A0A5K4FB32_SCHMA Loading...

Ras-GEF domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FB32, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,132 aa.

						>A0A5K4FB32_SCHMA|A0A5K4FB32
MALVNKIQPSQSVPPTRHPGKLKRVGSLVELFDFFVLNEGKVIDTVSVNTFLYTYRLFADMELVLEVVNKKFWDTCLSSLIPTSWKVGIISSFLYFLGAWLQQPHVKDFDSPQKIIHLKCLVRILAGWFDVFQPSYNQDSHNYILNEFMRCCGNNVFSKNQDATRIVLCNIDSEVWDRVTAEMEYLCRQAINCLKIIACKHQIDLNPEKKLPSVRIITINRASCHHSSHNPAMHKSEKHFKEIITITPSINPLINLWNLNLDTVAEQLTVADQRLFLDMELNDCLIYARGKPAPSVQATIDQYNKLYHLVQSSMFNSDQDFPILVEPTPIYSRRFNKRGNYNSPATRVSPQIITIWSKSSPNHNSSASDVGKLKTGCIITWIDIAYRLRQTRNYSALKAIIMALQSTPVLRLWHSWNVLEYHYHEHFMKFKYLASVVSFDNNQEQLRKRLDKCANKMYWYLKLNNPNPLCGDISRPGDISQFEDSDAEYSRRTKYSTSPNQSSYLSGVIPYLGVFLSDLTLLHHSSPDYISRSKYSPSNKNKQEIITNNQKSALPSTNTTTITDNNINDDINSSVISAINNTNYFSKQSVKNPYGIIKLLHISDQLGNFTRSTPDLSVVVASSSTVQSDNNSTKQSWKLLKNVSNTNASPVKPSVSADRNDNIQLNGRVKKEKFGLSRRHSTIDSTDDKLINLDKHRREFKILANIFLLQQNAQFYSLRPEPDFSTWFHSYPLISENEALNRSCDLEPADEQMQQHVNRPFRRFSIDLSAVKPASPYTFDTSDSSGAVDIINTNKPRHQRNDTNIHVERSKYAITRPPSATPIYATTTTTTSIMRNPNTHISNISSSTSGSLSRNNKSRINGTYSSSDLLDDIKYNRSTTTDELITGNTLDISNQQNNHKHNMKTSTSRWTTHKSSSTTFDTRNDYNSNLSITVSLHHTNSQHDGRVSPFIAKVAHLGSLSHGSHGHNDNHFSHSKQTQPIIQLSVSPVDSVSDVLSKALKLFGCADQKVDNYDLIHVHKDARDITLPKHFNFYESINYSSFNLSNNKHYELLEFICTPTIHNENNNDNNNSLNSSPSSSSTTAAYIKANNNTNYHGKKHNPKPNMTTTEYTKQYKLTSKSSNKHCTVELWS
					

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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	27.6	Very low	29.6	Very low	238 Å²	238	154.4 Å²	154.4	100%	1.172	83%	0.83	S	S	*	*				0	120.8	0	-62.9	167.3	173.7	0	0	107.8
2	A	32	Very low	29.5	Very low	98 Å²	98	150.8 Å²	150.8	81%	0.81	83%	0.825	S	S	*	*			cis	-143.4	114.3	-26.6	0	0	0	0	0	104.8
3	L	25.2	Very low	29.3	Very low	151 Å²	151	149.8 Å²	149.8	79%	0.791	83%	0.826	S	S	*	*			cis	70.5	88.5	42.6	-152.7	171.6	0	0	0	112
4	V	32.9	Very low	29.3	Very low	122 Å²	122	146.4 Å²	146.4	74%	0.739	81%	0.814	S	S	*	*			trans	-160.3	127.5	139	139.5	0	0	0	0	109
5	N	34.5	Very low	29.2	Very low	132 Å²	132	144.7 Å²	144.7	71%	0.706	81%	0.813	S	S	*	*			trans	18.7	122.6	155.2	-46	-21.2	0	0	0	118.4
6	K	28.9	Very low	29	Very low	207 Å²	207	143.3 Å²	143.3	90%	0.9	81%	0.809	S	S	*	*			cis	62.3	78.7	33.3	-158.7	-171.4	-177.1	-177.4	0	114.7
7	I	32	Very low	29	Very low	164 Å²	164	149.2 Å²	149.2	84%	0.841	82%	0.816	S	S	*	*			trans	-146.3	138.8	146.6	-91.3	147.3	0	0	0	107.1
8	Q	28.7	Very low	29	Very low	182 Å²	182	150.2 Å²	150.2	85%	0.85	81%	0.813	S	S	*	*			trans	-129.6	151.5	165.6	-133	-173.9	14.3	0	0	106.7
9	P	30.7	Very low	29.1	Very low	109 Å²	109	149.1 Å²	149.1	71%	0.708	81%	0.814	S	S	*	*				-145	135.8	113.7	34	-18.2	0	0	0	115.2
10	S	24.5	Very low	29.4	Very low	100 Å²	100	144.3 Å²	144.3	70%	0.699	80%	0.801	S	S	*	*			trans	25.1	105.6	146.6	60.2	0	0	0	0	120
11	Q	29.2	Very low	30	Very low	195 Å²	195	146.8 Å²	146.8	91%	0.911	80%	0.804	S	S	*	*			trans	-135.5	157.3	145.9	-73.8	-161.2	-7.8	0	0	111
12	S	27.9	Very low	31	Very low	111 Å²	111	142.1 Å²	142.1	78%	0.776	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-62.8	137.8	-161	52	0	0	0	0	116.6
13	V	26.4	Very low	32.3	Very low	138 Å²	138	143.5 Å²	143.5	84%	0.836	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-77.8	122.5	161.8	179.2	0	0	0	0	109.8
14	P	29.3	Very low	34.7	Very low	102 Å²	102	138.5 Å²	138.5	66%	0.662	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-76	148.1	172.1	31.5	-33.8	0	0	0	111.2	T16	P14-T16 PolarHBondContact O-N 3.49Å
15	P	28	Very low	37.1	Very low	121 Å²	121	133.3 Å²	133.3	79%	0.786	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-74.6	127.3	-170.9	29	-35.1	0	0	0	112.9	R17	P15-R17 PolarHBondContact O-N 3.23Å
16	T	26.9	Very low	39.6	Very low	123 Å²	123	127 Å²	127	76%	0.755	68%	0.676	S	S	*	*			trans	-63.3	100.3	172.2	47.8	0	0	0	0	111.1	P14 H18	P14-T16 PolarHBondContact O-N 3.49Å; T16-H18 PolarHBondContact O-N 3.4Å
17	R	28.9	Very low	42.4	Very low	244 Å²	244	117.5 Å²	117.5	92%	0.921	64%	0.636	S	S	*	*			trans	-70.8	99.6	170.5	-77.8	-175.5	172.6	177	-0.9	109.9	P15	P15-R17 PolarHBondContact O-N 3.23Å
18	H	27.9	Very low	44.9	Very low	166 Å²	166	109.8 Å²	109.8	77%	0.769	60%	0.596	S	S	*	*			trans	-53.3	144.7	163.9	-69.1	-80.1	0	0	0	110.4	T16 G20	T16-H18 PolarHBondContact O-N 3.4Å; H18-G20 PolarHBondContact O-N 3.45Å
19	P	32.2	Very low	47.6	Very low	129 Å²	129	103.5 Å²	103.5	84%	0.838	57%	0.57	S	S	*	*			trans	-76	59.7	179.7	32.9	-36.8	0	0	0	112	K21	P19-K21 PolarHBondContact O-N 3.07Å
20	G	33.4	Very low	50.2	Low	54 Å²	54	100.8 Å²	100.8	56%	0.557	55%	0.548	S	S	*	.			trans	-59.2	132.2	166	0	0	0	0	0	109.3	H18 L22	H18-G20 PolarHBondContact O-N 3.45Å; G20-L22 PolarHBondContact O-N 3Å
21	K	42.2	Very low	53.1	Low	197 Å²	197	96 Å²	96	86%	0.857	52%	0.515	S	S	*	.			trans	-50.9	87.6	-169.2	-69.2	174	177.5	171.4	0	113.6	P19 K23	P19-K21 PolarHBondContact O-N 3.07Å; K21-K23 PolarHBondContact O-N 2.94Å
22	L	48.7	Very low	55.7	Low	140 Å²	140	86.9 Å²	86.9	73%	0.733	47%	0.472	S	S	*	.			trans	-64.2	101.9	164.5	-79.2	157.8	0	0	0	107.2	G20 R24	G20-L22 PolarHBondContact O-N 3Å; L22-R24 PolarHBondContact O-N 3.18Å
23	K	59.1	Low	58.1	Low	127 Å²	127	85.7 Å²	85.7	55%	0.552	46%	0.457	S	S	*	.			trans	-56.5	134.8	170.2	-63.6	176	-177.8	171.3	0	107.4	K21 V25 Y535 D694	K21-K23 PolarHBondContact O-N 2.94Å; K23-V25 VanDerWaalsContact C-N 3.26Å; K23-V25 HydrophobicContact CB-CG2 4.18Å; K23-V25 PolarHBondContact O-N 3.18Å; K23-Y535 HydrophobicContact CB-CE1 4.15Å; K23-Y535 HydrophobicContact CD-CE1 3.96Å; K23-Y535 WeakPolarHBondContact CD-OH 3.42Å; K23-D694 WeakPolarHBondContact CA-OD2 3.4Å
24	R	76.1	Confident	60.5	Low	46 Å²	46	81.5 Å²	81.5	17%	0.174	43%	0.427	C	S	.	.	S	Bend	trans	-76.6	80.1	-169.2	-59.7	-179.2	179.4	-165.2	-4.7	108.9	L22 D44 S47 L693 D694	L22-R24 PolarHBondContact O-N 3.18Å; R24-D44 IonicContact CZ-OD1 3.58Å; R24-D44 IonicContact CZ-OD2 2.74Å; R24-D44 IonicContact NE-OD2 2.71Å; R24-D44 IonicContact NH1-OD1 3.47Å; R24-D44 PolarHBondContact NH1-OD1 3.26Å; R24-D44 IonicContact NH1-OD2 3.35Å; R24-D44 PolarHBondContact NH1-OD2 3.39Å; R24-D44 IonicContact NH2-OD1 2.7Å; R24-D44 PolarHBondContact NH2-OD1 3.11Å; R24-D44 IonicContact NH2-OD2 3.33Å; R24-D44 PolarHBondContact NH2-OD2 3.23Å; R24-S47 WeakPolarHBondContact CD-OG 3.49Å; R24-S47 PolarHBondContact NH1-OG 3.13Å; R24-L693 HydrophobicContact CB-CB 3.9Å; R24-L693 HydrophobicContact CB-CD2 4.26Å; R24-L693 WeakPolarHBondContact O-CA 3.5Å; R24-L693 WeakPolarHBondContact O-CB 3.28Å; R24-L693 PolarHBondContact O-N 3.45Å; R24-D694 PolarHBondContact N-OD2 2.83Å; R24-D694 PolarHBondContact O-N 3.38Å
25	V	84.6	Confident	63	Low	12 Å²	12	77 Å²	77	7%	0.073	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	120.7	-168.3	179.5	0	0	0	0	109.6	K23 F34 I530 Y535 L690 I691	K23-V25 VanDerWaalsContact C-N 3.26Å; K23-V25 HydrophobicContact CB-CG2 4.18Å; K23-V25 PolarHBondContact O-N 3.18Å; V25-F34 WeakPolarHBondContact O-CE2 3.47Å; V25-I530 HydrophobicContact CG1-CD1 4.35Å; V25-I530 HydrophobicContact CG2-CD1 4.11Å; V25-Y535 HydrophobicContact CG1-CD2 4.31Å; V25-Y535 HydrophobicContact CG1-CE2 4.01Å; V25-Y535 HydrophobicContact CG2-CE2 4.45Å; V25-L690 HydrophobicContact CG1-CB 3.5Å; V25-L690 HydrophobicContact CG1-CD1 3.96Å; V25-L690 HydrophobicContact CG1-CG 4.38Å; V25-I691 VanDerWaalsContact CA-O 3.32Å; V25-I691 WeakPolarHBondContact CA-O 3.49Å
26	G	85.5	Confident	65.2	Low	0 Å²	0	72.6 Å²	72.6	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.7	177.5	-178	0	0	0	0	0	114.3	E30 I691	G26-E30 WeakPolarHBondContact CA-OE2 3.29Å; G26-I691 PolarHBondContact N-O 2.78Å; G26-I691 WeakPolarHBondContact O-CB 3.47Å; G26-I691 PolarHBondContact O-N 3.5Å
27	S	87.4	Confident	67.1	Low	8 Å²	8	70 Å²	70	6%	0.056	35%	0.349	C	S	.	.			trans	-65.8	169.6	163.4	76	0	0	0	0	111.3	V29 E30 L31	S27-V29 PolarHBondContact O-N 2.77Å; S27-V29 PolarHBondContact OG-N 3.38Å; S27-E30 PolarHBondContact N-OE2 3.49Å; S27-E30 PolarHBondContact O-N 3.18Å; S27-E30 VanDerWaalsContact O-N 3.15Å; S27-E30 WeakPolarHBondContact OG-CG 3.36Å; S27-E30 PolarHBondContact OG-N 2.97Å; S27-L31 WeakPolarHBondContact O-CG 3.4Å; S27-L31 PolarHBondContact O-N 3.17Å
28	L	85.7	Confident	68.7	Low	1 Å²	1	63.6 Å²	63.6	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-57.1	-36.7	178.2	-178.7	56.6	0	0	0	112.4	F32 F51 A59 L63 V67	L28-F32 HydrophobicContact CD1-CE2 4.04Å; L28-F32 HydrophobicContact CG-CE2 4.44Å; L28-F32 VanDerWaalsContact O-CD2 3.24Å; L28-F32 WeakPolarHBondContact O-CD2 3.45Å; L28-F51 HydrophobicContact CD1-CE2 3.55Å; L28-F51 HydrophobicContact CD1-CZ 3.73Å; L28-A59 HydrophobicContact CD2-CB 4.06Å; L28-L63 HydrophobicContact CD2-CD1 4.38Å; L28-L63 HydrophobicContact CD2-CD2 3.86Å; L28-L63 HydrophobicContact CD2-CG 3.7Å; L28-V67 HydrophobicContact CD2-CB 4.44Å; L28-V67 HydrophobicContact CD2-CG2 3.93Å; L28-V67 HydrophobicContact CG-CG1 4.36Å; L28-V67 HydrophobicContact CG-CG2 4.3Å
29	V	85	Confident	70.4	Confident	50 Å²	50	60.5 Å²	60.5	30%	0.303	32%	0.32	S	S	.	.	H	α-helix	trans	-69.6	-44.9	176.7	-175.5	0	0	0	0	111.6	S27 L31 F32 V67 K71	S27-V29 PolarHBondContact O-N 2.77Å; S27-V29 PolarHBondContact OG-N 3.38Å; V29-L31 VanDerWaalsContact C-N 3.31Å; V29-L31 PolarHBondContact O-N 3.32Å; V29-F32 PolarHBondContact O-N 3.44Å; V29-V67 HydrophobicContact CG2-CG1 4.15Å; V29-K71 HydrophobicContact CG1-CD 4.4Å; V29-K71 PolarHBondContact O-NZ 3.22Å
30	E	84.9	Confident	71.9	Confident	52 Å²	52	54.8 Å²	54.8	24%	0.243	28%	0.284	C	S	.	.	H	α-helix	trans	-64.4	-33.5	178.7	-68.4	165.9	173.1	0	0	111.5	G26 S27 F32 D33 F34 R532	G26-E30 WeakPolarHBondContact CA-OE2 3.29Å; S27-E30 PolarHBondContact N-OE2 3.49Å; S27-E30 PolarHBondContact O-N 3.18Å; S27-E30 VanDerWaalsContact O-N 3.15Å; S27-E30 WeakPolarHBondContact OG-CG 3.36Å; S27-E30 PolarHBondContact OG-N 2.97Å; E30-F32 VanDerWaalsContact C-N 3.33Å; E30-F32 PolarHBondContact O-N 3.21Å; E30-D33 WeakPolarHBondContact O-CB 3.43Å; E30-D33 PolarHBondContact O-N 3.26Å; E30-D33 VanDerWaalsContact O-N 3.11Å; E30-F34 PolarHBondContact O-N 2.73Å; E30-R532 IonicContact OE1-CZ 2.89Å; E30-R532 VanDerWaalsContact OE1-CZ 3.31Å; E30-R532 IonicContact OE1-NH1 3.55Å; E30-R532 PolarHBondContact OE1-NH1 2.89Å; E30-R532 IonicContact OE1-NH2 3.88Å; E30-R532 PolarHBondContact OE1-NH2 3.48Å; E30-R532 IonicContact OE2-CZ 3.07Å; E30-R532 IonicContact OE2-NH1 3.41Å; E30-R532 IonicContact OE2-NH2 3.59Å; E30-R532 PolarHBondContact OE2-NH2 3.15Å
31	L	85.8	Confident	73.4	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-61.4	-38.6	175.4	-71.6	-172.5	0	0	0	112.7	S27 V29 D33 F34 F35 F51 F58 I691 L693	S27-L31 WeakPolarHBondContact O-CG 3.4Å; S27-L31 PolarHBondContact O-N 3.17Å; V29-L31 VanDerWaalsContact C-N 3.31Å; V29-L31 PolarHBondContact O-N 3.32Å; L31-D33 PolarHBondContact O-N 2.99Å; L31-F34 HydrophobicContact CD2-CD2 3.94Å; L31-F34 HydrophobicContact CD2-CE2 4.16Å; L31-F34 PolarHBondContact O-N 2.91Å; L31-F34 VanDerWaalsContact O-N 3.13Å; L31-F35 VanDerWaalsContact O-CD1 3.27Å; L31-F35 WeakPolarHBondContact O-CD1 3.5Å; L31-F35 WeakPolarHBondContact O-CE1 3.46Å; L31-F35 PolarHBondContact O-N 2.91Å; L31-F51 HydrophobicContact CD1-CD2 4.3Å; L31-F51 HydrophobicContact CD1-CE2 4.42Å; L31-F58 HydrophobicContact CD1-CE2 4.39Å; L31-F58 HydrophobicContact CD1-CZ 4.47Å; L31-I691 HydrophobicContact CD1-CB 4.04Å; L31-I691 HydrophobicContact CD1-CD1 3.84Å; L31-I691 HydrophobicContact CD1-CG2 3.96Å; L31-L693 HydrophobicContact CD1-CD1 4.4Å; L31-L693 HydrophobicContact CD2-CB 4.08Å; L31-L693 HydrophobicContact CD2-CD2 4.36Å
32	F	83.5	Confident	74.7	Confident	3 Å²	3	53.1 Å²	53.1	1%	0.013	27%	0.266	C	S	.	.	H	α-helix	trans	-67.3	-22.2	175.9	-78.9	-74.9	0	0	0	112.9	L28 V29 E30 F35 F51 V64 V67 V68 K71 F93 F96	L28-F32 HydrophobicContact CD1-CE2 4.04Å; L28-F32 HydrophobicContact CG-CE2 4.44Å; L28-F32 VanDerWaalsContact O-CD2 3.24Å; L28-F32 WeakPolarHBondContact O-CD2 3.45Å; V29-F32 PolarHBondContact O-N 3.44Å; E30-F32 VanDerWaalsContact C-N 3.33Å; E30-F32 PolarHBondContact O-N 3.21Å; F32-F35 AromaticContact CD1-CD2 3.58Å; F32-F35 HydrophobicContact CD1-CD2 3.58Å; F32-F35 AromaticContact CD1-CE2 3.45Å; F32-F35 HydrophobicContact CD1-CE2 3.45Å; F32-F35 VanDerWaalsContact CD1-CE2 3.45Å; F32-F35 HydrophobicContact CD1-CZ 4.49Å; F32-F35 HydrophobicContact CE1-CD2 4.04Å; F32-F35 AromaticContact CE1-CE2 3.56Å; F32-F35 HydrophobicContact CE1-CE2 3.56Å; F32-F35 HydrophobicContact CG-CD2 4.4Å; F32-F35 HydrophobicContact CG-CE2 4.19Å; F32-F35 HydrophobicContact CZ-CE2 4.37Å; F32-F51 HydrophobicContact CE2-CZ 4.31Å; F32-F51 HydrophobicContact CZ-CE1 4.27Å; F32-F51 HydrophobicContact CZ-CZ 4.06Å; F32-V64 HydrophobicContact CZ-CG1 4.31Å; F32-V67 HydrophobicContact CD2-CG1 3.86Å; F32-V67 HydrophobicContact CE2-CG1 3.9Å; F32-V68 HydrophobicContact CD1-CG2 4.42Å; F32-V68 HydrophobicContact CE1-CG2 3.56Å; F32-V68 HydrophobicContact CE2-CG2 4.02Å; F32-V68 HydrophobicContact CZ-CG2 3.34Å; F32-K71 HydrophobicContact CB-CD 3.88Å; F32-F93 HydrophobicContact CD1-CE1 4.08Å; F32-F96 HydrophobicContact CE1-CD1 4.28Å; F32-F96 HydrophobicContact CE1-CD2 4.1Å; F32-F96 HydrophobicContact CE1-CE1 4.01Å; F32-F96 AromaticContact CE1-CE2 3.8Å; F32-F96 HydrophobicContact CE1-CE2 3.8Å; F32-F96 HydrophobicContact CE1-CG 4.35Å; F32-F96 AromaticContact CE1-CZ 3.77Å; F32-F96 HydrophobicContact CE1-CZ 3.77Å; F32-F96 HydrophobicContact CZ-CE1 4.31Å; F32-F96 HydrophobicContact CZ-CE2 4.29Å; F32-F96 AromaticContact CZ-CZ 3.94Å; F32-F96 HydrophobicContact CZ-CZ 3.94Å
33	D	79.5	Confident	76	Confident	87 Å²	87	48.5 Å²	48.5	47%	0.465	24%	0.242	S	C	.	.	H	α-helix	trans	-70.5	-36.5	171	-62.6	-59.4	0	0	0	111.2	E30 L31 F35 V36 K71	E30-D33 WeakPolarHBondContact O-CB 3.43Å; E30-D33 PolarHBondContact O-N 3.26Å; E30-D33 VanDerWaalsContact O-N 3.11Å; L31-D33 PolarHBondContact O-N 2.99Å; D33-F35 PolarHBondContact O-N 3.44Å; D33-V36 PolarHBondContact O-N 3.16Å; D33-V36 VanDerWaalsContact O-N 3.15Å; D33-K71 VanDerWaalsContact N-NZ 3.2Å; D33-K71 WeakPolarHBondContact OD1-CE 3.31Å; D33-K71 IonicContact OD1-NZ 3.6Å; D33-K71 PolarHBondContact OD1-NZ 3.39Å; D33-K71 IonicContact OD2-NZ 2.72Å; D33-K71 PolarHBondContact OD2-NZ 3.49Å
34	F	77	Confident	77	Confident	49 Å²	49	43 Å²	43	22%	0.215	22%	0.218	C	C	.	.	H	α-helix	trans	-70.1	-14.7	178.5	-55	-41.4	0	0	0	114.1	V25 E30 L31 V36	V25-F34 WeakPolarHBondContact O-CE2 3.47Å; E30-F34 PolarHBondContact O-N 2.73Å; L31-F34 HydrophobicContact CD2-CD2 3.94Å; L31-F34 HydrophobicContact CD2-CE2 4.16Å; L31-F34 PolarHBondContact O-N 2.91Å; L31-F34 VanDerWaalsContact O-N 3.13Å; F34-V36 VanDerWaalsContact C-N 3.26Å
35	F	80.3	Confident	77.3	Confident	7 Å²	7	41.9 Å²	41.9	3%	0.031	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-22.8	173.8	-59.1	-7.2	0	0	0	111.7	L31 F32 D33 I43 D44 V48 F51 F96 L693	L31-F35 VanDerWaalsContact O-CD1 3.27Å; L31-F35 WeakPolarHBondContact O-CD1 3.5Å; L31-F35 WeakPolarHBondContact O-CE1 3.46Å; L31-F35 PolarHBondContact O-N 2.91Å; F32-F35 AromaticContact CD1-CD2 3.58Å; F32-F35 HydrophobicContact CD1-CD2 3.58Å; F32-F35 AromaticContact CD1-CE2 3.45Å; F32-F35 HydrophobicContact CD1-CE2 3.45Å; F32-F35 VanDerWaalsContact CD1-CE2 3.45Å; F32-F35 HydrophobicContact CD1-CZ 4.49Å; F32-F35 HydrophobicContact CE1-CD2 4.04Å; F32-F35 AromaticContact CE1-CE2 3.56Å; F32-F35 HydrophobicContact CE1-CE2 3.56Å; F32-F35 HydrophobicContact CG-CD2 4.4Å; F32-F35 HydrophobicContact CG-CE2 4.19Å; F32-F35 HydrophobicContact CZ-CE2 4.37Å; D33-F35 PolarHBondContact O-N 3.44Å; F35-I43 WeakPolarHBondContact O-CA 3.43Å; F35-D44 PolarHBondContact O-N 3.22Å; F35-V48 HydrophobicContact CB-CG2 4.06Å; F35-V48 HydrophobicContact CD2-CG2 3.98Å; F35-V48 HydrophobicContact CG-CG2 3.94Å; F35-F51 HydrophobicContact CE1-CB 4.18Å; F35-F51 HydrophobicContact CE2-CB 4.32Å; F35-F51 HydrophobicContact CE2-CG 4.23Å; F35-F51 HydrophobicContact CZ-CB 3.53Å; F35-F51 HydrophobicContact CZ-CD1 4.38Å; F35-F51 AromaticContact CZ-CD2 3.72Å; F35-F51 HydrophobicContact CZ-CD2 3.72Å; F35-F51 AromaticContact CZ-CG 3.63Å; F35-F51 HydrophobicContact CZ-CG 3.63Å; F35-F96 HydrophobicContact CD2-CD2 4.25Å; F35-F96 HydrophobicContact CE2-CD2 4.03Å; F35-F96 HydrophobicContact CE2-CE2 4.02Å; F35-L693 HydrophobicContact CE1-CD2 4.3Å
36	V	74.5	Confident	77.2	Confident	30 Å²	30	41.5 Å²	41.5	18%	0.182	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	96.8	-173.8	-170.2	0	0	0	0	109.6	D33 F34 G40 I89	D33-V36 PolarHBondContact O-N 3.16Å; D33-V36 VanDerWaalsContact O-N 3.15Å; F34-V36 VanDerWaalsContact C-N 3.26Å; V36-G40 VanDerWaalsContact CG1-CA 3.45Å; V36-I89 HydrophobicContact CG1-CG1 3.96Å
37	L	66.9	Low	77.2	Confident	67 Å²	67	41.5 Å²	41.5	35%	0.351	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	163.2	177.3	-54.8	-179.2	0	0	0	111.3	E39 G40 K41 V42 D44	L37-E39 VanDerWaalsContact C-N 3.3Å; L37-E39 PolarHBondContact O-N 2.85Å; L37-G40 PolarHBondContact O-N 2.98Å; L37-G40 VanDerWaalsContact O-N 3.15Å; L37-K41 PolarHBondContact O-N 3.49Å; L37-V42 CarbonylContact C-O 3.59Å; L37-V42 WeakPolarHBondContact CA-O 3.24Å; L37-V42 HydrophobicContact CB-CB 4.13Å; L37-V42 HydrophobicContact CB-CG1 4.39Å; L37-V42 WeakPolarHBondContact CB-O 3.47Å; L37-V42 PolarHBondContact N-O 2.92Å; L37-V42 PolarHBondContact O-N 3.16Å; L37-D44 HydrophobicContact CD1-CB 3.88Å; L37-D44 HydrophobicContact CG-CB 4.06Å
38	N	63.5	Low	77.2	Confident	110 Å²	110	41.1 Å²	41.1	59%	0.588	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	48.2	49.2	173.2	-61.4	-10.2	0	0	0	113.3	G40 K41 V42	N38-G40 VanDerWaalsContact C-N 3.27Å; N38-G40 PolarHBondContact O-N 3.14Å; N38-K41 HydrophobicContact CB-CB 4.26Å; N38-K41 VanDerWaalsContact O-CB 3.29Å; N38-K41 WeakPolarHBondContact O-CB 3.37Å; N38-K41 WeakPolarHBondContact O-CD 3.4Å; N38-K41 WeakPolarHBondContact O-CG 3.1Å; N38-K41 PolarHBondContact O-N 3.07Å; N38-K41 VanDerWaalsContact O-N 3.09Å; N38-V42 HydrophobicContact CB-CB 4.36Å; N38-V42 HydrophobicContact CB-CG2 4.17Å
39	E	63	Low	77.3	Confident	102 Å²	102	41.9 Å²	41.9	48%	0.477	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	60.4	30.4	175.5	-47.6	175.1	159.3	0	0	114.5	L37 K41 W85	L37-E39 VanDerWaalsContact C-N 3.3Å; L37-E39 PolarHBondContact O-N 2.85Å; E39-K41 IonicContact OE2-NZ 3.45Å; E39-K41 PolarHBondContact OE2-NZ 3.05Å; E39-W85 HydrophobicContact CB-CD2 4.02Å; E39-W85 HydrophobicContact CB-CG 4.09Å; E39-W85 HydrophobicContact CB-CZ2 4.14Å; E39-W85 VanDerWaalsContact CD-CZ2 3.44Å; E39-W85 HydrophobicContact CG-CZ2 3.8Å; E39-W85 WeakPolarHBondContact O-CA 3.45Å; E39-W85 WeakPolarHBondContact OE1-CZ2 3.49Å; E39-W85 PolarHBondContact OE2-NE1 3.39Å; E39-W85 VanDerWaalsContact OE2-NE1 3.13Å
40	G	63.5	Low	77.6	Confident	8 Å²	8	39.5 Å²	39.5	8%	0.082	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	102.5	-11.8	-176.1	0	0	0	0	0	114.6	V36 L37 N38 G88	V36-G40 VanDerWaalsContact CG1-CA 3.45Å; L37-G40 PolarHBondContact O-N 2.98Å; L37-G40 VanDerWaalsContact O-N 3.15Å; N38-G40 VanDerWaalsContact C-N 3.27Å; N38-G40 PolarHBondContact O-N 3.14Å; G40-G88 CarbonylContact O-C 3.52Å; G40-G88 WeakPolarHBondContact O-CA 3.38Å
41	K	65.7	Low	77.9	Confident	154 Å²	154	37 Å²	37	67%	0.67	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-16.5	-171	-62.7	166.2	-176.2	152.7	0	114.4	L37 N38 E39	L37-K41 PolarHBondContact O-N 3.49Å; N38-K41 HydrophobicContact CB-CB 4.26Å; N38-K41 VanDerWaalsContact O-CB 3.29Å; N38-K41 WeakPolarHBondContact O-CB 3.37Å; N38-K41 WeakPolarHBondContact O-CD 3.4Å; N38-K41 WeakPolarHBondContact O-CG 3.1Å; N38-K41 PolarHBondContact O-N 3.07Å; N38-K41 VanDerWaalsContact O-N 3.09Å; E39-K41 IonicContact OE2-NZ 3.45Å; E39-K41 PolarHBondContact OE2-NZ 3.05Å
42	V	69.1	Low	78.2	Confident	63 Å²	63	37.1 Å²	37.1	38%	0.382	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	133	-176.5	177.5	0	0	0	0	110.1	L37 N38	L37-V42 CarbonylContact C-O 3.59Å; L37-V42 WeakPolarHBondContact CA-O 3.24Å; L37-V42 HydrophobicContact CB-CB 4.13Å; L37-V42 HydrophobicContact CB-CG1 4.39Å; L37-V42 WeakPolarHBondContact CB-O 3.47Å; L37-V42 PolarHBondContact N-O 2.92Å; L37-V42 PolarHBondContact O-N 3.16Å; N38-V42 HydrophobicContact CB-CB 4.36Å; N38-V42 HydrophobicContact CB-CG2 4.17Å
43	I	75.8	Confident	78.6	Confident	43 Å²	43	37.9 Å²	37.9	22%	0.221	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	131.1	177.6	-59.3	164.6	0	0	0	109.3	F35 T45 V48 S92 Y95	F35-I43 WeakPolarHBondContact O-CA 3.43Å; I43-T45 VanDerWaalsContact C-N 3.27Å; I43-T45 PolarHBondContact O-N 3.09Å; I43-V48 HydrophobicContact CG2-CG2 4.01Å; I43-S92 WeakPolarHBondContact CG1-OG 3.36Å; I43-Y95 HydrophobicContact CD1-CD1 4.14Å; I43-Y95 HydrophobicContact CD1-CD2 4.22Å; I43-Y95 HydrophobicContact CD1-CG 3.75Å; I43-Y95 HydrophobicContact CG2-CD1 3.72Å; I43-Y95 HydrophobicContact CG2-CE1 3.82Å; I43-Y95 HydrophobicContact CG2-CG 4.41Å
44	D	80.7	Confident	79.3	Confident	11 Å²	11	33.8 Å²	33.8	6%	0.059	17%	0.171	C	C	.	.			trans	-77.2	78.4	172.8	-173	-4.3	0	0	0	109.8	R24 F35 L37 V46 S47 V48	R24-D44 IonicContact CZ-OD1 3.58Å; R24-D44 IonicContact CZ-OD2 2.74Å; R24-D44 IonicContact NE-OD2 2.71Å; R24-D44 IonicContact NH1-OD1 3.47Å; R24-D44 PolarHBondContact NH1-OD1 3.26Å; R24-D44 IonicContact NH1-OD2 3.35Å; R24-D44 PolarHBondContact NH1-OD2 3.39Å; R24-D44 IonicContact NH2-OD1 2.7Å; R24-D44 PolarHBondContact NH2-OD1 3.11Å; R24-D44 IonicContact NH2-OD2 3.33Å; R24-D44 PolarHBondContact NH2-OD2 3.23Å; F35-D44 PolarHBondContact O-N 3.22Å; L37-D44 HydrophobicContact CD1-CB 3.88Å; L37-D44 HydrophobicContact CG-CB 4.06Å; D44-V46 PolarHBondContact O-N 2.94Å; D44-V46 VanDerWaalsContact O-N 3.08Å; D44-S47 VanDerWaalsContact CG-CB 3.44Å; D44-S47 WeakPolarHBondContact O-CA 3.36Å; D44-S47 PolarHBondContact O-N 2.82Å; D44-S47 PolarHBondContact OD1-N 2.89Å; D44-S47 VanDerWaalsContact OD1-N 3.1Å; D44-S47 VanDerWaalsContact OD2-CB 3.26Å; D44-S47 WeakPolarHBondContact OD2-CB 3.46Å; D44-S47 PolarHBondContact OD2-OG 3.3Å; D44-V48 PolarHBondContact O-N 2.89Å
45	T	81.5	Confident	80	Confident	23 Å²	23	31.6 Å²	31.6	14%	0.141	16%	0.162	C	C	.	.	H	α-helix	trans	-53.4	-32.2	-177.5	66.9	0	0	0	0	112.1	I43 N49 Y95 D472	I43-T45 VanDerWaalsContact C-N 3.27Å; I43-T45 PolarHBondContact O-N 3.09Å; T45-N49 WeakPolarHBondContact O-CB 3.47Å; T45-N49 PolarHBondContact O-N 3.23Å; T45-N49 PolarHBondContact O-ND2 3.44Å; T45-Y95 WeakPolarHBondContact CB-OH 3.29Å; T45-Y95 HydrophobicContact CG2-CE1 4.39Å; T45-Y95 HydrophobicContact CG2-CE2 4.45Å; T45-Y95 WeakPolarHBondContact CG2-OH 3.42Å; T45-D472 WeakPolarHBondContact CG2-OD2 3.33Å; T45-D472 PolarHBondContact OG1-OD2 3.26Å
