CD1-CD1 3.68Å; F129-F156 HydrophobicContact CD1-CD1 3.68Å; F129-F156 AromaticContact CD1-CE1 3.33Å; F129-F156 HydrophobicContact CD1-CE1 3.33Å; F129-F156 HydrophobicContact CD1-CE2 4.25Å; F129-F156 HydrophobicContact CD1-CG 4.27Å; F129-F156 AromaticContact CD1-CZ 3.66Å; F129-F156 HydrophobicContact CD1-CZ 3.66Å; F129-F156 HydrophobicContact CD2-CD2 4.48Å; F129-F156 HydrophobicContact CD2-CG 4.45Å; F129-F156 AromaticContact CE1-CD1 3.65Å; F129-F156 HydrophobicContact CE1-CD1 3.65Å; F129-F156 AromaticContact CE1-CE1 3.71Å; F129-F156 HydrophobicContact CE1-CE1 3.71Å; F129-F156 HydrophobicContact CE1-CG 4.34Å; F129-F156 HydrophobicContact CE1-CZ 4.45Å; F129-F156 HydrophobicContact CG-CD1 4.19Å; F129-F156 HydrophobicContact CG-CD2 4.25Å; F129-F156 AromaticContact CG-CE1 3.96Å; F129-F156 HydrophobicContact CG-CE1 3.96Å; F129-F156 HydrophobicContact CG-CE2 4.03Å; F129-F156 HydrophobicContact CG-CG 4.33Å; F129-F156 AromaticContact CG-CZ 3.87Å; F129-F156 HydrophobicContact CG-CZ 3.87Å; F129-F156 HydrophobicContact CZ-CD1 4.13Å; F129-F156 HydrophobicContact CZ-CG 4.47Å; F129-W158 HydrophobicContact CB-CE3 4.48Å; F129-W158 HydrophobicContact CB-CZ3 4.36Å
130	R	93.8	Very high	93.2	Very high	161 Å²	161	66.2 Å²	66.2	61%	0.608	32%	0.323	S	S	*	.	H	α-helix	trans	-55.7	-54.6	170.9	-171.7	-179.9	178.9	-177.8	-1.2	110.5	K126 A127 N128 F132 I133 E134 W158	K126-R130 PolarHBondContact O-N 2.95Å; K126-R130 VanDerWaalsContact O-N 3.12Å; A127-R130 WeakPolarHBondContact O-CB 3.24Å; A127-R130 PolarHBondContact O-N 3.33Å; N128-R130 VanDerWaalsContact C-N 3.32Å; N128-R130 PolarHBondContact O-N 3.49Å; R130-F132 VanDerWaalsContact C-N 3.29Å; R130-F132 PolarHBondContact O-N 2.85Å; R130-I133 PolarHBondContact O-N 3.4Å; R130-E134 WeakPolarHBondContact O-CG 2.99Å; R130-E134 PolarHBondContact O-N 3Å; R130-W158 HydrophobicContact CB-CH2 3.5Å; R130-W158 VanDerWaalsContact CB-CH2 3.5Å; R130-W158 HydrophobicContact CB-CZ2 4.03Å; R130-W158 HydrophobicContact CB-CZ3 4.14Å; R130-W158 HydrophobicContact CG-CH2 3.81Å; R130-W158 HydrophobicContact CG-CZ2 3.86Å
131	Q	94	Very high	93.7	Very high	84 Å²	84	66.6 Å²	66.6	39%	0.393	33%	0.326	S	S	.	.	H	α-helix	trans	-63.5	-34.9	-176.6	-168.4	61.2	67.1	0	0	112.8	A127 N128 Y135	A127-Q131 PolarHBondContact O-N 3.32Å; N128-Q131 PolarHBondContact O-N 2.83Å; Q131-Y135 HydrophobicContact CG-CD2 4.4Å; Q131-Y135 HydrophobicContact CG-CE2 3.68Å; Q131-Y135 PolarHBondContact NE2-OH 2.94Å; Q131-Y135 WeakPolarHBondContact O-CD2 3.42Å; Q131-Y135 PolarHBondContact O-N 3.29Å
132	F	96.4	Very high	94	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-66.2	-45.7	175.2	-174.4	-106.5	0	0	0	111.9	N128 F129 R130 E134 Y135 V136 V144 W147 L148 L152 P154 F156 P165 L182	N128-F132 WeakPolarHBondContact O-CB 3.33Å; N128-F132 PolarHBondContact O-N 3.32Å; F129-F132 PolarHBondContact O-N 2.94Å; R130-F132 VanDerWaalsContact C-N 3.29Å; R130-F132 PolarHBondContact O-N 2.85Å; F132-E134 VanDerWaalsContact C-N 3.35Å; F132-E134 PolarHBondContact O-N 3.05Å; F132-Y135 PolarHBondContact O-N 2.83Å; F132-Y135 VanDerWaalsContact O-N 3.16Å; F132-V136 HydrophobicContact CD1-CG2 4.43Å; F132-V136 HydrophobicContact CE1-CG2 4.22Å; F132-V136 PolarHBondContact O-N 2.69Å; F132-V144 HydrophobicContact CE2-CB 4.18Å; F132-V144 HydrophobicContact CE2-CG1 3.83Å; F132-V144 HydrophobicContact CE2-CG2 4.14Å; F132-V144 HydrophobicContact CZ-CG1 3.95Å; F132-W147 HydrophobicContact CD2-CB 3.62Å; F132-W147 HydrophobicContact CD2-CG 4.01Å; F132-W147 HydrophobicContact CE2-CB 3.84Å; F132-L148 HydrophobicContact CE2-CD2 4.25Å; F132-L148 HydrophobicContact CE2-CG 4.08Å; F132-L148 HydrophobicContact CZ-CD2 3.86Å; F132-L148 HydrophobicContact CZ-CG 4.07Å; F132-L152 HydrophobicContact CB-CD1 4.12Å; F132-L152 HydrophobicContact CD1-CD2 3.74Å; F132-L152 HydrophobicContact CD2-CD1 4.15Å; F132-L152 HydrophobicContact CD2-CD2 3.87Å; F132-L152 HydrophobicContact CE1-CD2 3.71Å; F132-L152 HydrophobicContact CE2-CD2 3.85Å; F132-L152 HydrophobicContact CG-CD1 4.1Å; F132-L152 HydrophobicContact CG-CD2 3.81Å; F132-L152 HydrophobicContact CZ-CD2 3.76Å; F132-P154 HydrophobicContact CE1-CB 4.34Å; F132-F156 HydrophobicContact CD1-CE1 4.12Å; F132-F156 HydrophobicContact CD1-CZ 4.08Å; F132-F156 HydrophobicContact CE1-CE1 4.49Å; F132-P165 HydrophobicContact CD1-CG 4.22Å; F132-P165 HydrophobicContact CE1-CB 3.92Å; F132-P165 HydrophobicContact CE1-CG 3.9Å; F132-L182 HydrophobicContact CE1-CD2 3.98Å; F132-L182 HydrophobicContact CZ-CD2 3.69Å
133	I	95.4	Very high	94.3	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-61.7	-40.1	176.3	-71	-70.4	0	0	0	111.6	F129 R130 Y135 V136 K137 F156 W158 P165 M168	F129-I133 WeakPolarHBondContact O-CB 3.34Å; F129-I133 VanDerWaalsContact O-CG1 3.29Å; F129-I133 WeakPolarHBondContact O-CG1 3.42Å; F129-I133 PolarHBondContact O-N 3.44Å; R130-I133 PolarHBondContact O-N 3.4Å; I133-Y135 VanDerWaalsContact C-N 3.31Å; I133-Y135 PolarHBondContact O-N 3.05Å; I133-V136 PolarHBondContact O-N 2.74Å; I133-K137 WeakPolarHBondContact O-CG 3.36Å; I133-K137 PolarHBondContact O-N 2.77Å; I133-F156 HydrophobicContact CD1-CE2 3.91Å; I133-F156 HydrophobicContact CD1-CZ 3.92Å; I133-F156 HydrophobicContact CG1-CE2 3.79Å; I133-F156 HydrophobicContact CG1-CZ 3.84Å; I133-W158 HydrophobicContact CD1-CB 4.13Å; I133-W158 HydrophobicContact CD1-CG 4.38Å; I133-W158 HydrophobicContact CG1-CB 4.15Å; I133-W158 HydrophobicContact CG1-CD2 4.11Å; I133-W158 HydrophobicContact CG1-CE3 4.46Å; I133-W158 HydrophobicContact CG1-CG 3.93Å; I133-W158 HydrophobicContact CG2-CG 4.22Å; I133-P165 HydrophobicContact CD1-CB 4.41Å; I133-P165 HydrophobicContact CD1-CG 3.83Å; I133-M168 HydrophobicContact CD1-SD 3.94Å; I133-M168 HydrophobicContact CG2-CE 4Å; I133-M168 HydrophobicContact CG2-SD 3.8Å
134	E	94.5	Very high	94.7	Very high	60 Å²	60	58.7 Å²	58.7	28%	0.28	30%	0.301	S	S	.	.	H	α-helix	trans	-62.9	-36.4	175.1	-58.5	-48.7	144.7	0	0	112.2	R130 F132 K137 V138	R130-E134 WeakPolarHBondContact O-CG 2.99Å; R130-E134 PolarHBondContact O-N 3Å; F132-E134 VanDerWaalsContact C-N 3.35Å; F132-E134 PolarHBondContact O-N 3.05Å; E134-K137 PolarHBondContact O-N 3.36Å; E134-K137 IonicContact OE1-NZ 2.67Å; E134-K137 PolarHBondContact OE1-NZ 2.76Å; E134-K137 WeakPolarHBondContact OE2-CD 3.32Å; E134-K137 WeakPolarHBondContact OE2-CE 3.38Å; E134-K137 IonicContact OE2-NZ 2.64Å; E134-K137 PolarHBondContact OE2-NZ 3.26Å; E134-V138 VanDerWaalsContact O-CG2 3.29Å; E134-V138 WeakPolarHBondContact O-CG2 3.31Å; E134-V138 PolarHBondContact O-N 3.26Å; E134-V138 VanDerWaalsContact O-N 3.14Å
135	Y	96.4	Very high	94.9	Very high	57 Å²	57	59.1 Å²	59.1	22%	0.224	30%	0.303	C	S	.	.	H	α-helix	trans	-69.2	-34.5	173.4	-63	-39.3	0	0	0	113.1	Q131 F132 I133 V138 G139 D140 K143 W147	Q131-Y135 HydrophobicContact CG-CD2 4.4Å; Q131-Y135 HydrophobicContact CG-CE2 3.68Å; Q131-Y135 PolarHBondContact NE2-OH 2.94Å; Q131-Y135 WeakPolarHBondContact O-CD2 3.42Å; Q131-Y135 PolarHBondContact O-N 3.29Å; F132-Y135 PolarHBondContact O-N 2.83Å; F132-Y135 VanDerWaalsContact O-N 3.16Å; I133-Y135 VanDerWaalsContact C-N 3.31Å; I133-Y135 PolarHBondContact O-N 3.05Å; Y135-V138 PolarHBondContact O-N 2.72Å; Y135-G139 PolarHBondContact O-N 3.38Å; Y135-D140 HydrophobicContact CD1-CB 4.42Å; Y135-D140 PolarHBondContact O-N 3.14Å; Y135-K143 HydrophobicContact CD1-CB 4.11Å; Y135-K143 HydrophobicContact CD1-CD 3.73Å; Y135-K143 HydrophobicContact CD2-CB 3.69Å; Y135-K143 HydrophobicContact CD2-CD 4.48Å; Y135-K143 HydrophobicContact CE1-CB 4.35Å; Y135-K143 HydrophobicContact CE1-CD 3.36Å; Y135-K143 HydrophobicContact CE1-CG 4.45Å; Y135-K143 HydrophobicContact CE2-CB 3.92Å; Y135-K143 HydrophobicContact CE2-CD 4.15Å; Y135-K143 HydrophobicContact CG-CB 3.8Å; Y135-K143 HydrophobicContact CG-CD 4.3Å; Y135-W147 AromaticContact CD2-NE1 3.97Å; Y135-W147 AromaticContact CE2-NE1 3.64Å
136	V	96.5	Very high	95.1	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-64.1	-46.3	172.1	174.2	0	0	0	0	110.9	F132 I133 V138 G139 V144 P165 M168 A169 M178 L182	F132-V136 HydrophobicContact CD1-CG2 4.43Å; F132-V136 HydrophobicContact CE1-CG2 4.22Å; F132-V136 PolarHBondContact O-N 2.69Å; I133-V136 PolarHBondContact O-N 2.74Å; V136-V138 VanDerWaalsContact C-N 3.28Å; V136-V138 PolarHBondContact O-N 2.76Å; V136-G139 PolarHBondContact O-N 2.79Å; V136-G139 VanDerWaalsContact O-N 3.15Å; V136-V144 HydrophobicContact CG2-CG2 3.77Å; V136-P165 WeakPolarHBondContact CG1-O 3.41Å; V136-P165 HydrophobicContact CG2-CB 4.42Å; V136-M168 HydrophobicContact CG1-CB 4.06Å; V136-A169 HydrophobicContact CG1-CB 4.27Å; V136-M178 HydrophobicContact CG1-CG 4.44Å; V136-M178 HydrophobicContact CG2-SD 4.24Å; V136-L182 HydrophobicContact CG2-CD2 4.46Å
137	K	94.4	Very high	95.3	Very high	95 Å²	95	56.6 Å²	56.6	41%	0.413	29%	0.287	S	S	.	.	H	α-helix	trans	-57.7	-38.5	176.3	-70.9	-176.6	-154.4	161.5	0	113.4	I133 E134 G139 M168 L172	I133-K137 WeakPolarHBondContact O-CG 3.36Å; I133-K137 PolarHBondContact O-N 2.77Å; E134-K137 PolarHBondContact O-N 3.36Å; E134-K137 IonicContact OE1-NZ 2.67Å; E134-K137 PolarHBondContact OE1-NZ 2.76Å; E134-K137 WeakPolarHBondContact OE2-CD 3.32Å; E134-K137 WeakPolarHBondContact OE2-CE 3.38Å; E134-K137 IonicContact OE2-NZ 2.64Å; E134-K137 PolarHBondContact OE2-NZ 3.26Å; K137-G139 VanDerWaalsContact C-N 3.29Å; K137-M168 HydrophobicContact CD-CE 4.13Å; K137-M168 HydrophobicContact CG-CE 3.46Å; K137-M168 VanDerWaalsContact CG-CE 3.46Å; K137-L172 WeakPolarHBondContact O-CD2 3.38Å
138	V	94.5	Very high	95.4	Very high	113 Å²	113	53.3 Å²	53.3	69%	0.685	26%	0.259	S	S	*	.	H	α-helix	trans	-79.9	-11.8	-177.4	171.3	0	0	0	0	112.1	E134 Y135 V136 D140	E134-V138 VanDerWaalsContact O-CG2 3.29Å; E134-V138 WeakPolarHBondContact O-CG2 3.31Å; E134-V138 PolarHBondContact O-N 3.26Å; E134-V138 VanDerWaalsContact O-N 3.14Å; Y135-V138 PolarHBondContact O-N 2.72Å; V136-V138 VanDerWaalsContact C-N 3.28Å; V136-V138 PolarHBondContact O-N 2.76Å; V138-D140 VanDerWaalsContact C-N 3.35Å; V138-D140 HydrophobicContact CG1-CB 4.46Å
139	G	94.6	Very high	95.2	Very high	34 Å²	34	56.6 Å²	56.6	35%	0.351	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.3	18.8	-173.7	0	0	0	0	0	113.7	Y135 V136 K137 V141	Y135-G139 PolarHBondContact O-N 3.38Å; V136-G139 PolarHBondContact O-N 2.79Å; V136-G139 VanDerWaalsContact O-N 3.15Å; K137-G139 VanDerWaalsContact C-N 3.29Å; G139-V141 VanDerWaalsContact C-N 3.28Å; G139-V141 PolarHBondContact O-N 3.28Å
140	D	96.1	Very high	95.1	Very high	33 Å²	33	59.5 Å²	59.5	18%	0.176	29%	0.289	C	S	.	.			trans	-81	74.6	-177	-163	-44.1	0	0	0	111.5	Y135 V138 D142 K143 V144	Y135-D140 HydrophobicContact CD1-CB 4.42Å; Y135-D140 PolarHBondContact O-N 3.14Å; V138-D140 VanDerWaalsContact C-N 3.35Å; V138-D140 HydrophobicContact CG1-CB 4.46Å; D140-D142 PolarHBondContact O-N 3.28Å; D140-D142 VanDerWaalsContact O-N 3.16Å; D140-K143 HydrophobicContact CB-CB 4.41Å; D140-K143 PolarHBondContact O-N 3.41Å; D140-K143 VanDerWaalsContact OD1-CB 3.27Å; D140-K143 WeakPolarHBondContact OD1-CB 3.37Å; D140-K143 VanDerWaalsContact OD1-CG 3.24Å; D140-K143 WeakPolarHBondContact OD1-CG 3.43Å; D140-K143 PolarHBondContact OD1-N 2.85Å; D140-K143 WeakPolarHBondContact OD2-CD 3.35Å; D140-K143 WeakPolarHBondContact OD2-CE 3.44Å; D140-K143 IonicContact OD2-NZ 2.79Å; D140-K143 PolarHBondContact OD2-NZ 2.95Å; D140-V144 WeakPolarHBondContact O-CB 3.37Å; D140-V144 WeakPolarHBondContact O-CG2 3.22Å; D140-V144 PolarHBondContact O-N 2.84Å
141	V	96.4	Very high	94.9	Very high	28 Å²	28	52.2 Å²	52.2	17%	0.17	26%	0.264	C	S	.	.	H	α-helix	trans	-52	-35.4	179	176.7	0	0	0	0	111.3	G139 V144 N145 E177 M178 A181	G139-V141 VanDerWaalsContact C-N 3.28Å; G139-V141 PolarHBondContact O-N 3.28Å; V141-V144 PolarHBondContact O-N 3.07Å; V141-N145 VanDerWaalsContact O-CB 3.3Å; V141-N145 WeakPolarHBondContact O-CB 3.5Å; V141-N145 PolarHBondContact O-N 3.11Å; V141-N145 PolarHBondContact O-ND2 3.07Å; V141-E177 HydrophobicContact CG2-CB 3.87Å; V141-M178 HydrophobicContact CG2-CB 4.28Å; V141-M178 HydrophobicContact CG2-CE 3.89Å; V141-M178 HydrophobicContact CG2-SD 4.5Å; V141-A181 HydrophobicContact CG1-CB 3.92Å
142	D	96.6	Very high	94.9	Very high	95 Å²	95	48.2 Å²	48.2	51%	0.508	25%	0.245	S	C	.	.	H	α-helix	trans	-73.2	-44.1	-173.9	-151.8	16.7	0	0	0	111.7	D140 K146	D140-D142 PolarHBondContact O-N 3.28Å; D140-D142 VanDerWaalsContact O-N 3.16Å; D142-K146 WeakPolarHBondContact O-CB 3.39Å; D142-K146 VanDerWaalsContact O-CD 3.23Å; D142-K146 WeakPolarHBondContact O-CD 3.24Å; D142-K146 WeakPolarHBondContact O-CE 3.4Å; D142-K146 WeakPolarHBondContact O-CG 3.31Å; D142-K146 PolarHBondContact O-N 3.31Å; D142-K146 WeakPolarHBondContact OD1-CE 3.14Å; D142-K146 IonicContact OD1-NZ 2.68Å; D142-K146 PolarHBondContact OD1-NZ 2.84Å; D142-K146 IonicContact OD2-NZ 2.77Å; D142-K146 PolarHBondContact OD2-NZ 3.41Å
143	K	96.5	Very high	94.8	Very high	90 Å²	90	48.8 Å²	48.8	39%	0.391	25%	0.249	S	C	.	.	H	α-helix	trans	-71.7	-33.9	172.4	-67.5	175	-160	138.7	0	111.9	Y135 D140 K146 W147	Y135-K143 HydrophobicContact CD1-CB 4.11Å; Y135-K143 HydrophobicContact CD1-CD 3.73Å; Y135-K143 HydrophobicContact CD2-CB 3.69Å; Y135-K143 HydrophobicContact CD2-CD 4.48Å; Y135-K143 HydrophobicContact CE1-CB 4.35Å; Y135-K143 HydrophobicContact CE1-CD 3.36Å; Y135-K143 HydrophobicContact CE1-CG 4.45Å; Y135-K143 HydrophobicContact CE2-CB 3.92Å; Y135-K143 HydrophobicContact CE2-CD 4.15Å; Y135-K143 HydrophobicContact CG-CB 3.8Å; Y135-K143 HydrophobicContact CG-CD 4.3Å; D140-K143 HydrophobicContact CB-CB 4.41Å; D140-K143 PolarHBondContact O-N 3.41Å; D140-K143 VanDerWaalsContact OD1-CB 3.27Å; D140-K143 WeakPolarHBondContact OD1-CB 3.37Å; D140-K143 VanDerWaalsContact OD1-CG 3.24Å; D140-K143 WeakPolarHBondContact OD1-CG 3.43Å; D140-K143 PolarHBondContact OD1-N 2.85Å; D140-K143 WeakPolarHBondContact OD2-CD 3.35Å; D140-K143 WeakPolarHBondContact OD2-CE 3.44Å; D140-K143 IonicContact OD2-NZ 2.79Å; D140-K143 PolarHBondContact OD2-NZ 2.95Å; K143-K146 PolarHBondContact O-N 3.47Å; K143-W147 VanDerWaalsContact O-CD1 3.26Å; K143-W147 PolarHBondContact O-N 2.77Å; K143-W147 VanDerWaalsContact O-N 3.16Å
144	V	97	Very high	94.8	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-59.8	-51.4	170.9	163.4	0	0	0	0	110.6	F132 V136 D140 V141 K146 W147 L148 M178 L182	F132-V144 HydrophobicContact CE2-CB 4.18Å; F132-V144 HydrophobicContact CE2-CG1 3.83Å; F132-V144 HydrophobicContact CE2-CG2 4.14Å; F132-V144 HydrophobicContact CZ-CG1 3.95Å; V136-V144 HydrophobicContact CG2-CG2 3.77Å; D140-V144 WeakPolarHBondContact O-CB 3.37Å; D140-V144 WeakPolarHBondContact O-CG2 3.22Å; D140-V144 PolarHBondContact O-N 2.84Å; V141-V144 PolarHBondContact O-N 3.07Å; V144-K146 VanDerWaalsContact C-N 3.3Å; V144-K146 PolarHBondContact O-N 3.18Å; V144-W147 PolarHBondContact O-N 3.09Å; V144-L148 HydrophobicContact CG1-CD1 3.59Å; V144-L148 HydrophobicContact CG1-CG 4.27Å; V144-L148 WeakPolarHBondContact O-CG 3.33Å; V144-L148 PolarHBondContact O-N 3.41Å; V144-M178 HydrophobicContact CB-SD 4.14Å; V144-M178 HydrophobicContact CG1-SD 3.95Å; V144-M178 HydrophobicContact CG2-CE 4.01Å; V144-M178 HydrophobicContact CG2-SD 3.85Å; V144-L182 HydrophobicContact CG1-CD2 4.09Å
145	N	96.6	Very high	94.9	Very high	52 Å²	52	46.5 Å²	46.5	28%	0.278	24%	0.238	S	C	.	.	H	α-helix	trans	-57.9	-39.1	174.4	-83.9	-40.5	0	0	0	112.7	V141 W147 L148 N149	V141-N145 VanDerWaalsContact O-CB 3.3Å; V141-N145 WeakPolarHBondContact O-CB 3.5Å; V141-N145 PolarHBondContact O-N 3.11Å; V141-N145 PolarHBondContact O-ND2 3.07Å; N145-W147 PolarHBondContact O-N 3.25Å; N145-L148 PolarHBondContact O-N 3.21Å; N145-N149 VanDerWaalsContact O-CB 3.31Å; N145-N149 WeakPolarHBondContact O-CB 3.11Å; N145-N149 PolarHBondContact O-N 3.42Å; N145-N149 PolarHBondContact O-ND2 3.09Å
146	K	95.2	Very high	94.8	Very high	103 Å²	103	44.8 Å²	44.8	45%	0.448	23%	0.232	S	C	.	.	H	α-helix	trans	-66.4	-19	175.4	-70.7	157.7	-161	165.3	0	113.5	D142 K143 V144 K150	D142-K146 WeakPolarHBondContact O-CB 3.39Å; D142-K146 VanDerWaalsContact O-CD 3.23Å; D142-K146 WeakPolarHBondContact O-CD 3.24Å; D142-K146 WeakPolarHBondContact O-CE 3.4Å; D142-K146 WeakPolarHBondContact O-CG 3.31Å; D142-K146 PolarHBondContact O-N 3.31Å; D142-K146 WeakPolarHBondContact OD1-CE 3.14Å; D142-K146 IonicContact OD1-NZ 2.68Å; D142-K146 PolarHBondContact OD1-NZ 2.84Å; D142-K146 IonicContact OD2-NZ 2.77Å; D142-K146 PolarHBondContact OD2-NZ 3.41Å; K143-K146 PolarHBondContact O-N 3.47Å; V144-K146 VanDerWaalsContact C-N 3.3Å; V144-K146 PolarHBondContact O-N 3.18Å; K146-K150 VanDerWaalsContact O-CD 3.24Å; K146-K150 WeakPolarHBondContact O-CD 3.17Å; K146-K150 WeakPolarHBondContact O-CE 3.33Å; K146-K150 WeakPolarHBondContact O-CG 3.16Å
147	W	94.7	Very high	94.7	Very high	39 Å²	39	47.2 Å²	47.2	15%	0.148	24%	0.243	C	C	.	.	H	α-helix	trans	-90.2	-44.7	169.8	-81.5	106.8	0	0	0	112.7	I123 N128 F132 Y135 K143 V144 N145 N149 K150 L152	I123-W147 HydrophobicContact CG2-CE3 4.2Å; I123-W147 HydrophobicContact CG2-CZ3 4.26Å; N128-W147 HydrophobicContact CB-CH2 3.89Å; N128-W147 HydrophobicContact CB-CZ3 3.91Å; F132-W147 HydrophobicContact CD2-CB 3.62Å; F132-W147 HydrophobicContact CD2-CG 4.01Å; F132-W147 HydrophobicContact CE2-CB 3.84Å; Y135-W147 AromaticContact CD2-NE1 3.97Å; Y135-W147 AromaticContact CE2-NE1 3.64Å; K143-W147 VanDerWaalsContact O-CD1 3.26Å; K143-W147 PolarHBondContact O-N 2.77Å; K143-W147 VanDerWaalsContact O-N 3.16Å; V144-W147 PolarHBondContact O-N 3.09Å; N145-W147 PolarHBondContact O-N 3.25Å; W147-N149 VanDerWaalsContact C-N 3.29Å; W147-N149 PolarHBondContact O-N 2.99Å; W147-K150 HydrophobicContact CE3-CD 4.11Å; W147-K150 HydrophobicContact CZ3-CD 4.48Å; W147-K150 WeakPolarHBondContact O-CB 3.35Å; W147-K150 PolarHBondContact O-N 3.31Å; W147-L152 HydrophobicContact CB-CB 4.23Å; W147-L152 HydrophobicContact CB-CD1 4.2Å; W147-L152 HydrophobicContact CD2-CD1 4.2Å; W147-L152 HydrophobicContact CE3-CD1 3.83Å; W147-L152 HydrophobicContact CG-CD1 4.39Å; W147-L152 WeakPolarHBondContact O-CB 3.45Å; W147-L152 PolarHBondContact O-N 2.9Å
148	L	94.1	Very high	94.7	Very high	4 Å²	4	44 Å²	44	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-59.2	-39.7	178.1	-67.3	168.6	0	0	0	111.8	R108 F132 V144 N145 K150 G151 P154 A181 L182	R108-L148 PolarHBondContact NH1-O 3.24Å; R108-L148 PolarHBondContact NH2-O 3.27Å; F132-L148 HydrophobicContact CE2-CD2 4.25Å; F132-L148 HydrophobicContact CE2-CG 4.08Å; F132-L148 HydrophobicContact CZ-CD2 3.86Å; F132-L148 HydrophobicContact CZ-CG 4.07Å; V144-L148 HydrophobicContact CG1-CD1 3.59Å; V144-L148 HydrophobicContact CG1-CG 4.27Å; V144-L148 WeakPolarHBondContact O-CG 3.33Å; V144-L148 PolarHBondContact O-N 3.41Å; N145-L148 PolarHBondContact O-N 3.21Å; L148-K150 VanDerWaalsContact C-N 3.29Å; L148-K150 PolarHBondContact O-N 2.89Å; L148-G151 PolarHBondContact O-N 2.76Å; L148-G151 VanDerWaalsContact O-N 3.13Å; L148-P154 HydrophobicContact CD2-CB 4.16Å; L148-P154 HydrophobicContact CD2-CG 4.06Å; L148-A181 VanDerWaalsContact CD1-O 3.23Å; L148-A181 WeakPolarHBondContact CD1-O 3.29Å; L148-L182 HydrophobicContact CD1-CD2 4.49Å
149	N	92	Very high	94.4	Very high	107 Å²	107	47.1 Å²	47.1	57%	0.572	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-20.3	175.6	-79.5	-59.5	0	0	0	114.4	N145 W147 G151	N145-N149 VanDerWaalsContact O-CB 3.31Å; N145-N149 WeakPolarHBondContact O-CB 3.11Å; N145-N149 PolarHBondContact O-N 3.42Å; N145-N149 PolarHBondContact O-ND2 3.09Å; W147-N149 VanDerWaalsContact C-N 3.29Å; W147-N149 PolarHBondContact O-N 2.99Å; N149-G151 VanDerWaalsContact C-N 3.28Å
150	K	91	Very high	94	Very high	95 Å²	95	50.2 Å²	50.2	41%	0.413	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-21.1	172.1	-67.2	166	-174.3	163.5	0	112.1	T115 I123 K146 W147 L148	T115-K150 PolarHBondContact OG1-O 2.66Å; T115-K150 VanDerWaalsContact OG1-O 3.11Å; I123-K150 HydrophobicContact CD1-CB 3.9Å; I123-K150 VanDerWaalsContact CD1-O 3.26Å; I123-K150 WeakPolarHBondContact CD1-O 3.41Å; K146-K150 VanDerWaalsContact O-CD 3.24Å; K146-K150 WeakPolarHBondContact O-CD 3.17Å; K146-K150 WeakPolarHBondContact O-CE 3.33Å; K146-K150 WeakPolarHBondContact O-CG 3.16Å; W147-K150 HydrophobicContact CE3-CD 4.11Å; W147-K150 HydrophobicContact CZ3-CD 4.48Å; W147-K150 WeakPolarHBondContact O-CB 3.35Å; W147-K150 PolarHBondContact O-N 3.31Å; L148-K150 VanDerWaalsContact C-N 3.29Å; L148-K150 PolarHBondContact O-N 2.89Å
151	G	90.5	Very high	93.6	Very high	7 Å²	7	52.2 Å²	52.2	7%	0.072	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	99.7	34.4	-169.9	0	0	0	0	0	113.4	Y110 L120 N124 L148 N149	Y110-G151 PolarHBondContact OH-O 2.92Å; L120-G151 VanDerWaalsContact CD2-O 3.3Å; L120-G151 WeakPolarHBondContact CD2-O 3.4Å; N124-G151 PolarHBondContact ND2-O 3.2Å; L148-G151 PolarHBondContact O-N 2.76Å; L148-G151 VanDerWaalsContact O-N 3.13Å; N149-G151 VanDerWaalsContact C-N 3.28Å
152	L	94.2	Very high	93.4	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.252	C	S	.	.			trans	-71	138.4	163.6	-171.9	140.6	0	0	0	109.3	R108 I123 N124 F129 F132 W147	R108-L152 PolarHBondContact NH1-O 3.33Å; I123-L152 HydrophobicContact CG2-CB 3.73Å; I123-L152 HydrophobicContact CG2-CD1 4.33Å; I123-L152 HydrophobicContact CG2-CG 4.33Å; N124-L152 VanDerWaalsContact OD1-CA 3.31Å; N124-L152 WeakPolarHBondContact OD1-CA 3.48Å; F129-L152 HydrophobicContact CD1-CD1 4.2Å; F129-L152 HydrophobicContact CD1-CD2 4.5Å; F129-L152 HydrophobicContact CD1-CG 4.4Å; F129-L152 HydrophobicContact CE1-CD1 4.4Å; F129-L152 HydrophobicContact CE1-CD2 4.4Å; F129-L152 HydrophobicContact CE1-CG 4.17Å; F132-L152 HydrophobicContact CB-CD1 4.12Å; F132-L152 HydrophobicContact CD1-CD2 3.74Å; F132-L152 HydrophobicContact CD2-CD1 4.15Å; F132-L152 HydrophobicContact CD2-CD2 3.87Å; F132-L152 HydrophobicContact CE1-CD2 3.71Å; F132-L152 HydrophobicContact CE2-CD2 3.85Å; F132-L152 HydrophobicContact CG-CD1 4.1Å; F132-L152 HydrophobicContact CG-CD2 3.81Å; F132-L152 HydrophobicContact CZ-CD2 3.76Å; W147-L152 HydrophobicContact CB-CB 4.23Å; W147-L152 HydrophobicContact CB-CD1 4.2Å; W147-L152 HydrophobicContact CD2-CD1 4.2Å; W147-L152 HydrophobicContact CE3-CD1 3.83Å; W147-L152 HydrophobicContact CG-CD1 4.39Å; W147-L152 WeakPolarHBondContact O-CB 3.45Å; W147-L152 PolarHBondContact O-N 2.9Å
153	D	94.1	Very high	93.3	Very high	13 Å²	13	47.2 Å²	47.2	7%	0.07	23%	0.231	C	C	.	.			trans	-91.8	118.6	173.1	-165.7	-24.2	0	0	0	109.4	Q107 R108 N124 N155 F156	Q107-D153 WeakPolarHBondContact CB-OD2 3.42Å; R108-D153 HydrophobicContact CB-CB 4.22Å; R108-D153 VanDerWaalsContact CB-CG 3.42Å; R108-D153 WeakPolarHBondContact CB-OD1 3.24Å; R108-D153 WeakPolarHBondContact CB-OD2 3.1Å; R108-D153 PolarHBondContact N-OD1 3.38Å; R108-D153 PolarHBondContact N-OD2 3.42Å; N124-D153 PolarHBondContact OD1-N 2.86Å; D153-N155 VanDerWaalsContact C-N 3.29Å; D153-N155 WeakPolarHBondContact OD1-CB 3.42Å; D153-N155 PolarHBondContact OD1-N 3.48Å; D153-N155 PolarHBondContact OD1-ND2 2.99Å; D153-F156 WeakPolarHBondContact O-CD1 3.46Å
154	P	95.6	Very high	93.2	Very high	2 Å²	2	43 Å²	43	1%	0.013	21%	0.213	C	C	.	.			trans	-80.2	-4.8	177.2	33.4	-35.9	0	0	0	113.7	F132 L148 F156 P165 L182 A187	F132-P154 HydrophobicContact CE1-CB 4.34Å; L148-P154 HydrophobicContact CD2-CB 4.16Å; L148-P154 HydrophobicContact CD2-CG 4.06Å; P154-F156 PolarHBondContact O-N 3.43Å; P154-F156 VanDerWaalsContact O-N 3.13Å; P154-P165 HydrophobicContact CB-CG 4.49Å; P154-P165 VanDerWaalsContact O-CD 3.23Å; P154-P165 WeakPolarHBondContact O-CD 3.31Å; P154-P165 VanDerWaalsContact O-CG 3.26Å; P154-P165 WeakPolarHBondContact O-CG 3.3Å; P154-L182 HydrophobicContact CB-CD2 4.14Å; P154-A187 HydrophobicContact CB-CB 4.11Å; P154-A187 HydrophobicContact CG-CB 3.73Å
155	N	96	Very high	93.2	Very high	10 Å²	10	43 Å²	43	5%	0.053	21%	0.213	C	C	.	.			trans	-88.3	77.1	-178.1	-52.7	-79.2	0	0	0	110.8	K106 R108 D153 G186 A187 H188 Y191	K106-N155 WeakPolarHBondContact O-CB 3.07Å; R108-N155 PolarHBondContact N-ND2 3Å; D153-N155 VanDerWaalsContact C-N 3.29Å; D153-N155 WeakPolarHBondContact OD1-CB 3.42Å; D153-N155 PolarHBondContact OD1-N 3.48Å; D153-N155 PolarHBondContact OD1-ND2 2.99Å; N155-G186 PolarHBondContact ND2-O 2.91Å; N155-A187 WeakPolarHBondContact OD1-CA 3.46Å; N155-H188 PolarHBondContact OD1-CD2 2.94Å; N155-H188 VanDerWaalsContact OD1-CD2 3.27Å; N155-H188 PolarHBondContact OD1-N 3.27Å; N155-Y191 VanDerWaalsContact C-CE1 3.48Å; N155-Y191 HydrophobicContact CB-CD1 4.25Å; N155-Y191 HydrophobicContact CB-CD2 4.23Å; N155-Y191 HydrophobicContact CB-CE1 4.29Å; N155-Y191 HydrophobicContact CB-CE2 4.25Å; N155-Y191 HydrophobicContact CB-CG 4.25Å
156	F	94.5	Very high	93.2	Very high	21 Å²	21	40.8 Å²	40.8	9%	0.092	20%	0.201	C	C	.	.			trans	-145.8	150	173.2	65.4	-89.3	0	0	0	112.1	F129 F132 I133 D153 P154 W158 T164 P165 Y191	F129-F156 HydrophobicContact CB-CD2 4.36Å; F129-F156 HydrophobicContact CB-CE1 4.35Å; F129-F156 HydrophobicContact CB-CE2 3.77Å; F129-F156 HydrophobicContact CB-CZ 3.75Å; F129-F156 AromaticContact CD1-CD1 3.68Å; F129-F156 HydrophobicContact CD1-CD1 3.68Å; F129-F156 AromaticContact CD1-CE1 3.33Å; F129-F156 HydrophobicContact CD1-CE1 3.33Å; F129-F156 HydrophobicContact CD1-CE2 4.25Å; F129-F156 HydrophobicContact CD1-CG 4.27Å; F129-F156 AromaticContact CD1-CZ 3.66Å; F129-F156 HydrophobicContact CD1-CZ 3.66Å; F129-F156 HydrophobicContact CD2-CD2 4.48Å; F129-F156 HydrophobicContact CD2-CG 4.45Å; F129-F156 AromaticContact CE1-CD1 3.65Å; F129-F156 HydrophobicContact CE1-CD1 3.65Å; F129-F156 AromaticContact CE1-CE1 3.71Å; F129-F156 HydrophobicContact CE1-CE1 3.71Å; F129-F156 HydrophobicContact CE1-CG 4.34Å; F129-F156 HydrophobicContact CE1-CZ 4.45Å; F129-F156 HydrophobicContact CG-CD1 4.19Å; F129-F156 HydrophobicContact CG-CD2 4.25Å; F129-F156 AromaticContact CG-CE1 3.96Å; F129-F156 HydrophobicContact CG-CE1 3.96Å; F129-F156 HydrophobicContact CG-CE2 4.03Å; F129-F156 HydrophobicContact CG-CG 4.33Å; F129-F156 AromaticContact CG-CZ 3.87Å; F129-F156 HydrophobicContact CG-CZ 3.87Å; F129-F156 HydrophobicContact CZ-CD1 4.13Å; F129-F156 HydrophobicContact CZ-CG 4.47Å; F132-F156 HydrophobicContact CD1-CE1 4.12Å; F132-F156 HydrophobicContact CD1-CZ 4.08Å; F132-F156 HydrophobicContact CE1-CE1 4.49Å; I133-F156 HydrophobicContact CD1-CE2 3.91Å; I133-F156 HydrophobicContact CD1-CZ 3.92Å; I133-F156 HydrophobicContact CG1-CE2 3.79Å; I133-F156 HydrophobicContact CG1-CZ 3.84Å; D153-F156 WeakPolarHBondContact O-CD1 3.46Å; P154-F156 PolarHBondContact O-N 3.43Å; P154-F156 VanDerWaalsContact O-N 3.13Å; F156-W158 HydrophobicContact CE2-CB 4.32Å; F156-W158 HydrophobicContact CE2-CE3 4.36Å; F156-T164 WeakPolarHBondContact O-CA 3.39Å; F156-P165 HydrophobicContact CD1-CG 4.22Å; F156-P165 HydrophobicContact CE1-CG 3.58Å; F156-P165 HydrophobicContact CE2-CG 4.25Å; F156-P165 HydrophobicContact CZ-CG 3.6Å; F156-P165 WeakPolarHBondContact O-CD 3.16Å; F156-Y191 WeakPolarHBondContact CA-OH 3.38Å; F156-Y191 VanDerWaalsContact N-CE1 3.34Å
157	Q	94.7	Very high	93.3	Very high	50 Å²	50	35.9 Å²	35.9	23%	0.234	18%	0.179	C	C	.	.			trans	-85.5	124.2	168.1	-67.5	169.5	-2.5	0	0	110.4	D64 N67 K159 T164 R192	D64-Q157 PolarHBondContact OD1-NE2 2.85Å; D64-Q157 VanDerWaalsContact OD1-NE2 3.13Å; D64-Q157 PolarHBondContact OD2-NE2 3.37Å; N67-Q157 PolarHBondContact ND2-NE2 2.66Å; Q157-K159 PolarHBondContact O-N 3.21Å; Q157-T164 HydrophobicContact CG-CG2 4.4Å; Q157-R192 PolarHBondContact NE2-O 3.1Å
158	W	93.2	Very high	93.3	Very high	27 Å²	27	35 Å²	35	10%	0.102	18%	0.177	C	C	.	.			trans	-80.3	102.3	177.7	-177.3	-124.2	0	0	0	110.4	K126 F129 R130 I133 F156 P160 N161 G162 E163	K126-W158 HydrophobicContact CG-CZ3 4.34Å; F129-W158 HydrophobicContact CB-CE3 4.48Å; F129-W158 HydrophobicContact CB-CZ3 4.36Å; R130-W158 HydrophobicContact CB-CH2 3.5Å; R130-W158 VanDerWaalsContact CB-CH2 3.5Å; R130-W158 HydrophobicContact CB-CZ2 4.03Å; R130-W158 HydrophobicContact CB-CZ3 4.14Å; R130-W158 HydrophobicContact CG-CH2 3.81Å; R130-W158 HydrophobicContact CG-CZ2 3.86Å; I133-W158 HydrophobicContact CD1-CB 4.13Å; I133-W158 HydrophobicContact CD1-CG 4.38Å; I133-W158 HydrophobicContact CG1-CB 4.15Å; I133-W158 HydrophobicContact CG1-CD2 4.11Å; I133-W158 HydrophobicContact CG1-CE3 4.46Å; I133-W158 HydrophobicContact CG1-CG 3.93Å; I133-W158 HydrophobicContact CG2-CG 4.22Å; F156-W158 HydrophobicContact CE2-CB 4.32Å; F156-W158 HydrophobicContact CE2-CE3 4.36Å; W158-P160 VanDerWaalsContact C-N 3.33Å; W158-P160 HydrophobicContact CD2-CG 4.39Å; W158-P160 VanDerWaalsContact CE2-CD 3.49Å; W158-P160 HydrophobicContact CZ2-CG 3.82Å; W158-P160 VanDerWaalsContact O-CD 3.32Å; W158-P160 WeakPolarHBondContact O-CD 3.39Å; W158-N161 VanDerWaalsContact CD1-OD1 3.28Å; W158-N161 PolarHBondContact O-N 3.01Å; W158-N161 VanDerWaalsContact O-N 3.13Å; W158-N161 PolarHBondContact O-OD1 2.73Å; W158-G162 PolarHBondContact O-N 2.79Å; W158-E163 WeakPolarHBondContact CB-O 3.44Å; W158-E163 PolarHBondContact N-O 3.4Å
159	K	87.8	Confident	93.4	Very high	179 Å²	179	34.9 Å²	34.9	78%	0.778	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.5	-30.3	-166.7	-57.5	-158.9	175.4	-157.1	0	118.4	Q157	Q157-K159 PolarHBondContact O-N 3.21Å
160	P	87.4	Confident	93.7	Very high	100 Å²	100	29.8 Å²	29.8	65%	0.649	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-26.7	178.3	-24.2	36.5	0	0	0	115.7	W158	W158-P160 VanDerWaalsContact C-N 3.33Å; W158-P160 HydrophobicContact CD2-CG 4.39Å; W158-P160 VanDerWaalsContact CE2-CD 3.49Å; W158-P160 HydrophobicContact CZ2-CG 3.82Å; W158-P160 VanDerWaalsContact O-CD 3.32Å; W158-P160 WeakPolarHBondContact O-CD 3.39Å
161	N	87.5	Confident	93.8	Very high	74 Å²	74	28.7 Å²	28.7	40%	0.396	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-130.1	-8.3	-179.1	64.1	-14.8	0	0	0	113.8	W158 E163	W158-N161 VanDerWaalsContact CD1-OD1 3.28Å; W158-N161 PolarHBondContact O-N 3.01Å; W158-N161 VanDerWaalsContact O-N 3.13Å; W158-N161 PolarHBondContact O-OD1 2.73Å; N161-E163 HydrophobicContact CB-CG 4.27Å; N161-E163 VanDerWaalsContact ND2-CG 3.31Å; N161-E163 WeakPolarHBondContact ND2-CG 3.22Å; N161-E163 PolarHBondContact O-N 2.96Å; N161-E163 PolarHBondContact OD1-N 2.9Å
162	G	92	Very high	94.1	Very high	5 Å²	5	29.9 Å²	29.9	5%	0.052	15%	0.15	C	C	.	.			trans	82.5	-11.2	-179.9	0	0	0	0	0	114.9	W158 A193 S194	W158-G162 PolarHBondContact O-N 2.79Å; G162-A193 VanDerWaalsContact O-CA 3.3Å; G162-A193 WeakPolarHBondContact O-CA 3.46Å; G162-A193 WeakPolarHBondContact O-CB 3.45Å; G162-S194 WeakPolarHBondContact CA-OG 3.38Å; G162-S194 PolarHBondContact O-N 3.18Å
163	E	94.4	Very high	93.9	Very high	14 Å²	14	38 Å²	38	7%	0.065	19%	0.188	C	C	.	.			trans	-72.8	154.7	-173.7	-61.8	-79.9	-138.6	0	0	112.8	W158 N161 T167 M168 Q171 R202	W158-E163 WeakPolarHBondContact CB-O 3.44Å; W158-E163 PolarHBondContact N-O 3.4Å; N161-E163 HydrophobicContact CB-CG 4.27Å; N161-E163 VanDerWaalsContact ND2-CG 3.31Å; N161-E163 WeakPolarHBondContact ND2-CG 3.22Å; N161-E163 PolarHBondContact O-N 2.96Å; N161-E163 PolarHBondContact OD1-N 2.9Å; E163-T167 WeakPolarHBondContact OE2-CB 3.07Å; E163-T167 PolarHBondContact OE2-OG1 2.71Å; E163-M168 HydrophobicContact CB-CG 3.53Å; E163-M168 HydrophobicContact CB-SD 3.92Å; E163-M168 HydrophobicContact CG-CG 4.16Å; E163-Q171 PolarHBondContact OE1-NE2 3.41Å; E163-R202 VanDerWaalsContact CD-NE 3.35Å; E163-R202 VanDerWaalsContact CD-NH2 3.35Å; E163-R202 IonicContact OE1-CZ 3.59Å; E163-R202 IonicContact OE1-NE 3.22Å; E163-R202 PolarHBondContact OE1-NE 2.89Å; E163-R202 IonicContact OE1-NH2 2.82Å; E163-R202 PolarHBondContact OE1-NH2 2.91Å; E163-R202 IonicContact OE2-CZ 2.71Å; E163-R202 IonicContact OE2-NE 3.42Å; E163-R202 PolarHBondContact OE2-NE 3.26Å; E163-R202 IonicContact OE2-NH2 3.71Å; E163-R202 PolarHBondContact OE2-NH2 3.4Å; E163-R202 VanDerWaalsContact OE2-NH2 3.09Å
164	T	95.6	Very high	93.9	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.012	22%	0.216	C	C	.	.			trans	-99.6	157.6	172.6	81.6	0	0	0	0	109.5	F156 Q157 L166 T167 M168 Y191 A193	F156-T164 WeakPolarHBondContact O-CA 3.39Å; Q157-T164 HydrophobicContact CG-CG2 4.4Å; T164-L166 PolarHBondContact O-N 2.81Å; T164-L166 VanDerWaalsContact O-N 3.09Å; T164-L166 PolarHBondContact OG1-N 2.9Å; T164-T167 HydrophobicContact CG2-CG2 4.44Å; T164-T167 PolarHBondContact N-OG1 3.48Å; T164-T167 PolarHBondContact O-N 3.22Å; T164-T167 VanDerWaalsContact O-N 3.11Å; T164-T167 PolarHBondContact O-OG1 2.73Å; T164-T167 PolarHBondContact OG1-N 2.72Å; T164-T167 VanDerWaalsContact OG1-N 3.07Å; T164-T167 PolarHBondContact OG1-OG1 3.41Å; T164-M168 WeakPolarHBondContact O-CG 3.34Å; T164-M168 PolarHBondContact O-N 3.04Å; T164-Y191 HydrophobicContact CG2-CD1 3.57Å; T164-Y191 HydrophobicContact CG2-CE1 3.59Å; T164-A193 HydrophobicContact CG2-CB 4.44Å
165	P	96.3	Very high	93.9	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-48.7	-37.3	172.9	-31	36.6	0	0	0	113.7	F132 I133 V136 P154 F156 A169 L182	F132-P165 HydrophobicContact CD1-CG 4.22Å; F132-P165 HydrophobicContact CE1-CB 3.92Å; F132-P165 HydrophobicContact CE1-CG 3.9Å; I133-P165 HydrophobicContact CD1-CB 4.41Å; I133-P165 HydrophobicContact CD1-CG 3.83Å; V136-P165 WeakPolarHBondContact CG1-O 3.41Å; V136-P165 HydrophobicContact CG2-CB 4.42Å; P154-P165 HydrophobicContact CB-CG 4.49Å; P154-P165 VanDerWaalsContact O-CD 3.23Å; P154-P165 WeakPolarHBondContact O-CD 3.31Å; P154-P165 VanDerWaalsContact O-CG 3.26Å; P154-P165 WeakPolarHBondContact O-CG 3.3Å; F156-P165 HydrophobicContact CD1-CG 4.22Å; F156-P165 HydrophobicContact CE1-CG 3.58Å; F156-P165 HydrophobicContact CE2-CG 4.25Å; F156-P165 HydrophobicContact CZ-CG 3.6Å; F156-P165 WeakPolarHBondContact O-CD 3.16Å; P165-A169 WeakPolarHBondContact O-CB 3.35Å; P165-A169 PolarHBondContact O-N 2.89Å; P165-L182 HydrophobicContact CB-CD1 4.24Å; P165-L182 HydrophobicContact CB-CD2 3.92Å; P165-L182 WeakPolarHBondContact O-CD1 3.4Å
166	L	96.8	Very high	93.9	Very high	4 Å²	4	49.5 Å²	49.5	2%	0.021	23%	0.234	C	C	.	.	H	α-helix	trans	-78.9	-36.4	-179.7	-168.7	57.7	0	0	0	112.6	T164 M168 A169 V170 V179 L182 V183 A187 L189 P199	T164-L166 PolarHBondContact O-N 2.81Å; T164-L166 VanDerWaalsContact O-N 3.09Å; T164-L166 PolarHBondContact OG1-N 2.9Å; L166-M168 PolarHBondContact O-N 3.32Å; L166-A169 PolarHBondContact O-N 3.13Å; L166-V170 PolarHBondContact O-N 2.85Å; L166-V179 HydrophobicContact CD1-CB 4.39Å; L166-V179 HydrophobicContact CD1-CG1 4.11Å; L166-V179 HydrophobicContact CD1-CG2 4.12Å; L166-L182 HydrophobicContact CD1-CB 4.31Å; L166-L182 HydrophobicContact CD1-CD1 4.27Å; L166-V183 HydrophobicContact CD1-CG2 4.32Å; L166-V183 HydrophobicContact CD2-CG2 4.29Å; L166-A187 HydrophobicContact CD2-CB 4.17Å; L166-L189 HydrophobicContact CD2-CD2 4.25Å; L166-P199 HydrophobicContact CB-CG 4.03Å; L166-P199 HydrophobicContact CD2-CB 4.39Å; L166-P199 HydrophobicContact CD2-CG 3.77Å; L166-P199 HydrophobicContact CG-CB 4Å; L166-P199 HydrophobicContact CG-CG 3.64Å
167	T	96.3	Very high	94	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-70.1	-20.5	171.9	65.4	0	0	0	0	113	E163 T164 V170 Q171 A193 P199 R202	E163-T167 WeakPolarHBondContact OE2-CB 3.07Å; E163-T167 PolarHBondContact OE2-OG1 2.71Å; T164-T167 HydrophobicContact CG2-CG2 4.44Å; T164-T167 PolarHBondContact N-OG1 3.48Å; T164-T167 PolarHBondContact O-N 3.22Å; T164-T167 VanDerWaalsContact O-N 3.11Å; T164-T167 PolarHBondContact O-OG1 2.73Å; T164-T167 PolarHBondContact OG1-N 2.72Å; T164-T167 VanDerWaalsContact OG1-N 3.07Å; T164-T167 PolarHBondContact OG1-OG1 3.41Å; T167-V170 VanDerWaalsContact O-CG2 3.22Å; T167-V170 WeakPolarHBondContact O-CG2 3.46Å; T167-Q171 PolarHBondContact O-NE2 2.72Å; T167-A193 HydrophobicContact CG2-CB 4.32Å; T167-P199 HydrophobicContact CG2-CB 4.41Å; T167-P199 HydrophobicContact CG2-CG 3.92Å; T167-R202 HydrophobicContact CG2-CG 4.27Å
168	M	95.6	Very high	94.1	Very high	22 Å²	22	52.5 Å²	52.5	11%	0.108	25%	0.249	C	C	.	.	H	α-helix	trans	-82	-40.1	170.7	-64.6	-171.7	68.1	0	0	112.7	I133 V136 K137 E163 T164 L166 V170 Q171	I133-M168 HydrophobicContact CD1-SD 3.94Å; I133-M168 HydrophobicContact CG2-CE 4Å; I133-M168 HydrophobicContact CG2-SD 3.8Å; V136-M168 HydrophobicContact CG1-CB 4.06Å; K137-M168 HydrophobicContact CD-CE 4.13Å; K137-M168 HydrophobicContact CG-CE 3.46Å; K137-M168 VanDerWaalsContact CG-CE 3.46Å; E163-M168 HydrophobicContact CB-CG 3.53Å; E163-M168 HydrophobicContact CB-SD 3.92Å; E163-M168 HydrophobicContact CG-CG 4.16Å; T164-M168 WeakPolarHBondContact O-CG 3.34Å; T164-M168 PolarHBondContact O-N 3.04Å; L166-M168 PolarHBondContact O-N 3.32Å; M168-V170 VanDerWaalsContact C-N 3.29Å; M168-V170 PolarHBondContact O-N 2.94Å; M168-Q171 PolarHBondContact O-N 2.99Å; M168-Q171 VanDerWaalsContact O-N 3.07Å
169	A	96.7	Very high	94.3	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60.6	-34.4	-179.9	0	0	0	0	0	113.8	V136 P165 L166 Q171 L172 M178 V179 L182	V136-A169 HydrophobicContact CG1-CB 4.27Å; P165-A169 WeakPolarHBondContact O-CB 3.35Å; P165-A169 PolarHBondContact O-N 2.89Å; L166-A169 PolarHBondContact O-N 3.13Å; A169-Q171 PolarHBondContact O-N 3.4Å; A169-L172 WeakPolarHBondContact O-CB 3.38Å; A169-L172 WeakPolarHBondContact O-CG 3.29Å; A169-L172 PolarHBondContact O-N 2.83Å; A169-M178 HydrophobicContact CB-CB 4.23Å; A169-M178 HydrophobicContact CB-CG 3.55Å; A169-V179 HydrophobicContact CB-CG2 4.16Å; A169-L182 HydrophobicContact CB-CD1 3.58Å
170	V	96.7	Very high	94.7	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-10.6	176.9	-62.3	0	0	0	0	114.3	L166 T167 M168 V179 P199 R202 A203 N208 A211 L215	L166-V170 PolarHBondContact O-N 2.85Å; T167-V170 VanDerWaalsContact O-CG2 3.22Å; T167-V170 WeakPolarHBondContact O-CG2 3.46Å; M168-V170 VanDerWaalsContact C-N 3.29Å; M168-V170 PolarHBondContact O-N 2.94Å; V170-V179 HydrophobicContact CG1-CG2 4.1Å; V170-P199 HydrophobicContact CG1-CB 4.25Å; V170-R202 HydrophobicContact CG2-CB 3.88Å; V170-A203 HydrophobicContact CB-CB 4.13Å; V170-A203 HydrophobicContact CG2-CB 4.46Å; V170-N208 PolarHBondContact O-ND2 3.32Å; V170-A211 HydrophobicContact CB-CB 3.75Å; V170-A211 HydrophobicContact CG1-CB 3.93Å; V170-L215 HydrophobicContact CG1-CD1 3.97Å
171	Q	94.7	Very high	95.2	Very high	72 Å²	72	40.2 Å²	40.2	34%	0.336	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-0.8	177.2	-56.9	-178.4	60.2	0	0	112.5	E163 T167 M168 A169 K206	E163-Q171 PolarHBondContact OE1-NE2 3.41Å; T167-Q171 PolarHBondContact O-NE2 2.72Å; M168-Q171 PolarHBondContact O-N 2.99Å; M168-Q171 VanDerWaalsContact O-N 3.07Å; A169-Q171 PolarHBondContact O-N 3.4Å; Q171-K206 HydrophobicContact CG-CG 3.98Å
172	L	94.9	Very high	95.6	Very high	32 Å²	32	36.7 Å²	36.7	17%	0.168	17%	0.17	C	C	.	.	S	Bend	trans	-75	152.6	171.6	-58.5	175.4	0	0	0	110.8	K137 A169 K174 M178 N208	K137-L172 WeakPolarHBondContact O-CD2 3.38Å; A169-L172 WeakPolarHBondContact O-CB 3.38Å; A169-L172 WeakPolarHBondContact O-CG 3.29Å; A169-L172 PolarHBondContact O-N 2.83Å; L172-K174 PolarHBondContact O-N 2.75Å; L172-M178 HydrophobicContact CD1-CB 3.97Å; L172-M178 HydrophobicContact CD1-CG 3.93Å; L172-N208 PolarHBondContact O-ND2 3.16Å
173	E	92	Very high	95.8	Very high	170 Å²	170	37.3 Å²	37.3	79%	0.794	17%	0.172	S	C	*	.	S	Bend	trans	-58.3	-36.1	174.3	-171.3	-167	139	0	0	112.4
174	K	93.4	Very high	95.8	Very high	154 Å²	154	38.5 Å²	38.5	67%	0.67	19%	0.185	S	C	*	.	S	Bend	trans	-125.5	80.3	-179.7	-64.6	-178.1	-177.2	177.5	0	110.1	L172 Y176	L172-K174 PolarHBondContact O-N 2.75Å; K174-Y176 PolarHBondContact O-N 3.31Å
175	P	95.4	Very high	95.6	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.186	C	C	.	.			trans	-71.1	-25.8	-173.6	29.1	-39.3	0	0	0	114.1	E177 M178 V179 E210 A211	P175-E177 PolarHBondContact O-N 2.98Å; P175-M178 PolarHBondContact O-N 2.78Å; P175-V179 HydrophobicContact CB-CG2 4.13Å; P175-V179 WeakPolarHBondContact O-CB 3.4Å; P175-V179 WeakPolarHBondContact O-CG2 3.36Å; P175-V179 PolarHBondContact O-N 3.25Å; P175-E210 VanDerWaalsContact CD-OE2 3.3Å; P175-E210 WeakPolarHBondContact CD-OE2 3.47Å; P175-E210 HydrophobicContact CG-CB 3.97Å; P175-E210 HydrophobicContact CG-CG 4.02Å; P175-A211 HydrophobicContact CB-CB 3.97Å; P175-A211 HydrophobicContact CG-CB 3.8Å
176	Y	96.3	Very high	95.4	Very high	113 Å²	113	38.6 Å²	38.6	44%	0.443	19%	0.186	S	C	.	.	H	α-helix	trans	-47.9	-61.1	-166.5	-175.8	-81.3	0	0	0	113.8	K174 M178 V179 M180 V214	K174-Y176 PolarHBondContact O-N 3.31Å; Y176-M178 PolarHBondContact O-N 3.09Å; Y176-V179 PolarHBondContact O-N 2.94Å; Y176-M180 HydrophobicContact CD1-CG 4.21Å; Y176-M180 HydrophobicContact CE1-CE 4.43Å; Y176-M180 HydrophobicContact CE1-CG 3.92Å; Y176-M180 HydrophobicContact CE2-CE 4.03Å; Y176-M180 WeakPolarHBondContact O-CB 3.28Å; Y176-M180 VanDerWaalsContact O-CG 3.31Å; Y176-M180 WeakPolarHBondContact O-CG 3.3Å; Y176-M180 PolarHBondContact O-N 3.18Å; Y176-V214 HydrophobicContact CD2-CG2 3.44Å; Y176-V214 VanDerWaalsContact CD2-CG2 3.44Å; Y176-V214 HydrophobicContact CE2-CG2 4.1Å; Y176-V214 HydrophobicContact CG-CG2 4.28Å
177	E	96.1	Very high	95.4	Very high	132 Å²	132	38.6 Å²	38.6	62%	0.617	19%	0.186	S	C	*	.	H	α-helix	trans	-66.3	-37.6	-173.5	-62.7	-177	-178.4	0	0	112.4	V141 P175 A181	V141-E177 HydrophobicContact CG2-CB 3.87Å; P175-E177 PolarHBondContact O-N 2.98Å; E177-A181 VanDerWaalsContact O-CB 3.23Å; E177-A181 WeakPolarHBondContact O-CB 3.26Å; E177-A181 PolarHBondContact O-N 3.13Å
178	M	97.1	Very high	95.3	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-71.3	-41.4	179.4	-174.3	61.9	72.5	0	0	111.6	V136 V141 V144 A169 L172 P175 Y176 A181 L182	V136-M178 HydrophobicContact CG1-CG 4.44Å; V136-M178 HydrophobicContact CG2-SD 4.24Å; V141-M178 HydrophobicContact CG2-CB 4.28Å; V141-M178 HydrophobicContact CG2-CE 3.89Å; V141-M178 HydrophobicContact CG2-SD 4.5Å; V144-M178 HydrophobicContact CB-SD 4.14Å; V144-M178 HydrophobicContact CG1-SD 3.95Å; V144-M178 HydrophobicContact CG2-CE 4.01Å; V144-M178 HydrophobicContact CG2-SD 3.85Å; A169-M178 HydrophobicContact CB-CB 4.23Å; A169-M178 HydrophobicContact CB-CG 3.55Å; L172-M178 HydrophobicContact CD1-CB 3.97Å; L172-M178 HydrophobicContact CD1-CG 3.93Å; P175-M178 PolarHBondContact O-N 2.78Å; Y176-M178 PolarHBondContact O-N 3.09Å; M178-A181 PolarHBondContact O-N 3.29Å; M178-L182 HydrophobicContact CG-CD1 4.12Å; M178-L182 WeakPolarHBondContact O-CB 3.28Å; M178-L182 VanDerWaalsContact O-CG 3.28Å; M178-L182 WeakPolarHBondContact O-CG 3.43Å; M178-L182 PolarHBondContact O-N 2.84Å; M178-L182 HydrophobicContact SD-CD1 4.41Å; M178-L182 HydrophobicContact SD-CG 4.43Å
179	V	97.3	Very high	95.3	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63.1	-48.6	174.5	169	0	0	0	0	110.1	L166 A169 V170 P175 Y176 A181 L182 V183 V214 L215 L218	L166-V179 HydrophobicContact CD1-CB 4.39Å; L166-V179 HydrophobicContact CD1-CG1 4.11Å; L166-V179 HydrophobicContact CD1-CG2 4.12Å; A169-V179 HydrophobicContact CB-CG2 4.16Å; V170-V179 HydrophobicContact CG1-CG2 4.1Å; P175-V179 HydrophobicContact CB-CG2 4.13Å; P175-V179 WeakPolarHBondContact O-CB 3.4Å; P175-V179 WeakPolarHBondContact O-CG2 3.36Å; P175-V179 PolarHBondContact O-N 3.25Å; Y176-V179 PolarHBondContact O-N 2.94Å; V179-A181 PolarHBondContact O-N 3.23Å; V179-L182 PolarHBondContact O-N 2.58Å; V179-V183 HydrophobicContact CG1-CG2 4.35Å; V179-V183 WeakPolarHBondContact O-CB 3.46Å; V179-V183 VanDerWaalsContact O-CG2 3.27Å; V179-V183 WeakPolarHBondContact O-CG2 3.48Å; V179-V183 PolarHBondContact O-N 2.97Å; V179-V214 HydrophobicContact CB-CG1 4.23Å; V179-V214 HydrophobicContact CG1-CG1 3.69Å; V179-L215 HydrophobicContact CG1-CD2 4.27Å; V179-L218 HydrophobicContact CG1-CD1 3.89Å
180	M	96.9	Very high	95	Very high	41 Å²	41	39.5 Å²	39.5	20%	0.202	19%	0.192	C	C	.	.	H	α-helix	trans	-58	-45.8	175.9	-74.1	-64.5	-170.9	0	0	112.1	Y176 V183 A184 V214 L218 L435	Y176-M180 HydrophobicContact CD1-CG 4.21Å; Y176-M180 HydrophobicContact CE1-CE 4.43Å; Y176-M180 HydrophobicContact CE1-CG 3.92Å; Y176-M180 HydrophobicContact CE2-CE 4.03Å; Y176-M180 WeakPolarHBondContact O-CB 3.28Å; Y176-M180 VanDerWaalsContact O-CG 3.31Å; Y176-M180 WeakPolarHBondContact O-CG 3.3Å; Y176-M180 PolarHBondContact O-N 3.18Å; M180-V183 PolarHBondContact O-N 2.97Å; M180-A184 WeakPolarHBondContact O-CB 3.4Å; M180-A184 PolarHBondContact O-N 3.2Å; M180-V214 HydrophobicContact CE-CG1 4.39Å; M180-L218 HydrophobicContact CE-CD2 4.08Å; M180-L218 HydrophobicContact CE-CG 4.32Å; M180-L218 HydrophobicContact SD-CD1 4.13Å; M180-L218 HydrophobicContact SD-CD2 3.88Å; M180-L218 HydrophobicContact SD-CG 4.36Å; M180-L435 HydrophobicContact SD-CD2 4.48Å
181	A	96.6	Very high	95	Very high	8 Å²	8	39.8 Å²	39.8	7%	0.066	19%	0.193	C	C	.	.	H	α-helix	trans	-62.1	-43.9	177.5	0	0	0	0	0	112.5	V141 L148 E177 M178 V179 G185	V141-A181 HydrophobicContact CG1-CB 3.92Å; L148-A181 VanDerWaalsContact CD1-O 3.23Å; L148-A181 WeakPolarHBondContact CD1-O 3.29Å; E177-A181 VanDerWaalsContact O-CB 3.23Å; E177-A181 WeakPolarHBondContact O-CB 3.26Å; E177-A181 PolarHBondContact O-N 3.13Å; M178-A181 PolarHBondContact O-N 3.29Å; V179-A181 PolarHBondContact O-N 3.23Å; A181-G185 WeakPolarHBondContact O-CA 3.29Å; A181-G185 PolarHBondContact O-N 2.97Å
182	L	97	Very high	95	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-66.6	-39.9	178.1	-73.4	169.8	0	0	0	112.7	F132 V136 V144 L148 P154 P165 L166 A169 M178 V179 G185 G186 A187	F132-L182 HydrophobicContact CE1-CD2 3.98Å; F132-L182 HydrophobicContact CZ-CD2 3.69Å; V136-L182 HydrophobicContact CG2-CD2 4.46Å; V144-L182 HydrophobicContact CG1-CD2 4.09Å; L148-L182 HydrophobicContact CD1-CD2 4.49Å; P154-L182 HydrophobicContact CB-CD2 4.14Å; P165-L182 HydrophobicContact CB-CD1 4.24Å; P165-L182 HydrophobicContact CB-CD2 3.92Å; P165-L182 WeakPolarHBondContact O-CD1 3.4Å; L166-L182 HydrophobicContact CD1-CB 4.31Å; L166-L182 HydrophobicContact CD1-CD1 4.27Å; A169-L182 HydrophobicContact CB-CD1 3.58Å; M178-L182 HydrophobicContact CG-CD1 4.12Å; M178-L182 WeakPolarHBondContact O-CB 3.28Å; M178-L182 VanDerWaalsContact O-CG 3.28Å; M178-L182 WeakPolarHBondContact O-CG 3.43Å; M178-L182 PolarHBondContact O-N 2.84Å; M178-L182 HydrophobicContact SD-CD1 4.41Å; M178-L182 HydrophobicContact SD-CG 4.43Å; V179-L182 PolarHBondContact O-N 2.58Å; L182-G185 CarbonylContact O-C 3.59Å; L182-G185 VanDerWaalsContact O-C 3.25Å; L182-G185 WeakPolarHBondContact O-CA 3.49Å; L182-G185 PolarHBondContact O-N 3.49Å; L182-G186 PolarHBondContact O-N 3.12Å; L182-G186 VanDerWaalsContact O-N 3.13Å; L182-A187 HydrophobicContact CB-CB 4.24Å; L182-A187 VanDerWaalsContact O-CB 3.28Å; L182-A187 WeakPolarHBondContact O-CB 3.36Å; L182-A187 PolarHBondContact O-N 2.8Å
183	V	95.7	Very high	95	Very high	17 Å²	17	35.7 Å²	35.7	10%	0.103	17%	0.172	C	C	.	.	H	α-helix	trans	-72.7	-43.6	-179.4	174.2	0	0	0	0	111.4	L166 V179 M180 G185 G186 L189 L218	L166-V183 HydrophobicContact CD1-CG2 4.32Å; L166-V183 HydrophobicContact CD2-CG2 4.29Å; V179-V183 HydrophobicContact CG1-CG2 4.35Å; V179-V183 WeakPolarHBondContact O-CB 3.46Å; V179-V183 VanDerWaalsContact O-CG2 3.27Å; V179-V183 WeakPolarHBondContact O-CG2 3.48Å; V179-V183 PolarHBondContact O-N 2.97Å; M180-V183 PolarHBondContact O-N 2.97Å; V183-G185 PolarHBondContact O-N 3.07Å; V183-G186 WeakPolarHBondContact O-CA 3.38Å; V183-G186 PolarHBondContact O-N 3Å; V183-L189 HydrophobicContact CG1-CD2 4.24Å; V183-L189 HydrophobicContact CG2-CD2 3.48Å; V183-L189 VanDerWaalsContact CG2-CD2 3.48Å; V183-L218 HydrophobicContact CB-CD1 4.48Å; V183-L218 HydrophobicContact CG1-CD1 4.44Å; V183-L218 HydrophobicContact CG2-CD1 4.22Å
184	A	93.6	Very high	95	Very high	40 Å²	40	31 Å²	31	33%	0.331	16%	0.158	S	C	.	.	H	α-helix	trans	-62.6	-29.6	167	0	0	0	0	0	111.9	M180 G186	M180-A184 WeakPolarHBondContact O-CB 3.4Å; M180-A184 PolarHBondContact O-N 3.2Å; A184-G186 PolarHBondContact O-N 3.45Å
185	G	92.6	Very high	94.9	Very high	3 Å²	3	25.5 Å²	25.5	3%	0.031	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-7.5	166.7	0	0	0	0	0	115.2	R108 A181 L182 V183	R108-G185 WeakPolarHBondContact CD-O 3.24Å; R108-G185 PolarHBondContact NE-O 2.99Å; R108-G185 PolarHBondContact NH2-O 3.43Å; A181-G185 WeakPolarHBondContact O-CA 3.29Å; A181-G185 PolarHBondContact O-N 2.97Å; L182-G185 CarbonylContact O-C 3.59Å; L182-G185 VanDerWaalsContact O-C 3.25Å; L182-G185 WeakPolarHBondContact O-CA 3.49Å; L182-G185 PolarHBondContact O-N 3.49Å; V183-G185 PolarHBondContact O-N 3.07Å
186	G	92.8	Very high	94.8	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.6	28.8	179.4	0	0	0	0	0	115.1	N155 L182 V183 A184	N155-G186 PolarHBondContact ND2-O 2.91Å; L182-G186 PolarHBondContact O-N 3.12Å; L182-G186 VanDerWaalsContact O-N 3.13Å; V183-G186 WeakPolarHBondContact O-CA 3.38Å; V183-G186 PolarHBondContact O-N 3Å; A184-G186 PolarHBondContact O-N 3.45Å
187	A	96	Very high	94.7	Very high	4 Å²	4	20.7 Å²	20.7	3%	0.033	12%	0.118	C	C	.	.			trans	-71.6	130.6	162	0	0	0	0	0	110.1	P154 N155 L166 L182	P154-A187 HydrophobicContact CB-CB 4.11Å; P154-A187 HydrophobicContact CG-CB 3.73Å; N155-A187 WeakPolarHBondContact OD1-CA 3.46Å; L166-A187 HydrophobicContact CD2-CB 4.17Å; L182-A187 HydrophobicContact CB-CB 4.24Å; L182-A187 VanDerWaalsContact O-CB 3.28Å; L182-A187 WeakPolarHBondContact O-CB 3.36Å; L182-A187 PolarHBondContact O-N 2.8Å
188	H	95	Very high	94.6	Very high	5 Å²	5	14.4 Å²	14.4	2%	0.023	9%	0.089	C	C	.	.			trans	-78.8	132.7	171.9	-56.6	-75	0	0	0	109.7	F82 K106 Q107 N155 D190 Y191	F82-H188 AromaticContact CD2-CE1 3.59Å; F82-H188 AromaticContact CE2-CE1 3.86Å; F82-H188 AromaticContact CE2-NE2 3.87Å; K106-H188 PolarHBondContact O-CD2 3.2Å; K106-H188 VanDerWaalsContact O-CD2 3.31Å; Q107-H188 PolarHBondContact O-NE2 2.82Å; N155-H188 PolarHBondContact OD1-CD2 2.94Å; N155-H188 VanDerWaalsContact OD1-CD2 3.27Å; N155-H188 PolarHBondContact OD1-N 3.27Å; H188-D190 PolarHBondContact O-N 3.09Å; H188-Y191 WeakPolarHBondContact O-CB 3.4Å; H188-Y191 PolarHBondContact O-N 3.41Å
189	L	93.6	Very high	94.6	Very high	3 Å²	3	14.3 Å²	14.3	2%	0.016	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-28.4	-177.8	-59	178.2	0	0	0	112.7	L166 V183 P199 L215 L218 Q220 Y433	L166-L189 HydrophobicContact CD2-CD2 4.25Å; V183-L189 HydrophobicContact CG1-CD2 4.24Å; V183-L189 HydrophobicContact CG2-CD2 3.48Å; V183-L189 VanDerWaalsContact CG2-CD2 3.48Å; L189-P199 VanDerWaalsContact O-CD 3.28Å; L189-P199 WeakPolarHBondContact O-CD 3.46Å; L189-P199 WeakPolarHBondContact O-CG 3.34Å; L189-L215 HydrophobicContact CD2-CD2 4.01Å; L189-L218 HydrophobicContact CD1-CB 4.04Å; L189-L218 WeakPolarHBondContact CD1-O 3.38Å; L189-L218 HydrophobicContact CD2-CB 4.48Å; L189-L218 HydrophobicContact CD2-CD1 4.43Å; L189-Q220 HydrophobicContact CB-CB 4.3Å; L189-Q220 HydrophobicContact CD1-CB 4.08Å; L189-Q220 PolarHBondContact O-NE2 3.09Å; L189-Q220 PolarHBondContact O-OE1 2.88Å; L189-Y433 HydrophobicContact CD1-CD2 3.99Å; L189-Y433 HydrophobicContact CD1-CE2 3.58Å; L189-Y433 HydrophobicContact CG-CE2 4.37Å
190	D	92.3	Very high	94.5	Very high	34 Å²	34	14.3 Å²	14.3	18%	0.182	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	10.4	-176.4	70.6	-12.2	0	0	0	113.9	K106 H188	K106-D190 IonicContact NZ-OD1 2.94Å; K106-D190 PolarHBondContact NZ-OD1 3.1Å; K106-D190 IonicContact NZ-OD2 2.97Å; K106-D190 PolarHBondContact NZ-OD2 2.81Å; H188-D190 PolarHBondContact O-N 3.09Å
191	Y	95	Very high	94.5	Very high	5 Å²	5	12.3 Å²	12.3	2%	0.02	8%	0.079	C	C	.	.	P	Polyproline II helix	trans	-75.9	126.9	177.6	-173.6	-103.6	0	0	0	111.6	N67 Y105 K106 N155 F156 T164 H188 P199	N67-Y191 HydrophobicContact CB-CD2 4.14Å; N67-Y191 HydrophobicContact CB-CE2 3.8Å; N67-Y191 VanDerWaalsContact CG-CE2 3.45Å; N67-Y191 WeakPolarHBondContact OD1-CD2 3.1Å; Y105-Y191 HydrophobicContact CE1-CE2 4Å; Y105-Y191 AromaticContact CZ-CE2 3.94Å; Y105-Y191 PolarHBondContact OH-OH 3.05Å; K106-Y191 HydrophobicContact CB-CD2 3.99Å; N155-Y191 VanDerWaalsContact C-CE1 3.48Å; N155-Y191 HydrophobicContact CB-CD1 4.25Å; N155-Y191 HydrophobicContact CB-CD2 4.23Å; N155-Y191 HydrophobicContact CB-CE1 4.29Å; N155-Y191 HydrophobicContact CB-CE2 4.25Å; N155-Y191 HydrophobicContact CB-CG 4.25Å; F156-Y191 WeakPolarHBondContact CA-OH 3.38Å; F156-Y191 VanDerWaalsContact N-CE1 3.34Å; T164-Y191 HydrophobicContact CG2-CD1 3.57Å; T164-Y191 HydrophobicContact CG2-CE1 3.59Å; H188-Y191 WeakPolarHBondContact O-CB 3.4Å; H188-Y191 PolarHBondContact O-N 3.41Å; Y191-P199 WeakPolarHBondContact O-CD 3.24Å
192	R	94.9	Very high	94.5	Very high	18 Å²	18	13 Å²	13	7%	0.068	8%	0.079	C	C	.	.	P	Polyproline II helix	trans	-100.7	142.4	-163.3	-65	162.5	-178.9	-90.2	9.9	113.8	N67 Q157 S196 M197 T198 R225	N67-R192 PolarHBondContact ND2-O 3.23Å; N67-R192 PolarHBondContact OD1-N 2.87Å; Q157-R192 PolarHBondContact NE2-O 3.1Å; R192-S196 WeakPolarHBondContact CG-O 3.48Å; R192-S196 PolarHBondContact NH1-O 2.78Å; R192-M197 VanDerWaalsContact CA-O 3.3Å; R192-M197 WeakPolarHBondContact CA-O 3.49Å; R192-T198 HydrophobicContact CG-CG2 3.76Å; R192-R225 PolarHBondContact NH1-O 2.99Å; R192-R225 PolarHBondContact NH2-O 3.04Å
193	A	95.2	Very high	94.4	Very high	0 Å²	0	13 Å²	13	0%	0	8%	0.079	C	C	.	.	P	Polyproline II helix	trans	-66.2	167.2	164.7	0	0	0	0	0	111.3	G162 T164 T167 D195 S196 M197	G162-A193 VanDerWaalsContact O-CA 3.3Å; G162-A193 WeakPolarHBondContact O-CA 3.46Å; G162-A193 WeakPolarHBondContact O-CB 3.45Å; T164-A193 HydrophobicContact CG2-CB 4.44Å; T167-A193 HydrophobicContact CG2-CB 4.32Å; A193-D195 WeakPolarHBondContact CB-OD1 3.34Å; A193-D195 PolarHBondContact O-N 2.69Å; A193-D195 VanDerWaalsContact O-N 3.17Å; A193-S196 WeakPolarHBondContact O-CA 3.35Å; A193-S196 PolarHBondContact O-N 3.49Å; A193-M197 PolarHBondContact N-O 3.42Å
194	S	92.6	Very high	94.5	Very high	71 Å²	71	12.1 Å²	12.1	50%	0.497	8%	0.075	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-11.1	-174.3	69.5	0	0	0	0	115	G162 S196	G162-S194 WeakPolarHBondContact CA-OG 3.38Å; G162-S194 PolarHBondContact O-N 3.18Å; S194-S196 VanDerWaalsContact C-N 3.26Å
195	D	91.2	Very high	94.5	Very high	40 Å²	40	12 Å²	12	21%	0.214	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	10.4	168.4	63	-3.1	0	0	0	112.5	A193 M197 R202	A193-D195 WeakPolarHBondContact CB-OD1 3.34Å; A193-D195 PolarHBondContact O-N 2.69Å; A193-D195 VanDerWaalsContact O-N 3.17Å; D195-M197 VanDerWaalsContact C-N 3.29Å; D195-M197 PolarHBondContact O-N 2.68Å; D195-M197 WeakPolarHBondContact OD1-CB 3.47Å; D195-M197 PolarHBondContact OD1-N 3.29Å; D195-M197 VanDerWaalsContact OD1-N 3.14Å; D195-R202 IonicContact OD1-NH2 2.83Å; D195-R202 IonicContact OD2-CZ 3.47Å; D195-R202 VanDerWaalsContact OD2-CZ 3.22Å; D195-R202 IonicContact OD2-NH1 3.18Å; D195-R202 PolarHBondContact OD2-NH1 2.92Å; D195-R202 IonicContact OD2-NH2 3.4Å; D195-R202 PolarHBondContact OD2-NH2 3.45Å
196	S	92.2	Very high	94.6	Very high	9 Å²	9	17.1 Å²	17.1	6%	0.063	9%	0.088	C	C	.	.	S	Bend	trans	71.1	-0.2	-175.5	75.4	0	0	0	0	117.2	R192 A193 S194 K227	R192-S196 WeakPolarHBondContact CG-O 3.48Å; R192-S196 PolarHBondContact NH1-O 2.78Å; A193-S196 WeakPolarHBondContact O-CA 3.35Å; A193-S196 PolarHBondContact O-N 3.49Å; S194-S196 VanDerWaalsContact C-N 3.26Å; S196-K227 WeakPolarHBondContact OG-CB 3.1Å; S196-K227 PolarHBondContact OG-N 3.22Å
197	M	94.3	Very high	94.7	Very high	2 Å²	2	17.5 Å²	17.5	1%	0.01	9%	0.093	C	C	.	.			trans	-67.4	137.5	179.4	-69.8	-157.5	-174	0	0	112.7	R192 A193 D195 H201 R202 Y235 F758	R192-M197 VanDerWaalsContact CA-O 3.3Å; R192-M197 WeakPolarHBondContact CA-O 3.49Å; A193-M197 PolarHBondContact N-O 3.42Å; D195-M197 VanDerWaalsContact C-N 3.29Å; D195-M197 PolarHBondContact O-N 2.68Å; D195-M197 WeakPolarHBondContact OD1-CB 3.47Å; D195-M197 PolarHBondContact OD1-N 3.29Å; D195-M197 VanDerWaalsContact OD1-N 3.14Å; M197-H201 HydrophobicContact CB-CB 3.96Å; M197-H201 HydrophobicContact CG-CB 4.09Å; M197-H201 HydrophobicContact SD-CB 4.03Å; M197-R202 HydrophobicContact SD-CG 4.47Å; M197-R202 PolarHBondContact SD-NH1 2.98Å; M197-Y235 HydrophobicContact CE-CD1 4.24Å; M197-Y235 HydrophobicContact CE-CE1 3.58Å; M197-Y235 HydrophobicContact CE-CE2 4.23Å; M197-F758 HydrophobicContact CE-CZ 4.37Å
198	T	94.9	Very high	94.7	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.099	C	C	.	.			trans	-86.5	162.9	167.4	68.3	0	0	0	0	110.6	R192 I200 H201 R202 T224	R192-T198 HydrophobicContact CG-CG2 3.76Å; T198-I200 PolarHBondContact O-N 2.7Å; T198-I200 VanDerWaalsContact O-N 3.1Å; T198-I200 VanDerWaalsContact OG1-CG2 3.29Å; T198-I200 WeakPolarHBondContact OG1-CG2 3.48Å; T198-H201 PolarHBondContact N-ND1 2.99Å; T198-H201 WeakPolarHBondContact O-CB 3.35Å; T198-H201 PolarHBondContact O-N 2.71Å; T198-H201 PolarHBondContact OG1-ND1 2.8Å; T198-R202 PolarHBondContact O-N 3.45Å; T198-T224 HydrophobicContact CG2-CG2 4.32Å; T198-T224 PolarHBondContact OG1-OG1 3.1Å
199	P	96.1	Very high	94.7	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-50.1	-34.3	175.6	-30.6	34.8	0	0	0	115.1	L166 T167 V170 L189 Y191 R202 A203 L215	L166-P199 HydrophobicContact CB-CG 4.03Å; L166-P199 HydrophobicContact CD2-CB 4.39Å; L166-P199 HydrophobicContact CD2-CG 3.77Å; L166-P199 HydrophobicContact CG-CB 4Å; L166-P199 HydrophobicContact CG-CG 3.64Å; T167-P199 HydrophobicContact CG2-CB 4.41Å; T167-P199 HydrophobicContact CG2-CG 3.92Å; V170-P199 HydrophobicContact CG1-CB 4.25Å; L189-P199 VanDerWaalsContact O-CD 3.28Å; L189-P199 WeakPolarHBondContact O-CD 3.46Å; L189-P199 WeakPolarHBondContact O-CG 3.34Å; Y191-P199 WeakPolarHBondContact O-CD 3.24Å; P199-R202 PolarHBondContact O-N 2.9Å; P199-A203 WeakPolarHBondContact O-CB 3.49Å; P199-A203 PolarHBondContact O-N 3.41Å; P199-L215 HydrophobicContact CB-CD1 3.83Å; P199-L215 HydrophobicContact CB-CD2 4.22Å
200	I	96.3	Very high	94.9	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-75.2	-28.2	177.9	-170.3	164	0	0	0	112.7	T198 S204 L215 L216 Q220 P232 L249	T198-I200 PolarHBondContact O-N 2.7Å; T198-I200 VanDerWaalsContact O-N 3.1Å; T198-I200 VanDerWaalsContact OG1-CG2 3.29Å; T198-I200 WeakPolarHBondContact OG1-CG2 3.48Å; I200-S204 VanDerWaalsContact O-CB 3.26Å; I200-S204 WeakPolarHBondContact O-CB 3.37Å; I200-S204 PolarHBondContact O-N 2.73Å; I200-S204 PolarHBondContact O-OG 3.38Å; I200-L215 HydrophobicContact CB-CD1 3.88Å; I200-L216 HydrophobicContact CD1-CD1 4.28Å; I200-L216 HydrophobicContact CD1-CD2 3.6Å; I200-L216 HydrophobicContact CD1-CG 3.8Å; I200-Q220 HydrophobicContact CB-CG 4.08Å; I200-Q220 HydrophobicContact CD1-CG 4.27Å; I200-Q220 HydrophobicContact CG2-CG 3.81Å; I200-P232 HydrophobicContact CB-CG 4.44Å; I200-P232 HydrophobicContact CG1-CB 4.09Å; I200-P232 HydrophobicContact CG1-CG 4.2Å; I200-P232 HydrophobicContact CG2-CB 4.47Å; I200-P232 HydrophobicContact CG2-CG 3.72Å; I200-L249 HydrophobicContact CD1-CD2 3.87Å; I200-L249 HydrophobicContact CG1-CD2 4.27Å
201	H	96.5	Very high	95.1	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-64.2	-48.6	168	-68.8	82.8	0	0	0	110.4	M197 T198 A203 S204 E205 T224 L230 Y235	M197-H201 HydrophobicContact CB-CB 3.96Å; M197-H201 HydrophobicContact CG-CB 4.09Å; M197-H201 HydrophobicContact SD-CB 4.03Å; T198-H201 PolarHBondContact N-ND1 2.99Å; T198-H201 WeakPolarHBondContact O-CB 3.35Å; T198-H201 PolarHBondContact O-N 2.71Å; T198-H201 PolarHBondContact OG1-ND1 2.8Å; H201-A203 PolarHBondContact O-N 2.77Å; H201-S204 CarbonylContact O-C 3.58Å; H201-S204 WeakPolarHBondContact O-CA 3.15Å; H201-S204 PolarHBondContact O-N 2.85Å; H201-S204 VanDerWaalsContact O-N 3.12Å; H201-E205 WeakPolarHBondContact O-CB 3.43Å; H201-E205 PolarHBondContact O-N 2.87Å; H201-T224 PolarHBondContact CE1-O 2.81Å; H201-T224 PolarHBondContact CE1-OG1 2.81Å; H201-T224 VanDerWaalsContact CE1-OG1 3.32Å; H201-T224 PolarHBondContact NE2-O 2.91Å; H201-L230 PolarHBondContact NE2-O 2.89Å; H201-Y235 AromaticContact CD2-CD2 3.75Å; H201-Y235 AromaticContact CD2-CE2 3.97Å
202	R	95.9	Very high	95.2	Very high	21 Å²	21	24 Å²	24	8%	0.079	12%	0.119	C	C	.	.	H	α-helix	trans	-62.9	-40	177.2	-79.2	-59.7	-155.2	-117.6	-25.7	113.4	E163 T167 V170 D195 M197 T198 P199 S204 E205 K206	E163-R202 VanDerWaalsContact CD-NE 3.35Å; E163-R202 VanDerWaalsContact CD-NH2 3.35Å; E163-R202 IonicContact OE1-CZ 3.59Å; E163-R202 IonicContact OE1-NE 3.22Å; E163-R202 PolarHBondContact OE1-NE 2.89Å; E163-R202 IonicContact OE1-NH2 2.82Å; E163-R202 PolarHBondContact OE1-NH2 2.91Å; E163-R202 IonicContact OE2-CZ 2.71Å; E163-R202 IonicContact OE2-NE 3.42Å; E163-R202 PolarHBondContact OE2-NE 3.26Å; E163-R202 IonicContact OE2-NH2 3.71Å; E163-R202 PolarHBondContact OE2-NH2 3.4Å; E163-R202 VanDerWaalsContact OE2-NH2 3.09Å; T167-R202 HydrophobicContact CG2-CG 4.27Å; V170-R202 HydrophobicContact CG2-CB 3.88Å; D195-R202 IonicContact OD1-NH2 2.83Å; D195-R202 IonicContact OD2-CZ 3.47Å; D195-R202 VanDerWaalsContact OD2-CZ 3.22Å; D195-R202 IonicContact OD2-NH1 3.18Å; D195-R202 PolarHBondContact OD2-NH1 2.92Å; D195-R202 IonicContact OD2-NH2 3.4Å; D195-R202 PolarHBondContact OD2-NH2 3.45Å; M197-R202 HydrophobicContact SD-CG 4.47Å; M197-R202 PolarHBondContact SD-NH1 2.98Å; T198-R202 PolarHBondContact O-N 3.45Å; P199-R202 PolarHBondContact O-N 2.9Å; R202-S204 VanDerWaalsContact C-N 3.27Å; R202-S204 PolarHBondContact O-N 2.7Å; R202-E205 WeakPolarHBondContact CD-OE2 2.94Å; R202-E205 IonicContact CZ-OE2 2.74Å; R202-E205 IonicContact NE-OE2 3.17Å; R202-E205 IonicContact NH1-OE2 2.82Å; R202-E205 PolarHBondContact NH1-OE2 3.32Å; R202-E205 WeakPolarHBondContact O-CB 3.33Å; R202-E205 PolarHBondContact O-N 2.8Å; R202-K206 PolarHBondContact O-N 3.25Å; R202-K206 VanDerWaalsContact O-N 3.09Å
203	A	96.6	Very high	95.2	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61	-39.4	173.4	0	0	0	0	0	111.6	V170 P199 H201 G207 N208 A211 I212 L215	V170-A203 HydrophobicContact CB-CB 4.13Å; V170-A203 HydrophobicContact CG2-CB 4.46Å; P199-A203 WeakPolarHBondContact O-CB 3.49Å; P199-A203 PolarHBondContact O-N 3.41Å; H201-A203 PolarHBondContact O-N 2.77Å; A203-G207 PolarHBondContact O-N 3.21Å; A203-N208 PolarHBondContact O-N 3.31Å; A203-A211 HydrophobicContact CB-CB 3.73Å; A203-I212 HydrophobicContact CB-CG1 3.66Å; A203-L215 HydrophobicContact CB-CD1 4.45Å
204	S	96.5	Very high	95.2	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-77.3	-22.8	176.5	-53.4	0	0	0	0	114	I200 H201 R202 P232 A236 T241	I200-S204 VanDerWaalsContact O-CB 3.26Å; I200-S204 WeakPolarHBondContact O-CB 3.37Å; I200-S204 PolarHBondContact O-N 2.73Å; I200-S204 PolarHBondContact O-OG 3.38Å; H201-S204 CarbonylContact O-C 3.58Å; H201-S204 WeakPolarHBondContact O-CA 3.15Å; H201-S204 PolarHBondContact O-N 2.85Å; H201-S204 VanDerWaalsContact O-N 3.12Å; R202-S204 VanDerWaalsContact C-N 3.27Å; R202-S204 PolarHBondContact O-N 2.7Å; S204-P232 WeakPolarHBondContact CB-O 3.35Å; S204-P232 WeakPolarHBondContact OG-CB 3.48Å; S204-A236 WeakPolarHBondContact O-CA 3.47Å; S204-T241 VanDerWaalsContact O-CG2 3.23Å; S204-T241 WeakPolarHBondContact O-CG2 3.41Å
205	E	95	Very high	95.4	Very high	38 Å²	38	24.3 Å²	24.3	18%	0.178	11%	0.113	C	C	.	.	H	α-helix	trans	-70.2	-41.2	170.4	-179.5	-163.4	137.8	0	0	110.6	H201 R202 N239	H201-E205 WeakPolarHBondContact O-CB 3.43Å; H201-E205 PolarHBondContact O-N 2.87Å; R202-E205 WeakPolarHBondContact CD-OE2 2.94Å; R202-E205 IonicContact CZ-OE2 2.74Å; R202-E205 IonicContact NE-OE2 3.17Å; R202-E205 IonicContact NH1-OE2 2.82Å; R202-E205 PolarHBondContact NH1-OE2 3.32Å; R202-E205 WeakPolarHBondContact O-CB 3.33Å; R202-E205 PolarHBondContact O-N 2.8Å; E205-N239 WeakPolarHBondContact CA-ND2 3.48Å; E205-N239 WeakPolarHBondContact CG-ND2 3.39Å; E205-N239 PolarHBondContact O-ND2 3.08Å
206	K	94.4	Very high	95.5	Very high	109 Å²	109	22.7 Å²	22.7	47%	0.474	10%	0.104	S	C	.	.	H	α-helix	trans	-88.6	-10.7	-179.3	-56	-46.5	-174.2	-162.9	0	114.2	Q171 R202 N208	Q171-K206 HydrophobicContact CG-CG 3.98Å; R202-K206 PolarHBondContact O-N 3.25Å; R202-K206 VanDerWaalsContact O-N 3.09Å; K206-N208 VanDerWaalsContact C-N 3.33Å
207	G	94.5	Very high	95.5	Very high	9 Å²	9	25.4 Å²	25.4	9%	0.093	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.1	26.2	-175.6	0	0	0	0	0	114.3	A203 Y209 T241 C245	A203-G207 PolarHBondContact O-N 3.21Å; G207-Y209 PolarHBondContact O-N 2.92Å; G207-Y209 VanDerWaalsContact O-N 3.07Å; G207-T241 VanDerWaalsContact CA-CG2 3.46Å; G207-C245 PolarHBondContact O-SG 2.76Å
208	N	95.7	Very high	95.4	Very high	29 Å²	29	25.7 Å²	25.7	16%	0.155	12%	0.12	C	C	.	.			trans	-79.9	90.6	-179.4	-172.2	-18.1	0	0	0	110.5	V170 L172 A203 K206 E210 A211 I212	V170-N208 PolarHBondContact O-ND2 3.32Å; L172-N208 PolarHBondContact O-ND2 3.16Å; A203-N208 PolarHBondContact O-N 3.31Å; K206-N208 VanDerWaalsContact C-N 3.33Å; N208-E210 VanDerWaalsContact C-N 3.29Å; N208-E210 PolarHBondContact O-N 2.97Å; N208-E210 PolarHBondContact OD1-N 3.15Å; N208-A211 HydrophobicContact CB-CB 3.91Å; N208-A211 PolarHBondContact O-N 3.41Å; N208-A211 PolarHBondContact OD1-N 3.43Å; N208-A211 VanDerWaalsContact OD1-N 3.09Å; N208-I212 WeakPolarHBondContact O-CG1 3.23Å; N208-I212 PolarHBondContact O-N 3.07Å
209	Y	95.9	Very high	95.1	Very high	81 Å²	81	26.8 Å²	26.8	32%	0.318	13%	0.13	S	C	.	.	H	α-helix	trans	-56.1	-39.5	179.5	179.4	-92.7	0	0	0	113.1	G207 I212 K213 L244 R248	G207-Y209 PolarHBondContact O-N 2.92Å; G207-Y209 VanDerWaalsContact O-N 3.07Å; Y209-I212 PolarHBondContact O-N 2.75Å; Y209-K213 HydrophobicContact CE1-CB 4.4Å; Y209-K213 HydrophobicContact CE1-CD 4.27Å; Y209-K213 VanDerWaalsContact O-CB 3.31Å; Y209-K213 WeakPolarHBondContact O-CB 3.42Å; Y209-K213 PolarHBondContact O-N 3.2Å; Y209-L244 HydrophobicContact CD2-CB 3.73Å; Y209-L244 HydrophobicContact CE2-CB 3.73Å; Y209-L244 HydrophobicContact CE2-CD2 4.43Å; Y209-L244 WeakPolarHBondContact CE2-O 3.38Å; Y209-R248 HydrophobicContact CE2-CB 3.93Å; Y209-R248 HydrophobicContact CE2-CG 4.38Å
210	E	96.2	Very high	94.9	Very high	76 Å²	76	26.9 Å²	26.9	36%	0.355	13%	0.131	S	C	.	.	H	α-helix	trans	-66	-43.3	178.9	-172.8	175.2	-143.6	0	0	110.9	P175 N208 I212 K213 V214	P175-E210 VanDerWaalsContact CD-OE2 3.3Å; P175-E210 WeakPolarHBondContact CD-OE2 3.47Å; P175-E210 HydrophobicContact CG-CB 3.97Å; P175-E210 HydrophobicContact CG-CG 4.02Å; N208-E210 VanDerWaalsContact C-N 3.29Å; N208-E210 PolarHBondContact O-N 2.97Å; N208-E210 PolarHBondContact OD1-N 3.15Å; E210-I212 PolarHBondContact O-N 2.79Å; E210-K213 PolarHBondContact O-N 3.1Å; E210-V214 HydrophobicContact CG-CG2 4.22Å; E210-V214 WeakPolarHBondContact O-CB 3.39Å; E210-V214 VanDerWaalsContact O-CG2 3.26Å; E210-V214 WeakPolarHBondContact O-CG2 3.22Å; E210-V214 PolarHBondContact O-N 3.23Å
211	A	97	Very high	94.6	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61.7	-43.8	175	0	0	0	0	0	112.2	V170 P175 A203 N208 L215	V170-A211 HydrophobicContact CB-CB 3.75Å; V170-A211 HydrophobicContact CG1-CB 3.93Å; P175-A211 HydrophobicContact CB-CB 3.97Å; P175-A211 HydrophobicContact CG-CB 3.8Å; A203-A211 HydrophobicContact CB-CB 3.73Å; N208-A211 HydrophobicContact CB-CB 3.91Å; N208-A211 PolarHBondContact O-N 3.41Å; N208-A211 PolarHBondContact OD1-N 3.43Å; N208-A211 VanDerWaalsContact OD1-N 3.09Å; A211-L215 WeakPolarHBondContact O-CB 3.48Å; A211-L215 VanDerWaalsContact O-CG 3.24Å; A211-L215 WeakPolarHBondContact O-CG 3.37Å; A211-L215 PolarHBondContact O-N 2.95Å
212	I	96.8	Very high	94.4	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-60.7	-49.9	176.6	-66.6	170.1	0	0	0	110	A203 N208 Y209 E210 L215 L216 C245 R248 L249	A203-I212 HydrophobicContact CB-CG1 3.66Å; N208-I212 WeakPolarHBondContact O-CG1 3.23Å; N208-I212 PolarHBondContact O-N 3.07Å; Y209-I212 PolarHBondContact O-N 2.75Å; E210-I212 PolarHBondContact O-N 2.79Å; I212-L215 PolarHBondContact O-N 3.2Å; I212-L216 HydrophobicContact CG2-CD1 3.55Å; I212-L216 HydrophobicContact CG2-CG 4.43Å; I212-L216 WeakPolarHBondContact O-CB 3.41Å; I212-L216 WeakPolarHBondContact O-CD1 3.47Å; I212-L216 VanDerWaalsContact O-CG 3.24Å; I212-L216 WeakPolarHBondContact O-CG 3.24Å; I212-L216 PolarHBondContact O-N 2.94Å; I212-C245 HydrophobicContact CD1-CB 3.67Å; I212-R248 HydrophobicContact CG2-CG 4.5Å; I212-L249 HydrophobicContact CG2-CD2 4.13Å; I212-L249 HydrophobicContact CG2-CG 4.22Å
213	K	95.2	Very high	94.1	Very high	90 Å²	90	28.1 Å²	28.1	39%	0.391	14%	0.14	S	C	.	.	H	α-helix	trans	-56.8	-52.8	177.3	176	176.4	177	-171.4	0	111.4	Y209 E210 L215 L216 D217	Y209-K213 HydrophobicContact CE1-CB 4.4Å; Y209-K213 HydrophobicContact CE1-CD 4.27Å; Y209-K213 VanDerWaalsContact O-CB 3.31Å; Y209-K213 WeakPolarHBondContact O-CB 3.42Å; Y209-K213 PolarHBondContact O-N 3.2Å; E210-K213 PolarHBondContact O-N 3.1Å; K213-L215 PolarHBondContact O-N 2.82Å; K213-L216 PolarHBondContact O-N 2.81Å; K213-D217 WeakPolarHBondContact CE-OD2 3.31Å; K213-D217 WeakPolarHBondContact CG-OD2 3.34Å; K213-D217 WeakPolarHBondContact O-CB 3.18Å; K213-D217 PolarHBondContact O-N 3.1Å
214	V	96	Very high	93.8	Very high	7 Å²	7	29 Å²	29	4%	0.042	15%	0.145	C	C	.	.	H	α-helix	trans	-62.3	-41.6	-177.5	172.3	0	0	0	0	111.7	Y176 V179 M180 E210 L218	Y176-V214 HydrophobicContact CD2-CG2 3.44Å; Y176-V214 VanDerWaalsContact CD2-CG2 3.44Å; Y176-V214 HydrophobicContact CE2-CG2 4.1Å; Y176-V214 HydrophobicContact CG-CG2 4.28Å; V179-V214 HydrophobicContact CB-CG1 4.23Å; V179-V214 HydrophobicContact CG1-CG1 3.69Å; M180-V214 HydrophobicContact CE-CG1 4.39Å; E210-V214 HydrophobicContact CG-CG2 4.22Å; E210-V214 WeakPolarHBondContact O-CB 3.39Å; E210-V214 VanDerWaalsContact O-CG2 3.26Å; E210-V214 WeakPolarHBondContact O-CG2 3.22Å; E210-V214 PolarHBondContact O-N 3.23Å; V214-L218 HydrophobicContact CG1-CD1 3.88Å; V214-L218 HydrophobicContact CG1-CG 4.42Å; V214-L218 VanDerWaalsContact O-CB 3.24Å; V214-L218 WeakPolarHBondContact O-CB 3.43Å; V214-L218 WeakPolarHBondContact O-CG 3.22Å; V214-L218 PolarHBondContact O-N 2.82Å
215	L	95.8	Very high	93.4	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.6	-42.9	175.8	-71.7	173.9	0	0	0	112	V170 V179 L189 P199 I200 A203 A211 I212 K213 L218 G219 Q220	V170-L215 HydrophobicContact CG1-CD1 3.97Å; V179-L215 HydrophobicContact CG1-CD2 4.27Å; L189-L215 HydrophobicContact CD2-CD2 4.01Å; P199-L215 HydrophobicContact CB-CD1 3.83Å; P199-L215 HydrophobicContact CB-CD2 4.22Å; I200-L215 HydrophobicContact CB-CD1 3.88Å; A203-L215 HydrophobicContact CB-CD1 4.45Å; A211-L215 WeakPolarHBondContact O-CB 3.48Å; A211-L215 VanDerWaalsContact O-CG 3.24Å; A211-L215 WeakPolarHBondContact O-CG 3.37Å; A211-L215 PolarHBondContact O-N 2.95Å; I212-L215 PolarHBondContact O-N 3.2Å; K213-L215 PolarHBondContact O-N 2.82Å; L215-L218 CarbonylContact O-C 3.57Å; L215-L218 PolarHBondContact O-N 2.71Å; L215-G219 PolarHBondContact O-N 3.24Å; L215-Q220 HydrophobicContact CB-CB 4.02Å; L215-Q220 HydrophobicContact CB-CG 4.38Å; L215-Q220 WeakPolarHBondContact O-CB 3.45Å; L215-Q220 PolarHBondContact O-N 2.88Å
216	L	94.1	Very high	93.2	Very high	5 Å²	5	33.1 Å²	33.1	3%	0.026	16%	0.16	C	C	.	.	H	α-helix	trans	-71.1	-37.1	179.2	-67.7	167.5	0	0	0	112.3	I200 I212 K213 L218 G219 P222 R248 L249 D252 R370	I200-L216 HydrophobicContact CD1-CD1 4.28Å; I200-L216 HydrophobicContact CD1-CD2 3.6Å; I200-L216 HydrophobicContact CD1-CG 3.8Å; I212-L216 HydrophobicContact CG2-CD1 3.55Å; I212-L216 HydrophobicContact CG2-CG 4.43Å; I212-L216 WeakPolarHBondContact O-CB 3.41Å; I212-L216 WeakPolarHBondContact O-CD1 3.47Å; I212-L216 VanDerWaalsContact O-CG 3.24Å; I212-L216 WeakPolarHBondContact O-CG 3.24Å; I212-L216 PolarHBondContact O-N 2.94Å; K213-L216 PolarHBondContact O-N 2.81Å; L216-L218 VanDerWaalsContact C-N 3.32Å; L216-G219 WeakPolarHBondContact O-CA 3.45Å; L216-G219 PolarHBondContact O-N 2.97Å; L216-P222 HydrophobicContact CD2-CB 4.16Å; L216-P222 HydrophobicContact CD2-CG 4.31Å; L216-R248 HydrophobicContact CD1-CG 4Å; L216-L249 HydrophobicContact CD1-CD2 4.3Å; L216-D252 WeakPolarHBondContact CB-OD2 3.38Å; L216-D252 HydrophobicContact CD1-CB 4.33Å; L216-D252 WeakPolarHBondContact CD1-OD2 3.46Å; L216-D252 HydrophobicContact CD2-CB 4.27Å; L216-R370 PolarHBondContact O-NH2 2.86Å
217	D	92.8	Very high	92.9	Very high	67 Å²	67	34.4 Å²	34.4	36%	0.358	17%	0.166	S	C	.	.	H	α-helix	trans	-70.4	-29.9	174.8	-66.4	-13.3	0	0	0	111	K213 G219 R248 M438	K213-D217 WeakPolarHBondContact CE-OD2 3.31Å; K213-D217 WeakPolarHBondContact CG-OD2 3.34Å; K213-D217 WeakPolarHBondContact O-CB 3.18Å; K213-D217 PolarHBondContact O-N 3.1Å; D217-G219 PolarHBondContact O-N 3.14Å; D217-R248 IonicContact OD1-CZ 3.24Å; D217-R248 IonicContact OD1-NH1 2.72Å; D217-R248 PolarHBondContact OD1-NH1 3.46Å; D217-R248 IonicContact OD1-NH2 2.66Å; D217-R248 PolarHBondContact OD1-NH2 3.04Å; D217-M438 HydrophobicContact CB-CE 4.1Å; D217-M438 WeakPolarHBondContact O-CE 3.4Å
218	L	91.9	Very high	92.6	Very high	8 Å²	8	35.7 Å²	35.7	4%	0.042	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-0.7	165.6	-73.2	172.4	0	0	0	113.9	V179 M180 V183 L189 V214 L215 L216 Y433 L435	V179-L218 HydrophobicContact CG1-CD1 3.89Å; M180-L218 HydrophobicContact CE-CD2 4.08Å; M180-L218 HydrophobicContact CE-CG 4.32Å; M180-L218 HydrophobicContact SD-CD1 4.13Å; M180-L218 HydrophobicContact SD-CD2 3.88Å; M180-L218 HydrophobicContact SD-CG 4.36Å; V183-L218 HydrophobicContact CB-CD1 4.48Å; V183-L218 HydrophobicContact CG1-CD1 4.44Å; V183-L218 HydrophobicContact CG2-CD1 4.22Å; L189-L218 HydrophobicContact CD1-CB 4.04Å; L189-L218 WeakPolarHBondContact CD1-O 3.38Å; L189-L218 HydrophobicContact CD2-CB 4.48Å; L189-L218 HydrophobicContact CD2-CD1 4.43Å; V214-L218 HydrophobicContact CG1-CD1 3.88Å; V214-L218 HydrophobicContact CG1-CG 4.42Å; V214-L218 VanDerWaalsContact O-CB 3.24Å; V214-L218 WeakPolarHBondContact O-CB 3.43Å; V214-L218 WeakPolarHBondContact O-CG 3.22Å; V214-L218 PolarHBondContact O-N 2.82Å; L215-L218 CarbonylContact O-C 3.57Å; L215-L218 PolarHBondContact O-N 2.71Å; L216-L218 VanDerWaalsContact C-N 3.32Å; L218-Y433 WeakPolarHBondContact O-CD1 3.38Å; L218-L435 HydrophobicContact CD2-CD2 3.7Å
219	G	88.6	Confident	92.3	Very high	22 Å²	22	38.5 Å²	38.5	23%	0.227	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.6	11.8	172.6	0	0	0	0	0	116.4	L215 L216 D217 S221 Y433	L215-G219 PolarHBondContact O-N 3.24Å; L216-G219 WeakPolarHBondContact O-CA 3.45Å; L216-G219 PolarHBondContact O-N 2.97Å; D217-G219 PolarHBondContact O-N 3.14Å; G219-S221 PolarHBondContact O-N 3.41Å; G219-Y433 VanDerWaalsContact C-CE1 3.4Å; G219-Y433 VanDerWaalsContact CA-CE1 3.46Å; G219-Y433 WeakPolarHBondContact O-CE1 3.42Å; G219-Y433 VanDerWaalsContact O-CZ 3.26Å; G219-Y433 PolarHBondContact O-OH 3.2Å
220	Q	91.8	Very high	92.2	Very high	3 Å²	3	35.3 Å²	35.3	1%	0.014	18%	0.179	C	C	.	.			trans	-53.1	138.8	168.9	177.8	68.2	-30	0	0	110.4	L189 I200 L215 R370	L189-Q220 HydrophobicContact CB-CB 4.3Å; L189-Q220 HydrophobicContact CD1-CB 4.08Å; L189-Q220 PolarHBondContact O-NE2 3.09Å; L189-Q220 PolarHBondContact O-OE1 2.88Å; I200-Q220 HydrophobicContact CB-CG 4.08Å; I200-Q220 HydrophobicContact CD1-CG 4.27Å; I200-Q220 HydrophobicContact CG2-CG 3.81Å; L215-Q220 HydrophobicContact CB-CB 4.02Å; L215-Q220 HydrophobicContact CB-CG 4.38Å; L215-Q220 WeakPolarHBondContact O-CB 3.45Å; L215-Q220 PolarHBondContact O-N 2.88Å; Q220-R370 PolarHBondContact O-NH1 3.17Å; Q220-R370 PolarHBondContact O-NH2 2.95Å
221	S	90	Very high	92.1	Very high	5 Å²	5	31.7 Å²	31.7	4%	0.035	16%	0.162	C	C	.	.			trans	-71.1	138.6	175.4	-164.5	0	0	0	0	110.9	D86 G219 N223	D86-S221 WeakPolarHBondContact OD2-CB 3.41Å; D86-S221 PolarHBondContact OD2-OG 3.4Å; G219-S221 PolarHBondContact O-N 3.41Å; S221-N223 PolarHBondContact O-N 2.91Å; S221-N223 PolarHBondContact OG-N 3.21Å
222	P	91.6	Very high	92	Very high	4 Å²	4	31.7 Å²	31.7	3%	0.026	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-13.3	172	15.6	3.4	0	0	0	110.7	L216 P232 L249 D252	L216-P222 HydrophobicContact CD2-CB 4.16Å; L216-P222 HydrophobicContact CD2-CG 4.31Å; P222-P232 WeakPolarHBondContact O-CD 3.31Å; P222-L249 HydrophobicContact CB-CD2 4.48Å; P222-D252 HydrophobicContact CG-CB 4.36Å; P222-D252 WeakPolarHBondContact CG-O 3.44Å
223	N	89.2	Confident	92	Very high	37 Å²	37	31.7 Å²	31.7	20%	0.198	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	3.8	-165.5	-55	-4.3	0	0	0	111.4	S221 R225 H253 P255	S221-N223 PolarHBondContact O-N 2.91Å; S221-N223 PolarHBondContact OG-N 3.21Å; N223-R225 PolarHBondContact O-N 3.24Å; N223-H253 PolarHBondContact OD1-O 2.74Å; N223-P255 WeakPolarHBondContact OD1-CD 3.34Å
224	T	89.9	Confident	92.1	Very high	19 Å²	19	27.8 Å²	27.8	12%	0.117	15%	0.145	C	C	.	.			trans	-57.4	127.1	173.1	61.4	0	0	0	0	108.6	T198 H201 P232	T198-T224 HydrophobicContact CG2-CG2 4.32Å; T198-T224 PolarHBondContact OG1-OG1 3.1Å; H201-T224 PolarHBondContact CE1-O 2.81Å; H201-T224 PolarHBondContact CE1-OG1 2.81Å; H201-T224 VanDerWaalsContact CE1-OG1 3.32Å; H201-T224 PolarHBondContact NE2-O 2.91Å; T224-P232 WeakPolarHBondContact O-CD 3.35Å
225	R	89.9	Confident	92.1	Very high	108 Å²	108	28.5 Å²	28.5	41%	0.408	15%	0.147	S	C	.	.			trans	-101.4	153.3	172.3	-63.7	-178.6	-177.3	175.2	-2.3	112	R192 N223 D229 L230 T231	R192-R225 PolarHBondContact NH1-O 2.99Å; R192-R225 PolarHBondContact NH2-O 3.04Å; N223-R225 PolarHBondContact O-N 3.24Å; R225-D229 VanDerWaalsContact CD-O 3.29Å; R225-D229 WeakPolarHBondContact CD-O 3.49Å; R225-D229 WeakPolarHBondContact CD-OD1 3.19Å; R225-D229 WeakPolarHBondContact CG-O 3.26Å; R225-D229 IonicContact CZ-OD1 3.76Å; R225-D229 IonicContact NE-OD1 3.72Å; R225-D229 IonicContact NH1-OD1 3.18Å; R225-D229 PolarHBondContact NH1-OD1 3.33Å; R225-L230 CarbonylContact C-O 3.41Å; R225-L230 WeakPolarHBondContact CA-O 3.36Å; R225-T231 HydrophobicContact CG-CG2 4.28Å
226	D	90.8	Very high	92.1	Very high	16 Å²	16	28.5 Å²	28.5	9%	0.086	15%	0.147	C	C	.	.			trans	-85.6	-168.2	169.8	78.9	-4.2	0	0	0	112.4	A228 D229 L230 Y235	D226-A228 VanDerWaalsContact C-N 3.26Å; D226-A228 PolarHBondContact O-N 2.81Å; D226-A228 WeakPolarHBondContact OD1-CA 3.12Å; D226-A228 WeakPolarHBondContact OD1-CB 3.42Å; D226-A228 PolarHBondContact OD1-N 2.8Å; D226-D229 PolarHBondContact O-N 3.47Å; D226-D229 PolarHBondContact OD1-N 2.72Å; D226-L230 PolarHBondContact N-O 3.42Å; D226-L230 PolarHBondContact OD1-N 3.23Å; D226-Y235 PolarHBondContact OD2-OH 3.32Å; D226-Y235 VanDerWaalsContact OD2-OH 3.12Å
227	K	88	Confident	92.2	Very high	137 Å²	137	28.3 Å²	28.3	60%	0.596	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-19.1	177.7	-178.6	-177.3	172.7	-165.1	0	113.5	S196 D229 C754	S196-K227 WeakPolarHBondContact OG-CB 3.1Å; S196-K227 PolarHBondContact OG-N 3.22Å; K227-D229 VanDerWaalsContact C-N 3.33Å; K227-C754 PolarHBondContact NZ-SG 2.73Å
228	A	88.7	Confident	92.2	Very high	36 Å²	36	27.4 Å²	27.4	30%	0.298	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	14.8	174.9	0	0	0	0	0	112.1	D226 L230	D226-A228 VanDerWaalsContact C-N 3.26Å; D226-A228 PolarHBondContact O-N 2.81Å; D226-A228 WeakPolarHBondContact OD1-CA 3.12Å; D226-A228 WeakPolarHBondContact OD1-CB 3.42Å; D226-A228 PolarHBondContact OD1-N 2.8Å; A228-L230 HydrophobicContact CB-CD1 4.12Å; A228-L230 HydrophobicContact CB-CG 3.95Å; A228-L230 PolarHBondContact O-N 2.76Å; A228-L230 VanDerWaalsContact O-N 3.15Å
229	D	89	Confident	92.3	Very high	87 Å²	87	30.3 Å²	30.3	47%	0.465	16%	0.156	S	C	.	.	S	Bend	trans	59.9	12	-173.2	-92.4	-69.7	0	0	0	114.7	R225 D226 K227 I258	R225-D229 VanDerWaalsContact CD-O 3.29Å; R225-D229 WeakPolarHBondContact CD-O 3.49Å; R225-D229 WeakPolarHBondContact CD-OD1 3.19Å; R225-D229 WeakPolarHBondContact CG-O 3.26Å; R225-D229 IonicContact CZ-OD1 3.76Å; R225-D229 IonicContact NE-OD1 3.72Å; R225-D229 IonicContact NH1-OD1 3.18Å; R225-D229 PolarHBondContact NH1-OD1 3.33Å; D226-D229 PolarHBondContact O-N 3.47Å; D226-D229 PolarHBondContact OD1-N 2.72Å; K227-D229 VanDerWaalsContact C-N 3.33Å; D229-I258 VanDerWaalsContact O-CG2 3.32Å; D229-I258 WeakPolarHBondContact O-CG2 3.33Å
230	L	93.6	Very high	92.5	Very high	15 Å²	15	34 Å²	34	8%	0.079	17%	0.171	C	C	.	.			trans	-78.5	154.8	-178.2	-58.9	179.8	0	0	0	112	H201 R225 D226 A228 Y234 Y235 D260	H201-L230 PolarHBondContact NE2-O 2.89Å; R225-L230 CarbonylContact C-O 3.41Å; R225-L230 WeakPolarHBondContact CA-O 3.36Å; D226-L230 PolarHBondContact N-O 3.42Å; D226-L230 PolarHBondContact OD1-N 3.23Å; A228-L230 HydrophobicContact CB-CD1 4.12Å; A228-L230 HydrophobicContact CB-CG 3.95Å; A228-L230 PolarHBondContact O-N 2.76Å; A228-L230 VanDerWaalsContact O-N 3.15Å; L230-Y234 HydrophobicContact CB-CD1 4.31Å; L230-Y234 HydrophobicContact CD1-CD1 3.9Å; L230-Y234 HydrophobicContact CD1-CE1 3.84Å; L230-Y234 HydrophobicContact CD2-CD1 3.85Å; L230-Y234 HydrophobicContact CD2-CD2 4.18Å; L230-Y234 HydrophobicContact CD2-CE1 3.86Å; L230-Y234 HydrophobicContact CD2-CE2 4.22Å; L230-Y234 HydrophobicContact CD2-CG 4.02Å; L230-Y234 HydrophobicContact CG-CD1 4.25Å; L230-Y234 HydrophobicContact CG-CE1 4.42Å; L230-Y235 HydrophobicContact CB-CE2 3.87Å; L230-Y235 HydrophobicContact CD1-CE2 4.09Å; L230-D260 HydrophobicContact CD2-CB 3.85Å
231	T	94.2	Very high	92.6	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.174	C	C	.	.			trans	-109.3	163	-177.4	59.7	0	0	0	0	112.9	R225 L233 Y234 Y235 P255 I258	R225-T231 HydrophobicContact CG-CG2 4.28Å; T231-L233 PolarHBondContact O-N 2.64Å; T231-Y234 WeakPolarHBondContact O-CB 3.34Å; T231-Y234 PolarHBondContact O-N 2.84Å; T231-Y234 PolarHBondContact OG1-N 2.86Å; T231-Y235 WeakPolarHBondContact O-CD2 3.3Å; T231-Y235 PolarHBondContact O-N 3.03Å; T231-P255 HydrophobicContact CG2-CG 4.13Å; T231-I258 HydrophobicContact CG2-CB 4.37Å; T231-I258 HydrophobicContact CG2-CG1 3.88Å; T231-I258 HydrophobicContact CG2-CG2 4.31Å
232	P	95.4	Very high	92.8	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-57.4	-34.8	172.1	-23.6	33.9	0	0	0	112.8	I200 S204 P222 T224 Y235 A236 L249	I200-P232 HydrophobicContact CB-CG 4.44Å; I200-P232 HydrophobicContact CG1-CB 4.09Å; I200-P232 HydrophobicContact CG1-CG 4.2Å; I200-P232 HydrophobicContact CG2-CB 4.47Å; I200-P232 HydrophobicContact CG2-CG 3.72Å; S204-P232 WeakPolarHBondContact CB-O 3.35Å; S204-P232 WeakPolarHBondContact OG-CB 3.48Å; P222-P232 WeakPolarHBondContact O-CD 3.31Å; T224-P232 WeakPolarHBondContact O-CD 3.35Å; P232-Y235 PolarHBondContact O-N 2.8Å; P232-A236 PolarHBondContact O-N 3.08Å; P232-L249 HydrophobicContact CB-CD1 4.4Å; P232-L249 HydrophobicContact CB-CD2 4.22Å
233	L	96.3	Very high	92.9	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-60.6	-45.2	173.8	178.3	69.1	0	0	0	111.7	T231 Y235 A236 V237 V246 L249 L250 S254 P255 L256 E266 L282	T231-L233 PolarHBondContact O-N 2.64Å; L233-Y235 VanDerWaalsContact C-N 3.31Å; L233-Y235 PolarHBondContact O-N 2.77Å; L233-A236 PolarHBondContact O-N 2.81Å; L233-V237 HydrophobicContact CD1-CG2 4.38Å; L233-V237 WeakPolarHBondContact O-CG2 3.22Å; L233-V237 PolarHBondContact O-N 3.09Å; L233-V246 HydrophobicContact CD1-CB 4.4Å; L233-V246 HydrophobicContact CD1-CG1 3.86Å; L233-L249 HydrophobicContact CB-CD1 4.46Å; L233-L249 HydrophobicContact CD1-CB 4.27Å; L233-L250 HydrophobicContact CD1-CD1 4.19Å; L233-L250 HydrophobicContact CD1-CD2 4.28Å; L233-L250 HydrophobicContact CD1-CG 3.9Å; L233-L250 HydrophobicContact CD2-CD2 3.65Å; L233-L250 HydrophobicContact CD2-CG 4.21Å; L233-S254 WeakPolarHBondContact CB-OG 3.24Å; L233-P255 VanDerWaalsContact CD2-O 3.31Å; L233-P255 WeakPolarHBondContact CD2-O 3.43Å; L233-L256 HydrophobicContact CD2-CD2 4.05Å; L233-E266 HydrophobicContact CD2-CG 4.16Å; L233-E266 HydrophobicContact CG-CG 4.3Å; L233-L282 HydrophobicContact CD2-CD2 4.29Å
234	Y	96.2	Very high	93.2	Very high	8 Å²	8	42 Å²	42	3%	0.031	21%	0.214	C	C	.	.	H	α-helix	trans	-57.8	-44.6	176.2	-170.8	-85.9	0	0	0	111.2	L230 T231 V237 L238 D260 E266 Q269	L230-Y234 HydrophobicContact CB-CD1 4.31Å; L230-Y234 HydrophobicContact CD1-CD1 3.9Å; L230-Y234 HydrophobicContact CD1-CE1 3.84Å; L230-Y234 HydrophobicContact CD2-CD1 3.85Å; L230-Y234 HydrophobicContact CD2-CD2 4.18Å; L230-Y234 HydrophobicContact CD2-CE1 3.86Å; L230-Y234 HydrophobicContact CD2-CE2 4.22Å; L230-Y234 HydrophobicContact CD2-CG 4.02Å; L230-Y234 HydrophobicContact CG-CD1 4.25Å; L230-Y234 HydrophobicContact CG-CE1 4.42Å; T231-Y234 WeakPolarHBondContact O-CB 3.34Å; T231-Y234 PolarHBondContact O-N 2.84Å; T231-Y234 PolarHBondContact OG1-N 2.86Å; Y234-V237 CarbonylContact O-C 3.58Å; Y234-V237 PolarHBondContact O-N 2.85Å; Y234-L238 HydrophobicContact CE1-CD2 4.21Å; Y234-L238 VanDerWaalsContact O-CB 3.24Å; Y234-L238 WeakPolarHBondContact O-CB 3.49Å; Y234-L238 PolarHBondContact O-N 2.89Å; Y234-D260 HydrophobicContact CE2-CB 4.35Å; Y234-D260 WeakPolarHBondContact OH-CB 3.36Å; Y234-D260 PolarHBondContact OH-OD2 2.74Å; Y234-E266 HydrophobicContact CD2-CG 4.16Å; Y234-Q269 HydrophobicContact CE2-CG 3.95Å; Y234-Q269 WeakPolarHBondContact OH-CG 3.4Å; Y234-Q269 PolarHBondContact OH-NE2 3.25Å
235	Y	95.6	Very high	93.4	Very high	22 Å²	22	41.1 Å²	41.1	9%	0.086	21%	0.208	C	C	.	.	H	α-helix	trans	-66.6	-39.6	175.9	-80	-78.8	0	0	0	113.8	M197 H201 D226 L230 T231 P232 L233 V237 L238 N239	M197-Y235 HydrophobicContact CE-CD1 4.24Å; M197-Y235 HydrophobicContact CE-CE1 3.58Å; M197-Y235 HydrophobicContact CE-CE2 4.23Å; H201-Y235 AromaticContact CD2-CD2 3.75Å; H201-Y235 AromaticContact CD2-CE2 3.97Å; D226-Y235 PolarHBondContact OD2-OH 3.32Å; D226-Y235 VanDerWaalsContact OD2-OH 3.12Å; L230-Y235 HydrophobicContact CB-CE2 3.87Å; L230-Y235 HydrophobicContact CD1-CE2 4.09Å; T231-Y235 WeakPolarHBondContact O-CD2 3.3Å; T231-Y235 PolarHBondContact O-N 3.03Å; P232-Y235 PolarHBondContact O-N 2.8Å; L233-Y235 VanDerWaalsContact C-N 3.31Å; L233-Y235 PolarHBondContact O-N 2.77Å; Y235-V237 VanDerWaalsContact C-N 3.27Å; Y235-V237 PolarHBondContact O-N 3.24Å; Y235-L238 HydrophobicContact CD1-CD2 4.31Å; Y235-L238 HydrophobicContact CE1-CD2 4.33Å; Y235-L238 PolarHBondContact O-N 2.98Å; Y235-L238 VanDerWaalsContact O-N 3.15Å; Y235-N239 PolarHBondContact O-N 3.45Å
236	A	96.1	Very high	93.7	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-59.1	-40.1	174.3	0	0	0	0	0	112	S204 P232 L233 T241 V246 L249	S204-A236 WeakPolarHBondContact O-CA 3.47Å; P232-A236 PolarHBondContact O-N 3.08Å; L233-A236 PolarHBondContact O-N 2.81Å; A236-T241 WeakPolarHBondContact CA-OG1 3.32Å; A236-T241 WeakPolarHBondContact CB-OG1 3.3Å; A236-T241 PolarHBondContact O-N 3.07Å; A236-T241 PolarHBondContact O-OG1 2.94Å; A236-V246 HydrophobicContact CB-CG2 3.77Å; A236-L249 HydrophobicContact CB-CD1 4.08Å
237	V	95.9	Very high	93.9	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.006	20%	0.204	C	C	.	.	H	α-helix	trans	-80.1	-21.1	177.4	177.6	0	0	0	0	112.4	L233 Y234 Y235 V246 E266 A270 R275 H278 L282	L233-V237 HydrophobicContact CD1-CG2 4.38Å; L233-V237 WeakPolarHBondContact O-CG2 3.22Å; L233-V237 PolarHBondContact O-N 3.09Å; Y234-V237 CarbonylContact O-C 3.58Å; Y234-V237 PolarHBondContact O-N 2.85Å; Y235-V237 VanDerWaalsContact C-N 3.27Å; Y235-V237 PolarHBondContact O-N 3.24Å; V237-V246 HydrophobicContact CG2-CG1 4.17Å; V237-V246 HydrophobicContact CG2-CG2 3.77Å; V237-E266 WeakPolarHBondContact CG1-O 3.29Å; V237-A270 HydrophobicContact CG1-CB 3.89Å; V237-R275 PolarHBondContact O-NH1 3.29Å; V237-H278 HydrophobicContact CG2-CB 4.41Å; V237-L282 HydrophobicContact CG1-CD1 4.27Å; V237-L282 HydrophobicContact CG2-CD1 4.26Å
238	L	94.5	Very high	94.2	Very high	48 Å²	48	34.2 Å²	34.2	25%	0.251	18%	0.181	S	C	.	.	H	α-helix	trans	-82.1	-32.4	175.7	-175.9	62.7	0	0	0	113.4	Y234 Y235 F273 R275	Y234-L238 HydrophobicContact CE1-CD2 4.21Å; Y234-L238 VanDerWaalsContact O-CB 3.24Å; Y234-L238 WeakPolarHBondContact O-CB 3.49Å; Y234-L238 PolarHBondContact O-N 2.89Å; Y235-L238 HydrophobicContact CD1-CD2 4.31Å; Y235-L238 HydrophobicContact CE1-CD2 4.33Å; Y235-L238 PolarHBondContact O-N 2.98Å; Y235-L238 VanDerWaalsContact O-N 3.15Å; L238-F273 HydrophobicContact CD1-CE2 3.8Å; L238-F273 HydrophobicContact CD1-CZ 4.34Å; L238-R275 PolarHBondContact O-NH1 3.21Å; L238-R275 PolarHBondContact O-NH2 3.26Å
239	N	93.7	Very high	94.5	Very high	68 Å²	68	32.5 Å²	32.5	36%	0.364	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	11.8	-174.9	-73.2	12.5	0	0	0	114.7	E205 Y235 T241	E205-N239 WeakPolarHBondContact CA-ND2 3.48Å; E205-N239 WeakPolarHBondContact CG-ND2 3.39Å; E205-N239 PolarHBondContact O-ND2 3.08Å; Y235-N239 PolarHBondContact O-N 3.45Å; N239-T241 VanDerWaalsContact C-N 3.33Å; N239-T241 HydrophobicContact CB-CG2 4.1Å; N239-T241 PolarHBondContact O-N 3.45Å
240	N	92.9	Very high	94.7	Very high	99 Å²	99	28.4 Å²	28.4	53%	0.529	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	41.9	-177.8	-159.4	45.6	0	0	0	114.1	R275	N240-R275 VanDerWaalsContact OD1-CD 3.29Å; N240-R275 WeakPolarHBondContact OD1-CD 3.49Å; N240-R275 PolarHBondContact OD1-NE 3.45Å
241	T	93.8	Very high	94.7	Very high	12 Å²	12	31.1 Å²	31.1	7%	0.074	16%	0.156	C	C	.	.			trans	-71.7	167.7	-174.9	63	0	0	0	0	113.4	S204 G207 A236 N239 S243 H278	S204-T241 VanDerWaalsContact O-CG2 3.23Å; S204-T241 WeakPolarHBondContact O-CG2 3.41Å; G207-T241 VanDerWaalsContact CA-CG2 3.46Å; A236-T241 WeakPolarHBondContact CA-OG1 3.32Å; A236-T241 WeakPolarHBondContact CB-OG1 3.3Å; A236-T241 PolarHBondContact O-N 3.07Å; A236-T241 PolarHBondContact O-OG1 2.94Å; N239-T241 VanDerWaalsContact C-N 3.33Å; N239-T241 HydrophobicContact CB-CG2 4.1Å; N239-T241 PolarHBondContact O-N 3.45Å; T241-S243 PolarHBondContact O-N 3.22Å; T241-H278 PolarHBondContact O-CE1 3.14Å; T241-H278 VanDerWaalsContact O-CE1 3.24Å; T241-H278 PolarHBondContact O-NE2 3.4Å
242	I	93.6	Very high	94.5	Very high	101 Å²	101	31.1 Å²	31.1	52%	0.518	16%	0.156	S	C	.	.			trans	-54.7	127.9	177.4	-57.5	172.7	0	0	0	109.3	L244 C245	I242-L244 HydrophobicContact CG2-CB 4.34Å; I242-L244 HydrophobicContact CG2-CD1 3.81Å; I242-L244 PolarHBondContact O-N 2.6Å; I242-C245 WeakPolarHBondContact O-CB 3.3Å; I242-C245 PolarHBondContact O-N 2.95Å; I242-C245 PolarHBondContact O-SG 2.83Å
243	S	93.6	Very high	94.2	Very high	18 Å²	18	32.4 Å²	32.4	13%	0.126	16%	0.162	C	C	.	.	H	α-helix	trans	-53.4	-30.6	-173.3	-52.5	0	0	0	0	114.2	T241 C245 V246 E247 Q277	T241-S243 PolarHBondContact O-N 3.22Å; S243-C245 PolarHBondContact O-N 2.92Å; S243-V246 PolarHBondContact O-N 3.37Å; S243-E247 PolarHBondContact O-N 2.86Å; S243-Q277 PolarHBondContact OG-OE1 2.81Å
244	L	94.8	Very high	94	Very high	87 Å²	87	32.6 Å²	32.6	46%	0.455	16%	0.163	S	C	.	.	H	α-helix	trans	-61.5	-25.5	173.1	-70.2	86.9	0	0	0	113.7	Y209 I242 R248	Y209-L244 HydrophobicContact CD2-CB 3.73Å; Y209-L244 HydrophobicContact CE2-CB 3.73Å; Y209-L244 HydrophobicContact CE2-CD2 4.43Å; Y209-L244 WeakPolarHBondContact CE2-O 3.38Å; I242-L244 HydrophobicContact CG2-CB 4.34Å; I242-L244 HydrophobicContact CG2-CD1 3.81Å; I242-L244 PolarHBondContact O-N 2.6Å; L244-R248 VanDerWaalsContact O-CB 3.24Å; L244-R248 WeakPolarHBondContact O-CB 3.45Å; L244-R248 PolarHBondContact O-N 2.81Å
245	C	95.9	Very high	93.7	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-67.9	-47.3	175.2	-59.5	0	0	0	0	110.7	G207 I212 I242 S243 R248 L249	G207-C245 PolarHBondContact O-SG 2.76Å; I212-C245 HydrophobicContact CD1-CB 3.67Å; I242-C245 WeakPolarHBondContact O-CB 3.3Å; I242-C245 PolarHBondContact O-N 2.95Å; I242-C245 PolarHBondContact O-SG 2.83Å; S243-C245 PolarHBondContact O-N 2.92Å; C245-R248 PolarHBondContact O-N 3.48Å; C245-L249 WeakPolarHBondContact O-CB 3.4Å; C245-L249 WeakPolarHBondContact O-CD1 3.16Å; C245-L249 VanDerWaalsContact O-CG 3.26Å; C245-L249 WeakPolarHBondContact O-CG 3.33Å; C245-L249 PolarHBondContact O-N 2.7Å