46	V	82.2	Confident	80.5	Confident	3 Å²	3	34.6 Å²	34.6	2%	0.018	17%	0.173	C	C	.	.	H	α-helix	trans	-69.2	-39.2	173.8	175.2	0	0	0	0	112.6	D44 T50 S474 P476 I479 R697	D44-V46 PolarHBondContact O-N 2.94Å; D44-V46 VanDerWaalsContact O-N 3.08Å; V46-T50 WeakPolarHBondContact O-CB 3.4Å; V46-T50 PolarHBondContact O-N 3.15Å; V46-T50 PolarHBondContact O-OG1 3.46Å; V46-S474 WeakPolarHBondContact CG2-OG 3.48Å; V46-P476 HydrophobicContact CG1-CB 4.02Å; V46-P476 HydrophobicContact CG1-CG 4.28Å; V46-I479 HydrophobicContact CG2-CD1 4.31Å; V46-R697 HydrophobicContact CG1-CG 4.34Å
47	S	85.8	Confident	81.3	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-70.7	-41.7	173.3	-75.5	0	0	0	0	112.5	R24 D44 T50 F51	R24-S47 WeakPolarHBondContact CD-OG 3.49Å; R24-S47 PolarHBondContact NH1-OG 3.13Å; D44-S47 VanDerWaalsContact CG-CB 3.44Å; D44-S47 WeakPolarHBondContact O-CA 3.36Å; D44-S47 PolarHBondContact O-N 2.82Å; D44-S47 PolarHBondContact OD1-N 2.89Å; D44-S47 VanDerWaalsContact OD1-N 3.1Å; D44-S47 VanDerWaalsContact OD2-CB 3.26Å; D44-S47 WeakPolarHBondContact OD2-CB 3.46Å; D44-S47 PolarHBondContact OD2-OG 3.3Å; S47-T50 PolarHBondContact O-N 3.45Å; S47-F51 WeakPolarHBondContact O-CB 3.17Å; S47-F51 PolarHBondContact O-N 3.41Å
48	V	88	Confident	82.4	Confident	1 Å²	1	32.1 Å²	32.1	1%	0.006	16%	0.158	C	C	.	.	H	α-helix	trans	-57.7	-51.9	175.9	170	0	0	0	0	110.4	F35 I43 D44 T50 F51 L52 Y95 F96 A99	F35-V48 HydrophobicContact CB-CG2 4.06Å; F35-V48 HydrophobicContact CD2-CG2 3.98Å; F35-V48 HydrophobicContact CG-CG2 3.94Å; I43-V48 HydrophobicContact CG2-CG2 4.01Å; D44-V48 PolarHBondContact O-N 2.89Å; V48-T50 PolarHBondContact O-N 2.97Å; V48-F51 PolarHBondContact O-N 2.97Å; V48-L52 HydrophobicContact CG1-CD1 3.9Å; V48-L52 HydrophobicContact CG1-CG 4.48Å; V48-L52 WeakPolarHBondContact O-CG 3.49Å; V48-L52 PolarHBondContact O-N 2.99Å; V48-Y95 HydrophobicContact CB-CE1 4.17Å; V48-Y95 HydrophobicContact CG1-CD1 4.35Å; V48-Y95 HydrophobicContact CG1-CE1 3.89Å; V48-Y95 HydrophobicContact CG2-CD1 4.45Å; V48-Y95 HydrophobicContact CG2-CE1 4.2Å; V48-F96 HydrophobicContact CG1-CD2 3.99Å; V48-A99 HydrophobicContact CG1-CB 4.37Å
49	N	87.9	Confident	83.6	Confident	16 Å²	16	27.4 Å²	27.4	9%	0.086	13%	0.134	C	C	.	.	H	α-helix	trans	-64.4	-40.8	176.6	-72.1	-23.7	0	0	0	111.8	T45 F51 L52 Y53 D472 F700	T45-N49 WeakPolarHBondContact O-CB 3.47Å; T45-N49 PolarHBondContact O-N 3.23Å; T45-N49 PolarHBondContact O-ND2 3.44Å; N49-F51 VanDerWaalsContact C-N 3.27Å; N49-F51 PolarHBondContact O-N 3.29Å; N49-L52 PolarHBondContact O-N 3.44Å; N49-Y53 WeakPolarHBondContact O-CB 3.07Å; N49-Y53 WeakPolarHBondContact O-CD2 3.48Å; N49-Y53 PolarHBondContact O-N 3.06Å; N49-D472 PolarHBondContact ND2-O 3.26Å; N49-D472 VanDerWaalsContact ND2-O 3.09Å; N49-F700 HydrophobicContact CB-CE1 4.07Å; N49-F700 HydrophobicContact CB-CE2 3.86Å; N49-F700 HydrophobicContact CB-CZ 3.49Å; N49-F700 VanDerWaalsContact CB-CZ 3.49Å
50	T	90.4	Very high	84.9	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-56.3	-43	174.7	-64.3	0	0	0	0	111.6	V46 S47 V48 T54 L693 H696 R697 F700	V46-T50 WeakPolarHBondContact O-CB 3.4Å; V46-T50 PolarHBondContact O-N 3.15Å; V46-T50 PolarHBondContact O-OG1 3.46Å; S47-T50 PolarHBondContact O-N 3.45Å; V48-T50 PolarHBondContact O-N 2.97Å; T50-T54 WeakPolarHBondContact O-CB 3.13Å; T50-T54 WeakPolarHBondContact O-CG2 3.32Å; T50-T54 PolarHBondContact O-N 3.06Å; T50-T54 PolarHBondContact O-OG1 3.31Å; T50-L693 HydrophobicContact CG2-CD1 3.72Å; T50-L693 HydrophobicContact CG2-CG 3.83Å; T50-H696 VanDerWaalsContact CG2-C 3.45Å; T50-H696 HydrophobicContact CG2-CB 3.84Å; T50-R697 VanDerWaalsContact CG2-CA 3.49Å; T50-R697 HydrophobicContact CG2-CB 3.97Å; T50-R697 VanDerWaalsContact CG2-N 3.25Å; T50-F700 HydrophobicContact CG2-CB 4.42Å; T50-F700 VanDerWaalsContact OG1-CD1 3.27Å; T50-F700 WeakPolarHBondContact OG1-CD1 3.43Å
51	F	92.5	Very high	86.2	Confident	1 Å²	1	27.5 Å²	27.5	0%	0.004	14%	0.136	C	C	.	.	H	α-helix	trans	-66.2	-54.9	177.5	-178.3	-86.1	0	0	0	111.4	L28 L31 F32 F35 S47 V48 N49 Y53 T54 Y55 F58 V64 F96	L28-F51 HydrophobicContact CD1-CE2 3.55Å; L28-F51 HydrophobicContact CD1-CZ 3.73Å; L31-F51 HydrophobicContact CD1-CD2 4.3Å; L31-F51 HydrophobicContact CD1-CE2 4.42Å; F32-F51 HydrophobicContact CE2-CZ 4.31Å; F32-F51 HydrophobicContact CZ-CE1 4.27Å; F32-F51 HydrophobicContact CZ-CZ 4.06Å; F35-F51 HydrophobicContact CE1-CB 4.18Å; F35-F51 HydrophobicContact CE2-CB 4.32Å; F35-F51 HydrophobicContact CE2-CG 4.23Å; F35-F51 HydrophobicContact CZ-CB 3.53Å; F35-F51 HydrophobicContact CZ-CD1 4.38Å; F35-F51 AromaticContact CZ-CD2 3.72Å; F35-F51 HydrophobicContact CZ-CD2 3.72Å; F35-F51 AromaticContact CZ-CG 3.63Å; F35-F51 HydrophobicContact CZ-CG 3.63Å; S47-F51 WeakPolarHBondContact O-CB 3.17Å; S47-F51 PolarHBondContact O-N 3.41Å; V48-F51 PolarHBondContact O-N 2.97Å; N49-F51 VanDerWaalsContact C-N 3.27Å; N49-F51 PolarHBondContact O-N 3.29Å; F51-Y53 PolarHBondContact O-N 2.8Å; F51-Y53 VanDerWaalsContact O-N 3.16Å; F51-T54 PolarHBondContact O-N 3.15Å; F51-Y55 HydrophobicContact CE1-CG 4.18Å; F51-Y55 WeakPolarHBondContact O-CB 3.11Å; F51-Y55 PolarHBondContact O-N 2.96Å; F51-F58 HydrophobicContact CD2-CE2 4.14Å; F51-F58 HydrophobicContact CD2-CZ 4.05Å; F51-F58 AromaticContact CE2-CE2 3.74Å; F51-F58 HydrophobicContact CE2-CE2 3.74Å; F51-F58 HydrophobicContact CE2-CZ 4.13Å; F51-V64 HydrophobicContact CE1-CG1 4.05Å; F51-V64 HydrophobicContact CE1-CG2 4.24Å; F51-V64 HydrophobicContact CZ-CG1 4.25Å; F51-V64 HydrophobicContact CZ-CG2 3.89Å; F51-F96 AromaticContact CD1-CE2 3.73Å; F51-F96 HydrophobicContact CD1-CE2 3.73Å; F51-F96 HydrophobicContact CD1-CZ 4.09Å; F51-F96 AromaticContact CE1-CE2 3.99Å; F51-F96 HydrophobicContact CE1-CE2 3.99Å; F51-F96 AromaticContact CE1-CZ 3.88Å; F51-F96 HydrophobicContact CE1-CZ 3.88Å
52	L	92.1	Very high	87.3	Confident	1 Å²	1	26.1 Å²	26.1	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-59.4	-31.4	-176.5	-68.6	173.6	0	0	0	112.9	V48 N49 F96 A99 W100 H105	V48-L52 HydrophobicContact CG1-CD1 3.9Å; V48-L52 HydrophobicContact CG1-CG 4.48Å; V48-L52 WeakPolarHBondContact O-CG 3.49Å; V48-L52 PolarHBondContact O-N 2.99Å; N49-L52 PolarHBondContact O-N 3.44Å; L52-F96 HydrophobicContact CD2-CD2 4.5Å; L52-F96 HydrophobicContact CD2-CE2 3.73Å; L52-F96 HydrophobicContact CD2-CZ 3.83Å; L52-F96 HydrophobicContact CG-CE2 4.11Å; L52-A99 HydrophobicContact CD1-CB 3.77Å; L52-W100 HydrophobicContact CD2-CB 3.92Å; L52-W100 HydrophobicContact CD2-CD2 4.1Å; L52-W100 HydrophobicContact CD2-CG 3.76Å; L52-H105 PolarHBondContact O-CE1 2.8Å; L52-H105 PolarHBondContact O-ND1 3.44Å
53	Y	91.2	Very high	88.3	Confident	20 Å²	20	23.9 Å²	23.9	8%	0.078	12%	0.118	C	C	.	.	H	α-helix	trans	-74.8	-25.1	173.8	-86.6	-103.9	0	0	0	114.1	N49 F51 P104 H105 L281 N282 F700 L703 F707	N49-Y53 WeakPolarHBondContact O-CB 3.07Å; N49-Y53 WeakPolarHBondContact O-CD2 3.48Å; N49-Y53 PolarHBondContact O-N 3.06Å; F51-Y53 PolarHBondContact O-N 2.8Å; F51-Y53 VanDerWaalsContact O-N 3.16Å; Y53-P104 HydrophobicContact CE1-CG 4.24Å; Y53-P104 HydrophobicContact CE2-CG 4.18Å; Y53-H105 AromaticContact CD2-CE1 3.2Å; Y53-H105 WeakPolarHBondContact CD2-CE1 3.28Å; Y53-H105 AromaticContact CD2-NE2 3.28Å; Y53-H105 VanDerWaalsContact CD2-NE2 3.28Å; Y53-H105 WeakPolarHBondContact CD2-NE2 3.4Å; Y53-H105 AromaticContact CE2-CE1 3.52Å; Y53-H105 AromaticContact CE2-NE2 3.22Å; Y53-H105 WeakPolarHBondContact CE2-NE2 3.48Å; Y53-H105 AromaticContact CG-CE1 3.76Å; Y53-H105 PolarHBondContact N-CE1 2.73Å; Y53-L281 HydrophobicContact CE1-CD1 3.91Å; Y53-N282 PolarHBondContact O-ND2 2.8Å; Y53-F700 HydrophobicContact CD1-CD2 4.02Å; Y53-F700 HydrophobicContact CD1-CE2 4.48Å; Y53-F700 AromaticContact CD2-CD2 3.61Å; Y53-F700 HydrophobicContact CD2-CD2 3.61Å; Y53-F700 AromaticContact CD2-CE2 3.58Å; Y53-F700 HydrophobicContact CD2-CE2 3.58Å; Y53-F700 HydrophobicContact CE1-CD2 4.38Å; Y53-F700 HydrophobicContact CE1-CE2 4.46Å; Y53-F700 HydrophobicContact CE2-CD2 4.05Å; Y53-F700 AromaticContact CE2-CE2 3.6Å; Y53-F700 HydrophobicContact CE2-CE2 3.6Å; Y53-F700 AromaticContact CG-CD2 3.59Å; Y53-F700 HydrophobicContact CG-CD2 3.59Å; Y53-F700 HydrophobicContact CG-CE2 4.04Å; Y53-L703 HydrophobicContact CD1-CB 3.48Å; Y53-L703 VanDerWaalsContact CD1-CB 3.48Å; Y53-L703 HydrophobicContact CD1-CD1 3.91Å; Y53-L703 HydrophobicContact CD1-CG 4.38Å; Y53-L703 HydrophobicContact CE1-CB 3.81Å; Y53-F707 WeakPolarHBondContact OH-CD1 3.5Å
54	T	93.1	Very high	89.1	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-119.5	-16.9	-167.8	64.2	0	0	0	0	116	T50 F51 R56 L57 L285 H696	T50-T54 WeakPolarHBondContact O-CB 3.13Å; T50-T54 WeakPolarHBondContact O-CG2 3.32Å; T50-T54 PolarHBondContact O-N 3.06Å; T50-T54 PolarHBondContact O-OG1 3.31Å; F51-T54 PolarHBondContact O-N 3.15Å; T54-R56 VanDerWaalsContact C-N 3.27Å; T54-R56 PolarHBondContact O-N 2.72Å; T54-L57 WeakPolarHBondContact O-CB 3.18Å; T54-L57 WeakPolarHBondContact O-CG 3.39Å; T54-L57 PolarHBondContact O-N 2.82Å; T54-L285 HydrophobicContact CG2-CD1 3.78Å; T54-H696 HydrophobicContact CG2-CB 3.85Å
55	Y	93.2	Very high	89.7	Confident	3 Å²	3	21.7 Å²	21.7	1%	0.012	11%	0.106	C	C	.	.	G	3₁₀ helix	trans	-52.7	-37.9	-164.7	80.6	-85.6	0	0	0	114.9	F51 L57 F58 A59 V64 W100 D108	F51-Y55 HydrophobicContact CE1-CG 4.18Å; F51-Y55 WeakPolarHBondContact O-CB 3.11Å; F51-Y55 PolarHBondContact O-N 2.96Å; Y55-L57 PolarHBondContact O-N 2.84Å; Y55-F58 PolarHBondContact O-N 3.15Å; Y55-A59 PolarHBondContact O-N 3.27Å; Y55-V64 HydrophobicContact CD2-CG2 3.75Å; Y55-V64 HydrophobicContact CE2-CG2 4.25Å; Y55-V64 HydrophobicContact CG-CG2 4.49Å; Y55-W100 HydrophobicContact CE1-CZ2 4.38Å; Y55-W100 HydrophobicContact CE2-CZ2 4.42Å; Y55-W100 AromaticContact CZ-CZ2 3.93Å; Y55-D108 PolarHBondContact OH-OD2 3.34Å
56	R	90.4	Very high	90	Very high	70 Å²	70	26.2 Å²	26.2	26%	0.264	13%	0.126	S	C	.	.	G	3₁₀ helix	trans	-52.6	-17.1	176.1	-72.1	-178.8	170.5	100.3	-10.4	115.4	T54 F58 A59 D108 N282	T54-R56 VanDerWaalsContact C-N 3.27Å; T54-R56 PolarHBondContact O-N 2.72Å; R56-F58 VanDerWaalsContact C-N 3.33Å; R56-A59 WeakPolarHBondContact CA-O 3.44Å; R56-D108 IonicContact CZ-OD1 3.58Å; R56-D108 IonicContact CZ-OD2 3.79Å; R56-D108 VanDerWaalsContact NH1-CG 3.27Å; R56-D108 IonicContact NH1-OD1 3.6Å; R56-D108 PolarHBondContact NH1-OD1 3.02Å; R56-D108 IonicContact NH1-OD2 2.67Å; R56-D108 PolarHBondContact NH1-OD2 3.36Å; R56-D108 IonicContact NH2-OD1 3.54Å; R56-D108 PolarHBondContact NH2-OD1 3.33Å; R56-D108 IonicContact NH2-OD2 2.82Å; R56-N282 VanDerWaalsContact CB-OD1 3.24Å; R56-N282 WeakPolarHBondContact CB-OD1 3.44Å
57	L	90.4	Very high	90.4	Very high	27 Å²	27	26.4 Å²	26.4	14%	0.141	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-72.6	-24.7	173.7	-67.5	178.4	0	0	0	113.5	T54 Y55 L285	T54-L57 WeakPolarHBondContact O-CB 3.18Å; T54-L57 WeakPolarHBondContact O-CG 3.39Å; T54-L57 PolarHBondContact O-N 2.82Å; Y55-L57 PolarHBondContact O-N 2.84Å; L57-L285 HydrophobicContact CD1-CB 4.12Å; L57-L285 HydrophobicContact CD1-CD1 3.81Å; L57-L285 HydrophobicContact CD2-CB 3.98Å; L57-L285 HydrophobicContact CG-CB 4.36Å; L57-L285 HydrophobicContact CG-CD1 4.32Å
58	F	89.7	Confident	90.6	Very high	18 Å²	18	26.5 Å²	26.5	8%	0.079	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-138	-13.6	-169.9	53.6	-105.5	0	0	0	115	L31 F51 Y55 R56 Y529 I691 H696	L31-F58 HydrophobicContact CD1-CE2 4.39Å; L31-F58 HydrophobicContact CD1-CZ 4.47Å; F51-F58 HydrophobicContact CD2-CE2 4.14Å; F51-F58 HydrophobicContact CD2-CZ 4.05Å; F51-F58 AromaticContact CE2-CE2 3.74Å; F51-F58 HydrophobicContact CE2-CE2 3.74Å; F51-F58 HydrophobicContact CE2-CZ 4.13Å; Y55-F58 PolarHBondContact O-N 3.15Å; R56-F58 VanDerWaalsContact C-N 3.33Å; F58-Y529 HydrophobicContact CB-CE1 4.42Å; F58-Y529 VanDerWaalsContact CB-OH 3.31Å; F58-Y529 WeakPolarHBondContact CB-OH 3.5Å; F58-I691 HydrophobicContact CB-CD1 4.49Å; F58-I691 HydrophobicContact CB-CG1 4.42Å; F58-I691 HydrophobicContact CD1-CG2 3.82Å; F58-I691 HydrophobicContact CD2-CD1 3.61Å; F58-I691 HydrophobicContact CD2-CG1 4.27Å; F58-I691 HydrophobicContact CD2-CG2 4.34Å; F58-I691 HydrophobicContact CE1-CG2 3.77Å; F58-I691 HydrophobicContact CE2-CD1 3.96Å; F58-I691 HydrophobicContact CE2-CG2 4.29Å; F58-I691 HydrophobicContact CG-CD1 4.11Å; F58-I691 HydrophobicContact CG-CG1 4.27Å; F58-I691 HydrophobicContact CG-CG2 4.11Å; F58-I691 HydrophobicContact CZ-CG2 4Å; F58-H696 AromaticContact CD1-NE2 3.7Å; F58-H696 AromaticContact CE1-CD2 3.66Å; F58-H696 AromaticContact CE1-NE2 3.68Å
59	A	89.8	Confident	90.7	Very high	11 Å²	11	28.7 Å²	28.7	9%	0.091	14%	0.139	C	C	.	.			trans	-143.8	149.5	174.9	0	0	0	0	0	111.3	L28 Y55 R56 L63 V64	L28-A59 HydrophobicContact CD2-CB 4.06Å; Y55-A59 PolarHBondContact O-N 3.27Å; R56-A59 WeakPolarHBondContact CA-O 3.44Å; A59-L63 HydrophobicContact CB-CD2 4.35Å; A59-V64 HydrophobicContact CB-CG2 3.87Å
60	D	89.7	Confident	90.7	Very high	95 Å²	95	33.4 Å²	33.4	51%	0.508	16%	0.159	S	C	.	.			trans	-91.6	173.2	168.4	60.1	57.2	0	0	0	111.6	E62 L63 V64	D60-E62 PolarHBondContact OD1-N 3Å; D60-L63 WeakPolarHBondContact OD1-CB 3.35Å; D60-L63 PolarHBondContact OD1-N 3.44Å; D60-V64 WeakPolarHBondContact O-CG2 3.32Å; D60-V64 PolarHBondContact O-N 3.05Å; D60-V64 VanDerWaalsContact O-N 3.17Å
61	M	90.3	Very high	90.6	Very high	17 Å²	17	34.5 Å²	34.5	8%	0.084	16%	0.164	C	C	.	.	H	α-helix	trans	-70.8	-32	-175.5	-175.9	176.1	-79.3	0	0	113	L65 W100 D108 F109 H117	M61-L65 HydrophobicContact CG-CD1 4.15Å; M61-L65 VanDerWaalsContact O-CG 3.32Å; M61-L65 WeakPolarHBondContact O-CG 3.44Å; M61-L65 PolarHBondContact O-N 3.15Å; M61-L65 VanDerWaalsContact O-N 3.09Å; M61-W100 HydrophobicContact CE-CZ2 3.82Å; M61-W100 HydrophobicContact CG-CH2 3.89Å; M61-W100 HydrophobicContact CG-CZ2 3.83Å; M61-W100 HydrophobicContact SD-CZ2 4.48Å; M61-D108 HydrophobicContact CE-CB 3.48Å; M61-D108 VanDerWaalsContact CE-CB 3.48Å; M61-D108 WeakPolarHBondContact CE-O 3.47Å; M61-F109 HydrophobicContact CE-CD1 3.97Å; M61-F109 HydrophobicContact CE-CE1 3.66Å; M61-F109 HydrophobicContact CE-CZ 4.1Å; M61-F109 HydrophobicContact SD-CD1 3.9Å; M61-F109 HydrophobicContact SD-CE1 3.53Å; M61-F109 VanDerWaalsContact SD-CE1 3.53Å; M61-F109 HydrophobicContact SD-CZ 4.41Å; M61-H117 HydrophobicContact CG-CB 3.95Å; M61-H117 HydrophobicContact SD-CB 3.2Å; M61-H117 WeakPolarHBondContact SD-CB 3.44Å; M61-H117 VanDerWaalsContact SD-CD2 3.6Å; M61-H117 VanDerWaalsContact SD-CG 3.56Å
62	E	90.1	Very high	90.3	Very high	125 Å²	125	34.4 Å²	34.4	58%	0.584	16%	0.163	S	C	*	.	H	α-helix	trans	-66.7	-46	178.9	-60.9	-173.6	160.7	0	0	109.7	D60 V64 L65 E66 H117	D60-E62 PolarHBondContact OD1-N 3Å; E62-V64 PolarHBondContact O-N 2.94Å; E62-L65 PolarHBondContact O-N 2.95Å; E62-E66 WeakPolarHBondContact O-CB 3.27Å; E62-E66 PolarHBondContact O-N 3.01Å; E62-H117 IonicContact OE1-CE1 3.31Å; E62-H117 PolarHBondContact OE1-CE1 3Å; E62-H117 VanDerWaalsContact OE1-CE1 3.31Å; E62-H117 IonicContact OE1-ND1 2.82Å
63	L	90.5	Very high	90.1	Very high	17 Å²	17	36.4 Å²	36.4	9%	0.089	17%	0.171	C	C	.	.	H	α-helix	trans	-64.7	-39.2	177.4	178.5	57.2	0	0	0	113.2	L28 A59 D60 E66 V67 I683	L28-L63 HydrophobicContact CD2-CD1 4.38Å; L28-L63 HydrophobicContact CD2-CD2 3.86Å; L28-L63 HydrophobicContact CD2-CG 3.7Å; A59-L63 HydrophobicContact CB-CD2 4.35Å; D60-L63 WeakPolarHBondContact OD1-CB 3.35Å; D60-L63 PolarHBondContact OD1-N 3.44Å; L63-E66 PolarHBondContact O-N 3.47Å; L63-V67 HydrophobicContact CD1-CG2 3.93Å; L63-V67 WeakPolarHBondContact O-CG2 3.3Å; L63-V67 PolarHBondContact O-N 3.02Å; L63-I683 HydrophobicContact CD1-CD1 3.44Å; L63-I683 VanDerWaalsContact CD1-CD1 3.44Å; L63-I683 HydrophobicContact CD1-CG1 3.76Å; L63-I683 HydrophobicContact CD2-CD1 4.42Å; L63-I683 HydrophobicContact CD2-CG1 4.31Å
64	V	92.4	Very high	89.8	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-65.3	-42.1	176.3	173.4	0	0	0	0	110.9	F32 F51 Y55 A59 D60 E62 V68 F96 W100	F32-V64 HydrophobicContact CZ-CG1 4.31Å; F51-V64 HydrophobicContact CE1-CG1 4.05Å; F51-V64 HydrophobicContact CE1-CG2 4.24Å; F51-V64 HydrophobicContact CZ-CG1 4.25Å; F51-V64 HydrophobicContact CZ-CG2 3.89Å; Y55-V64 HydrophobicContact CD2-CG2 3.75Å; Y55-V64 HydrophobicContact CE2-CG2 4.25Å; Y55-V64 HydrophobicContact CG-CG2 4.49Å; A59-V64 HydrophobicContact CB-CG2 3.87Å; D60-V64 WeakPolarHBondContact O-CG2 3.32Å; D60-V64 PolarHBondContact O-N 3.05Å; D60-V64 VanDerWaalsContact O-N 3.17Å; E62-V64 PolarHBondContact O-N 2.94Å; V64-V68 HydrophobicContact CG1-CG2 4.44Å; V64-V68 WeakPolarHBondContact O-CB 3.48Å; V64-V68 VanDerWaalsContact O-CG2 3.26Å; V64-V68 WeakPolarHBondContact O-CG2 3.35Å; V64-V68 PolarHBondContact O-N 3.27Å; V64-F96 HydrophobicContact CG1-CE1 4.49Å; V64-F96 HydrophobicContact CG1-CZ 4.18Å; V64-W100 HydrophobicContact CB-CH2 3.93Å; V64-W100 HydrophobicContact CB-CZ3 4.42Å; V64-W100 HydrophobicContact CG1-CH2 3.55Å; V64-W100 HydrophobicContact CG1-CZ2 4.49Å; V64-W100 HydrophobicContact CG1-CZ3 3.63Å
65	L	91.5	Very high	89.3	Confident	7 Å²	7	40 Å²	40	4%	0.037	19%	0.191	C	C	.	.	H	α-helix	trans	-65.5	-39.2	175	-70.7	171.6	0	0	0	112.1	M61 E62 N69 W100 H117 C120 L121 I124	M61-L65 HydrophobicContact CG-CD1 4.15Å; M61-L65 VanDerWaalsContact O-CG 3.32Å; M61-L65 WeakPolarHBondContact O-CG 3.44Å; M61-L65 PolarHBondContact O-N 3.15Å; M61-L65 VanDerWaalsContact O-N 3.09Å; E62-L65 PolarHBondContact O-N 2.95Å; L65-N69 VanDerWaalsContact O-CB 3.25Å; L65-N69 WeakPolarHBondContact O-CB 3.26Å; L65-N69 PolarHBondContact O-N 3.15Å; L65-W100 HydrophobicContact CD2-CH2 4.28Å; L65-W100 HydrophobicContact CD2-CZ3 3.78Å; L65-W100 HydrophobicContact CG-CH2 4.19Å; L65-W100 HydrophobicContact CG-CZ3 4.17Å; L65-H117 HydrophobicContact CD1-CB 4.28Å; L65-C120 HydrophobicContact CD1-CB 4.31Å; L65-L121 HydrophobicContact CD2-CB 3.98Å; L65-L121 HydrophobicContact CD2-CD1 3.93Å; L65-L121 HydrophobicContact CD2-CG 4.42Å; L65-I124 HydrophobicContact CB-CD1 4.02Å; L65-I124 HydrophobicContact CD2-CD1 4.3Å
66	E	89.7	Confident	88.7	Confident	118 Å²	118	39.9 Å²	39.9	55%	0.551	19%	0.191	S	C	*	.	H	α-helix	trans	-61.6	-50.9	175.4	-173.8	-176.1	170.2	0	0	111.5	E62 L63 N69 K70	E62-E66 WeakPolarHBondContact O-CB 3.27Å; E62-E66 PolarHBondContact O-N 3.01Å; L63-E66 PolarHBondContact O-N 3.47Å; E66-N69 PolarHBondContact O-N 3.22Å; E66-K70 VanDerWaalsContact O-CB 3.28Å; E66-K70 WeakPolarHBondContact O-CB 3.46Å; E66-K70 PolarHBondContact O-N 3.46Å
67	V	89.3	Confident	88.3	Confident	8 Å²	8	41.4 Å²	41.4	5%	0.048	20%	0.204	C	C	.	.	H	α-helix	trans	-65.3	-41	-179.2	170.6	0	0	0	0	111.7	L28 V29 F32 L63 K71	L28-V67 HydrophobicContact CD2-CB 4.44Å; L28-V67 HydrophobicContact CD2-CG2 3.93Å; L28-V67 HydrophobicContact CG-CG1 4.36Å; L28-V67 HydrophobicContact CG-CG2 4.3Å; V29-V67 HydrophobicContact CG2-CG1 4.15Å; F32-V67 HydrophobicContact CD2-CG1 3.86Å; F32-V67 HydrophobicContact CE2-CG1 3.9Å; L63-V67 HydrophobicContact CD1-CG2 3.93Å; L63-V67 WeakPolarHBondContact O-CG2 3.3Å; L63-V67 PolarHBondContact O-N 3.02Å; V67-K71 WeakPolarHBondContact O-CB 3.35Å; V67-K71 PolarHBondContact O-N 3.33Å
68	V	90.7	Very high	87.8	Confident	2 Å²	2	41.5 Å²	41.5	1%	0.012	21%	0.207	C	C	.	.	H	α-helix	trans	-64.5	-46.4	176.4	169.5	0	0	0	0	111.1	F32 V64 K71 F72 F93 F96 L97 W128	F32-V68 HydrophobicContact CD1-CG2 4.42Å; F32-V68 HydrophobicContact CE1-CG2 3.56Å; F32-V68 HydrophobicContact CE2-CG2 4.02Å; F32-V68 HydrophobicContact CZ-CG2 3.34Å; V64-V68 HydrophobicContact CG1-CG2 4.44Å; V64-V68 WeakPolarHBondContact O-CB 3.48Å; V64-V68 VanDerWaalsContact O-CG2 3.26Å; V64-V68 WeakPolarHBondContact O-CG2 3.35Å; V64-V68 PolarHBondContact O-N 3.27Å; V68-K71 PolarHBondContact O-N 2.95Å; V68-F72 WeakPolarHBondContact O-CB 3.39Å; V68-F72 PolarHBondContact O-N 3.26Å; V68-F93 HydrophobicContact CG1-CD1 4.13Å; V68-F96 HydrophobicContact CG2-CD1 4.32Å; V68-F96 HydrophobicContact CG2-CE1 3.86Å; V68-L97 HydrophobicContact CG1-CD1 4.48Å; V68-L97 HydrophobicContact CG1-CD2 4.35Å; V68-W128 HydrophobicContact CG1-CH2 3.7Å; V68-W128 HydrophobicContact CG1-CZ2 3.98Å
69	N	90	Very high	87.1	Confident	47 Å²	47	46.4 Å²	46.4	25%	0.251	24%	0.244	S	C	.	.	H	α-helix	trans	-63.1	-47.7	177.3	-176	47.3	0	0	0	111.7	L65 E66 K71 F72 W73 I124 W128	L65-N69 VanDerWaalsContact O-CB 3.25Å; L65-N69 WeakPolarHBondContact O-CB 3.26Å; L65-N69 PolarHBondContact O-N 3.15Å; E66-N69 PolarHBondContact O-N 3.22Å; N69-K71 PolarHBondContact O-N 2.91Å; N69-F72 PolarHBondContact O-N 2.96Å; N69-W73 PolarHBondContact O-N 3.36Å; N69-W73 VanDerWaalsContact O-N 3.15Å; N69-W73 PolarHBondContact OD1-NE1 3.32Å; N69-I124 HydrophobicContact CB-CD1 4.26Å; N69-I124 HydrophobicContact CB-CG1 4.42Å; N69-I124 HydrophobicContact CB-CG2 4.07Å; N69-W128 PolarHBondContact OD1-NE1 3.44Å
70	K	88.3	Confident	86.6	Confident	115 Å²	115	53.3 Å²	53.3	50%	0.5	28%	0.278	S	S	.	.	H	α-helix	trans	-56.6	-49.5	175.8	179.9	-178.9	174.4	-177	0	111.1	E66 F72 W73 D74	E66-K70 VanDerWaalsContact O-CB 3.28Å; E66-K70 WeakPolarHBondContact O-CB 3.46Å; E66-K70 PolarHBondContact O-N 3.46Å; K70-F72 VanDerWaalsContact C-N 3.33Å; K70-F72 PolarHBondContact O-N 2.88Å; K70-W73 PolarHBondContact O-N 2.91Å; K70-W73 VanDerWaalsContact O-N 3.13Å; K70-D74 WeakPolarHBondContact CE-OD2 3.27Å; K70-D74 WeakPolarHBondContact CG-OD2 3.33Å; K70-D74 PolarHBondContact O-N 3.19Å
71	K	86.7	Confident	86	Confident	22 Å²	22	50.9 Å²	50.9	10%	0.096	27%	0.265	C	S	.	.	H	α-helix	trans	-69.1	-29.5	-175.6	-161.1	171.4	-175.3	174.8	0	113.2	V29 F32 D33 V67 V68 N69 T75 F93	V29-K71 HydrophobicContact CG1-CD 4.4Å; V29-K71 PolarHBondContact O-NZ 3.22Å; F32-K71 HydrophobicContact CB-CD 3.88Å; D33-K71 VanDerWaalsContact N-NZ 3.2Å; D33-K71 WeakPolarHBondContact OD1-CE 3.31Å; D33-K71 IonicContact OD1-NZ 3.6Å; D33-K71 PolarHBondContact OD1-NZ 3.39Å; D33-K71 IonicContact OD2-NZ 2.72Å; D33-K71 PolarHBondContact OD2-NZ 3.49Å; V67-K71 WeakPolarHBondContact O-CB 3.35Å; V67-K71 PolarHBondContact O-N 3.33Å; V68-K71 PolarHBondContact O-N 2.95Å; N69-K71 PolarHBondContact O-N 2.91Å; K71-T75 WeakPolarHBondContact O-CB 3.19Å; K71-T75 PolarHBondContact O-N 2.99Å; K71-T75 PolarHBondContact O-OG1 2.95Å; K71-F93 HydrophobicContact CB-CZ 3.91Å; K71-F93 HydrophobicContact CD-CZ 3.95Å; K71-F93 HydrophobicContact CG-CZ 3.8Å