246	V	95.8	Very high	93.5	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-62.6	-46.2	175.7	171.7	0	0	0	0	110.1	L233 A236 V237 S243 L249 L250 I281	L233-V246 HydrophobicContact CD1-CB 4.4Å; L233-V246 HydrophobicContact CD1-CG1 3.86Å; A236-V246 HydrophobicContact CB-CG2 3.77Å; V237-V246 HydrophobicContact CG2-CG1 4.17Å; V237-V246 HydrophobicContact CG2-CG2 3.77Å; S243-V246 PolarHBondContact O-N 3.37Å; V246-L249 PolarHBondContact O-N 2.83Å; V246-L250 HydrophobicContact CG1-CD1 3.84Å; V246-L250 WeakPolarHBondContact O-CD1 3.19Å; V246-L250 WeakPolarHBondContact O-CG 3.15Å; V246-L250 PolarHBondContact O-N 3.26Å; V246-L250 VanDerWaalsContact O-N 3.08Å; V246-I281 HydrophobicContact CG1-CB 4.48Å; V246-I281 HydrophobicContact CG1-CG2 4.08Å
247	E	94.6	Very high	93.2	Very high	85 Å²	85	36.3 Å²	36.3	40%	0.397	19%	0.194	S	C	.	.	H	α-helix	trans	-58.7	-49	175.5	-172	-176.4	-176.6	0	0	112.6	S243 L249 L250 F251 I281 Y285	S243-E247 PolarHBondContact O-N 2.86Å; E247-L249 PolarHBondContact O-N 2.93Å; E247-L250 PolarHBondContact O-N 3.13Å; E247-F251 VanDerWaalsContact O-CB 3.31Å; E247-F251 WeakPolarHBondContact O-CB 3.35Å; E247-F251 PolarHBondContact O-N 3.14Å; E247-I281 HydrophobicContact CB-CD1 4.47Å; E247-I281 HydrophobicContact CB-CG2 4.24Å; E247-Y285 HydrophobicContact CG-CE2 4.18Å
248	R	94.4	Very high	93	Very high	32 Å²	32	37.4 Å²	37.4	12%	0.121	20%	0.199	C	C	.	.	H	α-helix	trans	-65.6	-37.2	-178.4	-179.7	65.1	-157.4	-114.2	-5.5	112.5	Y209 I212 L216 D217 L244 C245 D252	Y209-R248 HydrophobicContact CE2-CB 3.93Å; Y209-R248 HydrophobicContact CE2-CG 4.38Å; I212-R248 HydrophobicContact CG2-CG 4.5Å; L216-R248 HydrophobicContact CD1-CG 4Å; D217-R248 IonicContact OD1-CZ 3.24Å; D217-R248 IonicContact OD1-NH1 2.72Å; D217-R248 PolarHBondContact OD1-NH1 3.46Å; D217-R248 IonicContact OD1-NH2 2.66Å; D217-R248 PolarHBondContact OD1-NH2 3.04Å; L244-R248 VanDerWaalsContact O-CB 3.24Å; L244-R248 WeakPolarHBondContact O-CB 3.45Å; L244-R248 PolarHBondContact O-N 2.81Å; C245-R248 PolarHBondContact O-N 3.48Å; R248-D252 IonicContact CZ-OD2 2.69Å; R248-D252 IonicContact NE-OD2 3.6Å; R248-D252 PolarHBondContact NE-OD2 3.19Å; R248-D252 IonicContact NH2-OD1 3.22Å; R248-D252 IonicContact NH2-OD2 2.73Å; R248-D252 PolarHBondContact NH2-OD2 2.78Å; R248-D252 PolarHBondContact O-N 2.92Å
249	L	94.9	Very high	92.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-64.5	-42.2	174.7	-72.7	166.1	0	0	0	111.6	I200 I212 L216 P222 P232 L233 A236 C245 V246 E247 D252 S254	I200-L249 HydrophobicContact CD1-CD2 3.87Å; I200-L249 HydrophobicContact CG1-CD2 4.27Å; I212-L249 HydrophobicContact CG2-CD2 4.13Å; I212-L249 HydrophobicContact CG2-CG 4.22Å; L216-L249 HydrophobicContact CD1-CD2 4.3Å; P222-L249 HydrophobicContact CB-CD2 4.48Å; P232-L249 HydrophobicContact CB-CD1 4.4Å; P232-L249 HydrophobicContact CB-CD2 4.22Å; L233-L249 HydrophobicContact CB-CD1 4.46Å; L233-L249 HydrophobicContact CD1-CB 4.27Å; A236-L249 HydrophobicContact CB-CD1 4.08Å; C245-L249 WeakPolarHBondContact O-CB 3.4Å; C245-L249 WeakPolarHBondContact O-CD1 3.16Å; C245-L249 VanDerWaalsContact O-CG 3.26Å; C245-L249 WeakPolarHBondContact O-CG 3.33Å; C245-L249 PolarHBondContact O-N 2.7Å; V246-L249 PolarHBondContact O-N 2.83Å; E247-L249 PolarHBondContact O-N 2.93Å; L249-D252 PolarHBondContact O-N 2.94Å; L249-S254 WeakPolarHBondContact O-CB 3.29Å; L249-S254 PolarHBondContact O-N 2.87Å
250	L	93.8	Very high	92.8	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-70.9	-38.5	177.7	-71.8	163.8	0	0	0	112.7	L233 V246 E247 D252 H253 L256 I281 L282 Y285	L233-L250 HydrophobicContact CD1-CD1 4.19Å; L233-L250 HydrophobicContact CD1-CD2 4.28Å; L233-L250 HydrophobicContact CD1-CG 3.9Å; L233-L250 HydrophobicContact CD2-CD2 3.65Å; L233-L250 HydrophobicContact CD2-CG 4.21Å; V246-L250 HydrophobicContact CG1-CD1 3.84Å; V246-L250 WeakPolarHBondContact O-CD1 3.19Å; V246-L250 WeakPolarHBondContact O-CG 3.15Å; V246-L250 PolarHBondContact O-N 3.26Å; V246-L250 VanDerWaalsContact O-N 3.08Å; E247-L250 PolarHBondContact O-N 3.13Å; L250-D252 VanDerWaalsContact C-N 3.33Å; L250-D252 PolarHBondContact O-N 3.05Å; L250-H253 PolarHBondContact O-N 3.5Å; L250-H253 VanDerWaalsContact O-N 3.14Å; L250-L256 HydrophobicContact CD2-CD1 4.13Å; L250-L256 HydrophobicContact CD2-CD2 3.61Å; L250-L256 HydrophobicContact CD2-CG 3.74Å; L250-I281 HydrophobicContact CD1-CG2 3.76Å; L250-L282 HydrophobicContact CD1-CD2 4.18Å; L250-Y285 HydrophobicContact CB-CD1 3.92Å; L250-Y285 HydrophobicContact CB-CD2 3.62Å; L250-Y285 HydrophobicContact CB-CE1 4.11Å; L250-Y285 HydrophobicContact CB-CE2 3.82Å; L250-Y285 HydrophobicContact CB-CG 3.67Å; L250-Y285 HydrophobicContact CD1-CD2 3.71Å; L250-Y285 HydrophobicContact CD1-CE2 4.39Å; L250-Y285 HydrophobicContact CD1-CG 4.13Å; L250-Y285 HydrophobicContact CG-CD2 4.24Å; L250-Y285 HydrophobicContact CG-CG 4.34Å
251	F	92.3	Very high	92.6	Very high	72 Å²	72	38.3 Å²	38.3	32%	0.316	20%	0.204	S	C	.	.	H	α-helix	trans	-57.1	-45.6	171.8	-178.2	-106.1	0	0	0	111.1	E247 H253 K365 R366 N367	E247-F251 VanDerWaalsContact O-CB 3.31Å; E247-F251 WeakPolarHBondContact O-CB 3.35Å; E247-F251 PolarHBondContact O-N 3.14Å; F251-H253 PolarHBondContact O-N 3.41Å; F251-H253 VanDerWaalsContact O-N 3.13Å; F251-K365 WeakPolarHBondContact CD2-O 3.25Å; F251-R366 CarbonylContact O-C 3.59Å; F251-N367 HydrophobicContact CD1-CB 3.75Å; F251-N367 HydrophobicContact CE1-CB 3.47Å; F251-N367 VanDerWaalsContact CE1-CB 3.47Å; F251-N367 HydrophobicContact CE2-CB 4.38Å; F251-N367 HydrophobicContact CG-CB 4.33Å; F251-N367 HydrophobicContact CZ-CB 3.82Å; F251-N367 WeakPolarHBondContact O-CB 3.18Å; F251-N367 PolarHBondContact O-N 3.49Å
252	D	91.2	Very high	92.2	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	19.4	177.1	-79.4	-29.9	0	0	0	115	L216 P222 R248 L249 L250 N367 R370	L216-D252 WeakPolarHBondContact CB-OD2 3.38Å; L216-D252 HydrophobicContact CD1-CB 4.33Å; L216-D252 WeakPolarHBondContact CD1-OD2 3.46Å; L216-D252 HydrophobicContact CD2-CB 4.27Å; P222-D252 HydrophobicContact CG-CB 4.36Å; P222-D252 WeakPolarHBondContact CG-O 3.44Å; R248-D252 IonicContact CZ-OD2 2.69Å; R248-D252 IonicContact NE-OD2 3.6Å; R248-D252 PolarHBondContact NE-OD2 3.19Å; R248-D252 IonicContact NH2-OD1 3.22Å; R248-D252 IonicContact NH2-OD2 2.73Å; R248-D252 PolarHBondContact NH2-OD2 2.78Å; R248-D252 PolarHBondContact O-N 2.92Å; L249-D252 PolarHBondContact O-N 2.94Å; L250-D252 VanDerWaalsContact C-N 3.33Å; L250-D252 PolarHBondContact O-N 3.05Å; D252-N367 WeakPolarHBondContact OD1-CB 3.22Å; D252-N367 PolarHBondContact OD1-ND2 2.87Å; D252-R370 WeakPolarHBondContact O-CD 3.5Å; D252-R370 IonicContact OD1-NE 2.73Å
253	H	87.9	Confident	92.1	Very high	27 Å²	27	35 Å²	35	13%	0.125	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	34.8	176.3	-47.2	-95.1	0	0	0	116.1	N223 L250 F251 R366 N367 R370 S372	N223-H253 PolarHBondContact OD1-O 2.74Å; L250-H253 PolarHBondContact O-N 3.5Å; L250-H253 VanDerWaalsContact O-N 3.14Å; F251-H253 PolarHBondContact O-N 3.41Å; F251-H253 VanDerWaalsContact O-N 3.13Å; H253-R366 WeakPolarHBondContact CE1-CB 3.34Å; H253-N367 PolarHBondContact NE2-O 3.07Å; H253-R370 PolarHBondContact NE2-O 3.23Å; H253-R370 VanDerWaalsContact NE2-O 3.15Å; H253-S372 VanDerWaalsContact CE1-CB 3.49Å; H253-S372 WeakPolarHBondContact CE1-CB 3.42Å; H253-S372 WeakPolarHBondContact ND1-CB 3.16Å
254	S	91.7	Very high	92	Very high	3 Å²	3	35.4 Å²	35.4	2%	0.021	19%	0.194	C	C	.	.			trans	-51.1	136.6	160	-179.1	0	0	0	0	109.9	L233 L249	L233-S254 WeakPolarHBondContact CB-OG 3.24Å; L249-S254 WeakPolarHBondContact O-CB 3.29Å; L249-S254 PolarHBondContact O-N 2.87Å
255	P	90.3	Very high	92	Very high	41 Å²	41	32.7 Å²	32.7	27%	0.266	18%	0.179	S	C	.	.			trans	-62.4	158.6	170.1	30.1	-37.2	0	0	0	110.6	N223 T231 L233 I258	N223-P255 WeakPolarHBondContact OD1-CD 3.34Å; T231-P255 HydrophobicContact CG2-CG 4.13Å; L233-P255 VanDerWaalsContact CD2-O 3.31Å; L233-P255 WeakPolarHBondContact CD2-O 3.43Å; P255-I258 HydrophobicContact CB-CD1 4.27Å; P255-I258 HydrophobicContact CB-CG1 4.27Å; P255-I258 HydrophobicContact CG-CD1 4.28Å; P255-I258 HydrophobicContact CG-CG1 4.03Å
256	L	91.9	Very high	92	Very high	40 Å²	40	32.8 Å²	32.8	21%	0.209	18%	0.18	C	C	.	.	S	Bend	trans	-115.9	156.9	169.1	-77.5	166	0	0	0	108.4	L233 L250 L282 A287	L233-L256 HydrophobicContact CD2-CD2 4.05Å; L250-L256 HydrophobicContact CD2-CD1 4.13Å; L250-L256 HydrophobicContact CD2-CD2 3.61Å; L250-L256 HydrophobicContact CD2-CG 3.74Å; L256-L282 HydrophobicContact CD2-CD2 3.45Å; L256-L282 VanDerWaalsContact CD2-CD2 3.45Å; L256-A287 HydrophobicContact CD1-CB 4.38Å; L256-A287 HydrophobicContact CD2-CB 4.23Å
257	G	90.1	Very high	92	Very high	28 Å²	28	32.8 Å²	32.8	29%	0.289	18%	0.18	S	C	.	.			trans	83.3	18.6	174.5	0	0	0	0	0	113.8	A259 Q265 E266	G257-A259 PolarHBondContact O-N 3.12Å; G257-Q265 VanDerWaalsContact CA-CD 3.43Å; G257-Q265 PolarHBondContact O-NE2 2.79Å; G257-E266 WeakPolarHBondContact CA-OE2 3.29Å; G257-E266 PolarHBondContact N-OE1 3.24Å; G257-E266 PolarHBondContact N-OE2 3Å
258	I	91.5	Very high	92.1	Very high	23 Å²	23	28.8 Å²	28.8	12%	0.118	16%	0.161	C	C	.	.			trans	-77.8	116.8	173.8	-55.9	-56.9	0	0	0	108.4	D229 T231 P255 Q265 E266	D229-I258 VanDerWaalsContact O-CG2 3.32Å; D229-I258 WeakPolarHBondContact O-CG2 3.33Å; T231-I258 HydrophobicContact CG2-CB 4.37Å; T231-I258 HydrophobicContact CG2-CG1 3.88Å; T231-I258 HydrophobicContact CG2-CG2 4.31Å; P255-I258 HydrophobicContact CB-CD1 4.27Å; P255-I258 HydrophobicContact CB-CG1 4.27Å; P255-I258 HydrophobicContact CG-CD1 4.28Å; P255-I258 HydrophobicContact CG-CG1 4.03Å; I258-Q265 WeakPolarHBondContact O-CA 3.5Å; I258-E266 WeakPolarHBondContact CB-OE1 3.48Å; I258-E266 PolarHBondContact N-OE1 3.39Å; I258-E266 VanDerWaalsContact N-OE1 3.1Å; I258-E266 PolarHBondContact N-OE2 3Å
259	A	91.9	Very high	92.1	Very high	37 Å²	37	27.4 Å²	27.4	31%	0.306	16%	0.156	S	C	.	.			trans	-95.7	144.5	-178.5	0	0	0	0	0	111.9	G257 L264 Q265	G257-A259 PolarHBondContact O-N 3.12Å; A259-L264 WeakPolarHBondContact CA-O 2.95Å; A259-Q265 HydrophobicContact CB-CG 3.86Å
260	D	92.2	Very high	92.2	Very high	34 Å²	34	27.4 Å²	27.4	18%	0.182	16%	0.156	C	C	.	.			trans	-77.4	-178.5	172.9	71.2	2.3	0	0	0	113.6	L230 Y234 A262 G263 L264 Q269	L230-D260 HydrophobicContact CD2-CB 3.85Å; Y234-D260 HydrophobicContact CE2-CB 4.35Å; Y234-D260 WeakPolarHBondContact OH-CB 3.36Å; Y234-D260 PolarHBondContact OH-OD2 2.74Å; D260-A262 PolarHBondContact O-N 2.91Å; D260-A262 VanDerWaalsContact OD1-CA 3.26Å; D260-A262 WeakPolarHBondContact OD1-CA 3.47Å; D260-A262 VanDerWaalsContact OD1-CB 3.29Å; D260-A262 WeakPolarHBondContact OD1-CB 3.35Å; D260-A262 PolarHBondContact OD1-N 3.4Å; D260-G263 PolarHBondContact O-N 3.19Å; D260-G263 PolarHBondContact OD1-N 3.29Å; D260-L264 PolarHBondContact N-O 3.27Å; D260-L264 WeakPolarHBondContact OD1-CB 3.2Å; D260-L264 PolarHBondContact OD1-N 2.93Å; D260-Q269 PolarHBondContact OD2-NE2 2.71Å
261	E	88.4	Confident	92.3	Very high	163 Å²	163	27.4 Å²	27.4	76%	0.762	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-16.8	173.6	-67.2	-170.8	178.3	0	0	114.1	K295	E261-K295 WeakPolarHBondContact O-CE 3.34Å; E261-K295 PolarHBondContact O-NZ 2.89Å
262	A	86.3	Confident	92.5	Very high	37 Å²	37	29.5 Å²	29.5	31%	0.306	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-7.7	175.7	0	0	0	0	0	113.5	D260 L264 K295	D260-A262 PolarHBondContact O-N 2.91Å; D260-A262 VanDerWaalsContact OD1-CA 3.26Å; D260-A262 WeakPolarHBondContact OD1-CA 3.47Å; D260-A262 VanDerWaalsContact OD1-CB 3.29Å; D260-A262 WeakPolarHBondContact OD1-CB 3.35Å; D260-A262 PolarHBondContact OD1-N 3.4Å; A262-L264 HydrophobicContact CB-CD1 4.02Å; A262-L264 HydrophobicContact CB-CG 4.22Å; A262-K295 WeakPolarHBondContact O-CG 3.33Å
263	G	89.7	Confident	92.6	Very high	6 Å²	6	33.6 Å²	33.6	6%	0.062	18%	0.18	C	C	.	.	S	Bend	trans	83	17	-173.2	0	0	0	0	0	113.4	D260 T293	D260-G263 PolarHBondContact O-N 3.19Å; D260-G263 PolarHBondContact OD1-N 3.29Å; G263-T293 WeakPolarHBondContact O-CA 3.48Å
264	L	93.2	Very high	92.9	Very high	27 Å²	27	33.3 Å²	33.3	14%	0.141	19%	0.185	C	C	.	.			trans	-92.9	120.6	178	-63.2	163.9	0	0	0	109.9	A259 D260 A262 H268 Q269 T293 I303	A259-L264 WeakPolarHBondContact CA-O 2.95Å; D260-L264 PolarHBondContact N-O 3.27Å; D260-L264 WeakPolarHBondContact OD1-CB 3.2Å; D260-L264 PolarHBondContact OD1-N 2.93Å; A262-L264 HydrophobicContact CB-CD1 4.02Å; A262-L264 HydrophobicContact CB-CG 4.22Å; L264-H268 HydrophobicContact CB-CB 4.16Å; L264-H268 HydrophobicContact CD2-CB 3.8Å; L264-Q269 VanDerWaalsContact CD1-NE2 3.32Å; L264-T293 HydrophobicContact CD2-CG2 3.6Å; L264-T293 HydrophobicContact CG-CG2 4.44Å; L264-I303 HydrophobicContact CD2-CD1 3.53Å
265	Q	95	Very high	93.1	Very high	30 Å²	30	35 Å²	35	14%	0.14	19%	0.19	C	C	.	.			trans	-86.3	176.8	173.6	-61.8	175.9	-20.3	0	0	112.7	G257 I258 A259 I267 H268 Q269	G257-Q265 VanDerWaalsContact CA-CD 3.43Å; G257-Q265 PolarHBondContact O-NE2 2.79Å; I258-Q265 WeakPolarHBondContact O-CA 3.5Å; A259-Q265 HydrophobicContact CB-CG 3.86Å; Q265-I267 VanDerWaalsContact C-N 3.3Å; Q265-I267 HydrophobicContact CB-CG2 4.35Å; Q265-I267 PolarHBondContact O-N 3.24Å; Q265-H268 PolarHBondContact N-ND1 2.95Å; Q265-H268 WeakPolarHBondContact O-CB 3.43Å; Q265-H268 PolarHBondContact O-N 3.21Å; Q265-Q269 PolarHBondContact O-N 3.36Å; Q265-Q269 VanDerWaalsContact O-N 3.07Å
266	E	95.1	Very high	93.3	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.009	19%	0.187	C	C	.	.	H	α-helix	trans	-55.2	-44.4	179.8	-49.2	86.3	165.4	0	0	111.8	L233 Y234 V237 G257 I258 H268 Q269 A270 L282	L233-E266 HydrophobicContact CD2-CG 4.16Å; L233-E266 HydrophobicContact CG-CG 4.3Å; Y234-E266 HydrophobicContact CD2-CG 4.16Å; V237-E266 WeakPolarHBondContact CG1-O 3.29Å; G257-E266 WeakPolarHBondContact CA-OE2 3.29Å; G257-E266 PolarHBondContact N-OE1 3.24Å; G257-E266 PolarHBondContact N-OE2 3Å; I258-E266 WeakPolarHBondContact CB-OE1 3.48Å; I258-E266 PolarHBondContact N-OE1 3.39Å; I258-E266 VanDerWaalsContact N-OE1 3.1Å; I258-E266 PolarHBondContact N-OE2 3Å; E266-H268 VanDerWaalsContact C-N 3.31Å; E266-H268 PolarHBondContact O-N 3.15Å; E266-Q269 PolarHBondContact O-N 2.84Å; E266-A270 WeakPolarHBondContact O-CB 3.46Å; E266-A270 PolarHBondContact O-N 3.12Å; E266-L282 HydrophobicContact CB-CD1 4.17Å; E266-L282 HydrophobicContact CB-CD2 4.01Å
267	I	96	Very high	93.4	Very high	1 Å²	1	39 Å²	39	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-62.4	-36.2	176.6	-171.8	170.2	0	0	0	112.6	Q265 C271 L279 L283 A287 V291 P300 L316	Q265-I267 VanDerWaalsContact C-N 3.3Å; Q265-I267 HydrophobicContact CB-CG2 4.35Å; Q265-I267 PolarHBondContact O-N 3.24Å; I267-C271 WeakPolarHBondContact O-CB 3.28Å; I267-C271 PolarHBondContact O-N 2.87Å; I267-C271 PolarHBondContact O-SG 3.28Å; I267-L279 HydrophobicContact CD1-CD1 4.04Å; I267-L279 HydrophobicContact CG1-CD1 3.67Å; I267-L283 HydrophobicContact CD1-CD2 3.8Å; I267-L283 HydrophobicContact CD1-CG 4.42Å; I267-A287 HydrophobicContact CD1-CB 4.3Å; I267-V291 HydrophobicContact CG2-CG1 4.04Å; I267-P300 HydrophobicContact CD1-CB 4.44Å; I267-P300 HydrophobicContact CD1-CG 4.07Å; I267-P300 HydrophobicContact CG1-CB 4.22Å; I267-P300 HydrophobicContact CG1-CG 4Å; I267-P300 HydrophobicContact CG2-CG 3.99Å; I267-L316 HydrophobicContact CD1-CD2 4.43Å
268	H	96	Very high	93.7	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-68.8	-41.1	177.8	-67.1	101.9	0	0	0	111.5	L264 Q265 E266 C271 R272 I303	L264-H268 HydrophobicContact CB-CB 4.16Å; L264-H268 HydrophobicContact CD2-CB 3.8Å; Q265-H268 PolarHBondContact N-ND1 2.95Å; Q265-H268 WeakPolarHBondContact O-CB 3.43Å; Q265-H268 PolarHBondContact O-N 3.21Å; E266-H268 VanDerWaalsContact C-N 3.31Å; E266-H268 PolarHBondContact O-N 3.15Å; H268-C271 PolarHBondContact O-N 2.95Å; H268-R272 WeakPolarHBondContact O-CB 3.39Å; H268-R272 PolarHBondContact O-N 2.97Å; H268-I303 HydrophobicContact CB-CD1 3.71Å
269	Q	95.3	Very high	93.9	Very high	4 Å²	4	36.8 Å²	36.8	2%	0.019	19%	0.188	C	C	.	.	H	α-helix	trans	-70.2	-38.9	175.5	-59.1	-63.1	-2.3	0	0	111.7	Y234 D260 L264 Q265 E266 C271 R272 F273	Y234-Q269 HydrophobicContact CE2-CG 3.95Å; Y234-Q269 WeakPolarHBondContact OH-CG 3.4Å; Y234-Q269 PolarHBondContact OH-NE2 3.25Å; D260-Q269 PolarHBondContact OD2-NE2 2.71Å; L264-Q269 VanDerWaalsContact CD1-NE2 3.32Å; Q265-Q269 PolarHBondContact O-N 3.36Å; Q265-Q269 VanDerWaalsContact O-N 3.07Å; E266-Q269 PolarHBondContact O-N 2.84Å; Q269-C271 VanDerWaalsContact C-N 3.29Å; Q269-C271 PolarHBondContact O-N 3.23Å; Q269-R272 PolarHBondContact O-N 2.7Å; Q269-R272 VanDerWaalsContact OE1-CD 3.22Å; Q269-F273 HydrophobicContact CB-CD2 4.43Å; Q269-F273 HydrophobicContact CB-CE2 4.49Å; Q269-F273 VanDerWaalsContact O-CD2 3.24Å; Q269-F273 WeakPolarHBondContact O-CD2 3.33Å; Q269-F273 PolarHBondContact O-N 3.34Å; Q269-F273 VanDerWaalsContact O-N 3.09Å
270	A	95.9	Very high	94	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-56.6	-44.9	173.4	0	0	0	0	0	111.5	V237 E266 G274 R275 H278 L279 L282	V237-A270 HydrophobicContact CG1-CB 3.89Å; E266-A270 WeakPolarHBondContact O-CB 3.46Å; E266-A270 PolarHBondContact O-N 3.12Å; A270-G274 PolarHBondContact O-N 2.82Å; A270-R275 HydrophobicContact CB-CB 4.48Å; A270-R275 PolarHBondContact O-N 3.24Å; A270-H278 HydrophobicContact CB-CB 4.46Å; A270-L279 HydrophobicContact CB-CB 4.28Å; A270-L282 HydrophobicContact CB-CD1 3.99Å
271	C	96.7	Very high	94.1	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-66.2	-44.2	175.2	-67.1	0	0	0	0	112.7	I267 H268 Q269 F273 G274 I303 Q309	I267-C271 WeakPolarHBondContact O-CB 3.28Å; I267-C271 PolarHBondContact O-N 2.87Å; I267-C271 PolarHBondContact O-SG 3.28Å; H268-C271 PolarHBondContact O-N 2.95Å; Q269-C271 VanDerWaalsContact C-N 3.29Å; Q269-C271 PolarHBondContact O-N 3.23Å; C271-F273 VanDerWaalsContact C-N 3.26Å; C271-F273 PolarHBondContact O-N 3.15Å; C271-G274 PolarHBondContact O-N 3.38Å; C271-I303 HydrophobicContact CB-CG2 4.32Å; C271-Q309 WeakPolarHBondContact O-CG 3.45Å
272	R	95.3	Very high	94.4	Very high	115 Å²	115	30 Å²	30	43%	0.434	15%	0.15	S	C	.	.	H	α-helix	trans	-57.2	-37	179.8	-173.1	-172.6	-178.5	-175.9	1.1	113.2	H268 Q269 I303 T307	H268-R272 WeakPolarHBondContact O-CB 3.39Å; H268-R272 PolarHBondContact O-N 2.97Å; Q269-R272 PolarHBondContact O-N 2.7Å; Q269-R272 VanDerWaalsContact OE1-CD 3.22Å; R272-I303 HydrophobicContact CB-CG2 3.82Å; R272-I303 HydrophobicContact CG-CG2 4.42Å; R272-T307 HydrophobicContact CG-CG2 4.24Å
273	F	94.6	Very high	94.8	Very high	87 Å²	87	28.2 Å²	28.2	38%	0.382	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.2	12.7	-176.3	-63.5	-67.9	0	0	0	114.2	L238 Q269 C271 R275	L238-F273 HydrophobicContact CD1-CE2 3.8Å; L238-F273 HydrophobicContact CD1-CZ 4.34Å; Q269-F273 HydrophobicContact CB-CD2 4.43Å; Q269-F273 HydrophobicContact CB-CE2 4.49Å; Q269-F273 VanDerWaalsContact O-CD2 3.24Å; Q269-F273 WeakPolarHBondContact O-CD2 3.33Å; Q269-F273 PolarHBondContact O-N 3.34Å; Q269-F273 VanDerWaalsContact O-N 3.09Å; C271-F273 VanDerWaalsContact C-N 3.26Å; C271-F273 PolarHBondContact O-N 3.15Å; F273-R275 HydrophobicContact CB-CG 4Å; F273-R275 VanDerWaalsContact CB-CZ 3.43Å; F273-R275 WeakPolarHBondContact O-CG 3.46Å; F273-R275 PolarHBondContact O-N 2.83Å
274	G	94.3	Very high	94.9	Very high	22 Å²	22	28.8 Å²	28.8	23%	0.227	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.9	22.1	174.9	0	0	0	0	0	115.6	A270 C271 V276 C312	A270-G274 PolarHBondContact O-N 2.82Å; C271-G274 PolarHBondContact O-N 3.38Å; G274-V276 VanDerWaalsContact C-N 3.33Å; G274-V276 PolarHBondContact O-N 3.19Å; G274-C312 VanDerWaalsContact C-SG 3.57Å
275	R	94.7	Very high	94.8	Very high	37 Å²	37	27.9 Å²	27.9	14%	0.14	13%	0.134	C	C	.	.			trans	-89.2	67.7	-166	-60.5	-175.9	-179.3	147.4	1.1	112.2	V237 L238 N240 A270 F273 Q277 H278 L279	V237-R275 PolarHBondContact O-NH1 3.29Å; L238-R275 PolarHBondContact O-NH1 3.21Å; L238-R275 PolarHBondContact O-NH2 3.26Å; N240-R275 VanDerWaalsContact OD1-CD 3.29Å; N240-R275 WeakPolarHBondContact OD1-CD 3.49Å; N240-R275 PolarHBondContact OD1-NE 3.45Å; A270-R275 HydrophobicContact CB-CB 4.48Å; A270-R275 PolarHBondContact O-N 3.24Å; F273-R275 HydrophobicContact CB-CG 4Å; F273-R275 VanDerWaalsContact CB-CZ 3.43Å; F273-R275 WeakPolarHBondContact O-CG 3.46Å; F273-R275 PolarHBondContact O-N 2.83Å; R275-Q277 VanDerWaalsContact C-N 3.26Å; R275-Q277 PolarHBondContact O-N 3.21Å; R275-Q277 VanDerWaalsContact O-N 3.17Å; R275-H278 HydrophobicContact CB-CB 4.24Å; R275-H278 PolarHBondContact O-N 2.9Å; R275-H278 VanDerWaalsContact O-N 3.09Å; R275-L279 WeakPolarHBondContact O-CB 3.46Å; R275-L279 PolarHBondContact O-N 3.41Å
276	V	94.8	Very high	94.5	Very high	34 Å²	34	27.9 Å²	27.9	21%	0.206	14%	0.142	C	C	.	.	H	α-helix	trans	-50.2	-41.4	-176.2	-171.3	0	0	0	0	112.9	G274 L279 E280 M315	G274-V276 VanDerWaalsContact C-N 3.33Å; G274-V276 PolarHBondContact O-N 3.19Å; V276-L279 WeakPolarHBondContact O-CB 3.33Å; V276-L279 PolarHBondContact O-N 3.35Å; V276-E280 WeakPolarHBondContact O-CB 3.32Å; V276-E280 PolarHBondContact O-N 2.92Å; V276-M315 HydrophobicContact CG1-CE 3.83Å
277	Q	95.1	Very high	94.4	Very high	132 Å²	132	28.3 Å²	28.3	62%	0.617	15%	0.146	S	C	*	.	H	α-helix	trans	-68.4	-41.8	180	-63.4	-173.7	10.8	0	0	113	S243 R275 E280 I281	S243-Q277 PolarHBondContact OG-OE1 2.81Å; R275-Q277 VanDerWaalsContact C-N 3.26Å; R275-Q277 PolarHBondContact O-N 3.21Å; R275-Q277 VanDerWaalsContact O-N 3.17Å; Q277-E280 PolarHBondContact O-N 2.81Å; Q277-I281 WeakPolarHBondContact O-CG1 3.26Å; Q277-I281 PolarHBondContact O-N 3.5Å; Q277-I281 VanDerWaalsContact O-N 3.17Å
278	H	96.1	Very high	94.2	Very high	4 Å²	4	34.8 Å²	34.8	2%	0.019	18%	0.176	C	C	.	.	H	α-helix	trans	-67.9	-40.4	175.1	-57.5	131.7	0	0	0	110.7	V237 T241 A270 R275 I281 L282	V237-H278 HydrophobicContact CG2-CB 4.41Å; T241-H278 PolarHBondContact O-CE1 3.14Å; T241-H278 VanDerWaalsContact O-CE1 3.24Å; T241-H278 PolarHBondContact O-NE2 3.4Å; A270-H278 HydrophobicContact CB-CB 4.46Å; R275-H278 HydrophobicContact CB-CB 4.24Å; R275-H278 PolarHBondContact O-N 2.9Å; R275-H278 VanDerWaalsContact O-N 3.09Å; H278-I281 PolarHBondContact O-N 2.83Å; H278-L282 WeakPolarHBondContact O-CB 3.31Å; H278-L282 WeakPolarHBondContact O-CD1 3.13Å; H278-L282 WeakPolarHBondContact O-CG 3.33Å; H278-L282 PolarHBondContact O-N 3.26Å
279	L	95.9	Very high	94.1	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-57	-48.1	174	176.5	61.1	0	0	0	111.6	I267 A270 R275 V276 I281 L282 L283 C312 M315 L316	I267-L279 HydrophobicContact CD1-CD1 4.04Å; I267-L279 HydrophobicContact CG1-CD1 3.67Å; A270-L279 HydrophobicContact CB-CB 4.28Å; R275-L279 WeakPolarHBondContact O-CB 3.46Å; R275-L279 PolarHBondContact O-N 3.41Å; V276-L279 WeakPolarHBondContact O-CB 3.33Å; V276-L279 PolarHBondContact O-N 3.35Å; L279-I281 PolarHBondContact O-N 3.41Å; L279-L282 PolarHBondContact O-N 3.43Å; L279-L283 HydrophobicContact CD1-CD1 3.76Å; L279-L283 HydrophobicContact CD1-CG 4.06Å; L279-L283 HydrophobicContact CG-CD1 3.89Å; L279-L283 VanDerWaalsContact O-CB 3.31Å; L279-L283 WeakPolarHBondContact O-CB 3.4Å; L279-L283 WeakPolarHBondContact O-CG 3.44Å; L279-L283 PolarHBondContact O-N 3.01Å; L279-C312 HydrophobicContact CD2-CB 3.82Å; L279-M315 HydrophobicContact CD2-CB 4.02Å; L279-M315 HydrophobicContact CD2-CG 3.98Å; L279-M315 HydrophobicContact CG-CG 4.16Å; L279-L316 HydrophobicContact CD1-CD2 4.16Å; L279-L316 HydrophobicContact CD2-CG 4.34Å
280	E	93.9	Very high	94	Very high	67 Å²	67	38.2 Å²	38.2	31%	0.313	19%	0.194	S	C	.	.	H	α-helix	trans	-59.6	-44.8	177.6	-178.6	153.5	-127.8	0	0	112.5	V276 Q277 L283 A284 M315 R319	V276-E280 WeakPolarHBondContact O-CB 3.32Å; V276-E280 PolarHBondContact O-N 2.92Å; Q277-E280 PolarHBondContact O-N 2.81Å; E280-L283 PolarHBondContact O-N 2.97Å; E280-A284 VanDerWaalsContact O-CB 3.26Å; E280-A284 WeakPolarHBondContact O-CB 3.2Å; E280-A284 PolarHBondContact O-N 3.06Å; E280-M315 HydrophobicContact CB-CE 3.86Å; E280-M315 HydrophobicContact CG-CE 4.18Å; E280-R319 IonicContact OE1-NH2 3.6Å; E280-R319 PolarHBondContact OE1-NH2 3.21Å
281	I	94.4	Very high	93.9	Very high	25 Å²	25	39.1 Å²	39.1	13%	0.128	20%	0.2	C	C	.	.	H	α-helix	trans	-67.6	-45.9	179.4	-64.6	166.9	0	0	0	110.8	V246 E247 L250 Q277 H278 L279 L283 A284 Y285	V246-I281 HydrophobicContact CG1-CB 4.48Å; V246-I281 HydrophobicContact CG1-CG2 4.08Å; E247-I281 HydrophobicContact CB-CD1 4.47Å; E247-I281 HydrophobicContact CB-CG2 4.24Å; L250-I281 HydrophobicContact CD1-CG2 3.76Å; Q277-I281 WeakPolarHBondContact O-CG1 3.26Å; Q277-I281 PolarHBondContact O-N 3.5Å; Q277-I281 VanDerWaalsContact O-N 3.17Å; H278-I281 PolarHBondContact O-N 2.83Å; L279-I281 PolarHBondContact O-N 3.41Å; I281-L283 VanDerWaalsContact C-N 3.3Å; I281-L283 PolarHBondContact O-N 3.17Å; I281-A284 PolarHBondContact O-N 3.34Å; I281-Y285 HydrophobicContact CG2-CD2 3.81Å; I281-Y285 HydrophobicContact CG2-CE2 3.96Å; I281-Y285 WeakPolarHBondContact O-CD2 3.26Å; I281-Y285 PolarHBondContact O-N 3.26Å
282	L	94.9	Very high	93.8	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-55.9	-46.6	176.2	-72.1	166.2	0	0	0	110.9	L233 V237 L250 L256 E266 A270 H278 L279 Y285 G286 A287	L233-L282 HydrophobicContact CD2-CD2 4.29Å; V237-L282 HydrophobicContact CG1-CD1 4.27Å; V237-L282 HydrophobicContact CG2-CD1 4.26Å; L250-L282 HydrophobicContact CD1-CD2 4.18Å; L256-L282 HydrophobicContact CD2-CD2 3.45Å; L256-L282 VanDerWaalsContact CD2-CD2 3.45Å; E266-L282 HydrophobicContact CB-CD1 4.17Å; E266-L282 HydrophobicContact CB-CD2 4.01Å; A270-L282 HydrophobicContact CB-CD1 3.99Å; H278-L282 WeakPolarHBondContact O-CB 3.31Å; H278-L282 WeakPolarHBondContact O-CD1 3.13Å; H278-L282 WeakPolarHBondContact O-CG 3.33Å; H278-L282 PolarHBondContact O-N 3.26Å; L279-L282 PolarHBondContact O-N 3.43Å; L282-Y285 PolarHBondContact O-N 3.27Å; L282-G286 PolarHBondContact O-N 3Å; L282-A287 HydrophobicContact CB-CB 4.05Å; L282-A287 VanDerWaalsContact O-CB 3.26Å; L282-A287 WeakPolarHBondContact O-CB 3.37Å; L282-A287 PolarHBondContact O-N 3.3Å
283	L	93.5	Very high	93.7	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-63.5	-45.2	176.1	-72.5	173.8	0	0	0	112.2	I267 L279 E280 I281 Y285 G286 I289 M315 R319 I360	I267-L283 HydrophobicContact CD1-CD2 3.8Å; I267-L283 HydrophobicContact CD1-CG 4.42Å; L279-L283 HydrophobicContact CD1-CD1 3.76Å; L279-L283 HydrophobicContact CD1-CG 4.06Å; L279-L283 HydrophobicContact CG-CD1 3.89Å; L279-L283 VanDerWaalsContact O-CB 3.31Å; L279-L283 WeakPolarHBondContact O-CB 3.4Å; L279-L283 WeakPolarHBondContact O-CG 3.44Å; L279-L283 PolarHBondContact O-N 3.01Å; E280-L283 PolarHBondContact O-N 2.97Å; I281-L283 VanDerWaalsContact C-N 3.3Å; I281-L283 PolarHBondContact O-N 3.17Å; L283-Y285 PolarHBondContact O-N 3Å; L283-G286 PolarHBondContact O-N 3.24Å; L283-I289 HydrophobicContact CD2-CD1 4.31Å; L283-I289 HydrophobicContact CD2-CG1 3.76Å; L283-M315 HydrophobicContact CD1-CG 4.07Å; L283-R319 HydrophobicContact CD1-CG 4.19Å; L283-I360 HydrophobicContact CB-CD1 3.79Å; L283-I360 HydrophobicContact CD2-CD1 4.44Å; L283-I360 WeakPolarHBondContact O-CD1 3.12Å
284	A	91.7	Very high	93.5	Very high	18 Å²	18	38.2 Å²	38.2	15%	0.149	21%	0.212	C	C	.	.	H	α-helix	trans	-65.3	-22.9	178.6	0	0	0	0	0	113.8	E280 I281 Y363 L364	E280-A284 VanDerWaalsContact O-CB 3.26Å; E280-A284 WeakPolarHBondContact O-CB 3.2Å; E280-A284 PolarHBondContact O-N 3.06Å; I281-A284 PolarHBondContact O-N 3.34Å; A284-Y363 CarbonylContact O-C 3.54Å; A284-Y363 WeakPolarHBondContact O-CA 3.48Å; A284-L364 HydrophobicContact CB-CD1 3.67Å; A284-L364 HydrophobicContact CB-CG 3.98Å; A284-L364 PolarHBondContact O-N 3.15Å
285	Y	91.4	Very high	93.2	Very high	8 Å²	8	43.5 Å²	43.5	3%	0.031	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-1.7	170.2	-83.2	-79.2	0	0	0	114.1	E247 L250 I281 L282 L283 L364 R366	E247-Y285 HydrophobicContact CG-CE2 4.18Å; L250-Y285 HydrophobicContact CB-CD1 3.92Å; L250-Y285 HydrophobicContact CB-CD2 3.62Å; L250-Y285 HydrophobicContact CB-CE1 4.11Å; L250-Y285 HydrophobicContact CB-CE2 3.82Å; L250-Y285 HydrophobicContact CB-CG 3.67Å; L250-Y285 HydrophobicContact CD1-CD2 3.71Å; L250-Y285 HydrophobicContact CD1-CE2 4.39Å; L250-Y285 HydrophobicContact CD1-CG 4.13Å; L250-Y285 HydrophobicContact CG-CD2 4.24Å; L250-Y285 HydrophobicContact CG-CG 4.34Å; I281-Y285 HydrophobicContact CG2-CD2 3.81Å; I281-Y285 HydrophobicContact CG2-CE2 3.96Å; I281-Y285 WeakPolarHBondContact O-CD2 3.26Å; I281-Y285 PolarHBondContact O-N 3.26Å; L282-Y285 PolarHBondContact O-N 3.27Å; L283-Y285 PolarHBondContact O-N 3Å; Y285-L364 HydrophobicContact CD1-CB 4.04Å; Y285-L364 HydrophobicContact CD2-CB 4.34Å; Y285-L364 HydrophobicContact CD2-CD1 3.88Å; Y285-L364 HydrophobicContact CE1-CB 3.75Å; Y285-L364 HydrophobicContact CE2-CB 4.08Å; Y285-L364 HydrophobicContact CE2-CD1 3.54Å; Y285-L364 HydrophobicContact CE2-CG 4.46Å; Y285-L364 HydrophobicContact CG-CB 4.32Å; Y285-R366 HydrophobicContact CD1-CG 3.96Å; Y285-R366 HydrophobicContact CE1-CG 3.87Å; Y285-R366 VanDerWaalsContact O-CZ 3.25Å; Y285-R366 PolarHBondContact O-NH1 3.42Å; Y285-R366 PolarHBondContact O-NH2 2.63Å
286	G	90.1	Very high	93	Very high	29 Å²	29	45.3 Å²	45.3	30%	0.299	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.5	39.5	174.7	0	0	0	0	0	115.4	L282 L283 Y363	L282-G286 PolarHBondContact O-N 3Å; L283-G286 PolarHBondContact O-N 3.24Å; G286-Y363 VanDerWaalsContact CA-CE1 3.42Å
287	A	92.7	Very high	92.9	Very high	12 Å²	12	43.7 Å²	43.7	10%	0.099	23%	0.232	C	C	.	.			trans	-68.9	139.5	164.6	0	0	0	0	0	110.8	L256 I267 L282 I289	L256-A287 HydrophobicContact CD1-CB 4.38Å; L256-A287 HydrophobicContact CD2-CB 4.23Å; I267-A287 HydrophobicContact CD1-CB 4.3Å; L282-A287 HydrophobicContact CB-CB 4.05Å; L282-A287 VanDerWaalsContact O-CB 3.26Å; L282-A287 WeakPolarHBondContact O-CB 3.37Å; L282-A287 PolarHBondContact O-N 3.3Å; A287-I289 PolarHBondContact O-N 2.99Å
288	E	92.1	Very high	92.9	Very high	136 Å²	136	38.7 Å²	38.7	64%	0.636	21%	0.209	S	C	*	.			trans	-68	124.2	179.6	-67.9	178	-173.8	0	0	111	V291	E288-V291 HydrophobicContact CB-CB 4Å; E288-V291 HydrophobicContact CB-CG1 4.39Å; E288-V291 WeakPolarHBondContact O-CG1 3.36Å
289	I	93.3	Very high	92.9	Very high	31 Å²	31	38.6 Å²	38.6	16%	0.159	21%	0.209	C	C	.	.	S	Bend	trans	-73	-41.5	-175.4	-47.4	-171.7	0	0	0	111.5	L283 A287 P300 L316 R319 A321 I360	L283-I289 HydrophobicContact CD2-CD1 4.31Å; L283-I289 HydrophobicContact CD2-CG1 3.76Å; A287-I289 PolarHBondContact O-N 2.99Å; I289-P300 WeakPolarHBondContact O-CD 3.45Å; I289-L316 HydrophobicContact CG2-CD2 3.97Å; I289-R319 HydrophobicContact CD1-CB 4.04Å; I289-R319 WeakPolarHBondContact CD1-O 3.47Å; I289-A321 HydrophobicContact CG2-CB 3.61Å; I289-I360 HydrophobicContact CD1-CD1 4.49Å
290	N	93.2	Very high	92.9	Very high	46 Å²	46	38.6 Å²	38.6	25%	0.246	21%	0.209	C	C	.	.	S	Bend	trans	-104.7	15.4	-167.5	-61.9	-24.2	0	0	0	113.2	A321 D322 I325	N290-A321 VanDerWaalsContact OD1-CA 3.3Å; N290-A321 WeakPolarHBondContact OD1-CA 3.18Å; N290-D322 PolarHBondContact ND2-N 3.36Å; N290-D322 PolarHBondContact ND2-OD2 2.95Å; N290-D322 PolarHBondContact OD1-N 3.44Å; N290-I325 HydrophobicContact CB-CD1 3.79Å
291	V	93.9	Very high	93	Very high	19 Å²	19	35.5 Å²	35.5	12%	0.115	19%	0.194	C	C	.	.			trans	-57.8	147.5	175.2	61.8	0	0	0	0	111.5	I267 E288 T299 P300	I267-V291 HydrophobicContact CG2-CG1 4.04Å; E288-V291 HydrophobicContact CB-CB 4Å; E288-V291 HydrophobicContact CB-CG1 4.39Å; E288-V291 WeakPolarHBondContact O-CG1 3.36Å; V291-T299 VanDerWaalsContact O-CA 3.3Å; V291-T299 WeakPolarHBondContact O-CA 3.42Å; V291-P300 HydrophobicContact CG1-CG 4.12Å; V291-P300 VanDerWaalsContact O-CD 3.31Å; V291-P300 WeakPolarHBondContact O-CD 3.36Å
292	Q	94.1	Very high	93.1	Very high	85 Å²	85	34.3 Å²	34.3	40%	0.397	19%	0.188	S	C	.	.			trans	-114.4	137.1	-179	-68.6	-172.6	-67.1	0	0	112.2	G297 T299 I325 K326	Q292-G297 WeakPolarHBondContact CG-O 3.49Å; Q292-G297 PolarHBondContact NE2-O 2.77Å; Q292-T299 HydrophobicContact CG-CG2 3.91Å; Q292-I325 HydrophobicContact CG-CG2 4.5Å; Q292-K326 PolarHBondContact NE2-O 3.47Å
293	T	93.5	Very high	93.1	Very high	4 Å²	4	34.9 Å²	34.9	3%	0.025	19%	0.191	C	C	.	.			trans	-61.9	131.1	171.6	50.3	0	0	0	0	112.2	G263 L264 K295 N296 G297 N298	G263-T293 WeakPolarHBondContact O-CA 3.48Å; L264-T293 HydrophobicContact CD2-CG2 3.6Å; L264-T293 HydrophobicContact CG-CG2 4.44Å; T293-K295 PolarHBondContact O-N 3.46Å; T293-N296 PolarHBondContact O-N 3.49Å; T293-G297 PolarHBondContact O-N 3.06Å; T293-G297 PolarHBondContact OG1-N 2.76Å; T293-N298 WeakPolarHBondContact CG2-O 3.46Å; T293-N298 PolarHBondContact N-O 2.89Å; T293-N298 PolarHBondContact OG1-N 3.14Å; T293-N298 PolarHBondContact OG1-O 3.17Å; T293-N298 VanDerWaalsContact OG1-O 3.07Å
294	S	89.2	Confident	93.3	Very high	94 Å²	94	34.9 Å²	34.9	66%	0.657	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63	-18.9	-173.4	-42.9	0	0	0	0	115.2
295	K	88.5	Confident	93.5	Very high	132 Å²	132	34 Å²	34	57%	0.574	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-29	-179	-67.5	-170.7	-177.7	178.7	0	114.8	E261 A262 T293	E261-K295 WeakPolarHBondContact O-CE 3.34Å; E261-K295 PolarHBondContact O-NZ 2.89Å; A262-K295 WeakPolarHBondContact O-CG 3.33Å; T293-K295 PolarHBondContact O-N 3.46Å
296	N	90.6	Very high	93.6	Very high	76 Å²	76	40.8 Å²	40.8	41%	0.406	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126.8	-12.6	-168.9	-71.8	84.4	0	0	0	113.8	T293 N298 N327 F328	T293-N296 PolarHBondContact O-N 3.49Å; N296-N298 HydrophobicContact CB-CB 4.46Å; N296-N298 PolarHBondContact O-N 3.45Å; N296-N298 VanDerWaalsContact O-N 3.14Å; N296-N327 WeakPolarHBondContact O-CB 3.46Å; N296-F328 VanDerWaalsContact C-CG 3.49Å; N296-F328 WeakPolarHBondContact O-CB 3.36Å; N296-F328 PolarHBondContact O-N 2.72Å
297	G	92.8	Very high	93.9	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.207	C	C	.	.			trans	69.4	2.4	-173.7	0	0	0	0	0	114.3	Q292 T293 T299 F328	Q292-G297 WeakPolarHBondContact CG-O 3.49Å; Q292-G297 PolarHBondContact NE2-O 2.77Å; T293-G297 PolarHBondContact O-N 3.06Å; T293-G297 PolarHBondContact OG1-N 2.76Å; G297-T299 PolarHBondContact O-N 3.33Å; G297-F328 VanDerWaalsContact CA-CE1 3.47Å
298	N	95.1	Very high	94	Very high	27 Å²	27	41.9 Å²	41.9	14%	0.144	22%	0.216	C	C	.	.			trans	-64.3	133.8	176.5	-73.3	-26.3	0	0	0	109.5	T293 N296 H302 I303 N327	T293-N298 WeakPolarHBondContact CG2-O 3.46Å; T293-N298 PolarHBondContact N-O 2.89Å; T293-N298 PolarHBondContact OG1-N 3.14Å; T293-N298 PolarHBondContact OG1-O 3.17Å; T293-N298 VanDerWaalsContact OG1-O 3.07Å; N296-N298 HydrophobicContact CB-CB 4.46Å; N296-N298 PolarHBondContact O-N 3.45Å; N296-N298 VanDerWaalsContact O-N 3.14Å; N298-H302 HydrophobicContact CB-CB 3.81Å; N298-I303 HydrophobicContact CB-CG1 4.48Å; N298-N327 WeakPolarHBondContact OD1-CB 3.23Å; N298-N327 PolarHBondContact OD1-ND2 3.46Å
299	T	95.6	Very high	94.2	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.006	20%	0.2	C	C	.	.			trans	-87	169.6	166.9	67.3	0	0	0	0	111.2	V291 Q292 G297 L301 H302 I303 I325	V291-T299 VanDerWaalsContact O-CA 3.3Å; V291-T299 WeakPolarHBondContact O-CA 3.42Å; Q292-T299 HydrophobicContact CG-CG2 3.91Å; G297-T299 PolarHBondContact O-N 3.33Å; T299-L301 PolarHBondContact O-N 3.48Å; T299-L301 VanDerWaalsContact O-N 3.14Å; T299-L301 PolarHBondContact OG1-N 2.91Å; T299-H302 PolarHBondContact N-ND1 3.32Å; T299-H302 WeakPolarHBondContact O-CB 3.44Å; T299-H302 PolarHBondContact O-N 2.97Å; T299-H302 PolarHBondContact OG1-N 2.72Å; T299-H302 PolarHBondContact OG1-ND1 3.16Å; T299-I303 PolarHBondContact O-N 3.41Å; T299-I325 HydrophobicContact CG2-CB 4.18Å; T299-I325 HydrophobicContact CG2-CD1 4.08Å; T299-I325 HydrophobicContact CG2-CG2 3.67Å
300	P	95.9	Very high	94.3	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-50.9	-34.7	171.1	-30.7	37.7	0	0	0	113.9	I267 I289 V291 I303 C304 L316	I267-P300 HydrophobicContact CD1-CB 4.44Å; I267-P300 HydrophobicContact CD1-CG 4.07Å; I267-P300 HydrophobicContact CG1-CB 4.22Å; I267-P300 HydrophobicContact CG1-CG 4Å; I267-P300 HydrophobicContact CG2-CG 3.99Å; I289-P300 WeakPolarHBondContact O-CD 3.45Å; V291-P300 HydrophobicContact CG1-CG 4.12Å; V291-P300 VanDerWaalsContact O-CD 3.31Å; V291-P300 WeakPolarHBondContact O-CD 3.36Å; P300-I303 PolarHBondContact O-N 3.34Å; P300-C304 PolarHBondContact O-N 2.98Å; P300-C304 PolarHBondContact O-SG 2.86Å; P300-L316 HydrophobicContact CB-CD1 3.82Å; P300-L316 HydrophobicContact CB-CD2 4.12Å
301	L	96.5	Very high	94.4	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-73	-35.4	177.3	-174.2	57.5	0	0	0	112.6	T299 I303 C304 A305 A313 L316 L317 A321 K323 T333 I349	T299-L301 PolarHBondContact O-N 3.48Å; T299-L301 VanDerWaalsContact O-N 3.14Å; T299-L301 PolarHBondContact OG1-N 2.91Å; L301-I303 VanDerWaalsContact C-N 3.28Å; L301-I303 PolarHBondContact O-N 3.2Å; L301-C304 PolarHBondContact O-N 3.41Å; L301-A305 WeakPolarHBondContact O-CB 3.48Å; L301-A305 PolarHBondContact O-N 2.99Å; L301-A313 HydrophobicContact CD1-CB 3.9Å; L301-L316 HydrophobicContact CB-CD1 4.02Å; L301-L316 HydrophobicContact CD1-CB 4.44Å; L301-L316 HydrophobicContact CD1-CD1 4.34Å; L301-L317 HydrophobicContact CD1-CG 4.3Å; L301-L317 HydrophobicContact CD2-CD2 3.74Å; L301-L317 HydrophobicContact CD2-CG 4.15Å; L301-A321 HydrophobicContact CD2-CB 4.07Å; L301-K323 HydrophobicContact CD2-CB 4.17Å; L301-T333 HydrophobicContact CB-CG2 4.01Å; L301-T333 HydrophobicContact CD2-CG2 3.9Å; L301-T333 HydrophobicContact CG-CG2 3.76Å; L301-I349 HydrophobicContact CD1-CD1 4.49Å
302	H	96.4	Very high	94.5	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63	-35.6	169.7	-71.4	83.9	0	0	0	111.8	N298 T299 Y306 I325 H331 T333	N298-H302 HydrophobicContact CB-CB 3.81Å; T299-H302 PolarHBondContact N-ND1 3.32Å; T299-H302 WeakPolarHBondContact O-CB 3.44Å; T299-H302 PolarHBondContact O-N 2.97Å; T299-H302 PolarHBondContact OG1-N 2.72Å; T299-H302 PolarHBondContact OG1-ND1 3.16Å; H302-Y306 WeakPolarHBondContact O-CB 3.23Å; H302-Y306 PolarHBondContact O-N 3.26Å; H302-I325 PolarHBondContact CE1-O 3.09Å; H302-I325 PolarHBondContact NE2-O 3.34Å; H302-H331 PolarHBondContact NE2-O 2.8Å; H302-T333 WeakPolarHBondContact ND1-CG2 3.44Å; H302-T333 PolarHBondContact NE2-N 3.06Å
303	I	95.4	Very high	94.6	Very high	12 Å²	12	35.1 Å²	35.1	6%	0.062	19%	0.188	C	C	.	.	H	α-helix	trans	-66	-47.2	174.8	-65.6	-173.2	0	0	0	110.1	L264 H268 C271 R272 N298 T299 P300 L301 A305 Y306 T307	L264-I303 HydrophobicContact CD2-CD1 3.53Å; H268-I303 HydrophobicContact CB-CD1 3.71Å; C271-I303 HydrophobicContact CB-CG2 4.32Å; R272-I303 HydrophobicContact CB-CG2 3.82Å; R272-I303 HydrophobicContact CG-CG2 4.42Å; N298-I303 HydrophobicContact CB-CG1 4.48Å; T299-I303 PolarHBondContact O-N 3.41Å; P300-I303 PolarHBondContact O-N 3.34Å; L301-I303 VanDerWaalsContact C-N 3.28Å; L301-I303 PolarHBondContact O-N 3.2Å; I303-A305 VanDerWaalsContact C-N 3.29Å; I303-A305 PolarHBondContact O-N 3.17Å; I303-Y306 CarbonylContact O-C 3.57Å; I303-Y306 PolarHBondContact O-N 3.18Å; I303-T307 HydrophobicContact CG2-CG2 4.12Å; I303-T307 PolarHBondContact O-N 3.37Å; I303-T307 PolarHBondContact O-OG1 3.38Å
304	C	96.4	Very high	94.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-57.1	-42.8	176.7	-60.4	0	0	0	0	112.3	P300 L301 Y306 T307 G308 Q309 C312 A313 I345	P300-C304 PolarHBondContact O-N 2.98Å; P300-C304 PolarHBondContact O-SG 2.86Å; L301-C304 PolarHBondContact O-N 3.41Å; C304-Y306 VanDerWaalsContact C-N 3.33Å; C304-Y306 PolarHBondContact O-N 3.1Å; C304-T307 PolarHBondContact O-N 2.81Å; C304-G308 PolarHBondContact O-N 3.21Å; C304-G308 VanDerWaalsContact O-N 3.07Å; C304-Q309 HydrophobicContact CB-CB 4.41Å; C304-Q309 PolarHBondContact O-N 2.95Å; C304-Q309 VanDerWaalsContact O-N 3.12Å; C304-C312 WeakPolarHBondContact SG-CB 3.42Å; C304-A313 HydrophobicContact CB-CB 3.95Å; C304-I345 WeakPolarHBondContact O-CD1 3.34Å
305	A	96.3	Very high	94.8	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.2	-35.3	174.5	0	0	0	0	0	113.5	L301 I303 T333 Q336 A337 H342	L301-A305 WeakPolarHBondContact O-CB 3.48Å; L301-A305 PolarHBondContact O-N 2.99Å; I303-A305 VanDerWaalsContact C-N 3.29Å; I303-A305 PolarHBondContact O-N 3.17Å; A305-T333 WeakPolarHBondContact CB-O 3.42Å; A305-Q336 HydrophobicContact CB-CB 4.45Å; A305-A337 HydrophobicContact CB-CB 3.82Å; A305-H342 PolarHBondContact O-ND1 3.31Å
306	Y	95.1	Very high	95.1	Very high	151 Å²	151	26.8 Å²	26.8	59%	0.592	14%	0.138	S	C	*	.	H	α-helix	trans	-80.3	-28	176.3	178.1	-109.5	0	0	0	113.8	H302 I303 C304 H342	H302-Y306 WeakPolarHBondContact O-CB 3.23Å; H302-Y306 PolarHBondContact O-N 3.26Å; I303-Y306 CarbonylContact O-C 3.57Å; I303-Y306 PolarHBondContact O-N 3.18Å; C304-Y306 VanDerWaalsContact C-N 3.33Å; C304-Y306 PolarHBondContact O-N 3.1Å; Y306-H342 PolarHBondContact O-CE1 3.22Å; Y306-H342 VanDerWaalsContact O-CE1 3.28Å
307	T	94.9	Very high	95.3	Very high	36 Å²	36	23.2 Å²	23.2	22%	0.221	12%	0.119	C	C	.	.	H	α-helix	trans	-108.2	6	-172.8	59.6	0	0	0	0	115.4	R272 I303 C304 Q309	R272-T307 HydrophobicContact CG-CG2 4.24Å; I303-T307 HydrophobicContact CG2-CG2 4.12Å; I303-T307 PolarHBondContact O-N 3.37Å; I303-T307 PolarHBondContact O-OG1 3.38Å; C304-T307 PolarHBondContact O-N 2.81Å; T307-Q309 VanDerWaalsContact C-N 3.31Å; T307-Q309 PolarHBondContact O-N 3.22Å; T307-Q309 PolarHBondContact O-NE2 3.12Å; T307-Q309 VanDerWaalsContact OG1-CG 3.25Å; T307-Q309 WeakPolarHBondContact OG1-CG 3.29Å
308	G	94.7	Very high	95.2	Very high	28 Å²	28	24.2 Å²	24.2	29%	0.289	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	72	21.1	177.6	0	0	0	0	0	114.1	C304 E310 H342	C304-G308 PolarHBondContact O-N 3.21Å; C304-G308 VanDerWaalsContact O-N 3.07Å; G308-E310 PolarHBondContact O-N 2.78Å; G308-E310 VanDerWaalsContact O-N 3.09Å; G308-H342 PolarHBondContact N-CE1 3.22Å; G308-H342 VanDerWaalsContact N-CE1 3.27Å; G308-H342 PolarHBondContact N-ND1 2.79Å
309	Q	96	Very high	95	Very high	63 Å²	63	24.9 Å²	24.9	29%	0.294	12%	0.124	S	C	.	.			trans	-91.9	70	-170.6	-59.5	-57	-38.3	0	0	112.3	C271 C304 T307 S311 C312 A313	C271-Q309 WeakPolarHBondContact O-CG 3.45Å; C304-Q309 HydrophobicContact CB-CB 4.41Å; C304-Q309 PolarHBondContact O-N 2.95Å; C304-Q309 VanDerWaalsContact O-N 3.12Å; T307-Q309 VanDerWaalsContact C-N 3.31Å; T307-Q309 PolarHBondContact O-N 3.22Å; T307-Q309 PolarHBondContact O-NE2 3.12Å; T307-Q309 VanDerWaalsContact OG1-CG 3.25Å; T307-Q309 WeakPolarHBondContact OG1-CG 3.29Å; Q309-S311 PolarHBondContact O-N 3.33Å; Q309-C312 HydrophobicContact CB-CB 4.13Å; Q309-C312 WeakPolarHBondContact O-CB 3.34Å; Q309-C312 PolarHBondContact O-N 3.42Å; Q309-C312 VanDerWaalsContact O-N 3.08Å; Q309-A313 PolarHBondContact O-N 2.78Å
310	E	95.2	Very high	94.8	Very high	54 Å²	54	25.9 Å²	25.9	25%	0.252	13%	0.134	S	C	.	.	H	α-helix	trans	-56	-46.5	-173.5	-169.6	-110.2	-179.6	0	0	113.2	G308 C312 A313 R314 I345 L348	G308-E310 PolarHBondContact O-N 2.78Å; G308-E310 VanDerWaalsContact O-N 3.09Å; E310-C312 VanDerWaalsContact C-N 3.31Å; E310-C312 PolarHBondContact O-N 3.05Å; E310-A313 WeakPolarHBondContact O-CB 3.47Å; E310-A313 PolarHBondContact O-N 2.92Å; E310-A313 VanDerWaalsContact O-N 3.12Å; E310-R314 WeakPolarHBondContact O-CG 3.24Å; E310-R314 PolarHBondContact O-N 2.97Å; E310-R314 IonicContact OE1-CZ 2.68Å; E310-R314 IonicContact OE1-NE 3.13Å; E310-R314 PolarHBondContact OE1-NE 2.9Å; E310-R314 IonicContact OE1-NH2 3.37Å; E310-R314 PolarHBondContact OE1-NH2 2.84Å; E310-R314 IonicContact OE2-NE 2.75Å; E310-I345 HydrophobicContact CB-CD1 4.07Å; E310-I345 HydrophobicContact CB-CG1 3.88Å; E310-I345 HydrophobicContact CG-CG1 4.09Å; E310-L348 HydrophobicContact CG-CD1 3.75Å
311	S	95.5	Very high	94.6	Very high	58 Å²	58	26.4 Å²	26.4	41%	0.406	14%	0.138	S	C	.	.	H	α-helix	trans	-65.8	-28.9	176.8	-65.4	0	0	0	0	114.1	Q309 M315	Q309-S311 PolarHBondContact O-N 3.33Å; S311-M315 PolarHBondContact O-N 3.1Å
312	C	96.1	Very high	94.5	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-74.8	-37.9	171.4	-71	0	0	0	0	111.4	G274 L279 C304 Q309 E310 M315 L316	G274-C312 VanDerWaalsContact C-SG 3.57Å; L279-C312 HydrophobicContact CD2-CB 3.82Å; C304-C312 WeakPolarHBondContact SG-CB 3.42Å; Q309-C312 HydrophobicContact CB-CB 4.13Å; Q309-C312 WeakPolarHBondContact O-CB 3.34Å; Q309-C312 PolarHBondContact O-N 3.42Å; Q309-C312 VanDerWaalsContact O-N 3.08Å; E310-C312 VanDerWaalsContact C-N 3.31Å; E310-C312 PolarHBondContact O-N 3.05Å; C312-M315 PolarHBondContact O-N 2.82Å; C312-L316 WeakPolarHBondContact O-CB 3.17Å; C312-L316 WeakPolarHBondContact O-CG 3.46Å; C312-L316 PolarHBondContact O-N 2.81Å
313	A	96.1	Very high	94.3	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-61.1	-44.3	173	0	0	0	0	0	111.7	L301 C304 Q309 E310 L316 L317 I345	L301-A313 HydrophobicContact CD1-CB 3.9Å; C304-A313 HydrophobicContact CB-CB 3.95Å; Q309-A313 PolarHBondContact O-N 2.78Å; E310-A313 WeakPolarHBondContact O-CB 3.47Å; E310-A313 PolarHBondContact O-N 2.92Å; E310-A313 VanDerWaalsContact O-N 3.12Å; A313-L316 PolarHBondContact O-N 2.84Å; A313-L317 WeakPolarHBondContact O-CB 3.5Å; A313-L317 WeakPolarHBondContact O-CG 3.4Å; A313-L317 PolarHBondContact O-N 3.26Å; A313-I345 HydrophobicContact CB-CG2 4.04Å
314	R	94.4	Very high	94.1	Very high	51 Å²	51	38.8 Å²	38.8	19%	0.192	20%	0.202	C	C	.	.	H	α-helix	trans	-53.2	-55.8	171.6	-71.4	-178.8	-179.8	-79.2	-16.7	111.2	E310 L316 L317 F318 L348 E1002	E310-R314 WeakPolarHBondContact O-CG 3.24Å; E310-R314 PolarHBondContact O-N 2.97Å; E310-R314 IonicContact OE1-CZ 2.68Å; E310-R314 IonicContact OE1-NE 3.13Å; E310-R314 PolarHBondContact OE1-NE 2.9Å; E310-R314 IonicContact OE1-NH2 3.37Å; E310-R314 PolarHBondContact OE1-NH2 2.84Å; E310-R314 IonicContact OE2-NE 2.75Å; R314-L316 PolarHBondContact O-N 3.46Å; R314-L317 PolarHBondContact O-N 3.34Å; R314-F318 HydrophobicContact CB-CD2 4.21Å; R314-F318 HydrophobicContact CB-CE2 4.16Å; R314-F318 WeakPolarHBondContact O-CB 3.46Å; R314-F318 WeakPolarHBondContact O-CD2 3.46Å; R314-F318 WeakPolarHBondContact O-CG 3.46Å; R314-F318 PolarHBondContact O-N 3.25Å; R314-L348 HydrophobicContact CG-CD1 3.64Å; R314-L348 HydrophobicContact CG-CD2 4.38Å; R314-L348 HydrophobicContact CG-CG 4.46Å; R314-E1002 WeakPolarHBondContact CD-OE2 3.4Å; R314-E1002 IonicContact CZ-OE1 3.87Å; R314-E1002 IonicContact CZ-OE2 2.8Å; R314-E1002 IonicContact NE-OE2 2.72Å; R314-E1002 VanDerWaalsContact NH1-CD 3.31Å; R314-E1002 IonicContact NH1-OE1 2.81Å; R314-E1002 PolarHBondContact NH1-OE1 3.32Å; R314-E1002 IonicContact NH1-OE2 3.15Å; R314-E1002 PolarHBondContact NH1-OE2 3.48Å
315	M	93.5	Very high	94	Very high	3 Å²	3	40.6 Å²	40.6	2%	0.015	21%	0.211	C	C	.	.	H	α-helix	trans	-56.3	-48	179.8	-178.8	68.5	73.7	0	0	111.9	V276 L279 E280 L283 S311 C312 R319 F1001	V276-M315 HydrophobicContact CG1-CE 3.83Å; L279-M315 HydrophobicContact CD2-CB 4.02Å; L279-M315 HydrophobicContact CD2-CG 3.98Å; L279-M315 HydrophobicContact CG-CG 4.16Å; E280-M315 HydrophobicContact CB-CE 3.86Å; E280-M315 HydrophobicContact CG-CE 4.18Å; L283-M315 HydrophobicContact CD1-CG 4.07Å; S311-M315 PolarHBondContact O-N 3.1Å; C312-M315 PolarHBondContact O-N 2.82Å; M315-R319 HydrophobicContact CG-CG 4.5Å; M315-R319 WeakPolarHBondContact O-CB 3.41Å; M315-R319 WeakPolarHBondContact O-CG 3.49Å; M315-R319 PolarHBondContact O-N 2.85Å; M315-R319 HydrophobicContact SD-CG 4.12Å; M315-F1001 HydrophobicContact CE-CE1 3.98Å; M315-F1001 HydrophobicContact CE-CE2 4.16Å; M315-F1001 HydrophobicContact CE-CZ 3.35Å; M315-F1001 HydrophobicContact SD-CZ 4.4Å
316	L	94.8	Very high	94	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60.4	-48.9	179.9	-74.9	172.8	0	0	0	112.1	I267 L279 I289 P300 L301 C312 A313 R314 R319 G320 A321	I267-L316 HydrophobicContact CD1-CD2 4.43Å; L279-L316 HydrophobicContact CD1-CD2 4.16Å; L279-L316 HydrophobicContact CD2-CG 4.34Å; I289-L316 HydrophobicContact CG2-CD2 3.97Å; P300-L316 HydrophobicContact CB-CD1 3.82Å; P300-L316 HydrophobicContact CB-CD2 4.12Å; L301-L316 HydrophobicContact CB-CD1 4.02Å; L301-L316 HydrophobicContact CD1-CB 4.44Å; L301-L316 HydrophobicContact CD1-CD1 4.34Å; C312-L316 WeakPolarHBondContact O-CB 3.17Å; C312-L316 WeakPolarHBondContact O-CG 3.46Å; C312-L316 PolarHBondContact O-N 2.81Å; A313-L316 PolarHBondContact O-N 2.84Å; R314-L316 PolarHBondContact O-N 3.46Å; L316-R319 PolarHBondContact O-N 3.22Å; L316-G320 PolarHBondContact O-N 3.11Å; L316-A321 HydrophobicContact CB-CB 3.8Å; L316-A321 VanDerWaalsContact O-CB 3.23Å; L316-A321 WeakPolarHBondContact O-CB 3.31Å; L316-A321 PolarHBondContact O-N 3.5Å
317	L	93.7	Very high	93.9	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-62.9	-48.3	179.2	-72.4	165.4	0	0	0	111.4	L301 A313 R314 R319 G320 K323 L348 I349 F352	L301-L317 HydrophobicContact CD1-CG 4.3Å; L301-L317 HydrophobicContact CD2-CD2 3.74Å; L301-L317 HydrophobicContact CD2-CG 4.15Å; A313-L317 WeakPolarHBondContact O-CB 3.5Å; A313-L317 WeakPolarHBondContact O-CG 3.4Å; A313-L317 PolarHBondContact O-N 3.26Å; R314-L317 PolarHBondContact O-N 3.34Å; L317-R319 PolarHBondContact O-N 2.93Å; L317-R319 VanDerWaalsContact O-N 3.14Å; L317-G320 PolarHBondContact O-N 3.28Å; L317-K323 HydrophobicContact CD2-CB 4.22Å; L317-L348 HydrophobicContact CD1-CD2 3.39Å; L317-I349 HydrophobicContact CD1-CG1 4.09Å; L317-F352 HydrophobicContact CB-CD1 3.9Å; L317-F352 HydrophobicContact CB-CD2 3.88Å; L317-F352 HydrophobicContact CB-CE1 3.88Å; L317-F352 HydrophobicContact CB-CE2 3.87Å; L317-F352 HydrophobicContact CB-CG 3.91Å; L317-F352 HydrophobicContact CB-CZ 3.88Å; L317-F352 HydrophobicContact CD1-CB 4.19Å; L317-F352 HydrophobicContact CD1-CG 4.19Å; L317-F352 HydrophobicContact CD2-CD1 3.9Å; L317-F352 HydrophobicContact CD2-CE1 4.37Å; L317-F352 HydrophobicContact CD2-CG 4.28Å; L317-F352 HydrophobicContact CG-CD1 4.36Å; L317-F352 HydrophobicContact CG-CG 4.36Å; L317-F352 WeakPolarHBondContact O-CE1 3.32Å; L317-F352 WeakPolarHBondContact O-CZ 3.47Å
318	F	91.7	Very high	93.9	Very high	22 Å²	22	43.3 Å²	43.3	10%	0.096	22%	0.223	C	C	.	.	H	α-helix	trans	-58.6	-26.9	175.7	-76.9	-55.5	0	0	0	113.4	R314 F352 V358 L1005 V1009	R314-F318 HydrophobicContact CB-CD2 4.21Å; R314-F318 HydrophobicContact CB-CE2 4.16Å; R314-F318 WeakPolarHBondContact O-CB 3.46Å; R314-F318 WeakPolarHBondContact O-CD2 3.46Å; R314-F318 WeakPolarHBondContact O-CG 3.46Å; R314-F318 PolarHBondContact O-N 3.25Å; F318-F352 AromaticContact CD1-CE2 3.74Å; F318-F352 HydrophobicContact CD1-CE2 3.74Å; F318-F352 HydrophobicContact CD1-CZ 4.34Å; F318-F352 AromaticContact CE1-CE2 3.92Å; F318-F352 HydrophobicContact CE1-CE2 3.92Å; F318-F352 HydrophobicContact CG-CE2 4.31Å; F318-V358 CarbonylContact O-C 3.56Å; F318-V358 WeakPolarHBondContact O-CA 3.4Å; F318-V358 PolarHBondContact O-N 2.85Å; F318-L1005 HydrophobicContact CB-CD2 4.42Å; F318-L1005 HydrophobicContact CD1-CD2 4.25Å; F318-L1005 HydrophobicContact CD2-CD1 3.69Å; F318-L1005 HydrophobicContact CD2-CD2 3.9Å; F318-L1005 HydrophobicContact CD2-CG 4.37Å; F318-L1005 HydrophobicContact CE2-CB 4.44Å; F318-L1005 HydrophobicContact CE2-CD1 3.73Å; F318-L1005 HydrophobicContact CE2-CD2 4.2Å; F318-L1005 HydrophobicContact CE2-CG 4.36Å; F318-L1005 HydrophobicContact CG-CD2 3.95Å; F318-V1009 HydrophobicContact CD1-CG2 4.41Å; F318-V1009 HydrophobicContact CE1-CG2 3.96Å
319	R	91.1	Very high	93.8	Very high	41 Å²	41	47 Å²	47	16%	0.155	24%	0.237	C	C	.	.	H	α-helix	trans	-90.7	-5.6	177	-59.9	-67.1	-172.7	153	4.4	114	E280 L283 I289 M315 L316 L317 I360	E280-R319 IonicContact OE1-NH2 3.6Å; E280-R319 PolarHBondContact OE1-NH2 3.21Å; L283-R319 HydrophobicContact CD1-CG 4.19Å; I289-R319 HydrophobicContact CD1-CB 4.04Å; I289-R319 WeakPolarHBondContact CD1-O 3.47Å; M315-R319 HydrophobicContact CG-CG 4.5Å; M315-R319 WeakPolarHBondContact O-CB 3.41Å; M315-R319 WeakPolarHBondContact O-CG 3.49Å; M315-R319 PolarHBondContact O-N 2.85Å; M315-R319 HydrophobicContact SD-CG 4.12Å; L316-R319 PolarHBondContact O-N 3.22Å; L317-R319 PolarHBondContact O-N 2.93Å; L317-R319 VanDerWaalsContact O-N 3.14Å; R319-I360 HydrophobicContact CB-CD1 4.41Å; R319-I360 HydrophobicContact CB-CG1 4.43Å
320	G	90.4	Very high	93.7	Very high	22 Å²	22	45.7 Å²	45.7	23%	0.227	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	103.7	39.3	176.3	0	0	0	0	0	115.4	L316 L317	L316-G320 PolarHBondContact O-N 3.11Å; L317-G320 PolarHBondContact O-N 3.28Å
321	A	93.4	Very high	93.7	Very high	10 Å²	10	45.7 Å²	45.7	8%	0.083	24%	0.24	C	C	.	.			trans	-74.4	131.7	175.1	0	0	0	0	0	113.2	I289 N290 L301 L316 K323	I289-A321 HydrophobicContact CG2-CB 3.61Å; N290-A321 VanDerWaalsContact OD1-CA 3.3Å; N290-A321 WeakPolarHBondContact OD1-CA 3.18Å; L301-A321 HydrophobicContact CD2-CB 4.07Å; L316-A321 HydrophobicContact CB-CB 3.8Å; L316-A321 VanDerWaalsContact O-CB 3.23Å; L316-A321 WeakPolarHBondContact O-CB 3.31Å; L316-A321 PolarHBondContact O-N 3.5Å; A321-K323 PolarHBondContact O-N 3.29Å
322	D	92.9	Very high	93.6	Very high	84 Å²	84	44.1 Å²	44.1	45%	0.449	23%	0.228	S	C	.	.			trans	-74.5	92.7	-178.1	-72.3	-33	0	0	0	111.4	N290 N324 I325	N290-D322 PolarHBondContact ND2-N 3.36Å; N290-D322 PolarHBondContact ND2-OD2 2.95Å; N290-D322 PolarHBondContact OD1-N 3.44Å; D322-N324 PolarHBondContact O-N 2.94Å; D322-N324 VanDerWaalsContact O-N 3.1Å; D322-I325 HydrophobicContact CB-CD1 3.63Å; D322-I325 HydrophobicContact CB-CG1 3.73Å; D322-I325 PolarHBondContact O-N 3.5Å
323	K	92.1	Very high	93.6	Very high	58 Å²	58	44.1 Å²	44.1	25%	0.252	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-21	177.7	66.9	-176.4	-171.2	176.7	0	114.4	L301 L317 A321 T333 I349 F352	L301-K323 HydrophobicContact CD2-CB 4.17Å; L317-K323 HydrophobicContact CD2-CB 4.22Å; A321-K323 PolarHBondContact O-N 3.29Å; K323-T333 PolarHBondContact O-OG1 3Å; K323-I349 HydrophobicContact CB-CG2 4Å; K323-I349 HydrophobicContact CD-CG2 4.05Å; K323-I349 WeakPolarHBondContact CD-O 3.49Å; K323-I349 PolarHBondContact NZ-O 3Å; K323-F352 PolarHBondContact NZ-O 2.94Å
324	N	92.1	Very high	93.6	Very high	132 Å²	132	47.7 Å²	47.7	71%	0.706	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-12.3	-177.1	-62.7	-22	0	0	0	114.5	D322	D322-N324 PolarHBondContact O-N 2.94Å; D322-N324 VanDerWaalsContact O-N 3.1Å
325	I	94.2	Very high	93.6	Very high	38 Å²	38	48.9 Å²	48.9	20%	0.195	25%	0.25	C	C	.	.			trans	-61.1	141.9	176.4	-68.9	174.3	0	0	0	109.3	N290 Q292 T299 H302 D322	N290-I325 HydrophobicContact CB-CD1 3.79Å; Q292-I325 HydrophobicContact CG-CG2 4.5Å; T299-I325 HydrophobicContact CG2-CB 4.18Å; T299-I325 HydrophobicContact CG2-CD1 4.08Å; T299-I325 HydrophobicContact CG2-CG2 3.67Å; H302-I325 PolarHBondContact CE1-O 3.09Å; H302-I325 PolarHBondContact NE2-O 3.34Å; D322-I325 HydrophobicContact CB-CD1 3.63Å; D322-I325 HydrophobicContact CB-CG1 3.73Å; D322-I325 PolarHBondContact O-N 3.5Å
326	K	95.1	Very high	93.7	Very high	107 Å²	107	49.6 Å²	49.6	47%	0.465	25%	0.253	S	S	.	.	B	Isolated β-bridge	trans	-105.8	141.1	174	-73.1	174	171.1	-86.2	0	110.9	Q292 G330 H331 T332 E335	Q292-K326 PolarHBondContact NE2-O 3.47Å; K326-G330 WeakPolarHBondContact CD-O 3.26Å; K326-G330 WeakPolarHBondContact CG-O 3.47Å; K326-G330 PolarHBondContact NZ-O 3.42Å; K326-H331 CarbonylContact C-O 3.55Å; K326-H331 VanDerWaalsContact CA-O 3.26Å; K326-H331 WeakPolarHBondContact CA-O 3.45Å; K326-T332 HydrophobicContact CD-CG2 4.37Å; K326-T332 HydrophobicContact CG-CG2 3.67Å; K326-E335 IonicContact NZ-OE2 3.54Å
327	N	94.2	Very high	93.7	Very high	8 Å²	8	49.6 Å²	49.6	4%	0.043	25%	0.253	C	S	.	.			trans	-77.6	177.8	170	73	11.6	0	0	0	111.6	N296 N298 N329 G330 H331	N296-N327 WeakPolarHBondContact O-CB 3.46Å; N298-N327 WeakPolarHBondContact OD1-CB 3.23Å; N298-N327 PolarHBondContact OD1-ND2 3.46Å; N327-N329 PolarHBondContact O-N 3.26Å; N327-N329 WeakPolarHBondContact OD1-CA 3.4Å; N327-N329 WeakPolarHBondContact OD1-CB 3.47Å; N327-N329 PolarHBondContact OD1-N 3.41Å; N327-G330 WeakPolarHBondContact O-CA 3.15Å; N327-G330 PolarHBondContact O-N 2.92Å; N327-G330 PolarHBondContact OD1-N 3.32Å; N327-H331 PolarHBondContact N-O 2.91Å; N327-H331 PolarHBondContact OD1-N 2.9Å; N327-H331 VanDerWaalsContact OD1-N 3.08Å; N327-H331 PolarHBondContact OD1-O 3.15Å
328	F	94.3	Very high	93.8	Very high	129 Å²	129	53.1 Å²	53.1	57%	0.566	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-10.9	-178	-61.2	-17	0	0	0	114	N296 G297 G330	N296-F328 VanDerWaalsContact C-CG 3.49Å; N296-F328 WeakPolarHBondContact O-CB 3.36Å; N296-F328 PolarHBondContact O-N 2.72Å; G297-F328 VanDerWaalsContact CA-CE1 3.47Å; F328-G330 VanDerWaalsContact C-N 3.28Å
329	N	93.1	Very high	94	Very high	107 Å²	107	57.1 Å²	57.1	57%	0.572	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-2.7	169.2	-60.2	-5	0	0	0	112	N327 H331	N327-N329 PolarHBondContact O-N 3.26Å; N327-N329 WeakPolarHBondContact OD1-CA 3.4Å; N327-N329 WeakPolarHBondContact OD1-CB 3.47Å; N327-N329 PolarHBondContact OD1-N 3.41Å; N329-H331 VanDerWaalsContact C-N 3.29Å; N329-H331 PolarHBondContact O-N 2.68Å
330	G	93.5	Very high	94.1	Very high	35 Å²	35	56.4 Å²	56.4	36%	0.361	29%	0.293	S	S	.	.	S	Bend	trans	82.1	-0.1	-175.9	0	0	0	0	0	114.6	K326 N327 F328	K326-G330 WeakPolarHBondContact CD-O 3.26Å; K326-G330 WeakPolarHBondContact CG-O 3.47Å; K326-G330 PolarHBondContact NZ-O 3.42Å; N327-G330 WeakPolarHBondContact O-CA 3.15Å; N327-G330 PolarHBondContact O-N 2.92Å; N327-G330 PolarHBondContact OD1-N 3.32Å; F328-G330 VanDerWaalsContact C-N 3.28Å
331	H	95	Very high	94.3	Very high	53 Å²	53	61.3 Å²	61.3	25%	0.245	31%	0.314	C	S	.	.			trans	-78.8	138.5	179.1	-52.6	167.6	0	0	0	110.6	H302 K326 N327 N329 E335 Q336 I339	H302-H331 PolarHBondContact NE2-O 2.8Å; K326-H331 CarbonylContact C-O 3.55Å; K326-H331 VanDerWaalsContact CA-O 3.26Å; K326-H331 WeakPolarHBondContact CA-O 3.45Å; N327-H331 PolarHBondContact N-O 2.91Å; N327-H331 PolarHBondContact OD1-N 2.9Å; N327-H331 VanDerWaalsContact OD1-N 3.08Å; N327-H331 PolarHBondContact OD1-O 3.15Å; N329-H331 VanDerWaalsContact C-N 3.29Å; N329-H331 PolarHBondContact O-N 2.68Å; H331-E335 HydrophobicContact CB-CB 4.24Å; H331-Q336 PolarHBondContact ND1-OE1 2.73Å; H331-I339 VanDerWaalsContact CE1-CD1 3.43Å; H331-I339 WeakPolarHBondContact CE1-CD1 3.2Å
332	T	95	Very high	94.4	Very high	25 Å²	25	63.7 Å²	63.7	15%	0.153	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-78.3	171.7	164	58.1	0	0	0	0	111.5	K326 Y334 E335 Q336	K326-T332 HydrophobicContact CD-CG2 4.37Å; K326-T332 HydrophobicContact CG-CG2 3.67Å; T332-Y334 VanDerWaalsContact C-N 3.32Å; T332-Y334 PolarHBondContact O-N 2.92Å; T332-E335 VanDerWaalsContact CB-OE2 3.3Å; T332-E335 WeakPolarHBondContact CB-OE2 3.46Å; T332-E335 WeakPolarHBondContact CG2-OE2 3.43Å; T332-E335 PolarHBondContact N-OE2 3.17Å; T332-E335 PolarHBondContact O-N 2.85Å; T332-E335 VanDerWaalsContact OG1-CD 3.28Å; T332-E335 WeakPolarHBondContact OG1-CG 3.45Å; T332-E335 PolarHBondContact OG1-N 2.93Å; T332-E335 PolarHBondContact OG1-OE2 3.31Å; T332-Q336 WeakPolarHBondContact O-CB 3.24Å; T332-Q336 PolarHBondContact O-N 3.4Å
333	T	94.8	Very high	94.4	Very high	0 Å²	0	64 Å²	64	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-58.2	-39.6	175.1	60.5	0	0	0	0	113.3	L301 H302 A305 K323 A337	L301-T333 HydrophobicContact CB-CG2 4.01Å; L301-T333 HydrophobicContact CD2-CG2 3.9Å; L301-T333 HydrophobicContact CG-CG2 3.76Å; H302-T333 WeakPolarHBondContact ND1-CG2 3.44Å; H302-T333 PolarHBondContact NE2-N 3.06Å; A305-T333 WeakPolarHBondContact CB-O 3.42Å; K323-T333 PolarHBondContact O-OG1 3Å; T333-A337 PolarHBondContact O-N 2.75Å
334	Y	95.7	Very high	94.5	Very high	75 Å²	75	68.3 Å²	68.3	29%	0.294	35%	0.345	S	S	.	.	H	α-helix	trans	-67.6	-48.2	176.2	175	-94.9	0	0	0	112.2	T332 Q336 A337 M338 A346 K350	T332-Y334 VanDerWaalsContact C-N 3.32Å; T332-Y334 PolarHBondContact O-N 2.92Å; Y334-Q336 VanDerWaalsContact C-N 3.27Å; Y334-Q336 PolarHBondContact O-N 3.09Å; Y334-A337 PolarHBondContact O-N 2.95Å; Y334-A337 VanDerWaalsContact O-N 3.14Å; Y334-M338 HydrophobicContact CD1-CG 4.39Å; Y334-M338 HydrophobicContact CE1-CG 3.92Å; Y334-M338 HydrophobicContact CE2-CG 4.41Å; Y334-M338 PolarHBondContact O-N 3.24Å; Y334-A346 HydrophobicContact CD2-CB 3.94Å; Y334-A346 VanDerWaalsContact CD2-O 3.29Å; Y334-A346 WeakPolarHBondContact CD2-O 3.33Å; Y334-A346 HydrophobicContact CE2-CB 3.81Å; Y334-A346 WeakPolarHBondContact CE2-O 3.43Å; Y334-K350 HydrophobicContact CD2-CB 4.12Å; Y334-K350 HydrophobicContact CE2-CB 3.89Å; Y334-K350 HydrophobicContact CE2-CD 3.88Å; Y334-K350 HydrophobicContact CE2-CG 4.35Å
335	E	95.4	Very high	94.6	Very high	77 Å²	77	62.2 Å²	62.2	36%	0.36	31%	0.312	S	S	.	.	H	α-helix	trans	-60.3	-39.7	177	-69.7	161.7	136.6	0	0	110.5	K326 H331 T332 M338 I339	K326-E335 IonicContact NZ-OE2 3.54Å; H331-E335 HydrophobicContact CB-CB 4.24Å; T332-E335 VanDerWaalsContact CB-OE2 3.3Å; T332-E335 WeakPolarHBondContact CB-OE2 3.46Å; T332-E335 WeakPolarHBondContact CG2-OE2 3.43Å; T332-E335 PolarHBondContact N-OE2 3.17Å; T332-E335 PolarHBondContact O-N 2.85Å; T332-E335 VanDerWaalsContact OG1-CD 3.28Å; T332-E335 WeakPolarHBondContact OG1-CG 3.45Å; T332-E335 PolarHBondContact OG1-N 2.93Å; T332-E335 PolarHBondContact OG1-OE2 3.31Å; E335-M338 PolarHBondContact O-N 3.25Å; E335-I339 WeakPolarHBondContact O-CB 3.09Å; E335-I339 WeakPolarHBondContact O-CD1 3.31Å; E335-I339 WeakPolarHBondContact O-CG1 3.41Å; E335-I339 PolarHBondContact O-N 3.02Å
336	Q	95.1	Very high	94.7	Very high	18 Å²	18	60.4 Å²	60.4	8%	0.084	30%	0.303	C	S	.	.	H	α-helix	trans	-66.4	-36.8	175.5	-169.7	57.3	60.4	0	0	112.8	A305 H331 T332 Y334 S340	A305-Q336 HydrophobicContact CB-CB 4.45Å; H331-Q336 PolarHBondContact ND1-OE1 2.73Å; T332-Q336 WeakPolarHBondContact O-CB 3.24Å; T332-Q336 PolarHBondContact O-N 3.4Å; Y334-Q336 VanDerWaalsContact C-N 3.27Å; Y334-Q336 PolarHBondContact O-N 3.09Å; Q336-S340 PolarHBondContact NE2-OG 2.88Å; Q336-S340 VanDerWaalsContact NE2-OG 3.12Å; Q336-S340 WeakPolarHBondContact O-CB 3.36Å; Q336-S340 PolarHBondContact O-N 3.32Å; Q336-S340 PolarHBondContact O-OG 3.42Å
337	A	96.1	Very high	94.7	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-65.4	-45.4	175.1	0	0	0	0	0	111.5	A305 T333 Y334 S340 N341 H342 I345 A346 I349	A305-A337 HydrophobicContact CB-CB 3.82Å; T333-A337 PolarHBondContact O-N 2.75Å; Y334-A337 PolarHBondContact O-N 2.95Å; Y334-A337 VanDerWaalsContact O-N 3.14Å; A337-S340 CarbonylContact O-C 3.55Å; A337-S340 PolarHBondContact O-N 2.88Å; A337-N341 PolarHBondContact O-N 2.85Å; A337-N341 VanDerWaalsContact O-N 3.15Å; A337-H342 PolarHBondContact O-N 3.1Å; A337-I345 HydrophobicContact CB-CG2 4.41Å; A337-A346 HydrophobicContact CB-CB 3.78Å; A337-I349 HydrophobicContact CB-CD1 4.49Å
338	M	95.3	Very high	94.6	Very high	75 Å²	75	59.9 Å²	59.9	37%	0.369	31%	0.305	S	S	.	.	H	α-helix	trans	-59.1	-49.1	174.5	-75.8	-83.6	108.3	0	0	112.3	Y334 E335 S340 N341 I343 A346	Y334-M338 HydrophobicContact CD1-CG 4.39Å; Y334-M338 HydrophobicContact CE1-CG 3.92Å; Y334-M338 HydrophobicContact CE2-CG 4.41Å; Y334-M338 PolarHBondContact O-N 3.24Å; E335-M338 PolarHBondContact O-N 3.25Å; M338-S340 PolarHBondContact O-N 3.44Å; M338-N341 PolarHBondContact O-N 3.35Å; M338-I343 HydrophobicContact CE-CG1 4.43Å; M338-I343 HydrophobicContact CE-CG2 4.42Å; M338-A346 HydrophobicContact CE-CB 3.37Å; M338-A346 HydrophobicContact CG-CB 4.08Å
339	I	94.6	Very high	94.6	Very high	106 Å²	106	53.9 Å²	53.9	54%	0.544	28%	0.279	S	S	.	.	H	α-helix	trans	-62.2	-28.3	177.6	-70.3	165.4	0	0	0	112	H331 E335 N341	H331-I339 VanDerWaalsContact CE1-CD1 3.43Å; H331-I339 WeakPolarHBondContact CE1-CD1 3.2Å; E335-I339 WeakPolarHBondContact O-CB 3.09Å; E335-I339 WeakPolarHBondContact O-CD1 3.31Å; E335-I339 WeakPolarHBondContact O-CG1 3.41Å; E335-I339 PolarHBondContact O-N 3.02Å; I339-N341 VanDerWaalsContact C-N 3.34Å
340	S	94.1	Very high	94.6	Very high	25 Å²	25	54.9 Å²	54.9	18%	0.175	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	4.1	178.1	-43.6	0	0	0	0	113.1	Q336 A337 M338 H342	Q336-S340 PolarHBondContact NE2-OG 2.88Å; Q336-S340 VanDerWaalsContact NE2-OG 3.12Å; Q336-S340 WeakPolarHBondContact O-CB 3.36Å; Q336-S340 PolarHBondContact O-N 3.32Å; Q336-S340 PolarHBondContact O-OG 3.42Å; A337-S340 CarbonylContact O-C 3.55Å; A337-S340 PolarHBondContact O-N 2.88Å; M338-S340 PolarHBondContact O-N 3.44Å; S340-H342 WeakPolarHBondContact CB-ND1 3.44Å; S340-H342 PolarHBondContact O-N 2.96Å
341	N	94.2	Very high	94.4	Very high	126 Å²	126	55.4 Å²	55.4	67%	0.674	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	25.4	-175.1	-160	45.5	0	0	0	115.4	A337 M338 I339 I343	A337-N341 PolarHBondContact O-N 2.85Å; A337-N341 VanDerWaalsContact O-N 3.15Å; M338-N341 PolarHBondContact O-N 3.35Å; I339-N341 VanDerWaalsContact C-N 3.34Å; N341-I343 VanDerWaalsContact C-N 3.35Å; N341-I343 PolarHBondContact O-N 3.42Å
342	H	95.2	Very high	94.2	Very high	59 Å²	59	54 Å²	54	27%	0.273	28%	0.276	S	S	.	.			trans	-91	69.9	175.1	-63.5	125.7	0	0	0	110.5	A305 Y306 G308 A337 S340 E344 I345 A346	A305-H342 PolarHBondContact O-ND1 3.31Å; Y306-H342 PolarHBondContact O-CE1 3.22Å; Y306-H342 VanDerWaalsContact O-CE1 3.28Å; G308-H342 PolarHBondContact N-CE1 3.22Å; G308-H342 VanDerWaalsContact N-CE1 3.27Å; G308-H342 PolarHBondContact N-ND1 2.79Å; A337-H342 PolarHBondContact O-N 3.1Å; S340-H342 WeakPolarHBondContact CB-ND1 3.44Å; S340-H342 PolarHBondContact O-N 2.96Å; H342-E344 VanDerWaalsContact C-N 3.34Å; H342-E344 PolarHBondContact O-N 2.96Å; H342-I345 HydrophobicContact CB-CB 4.28Å; H342-I345 HydrophobicContact CB-CD1 4.28Å; H342-I345 HydrophobicContact CB-CG1 4.4Å; H342-I345 PolarHBondContact O-N 3.16Å; H342-I345 VanDerWaalsContact O-N 3.13Å; H342-A346 PolarHBondContact O-N 2.8Å
343	I	93.9	Very high	93.7	Very high	90 Å²	90	58 Å²	58	46%	0.462	29%	0.293	S	S	.	.	H	α-helix	trans	-54.9	-47.6	-174.1	-56.7	175.5	0	0	0	111.3	M338 N341 I345 A346 D347	M338-I343 HydrophobicContact CE-CG1 4.43Å; M338-I343 HydrophobicContact CE-CG2 4.42Å; N341-I343 VanDerWaalsContact C-N 3.35Å; N341-I343 PolarHBondContact O-N 3.42Å; I343-I345 VanDerWaalsContact C-N 3.26Å; I343-I345 PolarHBondContact O-N 3.32Å; I343-A346 WeakPolarHBondContact O-CA 3.25Å; I343-A346 WeakPolarHBondContact O-CB 3.35Å; I343-A346 PolarHBondContact O-N 2.86Å; I343-D347 PolarHBondContact O-N 3.14Å
344	E	93.8	Very high	93.1	Very high	150 Å²	150	66.7 Å²	66.7	70%	0.701	33%	0.334	S	S	*	.	H	α-helix	trans	-54.1	-41	179	-59.9	175.6	156.9	0	0	112.5	H342 L348	H342-E344 VanDerWaalsContact C-N 3.34Å; H342-E344 PolarHBondContact O-N 2.96Å; E344-L348 WeakPolarHBondContact O-CB 3.34Å; E344-L348 PolarHBondContact O-N 3.41Å
345	I	94.8	Very high	92.4	Very high	3 Å²	3	69.9 Å²	69.9	2%	0.015	35%	0.351	C	S	.	.	H	α-helix	trans	-75.7	-34.1	179.1	-59.5	-177.6	0	0	0	111.1	C304 E310 A313 A337 H342 I343 L348 I349	C304-I345 WeakPolarHBondContact O-CD1 3.34Å; E310-I345 HydrophobicContact CB-CD1 4.07Å; E310-I345 HydrophobicContact CB-CG1 3.88Å; E310-I345 HydrophobicContact CG-CG1 4.09Å; A313-I345 HydrophobicContact CB-CG2 4.04Å; A337-I345 HydrophobicContact CB-CG2 4.41Å; H342-I345 HydrophobicContact CB-CB 4.28Å; H342-I345 HydrophobicContact CB-CD1 4.28Å; H342-I345 HydrophobicContact CB-CG1 4.4Å; H342-I345 PolarHBondContact O-N 3.16Å; H342-I345 VanDerWaalsContact O-N 3.13Å; I343-I345 VanDerWaalsContact C-N 3.26Å; I343-I345 PolarHBondContact O-N 3.32Å; I345-L348 PolarHBondContact O-N 3.43Å; I345-I349 HydrophobicContact CG2-CD1 3.81Å; I345-I349 HydrophobicContact CG2-CG1 4.35Å; I345-I349 WeakPolarHBondContact O-CB 3.28Å; I345-I349 WeakPolarHBondContact O-CD1 3.35Å; I345-I349 VanDerWaalsContact O-CG1 3.23Å; I345-I349 WeakPolarHBondContact O-CG1 3.25Å; I345-I349 PolarHBondContact O-N 2.74Å
346	A	95.1	Very high	91.9	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-66.1	-46.7	175.3	0	0	0	0	0	111.3	Y334 A337 M338 H342 I343 L348 I349 K350	Y334-A346 HydrophobicContact CD2-CB 3.94Å; Y334-A346 VanDerWaalsContact CD2-O 3.29Å; Y334-A346 WeakPolarHBondContact CD2-O 3.33Å; Y334-A346 HydrophobicContact CE2-CB 3.81Å; Y334-A346 WeakPolarHBondContact CE2-O 3.43Å; A337-A346 HydrophobicContact CB-CB 3.78Å; M338-A346 HydrophobicContact CE-CB 3.37Å; M338-A346 HydrophobicContact CG-CB 4.08Å; H342-A346 PolarHBondContact O-N 2.8Å; I343-A346 WeakPolarHBondContact O-CA 3.25Å; I343-A346 WeakPolarHBondContact O-CB 3.35Å; I343-A346 PolarHBondContact O-N 2.86Å; A346-L348 VanDerWaalsContact C-N 3.29Å; A346-L348 PolarHBondContact O-N 3.47Å; A346-I349 PolarHBondContact O-N 2.94Å; A346-K350 WeakPolarHBondContact O-CB 3.29Å; A346-K350 PolarHBondContact O-N 2.93Å
347	D	94.8	Very high	91.5	Very high	82 Å²	82	67.4 Å²	67.4	44%	0.439	34%	0.342	S	S	.	.	H	α-helix	trans	-63.7	-35.7	175.5	-76.1	-35.1	0	0	0	112	I343 K350 G351	I343-D347 PolarHBondContact O-N 3.14Å; D347-K350 PolarHBondContact O-N 3.45Å; D347-G351 PolarHBondContact O-N 2.92Å
348	L	94	Very high	90.8	Very high	22 Å²	22	69 Å²	69	12%	0.115	35%	0.352	C	S	.	.	H	α-helix	trans	-64.2	-49.5	173.1	-165.8	170.6	0	0	0	111.9	E310 R314 L317 E344 I345 A346 K350 G351 F352	E310-L348 HydrophobicContact CG-CD1 3.75Å; R314-L348 HydrophobicContact CG-CD1 3.64Å; R314-L348 HydrophobicContact CG-CD2 4.38Å; R314-L348 HydrophobicContact CG-CG 4.46Å; L317-L348 HydrophobicContact CD1-CD2 3.39Å; E344-L348 WeakPolarHBondContact O-CB 3.34Å; E344-L348 PolarHBondContact O-N 3.41Å; I345-L348 PolarHBondContact O-N 3.43Å; A346-L348 VanDerWaalsContact C-N 3.29Å; A346-L348 PolarHBondContact O-N 3.47Å; L348-K350 VanDerWaalsContact C-N 3.26Å; L348-K350 PolarHBondContact O-N 3.24Å; L348-G351 PolarHBondContact O-N 2.84Å; L348-F352 VanDerWaalsContact O-CB 3.23Å; L348-F352 WeakPolarHBondContact O-CB 3.26Å; L348-F352 PolarHBondContact O-N 2.81Å
349	I	93.6	Very high	89.9	Confident	3 Å²	3	68.2 Å²	68.2	2%	0.015	35%	0.352	C	S	.	.	H	α-helix	trans	-60.8	-37.4	175.7	-70.9	164.5	0	0	0	111.2	L301 L317 K323 A337 I345 A346	L301-I349 HydrophobicContact CD1-CD1 4.49Å; L317-I349 HydrophobicContact CD1-CG1 4.09Å; K323-I349 HydrophobicContact CB-CG2 4Å; K323-I349 HydrophobicContact CD-CG2 4.05Å; K323-I349 WeakPolarHBondContact CD-O 3.49Å; K323-I349 PolarHBondContact NZ-O 3Å; A337-I349 HydrophobicContact CB-CD1 4.49Å; I345-I349 HydrophobicContact CG2-CD1 3.81Å; I345-I349 HydrophobicContact CG2-CG1 4.35Å; I345-I349 WeakPolarHBondContact O-CB 3.28Å; I345-I349 WeakPolarHBondContact O-CD1 3.35Å; I345-I349 VanDerWaalsContact O-CG1 3.23Å; I345-I349 WeakPolarHBondContact O-CG1 3.25Å; I345-I349 PolarHBondContact O-N 2.74Å; A346-I349 PolarHBondContact O-N 2.94Å
350	K	92.2	Very high	88.9	Confident	129 Å²	129	64.4 Å²	64.4	56%	0.561	33%	0.333	S	S	*	.	H	α-helix	trans	-70.1	-47.6	179.5	-179	179.1	173.2	-171.2	0	112.1	Y334 A346 D347 L348	Y334-K350 HydrophobicContact CD2-CB 4.12Å; Y334-K350 HydrophobicContact CE2-CB 3.89Å; Y334-K350 HydrophobicContact CE2-CD 3.88Å; Y334-K350 HydrophobicContact CE2-CG 4.35Å; A346-K350 WeakPolarHBondContact O-CB 3.29Å; A346-K350 PolarHBondContact O-N 2.93Å; D347-K350 PolarHBondContact O-N 3.45Å; L348-K350 VanDerWaalsContact C-N 3.26Å; L348-K350 PolarHBondContact O-N 3.24Å
351	G	89.7	Confident	87.5	Confident	45 Å²	45	70.2 Å²	70.2	46%	0.464	35%	0.351	S	S	.	.	H	α-helix	trans	-80.4	-11.3	179.8	0	0	0	0	0	115.5	D347 L348 H353	D347-G351 PolarHBondContact O-N 2.92Å; L348-G351 PolarHBondContact O-N 2.84Å; G351-H353 PolarHBondContact O-CD2 2.9Å; G351-H353 PolarHBondContact O-N 3.31Å; G351-H353 PolarHBondContact O-NE2 2.88Å
352	F	90	Very high	86.2	Confident	23 Å²	23	70.9 Å²	70.9	10%	0.101	35%	0.354	C	S	.	.			trans	-73.4	119.7	177.6	-173.7	-92.8	0	0	0	111.9	L317 F318 K323 L348 D356 V357	L317-F352 HydrophobicContact CB-CD1 3.9Å; L317-F352 HydrophobicContact CB-CD2 3.88Å; L317-F352 HydrophobicContact CB-CE1 3.88Å; L317-F352 HydrophobicContact CB-CE2 3.87Å; L317-F352 HydrophobicContact CB-CG 3.91Å; L317-F352 HydrophobicContact CB-CZ 3.88Å; L317-F352 HydrophobicContact CD1-CB 4.19Å; L317-F352 HydrophobicContact CD1-CG 4.19Å; L317-F352 HydrophobicContact CD2-CD1 3.9Å; L317-F352 HydrophobicContact CD2-CE1 4.37Å; L317-F352 HydrophobicContact CD2-CG 4.28Å; L317-F352 HydrophobicContact CG-CD1 4.36Å; L317-F352 HydrophobicContact CG-CG 4.36Å; L317-F352 WeakPolarHBondContact O-CE1 3.32Å; L317-F352 WeakPolarHBondContact O-CZ 3.47Å; F318-F352 AromaticContact CD1-CE2 3.74Å; F318-F352 HydrophobicContact CD1-CE2 3.74Å; F318-F352 HydrophobicContact CD1-CZ 4.34Å; F318-F352 AromaticContact CE1-CE2 3.92Å; F318-F352 HydrophobicContact CE1-CE2 3.92Å; F318-F352 HydrophobicContact CG-CE2 4.31Å; K323-F352 PolarHBondContact NZ-O 2.94Å; L348-F352 VanDerWaalsContact O-CB 3.23Å; L348-F352 WeakPolarHBondContact O-CB 3.26Å; L348-F352 PolarHBondContact O-N 2.81Å; F352-D356 HydrophobicContact CE2-CB 3.96Å; F352-D356 HydrophobicContact CZ-CB 4.14Å; F352-V357 HydrophobicContact CE1-CG2 3.59Å; F352-V357 HydrophobicContact CZ-CG2 3.81Å
353	H	86.4	Confident	85.2	Confident	111 Å²	111	74.9 Å²	74.9	51%	0.514	37%	0.368	S	S	.	.			trans	-98.7	148.8	179.3	-60.3	-79.4	0	0	0	111.9	G351 Q355 D356	G351-H353 PolarHBondContact O-CD2 2.9Å; G351-H353 PolarHBondContact O-N 3.31Å; G351-H353 PolarHBondContact O-NE2 2.88Å; H353-Q355 PolarHBondContact O-N 3.24Å; H353-D356 WeakPolarHBondContact O-CB 3.48Å; H353-D356 PolarHBondContact O-N 3.37Å
354	E	81.4	Confident	84.5	Confident	181 Å²	181	73.7 Å²	73.7	85%	0.846	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-63	-24.1	-178.6	-165.7	172.1	169.4	0	0	113.2	D356 V357	E354-D356 PolarHBondContact O-N 2.82Å; E354-V357 VanDerWaalsContact O-CB 3.31Å; E354-V357 WeakPolarHBondContact O-CB 3.36Å; E354-V357 VanDerWaalsContact O-CG2 3.31Å; E354-V357 WeakPolarHBondContact O-CG2 3.37Å; E354-V357 PolarHBondContact O-N 2.88Å
355	Q	81.6	Confident	83.5	Confident	143 Å²	143	75 Å²	75	67%	0.668	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-61.9	-28.7	172.7	-63.4	176.7	-2.6	0	0	113.2	H353 V357	H353-Q355 PolarHBondContact O-N 3.24Å; Q355-V357 PolarHBondContact O-N 2.91Å
356	D	84.8	Confident	82.8	Confident	18 Å²	18	78.3 Å²	78.3	10%	0.096	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-83.8	1.1	-178.2	-54.8	-47.7	0	0	0	112.2	F352 H353 E354 V1009 R1013	F352-D356 HydrophobicContact CE2-CB 3.96Å; F352-D356 HydrophobicContact CZ-CB 4.14Å; H353-D356 WeakPolarHBondContact O-CB 3.48Å; H353-D356 PolarHBondContact O-N 3.37Å; E354-D356 PolarHBondContact O-N 2.82Å; D356-V1009 HydrophobicContact CB-CG1 4.32Å; D356-V1009 WeakPolarHBondContact OD1-CG1 3.29Å; D356-R1013 IonicContact OD1-CZ 2.74Å; D356-R1013 IonicContact OD1-NE 3.19Å; D356-R1013 PolarHBondContact OD1-NE 2.86Å; D356-R1013 VanDerWaalsContact OD1-NE 3.15Å; D356-R1013 IonicContact OD1-NH2 3.15Å; D356-R1013 PolarHBondContact OD1-NH2 3.37Å; D356-R1013 IonicContact OD2-NH2 2.71Å; D356-R1013 PolarHBondContact OD2-NH2 2.88Å
357	V	85.2	Confident	81.7	Confident	24 Å²	24	79.7 Å²	79.7	15%	0.145	39%	0.385	C	S	.	.			trans	-74.8	134.1	178.2	179.4	0	0	0	0	111.6	F352 E354 Q355 P359 R1012	F352-V357 HydrophobicContact CE1-CG2 3.59Å; F352-V357 HydrophobicContact CZ-CG2 3.81Å; E354-V357 VanDerWaalsContact O-CB 3.31Å; E354-V357 WeakPolarHBondContact O-CB 3.36Å; E354-V357 VanDerWaalsContact O-CG2 3.31Å; E354-V357 WeakPolarHBondContact O-CG2 3.37Å; E354-V357 PolarHBondContact O-N 2.88Å; Q355-V357 PolarHBondContact O-N 2.91Å; V357-P359 HydrophobicContact CG1-CG 4Å; V357-P359 WeakPolarHBondContact O-CD 3.35Å; V357-R1012 PolarHBondContact O-NH1 3.49Å
358	V	83	Confident	80.6	Confident	35 Å²	35	83 Å²	83	21%	0.212	40%	0.402	C	S	.	.			trans	-123	80.4	-178.9	-173.8	0	0	0	0	108.8	F318 W1217	F318-V358 CarbonylContact O-C 3.56Å; F318-V358 WeakPolarHBondContact O-CA 3.4Å; F318-V358 PolarHBondContact O-N 2.85Å; V358-W1217 HydrophobicContact CG1-CE3 4.35Å; V358-W1217 HydrophobicContact CG1-CH2 3.66Å; V358-W1217 HydrophobicContact CG1-CZ3 3.4Å; V358-W1217 VanDerWaalsContact CG1-CZ3 3.4Å
359	P	74.7	Confident	78.8	Confident	58 Å²	58	90.7 Å²	90.7	38%	0.377	43%	0.43	S	S	.	.			trans	-62.9	150.1	-173.2	-21.3	32.6	0	0	0	113.1	V357 R361 W1217	V357-P359 HydrophobicContact CG1-CG 4Å; V357-P359 WeakPolarHBondContact O-CD 3.35Å; P359-R361 PolarHBondContact O-N 3.42Å; P359-W1217 VanDerWaalsContact O-CH2 3.24Å; P359-W1217 WeakPolarHBondContact O-CH2 3.07Å
360	I	75.2	Confident	77.3	Confident	26 Å²	26	92.7 Å²	92.7	13%	0.133	44%	0.437	C	S	.	.			trans	-74.8	90.6	179.5	-53	177.1	0	0	0	109.6	L283 I289 R319 Y363	L283-I360 HydrophobicContact CB-CD1 3.79Å; L283-I360 HydrophobicContact CD2-CD1 4.44Å; L283-I360 WeakPolarHBondContact O-CD1 3.12Å; I289-I360 HydrophobicContact CD1-CD1 4.49Å; R319-I360 HydrophobicContact CB-CD1 4.41Å; R319-I360 HydrophobicContact CB-CG1 4.43Å; I360-Y363 HydrophobicContact CB-CE1 4.34Å; I360-Y363 HydrophobicContact CG2-CD1 3.81Å; I360-Y363 HydrophobicContact CG2-CE1 3.69Å
361	R	63.2	Low	75.6	Confident	147 Å²	147	95.3 Å²	95.3	56%	0.555	44%	0.443	S	S	*	.			trans	-75.8	-27.7	-176.6	-70.3	177.1	175.4	-179.8	-4.4	114.2	P359	P359-R361 PolarHBondContact O-N 3.42Å
362	N	67.4	Low	73.7	Confident	139 Å²	139	93.9 Å²	93.9	74%	0.743	43%	0.426	S	S	*	.	S	Bend	trans	-136.9	127.9	-179.2	-75.4	-54	0	0	0	110
363	Y	74.6	Confident	71.7	Confident	144 Å²	144	96.1 Å²	96.1	57%	0.565	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-87.2	151.7	172.8	-59.6	-63.2	0	0	0	111.6	A284 G286 I360	A284-Y363 CarbonylContact O-C 3.54Å; A284-Y363 WeakPolarHBondContact O-CA 3.48Å; G286-Y363 VanDerWaalsContact CA-CE1 3.42Å; I360-Y363 HydrophobicContact CB-CE1 4.34Å; I360-Y363 HydrophobicContact CG2-CD1 3.81Å; I360-Y363 HydrophobicContact CG2-CE1 3.69Å
364	L	78.1	Confident	69.5	Low	65 Å²	65	94.5 Å²	94.5	34%	0.34	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-63.4	142.3	177.5	-68	174.3	0	0	0	112.1	A284 Y285 R366	A284-L364 HydrophobicContact CB-CD1 3.67Å; A284-L364 HydrophobicContact CB-CG 3.98Å; A284-L364 PolarHBondContact O-N 3.15Å; Y285-L364 HydrophobicContact CD1-CB 4.04Å; Y285-L364 HydrophobicContact CD2-CB 4.34Å; Y285-L364 HydrophobicContact CD2-CD1 3.88Å; Y285-L364 HydrophobicContact CE1-CB 3.75Å; Y285-L364 HydrophobicContact CE2-CB 4.08Å; Y285-L364 HydrophobicContact CE2-CD1 3.54Å; Y285-L364 HydrophobicContact CE2-CG 4.46Å; Y285-L364 HydrophobicContact CG-CB 4.32Å; L364-R366 PolarHBondContact O-N 3.5Å
365	K	74.2	Confident	67.6	Low	178 Å²	178	94.5 Å²	94.5	77%	0.774	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-66.1	132.3	178	-66.9	-179.7	-179.2	176	0	109.8	F251	F251-K365 WeakPolarHBondContact CD2-O 3.25Å
366	R	78.8	Confident	65.7	Low	72 Å²	72	91.4 Å²	91.4	27%	0.272	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-97.2	161.6	172.2	-66.4	174.8	161.2	90.4	-10.3	111	F251 H253 Y285 L364 L368	F251-R366 CarbonylContact O-C 3.59Å; H253-R366 WeakPolarHBondContact CE1-CB 3.34Å; Y285-R366 HydrophobicContact CD1-CG 3.96Å; Y285-R366 HydrophobicContact CE1-CG 3.87Å; Y285-R366 VanDerWaalsContact O-CZ 3.25Å; Y285-R366 PolarHBondContact O-NH1 3.42Å; Y285-R366 PolarHBondContact O-NH2 2.63Å; L364-R366 PolarHBondContact O-N 3.5Å; R366-L368 WeakPolarHBondContact O-CD1 3.25Å; R366-L368 PolarHBondContact O-N 3.25Å
367	N	72	Confident	63.5	Low	28 Å²	28	99.3 Å²	99.3	15%	0.15	45%	0.445	C	S	.	.			trans	-63.8	109.9	-171.1	-172.1	-9.5	0	0	0	113.4	F251 D252 H253 R369 R370	F251-N367 HydrophobicContact CD1-CB 3.75Å; F251-N367 HydrophobicContact CE1-CB 3.47Å; F251-N367 VanDerWaalsContact CE1-CB 3.47Å; F251-N367 HydrophobicContact CE2-CB 4.38Å; F251-N367 HydrophobicContact CG-CB 4.33Å; F251-N367 HydrophobicContact CZ-CB 3.82Å; F251-N367 WeakPolarHBondContact O-CB 3.18Å; F251-N367 PolarHBondContact O-N 3.49Å; D252-N367 WeakPolarHBondContact OD1-CB 3.22Å; D252-N367 PolarHBondContact OD1-ND2 2.87Å; H253-N367 PolarHBondContact NE2-O 3.07Å; N367-R369 VanDerWaalsContact C-N 3.28Å; N367-R369 PolarHBondContact O-N 3.29Å; N367-R369 WeakPolarHBondContact OD1-CB 3.08Å; N367-R369 PolarHBondContact OD1-N 3.26Å; N367-R370 HydrophobicContact CB-CB 4.35Å; N367-R370 PolarHBondContact O-N 3.27Å
368	L	72.6	Confident	61	Low	153 Å²	153	101.3 Å²	101.3	80%	0.801	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-21.2	179	-71.3	90	0	0	0	113.9	R366 R370	R366-L368 WeakPolarHBondContact O-CD1 3.25Å; R366-L368 PolarHBondContact O-N 3.25Å; L368-R370 VanDerWaalsContact C-N 3.26Å; L368-R370 PolarHBondContact O-N 2.9Å
369	R	56.5	Low	58.7	Low	183 Å²	183	107.6 Å²	107.6	69%	0.691	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-16.1	177.7	-66.9	-175.5	169.8	-155.7	-10.4	112.9	N367 D441	N367-R369 VanDerWaalsContact C-N 3.28Å; N367-R369 PolarHBondContact O-N 3.29Å; N367-R369 WeakPolarHBondContact OD1-CB 3.08Å; N367-R369 PolarHBondContact OD1-N 3.26Å; R369-D441 IonicContact CZ-OD2 2.75Å; R369-D441 VanDerWaalsContact CZ-OD2 3.24Å; R369-D441 IonicContact NH1-OD2 2.78Å; R369-D441 PolarHBondContact NH1-OD2 3.09Å; R369-D441 IonicContact NH2-OD2 3.88Å; R369-D441 PolarHBondContact NH2-OD2 3.39Å
370	R	62.2	Low	56.8	Low	44 Å²	44	113 Å²	113	17%	0.166	51%	0.508	C	S	.	.	S	Bend	trans	-110.7	127.6	-177.6	-175.1	173.7	-89.4	-119	-6.4	109.9	L216 Q220 D252 H253 N367 L368 S372	L216-R370 PolarHBondContact O-NH2 2.86Å; Q220-R370 PolarHBondContact O-NH1 3.17Å; Q220-R370 PolarHBondContact O-NH2 2.95Å; D252-R370 WeakPolarHBondContact O-CD 3.5Å; D252-R370 IonicContact OD1-NE 2.73Å; H253-R370 PolarHBondContact NE2-O 3.23Å; H253-R370 VanDerWaalsContact NE2-O 3.15Å; N367-R370 HydrophobicContact CB-CB 4.35Å; N367-R370 PolarHBondContact O-N 3.27Å; L368-R370 VanDerWaalsContact C-N 3.26Å; L368-R370 PolarHBondContact O-N 2.9Å; R370-S372 PolarHBondContact O-N 3.38Å; R370-S372 VanDerWaalsContact O-N 3.16Å
371	R	55.9	Low	54.5	Low	185 Å²	185	123.1 Å²	123.1	70%	0.698	54%	0.544	S	S	*	.			trans	-62.7	116.6	-177.8	-75.6	-173.6	177.5	178.5	0.4	110.5	D91 F373	D91-R371 IonicContact OD1-CZ 3.71Å; D91-R371 IonicContact OD1-NH1 3.85Å; D91-R371 PolarHBondContact OD1-NH1 3.22Å; D91-R371 IonicContact OD2-NH1 2.72Å; R371-F373 PolarHBondContact O-N 3.04Å
372	S	50.2	Low	52.7	Low	14 Å²	14	121.6 Å²	121.6	10%	0.098	56%	0.555	C	S	.	*			trans	-72	117.8	176.4	57.9	0	0	0	0	111.5	H253 R370 S374 R375	H253-S372 VanDerWaalsContact CE1-CB 3.49Å; H253-S372 WeakPolarHBondContact CE1-CB 3.42Å; H253-S372 WeakPolarHBondContact ND1-CB 3.16Å; R370-S372 PolarHBondContact O-N 3.38Å; R370-S372 VanDerWaalsContact O-N 3.16Å; S372-S374 PolarHBondContact O-N 2.84Å; S372-S374 VanDerWaalsContact O-N 3.12Å; S372-R375 PolarHBondContact O-N 2.99Å; S372-R375 WeakPolarHBondContact OG-CD 3.36Å; S372-R375 VanDerWaalsContact OG-CG 3.3Å; S372-R375 WeakPolarHBondContact OG-CG 3.49Å; S372-R375 PolarHBondContact OG-NE 3.34Å
373	F	48.8	Very low	50.8	Low	70 Å²	70	120.4 Å²	120.4	31%	0.307	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-54.4	-32.7	-178.9	-167.4	-88.8	0	0	0	113.7	L46 R371 R375	L46-F373 HydrophobicContact CD1-CE2 4.07Å; L46-F373 HydrophobicContact CD1-CZ 3.81Å; L46-F373 HydrophobicContact CD2-CE2 3.63Å; L46-F373 HydrophobicContact CD2-CZ 3.78Å; L46-F373 HydrophobicContact CG-CE2 4.49Å; L46-F373 HydrophobicContact CG-CZ 4.35Å; R371-F373 PolarHBondContact O-N 3.04Å; F373-R375 VanDerWaalsContact C-N 3.33Å; F373-R375 PolarHBondContact O-N 2.85Å
374	S	39.9	Very low	48.6	Very low	78 Å²	78	119.6 Å²	119.6	55%	0.545	57%	0.573	S	S	.	*	H	α-helix	trans	-60.5	-32.6	-179.8	48.1	0	0	0	0	114.8	S372 I376 R377 S378	S372-S374 PolarHBondContact O-N 2.84Å; S372-S374 VanDerWaalsContact O-N 3.12Å; S374-I376 PolarHBondContact O-N 3.15Å; S374-I376 VanDerWaalsContact O-N 3.11Å; S374-R377 PolarHBondContact O-N 3.46Å; S374-S378 PolarHBondContact O-N 2.88Å; S374-S378 PolarHBondContact O-OG 3.41Å
375	R	40	Very low	46.2	Very low	180 Å²	180	124.8 Å²	124.8	68%	0.679	60%	0.597	S	S	*	*	H	α-helix	trans	-61.5	-22.8	-175.7	-82.7	-177.8	-166.7	-155.3	2.5	114.2	S372 F373 S378	S372-R375 PolarHBondContact O-N 2.99Å; S372-R375 WeakPolarHBondContact OG-CD 3.36Å; S372-R375 VanDerWaalsContact OG-CG 3.3Å; S372-R375 WeakPolarHBondContact OG-CG 3.49Å; S372-R375 PolarHBondContact OG-NE 3.34Å; F373-R375 VanDerWaalsContact C-N 3.33Å; F373-R375 PolarHBondContact O-N 2.85Å; R375-S378 PolarHBondContact O-OG 3.08Å
376	I	42.4	Very low	44	Very low	78 Å²	78	119.6 Å²	119.6	40%	0.4	59%	0.594	S	S	.	*	H	α-helix	trans	-96.4	-29.8	-173.3	-35.8	177.9	0	0	0	111.9	M88 S374	M88-I376 HydrophobicContact CE-CB 3.82Å; M88-I376 HydrophobicContact CE-CD1 4.21Å; M88-I376 HydrophobicContact CE-CG2 3.67Å; M88-I376 HydrophobicContact SD-CB 4.28Å; M88-I376 HydrophobicContact SD-CD1 4.04Å; M88-I376 HydrophobicContact SD-CG2 3.61Å; S374-I376 PolarHBondContact O-N 3.15Å; S374-I376 VanDerWaalsContact O-N 3.11Å
377	R	37.8	Very low	41.6	Very low	185 Å²	185	127.8 Å²	127.8	70%	0.698	63%	0.625	S	S	*	*	H	α-helix	trans	-79.1	-25.8	171.5	-87.7	-169.5	175.5	-174.3	0.5	113.8	S374 Q379	S374-R377 PolarHBondContact O-N 3.46Å; R377-Q379 VanDerWaalsContact C-N 3.3Å; R377-Q379 PolarHBondContact O-N 3Å
378	S	33.9	Very low	39.4	Very low	66 Å²	66	134.6 Å²	134.6	46%	0.462	66%	0.66	S	S	.	*	G	3₁₀ helix	trans	-69.9	-22.1	-178.1	56.1	0	0	0	0	114.3	S374 R375 Q380 R381	S374-S378 PolarHBondContact O-N 2.88Å; S374-S378 PolarHBondContact O-OG 3.41Å; R375-S378 PolarHBondContact O-OG 3.08Å; S378-Q380 PolarHBondContact O-N 3.04Å; S378-R381 PolarHBondContact O-N 3.07Å
379	Q	34.1	Very low	37.2	Very low	166 Å²	166	135.5 Å²	135.5	78%	0.776	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-74.1	-4.6	-176.9	-72.6	-170.2	-35.9	0	0	115.1	R377	R377-Q379 VanDerWaalsContact C-N 3.3Å; R377-Q379 PolarHBondContact O-N 3Å
380	Q	35	Very low	35.8	Very low	173 Å²	173	135 Å²	135	81%	0.808	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-101	-1	172.1	-76.3	-171.6	-19.3	0	0	114.7	S378	S378-Q380 PolarHBondContact O-N 3.04Å
381	R	26.6	Very low	34.1	Very low	238 Å²	238	142.9 Å²	142.9	90%	0.898	71%	0.707	S	S	*	*	S	Bend	trans	-144.3	48.8	176.1	-76.2	-162.9	176.9	-177.5	0.3	114.7	S378	S378-R381 PolarHBondContact O-N 3.07Å
382	C	25.9	Very low	32.7	Very low	115 Å²	115	139.1 Å²	139.1	78%	0.777	71%	0.71	S	S	*	*			trans	-139.5	110.6	156.9	-90	0	0	0	0	109.6	S384	C382-S384 PolarHBondContact O-N 3.24Å
383	S	28.1	Very low	31.7	Very low	113 Å²	113	147.7 Å²	147.7	79%	0.79	75%	0.745	S	S	*	*			trans	-63.3	131.5	171	-53.4	0	0	0	0	110	M385	S383-M385 PolarHBondContact O-N 3.29Å
384	S	28.2	Very low	30.7	Very low	128 Å²	128	153.7 Å²	153.7	90%	0.895	77%	0.774	S	S	*	*			trans	-71.6	87.7	172	53.3	0	0	0	0	110.7	C382	C382-S384 PolarHBondContact O-N 3.24Å
385	M	27.3	Very low	30.1	Very low	174 Å²	174	158 Å²	158	86%	0.857	79%	0.791	S	S	*	*			trans	-121.9	136.9	164.5	-65.6	-158.9	-55.3	0	0	109.6	S383	S383-M385 PolarHBondContact O-N 3.29Å
386	G	27.2	Very low	29.6	Very low	68 Å²	68	153.2 Å²	153.2	70%	0.701	80%	0.797	S	S	*	*	S	Bend	trans	99.4	53.1	168.4	0	0	0	0	0	116.9
387	R	29	Very low	28.9	Very low	244 Å²	244	156 Å²	156	92%	0.921	82%	0.818	S	S	*	*	S	Bend	trans	-176	157.5	138.9	-96.8	147	-154.4	-116.9	2.5	110.9
388	L	26.7	Very low	28.4	Very low	172 Å²	172	153.1 Å²	153.1	90%	0.901	82%	0.821	S	S	*	*			trans	62.4	80.1	176.8	-54.8	178.7	0	0	0	115.1
389	N	25.4	Very low	28.1	Very low	171 Å²	171	158.2 Å²	158.2	91%	0.914	84%	0.838	S	S	*	*			trans	-140.5	65.8	154.8	-159.4	36	0	0	0	109.5
390	E	26.7	Very low	27.9	Very low	173 Å²	173	155.7 Å²	155.7	81%	0.808	83%	0.833	S	S	*	*			trans	-150.3	160.6	178	-127.6	164.8	-157.2	0	0	108.4
391	F	28.3	Very low	27.5	Very low	209 Å²	209	155 Å²	155	92%	0.917	84%	0.835	S	S	*	*			trans	63.3	62.4	-168.8	-60	-80.8	0	0	0	115.6
392	S	25.4	Very low	27.6	Very low	107 Å²	107	147.4 Å²	147.4	75%	0.748	83%	0.831	S	S	*	*			trans	-102.8	149.8	141.7	59.1	0	0	0	0	109.2
393	K	28.7	Very low	27.8	Very low	193 Å²	193	149.5 Å²	149.5	84%	0.839	83%	0.834	S	S	*	*			trans	88	97	-171.1	-55.2	168.7	179.4	174.6	0	115.6
394	Q	29.3	Very low	27.9	Very low	197 Å²	197	149.5 Å²	149.5	92%	0.921	83%	0.831	S	S	*	*				-157.4	160.8	91.4	-98.8	175.2	39.7	0	0	110.9
395	N	26.7	Very low	27.9	Very low	168 Å²	168	151.7 Å²	151.7	90%	0.898	83%	0.828	S	S	*	*			trans	-94.9	159.3	-171.4	-51.5	-19.1	0	0	0	111.1
396	G	28.9	Very low	27.9	Very low	79 Å²	79	151.8 Å²	151.8	81%	0.814	82%	0.823	S	S	*	*			trans	171.8	108.9	166.3	0	0	0	0	0	113
397	T	27.5	Very low	28	Very low	137 Å²	137	156.6 Å²	156.6	84%	0.84	83%	0.828	S	S	*	*			trans	-120.9	133.2	-177.5	47.8	0	0	0	0	111.8
398	T	28.7	Very low	28	Very low	124 Å²	124	153.5 Å²	153.5	76%	0.761	82%	0.823	S	S	*	*			trans	-173.3	131.9	156	23	0	0	0	0	106.2
399	E	26.4	Very low	28.1	Very low	174 Å²	174	152.1 Å²	152.1	81%	0.813	82%	0.817	S	S	*	*				73.1	130.4	63.9	-73.7	-174.2	171.3	0	0	113.1
400	V	29.9	Very low	28.4	Very low	112 Å²	112	152.2 Å²	152.2	68%	0.679	81%	0.812	S	S	*	*			cis	-152.1	173.5	-10.8	-147.4	0	0	0	0	109.4
401	D	26.3	Very low	28.3	Very low	159 Å²	159	148.7 Å²	148.7	85%	0.85	81%	0.805	S	S	*	*			trans	68.9	154.5	150.7	-65.5	-37.4	0	0	0	122.2
402	G	29.7	Very low	28.2	Very low	79 Å²	79	145.5 Å²	145.5	81%	0.814	80%	0.798	S	S	*	*			trans	131.1	59.3	161.7	0	0	0	0	0	119.3
403	L	30	Very low	28.2	Very low	158 Å²	158	146.3 Å²	146.3	83%	0.827	80%	0.798	S	S	*	*			trans	-84.9	150	160.7	-107	168	0	0	0	110.1
404	P	30.6	Very low	28.3	Very low	114 Å²	114	145.2 Å²	145.2	74%	0.74	80%	0.8	S	S	*	*				-149.4	-174.5	86.4	40.8	-22.4	0	0	0	116.1
405	E	26.6	Very low	28.3	Very low	174 Å²	174	145.7 Å²	145.7	81%	0.813	80%	0.799	S	S	*	*			trans	-87.1	-149	179.4	-57.9	170.7	97.4	0	0	113.1
406	F	28.9	Very low	28.4	Very low	175 Å²	175	141.2 Å²	141.2	77%	0.768	79%	0.794	S	S	*	*			trans	88.6	130.6	-175.4	-63.3	-76.8	0	0	0	116
407	E	28.2	Very low	28.6	Very low	170 Å²	170	144.8 Å²	144.8	79%	0.794	79%	0.794	S	S	*	*			cis	-154.1	168.1	-14.8	-156.1	160	-150.4	0	0	109.7
408	Q	28.3	Very low	28.6	Very low	178 Å²	178	149.3 Å²	149.3	83%	0.832	80%	0.796	S	S	*	*			trans	-86.1	139.6	168.2	-63.7	177.5	-2.6	0	0	109.2
409	D	30	Very low	28.5	Very low	143 Å²	143	151.6 Å²	151.6	77%	0.765	80%	0.799	S	S	*	*			trans	-158.5	148.5	146.2	-125.1	-3.3	0	0	0	120.6
410	H	30.8	Very low	28.6	Very low	174 Å²	174	149.7 Å²	149.7	81%	0.806	79%	0.793	S	S	*	*			trans	57	134.7	152.1	-86	68.2	0	0	0	124.9
411	C	24.3	Very low	28.5	Very low	99 Å²	99	156 Å²	156	67%	0.669	81%	0.805	S	S	*	*			trans	-98.1	161.3	-167.7	-145	0	0	0	0	113.1
412	N	26.4	Very low	28.4	Very low	142 Å²	142	155.2 Å²	155.2	76%	0.759	80%	0.801	S	S	*	*			trans	55.9	128	151.6	-62.7	-37.2	0	0	0	120.8
413	T	26.2	Very low	28.4	Very low	124 Å²	124	158.3 Å²	158.3	76%	0.761	80%	0.799	S	S	*	*				162.8	125.8	99.7	-68.5	0	0	0	0	112.1
414	L	31.1	Very low	28.1	Very low	169 Å²	169	156.4 Å²	156.4	89%	0.885	79%	0.794	S	S	*	*				-177.6	143.1	128.6	-100.6	164	0	0	0	112.1
415	K	27.9	Very low	28	Very low	207 Å²	207	162 Å²	162	90%	0.9	80%	0.8	S	S	*	*			trans	-107.6	139.9	177.1	-65.9	168.4	179.8	166.4	0	109.3