72	F	87.7	Confident	85.5	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-60.2	-54.1	166.5	173.2	-89.9	0	0	0	110.9	V68 N69 K70 D74 T75 C76 I90 W128 F132	V68-F72 WeakPolarHBondContact O-CB 3.39Å; V68-F72 PolarHBondContact O-N 3.26Å; N69-F72 PolarHBondContact O-N 2.96Å; K70-F72 VanDerWaalsContact C-N 3.33Å; K70-F72 PolarHBondContact O-N 2.88Å; F72-D74 PolarHBondContact O-N 3.15Å; F72-T75 WeakPolarHBondContact O-CB 3.3Å; F72-T75 PolarHBondContact O-N 3.08Å; F72-C76 WeakPolarHBondContact O-CB 3.26Å; F72-C76 PolarHBondContact O-N 3.49Å; F72-C76 PolarHBondContact O-SG 2.69Å; F72-I90 HydrophobicContact CD2-CG1 4.45Å; F72-I90 HydrophobicContact CE2-CG1 4.22Å; F72-I90 HydrophobicContact CE2-CG2 4.38Å; F72-W128 HydrophobicContact CB-CD2 4.48Å; F72-W128 HydrophobicContact CB-CH2 3.96Å; F72-W128 HydrophobicContact CB-CZ2 3.37Å; F72-W128 AromaticContact CD1-CD1 3.55Å; F72-W128 AromaticContact CD1-CD2 3.93Å; F72-W128 HydrophobicContact CD1-CD2 3.93Å; F72-W128 AromaticContact CD1-CE2 3.62Å; F72-W128 AromaticContact CD1-CG 3.9Å; F72-W128 HydrophobicContact CD1-CG 3.9Å; F72-W128 HydrophobicContact CD1-CZ2 4.26Å; F72-W128 AromaticContact CD1-NE1 3.36Å; F72-W128 AromaticContact CD2-CD2 3.75Å; F72-W128 HydrophobicContact CD2-CD2 3.75Å; F72-W128 AromaticContact CD2-CE2 3.81Å; F72-W128 AromaticContact CD2-CE3 3.82Å; F72-W128 HydrophobicContact CD2-CE3 3.82Å; F72-W128 HydrophobicContact CD2-CG 4.36Å; F72-W128 HydrophobicContact CD2-CH2 4.03Å; F72-W128 AromaticContact CD2-CZ2 3.97Å; F72-W128 HydrophobicContact CD2-CZ2 3.97Å; F72-W128 AromaticContact CD2-CZ3 3.96Å; F72-W128 HydrophobicContact CD2-CZ3 3.96Å; F72-W128 HydrophobicContact CE1-CB 4.16Å; F72-W128 AromaticContact CE1-CD1 3.54Å; F72-W128 HydrophobicContact CE1-CD2 4.03Å; F72-W128 AromaticContact CE1-CG 3.64Å; F72-W128 HydrophobicContact CE1-CG 3.64Å; F72-W128 AromaticContact CE1-NE1 3.87Å; F72-W128 HydrophobicContact CE2-CB 4.5Å; F72-W128 AromaticContact CE2-CD2 3.85Å; F72-W128 HydrophobicContact CE2-CD2 3.85Å; F72-W128 AromaticContact CE2-CE3 3.9Å; F72-W128 HydrophobicContact CE2-CE3 3.9Å; F72-W128 HydrophobicContact CE2-CG 4.12Å; F72-W128 HydrophobicContact CE2-CZ3 4.43Å; F72-W128 AromaticContact CG-CD2 3.79Å; F72-W128 HydrophobicContact CG-CD2 3.79Å; F72-W128 AromaticContact CG-CE2 3.41Å; F72-W128 VanDerWaalsContact CG-CE2 3.41Å; F72-W128 HydrophobicContact CG-CE3 4.29Å; F72-W128 HydrophobicContact CG-CG 4.26Å; F72-W128 HydrophobicContact CG-CH2 4.14Å; F72-W128 AromaticContact CG-CZ2 3.62Å; F72-W128 HydrophobicContact CG-CZ2 3.62Å; F72-W128 HydrophobicContact CG-CZ3 4.45Å; F72-W128 AromaticContact CG-NE1 3.67Å; F72-W128 HydrophobicContact CZ-CB 3.96Å; F72-W128 AromaticContact CZ-CD2 4Å; F72-W128 HydrophobicContact CZ-CD2 4Å; F72-W128 HydrophobicContact CZ-CE3 4.44Å; F72-W128 AromaticContact CZ-CG 3.76Å; F72-W128 HydrophobicContact CZ-CG 3.76Å; F72-F132 HydrophobicContact CE2-CE2 4.11Å; F72-F132 HydrophobicContact CE2-CZ 4.4Å; F72-F132 AromaticContact CZ-CE2 3.9Å; F72-F132 HydrophobicContact CZ-CE2 3.9Å; F72-F132 HydrophobicContact CZ-CZ 4.35Å
73	W	86.8	Confident	84.9	Confident	42 Å²	42	49.1 Å²	49.1	16%	0.159	27%	0.265	C	S	.	.	H	α-helix	trans	-64.3	-39.7	179.9	-67.5	110.2	0	0	0	113	N69 K70 T75 C76 L77 W128 V131 N160	N69-W73 PolarHBondContact O-N 3.36Å; N69-W73 VanDerWaalsContact O-N 3.15Å; N69-W73 PolarHBondContact OD1-NE1 3.32Å; K70-W73 PolarHBondContact O-N 2.91Å; K70-W73 VanDerWaalsContact O-N 3.13Å; W73-T75 VanDerWaalsContact C-N 3.31Å; W73-T75 PolarHBondContact O-N 3.31Å; W73-C76 PolarHBondContact O-N 2.92Å; W73-L77 VanDerWaalsContact O-CB 3.32Å; W73-L77 WeakPolarHBondContact O-CB 3.48Å; W73-L77 VanDerWaalsContact O-CG 3.3Å; W73-L77 WeakPolarHBondContact O-CG 3.5Å; W73-L77 PolarHBondContact O-N 2.67Å; W73-W128 AromaticContact NE1-NE1 3.99Å; W73-V131 HydrophobicContact CH2-CG2 3.42Å; W73-V131 VanDerWaalsContact CH2-CG2 3.42Å; W73-V131 HydrophobicContact CZ2-CG2 4.5Å; W73-V131 HydrophobicContact CZ3-CG2 3.83Å; W73-N160 WeakPolarHBondContact CH2-ND2 3.4Å
74	D	84.8	Confident	84.3	Confident	88 Å²	88	52.3 Å²	52.3	47%	0.471	29%	0.288	S	S	.	.	H	α-helix	trans	-59.8	-41	173.8	-70.1	-19.3	0	0	0	111.1	K70 F72 S78	K70-D74 WeakPolarHBondContact CE-OD2 3.27Å; K70-D74 WeakPolarHBondContact CG-OD2 3.33Å; K70-D74 PolarHBondContact O-N 3.19Å; F72-D74 PolarHBondContact O-N 3.15Å; D74-S78 WeakPolarHBondContact O-CB 3.47Å; D74-S78 PolarHBondContact O-N 2.94Å
75	T	83.5	Confident	83.7	Confident	7 Å²	7	56.9 Å²	56.9	4%	0.043	31%	0.306	C	S	.	.	H	α-helix	trans	-65.9	-46	175.6	-58.2	0	0	0	0	111.6	K71 F72 W73 I81 K86 I89	K71-T75 WeakPolarHBondContact O-CB 3.19Å; K71-T75 PolarHBondContact O-N 2.99Å; K71-T75 PolarHBondContact O-OG1 2.95Å; F72-T75 WeakPolarHBondContact O-CB 3.3Å; F72-T75 PolarHBondContact O-N 3.08Å; W73-T75 VanDerWaalsContact C-N 3.31Å; W73-T75 PolarHBondContact O-N 3.31Å; T75-I81 HydrophobicContact CG2-CD1 4.24Å; T75-K86 HydrophobicContact CG2-CB 4.34Å; T75-K86 HydrophobicContact CG2-CG 4.23Å; T75-K86 WeakPolarHBondContact O-CD 3.35Å; T75-K86 WeakPolarHBondContact O-CE 3.43Å; T75-I89 HydrophobicContact CG2-CB 3.99Å; T75-I89 HydrophobicContact CG2-CD1 3.98Å; T75-I89 HydrophobicContact CG2-CG2 3.71Å
76	C	80.1	Confident	83.3	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.007	31%	0.307	C	S	.	.	H	α-helix	trans	-63.4	-44.7	-179.5	-74.5	0	0	0	0	112	F72 W73 K86 V167	F72-C76 WeakPolarHBondContact O-CB 3.26Å; F72-C76 PolarHBondContact O-N 3.49Å; F72-C76 PolarHBondContact O-SG 2.69Å; W73-C76 PolarHBondContact O-N 2.92Å; C76-K86 PolarHBondContact O-NZ 3.08Å; C76-V167 HydrophobicContact CB-CB 4.27Å; C76-V167 HydrophobicContact CB-CG1 3.49Å; C76-V167 VanDerWaalsContact CB-CG1 3.49Å; C76-V167 HydrophobicContact CB-CG2 3.85Å; C76-V167 WeakPolarHBondContact O-CA 3.26Å
77	L	81.8	Confident	82.9	Confident	102 Å²	102	52.9 Å²	52.9	53%	0.534	29%	0.288	S	S	.	.	H	α-helix	trans	-85	-19	-176.3	-63.7	171.8	0	0	0	114.1	W73 S79 V167	W73-L77 VanDerWaalsContact O-CB 3.32Å; W73-L77 WeakPolarHBondContact O-CB 3.48Å; W73-L77 VanDerWaalsContact O-CG 3.3Å; W73-L77 WeakPolarHBondContact O-CG 3.5Å; W73-L77 PolarHBondContact O-N 2.67Å; L77-S79 PolarHBondContact O-N 2.92Å; L77-V167 HydrophobicContact CD2-CG2 4.36Å
78	S	80.8	Confident	82.5	Confident	30 Å²	30	53 Å²	53	21%	0.21	29%	0.291	C	S	.	.			trans	-63.8	128.8	179.5	179.5	0	0	0	0	112.5	D74 L80 K86	D74-S78 WeakPolarHBondContact O-CB 3.47Å; D74-S78 PolarHBondContact O-N 2.94Å; S78-L80 VanDerWaalsContact C-N 3.33Å; S78-L80 PolarHBondContact OG-N 3.12Å; S78-L80 VanDerWaalsContact OG-N 3.16Å; S78-K86 WeakPolarHBondContact O-CE 3.31Å; S78-K86 PolarHBondContact O-NZ 3.17Å
79	S	75.7	Confident	82.2	Confident	121 Å²	121	54.3 Å²	54.3	85%	0.846	30%	0.298	S	S	*	.	S	Bend	trans	-83.1	-8.8	169.7	54.5	0	0	0	0	113.4	L77	L77-S79 PolarHBondContact O-N 2.92Å
80	L	77.8	Confident	82	Confident	155 Å²	155	52.1 Å²	52.1	81%	0.812	29%	0.286	S	S	*	.	S	Bend	trans	-90.1	-13.1	-175.3	-65.4	165.3	0	0	0	113.4	S78	S78-L80 VanDerWaalsContact C-N 3.33Å; S78-L80 PolarHBondContact OG-N 3.12Å; S78-L80 VanDerWaalsContact OG-N 3.16Å
81	I	76.7	Confident	81.7	Confident	44 Å²	44	47.8 Å²	47.8	23%	0.226	27%	0.27	C	S	.	.	S	Bend	trans	-101	120.6	-176.5	-58.9	172.4	0	0	0	109.1	T75 W85 K86 I89	T75-I81 HydrophobicContact CG2-CD1 4.24Å; I81-W85 HydrophobicContact CG2-CB 3.81Å; I81-K86 HydrophobicContact CB-CG 4.06Å; I81-K86 HydrophobicContact CG2-CG 3.63Å; I81-K86 WeakPolarHBondContact O-CE 3.41Å; I81-I89 HydrophobicContact CG2-CD1 4.08Å
82	P	80.6	Confident	81.5	Confident	57 Å²	57	47 Å²	47	37%	0.37	27%	0.268	S	S	.	.			trans	-54.6	142.1	174.6	-26.1	34.6	0	0	0	112.5	S84 W85 K86	P82-S84 PolarHBondContact O-N 2.97Å; P82-S84 VanDerWaalsContact O-N 3.15Å; P82-W85 HydrophobicContact CB-CB 4.45Å; P82-W85 HydrophobicContact CB-CD2 4.3Å; P82-W85 HydrophobicContact CB-CG 4.05Å; P82-W85 HydrophobicContact CG-CD2 3.83Å; P82-W85 HydrophobicContact CG-CE3 4.14Å; P82-W85 HydrophobicContact CG-CG 4.12Å; P82-W85 WeakPolarHBondContact O-CA 3.16Å; P82-W85 WeakPolarHBondContact O-CB 3.37Å; P82-W85 PolarHBondContact O-N 3.19Å; P82-K86 PolarHBondContact O-N 3.34Å
83	T	77.8	Confident	81.5	Confident	49 Å²	49	47.4 Å²	47.4	30%	0.301	27%	0.269	S	S	.	.	H	α-helix	trans	-56.1	-36.6	-175.8	-41.9	0	0	0	0	113.1	W85 K86 V87 L168 C169 I171	T83-W85 VanDerWaalsContact C-N 3.35Å; T83-W85 PolarHBondContact O-N 3Å; T83-K86 PolarHBondContact O-N 3.02Å; T83-V87 PolarHBondContact O-N 3.18Å; T83-L168 HydrophobicContact CG2-CD2 4.14Å; T83-C169 WeakPolarHBondContact CG2-O 3.32Å; T83-I171 HydrophobicContact CG2-CD1 3.85Å; T83-I171 HydrophobicContact CG2-CG1 3.38Å
84	S	76.7	Confident	81.5	Confident	83 Å²	83	45.7 Å²	45.7	58%	0.58	26%	0.264	S	S	*	.	H	α-helix	trans	-64.7	-34.7	174.8	52.3	0	0	0	0	113.5	P82 G88	P82-S84 PolarHBondContact O-N 2.97Å; P82-S84 VanDerWaalsContact O-N 3.15Å; S84-G88 PolarHBondContact O-N 3.1Å
85	W	80.8	Confident	81.6	Confident	97 Å²	97	42.4 Å²	42.4	37%	0.367	25%	0.245	S	C	.	.	H	α-helix	trans	-74.2	-38.8	175.1	-61.5	7.2	0	0	0	110.7	E39 I81 P82 T83 V87 G88 I89	E39-W85 HydrophobicContact CB-CD2 4.02Å; E39-W85 HydrophobicContact CB-CG 4.09Å; E39-W85 HydrophobicContact CB-CZ2 4.14Å; E39-W85 VanDerWaalsContact CD-CZ2 3.44Å; E39-W85 HydrophobicContact CG-CZ2 3.8Å; E39-W85 WeakPolarHBondContact O-CA 3.45Å; E39-W85 WeakPolarHBondContact OE1-CZ2 3.49Å; E39-W85 PolarHBondContact OE2-NE1 3.39Å; E39-W85 VanDerWaalsContact OE2-NE1 3.13Å; I81-W85 HydrophobicContact CG2-CB 3.81Å; P82-W85 HydrophobicContact CB-CB 4.45Å; P82-W85 HydrophobicContact CB-CD2 4.3Å; P82-W85 HydrophobicContact CB-CG 4.05Å; P82-W85 HydrophobicContact CG-CD2 3.83Å; P82-W85 HydrophobicContact CG-CE3 4.14Å; P82-W85 HydrophobicContact CG-CG 4.12Å; P82-W85 WeakPolarHBondContact O-CA 3.16Å; P82-W85 WeakPolarHBondContact O-CB 3.37Å; P82-W85 PolarHBondContact O-N 3.19Å; T83-W85 VanDerWaalsContact C-N 3.35Å; T83-W85 PolarHBondContact O-N 3Å; W85-V87 VanDerWaalsContact C-N 3.34Å; W85-V87 PolarHBondContact O-N 3.45Å; W85-G88 PolarHBondContact O-N 2.81Å; W85-I89 WeakPolarHBondContact O-CD1 3.43Å; W85-I89 VanDerWaalsContact O-CG1 3.29Å; W85-I89 WeakPolarHBondContact O-CG1 3.4Å; W85-I89 PolarHBondContact O-N 2.75Å
86	K	83.5	Confident	81.9	Confident	15 Å²	15	42.1 Å²	42.1	7%	0.065	24%	0.243	C	C	.	.	H	α-helix	trans	-55.7	-47.6	175	-66.4	-168.7	178.4	-170.9	0	111.6	T75 C76 S78 I81 P82 T83 G88 I89 I90 V167 L168	T75-K86 HydrophobicContact CG2-CB 4.34Å; T75-K86 HydrophobicContact CG2-CG 4.23Å; T75-K86 WeakPolarHBondContact O-CD 3.35Å; T75-K86 WeakPolarHBondContact O-CE 3.43Å; C76-K86 PolarHBondContact O-NZ 3.08Å; S78-K86 WeakPolarHBondContact O-CE 3.31Å; S78-K86 PolarHBondContact O-NZ 3.17Å; I81-K86 HydrophobicContact CB-CG 4.06Å; I81-K86 HydrophobicContact CG2-CG 3.63Å; I81-K86 WeakPolarHBondContact O-CE 3.41Å; P82-K86 PolarHBondContact O-N 3.34Å; T83-K86 PolarHBondContact O-N 3.02Å; K86-G88 PolarHBondContact O-N 2.88Å; K86-I89 PolarHBondContact O-N 2.93Å; K86-I90 WeakPolarHBondContact O-CB 3.48Å; K86-I90 WeakPolarHBondContact O-CD1 3.19Å; K86-I90 VanDerWaalsContact O-CG1 3.24Å; K86-I90 WeakPolarHBondContact O-CG1 3.33Å; K86-I90 PolarHBondContact O-N 2.94Å; K86-V167 PolarHBondContact NZ-O 2.94Å; K86-L168 HydrophobicContact CB-CD2 3.59Å; K86-L168 HydrophobicContact CD-CD2 3.72Å; K86-L168 HydrophobicContact CG-CD2 4.31Å
87	V	81.3	Confident	82.4	Confident	26 Å²	26	42.1 Å²	42.1	16%	0.158	24%	0.243	C	C	.	.	H	α-helix	trans	-54.5	-50.8	176.5	170.4	0	0	0	0	111.4	T83 W85 I89 I90 S91 I171 V175 V179	T83-V87 PolarHBondContact O-N 3.18Å; W85-V87 VanDerWaalsContact C-N 3.34Å; W85-V87 PolarHBondContact O-N 3.45Å; V87-I89 PolarHBondContact O-N 3.27Å; V87-I90 PolarHBondContact O-N 2.9Å; V87-I90 VanDerWaalsContact O-N 3.15Å; V87-S91 PolarHBondContact O-N 3.28Å; V87-I171 HydrophobicContact CG2-CD1 3.37Å; V87-I171 HydrophobicContact CG2-CG1 4.46Å; V87-V175 HydrophobicContact CG1-CG1 3.76Å; V87-V175 HydrophobicContact CG2-CG1 3.99Å; V87-V179 HydrophobicContact CG1-CG2 4.01Å
88	G	81.1	Confident	82.8	Confident	11 Å²	11	37.4 Å²	37.4	11%	0.113	22%	0.219	C	C	.	.	H	α-helix	trans	-63.9	-38.6	-179.2	0	0	0	0	0	113.6	G40 S84 W85 K86 S92	G40-G88 CarbonylContact O-C 3.52Å; G40-G88 WeakPolarHBondContact O-CA 3.38Å; S84-G88 PolarHBondContact O-N 3.1Å; W85-G88 PolarHBondContact O-N 2.81Å; K86-G88 PolarHBondContact O-N 2.88Å; G88-S92 WeakPolarHBondContact O-CB 3.45Å; G88-S92 PolarHBondContact O-N 2.71Å; G88-S92 PolarHBondContact O-OG 2.58Å
89	I	83.8	Confident	83	Confident	28 Å²	28	36.3 Å²	36.3	14%	0.144	21%	0.211	C	C	.	.	H	α-helix	trans	-63.8	-41.3	172.7	-65.4	160	0	0	0	110.8	V36 T75 I81 W85 K86 V87 S92 F93	V36-I89 HydrophobicContact CG1-CG1 3.96Å; T75-I89 HydrophobicContact CG2-CB 3.99Å; T75-I89 HydrophobicContact CG2-CD1 3.98Å; T75-I89 HydrophobicContact CG2-CG2 3.71Å; I81-I89 HydrophobicContact CG2-CD1 4.08Å; W85-I89 WeakPolarHBondContact O-CD1 3.43Å; W85-I89 VanDerWaalsContact O-CG1 3.29Å; W85-I89 WeakPolarHBondContact O-CG1 3.4Å; W85-I89 PolarHBondContact O-N 2.75Å; K86-I89 PolarHBondContact O-N 2.93Å; V87-I89 PolarHBondContact O-N 3.27Å; I89-S92 WeakPolarHBondContact O-CB 3.32Å; I89-S92 PolarHBondContact O-N 3.01Å; I89-F93 HydrophobicContact CG2-CD2 4Å; I89-F93 HydrophobicContact CG2-CE2 3.48Å; I89-F93 VanDerWaalsContact CG2-CE2 3.48Å; I89-F93 HydrophobicContact CG2-CZ 4.25Å; I89-F93 VanDerWaalsContact O-CD2 3.26Å; I89-F93 WeakPolarHBondContact O-CD2 3.46Å; I89-F93 PolarHBondContact O-N 3.49Å; I89-F93 VanDerWaalsContact O-N 3.08Å
90	I	84.8	Confident	83.8	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-63.6	-54.8	178.2	-71	160.2	0	0	0	110.7	F72 K86 V87 S92 F93 L94 F132 L168 V179	F72-I90 HydrophobicContact CD2-CG1 4.45Å; F72-I90 HydrophobicContact CE2-CG1 4.22Å; F72-I90 HydrophobicContact CE2-CG2 4.38Å; K86-I90 WeakPolarHBondContact O-CB 3.48Å; K86-I90 WeakPolarHBondContact O-CD1 3.19Å; K86-I90 VanDerWaalsContact O-CG1 3.24Å; K86-I90 WeakPolarHBondContact O-CG1 3.33Å; K86-I90 PolarHBondContact O-N 2.94Å; V87-I90 PolarHBondContact O-N 2.9Å; V87-I90 VanDerWaalsContact O-N 3.15Å; I90-S92 PolarHBondContact O-N 3.42Å; I90-F93 WeakPolarHBondContact O-CA 3.41Å; I90-F93 WeakPolarHBondContact O-CB 3.36Å; I90-F93 PolarHBondContact O-N 3.13Å; I90-L94 HydrophobicContact CG2-CG 4.44Å; I90-L94 WeakPolarHBondContact O-CG 3.4Å; I90-L94 PolarHBondContact O-N 3.44Å; I90-F132 HydrophobicContact CD1-CZ 4.28Å; I90-F132 HydrophobicContact CG2-CZ 3.97Å; I90-L168 HydrophobicContact CD1-CD1 3.93Å; I90-L168 HydrophobicContact CD1-CD2 4.22Å; I90-V179 HydrophobicContact CG2-CG1 3.95Å
91	S	82.6	Confident	84.4	Confident	24 Å²	24	23.4 Å²	23.4	17%	0.168	13%	0.134	C	C	.	.	H	α-helix	trans	-60.6	-28.2	176.3	-68.4	0	0	0	0	112.6	V87 L94 Y95 E182	V87-S91 PolarHBondContact O-N 3.28Å; S91-L94 PolarHBondContact O-N 3.35Å; S91-Y95 WeakPolarHBondContact O-CB 3.3Å; S91-Y95 PolarHBondContact O-N 3.11Å; S91-E182 WeakPolarHBondContact CB-OE2 3.46Å; S91-E182 PolarHBondContact OG-OE2 3.28Å
92	S	82.3	Confident	84.8	Confident	7 Å²	7	23.2 Å²	23.2	5%	0.049	13%	0.132	C	C	.	.	H	α-helix	trans	-64.2	-38.9	170.5	-58.7	0	0	0	0	112.8	I43 G88 I89 I90 F96	I43-S92 WeakPolarHBondContact CG1-OG 3.36Å; G88-S92 WeakPolarHBondContact O-CB 3.45Å; G88-S92 PolarHBondContact O-N 2.71Å; G88-S92 PolarHBondContact O-OG 2.58Å; I89-S92 WeakPolarHBondContact O-CB 3.32Å; I89-S92 PolarHBondContact O-N 3.01Å; I90-S92 PolarHBondContact O-N 3.42Å; S92-F96 WeakPolarHBondContact O-CB 3.48Å; S92-F96 PolarHBondContact O-N 3.42Å
93	F	87.4	Confident	84.8	Confident	7 Å²	7	25.3 Å²	25.3	3%	0.031	14%	0.137	C	C	.	.	H	α-helix	trans	-70	-38.4	171.6	-70	-55.6	0	0	0	112.4	F32 V68 K71 I89 I90 F96 L97 W128	F32-F93 HydrophobicContact CD1-CE1 4.08Å; V68-F93 HydrophobicContact CG1-CD1 4.13Å; K71-F93 HydrophobicContact CB-CZ 3.91Å; K71-F93 HydrophobicContact CD-CZ 3.95Å; K71-F93 HydrophobicContact CG-CZ 3.8Å; I89-F93 HydrophobicContact CG2-CD2 4Å; I89-F93 HydrophobicContact CG2-CE2 3.48Å; I89-F93 VanDerWaalsContact CG2-CE2 3.48Å; I89-F93 HydrophobicContact CG2-CZ 4.25Å; I89-F93 VanDerWaalsContact O-CD2 3.26Å; I89-F93 WeakPolarHBondContact O-CD2 3.46Å; I89-F93 PolarHBondContact O-N 3.49Å; I89-F93 VanDerWaalsContact O-N 3.08Å; I90-F93 WeakPolarHBondContact O-CA 3.41Å; I90-F93 WeakPolarHBondContact O-CB 3.36Å; I90-F93 PolarHBondContact O-N 3.13Å; F93-F96 PolarHBondContact O-N 3.27Å; F93-L97 WeakPolarHBondContact O-CG 3.47Å; F93-L97 PolarHBondContact O-N 2.83Å; F93-W128 HydrophobicContact CB-CH2 4.06Å; F93-W128 HydrophobicContact CB-CZ3 4.13Å
94	L	87.8	Confident	85	Confident	7 Å²	7	23.6 Å²	23.6	4%	0.037	13%	0.127	C	C	.	.	H	α-helix	trans	-61	-46.2	176.2	-57.2	-170.3	0	0	0	111.1	I90 S91 L97 G98 W128 V179 E182 M183 L186	I90-L94 HydrophobicContact CG2-CG 4.44Å; I90-L94 WeakPolarHBondContact O-CG 3.4Å; I90-L94 PolarHBondContact O-N 3.44Å; S91-L94 PolarHBondContact O-N 3.35Å; L94-L97 PolarHBondContact O-N 3.13Å; L94-G98 PolarHBondContact O-N 3.15Å; L94-W128 HydrophobicContact CD2-CE3 4.41Å; L94-W128 HydrophobicContact CD2-CZ3 4.34Å; L94-V179 HydrophobicContact CD1-CG1 4.38Å; L94-E182 HydrophobicContact CD1-CB 3.67Å; L94-M183 HydrophobicContact CD1-CB 4.27Å; L94-M183 HydrophobicContact CD2-SD 3.37Å; L94-M183 WeakPolarHBondContact CD2-SD 3.35Å; L94-L186 HydrophobicContact CB-CD2 4.2Å; L94-L186 HydrophobicContact CD2-CD2 3.83Å
95	Y	85.9	Confident	85.5	Confident	18 Å²	18	20.1 Å²	20.1	7%	0.071	10%	0.101	C	C	.	.	H	α-helix	trans	-61.3	-45.1	173.5	173.5	-83.8	0	0	0	112.2	I43 T45 V48 S91 L97 G98 A99 L469 G471	I43-Y95 HydrophobicContact CD1-CD1 4.14Å; I43-Y95 HydrophobicContact CD1-CD2 4.22Å; I43-Y95 HydrophobicContact CD1-CG 3.75Å; I43-Y95 HydrophobicContact CG2-CD1 3.72Å; I43-Y95 HydrophobicContact CG2-CE1 3.82Å; I43-Y95 HydrophobicContact CG2-CG 4.41Å; T45-Y95 WeakPolarHBondContact CB-OH 3.29Å; T45-Y95 HydrophobicContact CG2-CE1 4.39Å; T45-Y95 HydrophobicContact CG2-CE2 4.45Å; T45-Y95 WeakPolarHBondContact CG2-OH 3.42Å; V48-Y95 HydrophobicContact CB-CE1 4.17Å; V48-Y95 HydrophobicContact CG1-CD1 4.35Å; V48-Y95 HydrophobicContact CG1-CE1 3.89Å; V48-Y95 HydrophobicContact CG2-CD1 4.45Å; V48-Y95 HydrophobicContact CG2-CE1 4.2Å; S91-Y95 WeakPolarHBondContact O-CB 3.3Å; S91-Y95 PolarHBondContact O-N 3.11Å; Y95-L97 PolarHBondContact O-N 2.83Å; Y95-G98 PolarHBondContact O-N 3.15Å; Y95-A99 WeakPolarHBondContact O-CB 3.21Å; Y95-A99 PolarHBondContact O-N 2.93Å; Y95-L469 HydrophobicContact CD2-CD2 4.34Å; Y95-G471 WeakPolarHBondContact OH-CA 3.48Å
96	F	89.9	Confident	85.8	Confident	2 Å²	2	16.5 Å²	16.5	1%	0.009	9%	0.089	C	C	.	.	H	α-helix	trans	-58.4	-46.5	178.4	170	-91.8	0	0	0	111.9	F32 F35 V48 F51 L52 V64 V68 S92 F93 A99 W100	F32-F96 HydrophobicContact CE1-CD1 4.28Å; F32-F96 HydrophobicContact CE1-CD2 4.1Å; F32-F96 HydrophobicContact CE1-CE1 4.01Å; F32-F96 AromaticContact CE1-CE2 3.8Å; F32-F96 HydrophobicContact CE1-CE2 3.8Å; F32-F96 HydrophobicContact CE1-CG 4.35Å; F32-F96 AromaticContact CE1-CZ 3.77Å; F32-F96 HydrophobicContact CE1-CZ 3.77Å; F32-F96 HydrophobicContact CZ-CE1 4.31Å; F32-F96 HydrophobicContact CZ-CE2 4.29Å; F32-F96 AromaticContact CZ-CZ 3.94Å; F32-F96 HydrophobicContact CZ-CZ 3.94Å; F35-F96 HydrophobicContact CD2-CD2 4.25Å; F35-F96 HydrophobicContact CE2-CD2 4.03Å; F35-F96 HydrophobicContact CE2-CE2 4.02Å; V48-F96 HydrophobicContact CG1-CD2 3.99Å; F51-F96 AromaticContact CD1-CE2 3.73Å; F51-F96 HydrophobicContact CD1-CE2 3.73Å; F51-F96 HydrophobicContact CD1-CZ 4.09Å; F51-F96 AromaticContact CE1-CE2 3.99Å; F51-F96 HydrophobicContact CE1-CE2 3.99Å; F51-F96 AromaticContact CE1-CZ 3.88Å; F51-F96 HydrophobicContact CE1-CZ 3.88Å; L52-F96 HydrophobicContact CD2-CD2 4.5Å; L52-F96 HydrophobicContact CD2-CE2 3.73Å; L52-F96 HydrophobicContact CD2-CZ 3.83Å; L52-F96 HydrophobicContact CG-CE2 4.11Å; V64-F96 HydrophobicContact CG1-CE1 4.49Å; V64-F96 HydrophobicContact CG1-CZ 4.18Å; V68-F96 HydrophobicContact CG2-CD1 4.32Å; V68-F96 HydrophobicContact CG2-CE1 3.86Å; S92-F96 WeakPolarHBondContact O-CB 3.48Å; S92-F96 PolarHBondContact O-N 3.42Å; F93-F96 PolarHBondContact O-N 3.27Å; F96-A99 PolarHBondContact O-N 2.8Å; F96-W100 AromaticContact CE1-CE3 3.93Å; F96-W100 HydrophobicContact CE1-CE3 3.93Å; F96-W100 HydrophobicContact CE1-CZ3 4.28Å; F96-W100 HydrophobicContact CZ-CE3 4.31Å; F96-W100 PolarHBondContact O-N 2.75Å; F96-W100 VanDerWaalsContact O-N 3.08Å
97	L	91.6	Very high	85.9	Confident	1 Å²	1	18.3 Å²	18.3	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-70.6	-36.3	178.2	-66.7	179.4	0	0	0	112.1	V68 F93 L94 Y95 W100 L101 L121 L125 W128 L186	V68-L97 HydrophobicContact CG1-CD1 4.48Å; V68-L97 HydrophobicContact CG1-CD2 4.35Å; F93-L97 WeakPolarHBondContact O-CG 3.47Å; F93-L97 PolarHBondContact O-N 2.83Å; L94-L97 PolarHBondContact O-N 3.13Å; Y95-L97 PolarHBondContact O-N 2.83Å; L97-W100 HydrophobicContact CD2-CE3 4.05Å; L97-W100 PolarHBondContact O-N 2.9Å; L97-L101 WeakPolarHBondContact O-CG 3.34Å; L97-L101 PolarHBondContact O-N 3.45Å; L97-L121 HydrophobicContact CD1-CD1 4Å; L97-L121 HydrophobicContact CD2-CD1 3.78Å; L97-L121 HydrophobicContact CG-CD1 4.39Å; L97-L125 HydrophobicContact CD1-CD2 3.83Å; L97-W128 HydrophobicContact CD1-CE3 4.5Å; L97-W128 HydrophobicContact CD1-CH2 3.7Å; L97-W128 HydrophobicContact CD1-CZ3 3.61Å; L97-L186 HydrophobicContact CB-CD1 4.18Å; L97-L186 HydrophobicContact CB-CD2 3.98Å; L97-L186 HydrophobicContact CD1-CD2 4.43Å
98	G	89.2	Confident	86.1	Confident	3 Å²	3	17.4 Å²	17.4	3%	0.031	9%	0.092	C	C	.	.	H	α-helix	trans	-61.5	-43.2	173	0	0	0	0	0	112.6	L94 Y95 W100 L101 Q102	L94-G98 PolarHBondContact O-N 3.15Å; Y95-G98 PolarHBondContact O-N 3.15Å; G98-W100 VanDerWaalsContact C-N 3.34Å; G98-W100 PolarHBondContact O-N 3.27Å; G98-L101 PolarHBondContact O-N 2.84Å; G98-Q102 WeakPolarHBondContact O-CG 3.28Å; G98-Q102 PolarHBondContact O-N 2.85Å; G98-Q102 PolarHBondContact O-NE2 3.22Å
99	A	86.7	Confident	86.5	Confident	6 Å²	6	16.9 Å²	16.9	5%	0.05	9%	0.086	C	C	.	.	H	α-helix	trans	-66.3	-33.4	174.7	0	0	0	0	0	112.7	V48 L52 Y95 F96 L101 Q102	V48-A99 HydrophobicContact CG1-CB 4.37Å; L52-A99 HydrophobicContact CD1-CB 3.77Å; Y95-A99 WeakPolarHBondContact O-CB 3.21Å; Y95-A99 PolarHBondContact O-N 2.93Å; F96-A99 PolarHBondContact O-N 2.8Å; A99-L101 VanDerWaalsContact C-N 3.35Å; A99-Q102 PolarHBondContact O-N 3.36Å