416	G	30.6	Very low	28	Very low	75 Å²	75	158.5 Å²	158.5	77%	0.773	79%	0.785	S	S	*	*			trans	-156.2	117.4	177.6	0	0	0	0	0	114.3
417	N	31.7	Very low	27.8	Very low	153 Å²	153	155 Å²	155	82%	0.818	77%	0.774	S	S	*	*			trans	-46.1	129.7	-177.5	-64.1	-42.7	0	0	0	115.3
418	R	27.6	Very low	27.8	Very low	233 Å²	233	148.4 Å²	148.4	88%	0.879	75%	0.746	S	S	*	*				51.5	113.7	86.4	-66.7	-175	179.4	-173.1	3.1	115.7
419	M	27.4	Very low	27.7	Very low	171 Å²	171	141.8 Å²	141.8	84%	0.842	72%	0.719	S	S	*	*				-170.2	119.9	105.2	-102.9	-162.9	178.5	0	0	115.6
420	I	27.6	Very low	27.7	Very low	134 Å²	134	136.4 Å²	136.4	69%	0.687	69%	0.69	S	S	*	*				34.7	114.9	128.9	-50.9	169.6	0	0	0	119.1
421	R	28.4	Very low	27.9	Very low	246 Å²	246	129.4 Å²	129.4	93%	0.928	66%	0.661	S	S	*	*				-150.3	155	128.2	-109.5	170.5	-166	178.4	5.3	110.6
422	N	24.3	Very low	28.1	Very low	142 Å²	142	127.3 Å²	127.3	76%	0.759	66%	0.655	S	S	*	*			trans	-82.2	136.6	-165.7	-58.4	-42	0	0	0	112.9
423	N	29.1	Very low	28.7	Very low	143 Å²	143	122.9 Å²	122.9	77%	0.765	63%	0.628	S	S	*	*			trans	-155.5	143.4	143.3	-105.1	-25	0	0	0	110.1
424	T	25.1	Very low	28.8	Very low	118 Å²	118	123 Å²	123	72%	0.724	62%	0.621	S	S	*	*			trans	-120.2	73.6	-161.1	-44.3	0	0	0	0	112.3
425	W	27.8	Very low	28.8	Very low	233 Å²	233	117.5 Å²	117.5	88%	0.883	59%	0.591	S	S	*	*			trans	-107.7	136.7	172.7	-70.3	-38.8	0	0	0	111.9
426	M	26.2	Very low	28.8	Very low	100 Å²	100	112.2 Å²	112.2	49%	0.493	57%	0.573	S	S	.	*			trans	-106.4	111.1	-172.9	-58.9	-163.8	-135.3	0	0	110.9	T428	M426-T428 HydrophobicContact CB-CG2 4.06Å; M426-T428 WeakPolarHBondContact O-CG2 3.46Å; M426-T428 PolarHBondContact O-N 2.97Å; M426-T428 PolarHBondContact O-OG1 3.39Å
427	N	25.8	Very low	28.8	Very low	101 Å²	101	112.3 Å²	112.3	54%	0.54	56%	0.562	S	S	.	*			trans	-63.6	90.2	173.2	-71.5	-14	0	0	0	110.7	R111 S429 N436	R111-N427 PolarHBondContact NH1-O 2.74Å; N427-S429 PolarHBondContact O-N 3.18Å; N427-N436 PolarHBondContact OD1-ND2 3.07Å
428	T	28.1	Very low	28.7	Very low	32 Å²	32	110 Å²	110	20%	0.196	55%	0.547	C	S	.	.			trans	-100.1	50.9	-171	38.3	0	0	0	0	112.2	M426 I430	M426-T428 HydrophobicContact CB-CG2 4.06Å; M426-T428 WeakPolarHBondContact O-CG2 3.46Å; M426-T428 PolarHBondContact O-N 2.97Å; M426-T428 PolarHBondContact O-OG1 3.39Å; T428-I430 PolarHBondContact O-N 2.8Å
429	S	26.4	Very low	28.9	Very low	38 Å²	38	105.5 Å²	105.5	27%	0.266	55%	0.546	S	S	.	.			trans	-70.2	66.9	174.3	41.7	0	0	0	0	113	R111 N427 Y433	R111-S429 VanDerWaalsContact NH2-C 3.29Å; R111-S429 PolarHBondContact NH2-O 3.49Å; R111-S429 PolarHBondContact NH2-OG 3.21Å; N427-S429 PolarHBondContact O-N 3.18Å; S429-Y433 WeakPolarHBondContact CA-O 3.41Å; S429-Y433 WeakPolarHBondContact CB-O 3.48Å
430	I	30.2	Very low	28.8	Very low	31 Å²	31	102.5 Å²	102.5	16%	0.159	54%	0.542	C	S	.	.	G	3₁₀ helix	trans	-75.4	148.6	163.8	-71.4	169.7	0	0	0	107.9	T428 G432 Y433	T428-I430 PolarHBondContact O-N 2.8Å; I430-G432 PolarHBondContact O-N 2.72Å; I430-Y433 PolarHBondContact O-N 2.94Å
431	S	34.2	Very low	28.8	Very low	27 Å²	27	100.2 Å²	100.2	19%	0.189	53%	0.531	C	S	.	.	G	3₁₀ helix	trans	47.4	31	-178	44.8	0	0	0	0	116.5	Q84 Y433	Q84-S431 PolarHBondContact NE2-O 3.36Å; S431-Y433 VanDerWaalsContact C-N 3.33Å; S431-Y433 PolarHBondContact O-N 3.4Å; S431-Y433 WeakPolarHBondContact OG-CD2 3.26Å; S431-Y433 VanDerWaalsContact OG-CE2 3.31Å; S431-Y433 WeakPolarHBondContact OG-CE2 3.23Å
432	G	29.3	Very low	28.8	Very low	54 Å²	54	92.6 Å²	92.6	56%	0.557	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	81.2	5	167.9	0	0	0	0	0	115.8	I430	I430-G432 PolarHBondContact O-N 2.72Å
433	Y	38	Very low	29	Very low	49 Å²	49	91.2 Å²	91.2	19%	0.192	51%	0.507	C	S	.	.			trans	-86.5	115.8	177.5	-52.1	-61.9	0	0	0	110.2	Q84 L189 L218 G219 S429 I430 S431 L435	Q84-Y433 PolarHBondContact NE2-OH 3.35Å; L189-Y433 HydrophobicContact CD1-CD2 3.99Å; L189-Y433 HydrophobicContact CD1-CE2 3.58Å; L189-Y433 HydrophobicContact CG-CE2 4.37Å; L218-Y433 WeakPolarHBondContact O-CD1 3.38Å; G219-Y433 VanDerWaalsContact C-CE1 3.4Å; G219-Y433 VanDerWaalsContact CA-CE1 3.46Å; G219-Y433 WeakPolarHBondContact O-CE1 3.42Å; G219-Y433 VanDerWaalsContact O-CZ 3.26Å; G219-Y433 PolarHBondContact O-OH 3.2Å; S429-Y433 WeakPolarHBondContact CA-O 3.41Å; S429-Y433 WeakPolarHBondContact CB-O 3.48Å; I430-Y433 PolarHBondContact O-N 2.94Å; S431-Y433 VanDerWaalsContact C-N 3.33Å; S431-Y433 PolarHBondContact O-N 3.4Å; S431-Y433 WeakPolarHBondContact OG-CD2 3.26Å; S431-Y433 VanDerWaalsContact OG-CE2 3.31Å; S431-Y433 WeakPolarHBondContact OG-CE2 3.23Å; Y433-L435 PolarHBondContact O-N 2.96Å
434	Q	28.4	Very low	29.1	Very low	128 Å²	128	89.3 Å²	89.3	60%	0.598	50%	0.497	S	S	*	.			trans	-83.8	109.7	174.3	-74	-165.4	-9.3	0	0	110.3	N436	Q434-N436 PolarHBondContact O-N 2.84Å; Q434-N436 VanDerWaalsContact O-N 3.1Å
435	L	30.6	Very low	29.4	Very low	52 Å²	52	93 Å²	93	27%	0.272	50%	0.503	S	S	.	.			trans	-70	4.4	172.9	-78.6	161.6	0	0	0	113.9	M180 L218 Y433	M180-L435 HydrophobicContact SD-CD2 4.48Å; L218-L435 HydrophobicContact CD2-CD2 3.7Å; Y433-L435 PolarHBondContact O-N 2.96Å
436	N	27.3	Very low	29.5	Very low	96 Å²	96	87.6 Å²	87.6	51%	0.513	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	27.4	-161.6	-69.3	49.8	0	0	0	113.9	N427 Q434	N427-N436 PolarHBondContact OD1-ND2 3.07Å; Q434-N436 PolarHBondContact O-N 2.84Å; Q434-N436 VanDerWaalsContact O-N 3.1Å
437	S	31	Very low	29.7	Very low	78 Å²	78	90.6 Å²	90.6	55%	0.545	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.3	-2.9	174.2	-163.7	0	0	0	0	114.1	V439	S437-V439 VanDerWaalsContact C-N 3.29Å; S437-V439 PolarHBondContact O-N 3.14Å
438	M	30.5	Very low	29.9	Very low	103 Å²	103	92.5 Å²	92.5	51%	0.507	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	30	-168.4	-69.1	-178.8	164.5	0	0	114.6	D217	D217-M438 HydrophobicContact CB-CE 4.1Å; D217-M438 WeakPolarHBondContact O-CE 3.4Å
439	V	31.3	Very low	30.1	Very low	139 Å²	139	99.4 Å²	99.4	84%	0.842	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.3	6	-178.1	-163	0	0	0	0	112.7	S437	S437-V439 VanDerWaalsContact C-N 3.29Å; S437-V439 PolarHBondContact O-N 3.14Å
440	S	26.4	Very low	30.3	Very low	109 Å²	109	103 Å²	103	76%	0.762	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-146	-4	-176	-49.7	0	0	0	0	116.1
441	D	27.1	Very low	30.2	Very low	86 Å²	86	111.6 Å²	111.6	46%	0.46	60%	0.595	S	S	.	*			trans	-103	66.4	174.4	-100.6	43.3	0	0	0	109.7	R369 I443	R369-D441 IonicContact CZ-OD2 2.75Å; R369-D441 VanDerWaalsContact CZ-OD2 3.24Å; R369-D441 IonicContact NH1-OD2 2.78Å; R369-D441 PolarHBondContact NH1-OD2 3.09Å; R369-D441 IonicContact NH2-OD2 3.88Å; R369-D441 PolarHBondContact NH2-OD2 3.39Å; D441-I443 PolarHBondContact O-N 3.21Å
442	S	27.1	Very low	30.1	Very low	86 Å²	86	114.9 Å²	114.9	60%	0.601	62%	0.624	S	S	*	*			trans	-72.4	103.9	151.3	54.5	0	0	0	0	106.4	D444	S442-D444 WeakPolarHBondContact CB-OD2 3.41Å; S442-D444 PolarHBondContact O-N 3.27Å; S442-D444 PolarHBondContact OG-OD2 2.74Å
443	I	30.4	Very low	30.3	Very low	113 Å²	113	116.3 Å²	116.3	58%	0.579	63%	0.631	S	S	*	*			trans	-76.9	77.9	157.7	-58	179.5	0	0	0	105.2	D441 F445	D441-I443 PolarHBondContact O-N 3.21Å; I443-F445 PolarHBondContact O-N 2.81Å
444	D	29.1	Very low	30.2	Very low	103 Å²	103	122.2 Å²	122.2	55%	0.551	66%	0.662	S	S	*	*			trans	-58.8	119.2	161.1	-62.5	-63.5	0	0	0	106.3	S442 D446	S442-D444 WeakPolarHBondContact CB-OD2 3.41Å; S442-D444 PolarHBondContact O-N 3.27Å; S442-D444 PolarHBondContact OG-OD2 2.74Å; D444-D446 PolarHBondContact O-N 2.85Å
445	F	31.7	Very low	30.5	Very low	195 Å²	195	120.5 Å²	120.5	86%	0.855	66%	0.662	S	S	*	*			trans	-74.1	82.4	163.4	-95.2	-92.1	0	0	0	105.9	I443 D447	I443-F445 PolarHBondContact O-N 2.81Å; F445-D447 PolarHBondContact O-N 3.03Å; F445-D447 VanDerWaalsContact O-N 3.14Å
446	D	31.7	Very low	30.5	Very low	120 Å²	120	125 Å²	125	64%	0.642	69%	0.686	S	S	*	*			trans	-51.7	120.2	-178.8	-84.3	-38.9	0	0	0	110.3	D444 N448	D444-D446 PolarHBondContact O-N 2.85Å; D446-N448 HydrophobicContact CB-CB 4.44Å; D446-N448 PolarHBondContact O-N 2.57Å
447	D	29.8	Very low	30.8	Very low	162 Å²	162	126.4 Å²	126.4	87%	0.866	69%	0.694	S	S	*	*			trans	-67.7	71.2	166.3	-96.9	-49.9	0	0	0	108.9	F445 K449	F445-D447 PolarHBondContact O-N 3.03Å; F445-D447 VanDerWaalsContact O-N 3.14Å; D447-K449 PolarHBondContact O-N 2.81Å
448	N	29.3	Very low	30.8	Very low	141 Å²	141	129.6 Å²	129.6	75%	0.754	70%	0.7	S	S	*	*			trans	-78.9	61.9	-171.1	-125.5	-47.4	0	0	0	111.7	D446	D446-N448 HydrophobicContact CB-CB 4.44Å; D446-N448 PolarHBondContact O-N 2.57Å
449	K	32.5	Very low	30.8	Very low	178 Å²	178	130.2 Å²	130.2	77%	0.774	71%	0.705	S	S	*	*			trans	-104	101.8	162.5	-79.1	-177.2	177.7	173.5	0	108.7	D447	D447-K449 PolarHBondContact O-N 2.81Å
450	N	29.7	Very low	30.7	Very low	114 Å²	114	129.5 Å²	129.5	61%	0.61	70%	0.697	S	S	*	*				165.2	169.6	113.3	-80.5	-21	0	0	0	112.9
451	Y	30	Very low	31	Very low	211 Å²	211	131.5 Å²	131.5	83%	0.827	69%	0.694	S	S	*	*			trans	73.2	92.5	157.4	-54	-56.1	0	0	0	119
452	A	31.6	Very low	31.1	Very low	95 Å²	95	133.3 Å²	133.3	79%	0.785	70%	0.703	S	S	*	*				-103.8	141.4	116	0	0	0	0	0	109.6
453	A	33.2	Very low	31.2	Very low	85 Å²	85	135 Å²	135	70%	0.702	71%	0.705	S	S	*	*	S	Bend	trans	7.7	142.5	149.6	0	0	0	0	0	119.9
454	M	35.3	Very low	31.3	Very low	173 Å²	173	137.1 Å²	137.1	85%	0.852	71%	0.713	S	S	*	*			cis	-155.2	-174.1	3.6	-114	-39.9	169.5	0	0	109.6
455	P	35	Very low	31.3	Very low	92 Å²	92	136.9 Å²	136.9	60%	0.597	72%	0.719	S	S	*	*			trans	-105.1	171.2	-135.2	43	-36.2	0	0	0	116
456	D	30.8	Very low	31.1	Very low	146 Å²	146	138.8 Å²	138.8	78%	0.781	72%	0.72	S	S	*	*				-179.5	160.5	103.4	-93.9	-32.9	0	0	0	115.2
457	D	32.6	Very low	30.8	Very low	126 Å²	126	138.4 Å²	138.4	67%	0.674	73%	0.727	S	S	*	*			trans	56	94.2	161.5	-80.5	-18.3	0	0	0	123.7
458	Q	32	Very low	30.8	Very low	145 Å²	145	135.4 Å²	135.4	68%	0.678	73%	0.725	S	S	*	*				88.2	123.8	110.8	-82.6	-175.9	71	0	0	123.4
459	N	29.8	Very low	30.6	Very low	115 Å²	115	139.6 Å²	139.6	62%	0.615	73%	0.732	S	S	*	*			trans	80.3	108.7	136.5	-65	-24.7	0	0	0	121.9
460	N	29.4	Very low	30.3	Very low	124 Å²	124	138 Å²	138	66%	0.663	73%	0.732	S	S	*	*				72.2	144.4	124.8	-67.4	-34.5	0	0	0	119.2
461	H	33.5	Very low	30.3	Very low	152 Å²	152	140.7 Å²	140.7	70%	0.704	75%	0.746	S	S	*	*			cis	-157.9	156.7	14.3	-118.4	-7.8	0	0	0	112.5
462	L	29.3	Very low	30.2	Very low	124 Å²	124	137.4 Å²	137.4	65%	0.649	74%	0.742	S	S	*	*			trans	58.3	121.9	147	-92.2	74	0	0	0	122.8
463	N	28.8	Very low	30	Very low	122 Å²	122	143.2 Å²	143.2	65%	0.652	74%	0.744	S	S	*	*				67.8	153	121.9	-65.7	-3.3	0	0	0	120.8
464	Q	32	Very low	29.8	Very low	157 Å²	157	148.1 Å²	148.1	73%	0.734	76%	0.757	S	S	*	*			cis	-156.4	163.4	2.8	-128.9	161.8	31	0	0	112.7
465	S	30.4	Very low	29.5	Very low	98 Å²	98	143.4 Å²	143.4	69%	0.685	74%	0.741	S	S	*	*			trans	19.4	122	154.8	54.1	0	0	0	0	121.2
466	R	26.8	Very low	29.2	Very low	234 Å²	234	146.9 Å²	146.9	88%	0.883	76%	0.755	S	S	*	*				93.9	111.6	60	-167.6	-172.1	-157.6	176.1	7.2	114.1
467	S	25.3	Very low	29.2	Very low	112 Å²	112	143.4 Å²	143.4	78%	0.783	75%	0.753	S	S	*	*			trans	51.3	117.1	155.9	65.7	0	0	0	0	121.7
468	A	29.7	Very low	29.1	Very low	100 Å²	100	146.7 Å²	146.7	83%	0.826	77%	0.767	S	S	*	*			trans	-156.2	142.4	141.4	0	0	0	0	0	111.6
469	Y	25.3	Very low	28.9	Very low	228 Å²	228	147.5 Å²	147.5	89%	0.894	78%	0.776	S	S	*	*			trans	-80.7	125.8	160.9	-81.5	-102.5	0	0	0	108.8
470	N	26.6	Very low	28.8	Very low	145 Å²	145	151.4 Å²	151.4	78%	0.775	79%	0.791	S	S	*	*			trans	161.9	133	140.7	-97.1	-68.8	0	0	0	110
471	L	29.6	Very low	28.6	Very low	171 Å²	171	155.2 Å²	155.2	90%	0.895	80%	0.801	S	S	*	*			trans	-159.1	78.6	137.6	-114.3	173.9	0	0	0	110.3
472	N	27	Very low	28.4	Very low	142 Å²	142	154.1 Å²	154.1	76%	0.759	81%	0.809	S	S	*	*			trans	-68.6	158.7	155.7	-120.1	-41.9	0	0	0	109.1
473	R	27.2	Very low	28.5	Very low	217 Å²	217	157 Å²	157	82%	0.819	82%	0.819	S	S	*	*			trans	70.4	87.5	155.8	-160.8	-170.2	-120.5	-176.1	-0.2	117.7
474	L	30.1	Very low	28.4	Very low	187 Å²	187	154.6 Å²	154.6	98%	0.979	81%	0.806	S	S	*	*				-118	136.2	125.3	-100.4	171.6	0	0	0	108.2
475	S	29.1	Very low	28.7	Very low	74 Å²	74	152.7 Å²	152.7	52%	0.517	81%	0.807	S	S	.	*			trans	-142.9	152.5	-164.1	57.8	0	0	0	0	112.6
476	N	28.8	Very low	28.9	Very low	165 Å²	165	153.9 Å²	153.9	88%	0.882	81%	0.806	S	S	*	*			trans	76.4	114.4	166.6	-52.2	-21.7	0	0	0	116.3
477	G	29.5	Very low	29	Very low	73 Å²	73	147.7 Å²	147.7	75%	0.753	79%	0.791	S	S	*	*			trans	-166.6	92.7	169.4	0	0	0	0	0	110.2
478	M	31.5	Very low	29.4	Very low	195 Å²	195	148.7 Å²	148.7	96%	0.961	79%	0.786	S	S	*	*			trans	64	105	177.9	-60.9	-168.7	177.5	0	0	117.7
479	N	26.7	Very low	29.3	Very low	162 Å²	162	150.6 Å²	150.6	87%	0.866	79%	0.787	S	S	*	*			trans	-77.3	140.8	156.1	-76	-68.1	0	0	0	110.1
480	Q	29.3	Very low	29.4	Very low	197 Å²	197	149.3 Å²	149.3	92%	0.921	78%	0.782	S	S	*	*			trans	-152.6	160	138.5	-113.4	169.5	73	0	0	110.3
481	K	24.7	Very low	29.6	Very low	205 Å²	205	146.8 Å²	146.8	89%	0.891	77%	0.773	S	S	*	*			trans	-89.2	129.3	-161.6	-60	169.1	-177.7	170.8	0	111.9
482	C	29.1	Very low	29.3	Very low	129 Å²	129	145.3 Å²	145.3	87%	0.872	77%	0.766	S	S	*	*			trans	-127.5	146	163.7	-61.6	0	0	0	0	109.3
483	H	30.3	Very low	29.4	Very low	184 Å²	184	148.6 Å²	148.6	85%	0.852	77%	0.77	S	S	*	*			trans	-83.1	159.5	-161.9	-83.9	-84.2	0	0	0	116.3
484	N	28.2	Very low	29.4	Very low	72 Å²	72	142.4 Å²	142.4	39%	0.385	76%	0.759	S	S	.	*			trans	-54.6	122.1	164.5	175	32.8	0	0	0	110.9	N486 D487	N484-N486 PolarHBondContact O-N 3.46Å; N484-N486 PolarHBondContact OD1-N 2.84Å; N484-N486 PolarHBondContact OD1-ND2 3.3Å; N484-D487 PolarHBondContact ND2-OD2 2.95Å
485	P	37.8	Very low	29.3	Very low	116 Å²	116	138.2 Å²	138.2	75%	0.753	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	3	-178.8	32.2	-36.4	0	0	0	114.4
486	N	33.5	Very low	29.3	Very low	124 Å²	124	139.6 Å²	139.6	66%	0.663	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-2.5	178.5	-62.1	-72.1	0	0	0	114.3	N484	N484-N486 PolarHBondContact O-N 3.46Å; N484-N486 PolarHBondContact OD1-N 2.84Å; N484-N486 PolarHBondContact OD1-ND2 3.3Å
487	D	28.8	Very low	29.3	Very low	104 Å²	104	140.4 Å²	140.4	56%	0.556	76%	0.758	S	S	*	*			trans	-118.4	60	-176.4	-70.6	-67.4	0	0	0	112.6	N484	N484-D487 PolarHBondContact ND2-OD2 2.95Å
488	I	34.3	Very low	29.4	Very low	133 Å²	133	145.6 Å²	145.6	68%	0.682	76%	0.76	S	S	*	*			trans	-128.7	117	162.9	-63.6	-176.7	0	0	0	109.4	Y490	I488-Y490 HydrophobicContact CG2-CD2 3.48Å; I488-Y490 VanDerWaalsContact CG2-CD2 3.48Å; I488-Y490 HydrophobicContact CG2-CE2 3.73Å
489	V	27.3	Very low	29.2	Very low	139 Å²	139	141.4 Å²	141.4	84%	0.842	75%	0.747	S	S	*	*			trans	-98.4	107.1	-179.1	177.8	0	0	0	0	110
490	Y	29.2	Very low	29.5	Very low	201 Å²	201	137.1 Å²	137.1	79%	0.788	73%	0.73	S	S	*	*			trans	-136.4	157.1	169.1	-79.6	-56.7	0	0	0	111.5	I488	I488-Y490 HydrophobicContact CG2-CD2 3.48Å; I488-Y490 VanDerWaalsContact CG2-CD2 3.48Å; I488-Y490 HydrophobicContact CG2-CE2 3.73Å
491	P	29.3	Very low	29.6	Very low	93 Å²	93	135.5 Å²	135.5	60%	0.604	72%	0.722	S	S	*	*			trans	-87.6	159.1	-137	-15.8	32.8	0	0	0	116	Y493	P491-Y493 VanDerWaalsContact C-N 3.3Å; P491-Y493 HydrophobicContact CB-CD2 4.06Å; P491-Y493 HydrophobicContact CB-CE2 4.08Å; P491-Y493 HydrophobicContact CG-CD2 4.48Å; P491-Y493 HydrophobicContact CG-CE2 4.23Å; P491-Y493 PolarHBondContact O-N 3.41Å
492	N	24.2	Very low	30	Very low	140 Å²	140	128.7 Å²	128.7	75%	0.749	70%	0.7	S	S	*	*			trans	-66.1	82	165.8	-77.1	-80	0	0	0	111.3	S494	N492-S494 PolarHBondContact O-N 2.89Å
493	Y	28.8	Very low	30.1	Very low	211 Å²	211	132.7 Å²	132.7	83%	0.827	70%	0.697	S	S	*	*			trans	-82.7	65.3	165.1	-88.1	-80.1	0	0	0	111.7	P491 A495	P491-Y493 VanDerWaalsContact C-N 3.3Å; P491-Y493 HydrophobicContact CB-CD2 4.06Å; P491-Y493 HydrophobicContact CB-CE2 4.08Å; P491-Y493 HydrophobicContact CG-CD2 4.48Å; P491-Y493 HydrophobicContact CG-CE2 4.23Å; P491-Y493 PolarHBondContact O-N 3.41Å; Y493-A495 PolarHBondContact O-N 2.85Å
494	S	26.6	Very low	30	Very low	86 Å²	86	135.2 Å²	135.2	60%	0.601	70%	0.699	S	S	*	*			trans	-69.5	101.9	155.3	54.6	0	0	0	0	108.2	N492 T496	N492-S494 PolarHBondContact O-N 2.89Å; S494-T496 PolarHBondContact O-N 3.12Å
495	A	29.3	Very low	30	Very low	100 Å²	100	138.6 Å²	138.6	83%	0.826	72%	0.723	S	S	*	*			trans	-68.7	81.2	174.8	0	0	0	0	0	110.7	Y493 M497	Y493-A495 PolarHBondContact O-N 2.85Å; A495-M497 PolarHBondContact O-N 3.33Å
496	T	28.4	Very low	29.6	Very low	103 Å²	103	136.2 Å²	136.2	63%	0.632	72%	0.719	S	S	*	*			trans	-75.4	102	175.4	54.1	0	0	0	0	110	S494 K498	S494-T496 PolarHBondContact O-N 3.12Å; T496-K498 PolarHBondContact O-N 2.76Å
497	M	28.2	Very low	29.4	Very low	181 Å²	181	141.8 Å²	141.8	89%	0.892	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-70.5	122.6	158.1	-69.2	-158.9	122.8	0	0	108.4	A495	A495-M497 PolarHBondContact O-N 3.33Å
498	K	31.3	Very low	29.4	Very low	183 Å²	183	141.9 Å²	141.9	80%	0.796	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-85	139.7	175.7	-64.2	179.3	-176.7	172.6	0	109.3	T496	T496-K498 PolarHBondContact O-N 2.76Å
499	P	28.3	Very low	29.2	Very low	106 Å²	106	141 Å²	141	69%	0.688	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-79.7	135	164.1	32.4	-31.5	0	0	0	110
500	S	33.7	Very low	29.5	Very low	72 Å²	72	140.6 Å²	140.6	50%	0.503	74%	0.743	S	S	.	*			trans	-127.1	153.3	166.1	47.8	0	0	0	0	110.9	E935	S500-E935 WeakPolarHBondContact CB-OE1 3.15Å; S500-E935 VanDerWaalsContact CB-OE2 3.24Å; S500-E935 WeakPolarHBondContact CB-OE2 3.3Å; S500-E935 PolarHBondContact OG-OE1 3.16Å; S500-E935 PolarHBondContact OG-OE2 3.19Å
501	Q	31.4	Very low	29.8	Very low	164 Å²	164	136.9 Å²	136.9	77%	0.766	74%	0.743	S	S	*	*			trans	-139.4	138	-177.2	-65.4	-176.1	1.5	0	0	109.9	L934	Q501-L934 WeakPolarHBondContact O-CD1 3.49Å; Q501-L934 WeakPolarHBondContact O-CD2 3.49Å
502	S	32.1	Very low	29.8	Very low	61 Å²	61	136.9 Å²	136.9	43%	0.427	75%	0.752	S	S	.	*				148.1	152.9	106.4	-150.9	0	0	0	0	113.1	L934	S502-L934 WeakPolarHBondContact O-CD2 3.4Å
503	R	31.7	Very low	30.6	Very low	213 Å²	213	134.7 Å²	134.7	80%	0.804	75%	0.753	S	S	*	*			trans	66.3	116	159.1	-67	143	-160	-121.3	-2.4	116.4
504	R	28.7	Very low	30.7	Very low	238 Å²	238	130.4 Å²	130.4	90%	0.898	75%	0.751	S	S	*	*				59.6	121.7	84.4	-70.9	-176.9	176.4	-170.1	-0.6	111.3
505	T	28.4	Very low	30.7	Very low	143 Å²	143	137 Å²	137	88%	0.877	76%	0.763	S	S	*	*			cis	-145.8	166.6	20.6	50.4	0	0	0	0	110.6
506	G	28.7	Very low	30.7	Very low	65 Å²	65	139.2 Å²	139.2	67%	0.67	76%	0.759	S	S	*	*			cis	158.6	170.4	5.1	0	0	0	0	0	109.7
507	R	28.7	Very low	30.8	Very low	242 Å²	242	139.3 Å²	139.3	91%	0.913	77%	0.77	S	S	*	*			trans	66.1	106	-171.5	-76.3	-176	172.7	-168.8	-3.7	113.8
508	S	28.5	Very low	30.8	Very low	106 Å²	106	135.7 Å²	135.7	74%	0.741	76%	0.763	S	S	*	*				77	133.8	77.8	71.1	0	0	0	0	113.2
509	S	31.8	Very low	30.6	Very low	115 Å²	115	136 Å²	136	80%	0.804	77%	0.767	S	S	*	*			cis	-144.5	139.7	30.9	51.1	0	0	0	0	116.5
510	T	31.9	Very low	30.5	Very low	129 Å²	129	135 Å²	135	79%	0.791	76%	0.763	S	S	*	*			trans	-89.5	-174.7	154	56.7	0	0	0	0	110
511	P	36.8	Very low	30.2	Very low	123 Å²	123	140.7 Å²	140.7	80%	0.799	78%	0.778	S	S	*	*			cis	-118	-147.6	-15.4	39.2	-19	0	0	0	109.8
512	A	28.9	Very low	29.9	Very low	94 Å²	94	141.6 Å²	141.6	78%	0.777	78%	0.78	S	S	*	*				-171.7	157.6	59.1	0	0	0	0	0	112.9
513	A	40.7	Very low	29.6	Very low	94 Å²	94	144.8 Å²	144.8	78%	0.777	80%	0.797	S	S	*	*			trans	-129.8	152.6	162.9	0	0	0	0	0	109.6
514	P	30.4	Very low	29.4	Very low	120 Å²	120	141.8 Å²	141.8	78%	0.779	80%	0.802	S	S	*	*			trans	-121.3	145.6	144.8	34.3	-24	0	0	0	109.8
515	R	27.3	Very low	29.3	Very low	226 Å²	226	137.3 Å²	137.3	85%	0.853	80%	0.796	S	S	*	*			cis	70.5	114	23.8	-95.9	-169.3	-172.7	-134.3	1.8	117
516	I	29.5	Very low	29.4	Very low	146 Å²	146	138.3 Å²	138.3	75%	0.749	80%	0.795	S	S	*	*			trans	82.4	110.9	152	-53	157	0	0	0	117.3
517	A	29.3	Very low	29.5	Very low	104 Å²	104	142.3 Å²	142.3	86%	0.86	80%	0.797	S	S	*	*			trans	-143.7	143.3	132.5	0	0	0	0	0	107.8
518	S	28.7	Very low	29.6	Very low	106 Å²	106	136.7 Å²	136.7	74%	0.741	79%	0.785	S	S	*	*			trans	-142.7	105.3	-175.5	58.3	0	0	0	0	111.1
519	E	28.2	Very low	29.7	Very low	189 Å²	189	140.2 Å²	140.2	88%	0.883	78%	0.782	S	S	*	*			trans	-160.8	154.4	173	-98.7	159.2	-144.6	0	0	106.3
520	S	26	Very low	29.8	Very low	86 Å²	86	141.8 Å²	141.8	60%	0.601	78%	0.776	S	S	*	*			cis	175.4	134.6	-41.8	53	0	0	0	0	104.8
521	F	26	Very low	29.9	Very low	190 Å²	190	140.4 Å²	140.4	83%	0.833	77%	0.772	S	S	*	*			trans	70.7	144.2	170.8	-66.5	-77.5	0	0	0	120.7
522	K	25.9	Very low	29.7	Very low	184 Å²	184	139.8 Å²	139.8	80%	0.8	77%	0.766	S	S	*	*			trans	70.5	91.2	155	-70	168.6	-176.6	-179.7	0	119.8
523	T	25.2	Very low	29.9	Very low	128 Å²	128	146.4 Å²	146.4	79%	0.785	77%	0.773	S	S	*	*				32.9	105.2	117.4	57.5	0	0	0	0	119.5
524	T	27.9	Very low	29.5	Very low	149 Å²	149	152.8 Å²	152.8	91%	0.914	78%	0.776	S	S	*	*				-172.1	166.3	118.3	25.6	0	0	0	0	111.2
525	N	25.6	Very low	29.7	Very low	145 Å²	145	151.6 Å²	151.6	78%	0.775	77%	0.769	S	S	*	*			trans	-77.3	149.4	174.5	-59.7	-42.1	0	0	0	112
526	L	30.5	Very low	30	Very low	164 Å²	164	145.2 Å²	145.2	86%	0.859	76%	0.759	S	S	*	*				-171.9	157.5	110.2	-100.9	161	0	0	0	111.8
527	Q	31.1	Very low	30.2	Very low	148 Å²	148	145.2 Å²	145.2	69%	0.692	76%	0.759	S	S	*	*			trans	-89.7	152.3	-178	-57.7	96.8	-76.6	0	0	113.1
528	D	31.6	Very low	30.3	Very low	125 Å²	125	146.7 Å²	146.7	67%	0.668	75%	0.753	S	S	*	*				162	148.2	126.9	-88.5	-6.7	0	0	0	110.7
529	R	29.8	Very low	30.7	Very low	179 Å²	179	147.6 Å²	147.6	68%	0.675	76%	0.756	S	S	*	*			cis	-159.7	157.3	2.6	-131.4	165	-149.7	-124.3	5	114.4
530	H	35.1	Very low	31	Very low	148 Å²	148	142.9 Å²	142.9	69%	0.685	75%	0.749	S	S	*	*			trans	61.8	157.1	164	-63.3	-61.9	0	0	0	116.7
531	S	33.7	Very low	31.3	Very low	100 Å²	100	150.6 Å²	150.6	70%	0.699	77%	0.766	S	S	*	*			cis	-144.1	150.8	-16.8	44.5	0	0	0	0	107.6
532	T	32.9	Very low	31.4	Very low	111 Å²	111	148.2 Å²	148.2	68%	0.681	76%	0.76	S	S	*	*			cis	87.5	109.5	21.4	71.1	0	0	0	0	117.2
533	Y	32.2	Very low	31.5	Very low	233 Å²	233	144.6 Å²	144.6	91%	0.914	76%	0.758	S	S	*	*				-150.2	125.5	112.7	-122.5	-77.3	0	0	0	113.2
534	R	32.5	Very low	31.5	Very low	227 Å²	227	146.1 Å²	146.1	86%	0.857	76%	0.756	S	S	*	*			trans	-172.9	144.7	174.5	-165.2	-162.6	-165.1	-127.4	9.9	109.5
535	P	35.5	Very low	31.4	Very low	95 Å²	95	144.8 Å²	144.8	62%	0.617	75%	0.748	S	S	*	*			trans	-68.8	153.4	164.6	-24.4	37.2	0	0	0	113.6
536	S	33.2	Very low	31.4	Very low	92 Å²	92	143.7 Å²	143.7	64%	0.643	74%	0.742	S	S	*	*			cis	90.5	126.9	11.2	88.3	0	0	0	0	117.7
537	L	32.8	Very low	31.4	Very low	146 Å²	146	143.9 Å²	143.9	76%	0.764	74%	0.739	S	S	*	*			cis	-165.7	145.4	-10.9	-137.9	79.6	0	0	0	111.2
538	D	31.8	Very low	31.2	Very low	136 Å²	136	142.1 Å²	142.1	73%	0.727	74%	0.743	S	S	*	*				46.5	175.4	126.4	-73.3	1.1	0	0	0	124.8
539	P	38	Very low	31.1	Very low	125 Å²	125	139.4 Å²	139.4	81%	0.812	74%	0.744	S	S	*	*			cis	-129.8	-170.2	-8.5	19.1	7.1	0	0	0	115.5
540	A	34.4	Very low	31.1	Very low	89 Å²	89	136.2 Å²	136.2	74%	0.736	75%	0.749	S	S	*	*			trans	-117.3	179	174.8	0	0	0	0	0	113.2
541	W	31.7	Very low	31.1	Very low	249 Å²	249	137 Å²	137	94%	0.943	75%	0.754	S	S	*	*			trans	-160.6	177.6	152.5	-113.8	89.2	0	0	0	112.9
542	I	27.5	Very low	30.9	Very low	139 Å²	139	138.3 Å²	138.3	71%	0.713	76%	0.757	S	S	*	*			trans	-124.9	143.5	-159	-65.1	161.1	0	0	0	113.4
543	S	28.3	Very low	30.8	Very low	109 Å²	109	137.1 Å²	137.1	76%	0.762	76%	0.758	S	S	*	*			trans	162	167.1	142.9	-76.3	0	0	0	0	111.5
544	Q	25.6	Very low	30.6	Very low	160 Å²	160	131 Å²	131	75%	0.748	75%	0.75	S	S	*	*			cis	-176.5	150.1	-42.3	-153.9	-177.3	25.5	0	0	106.3
545	T	25.7	Very low	30.5	Very low	121 Å²	121	126.8 Å²	126.8	74%	0.742	74%	0.743	S	S	*	*			trans	62.1	166.9	169.9	65.8	0	0	0	0	117.2
546	N	26.1	Very low	30.2	Very low	122 Å²	122	130.5 Å²	130.5	65%	0.652	75%	0.75	S	S	*	*			cis	-159.4	165.1	-46.9	-113.3	24.1	0	0	0	108.1
547	E	29.3	Very low	29.9	Very low	168 Å²	168	130.8 Å²	130.8	79%	0.785	75%	0.751	S	S	*	*			trans	62	169.4	155.6	-72.3	150.1	-121.7	0	0	117.9
548	S	28	Very low	29.9	Very low	110 Å²	110	129.6 Å²	129.6	77%	0.769	75%	0.75	S	S	*	*			cis	-159.7	178	-43.3	64.2	0	0	0	0	109
549	G	29.7	Very low	29.7	Very low	68 Å²	68	128.1 Å²	128.1	70%	0.701	75%	0.75	S	S	*	*			trans	90.1	111.4	-176.2	0	0	0	0	0	111.7
550	S	29.3	Very low	29.5	Very low	112 Å²	112	128.3 Å²	128.3	78%	0.783	76%	0.755	S	S	*	*			cis	64.5	121.9	47.4	-153.4	0	0	0	0	110.3
551	E	35.8	Very low	29.1	Very low	166 Å²	166	129 Å²	129	78%	0.776	75%	0.754	S	S	*	*				-151.6	151.7	59.3	-83.9	176.7	175.2	0	0	115.4
552	T	28.5	Very low	28.9	Very low	126 Å²	126	124.6 Å²	124.6	77%	0.773	75%	0.746	S	S	*	*			trans	34.9	152.6	138.2	69.4	0	0	0	0	121.7
553	A	30.1	Very low	28.8	Very low	86 Å²	86	128 Å²	128	71%	0.711	75%	0.75	S	S	*	*			cis	-178.2	162.1	-12.9	0	0	0	0	0	106.1
554	S	29.5	Very low	29	Very low	104 Å²	104	129.3 Å²	129.3	73%	0.727	75%	0.754	S	S	*	*			cis	-168.4	-157.6	-10.5	-97.1	0	0	0	0	106.2
555	I	29.3	Very low	29	Very low	139 Å²	139	127.8 Å²	127.8	71%	0.713	76%	0.757	S	S	*	*			trans	73	108	159.7	-55.2	174.9	0	0	0	114.5
556	F	28.9	Very low	29	Very low	174 Å²	174	126.9 Å²	126.9	76%	0.763	76%	0.756	S	S	*	*			cis	-149.6	130	-4.3	-99.6	-44.3	0	0	0	111.3
557	S	28.6	Very low	29	Very low	97 Å²	97	126.6 Å²	126.6	68%	0.678	76%	0.759	S	S	*	*				49.5	141.7	118.1	-68.3	0	0	0	0	122.1
558	V	31.4	Very low	28.8	Very low	121 Å²	121	125.2 Å²	125.2	73%	0.733	76%	0.757	S	S	*	*			cis	-147.5	135.2	-0.9	-103.9	0	0	0	0	107.8
559	S	28.5	Very low	28.6	Very low	105 Å²	105	125.6 Å²	125.6	73%	0.734	76%	0.76	S	S	*	*				64.1	131.8	76.5	-52.2	0	0	0	0	113.3
560	S	32.6	Very low	28.6	Very low	129 Å²	129	129.2 Å²	129.2	90%	0.902	77%	0.768	S	S	*	*			cis	-138.3	161.5	41.6	-66.9	0	0	0	0	115.7
561	S	27	Very low	28.6	Very low	104 Å²	104	133 Å²	133	73%	0.727	77%	0.765	S	S	*	*			trans	-114.9	148.3	-171.2	171.7	0	0	0	0	113
562	M	27.4	Very low	28.4	Very low	156 Å²	156	131.7 Å²	131.7	77%	0.768	76%	0.763	S	S	*	*			trans	-141.6	102.1	154.6	-88.7	-58.7	147	0	0	112.8
563	R	25.7	Very low	28.7	Very low	210 Å²	210	128.5 Å²	128.5	79%	0.792	76%	0.755	S	S	*	*			trans	40.6	111.7	142.2	-54.2	179.9	-166.3	-148.8	-0.8	118.6
564	T	31.7	Very low	29.5	Very low	138 Å²	138	126.8 Å²	126.8	85%	0.847	74%	0.738	S	S	*	*			trans	-63.4	148.1	162.7	53.6	0	0	0	0	113.3
565	P	26.4	Very low	30.2	Very low	127 Å²	127	123.8 Å²	123.8	83%	0.825	72%	0.72	S	S	*	*			trans	-115.5	173.3	133.2	36.3	-31.8	0	0	0	111.8
566	S	25.6	Very low	31.2	Very low	102 Å²	102	118.9 Å²	118.9	71%	0.713	69%	0.694	S	S	*	*			trans	-82.5	167.6	-170	50.1	0	0	0	0	115.3
567	T	24.9	Very low	32	Very low	116 Å²	116	113.9 Å²	113.9	71%	0.712	68%	0.675	S	S	*	*			trans	82.2	152.8	165.3	79.6	0	0	0	0	118.9
568	N	25.6	Very low	32.9	Very low	139 Å²	139	114.2 Å²	114.2	74%	0.743	67%	0.666	S	S	*	*			trans	59.2	84.9	158.8	-61.1	-47.1	0	0	0	118.9
569	S	24.4	Very low	33.7	Very low	119 Å²	119	112 Å²	112	83%	0.832	65%	0.65	S	S	*	*			trans	-135.6	40.5	171.7	-155.1	0	0	0	0	116.2
570	V	29.2	Very low	34.5	Very low	144 Å²	144	109 Å²	109	87%	0.873	63%	0.625	S	S	*	*	S	Bend	trans	-148.9	58.5	161.9	-162.5	0	0	0	0	111.9
571	R	28.6	Very low	35.3	Very low	192 Å²	192	107.1 Å²	107.1	73%	0.725	61%	0.605	S	S	*	*			trans	-142.2	-18.1	175.7	-74.2	-163.8	176.6	-177.7	0.3	118.1	G573 S574	R571-G573 VanDerWaalsContact C-N 3.29Å; R571-G573 PolarHBondContact O-N 2.97Å; R571-G573 VanDerWaalsContact O-N 3.09Å; R571-S574 VanDerWaalsContact O-CB 3.22Å; R571-S574 WeakPolarHBondContact O-CB 3.48Å; R571-S574 PolarHBondContact O-N 3.49Å
572	N	31.9	Very low	36.3	Very low	138 Å²	138	106.1 Å²	106.1	74%	0.738	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-69.4	-18.1	-160	-64.5	1.9	0	0	0	115.8	S574 A575	N572-S574 PolarHBondContact O-N 2.8Å; N572-A575 WeakPolarHBondContact O-CB 3.39Å; N572-A575 PolarHBondContact O-N 2.89Å; N572-A575 VanDerWaalsContact O-N 3.17Å
573	G	34.8	Very low	37.1	Very low	59 Å²	59	104.4 Å²	104.4	61%	0.608	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-63	-16.8	168.4	0	0	0	0	0	114.3	R571	R571-G573 VanDerWaalsContact C-N 3.29Å; R571-G573 PolarHBondContact O-N 2.97Å; R571-G573 VanDerWaalsContact O-N 3.09Å
574	S	47.5	Very low	37.8	Very low	50 Å²	50	99.1 Å²	99.1	35%	0.35	58%	0.577	S	S	.	*	G	3₁₀ helix	trans	-86.5	-13.3	176.6	-167.4	0	0	0	0	113.5	R571 N572 I576 L577 Q578	R571-S574 VanDerWaalsContact O-CB 3.22Å; R571-S574 WeakPolarHBondContact O-CB 3.48Å; R571-S574 PolarHBondContact O-N 3.49Å; N572-S574 PolarHBondContact O-N 2.8Å; S574-I576 PolarHBondContact O-N 3.04Å; S574-L577 PolarHBondContact O-N 3.01Å; S574-Q578 WeakPolarHBondContact O-CB 3.37Å; S574-Q578 WeakPolarHBondContact O-CG 3.03Å; S574-Q578 PolarHBondContact O-N 3.11Å; S574-Q578 PolarHBondContact OG-OE1 3.11Å
575	A	45	Very low	38.2	Very low	41 Å²	41	100.8 Å²	100.8	34%	0.339	58%	0.58	S	S	.	*	H	α-helix	trans	-64.6	-40.8	-166.9	0	0	0	0	0	113.6	N572 Q578 L579	N572-A575 WeakPolarHBondContact O-CB 3.39Å; N572-A575 PolarHBondContact O-N 2.89Å; N572-A575 VanDerWaalsContact O-N 3.17Å; A575-Q578 PolarHBondContact O-N 3.26Å; A575-L579 WeakPolarHBondContact O-CB 3.36Å; A575-L579 WeakPolarHBondContact O-CG 3.4Å; A575-L579 PolarHBondContact O-N 2.88Å
576	I	48.8	Very low	38.6	Very low	35 Å²	35	99.4 Å²	99.4	18%	0.179	57%	0.566	C	S	.	*	H	α-helix	trans	-68.8	-40.7	178.4	-63.8	160.9	0	0	0	110.7	S574 Q578 L579 L580 P629 L655 I686	S574-I576 PolarHBondContact O-N 3.04Å; I576-Q578 VanDerWaalsContact C-N 3.33Å; I576-Q578 PolarHBondContact O-N 2.88Å; I576-L579 PolarHBondContact O-N 2.71Å; I576-L580 HydrophobicContact CG2-CD1 4.17Å; I576-L580 WeakPolarHBondContact O-CG 3.46Å; I576-L580 PolarHBondContact O-N 2.7Å; I576-P629 HydrophobicContact CD1-CB 3.61Å; I576-P629 HydrophobicContact CG1-CB 4.4Å; I576-L655 HydrophobicContact CD1-CD2 4.02Å; I576-I686 HydrophobicContact CG2-CD1 4.17Å
577	L	45.6	Very low	39.3	Very low	69 Å²	69	101.5 Å²	101.5	36%	0.361	57%	0.568	S	S	.	*	H	α-helix	trans	-63.5	-39.7	173	-94.9	165.5	0	0	0	111.5	S574 L580 L581	S574-L577 PolarHBondContact O-N 3.01Å; L577-L580 PolarHBondContact O-N 3.37Å; L577-L581 HydrophobicContact CD2-CD1 4.46Å; L577-L581 VanDerWaalsContact O-CB 3.25Å; L577-L581 WeakPolarHBondContact O-CB 3.39Å; L577-L581 WeakPolarHBondContact O-CD1 3.42Å; L577-L581 WeakPolarHBondContact O-CG 3.45Å; L577-L581 PolarHBondContact O-N 3.48Å
578	Q	47.9	Very low	39.9	Very low	105 Å²	105	100.4 Å²	100.4	49%	0.491	57%	0.571	S	S	.	*	H	α-helix	trans	-68.3	-33.2	175.5	-74.7	172.7	-42.1	0	0	112.5	S574 A575 I576 A582	S574-Q578 WeakPolarHBondContact O-CB 3.37Å; S574-Q578 WeakPolarHBondContact O-CG 3.03Å; S574-Q578 PolarHBondContact O-N 3.11Å; S574-Q578 PolarHBondContact OG-OE1 3.11Å; A575-Q578 PolarHBondContact O-N 3.26Å; I576-Q578 VanDerWaalsContact C-N 3.33Å; I576-Q578 PolarHBondContact O-N 2.88Å; Q578-A582 WeakPolarHBondContact O-CB 3.4Å; Q578-A582 PolarHBondContact O-N 2.89Å
579	L	48.2	Very low	40.5	Very low	75 Å²	75	98.5 Å²	98.5	39%	0.393	56%	0.561	S	S	.	*	H	α-helix	trans	-70.7	-34.1	172	-79.5	161.7	0	0	0	113.1	A575 I576 N583 L626	A575-L579 WeakPolarHBondContact O-CB 3.36Å; A575-L579 WeakPolarHBondContact O-CG 3.4Å; A575-L579 PolarHBondContact O-N 2.88Å; I576-L579 PolarHBondContact O-N 2.71Å; L579-N583 PolarHBondContact O-ND2 3.48Å; L579-L626 HydrophobicContact CB-CD1 4.46Å; L579-L626 HydrophobicContact CB-CD2 4.05Å; L579-L626 HydrophobicContact CB-CG 4.29Å; L579-L626 HydrophobicContact CD2-CD1 4.45Å
580	L	46.6	Very low	41.2	Very low	41 Å²	41	95.2 Å²	95.2	22%	0.215	53%	0.534	C	S	.	.	H	α-helix	trans	-71.5	-43.1	172.7	-75.3	163.7	0	0	0	111.8	I576 L577	I576-L580 HydrophobicContact CG2-CD1 4.17Å; I576-L580 WeakPolarHBondContact O-CG 3.46Å; I576-L580 PolarHBondContact O-N 2.7Å; L577-L580 PolarHBondContact O-N 3.37Å
581	L	47.7	Very low	41.9	Very low	90 Å²	90	91.9 Å²	91.9	47%	0.471	51%	0.511	S	S	.	.	H	α-helix	trans	-75.7	-32	-178.1	-69.6	166.4	0	0	0	113.3	L577 N583	L577-L581 HydrophobicContact CD2-CD1 4.46Å; L577-L581 VanDerWaalsContact O-CB 3.25Å; L577-L581 WeakPolarHBondContact O-CB 3.39Å; L577-L581 WeakPolarHBondContact O-CD1 3.42Å; L577-L581 WeakPolarHBondContact O-CG 3.45Å; L577-L581 PolarHBondContact O-N 3.48Å; L581-N583 PolarHBondContact O-N 2.67Å
582	A	49.4	Very low	42.8	Very low	83 Å²	83	87.8 Å²	87.8	69%	0.686	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-5.7	177.1	0	0	0	0	0	114.1	Q578	Q578-A582 WeakPolarHBondContact O-CB 3.4Å; Q578-A582 PolarHBondContact O-N 2.89Å
583	N	42.7	Very low	43.7	Very low	119 Å²	119	83.2 Å²	83.2	64%	0.636	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.9	8.2	-177.3	-72.1	-64.6	0	0	0	113.8	L579 L581	L579-N583 PolarHBondContact O-ND2 3.48Å; L581-N583 PolarHBondContact O-N 2.67Å
584	R	42	Very low	44.7	Very low	99 Å²	99	81.8 Å²	81.8	37%	0.374	46%	0.463	S	S	.	.			trans	-139.8	122.1	176.4	-66.4	-168.2	-178.7	-172.8	3.2	111.8	N586 D589	R584-N586 VanDerWaalsContact C-N 3.26Å; R584-N586 PolarHBondContact O-N 3.46Å; R584-D589 PolarHBondContact NH1-O 2.67Å
585	D	40.4	Very low	45.5	Very low	173 Å²	173	82.3 Å²	82.3	93%	0.925	46%	0.461	S	S	*	.	S	Bend	trans	-72.2	-13.5	-178.4	-66.2	-51.1	0	0	0	114.3
586	N	34.2	Very low	46.9	Very low	98 Å²	98	82.4 Å²	82.4	52%	0.524	46%	0.458	S	S	.	.			trans	-129.3	136.3	-178	-82.5	-45.5	0	0	0	112.3	R584 A588 D589	R584-N586 VanDerWaalsContact C-N 3.26Å; R584-N586 PolarHBondContact O-N 3.46Å; N586-A588 VanDerWaalsContact C-N 3.26Å; N586-A588 PolarHBondContact O-N 3.1Å; N586-D589 VanDerWaalsContact CB-OD2 3.3Å; N586-D589 WeakPolarHBondContact CB-OD2 3.4Å
587	I	41.1	Very low	48.4	Very low	146 Å²	146	84 Å²	84	75%	0.749	46%	0.462	S	S	*	.	S	Bend	trans	-74	-19.2	173	-61.7	169.9	0	0	0	111.6	L590	I587-L590 WeakPolarHBondContact O-CB 3.49Å
588	A	37.3	Very low	50.1	Low	94 Å²	94	83 Å²	83	78%	0.777	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-29.9	-180	0	0	0	0	0	113.5	N586 L590	N586-A588 VanDerWaalsContact C-N 3.26Å; N586-A588 PolarHBondContact O-N 3.1Å; A588-L590 PolarHBondContact O-N 3.47Å; A588-L590 VanDerWaalsContact O-N 3.12Å
589	D	37.7	Very low	51.8	Low	99 Å²	99	78.6 Å²	78.6	53%	0.529	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	24.5	-177.8	-57	-44.3	0	0	0	112.3	R584 N586 D591	R584-D589 PolarHBondContact NH1-O 2.67Å; N586-D589 VanDerWaalsContact CB-OD2 3.3Å; N586-D589 WeakPolarHBondContact CB-OD2 3.4Å; D589-D591 PolarHBondContact O-N 3.01Å
590	L	39.5	Very low	53.5	Low	50 Å²	50	76.4 Å²	76.4	26%	0.262	43%	0.429	S	S	.	.			trans	-91.2	80.7	-173.9	-144.4	78.4	0	0	0	111.5	I587 A588 T592 L595	I587-L590 WeakPolarHBondContact O-CB 3.49Å; A588-L590 PolarHBondContact O-N 3.47Å; A588-L590 VanDerWaalsContact O-N 3.12Å; L590-T592 PolarHBondContact O-N 3.02Å; L590-L595 HydrophobicContact CD2-CD1 4.47Å; L590-L595 HydrophobicContact CD2-CD2 3.96Å; L590-L595 HydrophobicContact CD2-CG 4.42Å
591	D	43.5	Very low	55.4	Low	73 Å²	73	74.6 Å²	74.6	39%	0.39	42%	0.419	S	S	.	.			trans	-50.7	121.1	175.5	-168.9	4.7	0	0	0	111.7	D589 T593 N594 Q692	D589-D591 PolarHBondContact O-N 3.01Å; D591-T593 PolarHBondContact O-N 3.12Å; D591-N594 PolarHBondContact O-N 3.06Å; D591-Q692 PolarHBondContact OD2-NE2 3.47Å
592	T	48	Very low	57.2	Low	107 Å²	107	75.9 Å²	75.9	66%	0.656	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-71.7	-9	-159.4	61.7	0	0	0	0	114.7	L590	L590-T592 PolarHBondContact O-N 3.02Å
593	T	50.1	Low	58.9	Low	42 Å²	42	77.8 Å²	77.8	26%	0.258	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-67.1	-36.7	-179.8	57.7	0	0	0	0	112.9	D591 L595 D689	D591-T593 PolarHBondContact O-N 3.12Å; T593-L595 VanDerWaalsContact C-N 3.34Å; T593-L595 PolarHBondContact O-N 3.2Å; T593-D689 WeakPolarHBondContact CB-OD2 3.48Å; T593-D689 PolarHBondContact OG1-OD2 3.3Å
594	N	55.5	Low	60.7	Low	28 Å²	28	73.3 Å²	73.3	15%	0.15	39%	0.394	C	S	.	.	G	3₁₀ helix	trans	-90.7	11.6	-172.1	-65	-77.3	0	0	0	113.9	D591 I686 T687 D689	D591-N594 PolarHBondContact O-N 3.06Å; N594-I686 WeakPolarHBondContact O-CD1 3.04Å; N594-T687 PolarHBondContact OD1-O 3.12Å; N594-D689 PolarHBondContact OD1-N 3.39Å
595	L	64.8	Low	62.5	Low	61 Å²	61	75.1 Å²	75.1	32%	0.319	42%	0.419	S	S	.	.	S	Bend	trans	-87.5	140.9	174.4	-77.8	169.1	0	0	0	111.5	L590 T593 R597	L590-L595 HydrophobicContact CD2-CD1 4.47Å; L590-L595 HydrophobicContact CD2-CD2 3.96Å; L590-L595 HydrophobicContact CD2-CG 4.42Å; T593-L595 VanDerWaalsContact C-N 3.34Å; T593-L595 PolarHBondContact O-N 3.2Å; L595-R597 PolarHBondContact O-N 2.98Å
596	P	74.7	Confident	64.3	Low	43 Å²	43	73.2 Å²	73.2	28%	0.279	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-68.5	119	175.1	27.8	-33.5	0	0	0	111.1	L655 K684 V685	P596-L655 HydrophobicContact CB-CD1 3.85Å; P596-K684 HydrophobicContact CB-CG 4.43Å; P596-V685 CarbonylContact C-O 3.54Å; P596-V685 WeakPolarHBondContact CA-O 3.42Å
597	R	80.5	Confident	66.8	Low	68 Å²	68	69.7 Å²	69.7	26%	0.257	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	133.8	-178.4	-60.2	-178.7	-74.4	126.1	-0.7	110.5	L595 G647 D652 K684 V685 T687	L595-R597 PolarHBondContact O-N 2.98Å; R597-G647 PolarHBondContact NH1-O 3.43Å; R597-D652 IonicContact CZ-OD2 2.68Å; R597-D652 IonicContact NH2-OD1 3.91Å; R597-D652 PolarHBondContact NH2-OD1 3.22Å; R597-D652 IonicContact NH2-OD2 2.71Å; R597-D652 PolarHBondContact NH2-OD2 2.76Å; R597-K684 WeakPolarHBondContact O-CA 3.5Å; R597-V685 HydrophobicContact CB-CG2 4.37Å; R597-V685 PolarHBondContact N-O 2.89Å; R597-V685 PolarHBondContact O-N 2.94Å; R597-T687 PolarHBondContact NH2-OG1 2.86Å
598	M	80.4	Confident	69	Low	50 Å²	50	63.6 Å²	63.6	25%	0.246	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	128.8	173.3	-67.7	-64.1	-57.8	0	0	110.1	L24 F26 K684	L24-M598 HydrophobicContact CD1-CB 4.45Å; L24-M598 HydrophobicContact CD1-CG 3.84Å; F26-M598 HydrophobicContact CE1-CB 4.35Å; F26-M598 HydrophobicContact CZ-CB 4.22Å; F26-M598 HydrophobicContact CZ-CE 4.27Å; M598-K684 HydrophobicContact CE-CB 4.44Å; M598-K684 HydrophobicContact SD-CB 3.54Å; M598-K684 VanDerWaalsContact SD-CB 3.54Å; M598-K684 HydrophobicContact SD-CD 3.73Å; M598-K684 HydrophobicContact SD-CG 3.45Å; M598-K684 WeakPolarHBondContact SD-CG 3.47Å
599	I	83.8	Confident	71.5	Confident	12 Å²	12	59.5 Å²	59.5	6%	0.062	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	128.6	-172.7	-61.2	179.4	0	0	0	109.8	L601 A646 L648 L683 V685	I599-L601 HydrophobicContact CG2-CD2 3.71Å; I599-L601 HydrophobicContact CG2-CG 4.19Å; I599-A646 HydrophobicContact CG2-CB 3.65Å; I599-L648 HydrophobicContact CD1-CD2 3.53Å; I599-L648 HydrophobicContact CD1-CG 3.91Å; I599-L683 PolarHBondContact N-O 3.07Å; I599-L683 PolarHBondContact O-N 3.06Å; I599-V685 HydrophobicContact CD1-CG2 3.67Å; I599-V685 HydrophobicContact CG1-CG2 4.32Å
600	A	84.4	Confident	74.1	Confident	29 Å²	29	56.1 Å²	56.1	24%	0.24	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	120.6	172.4	0	0	0	0	0	110.2	F26 V98	F26-A600 HydrophobicContact CD1-CB 3.94Å; F26-A600 HydrophobicContact CD2-CB 4.13Å; F26-A600 HydrophobicContact CE1-CB 4.07Å; F26-A600 HydrophobicContact CE2-CB 4.25Å; F26-A600 HydrophobicContact CG-CB 3.97Å; F26-A600 HydrophobicContact CZ-CB 4.22Å; V98-A600 HydrophobicContact CG2-CB 4.45Å
601	L	85.4	Confident	76.5	Confident	2 Å²	2	56.6 Å²	56.6	1%	0.01	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	124.8	-179.7	-58.5	-179	0	0	0	110.6	I599 F608 F610 A643 A646 L648 I680 L681 L683	I599-L601 HydrophobicContact CG2-CD2 3.71Å; I599-L601 HydrophobicContact CG2-CG 4.19Å; L601-F608 HydrophobicContact CB-CD1 3.87Å; L601-F608 HydrophobicContact CD1-CB 4.23Å; L601-F610 HydrophobicContact CD1-CD1 3.87Å; L601-F610 HydrophobicContact CD1-CE1 3.43Å; L601-F610 VanDerWaalsContact CD1-CE1 3.43Å; L601-F610 HydrophobicContact CD1-CZ 4.4Å; L601-A643 HydrophobicContact CD1-CB 4.35Å; L601-A643 HydrophobicContact CD2-CB 4.49Å; L601-A646 HydrophobicContact CD2-CB 3.35Å; L601-L648 HydrophobicContact CD1-CD1 3.79Å; L601-L648 HydrophobicContact CD2-CD1 4.24Å; L601-L648 HydrophobicContact CG-CD1 4.5Å; L601-I680 CarbonylContact O-C 3.58Å; L601-I680 VanDerWaalsContact O-CA 3.3Å; L601-I680 WeakPolarHBondContact O-CA 3.43Å; L601-L681 HydrophobicContact CB-CB 4.45Å; L601-L681 HydrophobicContact CD1-CD2 4.4Å; L601-L681 PolarHBondContact N-O 3.48Å; L601-L681 PolarHBondContact O-N 2.86Å; L601-L683 HydrophobicContact CD1-CD1 3.8Å
602	Q	85.2	Confident	78.8	Confident	117 Å²	117	54.2 Å²	54.2	55%	0.547	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	136.4	167.8	-169.9	173.6	6.5	0	0	109.9	G604 A642 D679 I680	Q602-G604 PolarHBondContact O-N 3.23Å; Q602-A642 VanDerWaalsContact O-CB 3.22Å; Q602-A642 WeakPolarHBondContact O-CB 3.42Å; Q602-D679 CarbonylContact C-O 3.51Å; Q602-D679 WeakPolarHBondContact CA-O 3.46Å; Q602-I680 HydrophobicContact CG-CG1 4.44Å
603	R	85.3	Confident	80.7	Confident	124 Å²	124	53.6 Å²	53.6	47%	0.468	29%	0.289	S	S	.	.			trans	-66.5	118.7	-179.7	-167	167	-179.2	154.3	-0.8	110.2	F608 S677 S678 D679	R603-F608 HydrophobicContact CB-CD1 4.16Å; R603-F608 HydrophobicContact CB-CE1 3.65Å; R603-F608 HydrophobicContact CB-CZ 4.06Å; R603-F608 HydrophobicContact CG-CE1 4.23Å; R603-F608 HydrophobicContact CG-CZ 4.27Å; R603-S677 PolarHBondContact NH1-O 3.47Å; R603-S677 VanDerWaalsContact NH1-O 3.1Å; R603-S678 WeakPolarHBondContact CD-O 3.41Å; R603-S678 PolarHBondContact NH1-O 3.44Å; R603-D679 WeakPolarHBondContact CB-O 3.49Å; R603-D679 PolarHBondContact N-O 3.28Å
604	G	81.2	Confident	82.3	Confident	24 Å²	24	52.6 Å²	52.6	25%	0.247	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-85.8	179	171.9	0	0	0	0	0	112.3	Q602 N606 G607	Q602-G604 PolarHBondContact O-N 3.23Å; G604-N606 PolarHBondContact O-N 3.05Å; G604-G607 WeakPolarHBondContact CA-O 3.5Å; G604-G607 PolarHBondContact N-O 3.32Å; G604-G607 WeakPolarHBondContact O-CA 3.43Å; G604-G607 PolarHBondContact O-N 2.73Å
605	P	79.2	Confident	83	Confident	138 Å²	138	55.6 Å²	55.6	90%	0.896	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-29	177.2	24.8	-34.4	0	0	0	113
606	N	78.9	Confident	82.8	Confident	132 Å²	132	61.4 Å²	61.4	71%	0.706	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	21.9	176.1	-59	12.8	0	0	0	111.8	G604	G604-N606 PolarHBondContact O-N 3.05Å
607	G	85.8	Confident	82	Confident	24 Å²	24	63 Å²	63	25%	0.247	35%	0.346	C	S	.	.	B	Isolated β-bridge	trans	76.3	-150.9	-169.2	0	0	0	0	0	112.6	G604	G604-G607 WeakPolarHBondContact CA-O 3.5Å; G604-G607 PolarHBondContact N-O 3.32Å; G604-G607 WeakPolarHBondContact O-CA 3.43Å; G604-G607 PolarHBondContact O-N 2.73Å
608	F	88.3	Confident	80.7	Confident	18 Å²	18	62.9 Å²	62.9	8%	0.079	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-16.1	-176.3	-54.2	-72	0	0	0	114.1	L601 R603 F610 A643 L681	L601-F608 HydrophobicContact CB-CD1 3.87Å; L601-F608 HydrophobicContact CD1-CB 4.23Å; R603-F608 HydrophobicContact CB-CD1 4.16Å; R603-F608 HydrophobicContact CB-CE1 3.65Å; R603-F608 HydrophobicContact CB-CZ 4.06Å; R603-F608 HydrophobicContact CG-CE1 4.23Å; R603-F608 HydrophobicContact CG-CZ 4.27Å; F608-F610 HydrophobicContact CB-CD1 3.73Å; F608-F610 HydrophobicContact CB-CE1 3.37Å; F608-F610 HydrophobicContact CB-CZ 4.41Å; F608-F610 HydrophobicContact CD2-CE1 4.45Å; F608-F610 HydrophobicContact CG-CE1 4.16Å; F608-A643 WeakPolarHBondContact O-CB 3.47Å; F608-A643 PolarHBondContact O-N 3.14Å; F608-A643 VanDerWaalsContact O-N 3.12Å; F608-L681 HydrophobicContact CD1-CB 4.16Å; F608-L681 HydrophobicContact CD1-CD2 4.44Å; F608-L681 HydrophobicContact CD2-CD2 3.82Å; F608-L681 HydrophobicContact CE1-CB 3.65Å; F608-L681 HydrophobicContact CE2-CB 4.09Å; F608-L681 HydrophobicContact CE2-CD2 3.95Å; F608-L681 HydrophobicContact CG-CD2 4.09Å; F608-L681 HydrophobicContact CZ-CB 3.62Å; F608-L681 HydrophobicContact CZ-CD2 4.32Å
609	G	89	Confident	78.9	Confident	8 Å²	8	66.4 Å²	66.4	8%	0.082	38%	0.382	C	S	.	.			trans	74.6	45.2	171.6	0	0	0	0	0	116	E638 S641	G609-E638 WeakPolarHBondContact CA-OE2 3.37Å; G609-E638 PolarHBondContact O-N 3.44Å; G609-S641 PolarHBondContact O-OG 3.01Å
610	F	91.8	Very high	77.6	Confident	29 Å²	29	68.7 Å²	68.7	13%	0.127	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	162.7	171.4	65.4	-93.5	0	0	0	111	L601 F608 V612 L634 K636 V637 A643 I674 L681 L683	L601-F610 HydrophobicContact CD1-CD1 3.87Å; L601-F610 HydrophobicContact CD1-CE1 3.43Å; L601-F610 VanDerWaalsContact CD1-CE1 3.43Å; L601-F610 HydrophobicContact CD1-CZ 4.4Å; F608-F610 HydrophobicContact CB-CD1 3.73Å; F608-F610 HydrophobicContact CB-CE1 3.37Å; F608-F610 HydrophobicContact CB-CZ 4.41Å; F608-F610 HydrophobicContact CD2-CE1 4.45Å; F608-F610 HydrophobicContact CG-CE1 4.16Å; F610-V612 HydrophobicContact CD2-CG2 3.83Å; F610-V612 HydrophobicContact CE2-CG2 3.44Å; F610-V612 VanDerWaalsContact CE2-CG2 3.44Å; F610-L634 HydrophobicContact CB-CD2 4.33Å; F610-L634 HydrophobicContact CD2-CD2 3.34Å; F610-L634 HydrophobicContact CE2-CD2 3.88Å; F610-L634 HydrophobicContact CG-CD2 4.08Å; F610-K636 CarbonylContact C-O 3.37Å; F610-K636 VanDerWaalsContact CA-O 3.31Å; F610-K636 WeakPolarHBondContact CA-O 3.3Å; F610-V637 HydrophobicContact CB-CG2 4.39Å; F610-A643 HydrophobicContact CB-CB 4.01Å; F610-A643 HydrophobicContact CD1-CB 3.88Å; F610-A643 HydrophobicContact CG-CB 4.39Å; F610-I674 HydrophobicContact CE2-CD1 4.37Å; F610-I674 HydrophobicContact CZ-CD1 4.49Å; F610-I674 HydrophobicContact CZ-CG2 4.22Å; F610-L681 HydrophobicContact CE1-CD2 3.91Å; F610-L681 HydrophobicContact CZ-CD2 3.66Å; F610-L683 HydrophobicContact CE1-CD1 4.36Å; F610-L683 HydrophobicContact CZ-CD1 4.15Å