100	W	91.7	Very high	86.5	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-68.3	-33.3	174.3	-157.9	-4.7	0	0	0	112.4	L52 Y55 M61 V64 L65 F96 L97 G98 Q102 H105 V106 D108 F109	L52-W100 HydrophobicContact CD2-CB 3.92Å; L52-W100 HydrophobicContact CD2-CD2 4.1Å; L52-W100 HydrophobicContact CD2-CG 3.76Å; Y55-W100 HydrophobicContact CE1-CZ2 4.38Å; Y55-W100 HydrophobicContact CE2-CZ2 4.42Å; Y55-W100 AromaticContact CZ-CZ2 3.93Å; M61-W100 HydrophobicContact CE-CZ2 3.82Å; M61-W100 HydrophobicContact CG-CH2 3.89Å; M61-W100 HydrophobicContact CG-CZ2 3.83Å; M61-W100 HydrophobicContact SD-CZ2 4.48Å; V64-W100 HydrophobicContact CB-CH2 3.93Å; V64-W100 HydrophobicContact CB-CZ3 4.42Å; V64-W100 HydrophobicContact CG1-CH2 3.55Å; V64-W100 HydrophobicContact CG1-CZ2 4.49Å; V64-W100 HydrophobicContact CG1-CZ3 3.63Å; L65-W100 HydrophobicContact CD2-CH2 4.28Å; L65-W100 HydrophobicContact CD2-CZ3 3.78Å; L65-W100 HydrophobicContact CG-CH2 4.19Å; L65-W100 HydrophobicContact CG-CZ3 4.17Å; F96-W100 AromaticContact CE1-CE3 3.93Å; F96-W100 HydrophobicContact CE1-CE3 3.93Å; F96-W100 HydrophobicContact CE1-CZ3 4.28Å; F96-W100 HydrophobicContact CZ-CE3 4.31Å; F96-W100 PolarHBondContact O-N 2.75Å; F96-W100 VanDerWaalsContact O-N 3.08Å; L97-W100 HydrophobicContact CD2-CE3 4.05Å; L97-W100 PolarHBondContact O-N 2.9Å; G98-W100 VanDerWaalsContact C-N 3.34Å; G98-W100 PolarHBondContact O-N 3.27Å; W100-Q102 VanDerWaalsContact C-N 3.27Å; W100-Q102 PolarHBondContact O-N 2.82Å; W100-H105 CarbonylContact O-C 3.53Å; W100-H105 VanDerWaalsContact O-C 3.29Å; W100-H105 WeakPolarHBondContact O-CB 3.09Å; W100-V106 PolarHBondContact O-N 3.25Å; W100-D108 PolarHBondContact NE1-OD2 2.82Å; W100-F109 AromaticContact CD1-CE2 3.87Å; W100-F109 HydrophobicContact CD2-CZ 4.09Å; W100-F109 AromaticContact CE2-CZ 3.95Å; W100-F109 HydrophobicContact CG-CE2 4.24Å; W100-F109 HydrophobicContact CG-CZ 4.26Å; W100-F109 HydrophobicContact CZ2-CZ 4.44Å; W100-F109 AromaticContact NE1-CZ 4Å
101	L	89.8	Confident	86.4	Confident	6 Å²	6	18.5 Å²	18.5	3%	0.031	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-1.1	178.5	-71.7	167.9	0	0	0	114.2	L97 G98 A99 V106 F109 L118 L121 L186 A190 C193	L97-L101 WeakPolarHBondContact O-CG 3.34Å; L97-L101 PolarHBondContact O-N 3.45Å; G98-L101 PolarHBondContact O-N 2.84Å; A99-L101 VanDerWaalsContact C-N 3.35Å; L101-V106 WeakPolarHBondContact O-CB 3Å; L101-F109 HydrophobicContact CD2-CE2 4.22Å; L101-L118 HydrophobicContact CD2-CD1 3.79Å; L101-L121 HydrophobicContact CD1-CD2 4.4Å; L101-L121 HydrophobicContact CD2-CD2 3.96Å; L101-L121 HydrophobicContact CG-CD2 4.22Å; L101-L186 HydrophobicContact CD1-CD1 3.84Å; L101-A190 HydrophobicContact CD1-CB 3.73Å; L101-C193 HydrophobicContact CD2-CB 4.33Å
102	Q	84.7	Confident	86.2	Confident	39 Å²	39	20.6 Å²	20.6	18%	0.182	11%	0.109	C	C	.	.	S	Bend	trans	-105.7	165.7	179.3	-71.3	170.7	29.4	0	0	112.5	G98 A99 W100 H105 V106 L469	G98-Q102 WeakPolarHBondContact O-CG 3.28Å; G98-Q102 PolarHBondContact O-N 2.85Å; G98-Q102 PolarHBondContact O-NE2 3.22Å; A99-Q102 PolarHBondContact O-N 3.36Å; W100-Q102 VanDerWaalsContact C-N 3.27Å; W100-Q102 PolarHBondContact O-N 2.82Å; Q102-H105 CarbonylContact O-C 3.55Å; Q102-H105 WeakPolarHBondContact O-CA 3.37Å; Q102-H105 PolarHBondContact O-N 3.09Å; Q102-V106 PolarHBondContact O-N 3.32Å; Q102-L469 PolarHBondContact NE2-O 2.96Å
103	Q	80.6	Confident	86.2	Confident	101 Å²	101	27.1 Å²	27.1	47%	0.472	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	138.8	174.5	-70.9	-72.3	-9.4	0	0	111.2	V106 F707	Q103-V106 VanDerWaalsContact CD-CG1 3.47Å; Q103-V106 HydrophobicContact CG-CG1 3.92Å; Q103-V106 VanDerWaalsContact NE2-CG1 3.3Å; Q103-F707 HydrophobicContact CB-CZ 4.25Å
104	P	82.8	Confident	86.1	Confident	14 Å²	14	29.4 Å²	29.4	9%	0.091	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	cis	-83.3	-13	4.8	32.8	-35.5	0	0	0	115	Y53 V106 K107 L281 F707	Y53-P104 HydrophobicContact CE1-CG 4.24Å; Y53-P104 HydrophobicContact CE2-CG 4.18Å; P104-V106 VanDerWaalsContact C-N 3.32Å; P104-V106 PolarHBondContact O-N 3.01Å; P104-K107 WeakPolarHBondContact O-CB 3.08Å; P104-K107 PolarHBondContact O-N 3.23Å; P104-L281 HydrophobicContact CB-CD1 3.81Å; P104-L281 HydrophobicContact CG-CD1 3.92Å; P104-F707 HydrophobicContact CB-CD2 3.84Å; P104-F707 HydrophobicContact CB-CE2 3.79Å; P104-F707 HydrophobicContact CB-CG 4.49Å; P104-F707 HydrophobicContact CB-CZ 4.39Å; P104-F707 HydrophobicContact CG-CD2 4.17Å; P104-F707 HydrophobicContact CG-CE2 4.27Å; P104-F707 HydrophobicContact CG-CG 4.35Å
105	H	88	Confident	86	Confident	10 Å²	10	29.6 Å²	29.6	5%	0.046	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-70.9	-20.1	-166.2	-55.2	-63.9	0	0	0	114.8	L52 Y53 W100 Q102 K107 D108	L52-H105 PolarHBondContact O-CE1 2.8Å; L52-H105 PolarHBondContact O-ND1 3.44Å; Y53-H105 AromaticContact CD2-CE1 3.2Å; Y53-H105 WeakPolarHBondContact CD2-CE1 3.28Å; Y53-H105 AromaticContact CD2-NE2 3.28Å; Y53-H105 VanDerWaalsContact CD2-NE2 3.28Å; Y53-H105 WeakPolarHBondContact CD2-NE2 3.4Å; Y53-H105 AromaticContact CE2-CE1 3.52Å; Y53-H105 AromaticContact CE2-NE2 3.22Å; Y53-H105 WeakPolarHBondContact CE2-NE2 3.48Å; Y53-H105 AromaticContact CG-CE1 3.76Å; Y53-H105 PolarHBondContact N-CE1 2.73Å; W100-H105 CarbonylContact O-C 3.53Å; W100-H105 VanDerWaalsContact O-C 3.29Å; W100-H105 WeakPolarHBondContact O-CB 3.09Å; Q102-H105 CarbonylContact O-C 3.55Å; Q102-H105 WeakPolarHBondContact O-CA 3.37Å; Q102-H105 PolarHBondContact O-N 3.09Å; H105-K107 PolarHBondContact O-N 3.39Å; H105-K107 VanDerWaalsContact O-N 3.16Å; H105-D108 WeakPolarHBondContact O-CA 3.48Å; H105-D108 WeakPolarHBondContact O-CB 3.36Å; H105-D108 PolarHBondContact O-N 3.26Å
106	V	86.6	Confident	86	Confident	20 Å²	20	34.1 Å²	34.1	12%	0.121	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-60.9	-23.5	172.3	72.4	0	0	0	0	112.9	W100 L101 Q102 Q103 P104 D108 F109 I197	W100-V106 PolarHBondContact O-N 3.25Å; L101-V106 WeakPolarHBondContact O-CB 3Å; Q102-V106 PolarHBondContact O-N 3.32Å; Q103-V106 VanDerWaalsContact CD-CG1 3.47Å; Q103-V106 HydrophobicContact CG-CG1 3.92Å; Q103-V106 VanDerWaalsContact NE2-CG1 3.3Å; P104-V106 VanDerWaalsContact C-N 3.32Å; P104-V106 PolarHBondContact O-N 3.01Å; V106-D108 PolarHBondContact O-N 3.4Å; V106-D108 VanDerWaalsContact O-N 3.11Å; V106-F109 PolarHBondContact O-N 2.99Å; V106-F109 VanDerWaalsContact O-N 3.07Å; V106-I197 HydrophobicContact CG2-CD1 4.38Å
107	K	85.1	Confident	85.9	Confident	54 Å²	54	35.8 Å²	35.8	24%	0.235	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-58.2	-19.9	168.8	-72.4	-171.1	169.5	-167.7	0	112.8	P104 H105 F109 D110 L277	P104-K107 WeakPolarHBondContact O-CB 3.08Å; P104-K107 PolarHBondContact O-N 3.23Å; H105-K107 PolarHBondContact O-N 3.39Å; H105-K107 VanDerWaalsContact O-N 3.16Å; K107-F109 PolarHBondContact O-N 3.47Å; K107-D110 PolarHBondContact O-N 3.46Å; K107-L277 PolarHBondContact NZ-O 3.5Å
108	D	86.7	Confident	85.8	Confident	7 Å²	7	35.8 Å²	35.8	4%	0.037	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-64.3	-24.7	176.6	-58.9	-6	0	0	0	112.3	Y55 R56 M61 W100 H105 V106 K114	Y55-D108 PolarHBondContact OH-OD2 3.34Å; R56-D108 IonicContact CZ-OD1 3.58Å; R56-D108 IonicContact CZ-OD2 3.79Å; R56-D108 VanDerWaalsContact NH1-CG 3.27Å; R56-D108 IonicContact NH1-OD1 3.6Å; R56-D108 PolarHBondContact NH1-OD1 3.02Å; R56-D108 IonicContact NH1-OD2 2.67Å; R56-D108 PolarHBondContact NH1-OD2 3.36Å; R56-D108 IonicContact NH2-OD1 3.54Å; R56-D108 PolarHBondContact NH2-OD1 3.33Å; R56-D108 IonicContact NH2-OD2 2.82Å; M61-D108 HydrophobicContact CE-CB 3.48Å; M61-D108 VanDerWaalsContact CE-CB 3.48Å; M61-D108 WeakPolarHBondContact CE-O 3.47Å; W100-D108 PolarHBondContact NE1-OD2 2.82Å; H105-D108 WeakPolarHBondContact O-CA 3.48Å; H105-D108 WeakPolarHBondContact O-CB 3.36Å; H105-D108 PolarHBondContact O-N 3.26Å; V106-D108 PolarHBondContact O-N 3.4Å; V106-D108 VanDerWaalsContact O-N 3.11Å; D108-K114 WeakPolarHBondContact O-CB 3.37Å; D108-K114 WeakPolarHBondContact O-CD 3.42Å
109	F	88.5	Confident	85.7	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103	-10	178.2	-53.7	-73.3	0	0	0	113.5	M61 W100 L101 V106 K107 S111 L118 L121 I197	M61-F109 HydrophobicContact CE-CD1 3.97Å; M61-F109 HydrophobicContact CE-CE1 3.66Å; M61-F109 HydrophobicContact CE-CZ 4.1Å; M61-F109 HydrophobicContact SD-CD1 3.9Å; M61-F109 HydrophobicContact SD-CE1 3.53Å; M61-F109 VanDerWaalsContact SD-CE1 3.53Å; M61-F109 HydrophobicContact SD-CZ 4.41Å; W100-F109 AromaticContact CD1-CE2 3.87Å; W100-F109 HydrophobicContact CD2-CZ 4.09Å; W100-F109 AromaticContact CE2-CZ 3.95Å; W100-F109 HydrophobicContact CG-CE2 4.24Å; W100-F109 HydrophobicContact CG-CZ 4.26Å; W100-F109 HydrophobicContact CZ2-CZ 4.44Å; W100-F109 AromaticContact NE1-CZ 4Å; L101-F109 HydrophobicContact CD2-CE2 4.22Å; V106-F109 PolarHBondContact O-N 2.99Å; V106-F109 VanDerWaalsContact O-N 3.07Å; K107-F109 PolarHBondContact O-N 3.47Å; F109-S111 PolarHBondContact O-N 2.89Å; F109-L118 HydrophobicContact CB-CB 4.07Å; F109-L118 HydrophobicContact CB-CD2 4.03Å; F109-L118 HydrophobicContact CB-CG 4.49Å; F109-L118 HydrophobicContact CD1-CB 3.67Å; F109-L118 HydrophobicContact CD1-CD1 4.22Å; F109-L118 HydrophobicContact CD1-CG 4.43Å; F109-L118 HydrophobicContact CD2-CD1 4.42Å; F109-L118 HydrophobicContact CE1-CB 4.4Å; F109-L118 HydrophobicContact CE1-CD1 4.47Å; F109-L118 HydrophobicContact CG-CB 4.02Å; F109-L118 HydrophobicContact CG-CD1 4.18Å; F109-L118 HydrophobicContact CG-CD2 4.41Å; F109-L118 HydrophobicContact CG-CG 4.43Å; F109-L121 HydrophobicContact CE1-CD2 4.45Å; F109-L121 HydrophobicContact CZ-CD2 3.95Å; F109-I197 HydrophobicContact CB-CD1 3.86Å
110	D	84.2	Confident	85.8	Confident	47 Å²	47	40.5 Å²	40.5	25%	0.251	21%	0.207	S	C	.	.			trans	-78.2	58.9	-171.9	-171.4	10.6	0	0	0	113	K107 K200 H201	K107-D110 PolarHBondContact O-N 3.46Å; D110-K200 WeakPolarHBondContact OD1-CD 3.49Å; D110-K200 WeakPolarHBondContact OD1-CE 3.18Å; D110-K200 IonicContact OD1-NZ 2.69Å; D110-K200 PolarHBondContact OD1-NZ 3.46Å; D110-K200 IonicContact OD2-NZ 3.81Å; D110-K200 PolarHBondContact OD2-NZ 3.44Å; D110-H201 IonicContact OD1-CD2 3.75Å; D110-H201 IonicContact OD1-CE1 3.21Å; D110-H201 IonicContact OD1-NE2 3.39Å; D110-H201 PolarHBondContact OD1-NE2 2.83Å
111	S	81.5	Confident	85.8	Confident	16 Å²	16	40.5 Å²	40.5	11%	0.112	21%	0.207	C	C	.	.	S	Bend	trans	-154	146.7	173.6	136	0	0	0	0	110.7	F109 Q113 K114 I115	F109-S111 PolarHBondContact O-N 2.89Å; S111-Q113 PolarHBondContact O-N 3.22Å; S111-Q113 VanDerWaalsContact O-N 3.09Å; S111-Q113 PolarHBondContact OG-N 2.91Å; S111-Q113 VanDerWaalsContact OG-N 3.12Å; S111-Q113 PolarHBondContact OG-OE1 2.87Å; S111-K114 PolarHBondContact O-N 2.99Å; S111-K114 VanDerWaalsContact O-N 3.11Å; S111-K114 PolarHBondContact OG-N 3.09Å; S111-K114 VanDerWaalsContact OG-N 3.14Å; S111-I115 PolarHBondContact O-N 3.28Å
112	P	78.9	Confident	85.7	Confident	67 Å²	67	40.2 Å²	40.2	44%	0.435	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-23.3	176.6	-23.6	33.3	0	0	0	114.2	I115 H201 I203	P112-I115 WeakPolarHBondContact O-CG2 3.27Å; P112-H201 HydrophobicContact CG-CB 4.16Å; P112-I203 HydrophobicContact CB-CD1 4.27Å
113	Q	82.4	Confident	85.8	Confident	144 Å²	144	42.2 Å²	42.2	67%	0.673	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-45.3	174	-57.5	80.9	7.7	0	0	111.1	S111 I115 I116	S111-Q113 PolarHBondContact O-N 3.22Å; S111-Q113 VanDerWaalsContact O-N 3.09Å; S111-Q113 PolarHBondContact OG-N 2.91Å; S111-Q113 VanDerWaalsContact OG-N 3.12Å; S111-Q113 PolarHBondContact OG-OE1 2.87Å; Q113-I115 VanDerWaalsContact C-N 3.28Å; Q113-I115 PolarHBondContact O-N 3.34Å; Q113-I116 WeakPolarHBondContact O-CG2 3.22Å
114	K	84.8	Confident	86.1	Confident	55 Å²	55	38.6 Å²	38.6	24%	0.239	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-21.9	-175.9	-58.4	-178.3	-157.5	169.7	0	113.1	D108 S111 I116 H117 E280	D108-K114 WeakPolarHBondContact O-CB 3.37Å; D108-K114 WeakPolarHBondContact O-CD 3.42Å; S111-K114 PolarHBondContact O-N 2.99Å; S111-K114 VanDerWaalsContact O-N 3.11Å; S111-K114 PolarHBondContact OG-N 3.09Å; S111-K114 VanDerWaalsContact OG-N 3.14Å; K114-I116 PolarHBondContact O-N 3.4Å; K114-H117 PolarHBondContact O-CD2 2.96Å; K114-H117 PolarHBondContact O-N 2.69Å; K114-E280 IonicContact NZ-OE1 3.46Å; K114-E280 PolarHBondContact NZ-OE1 3.38Å
115	I	85.9	Confident	86.4	Confident	12 Å²	12	37.9 Å²	37.9	6%	0.062	19%	0.19	C	C	.	.	H	α-helix	trans	-57	-23.2	178.3	-160.7	174.1	0	0	0	114.1	S111 P112 Q113 H117 L118 K119 L194 I197 A198 I203	S111-I115 PolarHBondContact O-N 3.28Å; P112-I115 WeakPolarHBondContact O-CG2 3.27Å; Q113-I115 VanDerWaalsContact C-N 3.28Å; Q113-I115 PolarHBondContact O-N 3.34Å; I115-H117 VanDerWaalsContact C-N 3.27Å; I115-H117 PolarHBondContact O-N 3.43Å; I115-L118 PolarHBondContact O-N 3.28Å; I115-K119 PolarHBondContact O-N 2.89Å; I115-L194 HydrophobicContact CD1-CD1 3.9Å; I115-L194 HydrophobicContact CG1-CD1 3.73Å; I115-I197 HydrophobicContact CD1-CG2 4.15Å; I115-I197 HydrophobicContact CG1-CG2 4.36Å; I115-A198 HydrophobicContact CD1-CB 4.16Å; I115-I203 HydrophobicContact CD1-CD1 3.86Å; I115-I203 HydrophobicContact CG2-CD1 4.08Å
116	I	86	Confident	86.2	Confident	112 Å²	112	37.5 Å²	37.5	57%	0.574	19%	0.189	S	C	*	.	H	α-helix	trans	-62.3	-35.5	175.5	-163.2	171	0	0	0	111.9	Q113 K114 K119 C120	Q113-I116 WeakPolarHBondContact O-CG2 3.22Å; K114-I116 PolarHBondContact O-N 3.4Å; I116-K119 PolarHBondContact O-N 3.47Å; I116-C120 PolarHBondContact O-N 3.43Å
117	H	89.1	Confident	85.9	Confident	38 Å²	38	37.5 Å²	37.5	18%	0.176	19%	0.193	C	C	.	.	H	α-helix	trans	-74.8	-31.3	176.8	-47.5	-63.4	0	0	0	111.7	M61 E62 L65 K114 I115 C120 L121	M61-H117 HydrophobicContact CG-CB 3.95Å; M61-H117 HydrophobicContact SD-CB 3.2Å; M61-H117 WeakPolarHBondContact SD-CB 3.44Å; M61-H117 VanDerWaalsContact SD-CD2 3.6Å; M61-H117 VanDerWaalsContact SD-CG 3.56Å; E62-H117 IonicContact OE1-CE1 3.31Å; E62-H117 PolarHBondContact OE1-CE1 3Å; E62-H117 VanDerWaalsContact OE1-CE1 3.31Å; E62-H117 IonicContact OE1-ND1 2.82Å; L65-H117 HydrophobicContact CD1-CB 4.28Å; K114-H117 PolarHBondContact O-CD2 2.96Å; K114-H117 PolarHBondContact O-N 2.69Å; I115-H117 VanDerWaalsContact C-N 3.27Å; I115-H117 PolarHBondContact O-N 3.43Å; H117-C120 CarbonylContact O-C 3.58Å; H117-C120 WeakPolarHBondContact O-CA 3.24Å; H117-C120 VanDerWaalsContact O-CB 3.29Å; H117-C120 WeakPolarHBondContact O-CB 3.44Å; H117-C120 PolarHBondContact O-N 3.02Å; H117-C120 VanDerWaalsContact O-N 3.12Å; H117-L121 PolarHBondContact O-N 2.83Å
118	L	89.4	Confident	86	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-65.4	-42	170.4	-174.9	55.1	0	0	0	110.8	L101 F109 I115 C120 L121 V122 C193 L194 I197	L101-L118 HydrophobicContact CD2-CD1 3.79Å; F109-L118 HydrophobicContact CB-CB 4.07Å; F109-L118 HydrophobicContact CB-CD2 4.03Å; F109-L118 HydrophobicContact CB-CG 4.49Å; F109-L118 HydrophobicContact CD1-CB 3.67Å; F109-L118 HydrophobicContact CD1-CD1 4.22Å; F109-L118 HydrophobicContact CD1-CG 4.43Å; F109-L118 HydrophobicContact CD2-CD1 4.42Å; F109-L118 HydrophobicContact CE1-CB 4.4Å; F109-L118 HydrophobicContact CE1-CD1 4.47Å; F109-L118 HydrophobicContact CG-CB 4.02Å; F109-L118 HydrophobicContact CG-CD1 4.18Å; F109-L118 HydrophobicContact CG-CD2 4.41Å; F109-L118 HydrophobicContact CG-CG 4.43Å; I115-L118 PolarHBondContact O-N 3.28Å; L118-C120 PolarHBondContact O-N 3.26Å; L118-L121 HydrophobicContact CD1-CD2 4.32Å; L118-L121 PolarHBondContact O-N 3.06Å; L118-V122 HydrophobicContact CD1-CG2 4.31Å; L118-V122 HydrophobicContact CG-CG2 4.46Å; L118-V122 VanDerWaalsContact O-CB 3.27Å; L118-V122 WeakPolarHBondContact O-CB 3.33Å; L118-V122 WeakPolarHBondContact O-CG2 3.17Å; L118-V122 PolarHBondContact O-N 3.08Å; L118-C193 HydrophobicContact CD2-CB 4.45Å; L118-L194 HydrophobicContact CD2-CB 3.97Å; L118-L194 HydrophobicContact CD2-CD1 4.06Å; L118-L194 HydrophobicContact CG-CB 4.26Å; L118-L194 HydrophobicContact CG-CD1 4.19Å; L118-I197 HydrophobicContact CD2-CD1 3.9Å
119	K	87.5	Confident	85.8	Confident	53 Å²	53	34.7 Å²	34.7	23%	0.23	18%	0.18	C	C	.	.	H	α-helix	trans	-62.6	-28.3	170.2	-70.7	-166	176.9	-159.4	0	112.8	I115 I116 R123 C151 L194 L205	I115-K119 PolarHBondContact O-N 2.89Å; I116-K119 PolarHBondContact O-N 3.47Å; K119-R123 WeakPolarHBondContact O-CG 3.4Å; K119-R123 PolarHBondContact O-N 3Å; K119-R123 VanDerWaalsContact O-N 3.1Å; K119-C151 PolarHBondContact NZ-O 3.12Å; K119-L194 HydrophobicContact CG-CD1 3.87Å; K119-L194 HydrophobicContact CG-CD2 4.11Å; K119-L205 VanDerWaalsContact CE-CD2 3.44Å
120	C	88.3	Confident	85.3	Confident	56 Å²	56	36.7 Å²	36.7	38%	0.378	19%	0.191	S	C	.	.	H	α-helix	trans	-71.2	-48.6	172.5	-167	0	0	0	0	111.8	L65 I116 H117 L118 V122 R123 I124	L65-C120 HydrophobicContact CD1-CB 4.31Å; I116-C120 PolarHBondContact O-N 3.43Å; H117-C120 CarbonylContact O-C 3.58Å; H117-C120 WeakPolarHBondContact O-CA 3.24Å; H117-C120 VanDerWaalsContact O-CB 3.29Å; H117-C120 WeakPolarHBondContact O-CB 3.44Å; H117-C120 PolarHBondContact O-N 3.02Å; H117-C120 VanDerWaalsContact O-N 3.12Å; L118-C120 PolarHBondContact O-N 3.26Å; C120-V122 VanDerWaalsContact C-N 3.33Å; C120-V122 PolarHBondContact O-N 3.35Å; C120-R123 WeakPolarHBondContact O-CB 3.4Å; C120-R123 PolarHBondContact O-N 2.97Å; C120-R123 VanDerWaalsContact O-N 3.11Å; C120-I124 WeakPolarHBondContact O-CG1 3.43Å; C120-I124 PolarHBondContact O-N 2.85Å
121	L	91	Very high	85	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-57.4	-45.2	173.6	173.9	57	0	0	0	111.7	L65 L97 L101 F109 H117 L118 R123 I124 L125	L65-L121 HydrophobicContact CD2-CB 3.98Å; L65-L121 HydrophobicContact CD2-CD1 3.93Å; L65-L121 HydrophobicContact CD2-CG 4.42Å; L97-L121 HydrophobicContact CD1-CD1 4Å; L97-L121 HydrophobicContact CD2-CD1 3.78Å; L97-L121 HydrophobicContact CG-CD1 4.39Å; L101-L121 HydrophobicContact CD1-CD2 4.4Å; L101-L121 HydrophobicContact CD2-CD2 3.96Å; L101-L121 HydrophobicContact CG-CD2 4.22Å; F109-L121 HydrophobicContact CE1-CD2 4.45Å; F109-L121 HydrophobicContact CZ-CD2 3.95Å; H117-L121 PolarHBondContact O-N 2.83Å; L118-L121 HydrophobicContact CD1-CD2 4.32Å; L118-L121 PolarHBondContact O-N 3.06Å; L121-R123 VanDerWaalsContact C-N 3.31Å; L121-R123 PolarHBondContact O-N 2.69Å; L121-I124 PolarHBondContact O-N 2.74Å; L121-I124 VanDerWaalsContact O-N 3.13Å; L121-L125 HydrophobicContact CD1-CD1 4.09Å; L121-L125 HydrophobicContact CD1-CG 4.06Å; L121-L125 HydrophobicContact CG-CD1 4.14Å; L121-L125 WeakPolarHBondContact O-CB 3.28Å; L121-L125 WeakPolarHBondContact O-CG 3.47Å; L121-L125 PolarHBondContact O-N 2.97Å
122	V	88.7	Confident	84.6	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61	-36.4	175.7	166.1	0	0	0	0	111.5	L118 C120 A126 F148 C152 A190 L194	L118-V122 HydrophobicContact CD1-CG2 4.31Å; L118-V122 HydrophobicContact CG-CG2 4.46Å; L118-V122 VanDerWaalsContact O-CB 3.27Å; L118-V122 WeakPolarHBondContact O-CB 3.33Å; L118-V122 WeakPolarHBondContact O-CG2 3.17Å; L118-V122 PolarHBondContact O-N 3.08Å; C120-V122 VanDerWaalsContact C-N 3.33Å; C120-V122 PolarHBondContact O-N 3.35Å; V122-A126 WeakPolarHBondContact O-CB 3.39Å; V122-A126 PolarHBondContact O-N 3Å; V122-A126 VanDerWaalsContact O-N 3.08Å; V122-F148 HydrophobicContact CB-CE1 4.33Å; V122-F148 HydrophobicContact CG1-CD1 3.46Å; V122-F148 VanDerWaalsContact CG1-CD1 3.46Å; V122-F148 HydrophobicContact CG1-CE1 3.63Å; V122-F148 WeakPolarHBondContact O-CD1 3.27Å; V122-F148 WeakPolarHBondContact O-CE1 3.33Å; V122-C152 WeakPolarHBondContact CG1-SG 3.46Å; V122-A190 HydrophobicContact CG2-CB 3.91Å; V122-L194 HydrophobicContact CG1-CD2 4.22Å; V122-L194 HydrophobicContact CG2-CD2 4.26Å
123	R	85.5	Confident	84.1	Confident	81 Å²	81	35.1 Å²	35.1	31%	0.306	18%	0.175	S	C	.	.	H	α-helix	trans	-67.3	-43	169.8	-81.9	-174.5	134	74.9	21.8	113.6	K119 C120 L121 A126 G127 C152 G153 N155 V156	K119-R123 WeakPolarHBondContact O-CG 3.4Å; K119-R123 PolarHBondContact O-N 3Å; K119-R123 VanDerWaalsContact O-N 3.1Å; C120-R123 WeakPolarHBondContact O-CB 3.4Å; C120-R123 PolarHBondContact O-N 2.97Å; C120-R123 VanDerWaalsContact O-N 3.11Å; L121-R123 VanDerWaalsContact C-N 3.31Å; L121-R123 PolarHBondContact O-N 2.69Å; R123-A126 PolarHBondContact O-N 2.96Å; R123-G127 PolarHBondContact O-N 2.64Å; R123-C152 HydrophobicContact CG-CB 4.18Å; R123-C152 PolarHBondContact NH1-O 3.45Å; R123-C152 PolarHBondContact NH2-O 3.16Å; R123-G153 PolarHBondContact NH2-O 3.43Å; R123-N155 PolarHBondContact NE-O 3.23Å; R123-N155 PolarHBondContact NH2-O 3.07Å; R123-V156 HydrophobicContact CG-CG2 4.46Å
124	I	87.2	Confident	83.3	Confident	24 Å²	24	28.9 Å²	28.9	12%	0.123	15%	0.147	C	C	.	.	H	α-helix	trans	-61.7	-47.8	179.3	-70.3	163.4	0	0	0	109.3	L65 N69 C120 L121 A126 G127 W128	L65-I124 HydrophobicContact CB-CD1 4.02Å; L65-I124 HydrophobicContact CD2-CD1 4.3Å; N69-I124 HydrophobicContact CB-CD1 4.26Å; N69-I124 HydrophobicContact CB-CG1 4.42Å; N69-I124 HydrophobicContact CB-CG2 4.07Å; C120-I124 WeakPolarHBondContact O-CG1 3.43Å; C120-I124 PolarHBondContact O-N 2.85Å; L121-I124 PolarHBondContact O-N 2.74Å; L121-I124 VanDerWaalsContact O-N 3.13Å; I124-A126 PolarHBondContact O-N 2.8Å; I124-G127 PolarHBondContact O-N 2.92Å; I124-W128 HydrophobicContact CG2-CD2 4.27Å; I124-W128 HydrophobicContact CG2-CZ2 3.93Å; I124-W128 PolarHBondContact O-N 3.25Å
125	L	88.3	Confident	82.1	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-60.3	-41.6	175.6	-69.7	173.2	0	0	0	112.4	L97 L121 G127 W128 F129 F148 M183 L186 A190	L97-L125 HydrophobicContact CD1-CD2 3.83Å; L121-L125 HydrophobicContact CD1-CD1 4.09Å; L121-L125 HydrophobicContact CD1-CG 4.06Å; L121-L125 HydrophobicContact CG-CD1 4.14Å; L121-L125 WeakPolarHBondContact O-CB 3.28Å; L121-L125 WeakPolarHBondContact O-CG 3.47Å; L121-L125 PolarHBondContact O-N 2.97Å; L125-G127 PolarHBondContact O-N 2.86Å; L125-W128 HydrophobicContact CD2-CE3 4.32Å; L125-W128 PolarHBondContact O-N 3.41Å; L125-F129 VanDerWaalsContact O-CB 3.26Å; L125-F129 WeakPolarHBondContact O-CB 3.32Å; L125-F129 PolarHBondContact O-N 3.41Å; L125-F148 HydrophobicContact CB-CE1 4.44Å; L125-F148 HydrophobicContact CB-CZ 4.1Å; L125-M183 HydrophobicContact CB-CE 4.07Å; L125-M183 HydrophobicContact CD2-CE 3.66Å; L125-M183 HydrophobicContact CD2-SD 4.26Å; L125-M183 HydrophobicContact CG-CE 4.49Å; L125-M183 WeakPolarHBondContact O-CE 3.26Å; L125-L186 HydrophobicContact CD1-CG 4.21Å; L125-L186 HydrophobicContact CD2-CD2 3.55Å; L125-L186 HydrophobicContact CD2-CG 3.99Å; L125-A190 HydrophobicContact CD1-CB 3.52Å
126	A	83.8	Confident	80.6	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.008	20%	0.2	C	C	.	.	H	α-helix	trans	-60.8	-45	174.4	0	0	0	0	0	112.3	V122 R123 I124 W128 F129 D130 F148 V156	V122-A126 WeakPolarHBondContact O-CB 3.39Å; V122-A126 PolarHBondContact O-N 3Å; V122-A126 VanDerWaalsContact O-N 3.08Å; R123-A126 PolarHBondContact O-N 2.96Å; I124-A126 PolarHBondContact O-N 2.8Å; A126-W128 VanDerWaalsContact C-N 3.32Å; A126-W128 PolarHBondContact O-N 3.38Å; A126-F129 PolarHBondContact O-N 2.88Å; A126-D130 PolarHBondContact O-N 3.4Å; A126-F148 HydrophobicContact CB-CB 3.99Å; A126-F148 HydrophobicContact CB-CD1 3.9Å; A126-F148 HydrophobicContact CB-CD2 3.74Å; A126-F148 HydrophobicContact CB-CE1 4.23Å; A126-F148 HydrophobicContact CB-CE2 4.07Å; A126-F148 HydrophobicContact CB-CG 3.64Å; A126-F148 HydrophobicContact CB-CZ 4.3Å; A126-V156 HydrophobicContact CB-CG1 3.95Å
127	G	82.1	Confident	79.4	Confident	21 Å²	21	38 Å²	38	22%	0.216	19%	0.191	C	C	.	.	H	α-helix	trans	-72	-20.2	178.2	0	0	0	0	0	114.9	R123 I124 L125	R123-G127 PolarHBondContact O-N 2.64Å; I124-G127 PolarHBondContact O-N 2.92Å; L125-G127 PolarHBondContact O-N 2.86Å
128	W	86.8	Confident	78.3	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-79.3	-42.6	166.8	-70	11.5	0	0	0	111	V68 N69 F72 W73 F93 L94 L97 I124 L125 A126 D130 V131 F132 M183	V68-W128 HydrophobicContact CG1-CH2 3.7Å; V68-W128 HydrophobicContact CG1-CZ2 3.98Å; N69-W128 PolarHBondContact OD1-NE1 3.44Å; F72-W128 HydrophobicContact CB-CD2 4.48Å; F72-W128 HydrophobicContact CB-CH2 3.96Å; F72-W128 HydrophobicContact CB-CZ2 3.37Å; F72-W128 AromaticContact CD1-CD1 3.55Å; F72-W128 AromaticContact CD1-CD2 3.93Å; F72-W128 HydrophobicContact CD1-CD2 3.93Å; F72-W128 AromaticContact CD1-CE2 3.62Å; F72-W128 AromaticContact CD1-CG 3.9Å; F72-W128 HydrophobicContact CD1-CG 3.9Å; F72-W128 HydrophobicContact CD1-CZ2 4.26Å; F72-W128 AromaticContact CD1-NE1 3.36Å; F72-W128 AromaticContact CD2-CD2 3.75Å; F72-W128 HydrophobicContact CD2-CD2 3.75Å; F72-W128 AromaticContact CD2-CE2 3.81Å; F72-W128 AromaticContact CD2-CE3 3.82Å; F72-W128 HydrophobicContact CD2-CE3 3.82Å; F72-W128 HydrophobicContact CD2-CG 4.36Å; F72-W128 HydrophobicContact CD2-CH2 4.03Å; F72-W128 AromaticContact CD2-CZ2 3.97Å; F72-W128 HydrophobicContact CD2-CZ2 3.97Å; F72-W128 AromaticContact CD2-CZ3 3.96Å; F72-W128 HydrophobicContact CD2-CZ3 3.96Å; F72-W128 HydrophobicContact CE1-CB 4.16Å; F72-W128 AromaticContact CE1-CD1 3.54Å; F72-W128 HydrophobicContact CE1-CD2 4.03Å; F72-W128 AromaticContact CE1-CG 3.64Å; F72-W128 HydrophobicContact CE1-CG 3.64Å; F72-W128 AromaticContact CE1-NE1 3.87Å; F72-W128 HydrophobicContact CE2-CB 4.5Å; F72-W128 AromaticContact CE2-CD2 3.85Å; F72-W128 HydrophobicContact CE2-CD2 3.85Å; F72-W128 AromaticContact CE2-CE3 3.9Å; F72-W128 HydrophobicContact CE2-CE3 3.9Å; F72-W128 HydrophobicContact CE2-CG 4.12Å; F72-W128 HydrophobicContact CE2-CZ3 4.43Å; F72-W128 AromaticContact CG-CD2 3.79Å; F72-W128 HydrophobicContact CG-CD2 3.79Å; F72-W128 AromaticContact CG-CE2 3.41Å; F72-W128 VanDerWaalsContact CG-CE2 3.41Å; F72-W128 HydrophobicContact CG-CE3 4.29Å; F72-W128 HydrophobicContact CG-CG 4.26Å; F72-W128 HydrophobicContact CG-CH2 4.14Å; F72-W128 AromaticContact CG-CZ2 3.62Å; F72-W128 HydrophobicContact CG-CZ2 3.62Å; F72-W128 HydrophobicContact CG-CZ3 4.45Å; F72-W128 AromaticContact CG-NE1 3.67Å; F72-W128 HydrophobicContact CZ-CB 3.96Å; F72-W128 AromaticContact CZ-CD2 4Å; F72-W128 HydrophobicContact CZ-CD2 4Å; F72-W128 HydrophobicContact CZ-CE3 4.44Å; F72-W128 AromaticContact CZ-CG 3.76Å; F72-W128 HydrophobicContact CZ-CG 3.76Å; W73-W128 AromaticContact NE1-NE1 3.99Å; F93-W128 HydrophobicContact CB-CH2 4.06Å; F93-W128 HydrophobicContact CB-CZ3 4.13Å; L94-W128 HydrophobicContact CD2-CE3 4.41Å; L94-W128 HydrophobicContact CD2-CZ3 4.34Å; L97-W128 HydrophobicContact CD1-CE3 4.5Å; L97-W128 HydrophobicContact CD1-CH2 3.7Å; L97-W128 HydrophobicContact CD1-CZ3 3.61Å; I124-W128 HydrophobicContact CG2-CD2 4.27Å; I124-W128 HydrophobicContact CG2-CZ2 3.93Å; I124-W128 PolarHBondContact O-N 3.25Å; L125-W128 HydrophobicContact CD2-CE3 4.32Å; L125-W128 PolarHBondContact O-N 3.41Å; A126-W128 VanDerWaalsContact C-N 3.32Å; A126-W128 PolarHBondContact O-N 3.38Å; W128-D130 VanDerWaalsContact C-N 3.33Å; W128-D130 PolarHBondContact O-N 3.01Å; W128-V131 WeakPolarHBondContact O-CB 3.47Å; W128-V131 PolarHBondContact O-N 2.98Å; W128-F132 VanDerWaalsContact O-CD2 3.28Å; W128-F132 WeakPolarHBondContact O-CD2 3.34Å; W128-M183 HydrophobicContact CB-CE 3.48Å; W128-M183 VanDerWaalsContact CB-CE 3.48Å; W128-M183 HydrophobicContact CE3-CE 4.18Å; W128-M183 HydrophobicContact CG-CE 4.43Å
129	F	83.1	Confident	77.1	Confident	1 Å²	1	47.3 Å²	47.3	0%	0.004	24%	0.239	C	C	.	.	H	α-helix	trans	-65	-35.6	-177.8	-172.3	-121.1	0	0	0	111.9	L125 A126 V131 F132 H141 I144 L145 T180 M183 E184	L125-F129 VanDerWaalsContact O-CB 3.26Å; L125-F129 WeakPolarHBondContact O-CB 3.32Å; L125-F129 PolarHBondContact O-N 3.41Å; A126-F129 PolarHBondContact O-N 2.88Å; F129-V131 PolarHBondContact O-N 2.84Å; F129-V131 VanDerWaalsContact O-N 3.09Å; F129-F132 CarbonylContact O-C 3.59Å; F129-F132 WeakPolarHBondContact O-CA 3.48Å; F129-F132 PolarHBondContact O-N 3.23Å; F129-H141 AromaticContact CD1-CE1 3.99Å; F129-H141 AromaticContact CD1-ND1 3.8Å; F129-H141 HydrophobicContact CE1-CB 4.29Å; F129-H141 AromaticContact CE1-CE1 3.95Å; F129-H141 AromaticContact CE1-CG 3.85Å; F129-H141 AromaticContact CE1-ND1 3.3Å; F129-H141 VanDerWaalsContact CE1-ND1 3.3Å; F129-H141 WeakPolarHBondContact CE1-ND1 3.24Å; F129-H141 AromaticContact CE2-ND1 3.95Å; F129-H141 HydrophobicContact CZ-CB 4.3Å; F129-H141 AromaticContact CZ-ND1 3.4Å; F129-H141 WeakPolarHBondContact CZ-ND1 3.46Å; F129-H141 PolarHBondContact O-CE1 2.96Å; F129-H141 VanDerWaalsContact O-CE1 3.28Å; F129-I144 HydrophobicContact CD1-CG2 4Å; F129-I144 HydrophobicContact CE1-CB 3.87Å; F129-I144 HydrophobicContact CE1-CD1 4.39Å; F129-I144 HydrophobicContact CE1-CG2 3.62Å; F129-I144 HydrophobicContact CZ-CB 4.45Å; F129-I144 HydrophobicContact CZ-CD1 4.13Å; F129-I144 HydrophobicContact CZ-CG2 4.28Å; F129-L145 HydrophobicContact CD1-CD2 3.83Å; F129-L145 HydrophobicContact CD1-CG 4.09Å; F129-L145 HydrophobicContact CE1-CG 4.4Å; F129-T180 HydrophobicContact CE2-CG2 4.44Å; F129-M183 HydrophobicContact CB-CE 4.04Å; F129-M183 HydrophobicContact CB-CG 4.3Å; F129-M183 HydrophobicContact CD2-CB 4.28Å; F129-M183 HydrophobicContact CD2-CG 3.67Å; F129-M183 HydrophobicContact CG-CG 4.44Å; F129-E184 HydrophobicContact CE2-CB 4.05Å; F129-E184 HydrophobicContact CZ-CB 4.3Å
130	D	77.9	Confident	76.2	Confident	43 Å²	43	45.8 Å²	45.8	23%	0.23	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-25.5	170.3	-167.1	58.9	0	0	0	113.4	A126 W128	A126-D130 PolarHBondContact O-N 3.4Å; W128-D130 VanDerWaalsContact C-N 3.33Å; W128-D130 PolarHBondContact O-N 3.01Å
131	V	77.1	Confident	75.3	Confident	3 Å²	3	43.3 Å²	43.3	2%	0.018	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-27.6	174.8	-168.6	0	0	0	0	112.5	W73 W128 F129 Q133 T164 V167	W73-V131 HydrophobicContact CH2-CG2 3.42Å; W73-V131 VanDerWaalsContact CH2-CG2 3.42Å; W73-V131 HydrophobicContact CZ2-CG2 4.5Å; W73-V131 HydrophobicContact CZ3-CG2 3.83Å; W128-V131 WeakPolarHBondContact O-CB 3.47Å; W128-V131 PolarHBondContact O-N 2.98Å; F129-V131 PolarHBondContact O-N 2.84Å; F129-V131 VanDerWaalsContact O-N 3.09Å; V131-Q133 VanDerWaalsContact C-N 3.35Å; V131-Q133 PolarHBondContact O-N 3.05Å; V131-T164 WeakPolarHBondContact O-CG2 3.39Å; V131-V167 HydrophobicContact CG1-CG1 4.31Å
132	F	73.4	Confident	74.5	Confident	1 Å²	1	46.4 Å²	46.4	0%	0.004	23%	0.234	C	C	.	.			trans	-97	48.6	-176.9	-65.3	-72.2	0	0	0	111.7	F72 I90 W128 F129 P134 L168 W176 V179 T180 M183	F72-F132 HydrophobicContact CE2-CE2 4.11Å; F72-F132 HydrophobicContact CE2-CZ 4.4Å; F72-F132 AromaticContact CZ-CE2 3.9Å; F72-F132 HydrophobicContact CZ-CE2 3.9Å; F72-F132 HydrophobicContact CZ-CZ 4.35Å; I90-F132 HydrophobicContact CD1-CZ 4.28Å; I90-F132 HydrophobicContact CG2-CZ 3.97Å; W128-F132 VanDerWaalsContact O-CD2 3.28Å; W128-F132 WeakPolarHBondContact O-CD2 3.34Å; F129-F132 CarbonylContact O-C 3.59Å; F129-F132 WeakPolarHBondContact O-CA 3.48Å; F129-F132 PolarHBondContact O-N 3.23Å; F132-P134 WeakPolarHBondContact O-CD 3.2Å; F132-L168 HydrophobicContact CE1-CD1 3.82Å; F132-L168 HydrophobicContact CZ-CD1 4.36Å; F132-W176 AromaticContact CD1-CH2 3.86Å; F132-W176 HydrophobicContact CD1-CH2 3.86Å; F132-W176 HydrophobicContact CD1-CZ2 4.07Å; F132-W176 HydrophobicContact CD1-CZ3 4.13Å; F132-W176 HydrophobicContact CE1-CH2 4.32Å; F132-W176 HydrophobicContact CE1-CZ3 4.25Å; F132-V179 HydrophobicContact CD1-CG1 4.32Å; F132-V179 HydrophobicContact CE1-CG1 3.89Å; F132-V179 HydrophobicContact CZ-CG1 4.2Å; F132-T180 HydrophobicContact CB-CG2 4.4Å; F132-T180 WeakPolarHBondContact O-CG2 3.34Å; F132-M183 HydrophobicContact CD2-CG 4.44Å
133	Q	69	Low	73.9	Confident	93 Å²	93	53 Å²	53	44%	0.435	26%	0.26	S	S	.	.			trans	-63.3	119.8	177.2	-164.6	178	28.7	0	0	110.2	V131 W176	V131-Q133 VanDerWaalsContact C-N 3.35Å; V131-Q133 PolarHBondContact O-N 3.05Å; Q133-W176 PolarHBondContact O-NE1 3.27Å
134	P	65.1	Low	73.3	Confident	12 Å²	12	49.2 Å²	49.2	8%	0.078	25%	0.246	C	C	.	.			trans	-76.1	138	-177.7	29.3	-34.1	0	0	0	111.3	F132 Y136 N137 H141 T180	F132-P134 WeakPolarHBondContact O-CD 3.2Å; P134-Y136 VanDerWaalsContact C-N 3.26Å; P134-Y136 PolarHBondContact O-N 3.41Å; P134-N137 HydrophobicContact CG-CB 4.46Å; P134-N137 VanDerWaalsContact CG-O 3.31Å; P134-N137 WeakPolarHBondContact CG-O 3.39Å; P134-H141 WeakPolarHBondContact CD-ND1 3.2Å; P134-H141 HydrophobicContact CG-CB 3.85Å; P134-T180 HydrophobicContact CB-CG2 4.25Å
135	S	58.9	Low	72.7	Confident	80 Å²	80	48.6 Å²	48.6	56%	0.559	24%	0.243	S	C	*	.	S	Bend	trans	-66.3	-24.7	-177.4	-50	0	0	0	0	114.1
136	Y	55.3	Low	72.1	Confident	218 Å²	218	53.8 Å²	53.8	86%	0.855	27%	0.27	S	S	*	.	S	Bend	trans	-131.5	9.7	-169.7	-73.5	-73.7	0	0	0	115.6	P134	P134-Y136 VanDerWaalsContact C-N 3.26Å; P134-Y136 PolarHBondContact O-N 3.41Å
137	N	59.2	Low	71.7	Confident	72 Å²	72	55.1 Å²	55.1	39%	0.385	28%	0.277	S	S	.	.			trans	-147.7	61	-178.9	-165.1	18.5	0	0	0	112.9	P134 D139 S140	P134-N137 HydrophobicContact CG-CB 4.46Å; P134-N137 VanDerWaalsContact CG-O 3.31Å; P134-N137 WeakPolarHBondContact CG-O 3.39Å; N137-D139 PolarHBondContact O-N 2.81Å; N137-S140 PolarHBondContact ND2-OG 3.24Å
138	Q	66.1	Low	71.5	Confident	106 Å²	106	54.2 Å²	54.2	50%	0.495	27%	0.267	S	S	.	.	H	α-helix	trans	-65	-26.9	-178	-66.9	-173.4	-6.2	0	0	112.9	H141 N142	Q138-H141 PolarHBondContact O-N 3.45Å; Q138-N142 VanDerWaalsContact O-CB 3.24Å; Q138-N142 WeakPolarHBondContact O-CB 3.02Å; Q138-N142 PolarHBondContact O-N 3.47Å; Q138-N142 PolarHBondContact O-ND2 3.22Å; Q138-N142 VanDerWaalsContact O-ND2 3.16Å
139	D	65.8	Low	70.8	Confident	129 Å²	129	55.9 Å²	55.9	69%	0.69	28%	0.275	S	S	*	.	H	α-helix	trans	-70.2	-42.8	-174.8	-60.9	-42.4	0	0	0	113.3	N137 H141 Y143	N137-D139 PolarHBondContact O-N 2.81Å; D139-H141 VanDerWaalsContact C-N 3.34Å; D139-Y143 VanDerWaalsContact O-CB 3.28Å; D139-Y143 WeakPolarHBondContact O-CB 3.2Å; D139-Y143 PolarHBondContact O-N 2.85Å
140	S	68.5	Low	70.4	Confident	20 Å²	20	63.6 Å²	63.6	14%	0.14	30%	0.304	C	S	.	.	H	α-helix	trans	-67.4	-37.8	175.3	74.1	0	0	0	0	111.6	N137 Y143 I144 E184	N137-S140 PolarHBondContact ND2-OG 3.24Å; S140-Y143 PolarHBondContact O-N 3.22Å; S140-I144 WeakPolarHBondContact O-CB 3.26Å; S140-I144 VanDerWaalsContact O-CG1 3.32Å; S140-I144 WeakPolarHBondContact O-CG1 3.49Å; S140-I144 PolarHBondContact O-N 2.99Å; S140-E184 PolarHBondContact OG-OE2 3.32Å; S140-E184 VanDerWaalsContact OG-OE2 3.12Å
141	H	69.5	Low	70	Confident	4 Å²	4	62 Å²	62	2%	0.019	30%	0.296	C	S	.	.	H	α-helix	trans	-63.3	-50	176.7	-177.5	91.6	0	0	0	111.4	F129 P134 Q138 D139 Y143 I144 L145	F129-H141 AromaticContact CD1-CE1 3.99Å; F129-H141 AromaticContact CD1-ND1 3.8Å; F129-H141 HydrophobicContact CE1-CB 4.29Å; F129-H141 AromaticContact CE1-CE1 3.95Å; F129-H141 AromaticContact CE1-CG 3.85Å; F129-H141 AromaticContact CE1-ND1 3.3Å; F129-H141 VanDerWaalsContact CE1-ND1 3.3Å; F129-H141 WeakPolarHBondContact CE1-ND1 3.24Å; F129-H141 AromaticContact CE2-ND1 3.95Å; F129-H141 HydrophobicContact CZ-CB 4.3Å; F129-H141 AromaticContact CZ-ND1 3.4Å; F129-H141 WeakPolarHBondContact CZ-ND1 3.46Å; F129-H141 PolarHBondContact O-CE1 2.96Å; F129-H141 VanDerWaalsContact O-CE1 3.28Å; P134-H141 WeakPolarHBondContact CD-ND1 3.2Å; P134-H141 HydrophobicContact CG-CB 3.85Å; Q138-H141 PolarHBondContact O-N 3.45Å; D139-H141 VanDerWaalsContact C-N 3.34Å; H141-Y143 PolarHBondContact O-N 2.85Å; H141-I144 PolarHBondContact O-N 3.33Å; H141-L145 WeakPolarHBondContact O-CB 3.46Å; H141-L145 WeakPolarHBondContact O-CG 3.28Å; H141-L145 PolarHBondContact O-N 2.99Å
142	N	73.3	Confident	69.5	Low	66 Å²	66	62.7 Å²	62.7	35%	0.353	30%	0.301	S	S	.	.	H	α-helix	trans	-62.4	-40.1	175.4	-71.4	-25.1	0	0	0	112	Q138 L145 N146	Q138-N142 VanDerWaalsContact O-CB 3.24Å; Q138-N142 WeakPolarHBondContact O-CB 3.02Å; Q138-N142 PolarHBondContact O-N 3.47Å; Q138-N142 PolarHBondContact O-ND2 3.22Å; Q138-N142 VanDerWaalsContact O-ND2 3.16Å; N142-L145 PolarHBondContact O-N 2.81Å; N142-N146 WeakPolarHBondContact O-CB 3.34Å; N142-N146 PolarHBondContact O-N 2.87Å; N142-N146 PolarHBondContact O-ND2 3.15Å
143	Y	76.7	Confident	69	Low	139 Å²	139	63.3 Å²	63.3	55%	0.545	31%	0.307	S	S	.	.	H	α-helix	trans	-58.3	-49.7	174.7	178.7	-82.2	0	0	0	111.5	D139 S140 H141 N146 E147	D139-Y143 VanDerWaalsContact O-CB 3.28Å; D139-Y143 WeakPolarHBondContact O-CB 3.2Å; D139-Y143 PolarHBondContact O-N 2.85Å; S140-Y143 PolarHBondContact O-N 3.22Å; H141-Y143 PolarHBondContact O-N 2.85Å; Y143-N146 PolarHBondContact O-N 2.84Å; Y143-E147 PolarHBondContact O-N 2.85Å
144	I	73	Confident	68.4	Low	0 Å²	0	64.5 Å²	64.5	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-65.2	-42.6	-179.4	-71.9	165.8	0	0	0	111	F129 S140 H141 N146 E147 F148 E184 C187 R188	F129-I144 HydrophobicContact CD1-CG2 4Å; F129-I144 HydrophobicContact CE1-CB 3.87Å; F129-I144 HydrophobicContact CE1-CD1 4.39Å; F129-I144 HydrophobicContact CE1-CG2 3.62Å; F129-I144 HydrophobicContact CZ-CB 4.45Å; F129-I144 HydrophobicContact CZ-CD1 4.13Å; F129-I144 HydrophobicContact CZ-CG2 4.28Å; S140-I144 WeakPolarHBondContact O-CB 3.26Å; S140-I144 VanDerWaalsContact O-CG1 3.32Å; S140-I144 WeakPolarHBondContact O-CG1 3.49Å; S140-I144 PolarHBondContact O-N 2.99Å; H141-I144 PolarHBondContact O-N 3.33Å; I144-N146 VanDerWaalsContact C-N 3.33Å; I144-N146 PolarHBondContact O-N 3.14Å; I144-E147 PolarHBondContact O-N 2.95Å; I144-F148 HydrophobicContact CG2-CD2 3.66Å; I144-F148 HydrophobicContact CG2-CE2 3.46Å; I144-F148 VanDerWaalsContact CG2-CE2 3.46Å; I144-F148 HydrophobicContact CG2-CZ 4.49Å; I144-F148 WeakPolarHBondContact O-CD2 3.29Å; I144-F148 PolarHBondContact O-N 3.12Å; I144-E184 HydrophobicContact CD1-CB 4.18Å; I144-E184 HydrophobicContact CD1-CG 3.48Å; I144-E184 VanDerWaalsContact CD1-CG 3.48Å; I144-E184 WeakPolarHBondContact CD1-OE1 3.47Å; I144-C187 HydrophobicContact CG2-CB 4.05Å; I144-R188 HydrophobicContact CD1-CG 4.37Å
145	L	74.2	Confident	67.8	Low	12 Å²	12	70.9 Å²	70.9	6%	0.063	35%	0.35	C	S	.	.	H	α-helix	trans	-62.3	-38.4	174.6	-74.2	-175.7	0	0	0	112.4	F129 H141 N142 F148 M149 F157	F129-L145 HydrophobicContact CD1-CD2 3.83Å; F129-L145 HydrophobicContact CD1-CG 4.09Å; F129-L145 HydrophobicContact CE1-CG 4.4Å; H141-L145 WeakPolarHBondContact O-CB 3.46Å; H141-L145 WeakPolarHBondContact O-CG 3.28Å; H141-L145 PolarHBondContact O-N 2.99Å; N142-L145 PolarHBondContact O-N 2.81Å; L145-F148 HydrophobicContact CD2-CD2 4.36Å; L145-F148 WeakPolarHBondContact O-CB 3.44Å; L145-M149 VanDerWaalsContact O-CG 3.26Å; L145-M149 WeakPolarHBondContact O-CG 3.32Å; L145-M149 PolarHBondContact O-N 2.85Å; L145-F157 HydrophobicContact CB-CZ 3.93Å; L145-F157 HydrophobicContact CD1-CE1 4.24Å; L145-F157 HydrophobicContact CD1-CZ 4.23Å; L145-F157 HydrophobicContact CD2-CE1 3.95Å; L145-F157 HydrophobicContact CD2-CZ 3.94Å; L145-F157 HydrophobicContact CG-CZ 4.25Å
146	N	75	Confident	67.5	Low	108 Å²	108	68.8 Å²	68.8	58%	0.578	33%	0.334	S	S	*	.	H	α-helix	trans	-67.9	-37.4	173.2	-74.4	-35.2	0	0	0	112.3	N142 Y143 I144 M149 R150	N142-N146 WeakPolarHBondContact O-CB 3.34Å; N142-N146 PolarHBondContact O-N 2.87Å; N142-N146 PolarHBondContact O-ND2 3.15Å; Y143-N146 PolarHBondContact O-N 2.84Å; I144-N146 VanDerWaalsContact C-N 3.33Å; I144-N146 PolarHBondContact O-N 3.14Å; N146-M149 PolarHBondContact O-N 3.11Å; N146-R150 WeakPolarHBondContact O-CB 3.49Å; N146-R150 PolarHBondContact O-N 3.29Å
147	E	76.7	Confident	67.2	Low	30 Å²	30	62.1 Å²	62.1	14%	0.14	31%	0.309	C	S	.	.	H	α-helix	trans	-68.4	-39.1	175.5	-168.6	170.5	-148.2	0	0	112.2	Y143 I144 R150 C151 I191 K195	Y143-E147 PolarHBondContact O-N 2.85Å; I144-E147 PolarHBondContact O-N 2.95Å; E147-R150 PolarHBondContact O-N 3.33Å; E147-C151 PolarHBondContact O-N 3.21Å; E147-C151 PolarHBondContact O-SG 2.89Å; E147-C151 VanDerWaalsContact O-SG 3.33Å; E147-I191 HydrophobicContact CB-CD1 4.37Å; E147-I191 HydrophobicContact CG-CD1 4.23Å; E147-I191 HydrophobicContact CG-CG2 4.01Å; E147-K195 WeakPolarHBondContact OE1-CE 3.42Å; E147-K195 IonicContact OE1-NZ 3.9Å; E147-K195 PolarHBondContact OE1-NZ 3.09Å; E147-K195 IonicContact OE2-NZ 3.25Å
148	F	78	Confident	66.6	Low	2 Å²	2	64 Å²	64	1%	0.009	33%	0.329	C	S	.	.	H	α-helix	trans	-56.9	-48.8	169	-84.5	-57.6	0	0	0	111.8	V122 L125 A126 I144 L145 R150 C151 C152 C187 I191	V122-F148 HydrophobicContact CB-CE1 4.33Å; V122-F148 HydrophobicContact CG1-CD1 3.46Å; V122-F148 VanDerWaalsContact CG1-CD1 3.46Å; V122-F148 HydrophobicContact CG1-CE1 3.63Å; V122-F148 WeakPolarHBondContact O-CD1 3.27Å; V122-F148 WeakPolarHBondContact O-CE1 3.33Å; L125-F148 HydrophobicContact CB-CE1 4.44Å; L125-F148 HydrophobicContact CB-CZ 4.1Å; A126-F148 HydrophobicContact CB-CB 3.99Å; A126-F148 HydrophobicContact CB-CD1 3.9Å; A126-F148 HydrophobicContact CB-CD2 3.74Å; A126-F148 HydrophobicContact CB-CE1 4.23Å; A126-F148 HydrophobicContact CB-CE2 4.07Å; A126-F148 HydrophobicContact CB-CG 3.64Å; A126-F148 HydrophobicContact CB-CZ 4.3Å; I144-F148 HydrophobicContact CG2-CD2 3.66Å; I144-F148 HydrophobicContact CG2-CE2 3.46Å; I144-F148 VanDerWaalsContact CG2-CE2 3.46Å; I144-F148 HydrophobicContact CG2-CZ 4.49Å; I144-F148 WeakPolarHBondContact O-CD2 3.29Å; I144-F148 PolarHBondContact O-N 3.12Å; L145-F148 HydrophobicContact CD2-CD2 4.36Å; L145-F148 WeakPolarHBondContact O-CB 3.44Å; F148-R150 VanDerWaalsContact C-N 3.34Å; F148-R150 PolarHBondContact O-N 3.23Å; F148-C151 PolarHBondContact O-N 2.71Å; F148-C152 WeakPolarHBondContact O-CB 3.39Å; F148-C152 PolarHBondContact O-N 2.83Å; F148-C187 HydrophobicContact CE2-CB 3.68Å; F148-C187 HydrophobicContact CZ-CB 3.48Å; F148-C187 VanDerWaalsContact CZ-CB 3.48Å; F148-C187 WeakPolarHBondContact CZ-SG 3.44Å; F148-I191 HydrophobicContact CD1-CD1 3.9Å; F148-I191 HydrophobicContact CD1-CG1 4.04Å; F148-I191 HydrophobicContact CD2-CD1 4.3Å; F148-I191 HydrophobicContact CE1-CD1 3.89Å; F148-I191 HydrophobicContact CE1-CG1 3.89Å; F148-I191 HydrophobicContact CE2-CD1 4.31Å; F148-I191 HydrophobicContact CG-CD1 4.11Å; F148-I191 HydrophobicContact CZ-CD1 4.11Å; F148-I191 HydrophobicContact CZ-CG1 4.47Å
149	M	70.8	Confident	65.9	Low	34 Å²	34	68.2 Å²	68.2	17%	0.167	35%	0.345	C	S	.	.	H	α-helix	trans	-60.8	-41.9	176.8	-72.5	-75.3	-89.5	0	0	111.9	L145 N146 C151 G153 N154 V156 F157	L145-M149 VanDerWaalsContact O-CG 3.26Å; L145-M149 WeakPolarHBondContact O-CG 3.32Å; L145-M149 PolarHBondContact O-N 2.85Å; N146-M149 PolarHBondContact O-N 3.11Å; M149-C151 VanDerWaalsContact C-N 3.34Å; M149-C151 PolarHBondContact O-N 2.84Å; M149-G153 VanDerWaalsContact O-CA 3.29Å; M149-G153 WeakPolarHBondContact O-CA 3.5Å; M149-G153 PolarHBondContact O-N 2.65Å; M149-N154 HydrophobicContact CE-CB 3.86Å; M149-V156 HydrophobicContact SD-CB 3.91Å; M149-V156 HydrophobicContact SD-CG2 4.01Å; M149-F157 HydrophobicContact CE-CD2 3.73Å; M149-F157 HydrophobicContact CE-CE2 3.79Å; M149-F157 HydrophobicContact CG-CD2 4.32Å; M149-F157 HydrophobicContact CG-CE2 3.44Å; M149-F157 VanDerWaalsContact CG-CE2 3.44Å; M149-F157 HydrophobicContact CG-CZ 4.02Å; M149-F157 HydrophobicContact SD-CD2 3.87Å; M149-F157 HydrophobicContact SD-CE2 3.55Å; M149-F157 VanDerWaalsContact SD-CE2 3.55Å; M149-F157 HydrophobicContact SD-CZ 4.28Å
150	R	75.2	Confident	65.2	Low	164 Å²	164	65.1 Å²	65.1	62%	0.619	33%	0.329	S	S	*	.	H	α-helix	trans	-60.8	-40.3	176.7	-172.4	-179.7	-177.8	170.6	6.8	112.6	N146 E147 F148 N206	N146-R150 WeakPolarHBondContact O-CB 3.49Å; N146-R150 PolarHBondContact O-N 3.29Å; E147-R150 PolarHBondContact O-N 3.33Å; F148-R150 VanDerWaalsContact C-N 3.34Å; F148-R150 PolarHBondContact O-N 3.23Å; R150-N206 PolarHBondContact NE-OD1 3.21Å; R150-N206 PolarHBondContact NH2-OD1 3.08Å
151	C	69.8	Low	64.3	Low	9 Å²	9	72.1 Å²	72.1	6%	0.061	36%	0.359	C	S	.	.	H	α-helix	trans	-83.1	-25.3	-176.3	-64.6	0	0	0	0	114.4	K119 E147 F148 M149 L194	K119-C151 PolarHBondContact NZ-O 3.12Å; E147-C151 PolarHBondContact O-N 3.21Å; E147-C151 PolarHBondContact O-SG 2.89Å; E147-C151 VanDerWaalsContact O-SG 3.33Å; F148-C151 PolarHBondContact O-N 2.71Å; M149-C151 VanDerWaalsContact C-N 3.34Å; M149-C151 PolarHBondContact O-N 2.84Å; C151-L194 HydrophobicContact CB-CD2 3.87Å
152	C	66.2	Low	63.3	Low	18 Å²	18	77.7 Å²	77.7	12%	0.122	39%	0.389	C	S	.	.	H	α-helix	trans	-118.6	-13.2	-173.1	-76.4	0	0	0	0	115.3	V122 R123 F148	V122-C152 WeakPolarHBondContact CG1-SG 3.46Å; R123-C152 HydrophobicContact CG-CB 4.18Å; R123-C152 PolarHBondContact NH1-O 3.45Å; R123-C152 PolarHBondContact NH2-O 3.16Å; F148-C152 WeakPolarHBondContact O-CB 3.39Å; F148-C152 PolarHBondContact O-N 2.83Å
153	G	63.4	Low	62.3	Low	14 Å²	14	75.2 Å²	75.2	14%	0.144	38%	0.378	C	S	.	.			trans	76.3	155.8	-179.9	0	0	0	0	0	114.3	R123 M149 N155	R123-G153 PolarHBondContact NH2-O 3.43Å; M149-G153 VanDerWaalsContact O-CA 3.29Å; M149-G153 WeakPolarHBondContact O-CA 3.5Å; M149-G153 PolarHBondContact O-N 2.65Å; G153-N155 PolarHBondContact O-N 2.98Å
154	N	55.1	Low	61.1	Low	118 Å²	118	71 Å²	71	63%	0.631	37%	0.366	S	S	*	.	S	Bend	trans	-66.4	5.4	-148	-56.2	5.3	0	0	0	118.7	M149 V156	M149-N154 HydrophobicContact CE-CB 3.86Å; N154-V156 PolarHBondContact O-N 3.27Å
155	N	52.9	Low	60	Low	146 Å²	146	81.2 Å²	81.2	78%	0.781	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	68.2	-179.6	-63.3	0.6	0	0	0	110.9	R123 G153	R123-N155 PolarHBondContact NE-O 3.23Å; R123-N155 PolarHBondContact NH2-O 3.07Å; G153-N155 PolarHBondContact O-N 2.98Å
156	V	51.9	Low	59	Low	36 Å²	36	85.7 Å²	85.7	22%	0.218	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130	-35.8	176.3	-175	0	0	0	0	112.5	R123 A126 M149 N154	R123-V156 HydrophobicContact CG-CG2 4.46Å; A126-V156 HydrophobicContact CB-CG1 3.95Å; M149-V156 HydrophobicContact SD-CB 3.91Å; M149-V156 HydrophobicContact SD-CG2 4.01Å; N154-V156 PolarHBondContact O-N 3.27Å