611	V	90.8	Very high	76.4	Confident	60 Å²	60	75.3 Å²	75.3	36%	0.364	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	123.2	178.3	-177.3	0	0	0	0	109.5	L634 E635 K636	V611-L634 CarbonylContact O-C 3.43Å; V611-L634 WeakPolarHBondContact O-CA 3.38Å; V611-E635 HydrophobicContact CG1-CB 4.39Å; V611-E635 PolarHBondContact O-N 3.42Å; V611-K636 HydrophobicContact CB-CB 4.17Å; V611-K636 HydrophobicContact CG2-CB 4.12Å; V611-K636 PolarHBondContact N-O 3.31Å
612	V	91.1	Very high	75.6	Confident	22 Å²	22	76.7 Å²	76.7	13%	0.133	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	142.2	174.1	-171.2	0	0	0	0	109.8	F610 Q632 Y633 L634 I654 I674	F610-V612 HydrophobicContact CD2-CG2 3.83Å; F610-V612 HydrophobicContact CE2-CG2 3.44Å; F610-V612 VanDerWaalsContact CE2-CG2 3.44Å; V612-Q632 HydrophobicContact CG1-CB 4.06Å; V612-Y633 WeakPolarHBondContact CA-O 3.2Å; V612-L634 HydrophobicContact CG2-CD2 4.09Å; V612-I654 HydrophobicContact CG1-CD1 3.91Å; V612-I654 HydrophobicContact CG2-CD1 3.96Å; V612-I674 HydrophobicContact CG2-CD1 3.9Å
613	R	88.3	Confident	74.7	Confident	94 Å²	94	76.8 Å²	76.8	36%	0.355	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	135	175.8	-162.3	175.3	-172.9	106	-26.5	110.7	Q632 Y633 E635	R613-Q632 WeakPolarHBondContact O-CA 3.12Å; R613-Y633 HydrophobicContact CB-CE1 4.43Å; R613-Y633 HydrophobicContact CB-CE2 4.09Å; R613-Y633 WeakPolarHBondContact CD-OH 3.48Å; R613-Y633 PolarHBondContact N-O 2.96Å; R613-Y633 WeakPolarHBondContact O-CD1 3.44Å; R613-Y633 PolarHBondContact O-N 3.12Å; R613-Y633 VanDerWaalsContact O-N 3.1Å; R613-E635 HydrophobicContact CB-CB 4.03Å; R613-E635 WeakPolarHBondContact CD-OE2 3.23Å; R613-E635 IonicContact CZ-OE1 2.67Å; R613-E635 IonicContact CZ-OE2 3.51Å; R613-E635 IonicContact NE-OE1 3.58Å; R613-E635 IonicContact NE-OE2 2.7Å; R613-E635 IonicContact NH1-OE1 3.05Å; R613-E635 PolarHBondContact NH1-OE1 3.22Å; R613-E635 IonicContact NH1-OE2 3.12Å; R613-E635 PolarHBondContact NH1-OE2 3.03Å; R613-E635 IonicContact NH2-OE1 3.8Å
614	G	83.3	Confident	74	Confident	21 Å²	21	73.5 Å²	73.5	22%	0.216	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	148	168.9	0	0	0	0	0	112.1	K616	G614-K616 PolarHBondContact O-N 3.12Å
615	K	70.9	Confident	73.5	Confident	91 Å²	91	74.7 Å²	74.7	40%	0.396	45%	0.454	S	S	.	.			trans	-65.4	113.7	173.8	-172.9	175.1	-178.8	177.7	0	110.4	V618 C628 S631	K615-V618 HydrophobicContact CB-CG2 3.89Å; K615-V618 HydrophobicContact CD-CG2 4.02Å; K615-V618 HydrophobicContact CG-CG2 3.95Å; K615-C628 PolarHBondContact NZ-SG 3.32Å; K615-S631 PolarHBondContact N-O 2.68Å
616	K	61.4	Low	72.8	Confident	183 Å²	183	71.9 Å²	71.9	80%	0.796	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	139.4	172.3	-75.8	-169.3	173.1	-171.6	0	109.9	G614	G614-K616 PolarHBondContact O-N 3.12Å
617	G	56.2	Low	72.3	Confident	77 Å²	77	71.5 Å²	71.5	79%	0.794	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.3	2.1	179.6	0	0	0	0	0	115.8	S619	G617-S619 PolarHBondContact O-N 3.09Å
618	V	54	Low	71.8	Confident	65 Å²	65	71.1 Å²	71.1	39%	0.394	42%	0.418	S	S	.	.			trans	-90.4	85.5	175.7	-174.7	0	0	0	0	110.5	K615 F622	K615-V618 HydrophobicContact CB-CG2 3.89Å; K615-V618 HydrophobicContact CD-CG2 4.02Å; K615-V618 HydrophobicContact CG-CG2 3.95Å; V618-F622 HydrophobicContact CG1-CB 4.05Å; V618-F622 HydrophobicContact CG1-CD2 3.96Å; V618-F622 HydrophobicContact CG1-CG 4.49Å; V618-F622 HydrophobicContact CG2-CD2 4.25Å
619	S	42.8	Very low	71.3	Confident	124 Å²	124	70.4 Å²	70.4	87%	0.867	42%	0.416	S	S	*	.			trans	-107.8	76.8	172.2	57.3	0	0	0	0	110.6	G617	G617-S619 PolarHBondContact O-N 3.09Å
620	G	55.7	Low	71.1	Confident	60 Å²	60	70 Å²	70	62%	0.619	41%	0.412	S	S	*	.	S	Bend	trans	158.8	-179.2	-177.9	0	0	0	0	0	112.2	F622	G620-F622 PolarHBondContact O-N 3.07Å; G620-F622 VanDerWaalsContact O-N 3.16Å
621	N	59.1	Low	70.6	Confident	169 Å²	169	69.2 Å²	69.2	90%	0.904	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-61.5	116.1	175.9	-73.3	-9.8	0	0	0	110.3	T623	N621-T623 PolarHBondContact O-N 3.47Å
622	F	68.9	Low	70.5	Confident	30 Å²	30	66.5 Å²	66.5	13%	0.132	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-75.4	123.3	-179.9	178	-96.3	0	0	0	111.4	V618 G620 P624 C628 A630 T663 T664	V618-F622 HydrophobicContact CG1-CB 4.05Å; V618-F622 HydrophobicContact CG1-CD2 3.96Å; V618-F622 HydrophobicContact CG1-CG 4.49Å; V618-F622 HydrophobicContact CG2-CD2 4.25Å; G620-F622 PolarHBondContact O-N 3.07Å; G620-F622 VanDerWaalsContact O-N 3.16Å; F622-P624 HydrophobicContact CE1-CB 4.04Å; F622-C628 HydrophobicContact CZ-CB 4.4Å; F622-C628 WeakPolarHBondContact CZ-O 3.44Å; F622-A630 VanDerWaalsContact CE1-C 3.42Å; F622-A630 WeakPolarHBondContact CZ-O 3.3Å; F622-T663 VanDerWaalsContact CD1-O 3.22Å; F622-T663 WeakPolarHBondContact CD1-O 3.39Å; F622-T663 VanDerWaalsContact CE1-O 3.32Å; F622-T663 WeakPolarHBondContact CE1-O 3.38Å; F622-T664 HydrophobicContact CD1-CG2 4.39Å; F622-T664 WeakPolarHBondContact O-CG2 3.32Å
623	T	66.8	Low	70.5	Confident	120 Å²	120	68.6 Å²	68.6	74%	0.736	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-103.1	121.3	170.8	-19.5	0	0	0	0	109.2	N621	N621-T623 PolarHBondContact O-N 3.47Å
624	P	70.3	Confident	70.6	Confident	54 Å²	54	64.1 Å²	64.1	35%	0.351	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-67.6	141.2	179.2	27.6	-34.3	0	0	0	111.6	F622 P629	F622-P624 HydrophobicContact CE1-CB 4.04Å; P624-P629 WeakPolarHBondContact CB-O 3.33Å
625	S	70.3	Confident	70.9	Confident	49 Å²	49	67 Å²	67	34%	0.343	39%	0.39	S	S	.	.			trans	-129.7	171.2	179.1	77.2	0	0	0	0	111.8	E627 C628 P629	S625-E627 VanDerWaalsContact C-N 3.26Å; S625-E627 PolarHBondContact O-N 3.48Å; S625-E627 PolarHBondContact OG-N 3.37Å; S625-C628 PolarHBondContact N-O 3.03Å; S625-C628 CarbonylContact O-C 3.51Å; S625-C628 PolarHBondContact O-N 2.88Å; S625-C628 PolarHBondContact OG-N 2.85Å; S625-P629 WeakPolarHBondContact O-CA 3.31Å; S625-P629 VanDerWaalsContact O-N 3.17Å
626	L	64.5	Low	71.7	Confident	79 Å²	79	67.8 Å²	67.8	41%	0.414	39%	0.394	S	S	.	.	S	Bend	trans	-61.1	-31.9	175	-79.9	163.1	0	0	0	113.1	L579	L579-L626 HydrophobicContact CB-CD1 4.46Å; L579-L626 HydrophobicContact CB-CD2 4.05Å; L579-L626 HydrophobicContact CB-CG 4.29Å; L579-L626 HydrophobicContact CD2-CD1 4.45Å
627	E	69.3	Low	73.1	Confident	124 Å²	124	60.3 Å²	60.3	58%	0.579	36%	0.363	S	S	*	.	S	Bend	trans	-82.9	-24.4	176.2	-66.2	177.7	153.4	0	0	113.4	S625 I693	S625-E627 VanDerWaalsContact C-N 3.26Å; S625-E627 PolarHBondContact O-N 3.48Å; S625-E627 PolarHBondContact OG-N 3.37Å; E627-I693 HydrophobicContact CB-CD1 4.46Å; E627-I693 HydrophobicContact CG-CD1 3.94Å; E627-I693 HydrophobicContact CG-CG2 4.13Å
628	C	74.3	Confident	74.6	Confident	16 Å²	16	59.9 Å²	59.9	11%	0.108	34%	0.341	C	S	.	.			trans	-145.3	84.9	-177.5	-82.4	0	0	0	0	109.5	K615 F622 S625 A630 F653	K615-C628 PolarHBondContact NZ-SG 3.32Å; F622-C628 HydrophobicContact CZ-CB 4.4Å; F622-C628 WeakPolarHBondContact CZ-O 3.44Å; S625-C628 PolarHBondContact N-O 3.03Å; S625-C628 CarbonylContact O-C 3.51Å; S625-C628 PolarHBondContact O-N 2.88Å; S625-C628 PolarHBondContact OG-N 2.85Å; C628-A630 PolarHBondContact O-N 2.67Å; C628-F653 HydrophobicContact CB-CE1 4.29Å; C628-F653 HydrophobicContact CB-CZ 4.49Å
629	P	78.4	Confident	76	Confident	3 Å²	3	61.5 Å²	61.5	2%	0.019	35%	0.352	C	S	.	.	S	Bend	trans	-74.7	-10.1	-176.4	27.7	-34.4	0	0	0	114.1	I576 P624 S625 F653 L655 I686 V688	I576-P629 HydrophobicContact CD1-CB 3.61Å; I576-P629 HydrophobicContact CG1-CB 4.4Å; P624-P629 WeakPolarHBondContact CB-O 3.33Å; S625-P629 WeakPolarHBondContact O-CA 3.31Å; S625-P629 VanDerWaalsContact O-N 3.17Å; P629-F653 HydrophobicContact CG-CB 3.93Å; P629-F653 HydrophobicContact CG-CD1 4.36Å; P629-F653 HydrophobicContact CG-CD2 4.06Å; P629-F653 HydrophobicContact CG-CG 3.88Å; P629-L655 HydrophobicContact CB-CD2 4.19Å; P629-I686 HydrophobicContact CB-CG2 4.09Å; P629-I686 HydrophobicContact CG-CG2 3.47Å; P629-I686 VanDerWaalsContact CG-CG2 3.47Å; P629-V688 HydrophobicContact CG-CG2 3.82Å
630	A	84.4	Confident	77.9	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	35%	0.347	C	S	.	.	S	Bend	trans	-147.9	160.3	174.5	0	0	0	0	0	112.4	F622 C628 Q632 F653 I654 L655	F622-A630 VanDerWaalsContact CE1-C 3.42Å; F622-A630 WeakPolarHBondContact CZ-O 3.3Å; C628-A630 PolarHBondContact O-N 2.67Å; A630-Q632 PolarHBondContact O-N 2.75Å; A630-F653 HydrophobicContact CB-CB 4.33Å; A630-F653 HydrophobicContact CB-CD1 4.34Å; A630-I654 WeakPolarHBondContact CB-O 3.42Å; A630-L655 HydrophobicContact CB-CD2 4.38Å
631	S	82.5	Confident	79.3	Confident	13 Å²	13	61.1 Å²	61.1	9%	0.091	32%	0.322	C	S	.	.	S	Bend	trans	-67.3	-14.9	175.7	63.8	0	0	0	0	114	K615 T663 M665	K615-S631 PolarHBondContact N-O 2.68Å; S631-T663 PolarHBondContact N-O 3.39Å; S631-T663 PolarHBondContact OG-O 2.93Å; S631-M665 PolarHBondContact OG-O 3.25Å
632	Q	87.5	Confident	80.6	Confident	3 Å²	3	53.7 Å²	53.7	1%	0.014	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	144	-169.2	-65.9	180	68.6	0	0	113.1	V612 R613 A630 I654 M665 S666 H667	V612-Q632 HydrophobicContact CG1-CB 4.06Å; R613-Q632 WeakPolarHBondContact O-CA 3.12Å; A630-Q632 PolarHBondContact O-N 2.75Å; Q632-I654 PolarHBondContact O-N 3.27Å; Q632-M665 PolarHBondContact NE2-O 3.08Å; Q632-S666 PolarHBondContact NE2-O 3.39Å; Q632-S666 VanDerWaalsContact NE2-O 3.12Å; Q632-H667 PolarHBondContact OE1-ND1 2.89Å
633	Y	90.7	Very high	81.5	Confident	65 Å²	65	52.3 Å²	52.3	26%	0.255	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	166.7	-177.7	61.5	-85.7	0	0	0	111.6	V612 R613 D652	V612-Y633 WeakPolarHBondContact CA-O 3.2Å; R613-Y633 HydrophobicContact CB-CE1 4.43Å; R613-Y633 HydrophobicContact CB-CE2 4.09Å; R613-Y633 WeakPolarHBondContact CD-OH 3.48Å; R613-Y633 PolarHBondContact N-O 2.96Å; R613-Y633 WeakPolarHBondContact O-CD1 3.44Å; R613-Y633 PolarHBondContact O-N 3.12Å; R613-Y633 VanDerWaalsContact O-N 3.1Å; Y633-D652 CarbonylContact C-O 3.58Å; Y633-D652 VanDerWaalsContact CA-O 3.3Å; Y633-D652 WeakPolarHBondContact CA-O 3.22Å
634	L	90.5	Very high	82.4	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	113.6	175	-62.7	-175.9	0	0	0	110.9	F610 V611 V612 V637 L648 A650 G651 D652 I654	F610-L634 HydrophobicContact CB-CD2 4.33Å; F610-L634 HydrophobicContact CD2-CD2 3.34Å; F610-L634 HydrophobicContact CE2-CD2 3.88Å; F610-L634 HydrophobicContact CG-CD2 4.08Å; V611-L634 CarbonylContact O-C 3.43Å; V611-L634 WeakPolarHBondContact O-CA 3.38Å; V612-L634 HydrophobicContact CG2-CD2 4.09Å; L634-V637 HydrophobicContact CD1-CG2 4.3Å; L634-L648 HydrophobicContact CD1-CB 4.05Å; L634-L648 HydrophobicContact CD1-CD1 3.9Å; L634-L648 HydrophobicContact CD1-CD2 3.72Å; L634-L648 HydrophobicContact CD1-CG 4.12Å; L634-A650 CarbonylContact O-C 3.57Å; L634-A650 WeakPolarHBondContact O-CA 3.4Å; L634-G651 PolarHBondContact O-N 3.41Å; L634-D652 HydrophobicContact CD1-CB 4.17Å; L634-D652 HydrophobicContact CG-CB 4.5Å; L634-D652 PolarHBondContact N-O 3.41Å; L634-I654 HydrophobicContact CD2-CD1 4.05Å
635	E	89.6	Confident	83	Confident	81 Å²	81	54.9 Å²	54.9	38%	0.379	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	-42.5	176.4	170.1	175.9	-153.2	0	0	111.7	V611 R613 A650	V611-E635 HydrophobicContact CG1-CB 4.39Å; V611-E635 PolarHBondContact O-N 3.42Å; R613-E635 HydrophobicContact CB-CB 4.03Å; R613-E635 WeakPolarHBondContact CD-OE2 3.23Å; R613-E635 IonicContact CZ-OE1 2.67Å; R613-E635 IonicContact CZ-OE2 3.51Å; R613-E635 IonicContact NE-OE1 3.58Å; R613-E635 IonicContact NE-OE2 2.7Å; R613-E635 IonicContact NH1-OE1 3.05Å; R613-E635 PolarHBondContact NH1-OE1 3.22Å; R613-E635 IonicContact NH1-OE2 3.12Å; R613-E635 PolarHBondContact NH1-OE2 3.03Å; R613-E635 IonicContact NH2-OE1 3.8Å; E635-A650 WeakPolarHBondContact O-CB 3.46Å
636	K	88.8	Confident	83.6	Confident	109 Å²	109	54.3 Å²	54.3	47%	0.474	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	135.6	-175.5	-174.4	-174.3	178.4	-165.5	0	109.5	F610 V611	F610-K636 CarbonylContact C-O 3.37Å; F610-K636 VanDerWaalsContact CA-O 3.31Å; F610-K636 WeakPolarHBondContact CA-O 3.3Å; V611-K636 HydrophobicContact CB-CB 4.17Å; V611-K636 HydrophobicContact CG2-CB 4.12Å; V611-K636 PolarHBondContact N-O 3.31Å
637	V	89.9	Confident	84.5	Confident	25 Å²	25	52.3 Å²	52.3	15%	0.152	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	131.8	165.4	179.2	0	0	0	0	107	F610 L634 A643 L648	F610-V637 HydrophobicContact CB-CG2 4.39Å; L634-V637 HydrophobicContact CD1-CG2 4.3Å; V637-A643 HydrophobicContact CG1-CB 3.79Å; V637-L648 HydrophobicContact CG2-CB 4.04Å
638	E	88.2	Confident	85.4	Confident	69 Å²	69	46.9 Å²	46.9	32%	0.322	25%	0.247	S	C	.	.			trans	-78.2	130.1	-179.7	-65.3	-171.5	137.7	0	0	110.7	G609 S641 S644	G609-E638 WeakPolarHBondContact CA-OE2 3.37Å; G609-E638 PolarHBondContact O-N 3.44Å; E638-S641 WeakPolarHBondContact O-CB 3.44Å; E638-S641 PolarHBondContact O-N 3.45Å; E638-S641 PolarHBondContact O-OG 3.3Å; E638-S644 WeakPolarHBondContact O-CB 3.31Å
639	P	82.8	Confident	86	Confident	99 Å²	99	51.8 Å²	51.8	64%	0.643	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	141.2	178.2	27	-34.3	0	0	0	110.5	S641	P639-S641 PolarHBondContact O-N 3.06Å
640	H	82.9	Confident	86.5	Confident	161 Å²	161	54.8 Å²	54.8	75%	0.745	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	13.7	-175.5	-41.3	-78.7	0	0	0	115.3	S644 R645	H640-S644 PolarHBondContact N-OG 3.25Å; H640-R645 PolarHBondContact O-NH1 2.99Å
641	S	86.5	Confident	86.6	Confident	14 Å²	14	56.6 Å²	56.6	10%	0.098	31%	0.309	C	S	.	.	S	Bend	trans	-78.8	179.7	172.2	85.8	0	0	0	0	113.4	G609 E638 P639 A643 S644 R645	G609-S641 PolarHBondContact O-OG 3.01Å; E638-S641 WeakPolarHBondContact O-CB 3.44Å; E638-S641 PolarHBondContact O-N 3.45Å; E638-S641 PolarHBondContact O-OG 3.3Å; P639-S641 PolarHBondContact O-N 3.06Å; S641-A643 PolarHBondContact OG-N 2.88Å; S641-S644 PolarHBondContact OG-N 2.98Å; S641-R645 PolarHBondContact O-N 3.06Å
642	A	84.5	Confident	86.9	Confident	14 Å²	14	56 Å²	56	12%	0.116	31%	0.305	C	S	.	.	H	α-helix	trans	-63.1	-43.6	171.9	0	0	0	0	0	111.5	Q602 R645 A646	Q602-A642 VanDerWaalsContact O-CB 3.22Å; Q602-A642 WeakPolarHBondContact O-CB 3.42Å; A642-R645 PolarHBondContact O-N 2.91Å; A642-A646 WeakPolarHBondContact O-CB 3.31Å; A642-A646 PolarHBondContact O-N 3.35Å; A642-A646 VanDerWaalsContact O-N 3.09Å
643	A	88.4	Confident	87	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-62.4	-43.2	174.9	0	0	0	0	0	113.4	L601 F608 F610 V637 S641 A646 G647 L648	L601-A643 HydrophobicContact CD1-CB 4.35Å; L601-A643 HydrophobicContact CD2-CB 4.49Å; F608-A643 WeakPolarHBondContact O-CB 3.47Å; F608-A643 PolarHBondContact O-N 3.14Å; F608-A643 VanDerWaalsContact O-N 3.12Å; F610-A643 HydrophobicContact CB-CB 4.01Å; F610-A643 HydrophobicContact CD1-CB 3.88Å; F610-A643 HydrophobicContact CG-CB 4.39Å; V637-A643 HydrophobicContact CG1-CB 3.79Å; S641-A643 PolarHBondContact OG-N 2.88Å; A643-A646 PolarHBondContact O-N 2.96Å; A643-A646 VanDerWaalsContact O-N 3.16Å; A643-G647 PolarHBondContact O-N 2.95Å; A643-L648 HydrophobicContact CB-CB 4.23Å; A643-L648 HydrophobicContact CB-CD1 3.72Å; A643-L648 PolarHBondContact O-N 3.5Å; A643-L648 VanDerWaalsContact O-N 3.16Å
644	S	86.2	Confident	87	Confident	50 Å²	50	53.8 Å²	53.8	35%	0.35	30%	0.297	S	S	.	.	H	α-helix	trans	-62.6	-43.2	176.2	165.9	0	0	0	0	112	E638 H640 S641 A646 G647	E638-S644 WeakPolarHBondContact O-CB 3.31Å; H640-S644 PolarHBondContact N-OG 3.25Å; S641-S644 PolarHBondContact OG-N 2.98Å; S644-A646 PolarHBondContact O-N 3.17Å; S644-G647 PolarHBondContact O-N 3.48Å
645	R	83	Confident	86.8	Confident	179 Å²	179	54.4 Å²	54.4	68%	0.675	30%	0.3	S	S	*	.	H	α-helix	trans	-64.5	-25.4	174.2	-78.9	-171.1	-67.2	-80.7	-6.6	113.9	H640 S641 A642	H640-R645 PolarHBondContact O-NH1 2.99Å; S641-R645 PolarHBondContact O-N 3.06Å; A642-R645 PolarHBondContact O-N 2.91Å
646	A	82.4	Confident	86.8	Confident	36 Å²	36	52.3 Å²	52.3	30%	0.298	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	5.1	-178.2	0	0	0	0	0	113.9	I599 L601 A642 A643 S644	I599-A646 HydrophobicContact CG2-CB 3.65Å; L601-A646 HydrophobicContact CD2-CB 3.35Å; A642-A646 WeakPolarHBondContact O-CB 3.31Å; A642-A646 PolarHBondContact O-N 3.35Å; A642-A646 VanDerWaalsContact O-N 3.09Å; A643-A646 PolarHBondContact O-N 2.96Å; A643-A646 VanDerWaalsContact O-N 3.16Å; S644-A646 PolarHBondContact O-N 3.17Å
647	G	83.2	Confident	86.8	Confident	38 Å²	38	47.1 Å²	47.1	39%	0.392	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.9	20.3	174.8	0	0	0	0	0	115.4	R597 A643 S644	R597-G647 PolarHBondContact NH1-O 3.43Å; A643-G647 PolarHBondContact O-N 2.95Å; S644-G647 PolarHBondContact O-N 3.48Å
648	L	88.2	Confident	86.5	Confident	10 Å²	10	48.9 Å²	48.9	5%	0.052	28%	0.277	C	S	.	.			trans	-74.7	141.9	169.7	-73.9	174.7	0	0	0	111.6	I599 L601 L634 V637 A643 L683 V685	I599-L648 HydrophobicContact CD1-CD2 3.53Å; I599-L648 HydrophobicContact CD1-CG 3.91Å; L601-L648 HydrophobicContact CD1-CD1 3.79Å; L601-L648 HydrophobicContact CD2-CD1 4.24Å; L601-L648 HydrophobicContact CG-CD1 4.5Å; L634-L648 HydrophobicContact CD1-CB 4.05Å; L634-L648 HydrophobicContact CD1-CD1 3.9Å; L634-L648 HydrophobicContact CD1-CD2 3.72Å; L634-L648 HydrophobicContact CD1-CG 4.12Å; V637-L648 HydrophobicContact CG2-CB 4.04Å; A643-L648 HydrophobicContact CB-CB 4.23Å; A643-L648 HydrophobicContact CB-CD1 3.72Å; A643-L648 PolarHBondContact O-N 3.5Å; A643-L648 VanDerWaalsContact O-N 3.16Å; L648-L683 HydrophobicContact CD1-CD1 4.07Å; L648-V685 HydrophobicContact CD2-CB 4.34Å; L648-V685 HydrophobicContact CD2-CG1 4.03Å; L648-V685 HydrophobicContact CD2-CG2 3.67Å
649	K	88	Confident	86.1	Confident	119 Å²	119	51.2 Å²	51.2	52%	0.517	29%	0.291	S	S	.	.			trans	-117.1	158.1	176	-61.7	178.8	-179.9	177.2	0	110.8	D652	K649-D652 PolarHBondContact N-OD2 2.92Å; K649-D652 PolarHBondContact O-N 3.15Å
650	A	87.4	Confident	86.2	Confident	66 Å²	66	50.2 Å²	50.2	55%	0.545	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	138	160.1	0	0	0	0	0	108.9	L634 E635	L634-A650 CarbonylContact O-C 3.57Å; L634-A650 WeakPolarHBondContact O-CA 3.4Å; E635-A650 WeakPolarHBondContact O-CB 3.46Å
651	G	86.5	Confident	86.2	Confident	37 Å²	37	45.6 Å²	45.6	38%	0.381	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.8	-11.2	-172.8	0	0	0	0	0	115.3	L634 F653	L634-G651 PolarHBondContact O-N 3.41Å; G651-F653 PolarHBondContact O-N 2.74Å
652	D	89.5	Confident	86.2	Confident	0 Å²	0	45 Å²	45	0%	0	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-67.3	126.3	175.4	-74.7	-16.6	0	0	0	111	R597 Y633 L634 K649 V685 T687	R597-D652 IonicContact CZ-OD2 2.68Å; R597-D652 IonicContact NH2-OD1 3.91Å; R597-D652 PolarHBondContact NH2-OD1 3.22Å; R597-D652 IonicContact NH2-OD2 2.71Å; R597-D652 PolarHBondContact NH2-OD2 2.76Å; Y633-D652 CarbonylContact C-O 3.58Å; Y633-D652 VanDerWaalsContact CA-O 3.3Å; Y633-D652 WeakPolarHBondContact CA-O 3.22Å; L634-D652 HydrophobicContact CD1-CB 4.17Å; L634-D652 HydrophobicContact CG-CB 4.5Å; L634-D652 PolarHBondContact N-O 3.41Å; K649-D652 PolarHBondContact N-OD2 2.92Å; K649-D652 PolarHBondContact O-N 3.15Å; D652-V685 HydrophobicContact CB-CB 4.32Å; D652-T687 WeakPolarHBondContact OD1-CB 3.37Å; D652-T687 PolarHBondContact OD1-OG1 2.86Å
653	F	90.3	Very high	86.2	Confident	23 Å²	23	45.3 Å²	45.3	10%	0.101	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	140.4	177	-75.1	-92.6	0	0	0	111.6	C628 P629 A630 G651 V685 I686 V688	C628-F653 HydrophobicContact CB-CE1 4.29Å; C628-F653 HydrophobicContact CB-CZ 4.49Å; P629-F653 HydrophobicContact CG-CB 3.93Å; P629-F653 HydrophobicContact CG-CD1 4.36Å; P629-F653 HydrophobicContact CG-CD2 4.06Å; P629-F653 HydrophobicContact CG-CG 3.88Å; A630-F653 HydrophobicContact CB-CB 4.33Å; A630-F653 HydrophobicContact CB-CD1 4.34Å; G651-F653 PolarHBondContact O-N 2.74Å; F653-V685 CarbonylContact O-C 3.1Å; F653-V685 WeakPolarHBondContact O-CA 3.49Å; F653-I686 HydrophobicContact CB-CG2 3.91Å; F653-I686 PolarHBondContact N-O 3.2Å; F653-I686 PolarHBondContact O-N 3.06Å; F653-V688 HydrophobicContact CD2-CB 4.46Å; F653-V688 HydrophobicContact CD2-CG2 3.94Å; F653-V688 HydrophobicContact CE2-CB 4.26Å; F653-V688 HydrophobicContact CE2-CG2 4.1Å
654	I	90.2	Very high	85.9	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	119.6	-177	-46	177.7	0	0	0	110.8	V612 A630 Q632 L634 V657 V662 L683 V685	V612-I654 HydrophobicContact CG1-CD1 3.91Å; V612-I654 HydrophobicContact CG2-CD1 3.96Å; A630-I654 WeakPolarHBondContact CB-O 3.42Å; Q632-I654 PolarHBondContact O-N 3.27Å; L634-I654 HydrophobicContact CD2-CD1 4.05Å; I654-V657 HydrophobicContact CG2-CG2 3.84Å; I654-V662 HydrophobicContact CB-CG2 4.31Å; I654-V662 HydrophobicContact CG2-CG2 3.76Å; I654-L683 HydrophobicContact CG2-CD2 4.19Å; I654-V685 HydrophobicContact CG1-CG1 4.26Å
655	L	86.7	Confident	85.7	Confident	12 Å²	12	49.4 Å²	49.4	6%	0.063	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	-46.8	-178.5	-59.8	176.2	0	0	0	112.7	I576 P596 P629 A630 V662 T663 K684 I686	I576-L655 HydrophobicContact CD1-CD2 4.02Å; P596-L655 HydrophobicContact CB-CD1 3.85Å; P629-L655 HydrophobicContact CB-CD2 4.19Å; A630-L655 HydrophobicContact CB-CD2 4.38Å; L655-V662 WeakPolarHBondContact O-CG2 3.2Å; L655-V662 PolarHBondContact O-N 3.32Å; L655-T663 HydrophobicContact CB-CG2 4.26Å; L655-T663 HydrophobicContact CD2-CG2 3.79Å; L655-T663 PolarHBondContact O-N 3.02Å; L655-K684 HydrophobicContact CB-CB 4.29Å; L655-K684 HydrophobicContact CB-CD 4.33Å; L655-K684 HydrophobicContact CB-CG 4.19Å; L655-K684 HydrophobicContact CD1-CG 4.29Å; L655-K684 PolarHBondContact N-O 2.86Å; L655-I686 HydrophobicContact CD1-CB 4.06Å; L655-I686 HydrophobicContact CD1-CG2 3.93Å; L655-I686 HydrophobicContact CD2-CG2 4Å; L655-I686 HydrophobicContact CG-CG2 4Å
656	E	89	Confident	85.8	Confident	37 Å²	37	44.2 Å²	44.2	17%	0.173	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	145.1	179.9	-74.1	149.4	-140.1	0	0	110.6	I660 N661 K684	E656-I660 CarbonylContact C-O 3.54Å; E656-I660 WeakPolarHBondContact CA-O 3.33Å; E656-N661 HydrophobicContact CG-CB 4.24Å; E656-K684 HydrophobicContact CB-CB 3.8Å; E656-K684 HydrophobicContact CB-CD 4.09Å; E656-K684 HydrophobicContact CG-CD 4.1Å; E656-K684 PolarHBondContact N-O 3.45Å; E656-K684 PolarHBondContact O-N 3.14Å; E656-K684 WeakPolarHBondContact OE1-CD 3.23Å; E656-K684 IonicContact OE1-NZ 3.29Å; E656-K684 PolarHBondContact OE1-NZ 2.92Å; E656-K684 WeakPolarHBondContact OE2-CD 3.4Å; E656-K684 IonicContact OE2-NZ 3.67Å; E656-K684 PolarHBondContact OE2-NZ 3.19Å
657	V	88.1	Confident	86	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	119.1	174.9	171.9	0	0	0	0	108	I654 N659 I660 V662 V670 L673 I674 L681 G682 L683	I654-V657 HydrophobicContact CG2-CG2 3.84Å; V657-N659 PolarHBondContact O-N 2.96Å; V657-I660 PolarHBondContact N-O 2.96Å; V657-I660 WeakPolarHBondContact O-CB 3.47Å; V657-I660 PolarHBondContact O-N 3.15Å; V657-V662 HydrophobicContact CB-CG1 3.84Å; V657-V662 HydrophobicContact CG2-CB 4.48Å; V657-V662 HydrophobicContact CG2-CG1 3.75Å; V657-V662 HydrophobicContact CG2-CG2 3.96Å; V657-V670 HydrophobicContact CG2-CG1 4.25Å; V657-L673 HydrophobicContact CG1-CB 3.92Å; V657-I674 HydrophobicContact CG1-CG1 4.1Å; V657-I674 HydrophobicContact CG2-CD1 4.49Å; V657-I674 HydrophobicContact CG2-CG1 4.31Å; V657-L681 HydrophobicContact CG1-CD1 3.77Å; V657-G682 CarbonylContact C-O 3.47Å; V657-G682 WeakPolarHBondContact CA-O 3.21Å; V657-L683 HydrophobicContact CG2-CD2 3.82Å
658	N	85.5	Confident	86.1	Confident	63 Å²	63	52.1 Å²	52.1	34%	0.337	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.2	45.9	-178.5	-58.2	-32.4	0	0	0	112.8	I660 G682	N658-I660 PolarHBondContact O-N 2.89Å; N658-G682 PolarHBondContact N-O 3.07Å; N658-G682 PolarHBondContact OD1-N 2.89Å
659	N	78.8	Confident	86.1	Confident	117 Å²	117	53.2 Å²	53.2	63%	0.626	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.5	1	-174.1	-55	-16.8	0	0	0	116.6	V657	V657-N659 PolarHBondContact O-N 2.96Å
660	I	84.5	Confident	86.1	Confident	78 Å²	78	47.5 Å²	47.5	40%	0.4	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	128.2	171.9	-60.4	165.2	0	0	0	108.6	E656 V657 N658 V662 M665 L673	E656-I660 CarbonylContact C-O 3.54Å; E656-I660 WeakPolarHBondContact CA-O 3.33Å; V657-I660 PolarHBondContact N-O 2.96Å; V657-I660 WeakPolarHBondContact O-CB 3.47Å; V657-I660 PolarHBondContact O-N 3.15Å; N658-I660 PolarHBondContact O-N 2.89Å; I660-V662 PolarHBondContact O-N 3.29Å; I660-M665 HydrophobicContact CG2-SD 4.03Å; I660-L673 HydrophobicContact CB-CD1 4.25Å; I660-L673 HydrophobicContact CD1-CD1 4.21Å; I660-L673 HydrophobicContact CD1-CD2 3.62Å; I660-L673 HydrophobicContact CG2-CD1 3.95Å
661	N	83.3	Confident	86.3	Confident	65 Å²	65	45.9 Å²	45.9	35%	0.348	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	120.9	177	-172.6	-48.4	0	0	0	110.3	E656 T663 M665	E656-N661 HydrophobicContact CG-CB 4.24Å; N661-T663 WeakPolarHBondContact OD1-CB 3.48Å; N661-T663 WeakPolarHBondContact OD1-CG2 3.48Å; N661-T663 PolarHBondContact OD1-N 3.36Å; N661-T663 PolarHBondContact OD1-OG1 3.09Å; N661-M665 VanDerWaalsContact O-SD 3.36Å
662	V	86.8	Confident	86.3	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.012	26%	0.262	C	S	.	.			trans	-108.9	1.3	-176.5	-62.9	0	0	0	0	113.8	I654 L655 V657 I660 T664 M665 V670 L673	I654-V662 HydrophobicContact CB-CG2 4.31Å; I654-V662 HydrophobicContact CG2-CG2 3.76Å; L655-V662 WeakPolarHBondContact O-CG2 3.2Å; L655-V662 PolarHBondContact O-N 3.32Å; V657-V662 HydrophobicContact CB-CG1 3.84Å; V657-V662 HydrophobicContact CG2-CB 4.48Å; V657-V662 HydrophobicContact CG2-CG1 3.75Å; V657-V662 HydrophobicContact CG2-CG2 3.96Å; I660-V662 PolarHBondContact O-N 3.29Å; V662-T664 PolarHBondContact O-N 2.96Å; V662-M665 HydrophobicContact CB-CB 4.42Å; V662-M665 HydrophobicContact CB-SD 4.36Å; V662-M665 HydrophobicContact CG1-SD 3.9Å; V662-M665 PolarHBondContact O-N 3.44Å; V662-V670 HydrophobicContact CB-CG1 4.4Å; V662-V670 HydrophobicContact CB-CG2 3.65Å; V662-V670 HydrophobicContact CG1-CG1 4.29Å; V662-V670 HydrophobicContact CG1-CG2 3.72Å; V662-L673 HydrophobicContact CG1-CD1 3.94Å
663	T	83.6	Confident	86.3	Confident	19 Å²	19	49.5 Å²	49.5	12%	0.117	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-35.1	-172.4	55.3	0	0	0	0	114.1	F622 S631 L655 N661	F622-T663 VanDerWaalsContact CD1-O 3.22Å; F622-T663 WeakPolarHBondContact CD1-O 3.39Å; F622-T663 VanDerWaalsContact CE1-O 3.32Å; F622-T663 WeakPolarHBondContact CE1-O 3.38Å; S631-T663 PolarHBondContact N-O 3.39Å; S631-T663 PolarHBondContact OG-O 2.93Å; L655-T663 HydrophobicContact CB-CG2 4.26Å; L655-T663 HydrophobicContact CD2-CG2 3.79Å; L655-T663 PolarHBondContact O-N 3.02Å; N661-T663 WeakPolarHBondContact OD1-CB 3.48Å; N661-T663 WeakPolarHBondContact OD1-CG2 3.48Å; N661-T663 PolarHBondContact OD1-N 3.36Å; N661-T663 PolarHBondContact OD1-OG1 3.09Å
664	T	82.2	Confident	86.3	Confident	84 Å²	84	49.3 Å²	49.3	52%	0.515	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-1.3	179.7	59.3	0	0	0	0	113.8	F622 V662	F622-T664 HydrophobicContact CD1-CG2 4.39Å; F622-T664 WeakPolarHBondContact O-CG2 3.32Å; V662-T664 PolarHBondContact O-N 2.96Å
665	M	83.1	Confident	86.1	Confident	52 Å²	52	58.6 Å²	58.6	26%	0.256	31%	0.308	S	S	.	.			trans	-74.1	153.2	-174.1	-72.1	-174.9	66.9	0	0	112.7	S631 Q632 I660 N661 V662 A669 V670 L673	S631-M665 PolarHBondContact OG-O 3.25Å; Q632-M665 PolarHBondContact NE2-O 3.08Å; I660-M665 HydrophobicContact CG2-SD 4.03Å; N661-M665 VanDerWaalsContact O-SD 3.36Å; V662-M665 HydrophobicContact CB-CB 4.42Å; V662-M665 HydrophobicContact CB-SD 4.36Å; V662-M665 HydrophobicContact CG1-SD 3.9Å; V662-M665 PolarHBondContact O-N 3.44Å; M665-A669 HydrophobicContact CE-CB 3.57Å; M665-V670 HydrophobicContact CB-CG2 3.6Å; M665-L673 HydrophobicContact CE-CD1 3.88Å; M665-L673 HydrophobicContact SD-CD1 4.16Å
666	S	85.2	Confident	86	Confident	70 Å²	70	61 Å²	61	49%	0.49	34%	0.336	S	S	.	.			trans	-66.1	155.2	176.3	74	0	0	0	0	111.8	Q632 E668 A669 V670	Q632-S666 PolarHBondContact NE2-O 3.39Å; Q632-S666 VanDerWaalsContact NE2-O 3.12Å; S666-E668 VanDerWaalsContact C-N 3.3Å; S666-E668 PolarHBondContact O-N 3.17Å; S666-A669 PolarHBondContact O-N 2.82Å; S666-A669 WeakPolarHBondContact OG-CB 3.42Å; S666-A669 PolarHBondContact OG-N 3.17Å; S666-V670 WeakPolarHBondContact O-CG2 3.47Å; S666-V670 PolarHBondContact O-N 3.2Å; S666-V670 VanDerWaalsContact O-N 3.15Å
667	H	85.6	Confident	85.6	Confident	85 Å²	85	59.7 Å²	59.7	39%	0.394	33%	0.33	S	S	.	.	H	α-helix	trans	-59.6	-42.8	179.5	-173	46.1	0	0	0	112.2	Q632 A669 V670 V671	Q632-H667 PolarHBondContact OE1-ND1 2.89Å; H667-A669 PolarHBondContact O-N 3.21Å; H667-V670 PolarHBondContact O-N 3.27Å; H667-V671 WeakPolarHBondContact O-CB 3.22Å; H667-V671 VanDerWaalsContact O-CG2 3.25Å; H667-V671 WeakPolarHBondContact O-CG2 3.47Å; H667-V671 PolarHBondContact O-N 3.28Å
668	E	85.9	Confident	85	Confident	156 Å²	156	63.5 Å²	63.5	73%	0.729	36%	0.357	S	S	*	.	H	α-helix	trans	-63	-41.2	178.1	-176.2	165.9	-141.2	0	0	113	S666 S672	S666-E668 VanDerWaalsContact C-N 3.3Å; S666-E668 PolarHBondContact O-N 3.17Å; E668-S672 VanDerWaalsContact O-CB 3.29Å; E668-S672 WeakPolarHBondContact O-CB 3.41Å; E668-S672 PolarHBondContact O-N 3.28Å; E668-S672 PolarHBondContact O-OG 3.13Å
669	A	87.2	Confident	84.8	Confident	32 Å²	32	65.7 Å²	65.7	26%	0.264	37%	0.369	S	S	.	.	H	α-helix	trans	-68	-39.9	178.9	0	0	0	0	0	112	M665 S666 H667 S672 L673	M665-A669 HydrophobicContact CE-CB 3.57Å; S666-A669 PolarHBondContact O-N 2.82Å; S666-A669 WeakPolarHBondContact OG-CB 3.42Å; S666-A669 PolarHBondContact OG-N 3.17Å; H667-A669 PolarHBondContact O-N 3.21Å; A669-S672 WeakPolarHBondContact O-CB 3.23Å; A669-S672 PolarHBondContact O-N 3.36Å; A669-L673 WeakPolarHBondContact O-CG 3.44Å; A669-L673 PolarHBondContact O-N 2.86Å
670	V	89.7	Confident	85	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-72.8	-38.8	177.8	178.3	0	0	0	0	112	V657 V662 M665 S666 H667 S672 L673 I674	V657-V670 HydrophobicContact CG2-CG1 4.25Å; V662-V670 HydrophobicContact CB-CG1 4.4Å; V662-V670 HydrophobicContact CB-CG2 3.65Å; V662-V670 HydrophobicContact CG1-CG1 4.29Å; V662-V670 HydrophobicContact CG1-CG2 3.72Å; M665-V670 HydrophobicContact CB-CG2 3.6Å; S666-V670 WeakPolarHBondContact O-CG2 3.47Å; S666-V670 PolarHBondContact O-N 3.2Å; S666-V670 VanDerWaalsContact O-N 3.15Å; H667-V670 PolarHBondContact O-N 3.27Å; V670-S672 PolarHBondContact O-N 3.06Å; V670-L673 PolarHBondContact O-N 2.95Å; V670-I674 HydrophobicContact CG1-CD1 3.97Å; V670-I674 WeakPolarHBondContact O-CB 3.48Å; V670-I674 WeakPolarHBondContact O-CG1 3.18Å; V670-I674 PolarHBondContact O-N 2.6Å
671	V	90.4	Very high	85.2	Confident	31 Å²	31	58.7 Å²	58.7	19%	0.188	33%	0.332	C	S	.	.	H	α-helix	trans	-61.8	-36.4	171	168.4	0	0	0	0	110.7	H667 R675	H667-V671 WeakPolarHBondContact O-CB 3.22Å; H667-V671 VanDerWaalsContact O-CG2 3.25Å; H667-V671 WeakPolarHBondContact O-CG2 3.47Å; H667-V671 PolarHBondContact O-N 3.28Å; V671-R675 HydrophobicContact CG1-CG 4.43Å; V671-R675 WeakPolarHBondContact O-CB 3.4Å; V671-R675 VanDerWaalsContact O-CG 3.23Å; V671-R675 WeakPolarHBondContact O-CG 3.33Å; V671-R675 PolarHBondContact O-N 3.35Å
672	S	87.7	Confident	85.4	Confident	70 Å²	70	56.3 Å²	56.3	49%	0.49	32%	0.323	S	S	.	.	H	α-helix	trans	-67.2	-43.4	174.4	-60.2	0	0	0	0	112.4	E668 A669 V670 I674 R675 G676	E668-S672 VanDerWaalsContact O-CB 3.29Å; E668-S672 WeakPolarHBondContact O-CB 3.41Å; E668-S672 PolarHBondContact O-N 3.28Å; E668-S672 PolarHBondContact O-OG 3.13Å; A669-S672 WeakPolarHBondContact O-CB 3.23Å; A669-S672 PolarHBondContact O-N 3.36Å; V670-S672 PolarHBondContact O-N 3.06Å; S672-I674 PolarHBondContact O-N 2.98Å; S672-R675 PolarHBondContact O-N 3.01Å; S672-G676 PolarHBondContact O-N 2.89Å
673	L	89.1	Confident	85.5	Confident	44 Å²	44	56.3 Å²	56.3	23%	0.23	32%	0.322	C	S	.	.	H	α-helix	trans	-59.5	-45.9	173.1	-71.5	176.6	0	0	0	112.1	V657 I660 V662 M665 A669 V670 R675 G676 S677	V657-L673 HydrophobicContact CG1-CB 3.92Å; I660-L673 HydrophobicContact CB-CD1 4.25Å; I660-L673 HydrophobicContact CD1-CD1 4.21Å; I660-L673 HydrophobicContact CD1-CD2 3.62Å; I660-L673 HydrophobicContact CG2-CD1 3.95Å; V662-L673 HydrophobicContact CG1-CD1 3.94Å; M665-L673 HydrophobicContact CE-CD1 3.88Å; M665-L673 HydrophobicContact SD-CD1 4.16Å; A669-L673 WeakPolarHBondContact O-CG 3.44Å; A669-L673 PolarHBondContact O-N 2.86Å; V670-L673 PolarHBondContact O-N 2.95Å; L673-R675 PolarHBondContact O-N 3.12Å; L673-G676 PolarHBondContact O-N 3.46Å; L673-S677 PolarHBondContact O-N 3.21Å; L673-S677 VanDerWaalsContact O-N 3.15Å; L673-S677 PolarHBondContact O-OG 3.05Å
674	I	89.5	Confident	85.6	Confident	18 Å²	18	57.8 Å²	57.8	9%	0.092	33%	0.327	C	S	.	.	H	α-helix	trans	-65.8	-37.8	179.5	-70.8	170.6	0	0	0	111.6	F610 V612 V657 V670 S672 S677 L681	F610-I674 HydrophobicContact CE2-CD1 4.37Å; F610-I674 HydrophobicContact CZ-CD1 4.49Å; F610-I674 HydrophobicContact CZ-CG2 4.22Å; V612-I674 HydrophobicContact CG2-CD1 3.9Å; V657-I674 HydrophobicContact CG1-CG1 4.1Å; V657-I674 HydrophobicContact CG2-CD1 4.49Å; V657-I674 HydrophobicContact CG2-CG1 4.31Å; V670-I674 HydrophobicContact CG1-CD1 3.97Å; V670-I674 WeakPolarHBondContact O-CB 3.48Å; V670-I674 WeakPolarHBondContact O-CG1 3.18Å; V670-I674 PolarHBondContact O-N 2.6Å; S672-I674 PolarHBondContact O-N 2.98Å; I674-S677 PolarHBondContact O-OG 2.88Å; I674-L681 HydrophobicContact CG1-CD1 4.24Å; I674-L681 HydrophobicContact CG1-CD2 4.37Å; I674-L681 HydrophobicContact CG2-CD2 3.98Å
675	R	87	Confident	86	Confident	195 Å²	195	53.8 Å²	53.8	74%	0.736	30%	0.303	S	S	*	.	H	α-helix	trans	-72.7	-29.5	174.2	-74.2	174.3	177	-179.1	-0.3	113.1	V671 S672 L673	V671-R675 HydrophobicContact CG1-CG 4.43Å; V671-R675 WeakPolarHBondContact O-CB 3.4Å; V671-R675 VanDerWaalsContact O-CG 3.23Å; V671-R675 WeakPolarHBondContact O-CG 3.33Å; V671-R675 PolarHBondContact O-N 3.35Å; S672-R675 PolarHBondContact O-N 3.01Å; L673-R675 PolarHBondContact O-N 3.12Å
676	G	83.9	Confident	86.1	Confident	64 Å²	64	51.6 Å²	51.6	66%	0.66	29%	0.292	S	S	*	.	H	α-helix	trans	-74	-26	177.8	0	0	0	0	0	114.1	S672 L673 S678	S672-G676 PolarHBondContact O-N 2.89Å; L673-G676 PolarHBondContact O-N 3.46Å; G676-S678 PolarHBondContact O-N 3Å
677	S	79.9	Confident	86	Confident	8 Å²	8	49 Å²	49	6%	0.056	27%	0.273	C	S	.	.			trans	-59.8	122.3	167.1	9	0	0	0	0	111	R603 L673 I674 I680	R603-S677 PolarHBondContact NH1-O 3.47Å; R603-S677 VanDerWaalsContact NH1-O 3.1Å; L673-S677 PolarHBondContact O-N 3.21Å; L673-S677 VanDerWaalsContact O-N 3.15Å; L673-S677 PolarHBondContact O-OG 3.05Å; I674-S677 PolarHBondContact O-OG 2.88Å; S677-I680 WeakPolarHBondContact CB-O 3.43Å
678	S	77.1	Confident	85.6	Confident	80 Å²	80	46.2 Å²	46.2	56%	0.559	26%	0.262	S	S	*	.			trans	-67.6	-82.9	-179.7	51.8	0	0	0	0	111.6	R603 G676	R603-S678 WeakPolarHBondContact CD-O 3.41Å; R603-S678 PolarHBondContact NH1-O 3.44Å; G676-S678 PolarHBondContact O-N 3Å
679	D	80.4	Confident	84.7	Confident	109 Å²	109	41.2 Å²	41.2	58%	0.583	24%	0.24	S	C	*	.	S	Bend	trans	-108.5	-24.3	-171.8	-61	-40.9	0	0	0	113.4	Q602 R603	Q602-D679 CarbonylContact C-O 3.51Å; Q602-D679 WeakPolarHBondContact CA-O 3.46Å; R603-D679 WeakPolarHBondContact CB-O 3.49Å; R603-D679 PolarHBondContact N-O 3.28Å
680	I	83.2	Confident	83.3	Confident	49 Å²	49	43.6 Å²	43.6	25%	0.251	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	137.2	-175.3	-69	171	0	0	0	109.5	S97 V98 L601 Q602 S677	S97-I680 VanDerWaalsContact OG-CD1 3.24Å; S97-I680 WeakPolarHBondContact OG-CD1 3.48Å; V98-I680 HydrophobicContact CG2-CD1 4.4Å; L601-I680 CarbonylContact O-C 3.58Å; L601-I680 VanDerWaalsContact O-CA 3.3Å; L601-I680 WeakPolarHBondContact O-CA 3.43Å; Q602-I680 HydrophobicContact CG-CG1 4.44Å; S677-I680 WeakPolarHBondContact CB-O 3.43Å
681	L	89	Confident	81.5	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	116.3	-179.3	166.8	63.5	0	0	0	109.1	L601 F608 F610 V657 I674 L683	L601-L681 HydrophobicContact CB-CB 4.45Å; L601-L681 HydrophobicContact CD1-CD2 4.4Å; L601-L681 PolarHBondContact N-O 3.48Å; L601-L681 PolarHBondContact O-N 2.86Å; F608-L681 HydrophobicContact CD1-CB 4.16Å; F608-L681 HydrophobicContact CD1-CD2 4.44Å; F608-L681 HydrophobicContact CD2-CD2 3.82Å; F608-L681 HydrophobicContact CE1-CB 3.65Å; F608-L681 HydrophobicContact CE2-CB 4.09Å; F608-L681 HydrophobicContact CE2-CD2 3.95Å; F608-L681 HydrophobicContact CG-CD2 4.09Å; F608-L681 HydrophobicContact CZ-CB 3.62Å; F608-L681 HydrophobicContact CZ-CD2 4.32Å; F610-L681 HydrophobicContact CE1-CD2 3.91Å; F610-L681 HydrophobicContact CZ-CD2 3.66Å; V657-L681 HydrophobicContact CG1-CD1 3.77Å; I674-L681 HydrophobicContact CG1-CD1 4.24Å; I674-L681 HydrophobicContact CG1-CD2 4.37Å; I674-L681 HydrophobicContact CG2-CD2 3.98Å; L681-L683 HydrophobicContact CD1-CD2 3.85Å; L681-L683 HydrophobicContact CD1-CG 4.37Å; L681-L683 HydrophobicContact CD2-CD1 4.34Å; L681-L683 HydrophobicContact CD2-CD2 4.15Å; L681-L683 HydrophobicContact CD2-CG 4.26Å; L681-L683 HydrophobicContact CG-CD2 3.98Å; L681-L683 HydrophobicContact CG-CG 4Å
682	G	86.6	Confident	79.4	Confident	15 Å²	15	52.1 Å²	52.1	16%	0.155	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	126	170.6	0	0	0	0	0	110.7	V657 N658	V657-G682 CarbonylContact C-O 3.47Å; V657-G682 WeakPolarHBondContact CA-O 3.21Å; N658-G682 PolarHBondContact N-O 3.07Å; N658-G682 PolarHBondContact OD1-N 2.89Å
683	L	89.3	Confident	77.3	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	140.5	175.5	-62.6	177.9	0	0	0	110.3	I599 L601 F610 L648 I654 V657 L681 V685	I599-L683 PolarHBondContact N-O 3.07Å; I599-L683 PolarHBondContact O-N 3.06Å; L601-L683 HydrophobicContact CD1-CD1 3.8Å; F610-L683 HydrophobicContact CE1-CD1 4.36Å; F610-L683 HydrophobicContact CZ-CD1 4.15Å; L648-L683 HydrophobicContact CD1-CD1 4.07Å; I654-L683 HydrophobicContact CG2-CD2 4.19Å; V657-L683 HydrophobicContact CG2-CD2 3.82Å; L681-L683 HydrophobicContact CD1-CD2 3.85Å; L681-L683 HydrophobicContact CD1-CG 4.37Å; L681-L683 HydrophobicContact CD2-CD1 4.34Å; L681-L683 HydrophobicContact CD2-CD2 4.15Å; L681-L683 HydrophobicContact CD2-CG 4.26Å; L681-L683 HydrophobicContact CG-CD2 3.98Å; L681-L683 HydrophobicContact CG-CG 4Å; L683-V685 HydrophobicContact CB-CG1 4.38Å
684	K	86.7	Confident	74.7	Confident	51 Å²	51	56.1 Å²	56.1	22%	0.222	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	119.5	161.7	-169.7	174.9	-166.2	172.2	0	107.7	P596 R597 M598 L655 E656	P596-K684 HydrophobicContact CB-CG 4.43Å; R597-K684 WeakPolarHBondContact O-CA 3.5Å; M598-K684 HydrophobicContact CE-CB 4.44Å; M598-K684 HydrophobicContact SD-CB 3.54Å; M598-K684 VanDerWaalsContact SD-CB 3.54Å; M598-K684 HydrophobicContact SD-CD 3.73Å; M598-K684 HydrophobicContact SD-CG 3.45Å; M598-K684 WeakPolarHBondContact SD-CG 3.47Å; L655-K684 HydrophobicContact CB-CB 4.29Å; L655-K684 HydrophobicContact CB-CD 4.33Å; L655-K684 HydrophobicContact CB-CG 4.19Å; L655-K684 HydrophobicContact CD1-CG 4.29Å; L655-K684 PolarHBondContact N-O 2.86Å; E656-K684 HydrophobicContact CB-CB 3.8Å; E656-K684 HydrophobicContact CB-CD 4.09Å; E656-K684 HydrophobicContact CG-CD 4.1Å; E656-K684 PolarHBondContact N-O 3.45Å; E656-K684 PolarHBondContact O-N 3.14Å; E656-K684 WeakPolarHBondContact OE1-CD 3.23Å; E656-K684 IonicContact OE1-NZ 3.29Å; E656-K684 PolarHBondContact OE1-NZ 2.92Å; E656-K684 WeakPolarHBondContact OE2-CD 3.4Å; E656-K684 IonicContact OE2-NZ 3.67Å; E656-K684 PolarHBondContact OE2-NZ 3.19Å
685	V	88.9	Confident	71.9	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	147.7	-175.1	-76	0	0	0	0	111.6	P596 R597 I599 L648 D652 F653 I654 L683	P596-V685 CarbonylContact C-O 3.54Å; P596-V685 WeakPolarHBondContact CA-O 3.42Å; R597-V685 HydrophobicContact CB-CG2 4.37Å; R597-V685 PolarHBondContact N-O 2.89Å; R597-V685 PolarHBondContact O-N 2.94Å; I599-V685 HydrophobicContact CD1-CG2 3.67Å; I599-V685 HydrophobicContact CG1-CG2 4.32Å; L648-V685 HydrophobicContact CD2-CB 4.34Å; L648-V685 HydrophobicContact CD2-CG1 4.03Å; L648-V685 HydrophobicContact CD2-CG2 3.67Å; D652-V685 HydrophobicContact CB-CB 4.32Å; F653-V685 CarbonylContact O-C 3.1Å; F653-V685 WeakPolarHBondContact O-CA 3.49Å; I654-V685 HydrophobicContact CG1-CG1 4.26Å; L683-V685 HydrophobicContact CB-CG1 4.38Å
686	I	85.3	Confident	69.2	Low	6 Å²	6	55.2 Å²	55.2	3%	0.031	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	132.7	174.4	-172.8	167.9	0	0	0	109.1	I576 N594 P629 F653 L655	I576-I686 HydrophobicContact CG2-CD1 4.17Å; N594-I686 WeakPolarHBondContact O-CD1 3.04Å; P629-I686 HydrophobicContact CB-CG2 4.09Å; P629-I686 HydrophobicContact CG-CG2 3.47Å; P629-I686 VanDerWaalsContact CG-CG2 3.47Å; F653-I686 HydrophobicContact CB-CG2 3.91Å; F653-I686 PolarHBondContact N-O 3.2Å; F653-I686 PolarHBondContact O-N 3.06Å; L655-I686 HydrophobicContact CD1-CB 4.06Å; L655-I686 HydrophobicContact CD1-CG2 3.93Å; L655-I686 HydrophobicContact CD2-CG2 4Å; L655-I686 HydrophobicContact CG-CG2 4Å
687	T	84.3	Confident	66.5	Low	16 Å²	16	58 Å²	58	10%	0.098	34%	0.34	C	S	.	.			trans	-87.9	140.1	168.2	-48.5	0	0	0	0	107.5	N594 R597 D652	N594-T687 PolarHBondContact OD1-O 3.12Å; R597-T687 PolarHBondContact NH2-OG1 2.86Å; D652-T687 WeakPolarHBondContact OD1-CB 3.37Å; D652-T687 PolarHBondContact OD1-OG1 2.86Å
688	V	76.3	Confident	63.9	Low	26 Å²	26	67.7 Å²	67.7	16%	0.158	38%	0.381	C	S	.	.			trans	-124.2	112	177.2	-179.8	0	0	0	0	107.5	P629 F653 S690 I693	P629-V688 HydrophobicContact CG-CG2 3.82Å; F653-V688 HydrophobicContact CD2-CB 4.46Å; F653-V688 HydrophobicContact CD2-CG2 3.94Å; F653-V688 HydrophobicContact CE2-CB 4.26Å; F653-V688 HydrophobicContact CE2-CG2 4.1Å; V688-S690 PolarHBondContact O-N 3.45Å; V688-S690 VanDerWaalsContact O-N 3.16Å; V688-I693 HydrophobicContact CG1-CD1 3.83Å
689	D	66.6	Low	61.6	Low	50 Å²	50	72 Å²	72	27%	0.267	40%	0.397	S	S	.	.			trans	-79.8	97.7	179.5	-67.3	-42.9	0	0	0	110.1	T593 N594 D691 Q692	T593-D689 WeakPolarHBondContact CB-OD2 3.48Å; T593-D689 PolarHBondContact OG1-OD2 3.3Å; N594-D689 PolarHBondContact OD1-N 3.39Å; D689-D691 PolarHBondContact O-N 2.93Å; D689-Q692 HydrophobicContact CB-CG 4.28Å; D689-Q692 PolarHBondContact O-N 3.22Å
690	S	58.7	Low	59	Low	82 Å²	82	71 Å²	71	57%	0.573	40%	0.399	S	S	*	.	H	α-helix	trans	-50.9	-25.5	-179.5	-56.8	0	0	0	0	114.7	V688 N694	V688-S690 PolarHBondContact O-N 3.45Å; V688-S690 VanDerWaalsContact O-N 3.16Å; S690-N694 PolarHBondContact O-ND2 3.36Å; S690-N694 VanDerWaalsContact O-ND2 3.12Å
691	D	52.7	Low	56.6	Low	143 Å²	143	75.8 Å²	75.8	77%	0.765	42%	0.42	S	S	*	.	H	α-helix	trans	-73.7	-32.8	-179.8	-62.8	-26.3	0	0	0	112.4	D689 I693	D689-D691 PolarHBondContact O-N 2.93Å; D691-I693 VanDerWaalsContact C-N 3.33Å; D691-I693 PolarHBondContact O-N 3.13Å
692	Q	44.4	Very low	53.6	Low	68 Å²	68	83.6 Å²	83.6	32%	0.318	46%	0.456	S	S	.	.	H	α-helix	trans	-74.2	-21.4	179.6	-64.4	-161.6	23.3	0	0	113.2	D591 D689 S695	D591-Q692 PolarHBondContact OD2-NE2 3.47Å; D689-Q692 HydrophobicContact CB-CG 4.28Å; D689-Q692 PolarHBondContact O-N 3.22Å; Q692-S695 PolarHBondContact O-OG 2.84Å; Q692-S695 VanDerWaalsContact O-OG 3.06Å
693	I	44.1	Very low	50.8	Low	60 Å²	60	88.4 Å²	88.4	31%	0.308	49%	0.488	S	S	.	.	H	α-helix	trans	-77.2	-34	-178.7	-57.7	-177.2	0	0	0	111.2	E627 V688 D691 S695	E627-I693 HydrophobicContact CB-CD1 4.46Å; E627-I693 HydrophobicContact CG-CD1 3.94Å; E627-I693 HydrophobicContact CG-CG2 4.13Å; V688-I693 HydrophobicContact CG1-CD1 3.83Å; D691-I693 VanDerWaalsContact C-N 3.33Å; D691-I693 PolarHBondContact O-N 3.13Å; I693-S695 VanDerWaalsContact C-N 3.34Å; I693-S695 PolarHBondContact O-N 3.19Å
694	N	34.3	Very low	47.8	Very low	137 Å²	137	94.2 Å²	94.2	73%	0.733	52%	0.523	S	S	*	.	S	Bend	trans	-80.8	-11	-178.3	-74.6	-75.6	0	0	0	113.9	S690 T696	S690-N694 PolarHBondContact O-ND2 3.36Å; S690-N694 VanDerWaalsContact O-ND2 3.12Å; N694-T696 PolarHBondContact O-N 3.5Å
695	S	31.3	Very low	45	Very low	90 Å²	90	98.9 Å²	98.9	63%	0.629	55%	0.55	S	S	*	*			trans	-92	54.7	-179	57.3	0	0	0	0	113.6	Q692 I693	Q692-S695 PolarHBondContact O-OG 2.84Å; Q692-S695 VanDerWaalsContact O-OG 3.06Å; I693-S695 VanDerWaalsContact C-N 3.34Å; I693-S695 PolarHBondContact O-N 3.19Å
696	T	29.5	Very low	42.1	Very low	104 Å²	104	104.2 Å²	104.2	64%	0.638	59%	0.588	S	S	*	*			trans	-122.1	134.3	172.9	52.7	0	0	0	0	112.2	N694 K698	N694-T696 PolarHBondContact O-N 3.5Å; T696-K698 PolarHBondContact O-N 2.61Å
697	P	27.9	Very low	39.4	Very low	122 Å²	122	111 Å²	111	79%	0.792	62%	0.624	S	S	*	*			trans	-76.8	117.3	-175	29.3	-33.6	0	0	0	111.8	L699	P697-L699 PolarHBondContact O-N 3.39Å
698	K	26.2	Very low	36.7	Very low	212 Å²	212	120.8 Å²	120.8	92%	0.922	66%	0.659	S	S	*	*			trans	-63.1	99.5	176.6	-68.2	179.8	179.8	177	0	111.9	T696	T696-K698 PolarHBondContact O-N 2.61Å
699	L	28.1	Very low	34.2	Very low	170 Å²	170	127 Å²	127	89%	0.89	69%	0.685	S	S	*	*			trans	-86.4	102.9	162.6	-89.9	163.5	0	0	0	109.6	P697	P697-L699 PolarHBondContact O-N 3.39Å
700	S	25.9	Very low	32.4	Very low	88 Å²	88	134.2 Å²	134.2	62%	0.615	71%	0.709	S	S	*	*			trans	-70.1	152	173.9	55.5	0	0	0	0	112.2
701	H	32.2	Very low	30.9	Very low	151 Å²	151	137.9 Å²	137.9	70%	0.699	72%	0.717	S	S	*	*				-170.2	119.6	119.2	-100.5	-78.1	0	0	0	113.3
702	Q	26.7	Very low	29.8	Very low	163 Å²	163	136 Å²	136	76%	0.762	72%	0.715	S	S	*	*			trans	57.7	103	140.7	-68.2	163.1	-34.4	0	0	122.9
703	S	26.8	Very low	29.2	Very low	117 Å²	117	137.3 Å²	137.3	82%	0.818	73%	0.732	S	S	*	*				-171.7	108.3	114.3	30.6	0	0	0	0	109.3
704	V	27.8	Very low	28.5	Very low	122 Å²	122	140.3 Å²	140.3	74%	0.739	75%	0.749	S	S	*	*				82.2	103.6	84.1	171.2	0	0	0	0	113.3