157	F	50.4	Low	58.2	Low	77 Å²	77	80.7 Å²	80.7	34%	0.338	40%	0.401	S	S	.	.			trans	-102.3	113.1	-175.2	-52.5	-55.1	0	0	0	113.5	L145 M149	L145-F157 HydrophobicContact CB-CZ 3.93Å; L145-F157 HydrophobicContact CD1-CE1 4.24Å; L145-F157 HydrophobicContact CD1-CZ 4.23Å; L145-F157 HydrophobicContact CD2-CE1 3.95Å; L145-F157 HydrophobicContact CD2-CZ 3.94Å; L145-F157 HydrophobicContact CG-CZ 4.25Å; M149-F157 HydrophobicContact CE-CD2 3.73Å; M149-F157 HydrophobicContact CE-CE2 3.79Å; M149-F157 HydrophobicContact CG-CD2 4.32Å; M149-F157 HydrophobicContact CG-CE2 3.44Å; M149-F157 VanDerWaalsContact CG-CE2 3.44Å; M149-F157 HydrophobicContact CG-CZ 4.02Å; M149-F157 HydrophobicContact SD-CD2 3.87Å; M149-F157 HydrophobicContact SD-CE2 3.55Å; M149-F157 VanDerWaalsContact SD-CE2 3.55Å; M149-F157 HydrophobicContact SD-CZ 4.28Å
158	S	47.1	Very low	57.5	Low	113 Å²	113	80.2 Å²	80.2	79%	0.79	40%	0.399	S	S	*	.	S	Bend	trans	166.8	96.1	145.4	38.5	0	0	0	0	111.3
159	K	50.1	Low	56.5	Low	193 Å²	193	83.3 Å²	83.3	84%	0.839	42%	0.421	S	S	*	.	S	Bend	trans	172.6	-21	146.9	-99.5	159.4	-174.2	-177.1	0	116
160	N	52.6	Low	56.2	Low	65 Å²	65	89.6 Å²	89.6	35%	0.348	46%	0.455	S	S	.	.	G	3₁₀ helix	trans	-96.7	13.3	-164.1	-70.4	5.4	0	0	0	115.9	W73 D162 A163	W73-N160 WeakPolarHBondContact CH2-ND2 3.4Å; N160-D162 PolarHBondContact O-N 3.45Å; N160-D162 VanDerWaalsContact O-N 3.12Å; N160-A163 HydrophobicContact CB-CB 4.31Å; N160-A163 VanDerWaalsContact O-CB 3.3Å; N160-A163 WeakPolarHBondContact O-CB 3.3Å; N160-A163 PolarHBondContact O-N 3.29Å
161	Q	48.2	Very low	56	Low	166 Å²	166	83.7 Å²	83.7	78%	0.776	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-64.3	-14.1	178.8	-72.9	-176.9	-24.6	0	0	114.8	T164	Q161-T164 PolarHBondContact O-OG1 3.44Å
162	D	49.3	Very low	56.3	Low	122 Å²	122	88.2 Å²	88.2	65%	0.652	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-87.1	-22.2	170.2	-65.8	-55.5	0	0	0	112.9	N160 T164 R165	N160-D162 PolarHBondContact O-N 3.45Å; N160-D162 VanDerWaalsContact O-N 3.12Å; D162-T164 VanDerWaalsContact C-N 3.35Å; D162-T164 PolarHBondContact O-N 2.94Å; D162-R165 PolarHBondContact O-N 2.92Å
163	A	52.6	Low	56.7	Low	13 Å²	13	90 Å²	90	11%	0.107	47%	0.472	C	S	.	.	G	3₁₀ helix	trans	-69	-33.4	-177.5	0	0	0	0	0	112.3	N160 R165 I166 V167	N160-A163 HydrophobicContact CB-CB 4.31Å; N160-A163 VanDerWaalsContact O-CB 3.3Å; N160-A163 WeakPolarHBondContact O-CB 3.3Å; N160-A163 PolarHBondContact O-N 3.29Å; A163-R165 PolarHBondContact O-N 3.24Å; A163-I166 PolarHBondContact O-N 3.49Å; A163-V167 HydrophobicContact CB-CG2 4.18Å; A163-V167 WeakPolarHBondContact O-CB 3.23Å; A163-V167 VanDerWaalsContact O-CG2 3.27Å; A163-V167 WeakPolarHBondContact O-CG2 3.49Å; A163-V167 PolarHBondContact O-N 3.36Å
164	T	51.8	Low	57.4	Low	51 Å²	51	96 Å²	96	31%	0.313	50%	0.496	S	S	.	.	G	3₁₀ helix	trans	-52.1	-26.2	174	11.1	0	0	0	0	113.5	V131 Q161 D162	V131-T164 WeakPolarHBondContact O-CG2 3.39Å; Q161-T164 PolarHBondContact O-OG1 3.44Å; D162-T164 VanDerWaalsContact C-N 3.35Å; D162-T164 PolarHBondContact O-N 2.94Å
165	R	49.5	Very low	58.6	Low	214 Å²	214	92.1 Å²	92.1	81%	0.808	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-95.2	-6	178.8	-73.9	-177.3	169.6	176.5	-2.4	115.1	D162 A163 C169	D162-R165 PolarHBondContact O-N 2.92Å; A163-R165 PolarHBondContact O-N 3.24Å; R165-C169 PolarHBondContact O-SG 2.99Å
166	I	52.8	Low	59.9	Low	107 Å²	107	87 Å²	87	55%	0.549	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.3	-37.5	-171.4	-61.6	172.2	0	0	0	111.3	A163 L168	A163-I166 PolarHBondContact O-N 3.49Å; I166-L168 PolarHBondContact O-N 3.37Å
167	V	58.4	Low	61.3	Low	3 Å²	3	88.3 Å²	88.3	2%	0.018	45%	0.452	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-39.9	-161.6	159.3	0	0	0	0	113.8	C76 L77 K86 V131 A163	C76-V167 HydrophobicContact CB-CB 4.27Å; C76-V167 HydrophobicContact CB-CG1 3.49Å; C76-V167 VanDerWaalsContact CB-CG1 3.49Å; C76-V167 HydrophobicContact CB-CG2 3.85Å; C76-V167 WeakPolarHBondContact O-CA 3.26Å; L77-V167 HydrophobicContact CD2-CG2 4.36Å; K86-V167 PolarHBondContact NZ-O 2.94Å; V131-V167 HydrophobicContact CG1-CG1 4.31Å; A163-V167 HydrophobicContact CB-CG2 4.18Å; A163-V167 WeakPolarHBondContact O-CB 3.23Å; A163-V167 VanDerWaalsContact O-CG2 3.27Å; A163-V167 WeakPolarHBondContact O-CG2 3.49Å; A163-V167 PolarHBondContact O-N 3.36Å
168	L	61.2	Low	62.7	Low	19 Å²	19	90.5 Å²	90.5	10%	0.099	46%	0.458	C	S	.	.	T	Hydrogen-bonded Turn	trans	-143.3	55.3	-171.8	-69.4	167.1	0	0	0	113.1	T83 K86 I90 F132 I166 I171 W176	T83-L168 HydrophobicContact CG2-CD2 4.14Å; K86-L168 HydrophobicContact CB-CD2 3.59Å; K86-L168 HydrophobicContact CD-CD2 3.72Å; K86-L168 HydrophobicContact CG-CD2 4.31Å; I90-L168 HydrophobicContact CD1-CD1 3.93Å; I90-L168 HydrophobicContact CD1-CD2 4.22Å; F132-L168 HydrophobicContact CE1-CD1 3.82Å; F132-L168 HydrophobicContact CZ-CD1 4.36Å; I166-L168 PolarHBondContact O-N 3.37Å; L168-I171 HydrophobicContact CB-CD1 3.7Å; L168-I171 HydrophobicContact CB-CG1 4.16Å; L168-I171 HydrophobicContact CD1-CD1 4.04Å; L168-I171 HydrophobicContact CD2-CD1 3.84Å; L168-I171 HydrophobicContact CG-CD1 4.03Å; L168-W176 HydrophobicContact CB-CZ3 3.96Å; L168-W176 HydrophobicContact CD1-CE3 4.49Å; L168-W176 HydrophobicContact CD1-CZ3 3.73Å; L168-W176 HydrophobicContact CG-CZ3 4.49Å
169	C	58.2	Low	64.4	Low	68 Å²	68	85.6 Å²	85.6	46%	0.459	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	141.7	175.4	-58.5	0	0	0	0	112.1	T83 R165	T83-C169 WeakPolarHBondContact CG2-O 3.32Å; R165-C169 PolarHBondContact O-SG 2.99Å
170	N	63.2	Low	65.9	Low	165 Å²	165	76.8 Å²	76.8	88%	0.882	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	38.3	177.1	-52.8	-16.8	0	0	0	115.3
171	I	70.9	Confident	67.3	Low	41 Å²	41	75.7 Å²	75.7	21%	0.21	39%	0.386	C	S	.	.			trans	-82.8	142.9	164.5	-73.4	-162.6	0	0	0	111.1	T83 V87 L168 V175 W176	T83-I171 HydrophobicContact CG2-CD1 3.85Å; T83-I171 HydrophobicContact CG2-CG1 3.38Å; V87-I171 HydrophobicContact CG2-CD1 3.37Å; V87-I171 HydrophobicContact CG2-CG1 4.46Å; L168-I171 HydrophobicContact CB-CD1 3.7Å; L168-I171 HydrophobicContact CB-CG1 4.16Å; L168-I171 HydrophobicContact CD1-CD1 4.04Å; L168-I171 HydrophobicContact CD2-CD1 3.84Å; L168-I171 HydrophobicContact CG-CD1 4.03Å; I171-V175 HydrophobicContact CG2-CB 3.99Å; I171-V175 HydrophobicContact CG2-CG1 4.23Å; I171-W176 HydrophobicContact CG2-CB 3.98Å; I171-W176 HydrophobicContact CG2-CE3 4.35Å
172	D	75.9	Confident	69	Low	103 Å²	103	70.5 Å²	70.5	55%	0.551	36%	0.362	S	S	*	.			trans	-71.4	136.5	169.2	-179.3	7.7	0	0	0	111.4	E174 V175 W176	D172-E174 VanDerWaalsContact C-N 3.27Å; D172-E174 PolarHBondContact O-N 3.47Å; D172-V175 HydrophobicContact CB-CG2 4.13Å; D172-V175 WeakPolarHBondContact O-CA 3.36Å; D172-V175 WeakPolarHBondContact O-CB 2.97Å; D172-V175 PolarHBondContact O-N 3.31Å; D172-W176 PolarHBondContact O-N 3.23Å
173	S	75.6	Confident	70.7	Confident	57 Å²	57	64.7 Å²	64.7	40%	0.399	33%	0.33	S	S	.	.	H	α-helix	trans	-55.8	-41.1	-174.8	-158.5	0	0	0	0	111.8	V175 W176 D177	S173-V175 PolarHBondContact O-N 3.44Å; S173-V175 VanDerWaalsContact O-N 3.16Å; S173-W176 WeakPolarHBondContact O-CB 3.41Å; S173-W176 PolarHBondContact O-N 2.99Å; S173-D177 WeakPolarHBondContact O-CB 3.42Å; S173-D177 PolarHBondContact O-N 3.41Å; S173-D177 PolarHBondContact OG-OD2 3.4Å
174	E	78.9	Confident	72.2	Confident	138 Å²	138	66 Å²	66	65%	0.645	33%	0.334	S	S	*	.	H	α-helix	trans	-61.4	-28.1	178.6	-66.7	-165.5	-176.9	0	0	113.3	D172 R178	D172-E174 VanDerWaalsContact C-N 3.27Å; D172-E174 PolarHBondContact O-N 3.47Å; E174-R178 VanDerWaalsContact O-CB 3.31Å; E174-R178 WeakPolarHBondContact O-CB 3.07Å; E174-R178 VanDerWaalsContact O-CZ 3.24Å; E174-R178 PolarHBondContact O-N 2.94Å; E174-R178 PolarHBondContact O-NH1 2.85Å; E174-R178 PolarHBondContact O-NH2 3.42Å
175	V	79.7	Confident	73.8	Confident	37 Å²	37	67.1 Å²	67.1	22%	0.224	33%	0.334	C	S	.	.	H	α-helix	trans	-80.1	-41.3	175.5	-178.8	0	0	0	0	110.1	V87 I171 D172 S173 V179	V87-V175 HydrophobicContact CG1-CG1 3.76Å; V87-V175 HydrophobicContact CG2-CG1 3.99Å; I171-V175 HydrophobicContact CG2-CB 3.99Å; I171-V175 HydrophobicContact CG2-CG1 4.23Å; D172-V175 HydrophobicContact CB-CG2 4.13Å; D172-V175 WeakPolarHBondContact O-CA 3.36Å; D172-V175 WeakPolarHBondContact O-CB 2.97Å; D172-V175 PolarHBondContact O-N 3.31Å; S173-V175 PolarHBondContact O-N 3.44Å; S173-V175 VanDerWaalsContact O-N 3.16Å; V175-V179 WeakPolarHBondContact O-CG2 3.5Å; V175-V179 PolarHBondContact O-N 3.41Å; V175-V179 VanDerWaalsContact O-N 3.11Å
176	W	79.7	Confident	75.6	Confident	39 Å²	39	57.1 Å²	57.1	15%	0.148	30%	0.296	C	S	.	.	H	α-helix	trans	-60.9	-54.3	175.9	-172.6	-98.6	0	0	0	111.9	F132 Q133 L168 I171 D172 S173 R178 V179 T180	F132-W176 AromaticContact CD1-CH2 3.86Å; F132-W176 HydrophobicContact CD1-CH2 3.86Å; F132-W176 HydrophobicContact CD1-CZ2 4.07Å; F132-W176 HydrophobicContact CD1-CZ3 4.13Å; F132-W176 HydrophobicContact CE1-CH2 4.32Å; F132-W176 HydrophobicContact CE1-CZ3 4.25Å; Q133-W176 PolarHBondContact O-NE1 3.27Å; L168-W176 HydrophobicContact CB-CZ3 3.96Å; L168-W176 HydrophobicContact CD1-CE3 4.49Å; L168-W176 HydrophobicContact CD1-CZ3 3.73Å; L168-W176 HydrophobicContact CG-CZ3 4.49Å; I171-W176 HydrophobicContact CG2-CB 3.98Å; I171-W176 HydrophobicContact CG2-CE3 4.35Å; D172-W176 PolarHBondContact O-N 3.23Å; S173-W176 WeakPolarHBondContact O-CB 3.41Å; S173-W176 PolarHBondContact O-N 2.99Å; W176-R178 PolarHBondContact O-N 3.11Å; W176-V179 PolarHBondContact O-N 3.48Å; W176-V179 VanDerWaalsContact O-N 3.15Å; W176-T180 WeakPolarHBondContact O-CB 3.37Å; W176-T180 PolarHBondContact O-N 3.27Å; W176-T180 PolarHBondContact O-OG1 3.33Å; W176-T180 VanDerWaalsContact O-OG1 3.08Å
177	D	80.6	Confident	77.2	Confident	64 Å²	64	52 Å²	52	34%	0.342	27%	0.27	S	S	.	.	H	α-helix	trans	-62.9	-32.3	-176.4	-66.2	-46.6	0	0	0	111.8	S173 A181	S173-D177 WeakPolarHBondContact O-CB 3.42Å; S173-D177 PolarHBondContact O-N 3.41Å; S173-D177 PolarHBondContact OG-OD2 3.4Å; D177-A181 VanDerWaalsContact O-CB 3.28Å; D177-A181 WeakPolarHBondContact O-CB 3.48Å; D177-A181 PolarHBondContact O-N 2.85Å
178	R	81.6	Confident	78.6	Confident	123 Å²	123	56.2 Å²	56.2	46%	0.464	29%	0.285	S	S	.	.	H	α-helix	trans	-66.9	-48.9	172	170.3	165.3	49.4	-98.5	0.3	112.8	E174 W176 T180 A181 E182	E174-R178 VanDerWaalsContact O-CB 3.31Å; E174-R178 WeakPolarHBondContact O-CB 3.07Å; E174-R178 VanDerWaalsContact O-CZ 3.24Å; E174-R178 PolarHBondContact O-N 2.94Å; E174-R178 PolarHBondContact O-NH1 2.85Å; E174-R178 PolarHBondContact O-NH2 3.42Å; W176-R178 PolarHBondContact O-N 3.11Å; R178-T180 VanDerWaalsContact C-N 3.33Å; R178-T180 PolarHBondContact O-N 3.17Å; R178-A181 PolarHBondContact O-N 3.06Å; R178-E182 WeakPolarHBondContact O-CG 3.43Å; R178-E182 PolarHBondContact O-N 3.14Å
179	V	81.1	Confident	79.8	Confident	9 Å²	9	56.5 Å²	56.5	6%	0.055	29%	0.286	C	S	.	.	H	α-helix	trans	-64.7	-39.6	178.1	173.5	0	0	0	0	110.8	V87 I90 L94 F132 V175 W176 A181 E182 M183	V87-V179 HydrophobicContact CG1-CG2 4.01Å; I90-V179 HydrophobicContact CG2-CG1 3.95Å; L94-V179 HydrophobicContact CD1-CG1 4.38Å; F132-V179 HydrophobicContact CD1-CG1 4.32Å; F132-V179 HydrophobicContact CE1-CG1 3.89Å; F132-V179 HydrophobicContact CZ-CG1 4.2Å; V175-V179 WeakPolarHBondContact O-CG2 3.5Å; V175-V179 PolarHBondContact O-N 3.41Å; V175-V179 VanDerWaalsContact O-N 3.11Å; W176-V179 PolarHBondContact O-N 3.48Å; W176-V179 VanDerWaalsContact O-N 3.15Å; V179-A181 VanDerWaalsContact C-N 3.33Å; V179-A181 PolarHBondContact O-N 2.69Å; V179-E182 PolarHBondContact O-N 3.47Å; V179-M183 WeakPolarHBondContact O-CB 3.41Å; V179-M183 PolarHBondContact O-N 3.5Å
180	T	82.1	Confident	81.2	Confident	8 Å²	8	53.2 Å²	53.2	5%	0.049	26%	0.264	C	S	.	.	H	α-helix	trans	-64.2	-36.5	174.7	-58.5	0	0	0	0	111.9	F129 F132 P134 W176 R178 M183 E184	F129-T180 HydrophobicContact CE2-CG2 4.44Å; F132-T180 HydrophobicContact CB-CG2 4.4Å; F132-T180 WeakPolarHBondContact O-CG2 3.34Å; P134-T180 HydrophobicContact CB-CG2 4.25Å; W176-T180 WeakPolarHBondContact O-CB 3.37Å; W176-T180 PolarHBondContact O-N 3.27Å; W176-T180 PolarHBondContact O-OG1 3.33Å; W176-T180 VanDerWaalsContact O-OG1 3.08Å; R178-T180 VanDerWaalsContact C-N 3.33Å; R178-T180 PolarHBondContact O-N 3.17Å; T180-M183 PolarHBondContact O-N 2.91Å; T180-E184 WeakPolarHBondContact O-CB 3.49Å; T180-E184 PolarHBondContact O-N 2.82Å
181	A	82.9	Confident	82.4	Confident	43 Å²	43	45.4 Å²	45.4	36%	0.355	22%	0.222	S	C	.	.	H	α-helix	trans	-70.9	-40.1	174.1	0	0	0	0	0	113.3	D177 R178 V179 M183 E184 Y185	D177-A181 VanDerWaalsContact O-CB 3.28Å; D177-A181 WeakPolarHBondContact O-CB 3.48Å; D177-A181 PolarHBondContact O-N 2.85Å; R178-A181 PolarHBondContact O-N 3.06Å; V179-A181 VanDerWaalsContact C-N 3.33Å; V179-A181 PolarHBondContact O-N 2.69Å; A181-M183 VanDerWaalsContact C-N 3.28Å; A181-M183 PolarHBondContact O-N 3.18Å; A181-E184 PolarHBondContact O-N 3.09Å; A181-Y185 WeakPolarHBondContact O-CB 3.39Å; A181-Y185 PolarHBondContact O-N 2.87Å
182	E	82.8	Confident	83.2	Confident	56 Å²	56	45.8 Å²	45.8	26%	0.262	23%	0.225	S	C	.	.	H	α-helix	trans	-58.4	-42.4	170.5	-74.2	175.6	-176.2	0	0	110.7	S91 L94 R178 V179 Y185 L186	S91-E182 WeakPolarHBondContact CB-OE2 3.46Å; S91-E182 PolarHBondContact OG-OE2 3.28Å; L94-E182 HydrophobicContact CD1-CB 3.67Å; R178-E182 WeakPolarHBondContact O-CG 3.43Å; R178-E182 PolarHBondContact O-N 3.14Å; V179-E182 PolarHBondContact O-N 3.47Å; E182-Y185 PolarHBondContact O-N 3.45Å; E182-L186 WeakPolarHBondContact O-CB 3.47Å; E182-L186 PolarHBondContact O-N 3.45Å
183	M	85.5	Confident	83.7	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-68.6	-46.5	177.9	-170.2	63.6	-175.4	0	0	112.3	L94 L125 W128 F129 F132 V179 T180 A181 Y185 L186 C187	L94-M183 HydrophobicContact CD1-CB 4.27Å; L94-M183 HydrophobicContact CD2-SD 3.37Å; L94-M183 WeakPolarHBondContact CD2-SD 3.35Å; L125-M183 HydrophobicContact CB-CE 4.07Å; L125-M183 HydrophobicContact CD2-CE 3.66Å; L125-M183 HydrophobicContact CD2-SD 4.26Å; L125-M183 HydrophobicContact CG-CE 4.49Å; L125-M183 WeakPolarHBondContact O-CE 3.26Å; W128-M183 HydrophobicContact CB-CE 3.48Å; W128-M183 VanDerWaalsContact CB-CE 3.48Å; W128-M183 HydrophobicContact CE3-CE 4.18Å; W128-M183 HydrophobicContact CG-CE 4.43Å; F129-M183 HydrophobicContact CB-CE 4.04Å; F129-M183 HydrophobicContact CB-CG 4.3Å; F129-M183 HydrophobicContact CD2-CB 4.28Å; F129-M183 HydrophobicContact CD2-CG 3.67Å; F129-M183 HydrophobicContact CG-CG 4.44Å; F132-M183 HydrophobicContact CD2-CG 4.44Å; V179-M183 WeakPolarHBondContact O-CB 3.41Å; V179-M183 PolarHBondContact O-N 3.5Å; T180-M183 PolarHBondContact O-N 2.91Å; A181-M183 VanDerWaalsContact C-N 3.28Å; A181-M183 PolarHBondContact O-N 3.18Å; M183-Y185 VanDerWaalsContact C-N 3.29Å; M183-Y185 PolarHBondContact O-N 2.86Å; M183-L186 PolarHBondContact O-N 3.32Å; M183-L186 HydrophobicContact SD-CD2 4.39Å; M183-C187 WeakPolarHBondContact O-CB 3.44Å; M183-C187 PolarHBondContact O-N 2.9Å; M183-C187 PolarHBondContact O-SG 3.5Å
184	E	84	Confident	84.3	Confident	40 Å²	40	39.3 Å²	39.3	19%	0.187	19%	0.187	C	C	.	.	H	α-helix	trans	-56.2	-43.6	173.9	160.7	156.1	-177.8	0	0	111.1	F129 S140 I144 T180 A181 C187 R188	F129-E184 HydrophobicContact CE2-CB 4.05Å; F129-E184 HydrophobicContact CZ-CB 4.3Å; S140-E184 PolarHBondContact OG-OE2 3.32Å; S140-E184 VanDerWaalsContact OG-OE2 3.12Å; I144-E184 HydrophobicContact CD1-CB 4.18Å; I144-E184 HydrophobicContact CD1-CG 3.48Å; I144-E184 VanDerWaalsContact CD1-CG 3.48Å; I144-E184 WeakPolarHBondContact CD1-OE1 3.47Å; T180-E184 WeakPolarHBondContact O-CB 3.49Å; T180-E184 PolarHBondContact O-N 2.82Å; A181-E184 PolarHBondContact O-N 3.09Å; E184-C187 WeakPolarHBondContact O-CB 3.4Å; E184-C187 PolarHBondContact O-N 3.28Å; E184-R188 WeakPolarHBondContact O-CG 3.25Å; E184-R188 PolarHBondContact O-N 3.06Å; E184-R188 IonicContact OE1-CZ 2.67Å; E184-R188 IonicContact OE1-NE 2.71Å; E184-R188 PolarHBondContact OE1-NE 3.26Å; E184-R188 IonicContact OE1-NH2 3.19Å; E184-R188 PolarHBondContact OE1-NH2 3.08Å
185	Y	85.4	Confident	84.7	Confident	76 Å²	76	36.4 Å²	36.4	30%	0.298	17%	0.172	S	C	.	.	H	α-helix	trans	-66.6	-37.2	177.4	179.7	-111.4	0	0	0	113	A181 E182 M183 Q189 N467 L469	A181-Y185 WeakPolarHBondContact O-CB 3.39Å; A181-Y185 PolarHBondContact O-N 2.87Å; E182-Y185 PolarHBondContact O-N 3.45Å; M183-Y185 VanDerWaalsContact C-N 3.29Å; M183-Y185 PolarHBondContact O-N 2.86Å; Y185-Q189 HydrophobicContact CE1-CG 4.39Å; Y185-Q189 HydrophobicContact CE2-CG 4.39Å; Y185-Q189 WeakPolarHBondContact O-CG 3.39Å; Y185-Q189 PolarHBondContact O-N 3.46Å; Y185-Q189 PolarHBondContact O-NE2 3.42Å; Y185-Q189 VanDerWaalsContact O-NE2 3.11Å; Y185-N467 PolarHBondContact OH-ND2 3.26Å; Y185-L469 HydrophobicContact CD1-CD1 3.53Å; Y185-L469 HydrophobicContact CE1-CB 4.47Å; Y185-L469 HydrophobicContact CE1-CD1 3.7Å
186	L	87.9	Confident	85	Confident	4 Å²	4	38.8 Å²	38.8	2%	0.021	18%	0.183	C	C	.	.	H	α-helix	trans	-66.8	-42.7	173.2	-178.5	62.7	0	0	0	112.2	L94 L97 L101 L125 E182 M183 Q189 A190	L94-L186 HydrophobicContact CB-CD2 4.2Å; L94-L186 HydrophobicContact CD2-CD2 3.83Å; L97-L186 HydrophobicContact CB-CD1 4.18Å; L97-L186 HydrophobicContact CB-CD2 3.98Å; L97-L186 HydrophobicContact CD1-CD2 4.43Å; L101-L186 HydrophobicContact CD1-CD1 3.84Å; L125-L186 HydrophobicContact CD1-CG 4.21Å; L125-L186 HydrophobicContact CD2-CD2 3.55Å; L125-L186 HydrophobicContact CD2-CG 3.99Å; E182-L186 WeakPolarHBondContact O-CB 3.47Å; E182-L186 PolarHBondContact O-N 3.45Å; M183-L186 PolarHBondContact O-N 3.32Å; M183-L186 HydrophobicContact SD-CD2 4.39Å; L186-Q189 PolarHBondContact O-N 3.33Å; L186-A190 WeakPolarHBondContact O-CB 3.38Å; L186-A190 PolarHBondContact O-N 2.81Å
187	C	86.8	Confident	85.3	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-59	-48.4	175.2	-70.3	0	0	0	0	111.6	I144 F148 M183 E184 A190 I191	I144-C187 HydrophobicContact CG2-CB 4.05Å; F148-C187 HydrophobicContact CE2-CB 3.68Å; F148-C187 HydrophobicContact CZ-CB 3.48Å; F148-C187 VanDerWaalsContact CZ-CB 3.48Å; F148-C187 WeakPolarHBondContact CZ-SG 3.44Å; M183-C187 WeakPolarHBondContact O-CB 3.44Å; M183-C187 PolarHBondContact O-N 2.9Å; M183-C187 PolarHBondContact O-SG 3.5Å; E184-C187 WeakPolarHBondContact O-CB 3.4Å; E184-C187 PolarHBondContact O-N 3.28Å; C187-A190 PolarHBondContact O-N 3.37Å; C187-I191 WeakPolarHBondContact O-CB 3.42Å; C187-I191 WeakPolarHBondContact O-CG1 3.42Å; C187-I191 PolarHBondContact O-N 2.69Å
188	R	86.2	Confident	85.6	Confident	91 Å²	91	34.5 Å²	34.5	34%	0.343	16%	0.163	S	C	.	.	H	α-helix	trans	-60.8	-43.7	176.4	-72.4	174.8	-179.5	-83	1.8	112.2	I144 E184 I191 N192	I144-R188 HydrophobicContact CD1-CG 4.37Å; E184-R188 WeakPolarHBondContact O-CG 3.25Å; E184-R188 PolarHBondContact O-N 3.06Å; E184-R188 IonicContact OE1-CZ 2.67Å; E184-R188 IonicContact OE1-NE 2.71Å; E184-R188 PolarHBondContact OE1-NE 3.26Å; E184-R188 IonicContact OE1-NH2 3.19Å; E184-R188 PolarHBondContact OE1-NH2 3.08Å; R188-I191 PolarHBondContact O-N 3Å; R188-N192 WeakPolarHBondContact O-CB 3.39Å; R188-N192 PolarHBondContact O-N 3.2Å
189	Q	86.7	Confident	85.8	Confident	24 Å²	24	33.4 Å²	33.4	11%	0.112	17%	0.173	C	C	.	.	H	α-helix	trans	-59.3	-48.5	173.4	-78.5	170.9	103	0	0	111.9	Y185 L186 I191 N192 C193	Y185-Q189 HydrophobicContact CE1-CG 4.39Å; Y185-Q189 HydrophobicContact CE2-CG 4.39Å; Y185-Q189 WeakPolarHBondContact O-CG 3.39Å; Y185-Q189 PolarHBondContact O-N 3.46Å; Y185-Q189 PolarHBondContact O-NE2 3.42Å; Y185-Q189 VanDerWaalsContact O-NE2 3.11Å; L186-Q189 PolarHBondContact O-N 3.33Å; Q189-I191 VanDerWaalsContact C-N 3.32Å; Q189-I191 PolarHBondContact O-N 3.44Å; Q189-N192 PolarHBondContact O-N 2.81Å; Q189-C193 WeakPolarHBondContact O-CB 3.47Å; Q189-C193 PolarHBondContact O-N 3.08Å; Q189-C193 PolarHBondContact O-SG 3.28Å; Q189-C193 VanDerWaalsContact O-SG 3.39Å
190	A	88.8	Confident	86	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.9	-40.5	-178.6	0	0	0	0	0	112.3	L101 V122 L125 L186 C187 L194	L101-A190 HydrophobicContact CD1-CB 3.73Å; V122-A190 HydrophobicContact CG2-CB 3.91Å; L125-A190 HydrophobicContact CD1-CB 3.52Å; L186-A190 WeakPolarHBondContact O-CB 3.38Å; L186-A190 PolarHBondContact O-N 2.81Å; C187-A190 PolarHBondContact O-N 3.37Å; A190-L194 WeakPolarHBondContact O-CB 3.31Å; A190-L194 PolarHBondContact O-N 3.16Å
191	I	87.5	Confident	86.2	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-65.2	-44.1	174.1	-70.6	168.1	0	0	0	111	E147 F148 C187 R188 Q189 L194 K195	E147-I191 HydrophobicContact CB-CD1 4.37Å; E147-I191 HydrophobicContact CG-CD1 4.23Å; E147-I191 HydrophobicContact CG-CG2 4.01Å; F148-I191 HydrophobicContact CD1-CD1 3.9Å; F148-I191 HydrophobicContact CD1-CG1 4.04Å; F148-I191 HydrophobicContact CD2-CD1 4.3Å; F148-I191 HydrophobicContact CE1-CD1 3.89Å; F148-I191 HydrophobicContact CE1-CG1 3.89Å; F148-I191 HydrophobicContact CE2-CD1 4.31Å; F148-I191 HydrophobicContact CG-CD1 4.11Å; F148-I191 HydrophobicContact CZ-CD1 4.11Å; F148-I191 HydrophobicContact CZ-CG1 4.47Å; C187-I191 WeakPolarHBondContact O-CB 3.42Å; C187-I191 WeakPolarHBondContact O-CG1 3.42Å; C187-I191 PolarHBondContact O-N 2.69Å; R188-I191 PolarHBondContact O-N 3Å; Q189-I191 VanDerWaalsContact C-N 3.32Å; Q189-I191 PolarHBondContact O-N 3.44Å; I191-L194 WeakPolarHBondContact O-CB 3.27Å; I191-L194 PolarHBondContact O-N 3.48Å; I191-K195 HydrophobicContact CG2-CD 4.21Å; I191-K195 VanDerWaalsContact CG2-CE 3.48Å; I191-K195 WeakPolarHBondContact O-CG 3.21Å; I191-K195 PolarHBondContact O-N 3.03Å
192	N	87.8	Confident	86.2	Confident	50 Å²	50	48.1 Å²	48.1	27%	0.267	23%	0.232	S	C	.	.	H	α-helix	trans	-67	-42.1	178.8	-75.8	-1.4	0	0	0	112.3	R188 Q189 L194 K195 I196	R188-N192 WeakPolarHBondContact O-CB 3.39Å; R188-N192 PolarHBondContact O-N 3.2Å; Q189-N192 PolarHBondContact O-N 2.81Å; N192-L194 VanDerWaalsContact C-N 3.28Å; N192-L194 PolarHBondContact O-N 3.36Å; N192-K195 PolarHBondContact O-N 3.3Å; N192-K195 PolarHBondContact OD1-NZ 2.9Å; N192-K195 VanDerWaalsContact OD1-NZ 3.15Å; N192-I196 WeakPolarHBondContact O-CB 3.39Å; N192-I196 VanDerWaalsContact O-CG1 3.27Å; N192-I196 WeakPolarHBondContact O-CG1 3.36Å; N192-I196 PolarHBondContact O-N 2.94Å
193	C	87.4	Confident	86.1	Confident	23 Å²	23	48 Å²	48	16%	0.155	23%	0.232	C	C	.	.	H	α-helix	trans	-57.6	-41.2	170.5	-70.1	0	0	0	0	111.7	L101 L118 Q189 I196 I197	L101-C193 HydrophobicContact CD2-CB 4.33Å; L118-C193 HydrophobicContact CD2-CB 4.45Å; Q189-C193 WeakPolarHBondContact O-CB 3.47Å; Q189-C193 PolarHBondContact O-N 3.08Å; Q189-C193 PolarHBondContact O-SG 3.28Å; Q189-C193 VanDerWaalsContact O-SG 3.39Å; C193-I196 PolarHBondContact O-N 3.32Å; C193-I197 WeakPolarHBondContact O-CB 3.34Å; C193-I197 VanDerWaalsContact O-CG1 3.29Å; C193-I197 WeakPolarHBondContact O-CG1 3.39Å; C193-I197 PolarHBondContact O-N 2.87Å