705	N	26.4	Very low	28.4	Very low	149 Å²	149	140.3 Å²	140.3	80%	0.797	75%	0.749	S	S	*	*			trans	65.1	150	163	-55.7	-13	0	0	0	117.1
706	S	29.8	Very low	28.3	Very low	113 Å²	113	142.1 Å²	142.1	79%	0.79	75%	0.75	S	S	*	*			cis	-139.2	160.8	11.8	-57.1	0	0	0	0	113.2
707	N	26.9	Very low	28.2	Very low	149 Å²	149	147.9 Å²	147.9	80%	0.797	76%	0.762	S	S	*	*			trans	-57.9	158	167.2	-53.8	-50.2	0	0	0	111.6
708	R	27.7	Very low	28.2	Very low	220 Å²	220	146.1 Å²	146.1	83%	0.83	75%	0.753	S	S	*	*				-175	146.4	66.3	-83.7	-171.1	171.4	156.3	-1.7	112.9
709	F	25.2	Very low	28.4	Very low	158 Å²	158	140.5 Å²	140.5	69%	0.693	74%	0.74	S	S	*	*			trans	45.4	155.6	138.5	-67.3	-103.3	0	0	0	120.9
710	Y	28.2	Very low	28.7	Very low	200 Å²	200	141.3 Å²	141.3	78%	0.784	74%	0.736	S	S	*	*			cis	-141.9	179.7	18.7	-127.5	-74.1	0	0	0	112.4
711	E	27.1	Very low	28.7	Very low	159 Å²	159	144.3 Å²	144.3	74%	0.743	74%	0.744	S	S	*	*			trans	-102.3	-165.9	-169.6	-59.4	167.3	98.6	0	0	115.8
712	S	29.6	Very low	28.6	Very low	104 Å²	104	147 Å²	147	73%	0.727	75%	0.753	S	S	*	*			trans	89.8	122.1	170	-51.4	0	0	0	0	115.9
713	S	30.8	Very low	28.6	Very low	95 Å²	95	148.8 Å²	148.8	66%	0.664	76%	0.759	S	S	*	*			cis	77.9	146.5	42.7	101.3	0	0	0	0	112.8
714	D	30.2	Very low	28.6	Very low	124 Å²	124	149 Å²	149	66%	0.663	76%	0.76	S	S	*	*			cis	-156.3	-174.5	16	-106.7	-50.2	0	0	0	112.7
715	N	32.1	Very low	28.5	Very low	137 Å²	137	150.3 Å²	150.3	73%	0.733	76%	0.763	S	S	*	*			trans	88.5	122.5	163.4	-52.3	-66.8	0	0	0	117.7
716	I	28.5	Very low	28.5	Very low	128 Å²	128	154.1 Å²	154.1	66%	0.656	77%	0.768	S	S	*	*			cis	92.7	102.7	30.3	-59.1	162.4	0	0	0	114
717	Y	29.2	Very low	28.4	Very low	224 Å²	224	155.2 Å²	155.2	88%	0.878	76%	0.76	S	S	*	*				-179.4	167.3	127.3	-118.6	-84.6	0	0	0	112.2
718	S	26.4	Very low	28.4	Very low	86 Å²	86	155.1 Å²	155.1	60%	0.601	76%	0.76	S	S	*	*				-164.3	133	-96.1	179.6	0	0	0	0	112.4
719	S	30.9	Very low	28.3	Very low	94 Å²	94	150.8 Å²	150.8	66%	0.657	75%	0.747	S	S	*	*			trans	63.3	135.6	164	75.5	0	0	0	0	118.4
720	K	33.5	Very low	28.5	Very low	186 Å²	186	153.6 Å²	153.6	81%	0.809	76%	0.759	S	S	*	*				-165.9	116.4	78.5	-91.1	165.4	-178.5	167.9	0	114.8
721	I	27.8	Very low	28.4	Very low	151 Å²	151	149.2 Å²	149.2	77%	0.774	76%	0.758	S	S	*	*				31.1	114.6	125.3	-40.4	165.6	0	0	0	118.8
722	K	28.4	Very low	28.6	Very low	207 Å²	207	149.6 Å²	149.6	90%	0.9	77%	0.765	S	S	*	*				-171.7	158.1	111	-101	179.5	-174.7	178.2	0	113.3
723	K	27.3	Very low	28.4	Very low	202 Å²	202	152.8 Å²	152.8	88%	0.878	77%	0.766	S	S	*	*			trans	-83.8	150.1	-173.3	-56.3	172.7	178.1	179.4	0	112.5
724	S	27.6	Very low	28.3	Very low	120 Å²	120	158.2 Å²	158.2	84%	0.839	77%	0.773	S	S	*	*				-164.7	156.5	124.4	34.7	0	0	0	0	111.9
725	N	25	Very low	28.3	Very low	150 Å²	150	158.1 Å²	158.1	80%	0.802	78%	0.781	S	S	*	*			trans	-72.2	148.2	-163.8	-43.4	-26	0	0	0	113.4
726	Y	27.2	Very low	28	Very low	230 Å²	230	157.1 Å²	157.1	90%	0.902	78%	0.78	S	S	*	*				-150.8	150.4	108.5	-126.3	-92.9	0	0	0	109.9
727	E	26.4	Very low	27.9	Very low	136 Å²	136	156.8 Å²	156.8	64%	0.636	79%	0.789	S	S	*	*			trans	-80.4	153.8	168.2	-58	-173.5	154.2	0	0	109.5	K729	E727-K729 VanDerWaalsContact OE2-CE 3.28Å; E727-K729 WeakPolarHBondContact OE2-CE 3.17Å; E727-K729 IonicContact OE2-NZ 3.6Å; E727-K729 PolarHBondContact OE2-NZ 2.74Å
728	D	27.6	Very low	27.8	Very low	146 Å²	146	150.4 Å²	150.4	78%	0.781	77%	0.773	S	S	*	*				-151.2	160.6	112.8	-134.8	-26.2	0	0	0	113.4
729	K	25.9	Very low	27.7	Very low	129 Å²	129	156 Å²	156	56%	0.561	79%	0.789	S	S	*	*			trans	-94.1	139.1	-177.3	-52	90.3	-177.7	163	0	110.1	E727	E727-K729 VanDerWaalsContact OE2-CE 3.28Å; E727-K729 WeakPolarHBondContact OE2-CE 3.17Å; E727-K729 IonicContact OE2-NZ 3.6Å; E727-K729 PolarHBondContact OE2-NZ 2.74Å
730	F	29.5	Very low	27.5	Very low	218 Å²	218	156.9 Å²	156.9	96%	0.956	79%	0.787	S	S	*	*			trans	-157.3	97.5	137	-106.3	-67.1	0	0	0	110.4
731	S	26	Very low	27	Very low	108 Å²	108	155.8 Å²	155.8	76%	0.755	79%	0.79	S	S	*	*			trans	-93.8	144.2	173.2	48.6	0	0	0	0	111.1	K733	S731-K733 PolarHBondContact O-N 3.42Å
732	N	30.4	Very low	26.9	Very low	167 Å²	167	158.3 Å²	158.3	89%	0.893	79%	0.79	S	S	*	*			trans	-57.4	131.3	170.9	-79.9	-30.5	0	0	0	111.6
733	K	26	Very low	26.6	Very low	170 Å²	170	153.4 Å²	153.4	74%	0.739	78%	0.779	S	S	*	*			trans	-162.2	147.9	148.6	-116.8	167.5	-174.5	178.9	0	112.3	S731	S731-K733 PolarHBondContact O-N 3.42Å
734	Y	27.5	Very low	26.6	Very low	209 Å²	209	155 Å²	155	82%	0.82	78%	0.779	S	S	*	*			trans	64.8	73.6	-178.4	-54.4	-68.2	0	0	0	114.3
735	C	30.4	Very low	26.5	Very low	122 Å²	122	155.9 Å²	155.9	82%	0.824	78%	0.775	S	S	*	*				-47.6	124.1	77.7	-64.7	0	0	0	0	117.8
736	V	27	Very low	26.6	Very low	117 Å²	117	154 Å²	154	71%	0.709	77%	0.769	S	S	*	*				-179.6	125.4	106.8	153.5	0	0	0	0	107.9	V738	V736-V738 HydrophobicContact CG1-CG2 4.45Å
737	S	26	Very low	26.7	Very low	121 Å²	121	150 Å²	150	85%	0.846	76%	0.758	S	S	*	*	S	Bend	trans	-150.7	58	157.4	-79.2	0	0	0	0	110.1
738	V	27.5	Very low	26.6	Very low	90 Å²	90	148.1 Å²	148.1	55%	0.545	75%	0.753	S	S	.	*			trans	62.3	88	147.2	-173.7	0	0	0	0	115.3	V736 N740	V736-V738 HydrophobicContact CG1-CG2 4.45Å; V738-N740 HydrophobicContact CG1-CB 3.58Å; V738-N740 VanDerWaalsContact CG1-ND2 3.29Å; V738-N740 WeakPolarHBondContact CG1-ND2 3.25Å; V738-N740 WeakPolarHBondContact CG1-OD1 3.46Å; V738-N740 PolarHBondContact O-N 3.15Å; V738-N740 VanDerWaalsContact O-N 3.17Å
739	E	24.9	Very low	26.6	Very low	203 Å²	203	145.3 Å²	145.3	95%	0.949	75%	0.75	S	S	*	*			trans	-59.6	106.1	138	-66.7	171.3	132.1	0	0	107.3
740	N	24.9	Very low	26.7	Very low	112 Å²	112	150 Å²	150	60%	0.599	77%	0.766	S	S	*	*			trans	-117.1	129.8	165.5	-101.7	-10.3	0	0	0	107.2	V738 W742	V738-N740 HydrophobicContact CG1-CB 3.58Å; V738-N740 VanDerWaalsContact CG1-ND2 3.29Å; V738-N740 WeakPolarHBondContact CG1-ND2 3.25Å; V738-N740 WeakPolarHBondContact CG1-OD1 3.46Å; V738-N740 PolarHBondContact O-N 3.15Å; V738-N740 VanDerWaalsContact O-N 3.17Å; N740-W742 PolarHBondContact O-N 2.99Å
741	D	24.6	Very low	26.6	Very low	164 Å²	164	146 Å²	146	88%	0.877	75%	0.748	S	S	*	*			trans	-53.5	120	169.2	-58.2	-83.4	0	0	0	110.8
742	W	24.2	Very low	26.6	Very low	203 Å²	203	146.2 Å²	146.2	77%	0.769	75%	0.745	S	S	*	*			trans	-120.6	124.3	164.2	-85.3	70.8	0	0	0	109.7	N740 T746	N740-W742 PolarHBondContact O-N 2.99Å; W742-T746 HydrophobicContact CE3-CG2 4.33Å; W742-T746 HydrophobicContact CZ3-CG2 4.5Å
743	P	23.4	Very low	26.5	Very low	105 Å²	105	144.3 Å²	144.3	68%	0.682	74%	0.739	S	S	*	*			trans	-78.3	176.7	-171.1	33.7	-37.8	0	0	0	112.1
744	R	26.2	Very low	26.6	Very low	234 Å²	234	140.7 Å²	140.7	88%	0.883	73%	0.734	S	S	*	*	S	Bend	trans	-46.9	140.5	163.1	-56.7	176.2	-174.7	-176.2	0.3	110
745	N	24.9	Very low	26.7	Very low	140 Å²	140	139.4 Å²	139.4	75%	0.749	73%	0.728	S	S	*	*			trans	91	77.6	179.4	-51.8	-12.2	0	0	0	117.2
746	T	28.7	Very low	26.5	Very low	111 Å²	111	140 Å²	140	68%	0.681	72%	0.722	S	S	*	*			trans	-130.7	53.5	152.6	41.6	0	0	0	0	111.5	W742	W742-T746 HydrophobicContact CE3-CG2 4.33Å; W742-T746 HydrophobicContact CZ3-CG2 4.5Å
747	E	27.8	Very low	26.7	Very low	144 Å²	144	138.9 Å²	138.9	67%	0.673	72%	0.72	S	S	*	*			trans	-66.6	142.1	167.2	-151.1	-162.1	148.2	0	0	110.3	K751	E747-K751 IonicContact OE1-NZ 2.7Å; E747-K751 PolarHBondContact OE1-NZ 3.1Å
748	N	25.9	Very low	26.9	Very low	97 Å²	97	139.6 Å²	139.6	52%	0.519	71%	0.708	S	S	.	*			trans	81.9	66.4	176.9	-45.9	-76.9	0	0	0	117.9	K751	N748-K751 WeakPolarHBondContact OD1-CD 3.41Å; N748-K751 WeakPolarHBondContact OD1-CE 3.47Å; N748-K751 PolarHBondContact OD1-NZ 3.27Å
749	A	26.5	Very low	27	Very low	87 Å²	87	143.2 Å²	143.2	72%	0.719	72%	0.719	S	S	*	*	S	Bend	trans	-139.5	-2.2	165.7	0	0	0	0	0	117.6
750	Y	27.8	Very low	27	Very low	229 Å²	229	144.9 Å²	144.9	90%	0.898	72%	0.716	S	S	*	*	S	Bend	trans	-132.8	38.7	175.4	-89.4	-79.3	0	0	0	113.1	T752	Y750-T752 PolarHBondContact O-N 3.49Å
751	K	27.8	Very low	27.1	Very low	132 Å²	132	147.2 Å²	147.2	57%	0.574	73%	0.729	S	S	*	*			trans	-96.3	49.1	-174.8	-71.4	-174.1	175.2	173.5	0	114	E747 N748	E747-K751 IonicContact OE1-NZ 2.7Å; E747-K751 PolarHBondContact OE1-NZ 3.1Å; N748-K751 WeakPolarHBondContact OD1-CD 3.41Å; N748-K751 WeakPolarHBondContact OD1-CE 3.47Å; N748-K751 PolarHBondContact OD1-NZ 3.27Å
752	T	26.4	Very low	27.3	Very low	113 Å²	113	145.5 Å²	145.5	69%	0.693	72%	0.715	S	S	*	*			trans	-147.2	15.1	-175.7	-5.1	0	0	0	0	118.8	Y750	Y750-T752 PolarHBondContact O-N 3.49Å
753	V	28.2	Very low	27.5	Very low	128 Å²	128	143.4 Å²	143.4	78%	0.776	72%	0.719	S	S	*	*	S	Bend	trans	-132.7	48.1	179.3	-157	0	0	0	0	114.1
754	C	28.1	Very low	27.7	Very low	93 Å²	93	145.3 Å²	145.3	63%	0.628	72%	0.724	S	S	*	*	S	Bend	trans	-151.5	7	162	-97	0	0	0	0	113.5	K227	K227-C754 PolarHBondContact NZ-SG 2.73Å
755	R	28.8	Very low	27.8	Very low	183 Å²	183	138 Å²	138	69%	0.691	70%	0.702	S	S	*	*	S	Bend	trans	-97.5	-11.7	-166.2	-148	170.5	-176.5	120	0.9	115.1
756	D	26.9	Very low	28	Very low	133 Å²	133	134.4 Å²	134.4	71%	0.711	69%	0.688	S	S	*	*	S	Bend	trans	-96.3	-3.3	-168.4	-64.2	-38.8	0	0	0	115.7
757	S	30.4	Very low	27.9	Very low	94 Å²	94	134.2 Å²	134.2	66%	0.657	68%	0.682	S	S	*	*	S	Bend	trans	-95.4	-9.4	175.5	-60.4	0	0	0	0	114.2
758	F	31.7	Very low	28.1	Very low	137 Å²	137	133.1 Å²	133.1	60%	0.601	68%	0.676	S	S	*	*	S	Bend	trans	-104.8	-1.2	-177	-90.5	-85.2	0	0	0	114.9	M197	M197-F758 HydrophobicContact CE-CZ 4.37Å
759	H	28.4	Very low	28.2	Very low	165 Å²	165	135.2 Å²	135.2	76%	0.764	69%	0.687	S	S	*	*			trans	-136.9	67.6	176.5	-74.4	-66.3	0	0	0	112.9
760	R	26.3	Very low	28.2	Very low	238 Å²	238	137.2 Å²	137.2	90%	0.898	69%	0.685	S	S	*	*			trans	-140	55.9	164.5	-80.4	-156.8	178.2	-143.7	0	113.9
761	N	26.5	Very low	28.2	Very low	161 Å²	161	132.2 Å²	132.2	86%	0.861	67%	0.674	S	S	*	*	S	Bend	trans	-145.8	159.3	142.6	-142	-13.8	0	0	0	109.3
762	Q	28.6	Very low	28.2	Very low	128 Å²	128	130.1 Å²	130.1	60%	0.598	68%	0.676	S	S	*	*			trans	64.9	84.7	-169.9	-57.7	-177	-11.8	0	0	115.6
763	N	27.5	Very low	28.4	Very low	159 Å²	159	130.2 Å²	130.2	85%	0.85	68%	0.677	S	S	*	*			trans	-154	71.1	142.4	-115.9	-34.3	0	0	0	108.7
764	N	29.3	Very low	28.4	Very low	146 Å²	146	130.6 Å²	130.6	78%	0.781	68%	0.675	S	S	*	*	S	Bend	trans	-174.5	130.3	166.8	-97.8	-10.7	0	0	0	108.6
765	L	28.4	Very low	28.6	Very low	79 Å²	79	134.7 Å²	134.7	41%	0.414	68%	0.682	S	S	.	*			cis	-162.6	68	-22.8	-147	63.7	0	0	0	112.4	T1156 N1157	L765-T1156 VanDerWaalsContact CD2-C 3.41Å; L765-T1156 WeakPolarHBondContact CD2-O 3.3Å; L765-T1156 VanDerWaalsContact CG-C 3.49Å; L765-N1157 CarbonylContact O-C 3.5Å; L765-N1157 WeakPolarHBondContact O-CA 3.34Å
766	S	28.1	Very low	28.6	Very low	65 Å²	65	130.7 Å²	130.7	46%	0.455	68%	0.682	S	S	.	*			trans	53.3	155.5	141.7	68	0	0	0	0	125	T1156 N1157 I1158	S766-T1156 VanDerWaalsContact OG-CA 3.25Å; S766-T1156 WeakPolarHBondContact OG-CA 3.34Å; S766-T1156 PolarHBondContact OG-N 3.36Å; S766-N1157 CarbonylContact O-C 3.59Å; S766-N1157 WeakPolarHBondContact O-CA 3.32Å; S766-N1157 PolarHBondContact O-OD1 2.65Å; S766-N1157 PolarHBondContact OG-OD1 3.5Å; S766-I1158 PolarHBondContact O-N 2.77Å
767	I	27.4	Very low	28.8	Very low	108 Å²	108	129.4 Å²	129.4	55%	0.554	68%	0.683	S	S	*	*			trans	59.2	159	165.2	-37	-178.5	0	0	0	118.2	T1156 N1157 I1158	I767-T1156 HydrophobicContact CD1-CG2 4.1Å; I767-N1157 WeakPolarHBondContact CB-OD1 3.45Å; I767-N1157 WeakPolarHBondContact CD1-OD1 3.17Å; I767-N1157 WeakPolarHBondContact CG1-OD1 3.47Å; I767-I1158 HydrophobicContact CB-CD1 3.87Å; I767-I1158 HydrophobicContact CB-CG1 4.23Å; I767-I1158 HydrophobicContact CG2-CD1 3.81Å
768	Q	30.9	Very low	28.7	Very low	120 Å²	120	130.3 Å²	130.3	56%	0.561	69%	0.685	S	S	*	*			trans	65.9	109.5	-162.3	-89.4	170.9	23.9	0	0	112.1	I1158 S1159	Q768-I1158 HydrophobicContact CB-CD1 3.57Å; Q768-I1158 HydrophobicContact CB-CG1 4.48Å; Q768-I1158 HydrophobicContact CB-CG2 4.23Å; Q768-I1158 VanDerWaalsContact CD-CD1 3.47Å; Q768-I1158 HydrophobicContact CG-CD1 3.35Å; Q768-I1158 HydrophobicContact CG-CG2 4.32Å; Q768-S1159 PolarHBondContact OE1-OG 3.48Å
769	L	27.3	Very low	28.6	Very low	141 Å²	141	130.9 Å²	130.9	74%	0.738	69%	0.694	S	S	*	*			cis	54.7	118.3	44.9	-61.1	166.3	0	0	0	112.5
770	D	27.1	Very low	28.5	Very low	129 Å²	129	129.5 Å²	129.5	69%	0.69	69%	0.693	S	S	*	*			trans	72.1	95.4	166.6	-55.4	-18	0	0	0	119.9
771	N	27.8	Very low	28.5	Very low	124 Å²	124	126 Å²	126	66%	0.663	68%	0.684	S	S	*	*			trans	78.1	109.3	133.3	-61	-40.6	0	0	0	121.5
772	S	29	Very low	28.7	Very low	88 Å²	88	125.2 Å²	125.2	62%	0.615	68%	0.678	S	S	*	*				93.6	112.6	129.8	70.9	0	0	0	0	122.4
773	T	29.4	Very low	28.6	Very low	116 Å²	116	125 Å²	125	71%	0.712	69%	0.69	S	S	*	*			trans	77.2	117.6	135.8	51.4	0	0	0	0	123.7
774	N	28.9	Very low	28.7	Very low	136 Å²	136	121 Å²	121	73%	0.727	69%	0.685	S	S	*	*				86.9	117.8	128.3	-73.7	-27.3	0	0	0	123.8
775	K	31.1	Very low	28.8	Very low	179 Å²	179	123.6 Å²	123.6	78%	0.778	69%	0.693	S	S	*	*				78.4	95.3	127.9	-72.2	-173.2	176.5	-177.4	0	122.2
776	S	28.8	Very low	28.9	Very low	99 Å²	99	128.6 Å²	128.6	69%	0.692	71%	0.712	S	S	*	*				68.7	148.4	113.6	66.8	0	0	0	0	122.9
777	S	31	Very low	29.1	Very low	105 Å²	105	132.3 Å²	132.3	73%	0.734	73%	0.726	S	S	*	*			trans	69	143.1	157.1	66.5	0	0	0	0	117.7
778	T	28.6	Very low	29.4	Very low	113 Å²	113	136 Å²	136	69%	0.693	74%	0.737	S	S	*	*			cis	-176.7	160.6	-35.4	16.1	0	0	0	0	105.8
779	N	29.3	Very low	29.2	Very low	149 Å²	149	135.4 Å²	135.4	80%	0.797	75%	0.747	S	S	*	*			trans	70.3	156.9	170.1	-46	-29.2	0	0	0	115
780	D	26.6	Very low	29.4	Very low	137 Å²	137	136.1 Å²	136.1	73%	0.733	75%	0.751	S	S	*	*			cis	-169	-173	-41.4	-147.7	-24.4	0	0	0	106.9
781	F	27.8	Very low	29.4	Very low	165 Å²	165	140.8 Å²	140.8	72%	0.724	76%	0.759	S	S	*	*			trans	68.9	97.1	161.7	-77.8	-74.9	0	0	0	121.6
782	I	28.8	Very low	29.5	Very low	143 Å²	143	142.6 Å²	142.6	73%	0.733	77%	0.767	S	S	*	*				57.9	104.2	119.8	-61.4	-172.2	0	0	0	119.7
783	C	28.3	Very low	29.5	Very low	124 Å²	124	146.8 Å²	146.8	84%	0.838	78%	0.777	S	S	*	*				57.2	86.6	121.8	-156	0	0	0	0	120.3
784	G	28.2	Very low	29.8	Very low	74 Å²	74	146.6 Å²	146.6	76%	0.763	78%	0.778	S	S	*	*				88.5	135.7	109.8	0	0	0	0	0	119.8
785	E	33	Very low	29.8	Very low	202 Å²	202	145.2 Å²	145.2	94%	0.944	78%	0.779	S	S	*	*			trans	-153.3	-179.9	137.6	-126.2	-176.1	180	0	0	112.1
786	K	28.5	Very low	29.8	Very low	184 Å²	184	142.2 Å²	142.2	80%	0.8	78%	0.78	S	S	*	*			trans	-82.6	160.4	179.4	-61.6	163.4	-179.8	166.1	0	110.3
787	L	33.1	Very low	29.9	Very low	143 Å²	143	142 Å²	142	75%	0.749	78%	0.779	S	S	*	*				172.1	133.2	109.7	-87.5	164.9	0	0	0	114
788	K	33.7	Very low	29.9	Very low	184 Å²	184	143.2 Å²	143.2	80%	0.8	78%	0.782	S	S	*	*			trans	39	116.5	141.7	-63.2	175.5	-173.4	172.2	0	121.8
789	S	28	Very low	30.1	Very low	108 Å²	108	142.6 Å²	142.6	76%	0.755	78%	0.782	S	S	*	*				73.1	155	114.7	-159.2	0	0	0	0	121.1
790	L	31.5	Very low	30.3	Very low	157 Å²	157	140 Å²	140	82%	0.822	78%	0.775	S	S	*	*			trans	73.5	109.5	-177.4	-49.2	173.1	0	0	0	112.2
791	R	25.3	Very low	30.6	Very low	227 Å²	227	142 Å²	142	86%	0.857	78%	0.783	S	S	*	*			cis	67.7	94.2	39.1	-163.4	-167.9	-172.6	149.2	5.4	113.5
792	L	31	Very low	30.9	Very low	161 Å²	161	138 Å²	138	84%	0.843	78%	0.78	S	S	*	*				-175.2	161.5	124	-97.1	162.6	0	0	0	111.5
793	E	28.1	Very low	31.1	Very low	176 Å²	176	136.5 Å²	136.5	82%	0.822	78%	0.782	S	S	*	*			trans	-80.9	166.9	-164.8	-74.5	-63.2	119.3	0	0	115.2
794	P	36.7	Very low	31.6	Very low	112 Å²	112	136.1 Å²	136.1	73%	0.727	78%	0.778	S	S	*	*			trans	-94.9	168.7	-168.9	38.3	-37.2	0	0	0	114.7
795	S	28.2	Very low	31.7	Very low	107 Å²	107	137.3 Å²	137.3	75%	0.748	78%	0.775	S	S	*	*			trans	-164	135.7	153.1	52.1	0	0	0	0	115.2
796	S	30.6	Very low	31.8	Very low	116 Å²	116	138.7 Å²	138.7	81%	0.811	77%	0.773	S	S	*	*			trans	67.8	165.5	152.4	85.9	0	0	0	0	117.6
797	S	31.6	Very low	31.9	Very low	95 Å²	95	140.5 Å²	140.5	66%	0.664	77%	0.774	S	S	*	*			cis	-157.1	161.6	8.8	60.5	0	0	0	0	112
798	V	32	Very low	32	Very low	131 Å²	131	139.3 Å²	139.3	79%	0.794	77%	0.774	S	S	*	*			trans	54.1	137.1	133.5	165.5	0	0	0	0	119.2
799	S	32.2	Very low	32.1	Very low	99 Å²	99	136.5 Å²	136.5	69%	0.692	77%	0.774	S	S	*	*			cis	179.2	175.8	-2.9	-96	0	0	0	0	108.2
800	S	32.9	Very low	32.7	Very low	94 Å²	94	136 Å²	136	66%	0.657	78%	0.776	S	S	*	*			cis	-175.5	-164.2	-25.6	63.2	0	0	0	0	108.7
801	M	33.7	Very low	33.5	Very low	181 Å²	181	134.1 Å²	134.1	89%	0.892	77%	0.773	S	S	*	*			trans	75.7	139.7	170	-60.6	-171.5	171.9	0	0	118.3
802	A	32.9	Very low	34.4	Very low	80 Å²	80	128.5 Å²	128.5	66%	0.661	77%	0.766	S	S	*	*			cis	-160.4	130.3	-17.5	0	0	0	0	0	108.2
803	S	33.5	Very low	34.7	Very low	111 Å²	111	126.8 Å²	126.8	78%	0.776	77%	0.765	S	S	*	*				68.5	157.2	97	-49	0	0	0	0	116
804	P	39.2	Very low	35.1	Very low	117 Å²	117	126 Å²	126	76%	0.76	77%	0.765	S	S	*	*			cis	-113.9	174.6	-16.6	36.3	-20.6	0	0	0	112.4
805	S	30.7	Very low	34.9	Very low	99 Å²	99	124.7 Å²	124.7	69%	0.692	76%	0.759	S	S	*	*			cis	106.2	99.3	9	-53.6	0	0	0	0	117.6
806	Y	34	Very low	35.3	Very low	230 Å²	230	124.5 Å²	124.5	90%	0.902	76%	0.758	S	S	*	*			trans	-139.5	99.5	151.9	-77.9	-84.4	0	0	0	108
807	R	31.2	Very low	35.4	Very low	222 Å²	222	127.8 Å²	127.8	84%	0.838	76%	0.757	S	S	*	*				71.2	96.3	85.2	-92.6	-159.9	169.3	-154.8	-2.5	114.9
808	T	35.3	Very low	35.7	Very low	119 Å²	119	128.9 Å²	128.9	73%	0.73	76%	0.762	S	S	*	*				84.4	155.8	91.8	51.5	0	0	0	0	114.5
809	P	36.4	Very low	35.7	Very low	125 Å²	125	128.1 Å²	128.1	81%	0.812	76%	0.757	S	S	*	*			cis	-129.3	175.5	11.1	41.8	-26.6	0	0	0	116.4
810	A	39	Very low	35.5	Very low	96 Å²	96	130.7 Å²	130.7	79%	0.793	76%	0.763	S	S	*	*			trans	-142.8	142.8	165.2	0	0	0	0	0	110.6
811	P	49	Very low	35.3	Very low	118 Å²	118	131.5 Å²	131.5	77%	0.766	76%	0.764	S	S	*	*			trans	-125.6	168.8	171	43.4	-32.2	0	0	0	112.8
812	P	43.6	Very low	35	Very low	109 Å²	109	129 Å²	129	71%	0.708	76%	0.759	S	S	*	*				-134	155.5	-61.5	36.6	-21.1	0	0	0	113.2
813	P	38.7	Very low	35	Very low	125 Å²	125	128.3 Å²	128.3	81%	0.812	76%	0.759	S	S	*	*			trans	-89.3	147.1	171.9	35	-33.4	0	0	0	113.1
814	L	36.1	Very low	34.9	Very low	159 Å²	159	128.5 Å²	128.5	83%	0.832	76%	0.756	S	S	*	*			trans	-144.5	152.4	169.6	-74	170.9	0	0	0	109.6
815	S	32.9	Very low	34.4	Very low	85 Å²	85	130.6 Å²	130.6	59%	0.594	76%	0.76	S	S	*	*			cis	-178.3	145.6	-32.5	51.4	0	0	0	0	108.2
816	S	35.2	Very low	34.3	Very low	103 Å²	103	130 Å²	130	72%	0.72	76%	0.756	S	S	*	*			trans	63.1	157	162.8	69.5	0	0	0	0	117.4
817	K	33.8	Very low	34.2	Very low	186 Å²	186	127.8 Å²	127.8	81%	0.809	75%	0.751	S	S	*	*			cis	-151.4	157.3	-10	-116.7	154.7	-164.6	171.6	0	107.5
818	P	38.2	Very low	34.1	Very low	117 Å²	117	122.5 Å²	122.5	76%	0.76	75%	0.748	S	S	*	*			trans	-81.8	-155.3	167.6	36.6	-34.2	0	0	0	110.2
819	V	30.5	Very low	33.9	Very low	115 Å²	115	119.5 Å²	119.5	70%	0.697	74%	0.741	S	S	*	*			trans	120	107.9	156.5	177.7	0	0	0	0	115.2
820	L	28.9	Very low	33.5	Very low	154 Å²	154	122.3 Å²	122.3	81%	0.806	74%	0.741	S	S	*	*			trans	63.7	167.2	153.4	-59.2	172.1	0	0	0	117.6
821	T	28.6	Very low	33	Very low	110 Å²	110	124.6 Å²	124.6	68%	0.675	74%	0.735	S	S	*	*			cis	-146.3	161.4	-1.1	-15.5	0	0	0	0	111.9
822	T	27.6	Very low	32.1	Very low	128 Å²	128	126.2 Å²	126.2	79%	0.785	74%	0.737	S	S	*	*			trans	-11.8	144.8	155.6	54.2	0	0	0	0	120.7
823	G	33.3	Very low	31.4	Very low	66 Å²	66	124.1 Å²	124.1	68%	0.68	74%	0.736	S	S	*	*			trans	165.2	53.9	164.3	0	0	0	0	0	114.4
824	T	29.8	Very low	31.4	Very low	115 Å²	115	123.4 Å²	123.4	71%	0.706	73%	0.731	S	S	*	*				63.4	133.3	95.4	65.2	0	0	0	0	116.5
825	L	29.5	Very low	31.1	Very low	162 Å²	162	122.7 Å²	122.7	85%	0.848	73%	0.728	S	S	*	*			trans	73.6	144.5	162.4	-59.2	159.5	0	0	0	116.4
826	S	29.5	Very low	31.2	Very low	87 Å²	87	124.4 Å²	124.4	61%	0.608	73%	0.731	S	S	*	*			cis	-169.1	162.3	-15.8	55.7	0	0	0	0	113.3
827	K	30.9	Very low	31.1	Very low	182 Å²	182	124.1 Å²	124.1	79%	0.791	72%	0.721	S	S	*	*			trans	54.1	110.2	139.9	-75.1	171.6	178.5	-179.9	0	118.2
828	S	28.8	Very low	31.2	Very low	111 Å²	111	122.5 Å²	122.5	78%	0.776	71%	0.714	S	S	*	*				95.2	156.9	96	74.7	0	0	0	0	113.3
829	G	31.1	Very low	31	Very low	57 Å²	57	126 Å²	126	59%	0.588	72%	0.717	S	S	*	*			cis	-131.1	-170	1.9	0	0	0	0	0	112.6
830	F	28.2	Very low	31.2	Very low	183 Å²	183	124.3 Å²	124.3	80%	0.803	72%	0.716	S	S	*	*				59.5	130.1	78.3	-57.7	-49.4	0	0	0	112.7
831	Q	28.8	Very low	31.3	Very low	144 Å²	144	125.6 Å²	125.6	67%	0.673	72%	0.717	S	S	*	*			cis	-168.6	163.8	3.5	-133.1	165	6.6	0	0	111
832	N	30.5	Very low	31.5	Very low	152 Å²	152	125.3 Å²	125.3	81%	0.813	72%	0.72	S	S	*	*			trans	63.6	165.7	162.4	-49.9	-31	0	0	0	115.3
833	G	27.6	Very low	31.6	Very low	65 Å²	65	126.7 Å²	126.7	67%	0.67	72%	0.722	S	S	*	*			cis	-161.2	166.7	-4.4	0	0	0	0	0	109.9
834	P	39.8	Very low	31.5	Very low	111 Å²	111	130.7 Å²	130.7	72%	0.721	73%	0.727	S	S	*	*			trans	-103.6	-174.2	-158	41.3	-37.9	0	0	0	114.7
835	N	29.7	Very low	31.6	Very low	144 Å²	144	130.7 Å²	130.7	77%	0.77	73%	0.73	S	S	*	*			trans	77.3	151.6	167.3	-50.6	-14.2	0	0	0	114.2
836	D	34.9	Very low	31.7	Very low	121 Å²	121	129.7 Å²	129.7	65%	0.647	72%	0.723	S	S	*	*			cis	-158.1	161.7	2.8	-145.2	-5.4	0	0	0	113.2
837	N	33	Very low	31.6	Very low	97 Å²	97	132.1 Å²	132.1	52%	0.519	73%	0.728	S	S	.	*			trans	63.3	154	151.3	-64.7	-47.3	0	0	0	120
838	K	36.7	Very low	31.6	Very low	152 Å²	152	130.9 Å²	130.9	66%	0.661	73%	0.729	S	S	*	*			cis	-163.6	139.5	-12.3	-115.1	161	-174.3	119.2	0	109.9
839	K	32.5	Very low	31.5	Very low	190 Å²	190	133.8 Å²	133.8	83%	0.826	73%	0.728	S	S	*	*			trans	61	152.8	151.5	-65.2	-179.1	175.6	-172.4	0	118.2
840	A	36.3	Very low	31.4	Very low	80 Å²	80	136.3 Å²	136.3	66%	0.661	74%	0.737	S	S	*	*			cis	-136.2	144.6	-9.8	0	0	0	0	0	106.5
841	E	30.3	Very low	31.5	Very low	180 Å²	180	138.7 Å²	138.7	84%	0.841	74%	0.74	S	S	*	*				56.4	133.1	63.2	-59.1	-174.4	139.4	0	0	112.7
842	S	33.3	Very low	31.7	Very low	104 Å²	104	136.3 Å²	136.3	73%	0.727	74%	0.737	S	S	*	*			cis	-145.2	147.8	27.7	54.6	0	0	0	0	114.9
843	N	29.1	Very low	31.7	Very low	157 Å²	157	134.1 Å²	134.1	84%	0.84	73%	0.729	S	S	*	*			trans	-80.6	142.1	154.2	-68.6	-86.1	0	0	0	109.3
844	L	31	Very low	32	Very low	150 Å²	150	138.9 Å²	138.9	79%	0.785	73%	0.734	S	S	*	*			trans	-144.2	118	157.2	-89.1	-176.4	0	0	0	112.3
845	P	31.9	Very low	31.4	Very low	116 Å²	116	137.9 Å²	137.9	75%	0.753	73%	0.73	S	S	*	*			trans	-89.3	142.2	165.1	34.8	-30.7	0	0	0	110.7
846	I	32.5	Very low	31.6	Very low	140 Å²	140	140 Å²	140	72%	0.718	74%	0.735	S	S	*	*			trans	-126.7	129.7	174.9	-64.4	-176	0	0	0	111.6	L848	I846-L848 HydrophobicContact CG2-CG 4.32Å
847	I	26.9	Very low	31.3	Very low	139 Å²	139	143.7 Å²	143.7	71%	0.713	75%	0.745	S	S	*	*			trans	-103.3	114.2	176.4	-62.1	167.5	0	0	0	109	K849	I847-K849 HydrophobicContact CG2-CD 4.31Å; I847-K849 HydrophobicContact CG2-CG 4.21Å
848	L	30.8	Very low	31.2	Very low	155 Å²	155	147.1 Å²	147.1	81%	0.812	76%	0.762	S	S	*	*			trans	-135.8	118	160.6	-67.7	175.6	0	0	0	106.7	I846	I846-L848 HydrophobicContact CG2-CG 4.32Å
849	K	27.8	Very low	30.8	Very low	172 Å²	172	148.4 Å²	148.4	75%	0.748	77%	0.768	S	S	*	*			cis	63.9	66.1	29.3	-78	-169.7	175.7	-178.9	0	115.4	I847	I847-K849 HydrophobicContact CG2-CD 4.31Å; I847-K849 HydrophobicContact CG2-CG 4.21Å
850	S	28.9	Very low	30.6	Very low	110 Å²	110	145.6 Å²	145.6	77%	0.769	76%	0.762	S	S	*	*				55.2	115.2	125	62	0	0	0	0	121.4
851	R	28.9	Very low	30.2	Very low	234 Å²	234	146.9 Å²	146.9	88%	0.883	77%	0.766	S	S	*	*				-165.6	149.6	114.8	-126.9	179.1	-178.9	178.7	-0.3	113.4
852	P	33.5	Very low	30.2	Very low	93 Å²	93	144.8 Å²	144.8	60%	0.604	77%	0.765	S	S	*	*			trans	-119.8	129.5	166.4	36.3	-24.9	0	0	0	113.9
853	T	30.1	Very low	30.1	Very low	106 Å²	106	145.2 Å²	145.2	65%	0.65	77%	0.768	S	S	*	*			trans	-179.1	141.9	175.9	38.4	0	0	0	0	107.2
854	H	33.7	Very low	30.3	Very low	166 Å²	166	147.3 Å²	147.3	77%	0.769	77%	0.77	S	S	*	*			cis	-146.9	157.6	-12.2	-86.7	-70.1	0	0	0	105.3
855	S	28.6	Very low	30.7	Very low	90 Å²	90	145.4 Å²	145.4	63%	0.629	77%	0.767	S	S	*	*			cis	89.4	73.3	27.2	90	0	0	0	0	117.7
856	E	32.8	Very low	30.8	Very low	189 Å²	189	147.6 Å²	147.6	88%	0.883	77%	0.766	S	S	*	*			trans	-166.9	134.5	148.6	-101.8	145.5	-147.8	0	0	105.7
857	K	29	Very low	30.8	Very low	197 Å²	197	146.8 Å²	146.8	86%	0.857	76%	0.764	S	S	*	*			cis	63.4	100.2	38.7	-80	-159.8	173.2	-166.9	0	114.8
858	I	30.8	Very low	30.9	Very low	170 Å²	170	145 Å²	145	87%	0.872	76%	0.764	S	S	*	*			trans	-164.8	169.2	131.5	-102	155.2	0	0	0	110.2
859	F	28.7	Very low	31.1	Very low	178 Å²	178	145.8 Å²	145.8	78%	0.781	77%	0.768	S	S	*	*			trans	-67.9	151.8	-163.2	-92	-122.9	0	0	0	117.7
860	D	28.9	Very low	31.2	Very low	131 Å²	131	141.7 Å²	141.7	70%	0.701	76%	0.761	S	S	*	*			trans	34.3	150.7	131.1	-56.7	-11.2	0	0	0	124.3
861	S	27.2	Very low	31.6	Very low	108 Å²	108	146.7 Å²	146.7	76%	0.755	77%	0.769	S	S	*	*			trans	103.2	101.7	142.3	74	0	0	0	0	120.8
862	V	29.7	Very low	31.9	Very low	135 Å²	135	142.3 Å²	142.3	82%	0.818	76%	0.763	S	S	*	*			trans	69.6	158.6	132.8	-172.3	0	0	0	0	118.8
863	S	31.5	Very low	32.4	Very low	113 Å²	113	147 Å²	147	79%	0.79	78%	0.776	S	S	*	*			trans	83.3	97.6	170.1	-48.6	0	0	0	0	118.5
864	K	32.6	Very low	33.1	Very low	202 Å²	202	147.2 Å²	147.2	88%	0.878	78%	0.78	S	S	*	*			trans	-69.3	175.6	147.6	-65.9	176.7	171	179.1	0	110
865	P	41	Very low	33.6	Very low	110 Å²	110	144.9 Å²	144.9	71%	0.714	78%	0.779	S	S	*	*				-132.5	-175.5	-53.9	38.7	-22.7	0	0	0	110.7
866	E	33.4	Very low	34.6	Very low	161 Å²	161	146.1 Å²	146.1	75%	0.752	79%	0.785	S	S	*	*				175.7	153.4	121.5	-100.8	-172.1	-156	0	0	115.1
867	N	31.1	Very low	35	Very low	123 Å²	123	143.5 Å²	143.5	66%	0.658	79%	0.785	S	S	*	*			trans	42	110.6	147.5	-66.7	-39.4	0	0	0	122.6
868	S	29.8	Very low	35.5	Very low	102 Å²	102	140.9 Å²	140.9	71%	0.713	79%	0.785	S	S	*	*			trans	53.6	121.2	132.7	65.7	0	0	0	0	121.1
869	L	35.5	Very low	36.2	Very low	172 Å²	172	137.1 Å²	137.1	90%	0.901	78%	0.779	S	S	*	*				-162.8	160	92.7	-100.1	165.9	0	0	0	111.6
870	S	29.7	Very low	36.6	Very low	85 Å²	85	134.2 Å²	134.2	59%	0.594	78%	0.778	S	S	*	*			trans	-94.2	147	-171.6	50.4	0	0	0	0	113.6
871	F	38.3	Very low	36.9	Very low	216 Å²	216	134 Å²	134	95%	0.947	78%	0.784	S	S	*	*			trans	-143.1	126.2	153.6	-102.1	-79.5	0	0	0	110.3
872	D	34.3	Very low	37.4	Very low	141 Å²	141	136.9 Å²	136.9	75%	0.754	79%	0.789	S	S	*	*			trans	-86.2	149.1	-173.1	-62.5	-73.6	0	0	0	114
873	H	44.1	Very low	37.7	Very low	191 Å²	191	136 Å²	136	88%	0.884	79%	0.789	S	S	*	*			trans	-139.4	140.5	150.9	-88.7	-37.7	0	0	0	110.9
874	P	43.9	Very low	37.8	Very low	111 Å²	111	135.9 Å²	135.9	72%	0.721	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-88.9	159.5	-164.1	35.3	-37.8	0	0	0	114.6
875	P	45.1	Very low	38	Very low	118 Å²	118	131.5 Å²	131.5	77%	0.766	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-75.1	157.3	168.3	33	-35.4	0	0	0	112.5
876	P	49.5	Very low	37.8	Very low	116 Å²	116	130.8 Å²	130.8	75%	0.753	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-74.6	158.2	176.8	31.6	-35.6	0	0	0	113.1
877	P	39.9	Very low	37.7	Very low	134 Å²	134	131.3 Å²	131.3	87%	0.87	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-85	146.7	-167.3	33.2	-36.6	0	0	0	115.2
878	T	40.9	Very low	37.9	Very low	142 Å²	142	132.1 Å²	132.1	87%	0.871	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-91.5	144.5	174	-44.7	0	0	0	0	111.6
879	A	45.3	Very low	37.9	Very low	90 Å²	90	133.7 Å²	133.7	74%	0.744	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-76.6	153.7	177.2	0	0	0	0	0	113.2
880	P	37.7	Very low	37.9	Very low	117 Å²	117	132.9 Å²	132.9	76%	0.76	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-85	153.6	-171.9	33.9	-36.5	0	0	0	114.3
881	P	33.6	Very low	38.3	Very low	127 Å²	127	134.2 Å²	134.2	83%	0.825	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-83.4	150.7	171.9	34.7	-34.3	0	0	0	112.3
882	I	38.9	Very low	38.4	Very low	168 Å²	168	129.2 Å²	129.2	86%	0.862	78%	0.778	S	S	*	*			trans	-108.3	142.8	171.1	-61.3	179.7	0	0	0	109.5
883	S	35.8	Very low	38.6	Very low	116 Å²	116	128.2 Å²	128.2	81%	0.811	78%	0.78	S	S	*	*			trans	-83.7	159.9	-165.9	49.4	0	0	0	0	115.6
884	S	32.6	Very low	38.5	Very low	111 Å²	111	124.7 Å²	124.7	78%	0.776	77%	0.774	S	S	*	*			trans	-102.5	141	-178.5	57.8	0	0	0	0	114.4
885	S	37.3	Very low	38.7	Very low	110 Å²	110	125.2 Å²	125.2	77%	0.769	78%	0.777	S	S	*	*			trans	-161.3	149	164.9	48.5	0	0	0	0	108.8
886	S	36.5	Very low	38.3	Very low	96 Å²	96	128.3 Å²	128.3	67%	0.671	79%	0.786	S	S	*	*			cis	-162.2	151.8	-3.1	-107.8	0	0	0	0	113
887	F	32.8	Very low	37.5	Very low	171 Å²	171	132.1 Å²	132.1	75%	0.75	79%	0.791	S	S	*	*			trans	47.8	119.3	148.2	-73.7	-71.8	0	0	0	123.8
888	N	33.9	Very low	37.2	Very low	140 Å²	140	135.4 Å²	135.4	75%	0.749	79%	0.792	S	S	*	*				136.8	153.1	123	-72.5	-34.4	0	0	0	114.2
889	L	29.9	Very low	36.8	Very low	136 Å²	136	134.9 Å²	134.9	71%	0.712	79%	0.789	S	S	*	*			cis	-176.3	166.1	-45.9	-118	174.8	0	0	0	108.4
890	I	36.4	Very low	36.6	Very low	155 Å²	155	135.5 Å²	135.5	80%	0.795	79%	0.785	S	S	*	*			trans	81	144.9	160.6	-71.5	158.4	0	0	0	118.1
891	P	36.9	Very low	36.4	Very low	112 Å²	112	136.5 Å²	136.5	73%	0.727	78%	0.784	S	S	*	*			trans	-137	-174.2	-142	44.5	-26.4	0	0	0	118
892	S	40.5	Very low	36.3	Very low	111 Å²	111	138.8 Å²	138.8	78%	0.776	78%	0.781	S	S	*	*			trans	-61.7	157.9	167.5	-28.8	0	0	0	0	114.1
893	P	40	Very low	35.9	Very low	120 Å²	120	136.8 Å²	136.8	78%	0.779	78%	0.776	S	S	*	*				-145.9	-149.4	122.8	41.3	-22.2	0	0	0	113.7
894	P	41.3	Very low	35.7	Very low	117 Å²	117	135.7 Å²	135.7	76%	0.76	77%	0.769	S	S	*	*				-130.7	-179.3	-110.4	39.5	-17.7	0	0	0	116.7
895	P	47.5	Very low	35.7	Very low	122 Å²	122	135.8 Å²	135.8	79%	0.792	77%	0.769	S	S	*	*			trans	-99.8	165.6	-175.4	38.3	-35.8	0	0	0	116.1
896	L	37.5	Very low	35.3	Very low	183 Å²	183	137.2 Å²	137.2	96%	0.958	77%	0.769	S	S	*	*			trans	-137.6	167.8	175.3	-84.7	174	0	0	0	114.1
897	K	32.5	Very low	35.1	Very low	196 Å²	196	138.7 Å²	138.7	85%	0.852	77%	0.768	S	S	*	*			trans	-122	147.2	-167.7	-54.5	172.2	179.6	177.8	0	113
898	K	33.4	Very low	34.9	Very low	204 Å²	204	137.4 Å²	137.4	89%	0.887	77%	0.769	S	S	*	*				165.8	166.1	121.1	-90.5	172.7	-178.8	-178.1	0	113.7
899	T	31.6	Very low	34.7	Very low	131 Å²	131	134.7 Å²	134.7	80%	0.804	76%	0.761	S	S	*	*			trans	-109.5	-170	-177.3	57.3	0	0	0	0	110
900	P	42.3	Very low	34.8	Very low	103 Å²	103	136.9 Å²	136.9	67%	0.669	77%	0.767	S	S	*	*			cis	-142.4	-172.3	0.6	42.9	-23.2	0	0	0	117.5
901	N	32.7	Very low	34.6	Very low	137 Å²	137	134.6 Å²	134.6	73%	0.733	77%	0.765	S	S	*	*			trans	93.7	119.7	142.1	-79.7	-13	0	0	0	124.9
902	K	33	Very low	34.6	Very low	176 Å²	176	134 Å²	134	77%	0.765	76%	0.761	S	S	*	*				81.7	124.6	129.2	-79.4	-167.6	172.8	-172.7	0	123.6
903	T	29.9	Very low	34.1	Very low	125 Å²	125	135.6 Å²	135.6	77%	0.767	77%	0.766	S	S	*	*			trans	60.3	144.8	139.7	52.9	0	0	0	0	120.7
904	S	30.6	Very low	33.6	Very low	94 Å²	94	133 Å²	133	66%	0.657	76%	0.761	S	S	*	*			cis	-172.8	167.4	-14.1	50.3	0	0	0	0	110.1
905	S	32.6	Very low	33.1	Very low	112 Å²	112	135 Å²	135	78%	0.783	76%	0.764	S	S	*	*			trans	62.7	150.4	153.5	46	0	0	0	0	120.1
906	N	29.8	Very low	32.3	Very low	141 Å²	141	135.4 Å²	135.4	75%	0.754	76%	0.759	S	S	*	*			cis	-170.2	-178	-25.3	-162.4	8.3	0	0	0	108.6
907	I	33	Very low	32.1	Very low	127 Å²	127	134.7 Å²	134.7	65%	0.651	75%	0.748	S	S	*	*			trans	79.9	111.1	154.1	-64	156.5	0	0	0	118.5
908	N	28.6	Very low	32.2	Very low	144 Å²	144	133.4 Å²	133.4	77%	0.77	74%	0.742	S	S	*	*				48.3	154.3	125.2	-53.5	4.3	0	0	0	121.7
909	S	28.9	Very low	32.1	Very low	83 Å²	83	129.6 Å²	129.6	58%	0.58	74%	0.736	S	S	*	*			cis	-165.6	-179.3	-11.8	43.5	0	0	0	0	111.1
910	E	32.2	Very low	32.2	Very low	182 Å²	182	127.9 Å²	127.9	85%	0.85	73%	0.73	S	S	*	*			trans	78.3	155.8	152.1	-79.2	142	-106.7	0	0	122.3
911	S	31.5	Very low	31.9	Very low	107 Å²	107	130.9 Å²	130.9	75%	0.748	73%	0.734	S	S	*	*			trans	-138.5	-166.5	-163	61.3	0	0	0	0	108.3
912	P	37.9	Very low	32	Very low	100 Å²	100	129.3 Å²	129.3	65%	0.649	73%	0.726	S	S	*	*			cis	-127.2	-166.9	-45.9	29	-7.9	0	0	0	112
913	T	29.9	Very low	32	Very low	144 Å²	144	128.9 Å²	128.9	88%	0.883	72%	0.724	S	S	*	*			trans	70.8	153.3	169.5	75.1	0	0	0	0	116.8
914	G	29.2	Very low	32.1	Very low	65 Å²	65	131.8 Å²	131.8	67%	0.67	73%	0.726	S	S	*	*			cis	172.6	173.7	-10.7	0	0	0	0	0	113.6
915	I	31	Very low	32.1	Very low	160 Å²	160	131.7 Å²	131.7	82%	0.821	73%	0.726	S	S	*	*			trans	84.1	105.1	148.3	-63.6	176.4	0	0	0	121.5
916	L	30.9	Very low	32	Very low	130 Å²	130	135 Å²	135	68%	0.681	73%	0.729	S	S	*	*			trans	81.5	126.5	136.9	-63	176.7	0	0	0	127.6
917	K	33	Very low	32	Very low	168 Å²	168	133.3 Å²	133.3	73%	0.73	73%	0.728	S	S	*	*			trans	73	153.9	135.2	-71.5	168.7	178.3	156.5	0	119.3
918	K	33.9	Very low	32.1	Very low	169 Å²	169	133.4 Å²	133.4	74%	0.735	74%	0.735	S	S	*	*			cis	-163	162.5	5.1	-132	-178.7	179.1	-173.2	0	112.8
919	T	31.9	Very low	32.5	Very low	124 Å²	124	135.8 Å²	135.8	76%	0.761	74%	0.738	S	S	*	*			trans	62.6	151.7	153.2	43.7	0	0	0	0	121.1
920	S	33.6	Very low	32.8	Very low	95 Å²	95	137.1 Å²	137.1	66%	0.664	75%	0.745	S	S	*	*			cis	-178.7	166.2	-14.6	50.2	0	0	0	0	114.3
921	H	36.7	Very low	32.8	Very low	165 Å²	165	134.6 Å²	134.6	76%	0.764	75%	0.748	S	S	*	*			trans	96.9	126.8	154.9	-84.6	-88.3	0	0	0	125.4
922	D	34.7	Very low	32.9	Very low	104 Å²	104	138.6 Å²	138.6	56%	0.556	75%	0.751	S	S	*	*			trans	66.3	111.1	140.6	-77.1	-49.8	0	0	0	128.4
923	K	31.7	Very low	32.4	Very low	167 Å²	167	141.1 Å²	141.1	73%	0.726	76%	0.76	S	S	*	*				69.9	153.3	121.9	-71.3	178.1	-174	112.4	0	126.7
924	F	31.8	Very low	32.4	Very low	186 Å²	186	138.6 Å²	138.6	82%	0.816	74%	0.74	S	S	*	*			trans	100.9	109.9	154	-88.6	-77.5	0	0	0	123.1
925	S	30.8	Very low	32.4	Very low	93 Å²	93	141 Å²	141	65%	0.65	73%	0.734	S	S	*	*			trans	58	114.9	135.2	58.4	0	0	0	0	125.1
926	E	31.1	Very low	32.3	Very low	181 Å²	181	139.9 Å²	139.9	85%	0.846	73%	0.73	S	S	*	*				99.8	117.5	109.4	-168.5	153.3	-131.9	0	0	123.5
927	S	30.9	Very low	32.2	Very low	106 Å²	106	137.9 Å²	137.9	74%	0.741	72%	0.723	S	S	*	*			trans	91.5	150.2	146	82.1	0	0	0	0	123.3
928	T	34.4	Very low	31.8	Very low	129 Å²	129	140 Å²	140	79%	0.791	73%	0.726	S	S	*	*			trans	79.7	79.4	153.6	-31.3	0	0	0	0	121.5
929	K	36.3	Very low	31.5	Very low	194 Å²	194	138.4 Å²	138.4	84%	0.843	73%	0.726	S	S	*	*			trans	-13.1	165.5	141.8	-63.8	176.7	176	173.6	0	118.9
930	P	35.9	Very low	31.4	Very low	110 Å²	110	140.5 Å²	140.5	71%	0.714	73%	0.727	S	S	*	*			cis	-146.2	152.7	-41.6	40.1	-23	0	0	0	115.2
931	S	32	Very low	31.1	Very low	130 Å²	130	141.9 Å²	141.9	91%	0.909	73%	0.727	S	S	*	*			trans	-170.2	151	145	-93.9	0	0	0	0	116.7
932	K	33.7	Very low	30.8	Very low	190 Å²	190	140.8 Å²	140.8	83%	0.826	73%	0.725	S	S	*	*			trans	-50.6	151.5	-172.7	-61.8	166.6	177.7	176.4	0	118.6
933	N	27.5	Very low	30.5	Very low	154 Å²	154	146.6 Å²	146.6	82%	0.824	74%	0.739	S	S	*	*			trans	68.7	133	164.6	-54.4	-0.7	0	0	0	114.6
934	L	30.5	Very low	30.3	Very low	91 Å²	91	143.4 Å²	143.4	48%	0.476	74%	0.739	S	S	.	*			cis	-147.3	-174.4	46.5	-167	55	0	0	0	113.7	Q501 S502	Q501-L934 WeakPolarHBondContact O-CD1 3.49Å; Q501-L934 WeakPolarHBondContact O-CD2 3.49Å; S502-L934 WeakPolarHBondContact O-CD2 3.4Å
935	E	27.8	Very low	30.2	Very low	115 Å²	115	141 Å²	141	54%	0.537	73%	0.734	S	S	.	*			trans	-57.4	172.8	164.1	-54.9	137.7	137.6	0	0	111.9	S500	S500-E935 WeakPolarHBondContact CB-OE1 3.15Å; S500-E935 VanDerWaalsContact CB-OE2 3.24Å; S500-E935 WeakPolarHBondContact CB-OE2 3.3Å; S500-E935 PolarHBondContact OG-OE1 3.16Å; S500-E935 PolarHBondContact OG-OE2 3.19Å
936	D	28.7	Very low	30.2	Very low	137 Å²	137	143.6 Å²	143.6	73%	0.733	74%	0.736	S	S	*	*			cis	-160.3	173.7	21.5	-158.8	0.7	0	0	0	113.3
937	T	29.2	Very low	30.2	Very low	87 Å²	87	143.1 Å²	143.1	53%	0.534	74%	0.738	S	S	.	*			trans	73.1	121.2	156.6	59.4	0	0	0	0	122.1
938	R	25.4	Very low	30.2	Very low	212 Å²	212	145.4 Å²	145.4	80%	0.8	74%	0.741	S	S	*	*				55.9	148.4	117.8	-56.8	172.6	-166.2	169.5	5.4	119.9
939	N	27.4	Very low	30.4	Very low	137 Å²	137	147.1 Å²	147.1	73%	0.733	75%	0.745	S	S	*	*			cis	-165.8	-172.5	-10.7	-106.9	5.7	0	0	0	107.2
940	Q	29.3	Very low	30.6	Very low	167 Å²	167	143.1 Å²	143.1	78%	0.78	74%	0.739	S	S	*	*			trans	79.8	141.4	167.1	-53	-167.1	-81.8	0	0	115.7
941	D	27.9	Very low	31.3	Very low	124 Å²	124	143.1 Å²	143.1	66%	0.663	74%	0.739	S	S	*	*			cis	-161.1	-171.6	-14.5	-105	-23	0	0	0	108.7
942	I	30.5	Very low	32.2	Very low	143 Å²	143	142.4 Å²	142.4	73%	0.733	73%	0.731	S	S	*	*			trans	92.1	104.6	163.4	-51.4	173.2	0	0	0	116.2
943	W	28.9	Very low	33.1	Very low	225 Å²	225	139 Å²	139	85%	0.852	73%	0.728	S	S	*	*			trans	22	114.2	141.7	-58.2	-44.8	0	0	0	119.1
944	S	25.7	Very low	34.4	Very low	101 Å²	101	136.9 Å²	136.9	71%	0.706	72%	0.723	S	S	*	*				71.4	106.5	86.1	-56.9	0	0	0	0	113.5
945	D	30.6	Very low	35.3	Very low	134 Å²	134	138.3 Å²	138.3	72%	0.717	74%	0.738	S	S	*	*				-160.4	153.7	97.1	-120.2	-28.6	0	0	0	115.6
946	Q	31.1	Very low	35.8	Very low	149 Å²	149	141 Å²	141	70%	0.696	75%	0.75	S	S	*	*			trans	14.6	122.3	155.1	-66.4	156.1	64.3	0	0	120.8
947	L	31.4	Very low	36	Very low	171 Å²	171	143.6 Å²	143.6	90%	0.895	76%	0.758	S	S	*	*				-158.8	117.4	101.7	-104.3	170.2	0	0	0	110.4
948	L	31	Very low	36.2	Very low	153 Å²	153	148.4 Å²	148.4	80%	0.801	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-76.1	140	174.2	-85.8	69.5	0	0	0	110.3
949	L	37.3	Very low	36.5	Very low	166 Å²	166	146.2 Å²	146.2	87%	0.869	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-84.8	136.5	153.3	-70	172.6	0	0	0	108.2
950	P	41.7	Very low	36.8	Very low	110 Å²	110	147.9 Å²	147.9	71%	0.714	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-73.8	153.8	-171.3	30	-36	0	0	0	112.6
951	P	49.9	Very low	36.7	Very low	110 Å²	110	146.8 Å²	146.8	71%	0.714	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-65	157.3	164.8	31	-35.2	0	0	0	110.8
952	P	51.3	Low	37	Very low	115 Å²	115	147.5 Å²	147.5	75%	0.747	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-63.5	149.9	171.7	29	-35.1	0	0	0	111
953	P	52.9	Low	37.2	Very low	117 Å²	117	147 Å²	147	76%	0.76	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-67.9	147.7	-179.5	28.8	-35.2	0	0	0	111.8
954	P	54.8	Low	37.1	Very low	110 Å²	110	144.2 Å²	144.2	71%	0.714	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-67.2	156.2	167.3	31.4	-35	0	0	0	110.7
955	P	49.5	Very low	37.6	Very low	122 Å²	122	145.2 Å²	145.2	79%	0.792	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-65.2	142.2	171.6	29.2	-34.4	0	0	0	110.9	E957	P955-E957 PolarHBondContact O-N 2.99Å
956	E	37.6	Very low	37.6	Very low	172 Å²	172	144.3 Å²	144.3	80%	0.804	79%	0.79	S	S	*	*			trans	-70.7	115.4	-175.2	-62.1	171.1	137.3	0	0	111.7
957	E	32.7	Very low	37.7	Very low	190 Å²	190	143 Å²	143	89%	0.888	79%	0.792	S	S	*	*			trans	-78.4	124.4	159.8	-68.6	-165.4	141.3	0	0	109.1	P955 E959	P955-E957 PolarHBondContact O-N 2.99Å; E957-E959 PolarHBondContact O-N 3.32Å
958	F	34.3	Very low	37.7	Very low	188 Å²	188	145.3 Å²	145.3	83%	0.825	79%	0.789	S	S	*	*			trans	-78.1	103.2	175.5	-91.7	-99.5	0	0	0	110.3	L960	F958-L960 PolarHBondContact O-N 3.17Å
959	E	30.1	Very low	37.7	Very low	167 Å²	167	146.4 Å²	146.4	78%	0.78	79%	0.79	S	S	*	*			trans	-59.4	132.7	165	-69.9	-170.1	146.2	0	0	111	E957	E957-E959 PolarHBondContact O-N 3.32Å
960	L	34.5	Very low	37.5	Very low	172 Å²	172	144.4 Å²	144.4	90%	0.901	79%	0.79	S	S	*	*			trans	-131.7	108	156	-86.2	176.2	0	0	0	109.4	F958	F958-L960 PolarHBondContact O-N 3.17Å
961	N	28	Very low	36.9	Very low	143 Å²	143	146.5 Å²	146.5	77%	0.765	80%	0.795	S	S	*	*			trans	-53.1	133.1	176.2	-61.2	-74.7	0	0	0	112.8
962	V	34.3	Very low	35.8	Very low	140 Å²	140	146.1 Å²	146.1	85%	0.848	79%	0.794	S	S	*	*			trans	-140.8	139.1	132.1	-178.1	0	0	0	0	109.2
963	T	34.4	Very low	35	Very low	132 Å²	132	148.4 Å²	148.4	81%	0.81	80%	0.795	S	S	*	*			trans	-66.1	156.8	-176.5	1.4	0	0	0	0	115.9
964	E	25.5	Very low	34	Very low	166 Å²	166	150.3 Å²	150.3	78%	0.776	79%	0.794	S	S	*	*			trans	-45.7	154.3	153.5	-102.6	-174.7	-143.5	0	0	113.3
965	P	36.6	Very low	32.7	Very low	123 Å²	123	151.5 Å²	151.5	80%	0.799	79%	0.794	S	S	*	*				-150.8	176.4	66.4	41.3	-21.3	0	0	0	118.6
966	V	30.8	Very low	31.8	Very low	114 Å²	114	150.7 Å²	150.7	69%	0.691	79%	0.787	S	S	*	*			trans	-76.7	132.3	179.2	-176.5	0	0	0	0	112.8
967	T	33.1	Very low	31.5	Very low	121 Å²	121	149.7 Å²	149.7	74%	0.742	79%	0.787	S	S	*	*				174	143.3	122.4	29.8	0	0	0	0	115.9
968	R	31.7	Very low	31.5	Very low	221 Å²	221	144.1 Å²	144.1	83%	0.834	78%	0.78	S	S	*	*			trans	51	111	146.5	-66.6	-179.7	175.8	-176.2	-1.7	121.5
969	Q	30.3	Very low	31.4	Very low	176 Å²	176	145.1 Å²	145.1	82%	0.822	78%	0.78	S	S	*	*				27.8	116.6	123.4	-64	173	-31.2	0	0	119
970	S	32.8	Very low	31.6	Very low	123 Å²	123	143 Å²	143	86%	0.86	77%	0.774	S	S	*	*				179.8	166.4	102.6	45.4	0	0	0	0	113.8
971	N	30.3	Very low	31.7	Very low	154 Å²	154	141.1 Å²	141.1	82%	0.824	76%	0.763	S	S	*	*			trans	-70.9	161	-164	-70.8	-19.4	0	0	0	118
972	C	27.1	Very low	32	Very low	103 Å²	103	140.9 Å²	140.9	70%	0.696	76%	0.762	S	S	*	*			trans	94.4	139.2	132.5	-89.4	0	0	0	0	122.7
973	Q	33.2	Very low	32	Very low	162 Å²	162	141.3 Å²	141.3	76%	0.757	76%	0.76	S	S	*	*			trans	66.7	107.3	149.9	-69.5	163.4	-6	0	0	117.1
974	Q	33.2	Very low	32	Very low	158 Å²	158	144 Å²	144	74%	0.738	76%	0.763	S	S	*	*				91.5	123.5	65.5	-89.6	-171.4	-4.7	0	0	112.8
975	N	27.4	Very low	32.4	Very low	135 Å²	135	141.2 Å²	141.2	72%	0.722	76%	0.757	S	S	*	*			trans	68.5	152.1	150.2	-61.8	-12.3	0	0	0	116.7
976	T	30.7	Very low	32.2	Very low	104 Å²	104	140.5 Å²	140.5	64%	0.638	76%	0.755	S	S	*	*			cis	-166.4	161.3	-5.3	14.1	0	0	0	0	111
977	N	30.3	Very low	32.1	Very low	152 Å²	152	145.9 Å²	145.9	81%	0.813	76%	0.764	S	S	*	*			trans	66	139.1	151.2	-57.1	-17.7	0	0	0	120.2
978	G	33.1	Very low	31.9	Very low	72 Å²	72	147.9 Å²	147.9	74%	0.742	76%	0.763	S	S	*	*			trans	165.8	87.2	168.7	0	0	0	0	0	116.4
979	Y	32.1	Very low	31.8	Very low	210 Å²	210	143.8 Å²	143.8	82%	0.824	76%	0.763	S	S	*	*			trans	-14.8	154.1	145.1	-60.6	-79.9	0	0	0	117.7
980	D	34.8	Very low	31.8	Very low	123 Å²	123	143.6 Å²	143.6	66%	0.658	76%	0.759	S	S	*	*			cis	-168.9	176.3	13.1	-133.5	-27.5	0	0	0	116.2
981	I	36.3	Very low	31.6	Very low	131 Å²	131	143.2 Å²	143.2	67%	0.672	76%	0.757	S	S	*	*			trans	76	120.3	141.7	-78.3	161.1	0	0	0	123.2
982	N	35	Very low	31.4	Very low	138 Å²	138	140.9 Å²	140.9	74%	0.738	75%	0.753	S	S	*	*			trans	68.4	95	145.7	-66.9	-6	0	0	0	124.8
983	N	33.1	Very low	31.5	Very low	150 Å²	150	140.7 Å²	140.7	80%	0.802	75%	0.752	S	S	*	*				18.1	128.2	118.7	-68.9	-27.3	0	0	0	120.4
984	H	35.6	Very low	31.2	Very low	189 Å²	189	142.2 Å²	142.2	88%	0.875	76%	0.76	S	S	*	*				-154.8	156.8	116.8	-116.2	-70.5	0	0	0	114.2
985	T	33.7	Very low	30.9	Very low	107 Å²	107	139.2 Å²	139.2	66%	0.656	75%	0.752	S	S	*	*			trans	-65	128.3	-163.8	-4.6	0	0	0	0	116.1
986	S	32.4	Very low	30.9	Very low	107 Å²	107	136.9 Å²	136.9	75%	0.748	75%	0.752	S	S	*	*			trans	-160	130.8	151	-81.3	0	0	0	0	108.8	K988	S986-K988 PolarHBondContact O-N 2.85Å
987	Y	28.5	Very low	31.1	Very low	227 Å²	227	140 Å²	140	89%	0.89	76%	0.756	S	S	*	*			trans	-75.8	65.9	-177	-75	-79	0	0	0	112.8
988	K	28.1	Very low	31.3	Very low	163 Å²	163	142.6 Å²	142.6	71%	0.709	76%	0.76	S	S	*	*			trans	-94	94.5	154.3	-73.3	-176.9	177.4	179.9	0	107.6	S986 F990	S986-K988 PolarHBondContact O-N 2.85Å; K988-F990 HydrophobicContact CB-CD2 4.06Å; K988-F990 HydrophobicContact CB-CE2 4.19Å; K988-F990 HydrophobicContact CD-CE2 4.19Å; K988-F990 PolarHBondContact O-N 3.34Å
989	T	30.8	Very low	31.8	Very low	136 Å²	136	142.4 Å²	142.4	83%	0.834	75%	0.745	S	S	*	*			trans	-66.6	86	158.5	27.9	0	0	0	0	107.9	S991	T989-S991 PolarHBondContact O-N 3.28Å
990	F	30	Very low	33.1	Very low	171 Å²	171	135.2 Å²	135.2	75%	0.75	73%	0.726	S	S	*	*			trans	-50.4	127.1	168.4	-94.1	-100.8	0	0	0	108.3	K988 S992	K988-F990 HydrophobicContact CB-CD2 4.06Å; K988-F990 HydrophobicContact CB-CE2 4.19Å; K988-F990 HydrophobicContact CD-CE2 4.19Å; K988-F990 PolarHBondContact O-N 3.34Å; F990-S992 PolarHBondContact O-N 2.93Å
991	S	27.7	Very low	34.1	Very low	116 Å²	116	133.6 Å²	133.6	81%	0.811	71%	0.713	S	S	*	*			trans	-76	65.3	-180	55.6	0	0	0	0	110.4	T989 S993	T989-S991 PolarHBondContact O-N 3.28Å; S991-S993 PolarHBondContact O-N 3.27Å
992	S	27.2	Very low	34.8	Very low	105 Å²	105	128.7 Å²	128.7	73%	0.734	69%	0.687	S	S	*	*			trans	-63.9	96.8	173.4	56.1	0	0	0	0	108.5	F990 Q994	F990-S992 PolarHBondContact O-N 2.93Å; S992-Q994 PolarHBondContact O-N 3.49Å
993	S	28	Very low	36.4	Very low	98 Å²	98	125.5 Å²	125.5	69%	0.685	67%	0.67	S	S	*	*			trans	-72.8	86	-167.6	57.2	0	0	0	0	111.7	S991 T995	S991-S993 PolarHBondContact O-N 3.27Å; S993-T995 PolarHBondContact O-N 2.86Å
994	Q	26.7	Very low	38.2	Very low	195 Å²	195	121.7 Å²	121.7	91%	0.911	65%	0.65	S	S	*	*			trans	-64.9	79.6	145.2	-75.2	-165.2	0.9	0	0	107.9	S992 A996	S992-Q994 PolarHBondContact O-N 3.49Å; Q994-A996 PolarHBondContact O-N 3.48Å
995	T	27.5	Very low	39.7	Very low	94 Å²	94	114 Å²	114	58%	0.577	62%	0.615	S	S	*	*			trans	-64.9	88.9	154.8	52	0	0	0	0	106.6	S993 K997	S993-T995 PolarHBondContact O-N 2.86Å; T995-K997 PolarHBondContact O-N 3.4Å
996	A	28.4	Very low	41.6	Very low	87 Å²	87	116 Å²	116	72%	0.719	61%	0.61	S	S	*	*			trans	-57.7	84.6	145.8	0	0	0	0	0	105.4	Q994 K998	Q994-A996 PolarHBondContact O-N 3.48Å; A996-K998 PolarHBondContact O-N 3.32Å