194	L	88	Confident	85.7	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-65.6	-42	176.1	-179.2	62.2	0	0	0	112.3	I115 L118 K119 V122 C151 A190 I191 N192 A198 L205	I115-L194 HydrophobicContact CD1-CD1 3.9Å; I115-L194 HydrophobicContact CG1-CD1 3.73Å; L118-L194 HydrophobicContact CD2-CB 3.97Å; L118-L194 HydrophobicContact CD2-CD1 4.06Å; L118-L194 HydrophobicContact CG-CB 4.26Å; L118-L194 HydrophobicContact CG-CD1 4.19Å; K119-L194 HydrophobicContact CG-CD1 3.87Å; K119-L194 HydrophobicContact CG-CD2 4.11Å; V122-L194 HydrophobicContact CG1-CD2 4.22Å; V122-L194 HydrophobicContact CG2-CD2 4.26Å; C151-L194 HydrophobicContact CB-CD2 3.87Å; A190-L194 WeakPolarHBondContact O-CB 3.31Å; A190-L194 PolarHBondContact O-N 3.16Å; I191-L194 WeakPolarHBondContact O-CB 3.27Å; I191-L194 PolarHBondContact O-N 3.48Å; N192-L194 VanDerWaalsContact C-N 3.28Å; N192-L194 PolarHBondContact O-N 3.36Å; L194-A198 WeakPolarHBondContact O-CB 3.48Å; L194-A198 PolarHBondContact O-N 3.39Å; L194-L205 HydrophobicContact CD1-CD2 4.31Å; L194-L205 HydrophobicContact CG-CD1 4.26Å; L194-L205 HydrophobicContact CG-CD2 4.34Å
195	K	87	Confident	85.1	Confident	77 Å²	77	52.3 Å²	52.3	34%	0.335	26%	0.256	S	S	.	.	H	α-helix	trans	-60.5	-48.4	174.2	-71	167.3	-175.9	162	0	111.6	E147 I191 N192 A198 C199	E147-K195 WeakPolarHBondContact OE1-CE 3.42Å; E147-K195 IonicContact OE1-NZ 3.9Å; E147-K195 PolarHBondContact OE1-NZ 3.09Å; E147-K195 IonicContact OE2-NZ 3.25Å; I191-K195 HydrophobicContact CG2-CD 4.21Å; I191-K195 VanDerWaalsContact CG2-CE 3.48Å; I191-K195 WeakPolarHBondContact O-CG 3.21Å; I191-K195 PolarHBondContact O-N 3.03Å; N192-K195 PolarHBondContact O-N 3.3Å; N192-K195 PolarHBondContact OD1-NZ 2.9Å; N192-K195 VanDerWaalsContact OD1-NZ 3.15Å; K195-A198 PolarHBondContact O-N 2.82Å; K195-C199 VanDerWaalsContact O-CB 3.28Å; K195-C199 WeakPolarHBondContact O-CB 3.28Å; K195-C199 PolarHBondContact O-N 3.23Å
196	I	85.4	Confident	84.1	Confident	88 Å²	88	52.1 Å²	52.1	45%	0.451	26%	0.26	S	S	.	.	H	α-helix	trans	-64.3	-49.4	-177.4	-68.5	164.5	0	0	0	110.6	N192 C193 C199 K200	N192-I196 WeakPolarHBondContact O-CB 3.39Å; N192-I196 VanDerWaalsContact O-CG1 3.27Å; N192-I196 WeakPolarHBondContact O-CG1 3.36Å; N192-I196 PolarHBondContact O-N 2.94Å; C193-I196 PolarHBondContact O-N 3.32Å; I196-C199 PolarHBondContact O-N 3.34Å; I196-K200 WeakPolarHBondContact O-CB 3.21Å; I196-K200 PolarHBondContact O-N 3.19Å
197	I	86.4	Confident	82.5	Confident	10 Å²	10	56 Å²	56	5%	0.051	29%	0.286	C	S	.	.	H	α-helix	trans	-66.3	-40.9	179.6	-66.7	169.4	0	0	0	110.6	V106 F109 I115 L118 C193 C199 K200 H201	V106-I197 HydrophobicContact CG2-CD1 4.38Å; F109-I197 HydrophobicContact CB-CD1 3.86Å; I115-I197 HydrophobicContact CD1-CG2 4.15Å; I115-I197 HydrophobicContact CG1-CG2 4.36Å; L118-I197 HydrophobicContact CD2-CD1 3.9Å; C193-I197 WeakPolarHBondContact O-CB 3.34Å; C193-I197 VanDerWaalsContact O-CG1 3.29Å; C193-I197 WeakPolarHBondContact O-CG1 3.39Å; C193-I197 PolarHBondContact O-N 2.87Å; I197-C199 PolarHBondContact O-N 3.13Å; I197-K200 PolarHBondContact O-N 3.3Å; I197-H201 PolarHBondContact O-CD2 3.21Å; I197-H201 VanDerWaalsContact O-CD2 3.26Å; I197-H201 PolarHBondContact O-N 2.75Å; I197-H201 VanDerWaalsContact O-N 3.07Å
198	A	86.1	Confident	80.4	Confident	3 Å²	3	64.3 Å²	64.3	3%	0.025	33%	0.325	C	S	.	.	H	α-helix	trans	-63.1	-41.2	175.4	0	0	0	0	0	112.4	I115 L194 K195 Q202 I203 L205	I115-A198 HydrophobicContact CD1-CB 4.16Å; L194-A198 WeakPolarHBondContact O-CB 3.48Å; L194-A198 PolarHBondContact O-N 3.39Å; K195-A198 PolarHBondContact O-N 2.82Å; A198-Q202 PolarHBondContact O-N 2.94Å; A198-I203 HydrophobicContact CB-CB 4.32Å; A198-I203 PolarHBondContact O-N 3.17Å; A198-L205 HydrophobicContact CB-CD1 3.77Å; A198-L205 HydrophobicContact CB-CD2 3.81Å; A198-L205 HydrophobicContact CB-CG 3.75Å
199	C	86.3	Confident	78.1	Confident	99 Å²	99	68.5 Å²	68.5	67%	0.669	35%	0.345	S	S	*	.	H	α-helix	trans	-62.6	-50.6	174.9	-177.2	0	0	0	0	111.6	K195 I196 I197 H201 Q202	K195-C199 VanDerWaalsContact O-CB 3.28Å; K195-C199 WeakPolarHBondContact O-CB 3.28Å; K195-C199 PolarHBondContact O-N 3.23Å; I196-C199 PolarHBondContact O-N 3.34Å; I197-C199 PolarHBondContact O-N 3.13Å; C199-H201 VanDerWaalsContact C-N 3.27Å; C199-H201 PolarHBondContact O-N 2.88Å; C199-Q202 PolarHBondContact O-N 3.23Å; C199-Q202 VanDerWaalsContact O-N 3.09Å
200	K	85.1	Confident	75.3	Confident	128 Å²	128	77.6 Å²	77.6	56%	0.557	38%	0.384	S	S	*	.	H	α-helix	trans	-54.2	-39.9	178.3	179.2	-179.3	174.5	-175.2	0	113.1	D110 I196 I197	D110-K200 WeakPolarHBondContact OD1-CD 3.49Å; D110-K200 WeakPolarHBondContact OD1-CE 3.18Å; D110-K200 IonicContact OD1-NZ 2.69Å; D110-K200 PolarHBondContact OD1-NZ 3.46Å; D110-K200 IonicContact OD2-NZ 3.81Å; D110-K200 PolarHBondContact OD2-NZ 3.44Å; I196-K200 WeakPolarHBondContact O-CB 3.21Å; I196-K200 PolarHBondContact O-N 3.19Å; I197-K200 PolarHBondContact O-N 3.3Å
201	H	85.7	Confident	72.5	Confident	56 Å²	56	84 Å²	84	26%	0.259	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	10.2	-178.7	-65.3	-77.2	0	0	0	114	D110 P112 I197 C199 I203	D110-H201 IonicContact OD1-CD2 3.75Å; D110-H201 IonicContact OD1-CE1 3.21Å; D110-H201 IonicContact OD1-NE2 3.39Å; D110-H201 PolarHBondContact OD1-NE2 2.83Å; P112-H201 HydrophobicContact CG-CB 4.16Å; I197-H201 PolarHBondContact O-CD2 3.21Å; I197-H201 VanDerWaalsContact O-CD2 3.26Å; I197-H201 PolarHBondContact O-N 2.75Å; I197-H201 VanDerWaalsContact O-N 3.07Å; C199-H201 VanDerWaalsContact C-N 3.27Å; C199-H201 PolarHBondContact O-N 2.88Å; H201-I203 VanDerWaalsContact C-N 3.33Å; H201-I203 HydrophobicContact CB-CD1 3.9Å; H201-I203 HydrophobicContact CB-CG1 4.02Å; H201-I203 PolarHBondContact O-N 3.5Å
202	Q	83.2	Confident	69.6	Low	186 Å²	186	89.2 Å²	89.2	87%	0.869	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	38.5	178.7	-56.7	-177.7	1.5	0	0	114.7	A198 C199	A198-Q202 PolarHBondContact O-N 2.94Å; C199-Q202 PolarHBondContact O-N 3.23Å; C199-Q202 VanDerWaalsContact O-N 3.09Å
203	I	81.1	Confident	66.6	Low	54 Å²	54	92.6 Å²	92.6	28%	0.277	48%	0.48	S	S	.	.			trans	-96.2	119	-178.1	-57	177.6	0	0	0	109.5	P112 I115 A198 H201	P112-I203 HydrophobicContact CB-CD1 4.27Å; I115-I203 HydrophobicContact CD1-CD1 3.86Å; I115-I203 HydrophobicContact CG2-CD1 4.08Å; A198-I203 HydrophobicContact CB-CB 4.32Å; A198-I203 PolarHBondContact O-N 3.17Å; H201-I203 VanDerWaalsContact C-N 3.33Å; H201-I203 HydrophobicContact CB-CD1 3.9Å; H201-I203 HydrophobicContact CB-CG1 4.02Å; H201-I203 PolarHBondContact O-N 3.5Å
204	D	76.5	Confident	63.7	Low	102 Å²	102	97 Å²	97	55%	0.545	51%	0.505	S	S	.	.			trans	-68.5	137.9	170.7	-162.5	-9.4	0	0	0	110.4	N206	D204-N206 PolarHBondContact OD1-N 2.93Å; D204-N206 PolarHBondContact OD1-ND2 2.76Å
205	L	72.6	Confident	60.8	Low	27 Å²	27	107.3 Å²	107.3	14%	0.141	54%	0.544	C	S	.	.			trans	-101.3	-17.4	178.3	-66.4	-179.8	0	0	0	112.6	K119 L194 A198	K119-L205 VanDerWaalsContact CE-CD2 3.44Å; L194-L205 HydrophobicContact CD1-CD2 4.31Å; L194-L205 HydrophobicContact CG-CD1 4.26Å; L194-L205 HydrophobicContact CG-CD2 4.34Å; A198-L205 HydrophobicContact CB-CD1 3.77Å; A198-L205 HydrophobicContact CB-CD2 3.81Å; A198-L205 HydrophobicContact CB-CG 3.75Å
206	N	63.7	Low	58	Low	73 Å²	73	110.9 Å²	110.9	39%	0.39	57%	0.566	S	S	.	*			trans	-83.1	122	-174.6	-53.8	-87.3	0	0	0	110.9	R150 D204 E208	R150-N206 PolarHBondContact NE-OD1 3.21Å; R150-N206 PolarHBondContact NH2-OD1 3.08Å; D204-N206 PolarHBondContact OD1-N 2.93Å; D204-N206 PolarHBondContact OD1-ND2 2.76Å; N206-E208 VanDerWaalsContact C-N 3.3Å; N206-E208 PolarHBondContact O-N 3.44Å
207	P	54.9	Low	55.2	Low	86 Å²	86	113.4 Å²	113.4	56%	0.558	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-4.5	-176.4	31.1	-35.7	0	0	0	115
208	E	43.3	Very low	52.3	Low	173 Å²	173	117.5 Å²	117.5	81%	0.808	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	-15.9	-161.2	-59	-165.5	129.6	0	0	115.6	N206 K210	N206-E208 VanDerWaalsContact C-N 3.3Å; N206-E208 PolarHBondContact O-N 3.44Å; E208-K210 PolarHBondContact O-N 3.26Å
209	K	36.5	Very low	49.5	Very low	179 Å²	179	124.2 Å²	124.2	78%	0.778	64%	0.638	S	S	*	*			trans	-80.5	91.4	176.8	-78.8	-175.4	177.5	175.7	0	111.6	L211	K209-L211 PolarHBondContact O-N 2.71Å
210	K	28.1	Very low	46.5	Very low	215 Å²	215	126 Å²	126	94%	0.935	64%	0.641	S	S	*	*			trans	-63.8	80	161.3	-78.8	-176.5	176.1	175	0	110.9	E208	E208-K210 PolarHBondContact O-N 3.26Å
211	L	29.3	Very low	43.7	Very low	135 Å²	135	131.3 Å²	131.3	71%	0.707	66%	0.657	S	S	*	*			trans	-92.1	142	170.8	-149.2	69.5	0	0	0	110	K209 S213	K209-L211 PolarHBondContact O-N 2.71Å; L211-S213 PolarHBondContact O-N 2.67Å
212	P	26.9	Very low	40.8	Very low	109 Å²	109	132.4 Å²	132.4	71%	0.708	68%	0.676	S	S	*	*			trans	-72.5	125.3	-173.3	-15.9	30.5	0	0	0	112.5	V214	P212-V214 VanDerWaalsContact C-N 3.33Å; P212-V214 PolarHBondContact O-N 3.2Å
213	S	25	Very low	38.1	Very low	122 Å²	122	127.4 Å²	127.4	85%	0.853	66%	0.662	S	S	*	*			trans	28.2	55.6	155.3	-59.1	0	0	0	0	117.2	L211 R215	L211-S213 PolarHBondContact O-N 2.67Å; S213-R215 PolarHBondContact O-N 3.12Å
214	V	26.9	Very low	35.4	Very low	114 Å²	114	130 Å²	130	69%	0.691	68%	0.683	S	S	*	*			trans	-65	103.2	169.2	179.2	0	0	0	0	107.5	P212 I216	P212-V214 VanDerWaalsContact C-N 3.33Å; P212-V214 PolarHBondContact O-N 3.2Å; V214-I216 PolarHBondContact O-N 2.72Å; V214-I216 VanDerWaalsContact O-N 3.13Å
215	R	26.8	Very low	33.2	Very low	218 Å²	218	132.6 Å²	132.6	82%	0.823	69%	0.692	S	S	*	*			trans	-57.2	119.2	166.8	-69.9	179.7	177.1	174.1	-0.2	106.8	S213 I217	S213-R215 PolarHBondContact O-N 3.12Å; R215-I217 VanDerWaalsContact C-N 3.27Å; R215-I217 PolarHBondContact O-N 3.23Å
216	I	28.1	Very low	31.1	Very low	152 Å²	152	140.3 Å²	140.3	78%	0.779	73%	0.727	S	S	*	*			trans	-62.5	99.5	165.1	-63.8	170	0	0	0	105.9	V214 T218	V214-I216 PolarHBondContact O-N 2.72Å; V214-I216 VanDerWaalsContact O-N 3.13Å; I216-T218 PolarHBondContact O-N 2.85Å
217	I	26.1	Very low	29.5	Very low	141 Å²	141	142.3 Å²	142.3	72%	0.723	75%	0.747	S	S	*	*			trans	-71.2	90.5	165.7	-60.5	178.1	0	0	0	104.6	R215 I219	R215-I217 VanDerWaalsContact C-N 3.27Å; R215-I217 PolarHBondContact O-N 3.23Å; I217-I219 VanDerWaalsContact C-N 3.29Å; I217-I219 HydrophobicContact CG2-CG1 4.31Å; I217-I219 PolarHBondContact O-N 2.95Å
218	T	26.7	Very low	28.4	Very low	96 Å²	96	143.1 Å²	143.1	59%	0.589	75%	0.754	S	S	*	*			trans	-58.4	100.7	164.9	-52.7	0	0	0	0	106.4	I216 N220	I216-T218 PolarHBondContact O-N 2.85Å; T218-N220 WeakPolarHBondContact CG2-OD1 3.33Å; T218-N220 PolarHBondContact O-N 3.49Å
219	I	26.3	Very low	27.9	Very low	143 Å²	143	143.3 Å²	143.3	73%	0.733	76%	0.755	S	S	*	*			trans	-69	87.1	169.4	-58.9	179.7	0	0	0	105.7	I217 R221	I217-I219 VanDerWaalsContact C-N 3.29Å; I217-I219 HydrophobicContact CG2-CG1 4.31Å; I217-I219 PolarHBondContact O-N 2.95Å; I219-R221 PolarHBondContact O-N 3.25Å
220	N	24.5	Very low	27.8	Very low	137 Å²	137	142.6 Å²	142.6	73%	0.733	76%	0.76	S	S	*	*			trans	-61.9	85	166.7	-74.1	-23.8	0	0	0	107.1	T218 A222	T218-N220 WeakPolarHBondContact CG2-OD1 3.33Å; T218-N220 PolarHBondContact O-N 3.49Å; N220-A222 PolarHBondContact O-N 3.22Å
221	R	26.2	Very low	27.9	Very low	239 Å²	239	138.1 Å²	138.1	90%	0.902	75%	0.753	S	S	*	*			trans	-54.6	111.1	158	-100.7	-171.9	163.2	113	-1.2	105.5	I219 S223	I219-R221 PolarHBondContact O-N 3.25Å; R221-S223 PolarHBondContact O-N 3.15Å
222	A	24.8	Very low	27.9	Very low	80 Å²	80	136.1 Å²	136.1	66%	0.661	76%	0.755	S	S	*	*			trans	-64.4	110.7	-159.6	0	0	0	0	0	110.8	N220 C224	N220-A222 PolarHBondContact O-N 3.22Å; A222-C224 PolarHBondContact O-N 3.46Å
223	S	26.2	Very low	27.9	Very low	80 Å²	80	140.1 Å²	140.1	56%	0.559	77%	0.767	S	S	*	*			trans	-72.5	107.1	156.2	-169.6	0	0	0	0	106.9	R221 H225	R221-S223 PolarHBondContact O-N 3.15Å; S223-H225 PolarHBondContact O-N 3.42Å; S223-H225 PolarHBondContact OG-CD2 3.38Å; S223-H225 VanDerWaalsContact OG-CD2 3.23Å; S223-H225 PolarHBondContact OG-CE1 3.06Å; S223-H225 PolarHBondContact OG-NE2 3.16Å
224	C	25.2	Very low	28.1	Very low	108 Å²	108	142.1 Å²	142.1	73%	0.73	76%	0.762	S	S	*	*			trans	-74.5	55.6	-177.7	-62.9	0	0	0	0	112.1	A222 H226	A222-C224 PolarHBondContact O-N 3.46Å; C224-H226 PolarHBondContact O-N 3.22Å; C224-H226 VanDerWaalsContact O-N 3.08Å
225	H	28.6	Very low	28.1	Very low	158 Å²	158	145.2 Å²	145.2	73%	0.731	77%	0.767	S	S	*	*			trans	-74.8	94.5	170.6	-65	-38.8	0	0	0	109.6	S223 S227	S223-H225 PolarHBondContact O-N 3.42Å; S223-H225 PolarHBondContact OG-CD2 3.38Å; S223-H225 VanDerWaalsContact OG-CD2 3.23Å; S223-H225 PolarHBondContact OG-CE1 3.06Å; S223-H225 PolarHBondContact OG-NE2 3.16Å; H225-S227 PolarHBondContact O-N 3.28Å
226	H	29.5	Very low	28	Very low	188 Å²	188	140.5 Å²	140.5	87%	0.87	77%	0.767	S	S	*	*			trans	-61.1	95.4	168	-86	-73.1	0	0	0	110.5	C224 S228	C224-H226 PolarHBondContact O-N 3.22Å; C224-H226 VanDerWaalsContact O-N 3.08Å; H226-S228 PolarHBondContact O-N 2.82Å; H226-S228 VanDerWaalsContact O-N 3.12Å
227	S	30.8	Very low	28	Very low	116 Å²	116	142.1 Å²	142.1	81%	0.811	77%	0.771	S	S	*	*			trans	-76.4	92.5	166.7	61.4	0	0	0	0	109.6	H225 H229	H225-S227 PolarHBondContact O-N 3.28Å; S227-H229 PolarHBondContact O-N 3.49Å
228	S	30.3	Very low	28.1	Very low	102 Å²	102	144.3 Å²	144.3	71%	0.713	78%	0.775	S	S	*	*			trans	-68.6	113.1	172.1	54.2	0	0	0	0	110.7	H226	H226-S228 PolarHBondContact O-N 2.82Å; H226-S228 VanDerWaalsContact O-N 3.12Å
229	H	33.2	Very low	28.1	Very low	177 Å²	177	148.2 Å²	148.2	82%	0.819	79%	0.787	S	S	*	*			trans	-175.3	102.5	145.2	-98.6	-60.1	0	0	0	112.4	S227	S227-H229 PolarHBondContact O-N 3.49Å
230	N	33.6	Very low	28.1	Very low	165 Å²	165	150.5 Å²	150.5	88%	0.882	79%	0.791	S	S	*	*			trans	-174.2	102.6	137.7	-106.9	-5.2	0	0	0	110.3
231	P	30.1	Very low	28.3	Very low	121 Å²	121	154.3 Å²	154.3	79%	0.786	80%	0.802	S	S	*	*			trans	-99.2	87.6	179.9	35.5	-29.6	0	0	0	111.9
232	A	29.3	Very low	28.3	Very low	92 Å²	92	150.7 Å²	150.7	76%	0.76	80%	0.795	S	S	*	*			trans	-165	94.3	165.5	0	0	0	0	0	113.3
233	M	28.9	Very low	28.4	Very low	193 Å²	193	154 Å²	154	95%	0.951	80%	0.8	S	S	*	*				-171.6	161.8	124	-91.3	-138.8	71.9	0	0	109.8
234	H	27.6	Very low	28.4	Very low	165 Å²	165	157.2 Å²	157.2	76%	0.764	81%	0.809	S	S	*	*			trans	-107.8	147.6	-162.2	-114.3	-67.6	0	0	0	113.3
235	K	26.7	Very low	28.5	Very low	179 Å²	179	157.1 Å²	157.1	78%	0.778	81%	0.805	S	S	*	*			trans	71.5	139	155.9	-62.1	167	-179.6	178.8	0	117.1
236	S	25.4	Very low	28.5	Very low	118 Å²	118	156.9 Å²	156.9	83%	0.825	81%	0.808	S	S	*	*			trans	61.6	144.7	170.1	35.4	0	0	0	0	115
237	E	28.3	Very low	28.5	Very low	186 Å²	186	152.8 Å²	152.8	87%	0.869	80%	0.796	S	S	*	*			cis	-129.2	173.6	18.8	-68.9	175.1	110.1	0	0	113.8
238	K	28.2	Very low	28.6	Very low	187 Å²	187	151.5 Å²	151.5	81%	0.813	79%	0.785	S	S	*	*			trans	-85.4	160.6	159	-65.3	174.2	-179.6	175.2	0	108.2
239	H	27.4	Very low	28.8	Very low	178 Å²	178	152.1 Å²	152.1	82%	0.824	79%	0.789	S	S	*	*			trans	70.7	99	-173.2	-54.2	-95.5	0	0	0	114.5
240	F	25.3	Very low	29.1	Very low	191 Å²	191	147.7 Å²	147.7	84%	0.838	77%	0.771	S	S	*	*			trans	179.2	76	133.6	-101.4	-66.2	0	0	0	108.7
241	K	28.3	Very low	29.6	Very low	217 Å²	217	143.3 Å²	143.3	94%	0.943	75%	0.748	S	S	*	*			trans	-114.6	51.9	169.9	-95.3	-163.5	173.8	-172.5	0	110.5
242	E	26.7	Very low	30.4	Very low	164 Å²	164	143.3 Å²	143.3	77%	0.766	75%	0.748	S	S	*	*			trans	-120.7	58	174.1	-165.5	163.5	-140.6	0	0	109.3	I244	E242-I244 PolarHBondContact O-N 3.31Å
243	I	27.2	Very low	31.1	Very low	148 Å²	148	145.4 Å²	145.4	76%	0.759	75%	0.746	S	S	*	*			trans	-83.3	108.4	170.5	-64.2	-179.6	0	0	0	107	T245	I243-T245 PolarHBondContact O-N 3.45Å; I243-T245 PolarHBondContact O-OG1 2.73Å; I243-T245 VanDerWaalsContact O-OG1 3.05Å
244	I	26.5	Very low	32.4	Very low	148 Å²	148	137.8 Å²	137.8	76%	0.759	71%	0.708	S	S	*	*			trans	-55	96.2	-179.1	-60.1	168.8	0	0	0	109.3	E242 I246	E242-I244 PolarHBondContact O-N 3.31Å; I244-I246 HydrophobicContact CG2-CG1 4.07Å; I244-I246 PolarHBondContact O-N 3.45Å
245	T	27.4	Very low	34.2	Very low	106 Å²	106	131.4 Å²	131.4	65%	0.65	68%	0.68	S	S	*	*			trans	-89.8	96.1	177.4	-54.9	0	0	0	0	107	I243 T247	I243-T245 PolarHBondContact O-N 3.45Å; I243-T245 PolarHBondContact O-OG1 2.73Å; I243-T245 VanDerWaalsContact O-OG1 3.05Å; T245-T247 HydrophobicContact CG2-CG2 3.98Å; T245-T247 PolarHBondContact O-N 2.9Å
246	I	27.7	Very low	36.3	Very low	154 Å²	154	122.9 Å²	122.9	79%	0.79	64%	0.643	S	S	*	*			trans	-70.5	77.1	171	-51	179.8	0	0	0	107.7	I244	I244-I246 HydrophobicContact CG2-CG1 4.07Å; I244-I246 PolarHBondContact O-N 3.45Å
247	T	30	Very low	38.6	Very low	101 Å²	101	119 Å²	119	62%	0.62	61%	0.61	S	S	*	*			trans	-62.3	130.3	162.2	44.8	0	0	0	0	107.2	T245 S249	T245-T247 HydrophobicContact CG2-CG2 3.98Å; T245-T247 PolarHBondContact O-N 2.9Å; T247-S249 PolarHBondContact O-N 2.82Å
248	P	32.6	Very low	40.6	Very low	89 Å²	89	114.9 Å²	114.9	58%	0.578	59%	0.594	S	S	*	*			trans	-59.3	132.4	160.2	28	-32.1	0	0	0	106.3	I250 T726	P248-I250 VanDerWaalsContact C-N 3.3Å; P248-I250 PolarHBondContact O-N 3.44Å; P248-T726 HydrophobicContact CB-CG2 4.48Å; P248-T726 HydrophobicContact CG-CG2 4.49Å
249	S	33.8	Very low	42.8	Very low	115 Å²	115	108 Å²	108	80%	0.804	57%	0.566	S	S	*	*			trans	-67.5	89.1	-176.9	53.4	0	0	0	0	109.9	T247 N251	T247-S249 PolarHBondContact O-N 2.82Å; S249-N251 PolarHBondContact O-N 3.27Å
250	I	41	Very low	45.4	Very low	85 Å²	85	104 Å²	104	44%	0.436	55%	0.55	S	S	.	*			trans	-57.9	111.5	172.6	-60.4	165.6	0	0	0	106.2	P248 P252 S730	P248-I250 VanDerWaalsContact C-N 3.3Å; P248-I250 PolarHBondContact O-N 3.44Å; I250-P252 VanDerWaalsContact O-CD 3.25Å; I250-P252 WeakPolarHBondContact O-CD 3.25Å; I250-P252 VanDerWaalsContact O-N 3.08Å; I250-S730 WeakPolarHBondContact CD1-OG 3.45Å
251	N	43.2	Very low	48.3	Very low	73 Å²	73	97.2 Å²	97.2	39%	0.39	52%	0.523	S	S	.	.			trans	-65.6	109.2	-175.8	-162.2	-7.9	0	0	0	107.8	S249 L253 I254	S249-N251 PolarHBondContact O-N 3.27Å; N251-L253 PolarHBondContact O-N 3Å; N251-I254 HydrophobicContact CB-CD1 3.97Å; N251-I254 HydrophobicContact CB-CG1 4.22Å; N251-I254 PolarHBondContact O-N 2.88Å
252	P	46.6	Very low	51.1	Low	121 Å²	121	89.9 Å²	89.9	79%	0.786	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-0.4	-161.4	29.2	-36.5	0	0	0	113.9	I250	I250-P252 VanDerWaalsContact O-CD 3.25Å; I250-P252 WeakPolarHBondContact O-CD 3.25Å; I250-P252 VanDerWaalsContact O-N 3.08Å
253	L	44.1	Very low	54	Low	136 Å²	136	83.7 Å²	83.7	71%	0.712	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-14.2	176.1	-57	175.3	0	0	0	112.9	N251 N255	N251-L253 PolarHBondContact O-N 3Å; L253-N255 PolarHBondContact O-N 3.04Å
254	I	56.8	Low	57.1	Low	33 Å²	33	76.7 Å²	76.7	17%	0.169	43%	0.432	C	S	.	.			trans	-80.1	84.2	-179	-54.4	176.8	0	0	0	109.9	N251 L259 D723 W727	N251-I254 HydrophobicContact CB-CD1 3.97Å; N251-I254 HydrophobicContact CB-CG1 4.22Å; N251-I254 PolarHBondContact O-N 2.88Å; I254-L259 HydrophobicContact CG2-CD1 4.1Å; I254-L259 HydrophobicContact CG2-CD2 4.27Å; I254-L259 HydrophobicContact CG2-CG 4.41Å; I254-D723 HydrophobicContact CD1-CB 3.82Å; I254-W727 HydrophobicContact CB-CG 4.45Å; I254-W727 HydrophobicContact CG2-CB 3.88Å; I254-W727 HydrophobicContact CG2-CD2 4.19Å; I254-W727 HydrophobicContact CG2-CG 3.6Å; I254-W727 PolarHBondContact O-NE1 2.84Å
255	N	65.5	Low	60.3	Low	30 Å²	30	69.7 Å²	69.7	16%	0.16	40%	0.395	C	S	.	.			trans	-99	140.6	163.7	-166.8	-10.2	0	0	0	109.5	L253 W257 N258 L259 D320	L253-N255 PolarHBondContact O-N 3.04Å; N255-W257 PolarHBondContact O-N 3.21Å; N255-W257 VanDerWaalsContact O-N 3.13Å; N255-W257 VanDerWaalsContact OD1-CD1 3.23Å; N255-N258 PolarHBondContact O-N 2.9Å; N255-L259 PolarHBondContact O-N 3.46Å; N255-D320 VanDerWaalsContact ND2-CB 3.27Å; N255-D320 WeakPolarHBondContact ND2-CB 3.44Å; N255-D320 PolarHBondContact ND2-O 3.25Å
256	L	71.1	Confident	63.5	Low	1 Å²	1	67.2 Å²	67.2	1%	0.005	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-50.1	-39.6	178.3	175.5	60.7	0	0	0	112.2	N258 L259 V264 W381 I384 W727	L256-N258 VanDerWaalsContact C-N 3.27Å; L256-N258 PolarHBondContact O-N 3.46Å; L256-L259 PolarHBondContact O-N 3.13Å; L256-V264 HydrophobicContact CD1-CG1 4.27Å; L256-V264 HydrophobicContact CD1-CG2 4.34Å; L256-W381 HydrophobicContact CD2-CH2 4.14Å; L256-W381 HydrophobicContact CD2-CZ2 3.46Å; L256-W381 VanDerWaalsContact CD2-CZ2 3.46Å; L256-I384 HydrophobicContact CD1-CD1 4.46Å; L256-W727 HydrophobicContact CB-CH2 4.35Å; L256-W727 HydrophobicContact CB-CZ2 3.93Å; L256-W727 HydrophobicContact CD1-CH2 4.02Å; L256-W727 HydrophobicContact CD1-CZ2 4.45Å
257	W	72.2	Confident	66.6	Low	35 Å²	35	60.5 Å²	60.5	13%	0.133	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-76.2	-11.2	-176.3	-39.9	119.9	0	0	0	114.3	N255 S313 D320 P322 C377 T380 W381	N255-W257 PolarHBondContact O-N 3.21Å; N255-W257 VanDerWaalsContact O-N 3.13Å; N255-W257 VanDerWaalsContact OD1-CD1 3.23Å; W257-S313 WeakPolarHBondContact CZ2-O 3.45Å; W257-D320 PolarHBondContact NE1-O 3.05Å; W257-P322 HydrophobicContact CB-CB 4.15Å; W257-P322 HydrophobicContact CD2-CB 4.33Å; W257-P322 HydrophobicContact CD2-CG 3.88Å; W257-P322 HydrophobicContact CE3-CB 4.18Å; W257-P322 HydrophobicContact CE3-CG 3.73Å; W257-P322 HydrophobicContact CG-CB 4.33Å; W257-P322 HydrophobicContact CG-CG 4.25Å; W257-P322 HydrophobicContact CZ3-CG 4.22Å; W257-C377 HydrophobicContact CH2-CB 3.7Å; W257-C377 HydrophobicContact CZ2-CB 4.24Å; W257-C377 HydrophobicContact CZ3-CB 4.28Å; W257-T380 HydrophobicContact CE3-CG2 3.9Å; W257-T380 HydrophobicContact CZ3-CG2 3.92Å; W257-W381 AromaticContact CH2-NE1 3.94Å
258	N	70.3	Confident	69.7	Low	101 Å²	101	55.8 Å²	55.8	54%	0.54	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-100.4	-7.3	175.3	-66.5	-18.9	0	0	0	112.5	N255 L256	N255-N258 PolarHBondContact O-N 2.9Å; L256-N258 VanDerWaalsContact C-N 3.27Å; L256-N258 PolarHBondContact O-N 3.46Å
259	L	74.1	Confident	72.8	Confident	43 Å²	43	51.6 Å²	51.6	23%	0.225	29%	0.285	C	S	.	.	S	Bend	trans	-83.4	147.2	178.3	-69.3	174.6	0	0	0	111.3	I254 N255 L256 L261 V264 F724	I254-L259 HydrophobicContact CG2-CD1 4.1Å; I254-L259 HydrophobicContact CG2-CD2 4.27Å; I254-L259 HydrophobicContact CG2-CG 4.41Å; N255-L259 PolarHBondContact O-N 3.46Å; L256-L259 PolarHBondContact O-N 3.13Å; L259-L261 PolarHBondContact O-N 3.23Å; L259-V264 HydrophobicContact CB-CG2 3.61Å; L259-V264 HydrophobicContact CD1-CG2 3.94Å; L259-V264 HydrophobicContact CG-CG2 4.44Å; L259-F724 HydrophobicContact CD1-CD2 4.03Å; L259-F724 HydrophobicContact CD1-CE2 4.32Å