997	K	33	Very low	43.7	Very low	169 Å²	169	116.7 Å²	116.7	74%	0.735	60%	0.596	S	S	*	*			trans	-56.3	110.2	-176.4	-73.8	-176.2	176.8	-178.5	0	105.8	T995 T999	T995-K997 PolarHBondContact O-N 3.4Å; K997-T999 PolarHBondContact O-N 3.17Å
998	K	34.6	Very low	45.7	Very low	206 Å²	206	108.3 Å²	108.3	90%	0.896	57%	0.574	S	S	*	*			trans	-56.9	98.9	161.8	-86.8	-173	173.2	-178.3	0	104.8	A996 S1000	A996-K998 PolarHBondContact O-N 3.32Å; K998-S1000 PolarHBondContact O-N 2.88Å; K998-S1000 VanDerWaalsContact O-N 3.14Å
999	T	44.2	Very low	47.9	Very low	69 Å²	69	101.5 Å²	101.5	42%	0.423	55%	0.547	S	S	.	.			trans	-51.8	124.7	-179.3	55.5	0	0	0	0	106.8	K997 D1003 N1004 R1007	K997-T999 PolarHBondContact O-N 3.17Å; T999-D1003 WeakPolarHBondContact CA-OD2 3.41Å; T999-N1004 PolarHBondContact O-ND2 2.95Å; T999-N1004 PolarHBondContact OG1-ND2 3.23Å; T999-N1004 VanDerWaalsContact OG1-ND2 3.1Å; T999-N1004 PolarHBondContact OG1-OD1 3.18Å; T999-R1007 VanDerWaalsContact CB-NH2 3.33Å
1000	S	58.7	Low	50.1	Low	59 Å²	59	97.9 Å²	97.9	41%	0.413	53%	0.53	S	S	.	.			trans	-54	154.2	-177.6	-176.5	0	0	0	0	109.9	K998 E1002 D1003 N1004	K998-S1000 PolarHBondContact O-N 2.88Å; K998-S1000 VanDerWaalsContact O-N 3.14Å; S1000-E1002 PolarHBondContact O-N 3.3Å; S1000-E1002 WeakPolarHBondContact OG-CB 3.43Å; S1000-E1002 PolarHBondContact OG-N 3.21Å; S1000-D1003 PolarHBondContact N-OD2 3.15Å; S1000-D1003 WeakPolarHBondContact O-CB 3.29Å; S1000-D1003 PolarHBondContact O-N 3.41Å; S1000-N1004 PolarHBondContact O-N 3.11Å; S1000-N1004 PolarHBondContact O-ND2 3.49Å
1001	F	56.5	Low	52.4	Low	88 Å²	88	96 Å²	96	39%	0.386	52%	0.524	S	S	.	.	H	α-helix	trans	-51.3	-39.6	165.1	175.6	-109.3	0	0	0	110.2	M315 N1004 L1005	M315-F1001 HydrophobicContact CE-CE1 3.98Å; M315-F1001 HydrophobicContact CE-CE2 4.16Å; M315-F1001 HydrophobicContact CE-CZ 3.35Å; M315-F1001 HydrophobicContact SD-CZ 4.4Å; F1001-N1004 PolarHBondContact O-N 3.18Å; F1001-L1005 HydrophobicContact CD1-CD1 3.88Å; F1001-L1005 HydrophobicContact CE1-CD1 3.28Å; F1001-L1005 HydrophobicContact CE1-CG 4.45Å; F1001-L1005 HydrophobicContact CE2-CD1 4.16Å; F1001-L1005 HydrophobicContact CZ-CD1 3.43Å; F1001-L1005 VanDerWaalsContact CZ-CD1 3.43Å; F1001-L1005 HydrophobicContact CZ-CG 4.25Å; F1001-L1005 PolarHBondContact O-N 3.44Å
1002	E	50.6	Low	54.3	Low	29 Å²	29	94.7 Å²	94.7	14%	0.136	50%	0.501	C	S	.	.	H	α-helix	trans	-60	-42.7	171.1	-175.1	68.7	-173.3	0	0	113	R314 S1000 N1004 L1005 R1006	R314-E1002 WeakPolarHBondContact CD-OE2 3.4Å; R314-E1002 IonicContact CZ-OE1 3.87Å; R314-E1002 IonicContact CZ-OE2 2.8Å; R314-E1002 IonicContact NE-OE2 2.72Å; R314-E1002 VanDerWaalsContact NH1-CD 3.31Å; R314-E1002 IonicContact NH1-OE1 2.81Å; R314-E1002 PolarHBondContact NH1-OE1 3.32Å; R314-E1002 IonicContact NH1-OE2 3.15Å; R314-E1002 PolarHBondContact NH1-OE2 3.48Å; S1000-E1002 PolarHBondContact O-N 3.3Å; S1000-E1002 WeakPolarHBondContact OG-CB 3.43Å; S1000-E1002 PolarHBondContact OG-N 3.21Å; E1002-N1004 VanDerWaalsContact C-N 3.32Å; E1002-N1004 PolarHBondContact O-N 3.24Å; E1002-L1005 PolarHBondContact O-N 3.14Å; E1002-R1006 WeakPolarHBondContact O-CB 3.21Å; E1002-R1006 VanDerWaalsContact O-CG 3.25Å; E1002-R1006 WeakPolarHBondContact O-CG 3.42Å; E1002-R1006 PolarHBondContact O-N 3.04Å; E1002-R1006 IonicContact OE1-CZ 3.03Å; E1002-R1006 IonicContact OE1-NE 3.09Å; E1002-R1006 PolarHBondContact OE1-NE 3.35Å; E1002-R1006 IonicContact OE1-NH2 3.56Å; E1002-R1006 PolarHBondContact OE1-NH2 3.16Å
1003	D	70.2	Confident	56.5	Low	71 Å²	71	94.3 Å²	94.3	38%	0.38	48%	0.484	S	S	.	.	H	α-helix	trans	-66.6	-34.5	178.3	-63.2	-32.5	0	0	0	112.1	T999 S1000 R1007	T999-D1003 WeakPolarHBondContact CA-OD2 3.41Å; S1000-D1003 PolarHBondContact N-OD2 3.15Å; S1000-D1003 WeakPolarHBondContact O-CB 3.29Å; S1000-D1003 PolarHBondContact O-N 3.41Å; D1003-R1007 VanDerWaalsContact C-NH2 3.33Å; D1003-R1007 WeakPolarHBondContact O-CB 3.43Å; D1003-R1007 VanDerWaalsContact O-CZ 3.31Å; D1003-R1007 PolarHBondContact O-N 3.03Å; D1003-R1007 VanDerWaalsContact O-N 3.14Å; D1003-R1007 PolarHBondContact O-NE 3.43Å; D1003-R1007 PolarHBondContact O-NH2 3.38Å
1004	N	70.3	Confident	58.8	Low	70 Å²	70	97.2 Å²	97.2	37%	0.374	48%	0.48	S	S	.	.	H	α-helix	trans	-73.3	-42.3	177.4	-74	-47.7	0	0	0	111.1	T999 S1000 F1001 E1002 R1007 A1008	T999-N1004 PolarHBondContact O-ND2 2.95Å; T999-N1004 PolarHBondContact OG1-ND2 3.23Å; T999-N1004 VanDerWaalsContact OG1-ND2 3.1Å; T999-N1004 PolarHBondContact OG1-OD1 3.18Å; S1000-N1004 PolarHBondContact O-N 3.11Å; S1000-N1004 PolarHBondContact O-ND2 3.49Å; F1001-N1004 PolarHBondContact O-N 3.18Å; E1002-N1004 VanDerWaalsContact C-N 3.32Å; E1002-N1004 PolarHBondContact O-N 3.24Å; N1004-R1007 PolarHBondContact O-N 3.21Å; N1004-R1007 VanDerWaalsContact OD1-CZ 3.27Å; N1004-R1007 PolarHBondContact OD1-NH1 2.92Å; N1004-R1007 PolarHBondContact OD1-NH2 3Å; N1004-A1008 PolarHBondContact O-N 3.07Å
1005	L	67.8	Low	61.1	Low	28 Å²	28	93.2 Å²	93.2	15%	0.147	46%	0.464	C	S	.	.	H	α-helix	trans	-61.4	-49.6	172.2	-93.7	164.6	0	0	0	112	F318 F1001 E1002 R1007 A1008 V1009	F318-L1005 HydrophobicContact CB-CD2 4.42Å; F318-L1005 HydrophobicContact CD1-CD2 4.25Å; F318-L1005 HydrophobicContact CD2-CD1 3.69Å; F318-L1005 HydrophobicContact CD2-CD2 3.9Å; F318-L1005 HydrophobicContact CD2-CG 4.37Å; F318-L1005 HydrophobicContact CE2-CB 4.44Å; F318-L1005 HydrophobicContact CE2-CD1 3.73Å; F318-L1005 HydrophobicContact CE2-CD2 4.2Å; F318-L1005 HydrophobicContact CE2-CG 4.36Å; F318-L1005 HydrophobicContact CG-CD2 3.95Å; F1001-L1005 HydrophobicContact CD1-CD1 3.88Å; F1001-L1005 HydrophobicContact CE1-CD1 3.28Å; F1001-L1005 HydrophobicContact CE1-CG 4.45Å; F1001-L1005 HydrophobicContact CE2-CD1 4.16Å; F1001-L1005 HydrophobicContact CZ-CD1 3.43Å; F1001-L1005 VanDerWaalsContact CZ-CD1 3.43Å; F1001-L1005 HydrophobicContact CZ-CG 4.25Å; F1001-L1005 PolarHBondContact O-N 3.44Å; E1002-L1005 PolarHBondContact O-N 3.14Å; L1005-R1007 VanDerWaalsContact C-N 3.29Å; L1005-R1007 PolarHBondContact O-N 2.9Å; L1005-A1008 PolarHBondContact O-N 2.9Å; L1005-A1008 VanDerWaalsContact O-N 3.12Å; L1005-V1009 WeakPolarHBondContact O-CG2 3.38Å; L1005-V1009 PolarHBondContact O-N 3.35Å
1006	R	72.5	Confident	63.2	Low	148 Å²	148	93.3 Å²	93.3	56%	0.558	46%	0.46	S	S	*	.	H	α-helix	trans	-58	-40.2	177.8	-74.1	177.9	-172.8	-168.1	7.6	112	E1002 A1010	E1002-R1006 WeakPolarHBondContact O-CB 3.21Å; E1002-R1006 VanDerWaalsContact O-CG 3.25Å; E1002-R1006 WeakPolarHBondContact O-CG 3.42Å; E1002-R1006 PolarHBondContact O-N 3.04Å; E1002-R1006 IonicContact OE1-CZ 3.03Å; E1002-R1006 IonicContact OE1-NE 3.09Å; E1002-R1006 PolarHBondContact OE1-NE 3.35Å; E1002-R1006 IonicContact OE1-NH2 3.56Å; E1002-R1006 PolarHBondContact OE1-NH2 3.16Å; R1006-A1010 VanDerWaalsContact O-CB 3.26Å; R1006-A1010 WeakPolarHBondContact O-CB 3.26Å; R1006-A1010 PolarHBondContact O-N 3.39Å
1007	R	77.4	Confident	65.5	Low	121 Å²	121	95.2 Å²	95.2	46%	0.457	45%	0.454	S	S	.	.	H	α-helix	trans	-64.5	-46.7	173	-90.3	177.3	-77.3	109.2	2.8	112.6	T999 D1003 N1004 L1005 V1009 A1010 E1011	T999-R1007 VanDerWaalsContact CB-NH2 3.33Å; D1003-R1007 VanDerWaalsContact C-NH2 3.33Å; D1003-R1007 WeakPolarHBondContact O-CB 3.43Å; D1003-R1007 VanDerWaalsContact O-CZ 3.31Å; D1003-R1007 PolarHBondContact O-N 3.03Å; D1003-R1007 VanDerWaalsContact O-N 3.14Å; D1003-R1007 PolarHBondContact O-NE 3.43Å; D1003-R1007 PolarHBondContact O-NH2 3.38Å; N1004-R1007 PolarHBondContact O-N 3.21Å; N1004-R1007 VanDerWaalsContact OD1-CZ 3.27Å; N1004-R1007 PolarHBondContact OD1-NH1 2.92Å; N1004-R1007 PolarHBondContact OD1-NH2 3Å; L1005-R1007 VanDerWaalsContact C-N 3.29Å; L1005-R1007 PolarHBondContact O-N 2.9Å; R1007-V1009 VanDerWaalsContact C-N 3.33Å; R1007-V1009 PolarHBondContact O-N 3.36Å; R1007-A1010 PolarHBondContact O-N 2.73Å; R1007-E1011 VanDerWaalsContact O-CB 3.23Å; R1007-E1011 WeakPolarHBondContact O-CB 3.19Å; R1007-E1011 PolarHBondContact O-N 3.32Å
1008	A	70.4	Confident	67.3	Low	52 Å²	52	93.1 Å²	93.1	43%	0.43	45%	0.448	S	S	.	.	H	α-helix	trans	-62.9	-36.9	178.7	0	0	0	0	0	113.1	N1004 L1005 R1012	N1004-A1008 PolarHBondContact O-N 3.07Å; L1005-A1008 PolarHBondContact O-N 2.9Å; L1005-A1008 VanDerWaalsContact O-N 3.12Å; A1008-R1012 WeakPolarHBondContact O-CB 3.48Å; A1008-R1012 PolarHBondContact O-N 3.05Å; A1008-R1012 VanDerWaalsContact O-N 3.11Å
1009	V	73.1	Confident	68.7	Low	20 Å²	20	87.4 Å²	87.4	12%	0.121	44%	0.44	C	S	.	.	H	α-helix	trans	-70	-45.2	174.6	174	0	0	0	0	111.2	F318 D356 L1005 R1007 R1012 R1013	F318-V1009 HydrophobicContact CD1-CG2 4.41Å; F318-V1009 HydrophobicContact CE1-CG2 3.96Å; D356-V1009 HydrophobicContact CB-CG1 4.32Å; D356-V1009 WeakPolarHBondContact OD1-CG1 3.29Å; L1005-V1009 WeakPolarHBondContact O-CG2 3.38Å; L1005-V1009 PolarHBondContact O-N 3.35Å; R1007-V1009 VanDerWaalsContact C-N 3.33Å; R1007-V1009 PolarHBondContact O-N 3.36Å; V1009-R1012 PolarHBondContact O-N 3.35Å; V1009-R1013 PolarHBondContact O-N 3.18Å
1010	A	77.2	Confident	69.3	Low	60 Å²	60	88.6 Å²	88.6	50%	0.496	45%	0.45	S	S	.	.	H	α-helix	trans	-64	-41.8	178	0	0	0	0	0	112.6	R1006 R1007 R1012 R1013 R1014	R1006-A1010 VanDerWaalsContact O-CB 3.26Å; R1006-A1010 WeakPolarHBondContact O-CB 3.26Å; R1006-A1010 PolarHBondContact O-N 3.39Å; R1007-A1010 PolarHBondContact O-N 2.73Å; A1010-R1012 VanDerWaalsContact C-N 3.32Å; A1010-R1012 PolarHBondContact O-N 3.37Å; A1010-R1013 PolarHBondContact O-N 2.89Å; A1010-R1014 WeakPolarHBondContact O-CB 3.44Å; A1010-R1014 PolarHBondContact O-N 3.19Å
1011	E	77.6	Confident	68.5	Low	131 Å²	131	88.6 Å²	88.6	61%	0.612	46%	0.46	S	S	*	.	H	α-helix	trans	-60.9	-41.3	174.1	-175.6	167.6	-149.5	0	0	111.3	R1007 R1014 L1015	R1007-E1011 VanDerWaalsContact O-CB 3.23Å; R1007-E1011 WeakPolarHBondContact O-CB 3.19Å; R1007-E1011 PolarHBondContact O-N 3.32Å; E1011-R1014 PolarHBondContact O-N 3.08Å; E1011-L1015 WeakPolarHBondContact O-CG 3.45Å; E1011-L1015 PolarHBondContact O-N 3.34Å; E1011-L1015 VanDerWaalsContact O-N 3.11Å
1012	R	69	Low	67.9	Low	89 Å²	89	93.8 Å²	93.8	34%	0.336	49%	0.486	S	S	.	.	H	α-helix	trans	-72.2	-35.8	176.3	-173.5	169.8	170.5	-146.7	-13	113.9	V357 A1008 V1009 A1010 L1015 I1016	V357-R1012 PolarHBondContact O-NH1 3.49Å; A1008-R1012 WeakPolarHBondContact O-CB 3.48Å; A1008-R1012 PolarHBondContact O-N 3.05Å; A1008-R1012 VanDerWaalsContact O-N 3.11Å; V1009-R1012 PolarHBondContact O-N 3.35Å; A1010-R1012 VanDerWaalsContact C-N 3.32Å; A1010-R1012 PolarHBondContact O-N 3.37Å; R1012-L1015 PolarHBondContact O-N 2.82Å; R1012-I1016 HydrophobicContact CG-CD1 4.38Å; R1012-I1016 WeakPolarHBondContact O-CG1 3.38Å; R1012-I1016 PolarHBondContact O-N 2.8Å; R1012-I1016 VanDerWaalsContact O-N 3.15Å
1013	R	73.6	Confident	67.5	Low	97 Å²	97	100.1 Å²	100.1	37%	0.366	52%	0.52	S	S	.	.	H	α-helix	trans	-60.8	-46.7	171.3	-76.4	-169.7	-177.5	-153.8	3.2	110.6	D356 V1009 A1010 L1015 I1016 E1017	D356-R1013 IonicContact OD1-CZ 2.74Å; D356-R1013 IonicContact OD1-NE 3.19Å; D356-R1013 PolarHBondContact OD1-NE 2.86Å; D356-R1013 VanDerWaalsContact OD1-NE 3.15Å; D356-R1013 IonicContact OD1-NH2 3.15Å; D356-R1013 PolarHBondContact OD1-NH2 3.37Å; D356-R1013 IonicContact OD2-NH2 2.71Å; D356-R1013 PolarHBondContact OD2-NH2 2.88Å; V1009-R1013 PolarHBondContact O-N 3.18Å; A1010-R1013 PolarHBondContact O-N 2.89Å; R1013-L1015 VanDerWaalsContact C-N 3.29Å; R1013-L1015 PolarHBondContact O-N 3.41Å; R1013-I1016 WeakPolarHBondContact O-CA 3.11Å; R1013-I1016 WeakPolarHBondContact O-CB 3.43Å; R1013-I1016 PolarHBondContact O-N 2.78Å; R1013-E1017 WeakPolarHBondContact O-CG 3.36Å; R1013-E1017 PolarHBondContact O-N 3Å
1014	R	75.3	Confident	65.9	Low	159 Å²	159	104.1 Å²	104.1	60%	0.6	54%	0.542	S	S	*	.	H	α-helix	trans	-57.5	-38.8	176.3	-166.8	-179.3	-173	-164	0.3	113	A1010 E1011 I1016 M1018	A1010-R1014 WeakPolarHBondContact O-CB 3.44Å; A1010-R1014 PolarHBondContact O-N 3.19Å; E1011-R1014 PolarHBondContact O-N 3.08Å; R1014-I1016 VanDerWaalsContact C-N 3.34Å; R1014-M1018 HydrophobicContact CG-CE 4.09Å; R1014-M1018 HydrophobicContact CG-SD 4.23Å; R1014-M1018 WeakPolarHBondContact O-CB 3.3Å; R1014-M1018 WeakPolarHBondContact O-CG 3.08Å; R1014-M1018 PolarHBondContact O-N 2.89Å
1015	L	76.3	Confident	64.6	Low	111 Å²	111	109.7 Å²	109.7	58%	0.581	57%	0.565	S	S	*	*	H	α-helix	trans	-69.5	-27.3	174.9	-72.5	171	0	0	0	113.7	E1011 R1012 R1013 A1019	E1011-L1015 WeakPolarHBondContact O-CG 3.45Å; E1011-L1015 PolarHBondContact O-N 3.34Å; E1011-L1015 VanDerWaalsContact O-N 3.11Å; R1012-L1015 PolarHBondContact O-N 2.82Å; R1013-L1015 VanDerWaalsContact C-N 3.29Å; R1013-L1015 PolarHBondContact O-N 3.41Å; L1015-A1019 WeakPolarHBondContact O-CB 3.24Å
1016	I	71.6	Confident	63.2	Low	96 Å²	96	114.5 Å²	114.5	49%	0.492	59%	0.591	S	S	.	*	H	α-helix	trans	-76.9	-45.9	173.6	-67.1	164.4	0	0	0	109.6	R1012 R1013 R1014 M1018 A1019 S1020	R1012-I1016 HydrophobicContact CG-CD1 4.38Å; R1012-I1016 WeakPolarHBondContact O-CG1 3.38Å; R1012-I1016 PolarHBondContact O-N 2.8Å; R1012-I1016 VanDerWaalsContact O-N 3.15Å; R1013-I1016 WeakPolarHBondContact O-CA 3.11Å; R1013-I1016 WeakPolarHBondContact O-CB 3.43Å; R1013-I1016 PolarHBondContact O-N 2.78Å; R1014-I1016 VanDerWaalsContact C-N 3.34Å; I1016-M1018 VanDerWaalsContact C-N 3.31Å; I1016-M1018 PolarHBondContact O-N 3.12Å; I1016-A1019 CarbonylContact O-C 3.6Å; I1016-A1019 WeakPolarHBondContact O-CA 3.47Å; I1016-A1019 PolarHBondContact O-N 2.88Å; I1016-S1020 PolarHBondContact O-N 3.33Å; I1016-S1020 PolarHBondContact O-OG 2.72Å; I1016-S1020 VanDerWaalsContact O-OG 3.08Å
1017	E	75.4	Confident	61.5	Low	126 Å²	126	113 Å²	113	59%	0.589	60%	0.603	S	S	*	*	H	α-helix	trans	-56.4	-44	175.4	-69.4	158.4	-169.9	0	0	111.5	R1013 A1019 S1020	R1013-E1017 WeakPolarHBondContact O-CG 3.36Å; R1013-E1017 PolarHBondContact O-N 3Å; E1017-A1019 PolarHBondContact O-N 3.17Å; E1017-S1020 PolarHBondContact O-N 3.45Å; E1017-S1020 PolarHBondContact O-OG 2.97Å
1018	M	71.6	Confident	59.5	Low	125 Å²	125	115.7 Å²	115.7	62%	0.616	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-16	173.6	-76.2	172.2	166.8	0	0	114.7	R1014 I1016	R1014-M1018 HydrophobicContact CG-CE 4.09Å; R1014-M1018 HydrophobicContact CG-SD 4.23Å; R1014-M1018 WeakPolarHBondContact O-CB 3.3Å; R1014-M1018 WeakPolarHBondContact O-CG 3.08Å; R1014-M1018 PolarHBondContact O-N 2.89Å; I1016-M1018 VanDerWaalsContact C-N 3.31Å; I1016-M1018 PolarHBondContact O-N 3.12Å
1019	A	64.4	Low	57.7	Low	87 Å²	87	118.1 Å²	118.1	72%	0.719	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.3	10.7	-179.3	0	0	0	0	0	113	L1015 I1016 E1017	L1015-A1019 WeakPolarHBondContact O-CB 3.24Å; I1016-A1019 CarbonylContact O-C 3.6Å; I1016-A1019 WeakPolarHBondContact O-CA 3.47Å; I1016-A1019 PolarHBondContact O-N 2.88Å; E1017-A1019 PolarHBondContact O-N 3.17Å
1020	S	55.8	Low	55.8	Low	93 Å²	93	125 Å²	125	65%	0.65	67%	0.669	S	S	*	*	S	Bend	trans	-134.9	25	-173.6	57.2	0	0	0	0	114.3	I1016 E1017	I1016-S1020 PolarHBondContact O-N 3.33Å; I1016-S1020 PolarHBondContact O-OG 2.72Å; I1016-S1020 VanDerWaalsContact O-OG 3.08Å; E1017-S1020 PolarHBondContact O-N 3.45Å; E1017-S1020 PolarHBondContact O-OG 2.97Å
1021	G	42.7	Very low	53.6	Low	60 Å²	60	127.4 Å²	127.4	62%	0.619	68%	0.68	S	S	*	*			trans	-144.2	88.2	176.6	0	0	0	0	0	112.5
1022	E	42.9	Very low	51.2	Low	197 Å²	197	128.9 Å²	128.9	92%	0.921	69%	0.692	S	S	*	*			trans	-135.1	91.6	161.9	-73.5	-167.6	147.3	0	0	108.8
1023	D	42.9	Very low	49.4	Very low	161 Å²	161	134.2 Å²	134.2	86%	0.861	72%	0.717	S	S	*	*			trans	8.8	138.7	159.9	-50.8	-30.2	0	0	0	122.7
1024	D	36.4	Very low	47.2	Very low	156 Å²	156	134.8 Å²	134.8	83%	0.834	74%	0.736	S	S	*	*			trans	-72.5	141.5	167.4	-56.6	-80.2	0	0	0	113.1
1025	H	43.1	Very low	44.9	Very low	186 Å²	186	138.4 Å²	138.4	86%	0.861	75%	0.751	S	S	*	*			trans	-166.2	166.9	146.7	-103.9	-42.8	0	0	0	113.7
1026	D	39.1	Very low	42.7	Very low	130 Å²	130	141.2 Å²	141.2	70%	0.695	76%	0.761	S	S	*	*			trans	-110.5	150.4	-144.6	-49.8	-101	0	0	0	117.5
1027	S	36.4	Very low	40.5	Very low	116 Å²	116	142.4 Å²	142.4	81%	0.811	78%	0.778	S	S	*	*			trans	67	146.1	148.2	72.5	0	0	0	0	119
1028	E	35.7	Very low	38.2	Very low	178 Å²	178	142.7 Å²	142.7	83%	0.832	79%	0.789	S	S	*	*			cis	-139.7	159	17.9	-73.9	-171.7	114.6	0	0	114.8
1029	S	32	Very low	36.1	Very low	102 Å²	102	142.2 Å²	142.2	71%	0.713	79%	0.793	S	S	*	*			trans	33.3	115	151.9	67.9	0	0	0	0	122.7
1030	I	32.6	Very low	34.4	Very low	164 Å²	164	149.5 Å²	149.5	84%	0.841	80%	0.803	S	S	*	*				-166.9	140.3	113.2	-98.7	158	0	0	0	109.1
1031	P	31.4	Very low	33.2	Very low	111 Å²	111	150.2 Å²	150.2	72%	0.721	80%	0.804	S	S	*	*			trans	-98.4	141.4	-158.7	35.7	-36.2	0	0	0	117.6
1032	N	26.3	Very low	32.6	Very low	162 Å²	162	155.2 Å²	155.2	87%	0.866	81%	0.811	S	S	*	*			trans	43.5	103	145.4	-67	-17.1	0	0	0	120.1
1033	K	31.3	Very low	32	Very low	202 Å²	202	151.6 Å²	151.6	88%	0.878	80%	0.798	S	S	*	*			trans	-142.9	152.8	141.3	-107.3	170.8	-172.7	174.3	0	110.7
1034	S	27.3	Very low	31.6	Very low	108 Å²	108	151.1 Å²	151.1	76%	0.755	80%	0.796	S	S	*	*			trans	-76.7	132.1	-167.9	52.5	0	0	0	0	114.2	H1036	S1034-H1036 PolarHBondContact O-N 2.8Å
1035	Y	27.1	Very low	31.5	Very low	235 Å²	235	148.6 Å²	148.6	92%	0.922	79%	0.786	S	S	*	*			trans	-86.7	104	168.8	-85.1	-85.4	0	0	0	112.1
1036	H	30.8	Very low	30.9	Very low	170 Å²	170	150.8 Å²	150.8	79%	0.787	79%	0.787	S	S	*	*			trans	-115.8	140.2	156	-95.3	-66	0	0	0	109.3	S1034 T1038	S1034-H1036 PolarHBondContact O-N 2.8Å; H1036-T1038 PolarHBondContact O-N 3.42Å
1037	S	26.2	Very low	30.6	Very low	121 Å²	121	149.5 Å²	149.5	85%	0.846	79%	0.785	S	S	*	*			trans	-35.2	120.4	178.4	162.9	0	0	0	0	117.1
1038	T	26.4	Very low	30.2	Very low	133 Å²	133	151.1 Å²	151.1	82%	0.816	78%	0.784	S	S	*	*			trans	-153.2	164.8	149.8	9.2	0	0	0	0	113.8	H1036	H1036-T1038 PolarHBondContact O-N 3.42Å
1039	T	26.6	Very low	29.7	Very low	114 Å²	114	151.4 Å²	151.4	70%	0.699	78%	0.783	S	S	*	*			trans	-61.4	152.5	-178.5	44.7	0	0	0	0	116.2
1040	Y	30.3	Very low	29.6	Very low	240 Å²	240	154.4 Å²	154.4	94%	0.941	79%	0.786	S	S	*	*			trans	-95.1	121.1	152.3	-94	-84.8	0	0	0	111
1041	T	29.8	Very low	29.3	Very low	108 Å²	108	153.1 Å²	153.1	66%	0.663	78%	0.776	S	S	*	*			trans	-144.6	178.6	164.5	45	0	0	0	0	107.5
1042	E	31	Very low	29	Very low	166 Å²	166	155.2 Å²	155.2	78%	0.776	78%	0.776	S	S	*	*			trans	75.6	152.5	177.5	-54.6	-152.4	-178.8	0	0	116.4
1043	N	29.3	Very low	28.9	Very low	121 Å²	121	155.2 Å²	155.2	65%	0.647	77%	0.771	S	S	*	*			cis	-162.2	141.7	-25.1	-106.5	-30.8	0	0	0	109.3
1044	N	35.4	Very low	28.6	Very low	150 Å²	150	151.8 Å²	151.8	80%	0.802	76%	0.761	S	S	*	*			trans	176.6	142.9	154.7	-95.7	-31.2	0	0	0	111.5
1045	T	33.5	Very low	28.7	Very low	103 Å²	103	152.3 Å²	152.3	63%	0.632	76%	0.759	S	S	*	*			cis	-166.2	126.2	-39.5	9.5	0	0	0	0	109.3
1046	R	30.6	Very low	28.6	Very low	232 Å²	232	148.1 Å²	148.1	88%	0.875	75%	0.752	S	S	*	*			trans	72	168.9	154.3	-63.9	-170.8	171.6	-155	-1.3	117.1
1047	P	33.5	Very low	28.6	Very low	103 Å²	103	145 Å²	145	67%	0.669	75%	0.75	S	S	*	*				-144.1	-160.4	-89.9	36.9	-11.8	0	0	0	115.5
1048	L	26.6	Very low	28.8	Very low	151 Å²	151	145.5 Å²	145.5	79%	0.791	74%	0.743	S	S	*	*			trans	77.3	135.2	165.9	-57.5	159.1	0	0	0	114.5
1049	K	27	Very low	29.2	Very low	183 Å²	183	145.4 Å²	145.4	80%	0.796	73%	0.733	S	S	*	*			cis	64.9	94.5	49.2	-81.7	-163.1	170	-169	0	114
1050	Q	28.2	Very low	29.7	Very low	166 Å²	166	147 Å²	147	78%	0.776	73%	0.73	S	S	*	*			trans	-173	136.4	133.4	-102.1	171.5	-48.4	0	0	108.6
1051	Q	26.8	Very low	29.9	Very low	137 Å²	137	140.2 Å²	140.2	64%	0.64	72%	0.717	S	S	*	*				59.5	110.7	103.4	-62.3	-170.1	-92.7	0	0	112.5
1052	E	25.5	Very low	30.1	Very low	154 Å²	154	143.4 Å²	143.4	72%	0.72	72%	0.722	S	S	*	*				77.3	136	87.5	-71.3	169.3	134.6	0	0	113.7
1053	E	24	Very low	30.1	Very low	162 Å²	162	143.6 Å²	143.6	76%	0.757	72%	0.721	S	S	*	*			trans	60.6	115.5	151.2	-69.3	-159.1	131.3	0	0	124
1054	I	25.1	Very low	30	Very low	131 Å²	131	144.2 Å²	144.2	67%	0.672	73%	0.729	S	S	*	*			trans	75.7	163.7	131	-52.1	164.9	0	0	0	118
1055	V	28.3	Very low	29.9	Very low	118 Å²	118	141.1 Å²	141.1	72%	0.715	73%	0.725	S	S	*	*			trans	75.3	90.1	173.4	-161.7	0	0	0	0	114.8
1056	L	25.8	Very low	30.1	Very low	147 Å²	147	141 Å²	141	77%	0.77	73%	0.726	S	S	*	*				68.4	140.3	79.1	-86.5	84.3	0	0	0	116.7
1057	S	30.9	Very low	30	Very low	106 Å²	106	138.5 Å²	138.5	74%	0.741	72%	0.724	S	S	*	*			trans	68.2	149.8	167	77.5	0	0	0	0	116.7
1058	N	31.1	Very low	30	Very low	131 Å²	131	140.8 Å²	140.8	70%	0.701	73%	0.731	S	S	*	*			cis	-159.4	155.7	-17	-111.9	28.1	0	0	0	105.6
1059	E	33.8	Very low	30.5	Very low	130 Å²	130	138.5 Å²	138.5	61%	0.607	73%	0.725	S	S	*	*			cis	-160.1	-162.7	-1.1	-131	179.5	135.6	0	0	105.6
1060	K	37.2	Very low	30.5	Very low	149 Å²	149	138 Å²	138	65%	0.648	73%	0.725	S	S	*	*			cis	-158.4	165	6.8	-143.1	150.3	-176.7	116.3	0	109
1061	S	35	Very low	30.6	Very low	96 Å²	96	134.8 Å²	134.8	67%	0.671	72%	0.716	S	S	*	*			trans	55.6	123.3	155.5	-58.2	0	0	0	0	120.7
1062	F	32.9	Very low	30.7	Very low	175 Å²	175	136.7 Å²	136.7	77%	0.768	73%	0.725	S	S	*	*			cis	-149	121.5	-12.5	-117.8	-104.7	0	0	0	104.3
1063	K	32	Very low	30.8	Very low	170 Å²	170	132.9 Å²	132.9	74%	0.739	72%	0.72	S	S	*	*				56.5	133.7	95.1	-75.9	-172.2	176.6	-174.7	0	115.8
1064	T	27.7	Very low	31.2	Very low	134 Å²	134	133.2 Å²	133.2	82%	0.822	73%	0.726	S	S	*	*			cis	-173.7	171.7	-21.5	8.8	0	0	0	0	107.8
1065	A	33.4	Very low	31.5	Very low	86 Å²	86	132.5 Å²	132.5	71%	0.711	73%	0.733	S	S	*	*			trans	-65.8	-177	164.7	0	0	0	0	0	111.9
1066	P	37	Very low	31.8	Very low	100 Å²	100	129.8 Å²	129.8	65%	0.649	73%	0.729	S	S	*	*			cis	-155.3	-174.7	47.8	44.2	-20.9	0	0	0	119.1
1067	E	29.1	Very low	32.2	Very low	180 Å²	180	130.8 Å²	130.8	84%	0.841	73%	0.733	S	S	*	*			trans	64.5	140.9	138.2	-78.4	149.7	-132.1	0	0	126
1068	N	32.1	Very low	32.1	Very low	151 Å²	151	132.8 Å²	132.8	81%	0.807	74%	0.735	S	S	*	*			trans	-29.5	171	143.5	-81.3	-29.2	0	0	0	117.3
1069	P	37.5	Very low	32.3	Very low	103 Å²	103	131.2 Å²	131.2	67%	0.669	73%	0.732	S	S	*	*			cis	-138.5	-166.4	0.6	30.6	-6.1	0	0	0	115.1
1070	H	27.8	Very low	32	Very low	171 Å²	171	129.9 Å²	129.9	79%	0.792	73%	0.733	S	S	*	*			trans	58.5	128.6	138.7	-98.1	-92.1	0	0	0	122.4
1071	V	28.8	Very low	31.6	Very low	99 Å²	99	129.6 Å²	129.6	60%	0.6	74%	0.738	S	S	*	*			trans	74.5	121.1	135.8	157.9	0	0	0	0	119.9
1072	Q	28.9	Very low	31.3	Very low	177 Å²	177	129 Å²	129	83%	0.827	73%	0.734	S	S	*	*			trans	42.9	146.7	133	-46.5	172.9	-0.6	0	0	119.7
1073	A	29.5	Very low	31.1	Very low	74 Å²	74	127 Å²	127	61%	0.612	74%	0.737	S	S	*	*			cis	-165.9	165.4	9.7	0	0	0	0	0	109.9
1074	L	30.4	Very low	31.1	Very low	169 Å²	169	126.3 Å²	126.3	89%	0.885	74%	0.739	S	S	*	*			trans	60	137.6	151.2	-59.9	166.7	0	0	0	117.5
1075	S	32.4	Very low	31.3	Very low	116 Å²	116	125.1 Å²	125.1	81%	0.811	73%	0.734	S	S	*	*			cis	-159.4	158.7	6.7	47.9	0	0	0	0	109.3
1076	G	33.6	Very low	31.8	Very low	62 Å²	62	126.7 Å²	126.7	64%	0.639	74%	0.737	S	S	*	*			cis	176.7	-166.7	-2.9	0	0	0	0	0	111.1
1077	I	34.2	Very low	31.9	Very low	167 Å²	167	127.4 Å²	127.4	86%	0.856	74%	0.741	S	S	*	*			trans	63.6	88.4	165.1	-50.6	176.3	0	0	0	112.5
1078	L	29.1	Very low	32.1	Very low	148 Å²	148	126.7 Å²	126.7	78%	0.775	74%	0.738	S	S	*	*			cis	54.4	144.5	36	-86.6	168.8	0	0	0	113
1079	P	35.7	Very low	32	Very low	99 Å²	99	125.1 Å²	125.1	64%	0.643	73%	0.73	S	S	*	*			cis	-140.2	154.4	6.4	43.4	-25.7	0	0	0	117.4
1080	T	28.3	Very low	31.7	Very low	101 Å²	101	128.8 Å²	128.8	62%	0.62	74%	0.735	S	S	*	*			trans	53.6	152.5	133	66.1	0	0	0	0	124.7
1081	N	29.2	Very low	31.9	Very low	144 Å²	144	127.1 Å²	127.1	77%	0.77	73%	0.726	S	S	*	*			trans	74.2	158.4	139.1	-74	-9.5	0	0	0	120.5
1082	S	28.5	Very low	32.1	Very low	83 Å²	83	127.2 Å²	127.2	58%	0.58	72%	0.723	S	S	*	*			cis	-170.3	138.3	-36.7	53.7	0	0	0	0	111
1083	T	27.7	Very low	32.3	Very low	134 Å²	134	127.4 Å²	127.4	82%	0.822	72%	0.721	S	S	*	*			trans	66.4	175.1	154.7	-46.3	0	0	0	0	116.9
1084	I	31.4	Very low	32.6	Very low	154 Å²	154	129.6 Å²	129.6	79%	0.79	72%	0.723	S	S	*	*			trans	91.6	136.2	169.2	-54.8	-179.7	0	0	0	114.8
1085	P	33.5	Very low	32.7	Very low	109 Å²	109	127.7 Å²	127.7	71%	0.708	71%	0.713	S	S	*	*			trans	-106.3	-175.9	-160	45.2	-35.6	0	0	0	112.8
1086	P	43.5	Very low	32.8	Very low	120 Å²	120	126.6 Å²	126.6	78%	0.779	71%	0.706	S	S	*	*			trans	-92.6	156.7	-160.8	36.9	-35.4	0	0	0	115.1
1087	P	38.2	Very low	32.9	Very low	114 Å²	114	130.1 Å²	130.1	74%	0.74	71%	0.709	S	S	*	*			trans	-102	149.4	132.1	31.9	-20.5	0	0	0	109.5
1088	E	32.9	Very low	32.9	Very low	166 Å²	166	128.1 Å²	128.1	78%	0.776	70%	0.7	S	S	*	*				68.1	130.1	51.8	-87.9	-161.1	-150	0	0	116
1089	N	30.8	Very low	33.2	Very low	118 Å²	118	129.1 Å²	129.1	63%	0.631	70%	0.698	S	S	*	*			trans	76.7	123.7	152.2	-67.7	-40.6	0	0	0	121.6
1090	F	31.3	Very low	33.2	Very low	179 Å²	179	130.6 Å²	130.6	79%	0.785	71%	0.705	S	S	*	*			trans	72.4	154.2	147.1	-78.2	-128.1	0	0	0	118.3
1091	K	31.9	Very low	33.8	Very low	137 Å²	137	130.5 Å²	130.5	60%	0.596	71%	0.706	S	S	*	*			cis	-177.6	158.2	-36.8	-128.8	172.9	144.8	-77.7	0	109.3
1092	D	32.9	Very low	33.9	Very low	100 Å²	100	129.2 Å²	129.2	54%	0.535	71%	0.707	S	S	.	*			trans	67.9	156.3	154.2	-53	-31	0	0	0	118.9
1093	F	34.1	Very low	34	Very low	182 Å²	182	131.4 Å²	131.4	80%	0.798	71%	0.712	S	S	*	*			trans	70.6	127.7	170.1	-53.1	-67.4	0	0	0	118.3
1094	D	36	Very low	34.3	Very low	119 Å²	119	130.9 Å²	130.9	64%	0.636	71%	0.709	S	S	*	*			cis	-159.9	170.7	-7.9	-145.9	5.6	0	0	0	115.5
1095	N	32	Very low	34.2	Very low	129 Å²	129	131.6 Å²	131.6	69%	0.69	71%	0.709	S	S	*	*			trans	19.9	143.2	146.7	-78	-45.5	0	0	0	120.9
1096	S	33.7	Very low	34.2	Very low	94 Å²	94	133.3 Å²	133.3	66%	0.657	71%	0.711	S	S	*	*			cis	-173.9	175.2	4.4	42.5	0	0	0	0	108
1097	I	36.2	Very low	33.5	Very low	135 Å²	135	134 Å²	134	69%	0.692	71%	0.707	S	S	*	*				179.9	134.8	65.8	-74.7	-172.5	0	0	0	109.4
1098	N	34.4	Very low	33.4	Very low	126 Å²	126	135.8 Å²	135.8	67%	0.674	71%	0.709	S	S	*	*			trans	53.8	164.5	159.2	-62.4	-29.3	0	0	0	121.2
1099	K	34.3	Very low	33.1	Very low	169 Å²	169	134.2 Å²	134.2	74%	0.735	71%	0.706	S	S	*	*			cis	-164.2	134.2	-32.4	-96.5	166.6	-177.1	172.8	0	104.9
1100	V	37.6	Very low	33.5	Very low	130 Å²	130	136.2 Å²	136.2	79%	0.788	72%	0.717	S	S	*	*			cis	76.8	129.5	46	175.5	0	0	0	0	113
1101	P	39.1	Very low	33.5	Very low	98 Å²	98	136.4 Å²	136.4	64%	0.636	72%	0.718	S	S	*	*			cis	-144	-164.9	-28.9	42.5	-22.2	0	0	0	114.1
1102	C	32.3	Very low	33.6	Very low	118 Å²	118	136.7 Å²	136.7	80%	0.797	73%	0.73	S	S	*	*			trans	-178.5	111.1	141	-94	0	0	0	0	109.4
1103	N	30.6	Very low	33.4	Very low	129 Å²	129	140.3 Å²	140.3	69%	0.69	74%	0.744	S	S	*	*				73.1	116.7	78	-64.3	21.4	0	0	0	112.1
1104	T	34	Very low	33.5	Very low	122 Å²	122	139.5 Å²	139.5	75%	0.748	75%	0.746	S	S	*	*				-157.2	125.5	67.3	-49.9	0	0	0	0	108.2
1105	E	28.6	Very low	33.5	Very low	170 Å²	170	137.6 Å²	137.6	79%	0.794	75%	0.747	S	S	*	*				50.2	143	90.5	-52.8	-170.5	168.8	0	0	114.7
1106	I	33.3	Very low	33.7	Very low	145 Å²	145	137.4 Å²	137.4	74%	0.744	75%	0.751	S	S	*	*			cis	-139.7	134.2	32.5	-62.3	164.9	0	0	0	108.7
1107	N	28.6	Very low	33.7	Very low	133 Å²	133	142 Å²	142	71%	0.711	76%	0.759	S	S	*	*				42.6	146.8	103.6	-117.1	-16.6	0	0	0	116.2
1108	I	36.3	Very low	33.8	Very low	153 Å²	153	140.6 Å²	140.6	79%	0.785	76%	0.759	S	S	*	*			cis	-139.9	143	46	-70.3	167.8	0	0	0	111.5
1109	N	28.1	Very low	33.9	Very low	133 Å²	133	142.6 Å²	142.6	71%	0.711	76%	0.761	S	S	*	*			trans	-90.4	153.7	163.1	-75.3	-87.8	0	0	0	110.7
1110	D	37.4	Very low	33.8	Very low	160 Å²	160	142.6 Å²	142.6	86%	0.856	76%	0.762	S	S	*	*			trans	-144.6	158.2	140.6	-134.6	-28.8	0	0	0	113.9
1111	K	32.1	Very low	33.8	Very low	183 Å²	183	141.3 Å²	141.3	80%	0.796	76%	0.756	S	S	*	*			trans	-117.4	143.2	-167.7	-55.6	164.1	-177.2	165.2	0	111.6
1112	V	34.2	Very low	33.4	Very low	142 Å²	142	144.2 Å²	144.2	86%	0.861	76%	0.764	S	S	*	*			trans	-147.5	142.5	135.9	169.3	0	0	0	0	108.8
1113	Q	29.2	Very low	33.5	Very low	176 Å²	176	146.4 Å²	146.4	82%	0.822	77%	0.767	S	S	*	*			trans	-107.9	156.8	170.2	-60.1	175.1	-6.6	0	0	109.8
1114	I	35.9	Very low	33.4	Very low	165 Å²	165	148.7 Å²	148.7	85%	0.846	77%	0.773	S	S	*	*			trans	-166.6	136.7	144.3	-102.9	148.2	0	0	0	111.9
1115	A	34.9	Very low	33.3	Very low	80 Å²	80	148 Å²	148	66%	0.661	77%	0.773	S	S	*	*			trans	4.7	154.3	152.3	0	0	0	0	0	122
1116	T	36.7	Very low	33.5	Very low	125 Å²	125	144.6 Å²	144.6	77%	0.767	77%	0.768	S	S	*	*			cis	-165.7	146.2	-3.8	11.7	0	0	0	0	113.3
1117	K	34.6	Very low	33.5	Very low	190 Å²	190	146.6 Å²	146.6	83%	0.826	77%	0.772	S	S	*	*				13.4	164	129.7	-71.8	178.9	-179.8	174	0	121.5
1118	P	38	Very low	33.6	Very low	105 Å²	105	145.4 Å²	145.4	68%	0.682	77%	0.77	S	S	*	*			cis	-148.7	-177.6	-31	42.9	-24.4	0	0	0	116.4
1119	K	35.4	Very low	33.5	Very low	169 Å²	169	147.2 Å²	147.2	74%	0.735	77%	0.772	S	S	*	*			trans	42	151.9	136.9	-72.7	174.8	169	-172.4	0	123
1120	F	33.6	Very low	33.5	Very low	169 Å²	169	146.5 Å²	146.5	74%	0.741	77%	0.772	S	S	*	*			cis	-145.2	-80.3	7.7	-126	-29.4	0	0	0	119
1121	P	36.8	Very low	33.3	Very low	103 Å²	103	146.5 Å²	146.5	67%	0.669	77%	0.771	S	S	*	*			trans	-137.7	153.4	-136.6	43.1	-25.2	0	0	0	121.9
1122	I	31	Very low	33.3	Very low	158 Å²	158	143.5 Å²	143.5	81%	0.81	76%	0.764	S	S	*	*			trans	28.5	131.2	134.8	-41.5	157	0	0	0	121.9
1123	I	34.2	Very low	33.3	Very low	165 Å²	165	145.7 Å²	145.7	85%	0.846	76%	0.762	S	S	*	*				175.1	162.9	125.5	-90.6	171.9	0	0	0	110.6
1124	Q	29.5	Very low	33.5	Very low	177 Å²	177	143.2 Å²	143.2	83%	0.827	76%	0.759	S	S	*	*			trans	-101.9	164.9	-169.8	-61.2	172.1	-88.5	0	0	115.4
1125	S	30.7	Very low	33.2	Very low	107 Å²	107	144.3 Å²	144.3	75%	0.748	76%	0.761	S	S	*	*			trans	94.4	134.9	136.6	74.5	0	0	0	0	122.6
1126	S	33.9	Very low	33.2	Very low	98 Å²	98	144.4 Å²	144.4	69%	0.685	77%	0.77	S	S	*	*			trans	68.9	117	141.8	47	0	0	0	0	124.7
1127	F	32.2	Very low	32.8	Very low	187 Å²	187	143.9 Å²	143.9	82%	0.82	77%	0.771	S	S	*	*				86.6	117.6	126.1	-86.6	-124.3	0	0	0	123.3
1128	T	31.9	Very low	32.8	Very low	109 Å²	109	146.7 Å²	146.7	67%	0.669	78%	0.776	S	S	*	*			trans	94.1	140.9	130.5	52.6	0	0	0	0	124.6
1129	K	33.6	Very low	32.4	Very low	190 Å²	190	148.9 Å²	148.9	83%	0.826	78%	0.782	S	S	*	*			trans	66.6	119	158.7	-69.2	163.5	-177.3	176.7	0	116.6
1130	T	27.9	Very low	32.3	Very low	118 Å²	118	148 Å²	148	72%	0.724	78%	0.784	S	S	*	*			cis	94.3	105.9	39.5	-64.2	0	0	0	0	112.4
1131	L	32.9	Very low	32.2	Very low	160 Å²	160	147.8 Å²	147.8	84%	0.838	79%	0.785	S	S	*	*			trans	169.2	168.3	148	-111.2	89.4	0	0	0	107.3
1132	N	33.2	Very low	31.8	Very low	120 Å²	120	150.8 Å²	150.8	64%	0.642	79%	0.791	S	S	*	*				-168.5	131.8	-60.3	-115.6	-24.5	0	0	0	109.2
1133	K	33.9	Very low	31.8	Very low	189 Å²	189	146.7 Å²	146.7	82%	0.822	79%	0.787	S	S	*	*			trans	62.8	170.5	164.8	-49.9	178.3	179.8	178.4	0	114.2
1134	T	32.6	Very low	31.6	Very low	124 Å²	124	147.5 Å²	147.5	76%	0.761	79%	0.785	S	S	*	*			cis	-139.6	179.1	7.5	-37.6	0	0	0	0	111.4
1135	Q	30.8	Very low	31.6	Very low	188 Å²	188	144.5 Å²	144.5	88%	0.879	78%	0.782	S	S	*	*			trans	-75.2	167	-174.2	-60	152.2	-55.4	0	0	114.6
1136	G	33.5	Very low	31.5	Very low	82 Å²	82	146.5 Å²	146.5	85%	0.845	78%	0.784	S	S	*	*			trans	-175.7	73.2	171.3	0	0	0	0	0	114.2
1137	S	29.7	Very low	31.3	Very low	113 Å²	113	146.4 Å²	146.4	79%	0.79	78%	0.784	S	S	*	*			trans	-91.6	144.3	179.7	-51.9	0	0	0	0	113
1138	R	33.8	Very low	31.1	Very low	249 Å²	249	143.2 Å²	143.2	94%	0.94	78%	0.779	S	S	*	*			trans	-160.8	154.2	147.3	-107.9	161.7	-144.3	-163.8	4.7	111.4
1139	N	28.8	Very low	31	Very low	152 Å²	152	145.4 Å²	145.4	81%	0.813	79%	0.787	S	S	*	*			trans	-100.4	171.2	-175.5	-51	-47.4	0	0	0	110.9
1140	I	33.9	Very low	30.6	Very low	151 Å²	151	139.8 Å²	139.8	77%	0.774	78%	0.775	S	S	*	*				-165.4	121	129.3	-100	152	0	0	0	110.5
1141	E	30.9	Very low	30.6	Very low	163 Å²	163	141.3 Å²	141.3	76%	0.762	78%	0.779	S	S	*	*			trans	41.7	131.8	140.1	-53.7	-177.9	131.5	0	0	121.3
1142	Q	28.7	Very low	30.3	Very low	167 Å²	167	138.9 Å²	138.9	78%	0.78	77%	0.771	S	S	*	*			cis	96.2	143.9	41	-79.2	-157.9	50.9	0	0	115.1
1143	G	32.4	Very low	30	Very low	72 Å²	72	139.8 Å²	139.8	74%	0.742	78%	0.775	S	S	*	*			trans	135.4	71.8	-171.6	0	0	0	0	0	111.2
1144	K	28.9	Very low	29.6	Very low	182 Å²	182	140.7 Å²	140.7	79%	0.791	78%	0.775	S	S	*	*				58.8	100.4	68.7	-79.1	-173.6	176.8	174	0	115.2
1145	C	29.8	Very low	29.3	Very low	114 Å²	114	139.1 Å²	139.1	77%	0.77	77%	0.765	S	S	*	*			trans	-178.3	142.9	130.1	-98.3	0	0	0	0	107.1
1146	N	28.8	Very low	29.1	Very low	148 Å²	148	133.2 Å²	133.2	79%	0.791	74%	0.742	S	S	*	*			cis	67.9	133.4	44.9	-63.2	6	0	0	0	112
1147	S	29	Very low	28.8	Very low	97 Å²	97	132.6 Å²	132.6	68%	0.678	72%	0.719	S	S	*	*			cis	-175	155.1	-2.7	45.6	0	0	0	0	111.8
1148	V	28.4	Very low	28.6	Very low	120 Å²	120	129.8 Å²	129.8	73%	0.727	70%	0.695	S	S	*	*			trans	71.4	140.4	141.9	163	0	0	0	0	119.8
1149	N	29	Very low	28.3	Very low	155 Å²	155	121.6 Å²	121.6	83%	0.829	68%	0.676	S	S	*	*			trans	63.8	162.5	167.6	-69.9	-11.6	0	0	0	117.8
1150	A	25.8	Very low	28.4	Very low	71 Å²	71	119.1 Å²	119.1	59%	0.587	67%	0.669	S	S	*	*			cis	-178.9	176.6	-33.9	0	0	0	0	0	106.4
1151	L	28.4	Very low	28.1	Very low	151 Å²	151	117.3 Å²	117.3	79%	0.791	66%	0.661	S	S	*	*			trans	62.4	98	159.7	-67.9	166	0	0	0	116.1
1152	T	25.6	Very low	28	Very low	109 Å²	109	113 Å²	113	67%	0.669	66%	0.661	S	S	*	*				82.1	155.4	94.1	53.3	0	0	0	0	115.7
1153	N	27.9	Very low	28.2	Very low	138 Å²	138	111.2 Å²	111.2	74%	0.738	66%	0.661	S	S	*	*			trans	80.7	120	177.8	-50.7	-25.5	0	0	0	113.6
1154	Y	24.9	Very low	28.3	Very low	209 Å²	209	115.7 Å²	115.7	82%	0.82	66%	0.663	S	S	*	*				85.2	149.1	53	-97.6	-72.3	0	0	0	113.4
1155	T	26.8	Very low	28.4	Very low	91 Å²	91	116 Å²	116	56%	0.558	66%	0.664	S	S	*	*			trans	66.5	132.9	151.3	44.6	0	0	0	0	118.5
1156	T	26.7	Very low	28.6	Very low	63 Å²	63	114.6 Å²	114.6	39%	0.387	66%	0.66	S	S	.	*			trans	70.8	129.5	132.4	64.8	0	0	0	0	119.1	L765 S766 I767	L765-T1156 VanDerWaalsContact CD2-C 3.41Å; L765-T1156 WeakPolarHBondContact CD2-O 3.3Å; L765-T1156 VanDerWaalsContact CG-C 3.49Å; S766-T1156 VanDerWaalsContact OG-CA 3.25Å; S766-T1156 WeakPolarHBondContact OG-CA 3.34Å; S766-T1156 PolarHBondContact OG-N 3.36Å; I767-T1156 HydrophobicContact CD1-CG2 4.1Å
1157	N	26.4	Very low	28.8	Very low	69 Å²	69	114 Å²	114	37%	0.369	66%	0.657	S	S	.	*			cis	176.9	167.9	13.3	-117.9	7.3	0	0	0	116.3	L765 S766 I767	L765-N1157 CarbonylContact O-C 3.5Å; L765-N1157 WeakPolarHBondContact O-CA 3.34Å; S766-N1157 CarbonylContact O-C 3.59Å; S766-N1157 WeakPolarHBondContact O-CA 3.32Å; S766-N1157 PolarHBondContact O-OD1 2.65Å; S766-N1157 PolarHBondContact OG-OD1 3.5Å; I767-N1157 WeakPolarHBondContact CB-OD1 3.45Å; I767-N1157 WeakPolarHBondContact CD1-OD1 3.17Å; I767-N1157 WeakPolarHBondContact CG1-OD1 3.47Å
1158	I	26.5	Very low	29	Very low	55 Å²	55	114.7 Å²	114.7	28%	0.282	66%	0.657	S	S	.	*			trans	63.3	116.2	132.8	-53.4	-108.9	0	0	0	119.8	S766 I767 Q768	S766-I1158 PolarHBondContact O-N 2.77Å; I767-I1158 HydrophobicContact CB-CD1 3.87Å; I767-I1158 HydrophobicContact CB-CG1 4.23Å; I767-I1158 HydrophobicContact CG2-CD1 3.81Å; Q768-I1158 HydrophobicContact CB-CD1 3.57Å; Q768-I1158 HydrophobicContact CB-CG1 4.48Å; Q768-I1158 HydrophobicContact CB-CG2 4.23Å; Q768-I1158 VanDerWaalsContact CD-CD1 3.47Å; Q768-I1158 HydrophobicContact CG-CD1 3.35Å; Q768-I1158 HydrophobicContact CG-CG2 4.32Å
1159	S	26.2	Very low	29	Very low	76 Å²	76	115.7 Å²	115.7	53%	0.531	66%	0.658	S	S	.	*			trans	41.1	-167.5	142.1	83.6	0	0	0	0	119.9	Q768	Q768-S1159 PolarHBondContact OE1-OG 3.48Å
1160	C	30.9	Very low	29.2	Very low	100 Å²	100	118.2 Å²	118.2	68%	0.676	66%	0.655	S	S	*	*			cis	-147.6	143.3	-1	21.2	0	0	0	0	113.8
1161	N	27.8	Very low	29.4	Very low	114 Å²	114	121.1 Å²	121.1	61%	0.61	66%	0.657	S	S	*	*				37.9	106.4	129.3	-50.1	-7.7	0	0	0	120.4
1162	G	29	Very low	29.7	Very low	73 Å²	73	120.4 Å²	120.4	75%	0.753	65%	0.652	S	S	*	*				71.7	115.5	84.4	0	0	0	0	0	120.7
1163	T	32.2	Very low	29.8	Very low	128 Å²	128	119.6 Å²	119.6	79%	0.785	65%	0.651	S	S	*	*			trans	-152.9	161.8	150.3	63.8	0	0	0	0	107.6
1164	H	35.1	Very low	30	Very low	167 Å²	167	118.9 Å²	118.9	77%	0.773	65%	0.652	S	S	*	*			cis	-112.3	165.4	-15.9	-80.3	-115.9	0	0	0	108.2
1165	K	31.9	Very low	30	Very low	189 Å²	189	116.7 Å²	116.7	82%	0.822	65%	0.647	S	S	*	*			cis	91.1	133.1	15.3	-156	173.3	-172.7	-178.1	0	116.2
1166	A	33.2	Very low	30.1	Very low	84 Å²	84	119.2 Å²	119.2	69%	0.694	65%	0.65	S	S	*	*			trans	70.3	138.2	-173.4	0	0	0	0	0	115
1167	D	33.7	Very low	30.2	Very low	136 Å²	136	123 Å²	123	73%	0.727	66%	0.664	S	S	*	*			cis	-163.7	-177.5	-16.4	-114.1	-56.5	0	0	0	108.1
1168	V	32.7	Very low	30.2	Very low	111 Å²	111	125.8 Å²	125.8	67%	0.673	68%	0.679	S	S	*	*			cis	-149.6	133.8	8.4	101.4	0	0	0	0	106.6
1169	L	29.1	Very low	30.2	Very low	141 Å²	141	129.3 Å²	129.3	74%	0.738	70%	0.698	S	S	*	*				47.7	148.4	102.7	-65.3	172.4	0	0	0	119.1
1170	R	31.4	Very low	30.3	Very low	207 Å²	207	132.5 Å²	132.5	78%	0.781	71%	0.714	S	S	*	*			trans	77.9	148.3	173.4	-59.4	-160.2	-114.9	-173.7	-0.8	116.4
1171	E	32	Very low	30.3	Very low	133 Å²	133	133.8 Å²	133.8	62%	0.621	72%	0.719	S	S	*	*			cis	-152.2	150.6	-4.6	-120.8	154.4	-176.9	0	0	112
1172	I	33.4	Very low	30.2	Very low	135 Å²	135	135.4 Å²	135.4	69%	0.692	72%	0.723	S	S	*	*				26.7	108.7	125.9	-62.6	179.4	0	0	0	115.2
1173	S	29	Very low	30.2	Very low	92 Å²	92	137.1 Å²	137.1	64%	0.643	72%	0.723	S	S	*	*				65.1	144.3	68.8	89.9	0	0	0	0	115.3
1174	T	30.7	Very low	30	Very low	124 Å²	124	138 Å²	138	76%	0.761	72%	0.716	S	S	*	*			trans	69	156.6	-171.6	84.6	0	0	0	0	114.7
1175	F	26.1	Very low	29.7	Very low	163 Å²	163	138 Å²	138	72%	0.715	72%	0.719	S	S	*	*			cis	-153.7	145.4	-18	-134.7	-143.9	0	0	0	110.8
1176	K	29.2	Very low	29.5	Very low	143 Å²	143	136.1 Å²	136.1	62%	0.622	72%	0.717	S	S	*	*			trans	44.4	153.8	136.3	-78.5	-164.4	-172.5	178.8	0	124.7
1177	Q	27.7	Very low	29.3	Very low	144 Å²	144	137.7 Å²	137.7	67%	0.673	72%	0.724	S	S	*	*			trans	78.4	117.5	144.7	-78.8	165.7	-37.4	0	0	116.9
1178	N	26.4	Very low	29.1	Very low	127 Å²	127	134.2 Å²	134.2	68%	0.679	72%	0.719	S	S	*	*				93.1	147.2	90.6	-76.9	17.6	0	0	0	110.9
1179	N	26	Very low	29	Very low	129 Å²	129	138 Å²	138	69%	0.69	73%	0.727	S	S	*	*			cis	-154.8	178.6	1.9	-103.2	-13.4	0	0	0	108.2
1180	V	28.4	Very low	28.8	Very low	143 Å²	143	136.4 Å²	136.4	87%	0.867	73%	0.728	S	S	*	*			trans	60	156.8	170.4	-98.4	0	0	0	0	115.9
1181	T	31.6	Very low	28.8	Very low	127 Å²	127	134.3 Å²	134.3	78%	0.779	73%	0.73	S	S	*	*			cis	-123.6	154.3	4.6	46	0	0	0	0	113.9
1182	E	24.8	Very low	28.9	Very low	148 Å²	148	131.1 Å²	131.1	69%	0.692	73%	0.733	S	S	*	*			trans	-67.1	148.1	160.3	-46.4	173.7	116.1	0	0	112.6	K1184	E1182-K1184 WeakPolarHBondContact OE1-CE 3.36Å; E1182-K1184 IonicContact OE1-NZ 2.63Å; E1182-K1184 PolarHBondContact OE1-NZ 3.06Å; E1182-K1184 IonicContact OE2-NZ 3.35Å; E1182-K1184 PolarHBondContact OE2-NZ 3.49Å
1183	S	30.2	Very low	28.6	Very low	109 Å²	109	135.3 Å²	135.3	76%	0.762	74%	0.742	S	S	*	*			trans	-165.6	115.1	133.7	59	0	0	0	0	107.5
1184	K	27.9	Very low	29.2	Very low	146 Å²	146	136.5 Å²	136.5	64%	0.635	75%	0.747	S	S	*	*				51.9	113.7	64.6	-58.5	170.4	-179.6	163.5	0	108.9	E1182	E1182-K1184 WeakPolarHBondContact OE1-CE 3.36Å; E1182-K1184 IonicContact OE1-NZ 2.63Å; E1182-K1184 PolarHBondContact OE1-NZ 3.06Å; E1182-K1184 IonicContact OE2-NZ 3.35Å; E1182-K1184 PolarHBondContact OE2-NZ 3.49Å
1185	M	28.4	Very low	29.2	Very low	167 Å²	167	141.7 Å²	141.7	82%	0.823	75%	0.753	S	S	*	*			cis	-137.3	151.3	39.4	-76.7	-171.7	179.6	0	0	112.9
1186	N	27.5	Very low	29.6	Very low	149 Å²	149	138.3 Å²	138.3	80%	0.797	75%	0.749	S	S	*	*				40.4	136	95.5	-49	-27.3	0	0	0	114.4
1187	S	29.6	Very low	29.9	Very low	118 Å²	118	136.8 Å²	136.8	83%	0.825	75%	0.752	S	S	*	*			cis	-155.1	163.5	5.2	41.2	0	0	0	0	108.8
1188	G	28.7	Very low	30.5	Very low	62 Å²	62	135.9 Å²	135.9	64%	0.639	76%	0.757	S	S	*	*			cis	105.5	139.8	20.7	0	0	0	0	0	110.5
1189	K	30.3	Very low	31.1	Very low	191 Å²	191	135.3 Å²	135.3	83%	0.83	76%	0.76	S	S	*	*			trans	75.1	119	-159.3	-55.3	175.9	-178.9	176.9	0	111.7
1190	S	26	Very low	31.5	Very low	108 Å²	108	134.6 Å²	134.6	76%	0.755	77%	0.765	S	S	*	*			cis	69.1	163.7	16.7	104.4	0	0	0	0	115.4
1191	I	31.2	Very low	31.7	Very low	163 Å²	163	132.7 Å²	132.7	84%	0.836	76%	0.758	S	S	*	*			trans	80.1	122.8	-156.9	-50.1	160.1	0	0	0	110.9
1192	G	33.6	Very low	31.8	Very low	66 Å²	66	133.9 Å²	133.9	68%	0.68	76%	0.759	S	S	*	*			cis	-168.1	160.5	-3.4	0	0	0	0	0	115.1
1193	Y	27	Very low	32.1	Very low	223 Å²	223	135.6 Å²	135.6	88%	0.875	77%	0.767	S	S	*	*			trans	-66.4	157	169.8	-58.1	-90.4	0	0	0	111
1194	P	40.9	Very low	32.1	Very low	117 Å²	117	135.1 Å²	135.1	76%	0.76	76%	0.763	S	S	*	*				-122.3	158.9	68.3	38.2	-27.6	0	0	0	112.8
1195	R	31.6	Very low	32	Very low	232 Å²	232	133.3 Å²	133.3	88%	0.875	77%	0.769	S	S	*	*				60.7	134.7	56.5	-92.7	-178.8	174.9	-178.3	-2	112.2
1196	S	34.9	Very low	32.4	Very low	92 Å²	92	130 Å²	130	64%	0.643	76%	0.76	S	S	*	*			cis	-156.8	176.5	9.9	57.6	0	0	0	0	113.4
1197	T	34.7	Very low	32.5	Very low	111 Å²	111	132.8 Å²	132.8	68%	0.681	76%	0.761	S	S	*	*			trans	57.9	104.1	152.3	44.5	0	0	0	0	118.2
1198	T	40.2	Very low	32.3	Very low	126 Å²	126	136 Å²	136	77%	0.773	76%	0.76	S	S	*	*				65	147.5	56.4	74	0	0	0	0	115.7
1199	P	39.1	Very low	32.4	Very low	115 Å²	115	140.4 Å²	140.4	75%	0.747	77%	0.767	S	S	*	*			cis	-124.5	158.7	-19.2	38.3	-23.5	0	0	0	112.8
1200	S	34.1	Very low	32.3	Very low	114 Å²	114	136.3 Å²	136.3	80%	0.797	76%	0.763	S	S	*	*				146.5	155.9	98.3	57.8	0	0	0	0	107.6
1201	S	33.8	Very low	32.6	Very low	102 Å²	102	140.4 Å²	140.4	71%	0.713	77%	0.77	S	S	*	*			cis	-145.4	145.9	-1.5	50	0	0	0	0	112.3
1202	L	32.7	Very low	32.8	Very low	153 Å²	153	138.2 Å²	138.2	80%	0.801	76%	0.764	S	S	*	*			trans	62.3	97.3	152.9	-61.8	170.3	0	0	0	121.4
1203	H	31.8	Very low	32.9	Very low	184 Å²	184	140.6 Å²	140.6	85%	0.852	77%	0.768	S	S	*	*			trans	60.4	106.3	135.5	-81.1	-71.5	0	0	0	122.3
1204	S	29.1	Very low	33.2	Very low	98 Å²	98	138.6 Å²	138.6	69%	0.685	76%	0.763	S	S	*	*			trans	-99.8	161.6	152.3	53.2	0	0	0	0	111.9
1205	S	27.7	Very low	33	Very low	109 Å²	109	139.4 Å²	139.4	76%	0.762	76%	0.76	S	S	*	*			trans	68.8	165	147.9	-76.8	0	0	0	0	120
1206	P	36.5	Very low	33	Very low	98 Å²	98	135.8 Å²	135.8	64%	0.636	76%	0.755	S	S	*	*			cis	-143.8	-179.6	-34.7	39.7	-22.9	0	0	0	115.8
1207	Y	28.4	Very low	32.8	Very low	207 Å²	207	137.5 Å²	137.5	81%	0.812	75%	0.748	S	S	*	*			trans	70.5	139.6	146.6	-81.7	-58.3	0	0	0	122.9
1208	F	26.8	Very low	32.9	Very low	186 Å²	186	137.8 Å²	137.8	82%	0.816	75%	0.754	S	S	*	*			trans	51.4	108.8	158.4	-78.8	-77.7	0	0	0	120.2
1209	I	29.1	Very low	32.6	Very low	153 Å²	153	136.3 Å²	136.3	79%	0.785	75%	0.745	S	S	*	*				-158.9	150.5	129.1	-102.2	151.2	0	0	0	108.7	E1211	I1209-E1211 PolarHBondContact O-N 3.27Å
1210	S	30	Very low	32.1	Very low	106 Å²	106	144 Å²	144	74%	0.741	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-58.5	127.9	-177.2	56.1	0	0	0	0	113.4	V1212	S1210-V1212 PolarHBondContact O-N 3.47Å
1211	E	30.6	Very low	32.1	Very low	193 Å²	193	145.5 Å²	145.5	90%	0.902	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-75.1	120.6	-180	-63.1	-166.3	132.9	0	0	112.7	I1209	I1209-E1211 PolarHBondContact O-N 3.27Å
1212	V	35.9	Very low	32	Very low	118 Å²	118	147.7 Å²	147.7	72%	0.715	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-95.7	133.2	158.3	177.1	0	0	0	0	106.7	S1210 K1214	S1210-V1212 PolarHBondContact O-N 3.47Å; V1212-K1214 PolarHBondContact O-N 3.25Å
1213	P	36.4	Very low	31.9	Very low	115 Å²	115	147.4 Å²	147.4	75%	0.747	77%	0.766	S	S	*	*			trans	-60.6	95.9	-177.8	-26.3	35.8	0	0	0	113.5	I1215	P1213-I1215 PolarHBondContact O-N 3.34Å
1214	K	33.1	Very low	31.9	Very low	181 Å²	181	145.3 Å²	145.3	79%	0.787	76%	0.761	S	S	*	*			trans	-73.8	90.7	169.9	-73.8	-177.7	178.5	176.6	0	109.5	V1212 M1216	V1212-K1214 PolarHBondContact O-N 3.25Å; K1214-M1216 HydrophobicContact CB-CG 4.38Å; K1214-M1216 PolarHBondContact O-N 2.68Å
1215	I	37.1	Very low	32.1	Very low	135 Å²	135	148.3 Å²	148.3	69%	0.692	77%	0.765	S	S	*	*			trans	-73.7	78.8	166.1	-54.5	-179.7	0	0	0	108.3	P1213	P1213-I1215 PolarHBondContact O-N 3.34Å
1216	M	32	Very low	32.4	Very low	156 Å²	156	150.9 Å²	150.9	77%	0.768	77%	0.765	S	S	*	*			trans	-68.7	140.2	169.2	-65.6	-167.1	-57.8	0	0	109.8	K1214 S1218	K1214-M1216 HydrophobicContact CB-CG 4.38Å; K1214-M1216 PolarHBondContact O-N 2.68Å; M1216-S1218 PolarHBondContact O-N 2.97Å
1217	W	30.6	Very low	32.1	Very low	128 Å²	128	154.6 Å²	154.6	49%	0.485	78%	0.775	S	S	.	*			trans	-81.6	114.9	171.7	-69	-1.9	0	0	0	109.9	V358 P359	V358-W1217 HydrophobicContact CG1-CE3 4.35Å; V358-W1217 HydrophobicContact CG1-CH2 3.66Å; V358-W1217 HydrophobicContact CG1-CZ3 3.4Å; V358-W1217 VanDerWaalsContact CG1-CZ3 3.4Å; P359-W1217 VanDerWaalsContact O-CH2 3.24Å; P359-W1217 WeakPolarHBondContact O-CH2 3.07Å
1218	S	36.4	Very low	32.4	Very low	116 Å²	116	150.6 Å²	150.6	81%	0.811	77%	0.772	S	S	*	*			trans	-99.2	105.8	163.2	179.8	0	0	0	0	108.5	M1216	M1216-S1218 PolarHBondContact O-N 2.97Å
1219	T	33.1	Very low	32.8	Very low	96 Å²	96	147.7 Å²	147.7	59%	0.589	77%	0.768	S	S	*	*			trans	-92.2	115.9	165.8	46.1	0	0	0	0	109.4
1220	K	30	Very low	33.2	Very low	275 Å²	275	147.2 Å²	147.2	100%	1.196	77%	0.767	S	S	*	*			trans	-91	0	138.6	-83.3	-168.5	171.2	-171.4	0	108.6

Retrieved 1,220 of 1,220 residues in 2024.8 ms (Link to these results)

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