260	N	82.6	Confident	75.7	Confident	92 Å²	92	47.1 Å²	47.1	49%	0.492	25%	0.254	S	S	.	.			trans	-64.9	127.1	170.3	179.3	13.3	0	0	0	110.1	D262 T263 V264	N260-D262 PolarHBondContact O-N 2.91Å; N260-D262 PolarHBondContact OD1-N 3Å; N260-T263 WeakPolarHBondContact O-CB 3.33Å; N260-T263 PolarHBondContact O-N 3.39Å; N260-T263 VanDerWaalsContact O-N 3.1Å; N260-V264 WeakPolarHBondContact O-CG2 3.49Å; N260-V264 PolarHBondContact O-N 3.18Å
261	L	86.9	Confident	78.3	Confident	49 Å²	49	44.5 Å²	44.5	26%	0.257	24%	0.244	S	C	.	.	H	α-helix	trans	-61.9	-33.2	-176.7	-49.2	-174	0	0	0	112.3	L259 V264 A265 T380 D383 I384	L259-L261 PolarHBondContact O-N 3.23Å; L261-V264 PolarHBondContact O-N 3.48Å; L261-A265 WeakPolarHBondContact O-CB 3.34Å; L261-A265 PolarHBondContact O-N 2.85Å; L261-T380 HydrophobicContact CD2-CG2 3.59Å; L261-D383 HydrophobicContact CD1-CB 3.98Å; L261-I384 HydrophobicContact CB-CG1 4.17Å; L261-I384 HydrophobicContact CD2-CD1 4.25Å; L261-I384 HydrophobicContact CD2-CG1 4.1Å
262	D	86.7	Confident	80.8	Confident	64 Å²	64	41.3 Å²	41.3	34%	0.342	23%	0.227	S	C	.	.	H	α-helix	trans	-63.9	-48	174	-72.6	-37.9	0	0	0	111.2	N260 V264 A265 E266 R387	N260-D262 PolarHBondContact O-N 2.91Å; N260-D262 PolarHBondContact OD1-N 3Å; D262-V264 PolarHBondContact O-N 3.45Å; D262-A265 PolarHBondContact O-N 2.93Å; D262-E266 WeakPolarHBondContact O-CB 3.2Å; D262-E266 WeakPolarHBondContact O-CG 3.41Å; D262-E266 PolarHBondContact O-N 3.28Å; D262-R387 WeakPolarHBondContact OD1-CD 3.5Å; D262-R387 WeakPolarHBondContact OD1-CG 3.07Å; D262-R387 IonicContact OD1-CZ 2.71Å; D262-R387 VanDerWaalsContact OD1-CZ 3.31Å; D262-R387 IonicContact OD1-NE 3.3Å; D262-R387 PolarHBondContact OD1-NE 3.2Å; D262-R387 IonicContact OD1-NH1 3.83Å; D262-R387 IonicContact OD1-NH2 2.84Å
263	T	88.4	Confident	83.2	Confident	33 Å²	33	36.8 Å²	36.8	20%	0.202	20%	0.196	C	C	.	.	H	α-helix	trans	-59.9	-45	175.7	-54.6	0	0	0	0	111.6	N260 A265 E266 Q267 E721	N260-T263 WeakPolarHBondContact O-CB 3.33Å; N260-T263 PolarHBondContact O-N 3.39Å; N260-T263 VanDerWaalsContact O-N 3.1Å; T263-A265 PolarHBondContact O-N 3.36Å; T263-E266 PolarHBondContact O-N 3.46Å; T263-Q267 HydrophobicContact CG2-CG 4.14Å; T263-Q267 WeakPolarHBondContact O-CB 3.32Å; T263-Q267 VanDerWaalsContact O-CG 3.32Å; T263-Q267 WeakPolarHBondContact O-CG 3.36Å; T263-Q267 PolarHBondContact O-N 2.85Å; T263-E721 VanDerWaalsContact CG2-OE1 3.24Å; T263-E721 WeakPolarHBondContact CG2-OE1 3.47Å; T263-E721 WeakPolarHBondContact CG2-OE2 3.35Å
264	V	91.4	Very high	85.6	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.012	19%	0.193	C	C	.	.	H	α-helix	trans	-58.8	-46.2	177	175	0	0	0	0	111.2	L256 L259 N260 L261 D262 L268 I384 F724	L256-V264 HydrophobicContact CD1-CG1 4.27Å; L256-V264 HydrophobicContact CD1-CG2 4.34Å; L259-V264 HydrophobicContact CB-CG2 3.61Å; L259-V264 HydrophobicContact CD1-CG2 3.94Å; L259-V264 HydrophobicContact CG-CG2 4.44Å; N260-V264 WeakPolarHBondContact O-CG2 3.49Å; N260-V264 PolarHBondContact O-N 3.18Å; L261-V264 PolarHBondContact O-N 3.48Å; D262-V264 PolarHBondContact O-N 3.45Å; V264-L268 HydrophobicContact CG1-CD1 4.1Å; V264-L268 WeakPolarHBondContact O-CB 3.49Å; V264-L268 VanDerWaalsContact O-CG 3.25Å; V264-L268 WeakPolarHBondContact O-CG 3.47Å; V264-L268 PolarHBondContact O-N 3.39Å; V264-I384 HydrophobicContact CG1-CD1 4.01Å; V264-I384 HydrophobicContact CG1-CG1 4.42Å; V264-I384 HydrophobicContact CG1-CG2 4.25Å; V264-F724 HydrophobicContact CB-CE2 4.37Å; V264-F724 HydrophobicContact CG1-CE2 4.14Å; V264-F724 HydrophobicContact CG1-CZ 4.43Å; V264-F724 HydrophobicContact CG2-CE2 4.2Å
265	A	94.2	Very high	87.5	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-67	-35.6	178.5	0	0	0	0	0	112.8	L261 D262 T263 T269 R387 L388	L261-A265 WeakPolarHBondContact O-CB 3.34Å; L261-A265 PolarHBondContact O-N 2.85Å; D262-A265 PolarHBondContact O-N 2.93Å; T263-A265 PolarHBondContact O-N 3.36Å; A265-T269 WeakPolarHBondContact O-CB 3.5Å; A265-T269 PolarHBondContact O-N 2.91Å; A265-T269 PolarHBondContact O-OG1 3.44Å; A265-R387 HydrophobicContact CB-CB 3.76Å; A265-R387 HydrophobicContact CB-CG 3.35Å; A265-L388 HydrophobicContact CB-CD2 4.01Å; A265-L388 HydrophobicContact CB-CG 3.89Å; A265-L388 VanDerWaalsContact O-CD2 3.28Å; A265-L388 WeakPolarHBondContact O-CD2 3.17Å
266	E	93.5	Very high	89	Confident	55 Å²	55	37.9 Å²	37.9	26%	0.257	19%	0.189	S	C	.	.	H	α-helix	trans	-70.9	-44.2	176.6	-75.5	170.5	-151.8	0	0	111.8	D262 T263 L268 T269 V270 R387 T391 L718	D262-E266 WeakPolarHBondContact O-CB 3.2Å; D262-E266 WeakPolarHBondContact O-CG 3.41Å; D262-E266 PolarHBondContact O-N 3.28Å; T263-E266 PolarHBondContact O-N 3.46Å; E266-L268 PolarHBondContact O-N 2.99Å; E266-T269 CarbonylContact O-C 3.54Å; E266-T269 WeakPolarHBondContact O-CA 3.49Å; E266-T269 WeakPolarHBondContact O-CB 3.26Å; E266-T269 PolarHBondContact O-N 3Å; E266-V270 WeakPolarHBondContact O-CG2 3.45Å; E266-V270 PolarHBondContact O-N 3.43Å; E266-R387 IonicContact OE1-CZ 3.21Å; E266-R387 IonicContact OE1-NE 3.57Å; E266-R387 IonicContact OE1-NH2 3.75Å; E266-R387 PolarHBondContact OE1-NH2 3.3Å; E266-T391 HydrophobicContact CG-CG2 4.34Å; E266-L718 HydrophobicContact CB-CD1 4.31Å; E266-L718 HydrophobicContact CB-CD2 4.24Å; E266-L718 HydrophobicContact CG-CD1 4.4Å; E266-L718 HydrophobicContact CG-CD2 3.94Å
267	Q	94.3	Very high	90.1	Very high	13 Å²	13	39.7 Å²	39.7	6%	0.061	20%	0.199	C	C	.	.	H	α-helix	trans	-67	-35.9	176.4	-63.5	-54.9	-29.9	0	0	112.7	T263 T269 V270 A271 R719 E721 F724	T263-Q267 HydrophobicContact CG2-CG 4.14Å; T263-Q267 WeakPolarHBondContact O-CB 3.32Å; T263-Q267 VanDerWaalsContact O-CG 3.32Å; T263-Q267 WeakPolarHBondContact O-CG 3.36Å; T263-Q267 PolarHBondContact O-N 2.85Å; Q267-T269 VanDerWaalsContact C-N 3.31Å; Q267-V270 PolarHBondContact O-N 2.89Å; Q267-A271 PolarHBondContact O-N 3.25Å; Q267-R719 PolarHBondContact NE2-O 2.85Å; Q267-R719 PolarHBondContact OE1-O 2.92Å; Q267-E721 HydrophobicContact CG-CB 4.26Å; Q267-E721 VanDerWaalsContact NE2-CG 3.31Å; Q267-E721 PolarHBondContact NE2-OE1 2.86Å; Q267-F724 HydrophobicContact CB-CB 4.4Å; Q267-F724 HydrophobicContact CB-CD1 3.34Å; Q267-F724 HydrophobicContact CB-CD2 4.17Å; Q267-F724 HydrophobicContact CB-CE1 3.51Å; Q267-F724 HydrophobicContact CB-CE2 4.31Å; Q267-F724 HydrophobicContact CB-CG 3.7Å; Q267-F724 HydrophobicContact CB-CZ 4Å; Q267-F724 HydrophobicContact CG-CB 4.13Å; Q267-F724 HydrophobicContact CG-CD1 4.02Å; Q267-F724 HydrophobicContact CG-CD2 4.41Å; Q267-F724 HydrophobicContact CG-CG 3.91Å
268	L	95.6	Very high	91	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.01	22%	0.217	C	C	.	.	H	α-helix	trans	-63.3	-37.1	168.3	-72.3	175.2	0	0	0	111.9	V264 E266 D272 L306 I384 L388 F724 F728	V264-L268 HydrophobicContact CG1-CD1 4.1Å; V264-L268 WeakPolarHBondContact O-CB 3.49Å; V264-L268 VanDerWaalsContact O-CG 3.25Å; V264-L268 WeakPolarHBondContact O-CG 3.47Å; V264-L268 PolarHBondContact O-N 3.39Å; E266-L268 PolarHBondContact O-N 2.99Å; L268-D272 PolarHBondContact O-N 3.43Å; L268-D272 VanDerWaalsContact O-N 3.1Å; L268-L306 HydrophobicContact CD1-CD1 4.03Å; L268-L306 HydrophobicContact CD1-CD2 4.25Å; L268-L306 HydrophobicContact CD2-CD1 4.02Å; L268-L306 HydrophobicContact CD2-CD2 4.31Å; L268-I384 HydrophobicContact CD1-CG2 4.39Å; L268-L388 HydrophobicContact CB-CD2 4.26Å; L268-L388 HydrophobicContact CD1-CD1 4.29Å; L268-F724 HydrophobicContact CD2-CZ 4.21Å; L268-F724 HydrophobicContact CG-CZ 4.17Å; L268-F728 HydrophobicContact CD2-CD2 4.4Å; L268-F728 HydrophobicContact CD2-CE2 3.86Å; L268-F728 HydrophobicContact CD2-CZ 4.05Å
269	T	96.3	Very high	92.2	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-66.4	-40.3	174.6	-56.5	0	0	0	0	111.4	A265 E266 Q267 Q273 T391 N393 I509 Y716 L718	A265-T269 WeakPolarHBondContact O-CB 3.5Å; A265-T269 PolarHBondContact O-N 2.91Å; A265-T269 PolarHBondContact O-OG1 3.44Å; E266-T269 CarbonylContact O-C 3.54Å; E266-T269 WeakPolarHBondContact O-CA 3.49Å; E266-T269 WeakPolarHBondContact O-CB 3.26Å; E266-T269 PolarHBondContact O-N 3Å; Q267-T269 VanDerWaalsContact C-N 3.31Å; T269-Q273 WeakPolarHBondContact O-CB 3.3Å; T269-Q273 PolarHBondContact O-N 2.85Å; T269-T391 PolarHBondContact OG1-OG1 3.33Å; T269-N393 HydrophobicContact CG2-CB 4.35Å; T269-I509 HydrophobicContact CG2-CD1 3.89Å; T269-I509 WeakPolarHBondContact O-CD1 3.29Å; T269-Y716 HydrophobicContact CG2-CD1 3.94Å; T269-Y716 HydrophobicContact CG2-CE1 3.58Å; T269-Y716 HydrophobicContact CG2-CE2 4.24Å; T269-Y716 HydrophobicContact CG2-CG 4.39Å; T269-L718 HydrophobicContact CG2-CD1 3.73Å
270	V	95.1	Very high	93	Very high	22 Å²	22	38.7 Å²	38.7	13%	0.133	19%	0.194	C	C	.	.	H	α-helix	trans	-62.3	-44.9	174.8	172.4	0	0	0	0	111.8	E266 Q267 Q273 R274 L718 P720	E266-V270 WeakPolarHBondContact O-CG2 3.45Å; E266-V270 PolarHBondContact O-N 3.43Å; Q267-V270 PolarHBondContact O-N 2.89Å; V270-Q273 PolarHBondContact O-N 3.34Å; V270-R274 PolarHBondContact O-N 3.33Å; V270-R274 VanDerWaalsContact O-N 3.11Å; V270-L718 HydrophobicContact CG2-CB 3.37Å; V270-L718 HydrophobicContact CG2-CD1 4.15Å; V270-L718 HydrophobicContact CG2-CG 4.41Å; V270-P720 HydrophobicContact CG1-CB 3.92Å
271	A	95	Very high	93.5	Very high	29 Å²	29	35.2 Å²	35.2	24%	0.24	18%	0.175	C	C	.	.	H	α-helix	trans	-62.1	-47.5	179.4	0	0	0	0	0	111.9	Q267 L275	Q267-A271 PolarHBondContact O-N 3.25Å; A271-L275 PolarHBondContact O-N 3.4Å
272	D	97	Very high	93.7	Very high	7 Å²	7	33.1 Å²	33.1	4%	0.037	16%	0.164	C	C	.	.	H	α-helix	trans	-69.3	-37.3	177.9	-71.9	6.1	0	0	0	112	L268 R274 L275 F276 Q302 N393 A396 I509	L268-D272 PolarHBondContact O-N 3.43Å; L268-D272 VanDerWaalsContact O-N 3.1Å; D272-R274 PolarHBondContact O-N 2.88Å; D272-L275 PolarHBondContact O-N 2.85Å; D272-F276 VanDerWaalsContact O-CB 3.28Å; D272-F276 WeakPolarHBondContact O-CB 3.45Å; D272-F276 PolarHBondContact O-N 2.59Å; D272-Q302 WeakPolarHBondContact OD1-CG 3.24Å; D272-Q302 PolarHBondContact OD1-NE2 2.84Å; D272-N393 PolarHBondContact OD2-ND2 3.33Å; D272-N393 PolarHBondContact OD2-OD1 3.5Å; D272-A396 PolarHBondContact OD2-N 3.35Å; D272-I509 HydrophobicContact CB-CD1 3.65Å; D272-I509 HydrophobicContact CB-CG2 4.23Å
273	Q	96.3	Very high	94	Very high	25 Å²	25	30.9 Å²	30.9	12%	0.117	15%	0.153	C	C	.	.	H	α-helix	trans	-58.9	-48.7	178.7	176.9	-163.8	1.9	0	0	110.2	T269 V270 F276 L277 I509 A713 Y716	T269-Q273 WeakPolarHBondContact O-CB 3.3Å; T269-Q273 PolarHBondContact O-N 2.85Å; V270-Q273 PolarHBondContact O-N 3.34Å; Q273-F276 PolarHBondContact O-N 3.42Å; Q273-L277 HydrophobicContact CG-CD1 3.9Å; Q273-L277 HydrophobicContact CG-CG 4.41Å; Q273-L277 WeakPolarHBondContact O-CB 3.47Å; Q273-L277 WeakPolarHBondContact O-CG 3.27Å; Q273-L277 PolarHBondContact O-N 3.11Å; Q273-I509 HydrophobicContact CB-CD1 4.03Å; Q273-A713 PolarHBondContact NE2-O 3.42Å; Q273-Y716 HydrophobicContact CB-CD2 4.42Å; Q273-Y716 HydrophobicContact CG-CD2 4Å
274	R	95.1	Very high	94.3	Very high	175 Å²	175	29.3 Å²	29.3	66%	0.66	14%	0.143	S	C	*	.	H	α-helix	trans	-56.6	-54.4	179.9	177.4	178.3	175.2	175.4	0.9	111.1	V270 D272 F276 L277 D278	V270-R274 PolarHBondContact O-N 3.33Å; V270-R274 VanDerWaalsContact O-N 3.11Å; D272-R274 PolarHBondContact O-N 2.88Å; R274-F276 VanDerWaalsContact C-N 3.3Å; R274-F276 PolarHBondContact O-N 2.97Å; R274-L277 PolarHBondContact O-N 2.82Å; R274-D278 WeakPolarHBondContact CG-OD2 3.06Å; R274-D278 IonicContact NE-OD2 2.68Å; R274-D278 WeakPolarHBondContact O-CB 3.46Å; R274-D278 VanDerWaalsContact O-CG 3.31Å; R274-D278 PolarHBondContact O-N 3.1Å
275	L	96.2	Very high	94.5	Very high	44 Å²	44	29.2 Å²	29.2	23%	0.23	14%	0.142	C	C	.	.	H	α-helix	trans	-61.2	-39.7	-179	-67.3	170.3	0	0	0	111.9	A271 D272 D278 M279 A298 Q302	A271-L275 PolarHBondContact O-N 3.4Å; D272-L275 PolarHBondContact O-N 2.85Å; L275-D278 PolarHBondContact O-N 3.42Å; L275-M279 WeakPolarHBondContact O-CB 3.47Å; L275-M279 PolarHBondContact O-N 3.24Å; L275-A298 HydrophobicContact CD2-CB 4.03Å; L275-Q302 HydrophobicContact CD1-CB 3.47Å; L275-Q302 VanDerWaalsContact CD1-CB 3.47Å; L275-Q302 HydrophobicContact CD1-CG 3.7Å
276	F	96.8	Very high	94.4	Very high	3 Å²	3	31 Å²	31	1%	0.013	15%	0.152	C	C	.	.	H	α-helix	trans	-69.2	-31.3	178.2	-176	-119.8	0	0	0	113.4	D272 Q273 R274 M279 I509 P510 I706 L709 Q710 A713	D272-F276 VanDerWaalsContact O-CB 3.28Å; D272-F276 WeakPolarHBondContact O-CB 3.45Å; D272-F276 PolarHBondContact O-N 2.59Å; Q273-F276 PolarHBondContact O-N 3.42Å; R274-F276 VanDerWaalsContact C-N 3.3Å; R274-F276 PolarHBondContact O-N 2.97Å; F276-M279 HydrophobicContact CD2-CE 3.85Å; F276-M279 HydrophobicContact CE2-CE 3.74Å; F276-I509 HydrophobicContact CB-CG2 4.33Å; F276-I509 HydrophobicContact CD1-CG2 4.47Å; F276-I509 HydrophobicContact CG-CG2 4.38Å; F276-P510 HydrophobicContact CD2-CG 4.3Å; F276-P510 HydrophobicContact CE1-CG 4.11Å; F276-P510 HydrophobicContact CE2-CG 3.55Å; F276-P510 VanDerWaalsContact CZ-CD 3.41Å; F276-P510 HydrophobicContact CZ-CG 3.45Å; F276-P510 VanDerWaalsContact CZ-CG 3.45Å; F276-I706 HydrophobicContact CE2-CG2 3.95Å; F276-I706 HydrophobicContact CZ-CG2 4.17Å; F276-L709 HydrophobicContact CE1-CB 4.12Å; F276-L709 HydrophobicContact CZ-CB 3.89Å; F276-Q710 HydrophobicContact CD1-CG 4.26Å; F276-Q710 HydrophobicContact CE1-CB 4.38Å; F276-Q710 HydrophobicContact CE1-CG 3.82Å; F276-Q710 HydrophobicContact CE2-CG 4.21Å; F276-Q710 HydrophobicContact CZ-CG 3.76Å; F276-Q710 PolarHBondContact O-NE2 3.14Å; F276-A713 HydrophobicContact CD1-CB 3.86Å; F276-A713 HydrophobicContact CE1-CB 4.15Å
277	L	93.9	Very high	94.5	Very high	40 Å²	40	29.1 Å²	29.1	21%	0.209	14%	0.142	C	C	.	.	H	α-helix	trans	-79.3	-34.4	173.4	-70.1	178.1	0	0	0	113	K107 Q273 R274 M279 Q710 A713 Q714	K107-L277 PolarHBondContact NZ-O 3.5Å; Q273-L277 HydrophobicContact CG-CD1 3.9Å; Q273-L277 HydrophobicContact CG-CG 4.41Å; Q273-L277 WeakPolarHBondContact O-CB 3.47Å; Q273-L277 WeakPolarHBondContact O-CG 3.27Å; Q273-L277 PolarHBondContact O-N 3.11Å; R274-L277 PolarHBondContact O-N 2.82Å; L277-M279 VanDerWaalsContact C-N 3.31Å; L277-Q710 HydrophobicContact CD2-CB 4.21Å; L277-Q710 VanDerWaalsContact CD2-O 3.28Å; L277-Q710 WeakPolarHBondContact CD2-O 3.4Å; L277-A713 HydrophobicContact CD2-CB 4.01Å; L277-A713 HydrophobicContact CG-CB 4.36Å; L277-Q714 HydrophobicContact CD1-CG 4.47Å; L277-Q714 HydrophobicContact CD2-CG 3.93Å
278	D	92.5	Very high	94.4	Very high	97 Å²	97	28.7 Å²	28.7	52%	0.519	14%	0.141	S	C	.	.	H	α-helix	trans	-71.3	-25.2	176	-73.5	-21.4	0	0	0	111.8	R274 L275 E280	R274-D278 WeakPolarHBondContact CG-OD2 3.06Å; R274-D278 IonicContact NE-OD2 2.68Å; R274-D278 WeakPolarHBondContact O-CB 3.46Å; R274-D278 VanDerWaalsContact O-CG 3.31Å; R274-D278 PolarHBondContact O-N 3.1Å; L275-D278 PolarHBondContact O-N 3.42Å; D278-E280 PolarHBondContact O-N 3.31Å
279	M	94.1	Very high	94.3	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.005	15%	0.147	C	C	.	.			trans	-54.7	124.8	-179.5	-170.4	179.4	64.4	0	0	114	L275 F276 L277 V296 L512 I706 Q710	L275-M279 WeakPolarHBondContact O-CB 3.47Å; L275-M279 PolarHBondContact O-N 3.24Å; F276-M279 HydrophobicContact CD2-CE 3.85Å; F276-M279 HydrophobicContact CE2-CE 3.74Å; L277-M279 VanDerWaalsContact C-N 3.31Å; M279-V296 HydrophobicContact CG-CG2 4.14Å; M279-V296 HydrophobicContact SD-CG2 4.01Å; M279-L512 HydrophobicContact CE-CD1 3.91Å; M279-L512 HydrophobicContact SD-CD1 3.85Å; M279-L512 HydrophobicContact SD-CD2 3.58Å; M279-L512 VanDerWaalsContact SD-CD2 3.58Å; M279-L512 HydrophobicContact SD-CG 4.39Å; M279-I706 HydrophobicContact CE-CG2 3.61Å; M279-Q710 PolarHBondContact O-NE2 2.95Å; M279-Q710 VanDerWaalsContact O-NE2 3.12Å
280	E	91	Very high	94	Very high	60 Å²	60	32.9 Å²	32.9	28%	0.28	17%	0.173	S	C	.	.			trans	-76.6	129	170.5	-75	-160	-164.4	0	0	109.8	K114 D278 N282 D283 S295	K114-E280 IonicContact NZ-OE1 3.46Å; K114-E280 PolarHBondContact NZ-OE1 3.38Å; D278-E280 PolarHBondContact O-N 3.31Å; E280-N282 VanDerWaalsContact C-N 3.28Å; E280-N282 PolarHBondContact O-N 2.84Å; E280-D283 HydrophobicContact CB-CB 4.1Å; E280-D283 VanDerWaalsContact O-CB 3.28Å; E280-D283 WeakPolarHBondContact O-CB 3.39Å; E280-D283 PolarHBondContact O-N 3.45Å; E280-S295 PolarHBondContact N-OG 3.22Å
281	L	92.5	Very high	93.8	Very high	18 Å²	18	37.1 Å²	37.1	9%	0.094	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-29	-177.4	-66.7	169.9	0	0	0	112.9	Y53 P104 C284 L703 I706 F707	Y53-L281 HydrophobicContact CE1-CD1 3.91Å; P104-L281 HydrophobicContact CB-CD1 3.81Å; P104-L281 HydrophobicContact CG-CD1 3.92Å; L281-C284 WeakPolarHBondContact O-CB 3.4Å; L281-C284 PolarHBondContact O-N 2.84Å; L281-L703 HydrophobicContact CB-CD1 4.48Å; L281-L703 WeakPolarHBondContact O-CD1 3.12Å; L281-L703 VanDerWaalsContact O-CD2 3.28Å; L281-L703 WeakPolarHBondContact O-CD2 3.41Å; L281-I706 HydrophobicContact CD2-CB 3.88Å; L281-I706 HydrophobicContact CD2-CG2 3.49Å; L281-I706 VanDerWaalsContact CD2-CG2 3.49Å; L281-F707 HydrophobicContact CD1-CB 3.84Å; L281-F707 HydrophobicContact CD1-CD2 4.21Å; L281-F707 HydrophobicContact CD1-CG 4.32Å
282	N	91.3	Very high	93.6	Very high	5 Å²	5	41.2 Å²	41.2	3%	0.027	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-28.4	177.4	-163.6	-94.1	0	0	0	112.5	Y53 R56 E280 C284 L285 I286	Y53-N282 PolarHBondContact O-ND2 2.8Å; R56-N282 VanDerWaalsContact CB-OD1 3.24Å; R56-N282 WeakPolarHBondContact CB-OD1 3.44Å; E280-N282 VanDerWaalsContact C-N 3.28Å; E280-N282 PolarHBondContact O-N 2.84Å; N282-C284 PolarHBondContact O-N 2.96Å; N282-C284 VanDerWaalsContact O-N 3.17Å; N282-L285 WeakPolarHBondContact O-CA 3.22Å; N282-L285 WeakPolarHBondContact O-CB 3.22Å; N282-L285 PolarHBondContact O-N 3.13Å; N282-I286 PolarHBondContact O-N 3.22Å; N282-I286 VanDerWaalsContact O-N 3.16Å
283	D	93.4	Very high	93.4	Very high	18 Å²	18	41 Å²	41	10%	0.096	21%	0.214	C	C	.	.	H	α-helix	trans	-56.5	-31.1	173.5	-117.4	16.1	0	0	0	111.2	E280 L285 I286 Y287 A293 S295 V296	E280-D283 HydrophobicContact CB-CB 4.1Å; E280-D283 VanDerWaalsContact O-CB 3.28Å; E280-D283 WeakPolarHBondContact O-CB 3.39Å; E280-D283 PolarHBondContact O-N 3.45Å; D283-L285 VanDerWaalsContact C-N 3.31Å; D283-L285 PolarHBondContact O-N 3.4Å; D283-I286 PolarHBondContact O-N 3.48Å; D283-Y287 WeakPolarHBondContact O-CB 3.45Å; D283-Y287 PolarHBondContact O-N 3.37Å; D283-A293 HydrophobicContact CB-CB 4.02Å; D283-A293 VanDerWaalsContact O-CB 3.3Å; D283-A293 WeakPolarHBondContact O-CB 3.36Å; D283-A293 VanDerWaalsContact OD2-C 3.28Å; D283-S295 WeakPolarHBondContact CB-OG 3.24Å; D283-S295 WeakPolarHBondContact OD2-CB 3.26Å; D283-S295 PolarHBondContact OD2-N 3.26Å; D283-S295 PolarHBondContact OD2-OG 3.05Å; D283-V296 HydrophobicContact CB-CG2 4.04Å
284	C	95.4	Very high	93.2	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-62.4	-34.4	172.7	-64.2	0	0	0	0	113.1	L281 N282 A288 V296 L516 L519 L703	L281-C284 WeakPolarHBondContact O-CB 3.4Å; L281-C284 PolarHBondContact O-N 2.84Å; N282-C284 PolarHBondContact O-N 2.96Å; N282-C284 VanDerWaalsContact O-N 3.17Å; C284-A288 VanDerWaalsContact O-CB 3.31Å; C284-A288 WeakPolarHBondContact O-CB 3.49Å; C284-A288 PolarHBondContact O-N 3.34Å; C284-A288 VanDerWaalsContact O-N 3.13Å; C284-V296 HydrophobicContact CB-CG2 4.48Å; C284-L516 HydrophobicContact CB-CD2 4.1Å; C284-L519 HydrophobicContact CB-CD1 3.79Å; C284-L703 HydrophobicContact CB-CD2 3.93Å
285	L	94.7	Very high	93.1	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-79	-28.5	176.7	-53.6	-177.3	0	0	0	112.7	T54 L57 N282 D283 R289 L519 E699 L703	T54-L285 HydrophobicContact CG2-CD1 3.78Å; L57-L285 HydrophobicContact CD1-CB 4.12Å; L57-L285 HydrophobicContact CD1-CD1 3.81Å; L57-L285 HydrophobicContact CD2-CB 3.98Å; L57-L285 HydrophobicContact CG-CB 4.36Å; L57-L285 HydrophobicContact CG-CD1 4.32Å; N282-L285 WeakPolarHBondContact O-CA 3.22Å; N282-L285 WeakPolarHBondContact O-CB 3.22Å; N282-L285 PolarHBondContact O-N 3.13Å; D283-L285 VanDerWaalsContact C-N 3.31Å; D283-L285 PolarHBondContact O-N 3.4Å; L285-R289 WeakPolarHBondContact O-CD 3.36Å; L285-R289 WeakPolarHBondContact O-CG 3.46Å; L285-R289 PolarHBondContact O-NH1 3.46Å; L285-L519 HydrophobicContact CD2-CD1 4.15Å; L285-L519 HydrophobicContact CD2-CD2 3.64Å; L285-L519 HydrophobicContact CD2-CG 4.46Å; L285-E699 HydrophobicContact CD2-CB 3.91Å; L285-E699 HydrophobicContact CD2-CG 4.46Å; L285-L703 HydrophobicContact CD1-CD1 3.78Å; L285-L703 HydrophobicContact CD2-CD1 3.96Å; L285-L703 HydrophobicContact CD2-CD2 4.17Å; L285-L703 HydrophobicContact CD2-CG 4.18Å; L285-L703 HydrophobicContact CG-CD1 3.83Å
286	I	92.9	Very high	93.1	Very high	38 Å²	38	35.3 Å²	35.3	20%	0.195	21%	0.205	C	C	.	.	H	α-helix	trans	-71.3	-48.5	174.9	-66.6	174.1	0	0	0	109.1	N282 D283 A288 R289 K291 A293	N282-I286 PolarHBondContact O-N 3.22Å; N282-I286 VanDerWaalsContact O-N 3.16Å; D283-I286 PolarHBondContact O-N 3.48Å; I286-A288 PolarHBondContact O-N 3.11Å; I286-R289 CarbonylContact O-C 3.48Å; I286-R289 WeakPolarHBondContact O-CA 3.28Å; I286-R289 WeakPolarHBondContact O-CB 3.2Å; I286-R289 PolarHBondContact O-N 3.1Å; I286-K291 HydrophobicContact CG2-CB 3.49Å; I286-K291 VanDerWaalsContact CG2-CB 3.49Å; I286-K291 HydrophobicContact CG2-CD 4.27Å; I286-K291 WeakPolarHBondContact O-CB 3.39Å; I286-K291 PolarHBondContact O-N 3.3Å; I286-A293 HydrophobicContact CB-CB 4.41Å; I286-A293 HydrophobicContact CG2-CB 4.18Å
287	Y	94.4	Very high	93.1	Very high	14 Å²	14	37.5 Å²	37.5	6%	0.055	22%	0.215	C	C	.	.	H	α-helix	trans	-58.4	-47.4	174	-178.2	-92.3	0	0	0	112.2	D283 R289 G290 V296 I300 L516 P818	D283-Y287 WeakPolarHBondContact O-CB 3.45Å; D283-Y287 PolarHBondContact O-N 3.37Å; Y287-R289 PolarHBondContact O-N 3.42Å; Y287-G290 PolarHBondContact O-N 2.84Å; Y287-V296 HydrophobicContact CD1-CG1 4.25Å; Y287-V296 HydrophobicContact CD2-CG1 3.84Å; Y287-V296 HydrophobicContact CE2-CG1 4.41Å; Y287-V296 HydrophobicContact CG-CG1 3.76Å; Y287-I300 HydrophobicContact CD2-CD1 4.4Å; Y287-I300 HydrophobicContact CE1-CD1 4.35Å; Y287-I300 HydrophobicContact CE2-CD1 3.68Å; Y287-L516 HydrophobicContact CD1-CB 4.4Å; Y287-L516 HydrophobicContact CD1-CD1 3.94Å; Y287-L516 HydrophobicContact CD1-CD2 3.92Å; Y287-L516 HydrophobicContact CD1-CG 4.3Å; Y287-L516 HydrophobicContact CE1-CB 4.31Å; Y287-L516 HydrophobicContact CE1-CD1 3.81Å; Y287-L516 HydrophobicContact CE1-CG 4.44Å; Y287-P818 PolarHBondContact OH-O 2.9Å
288	A	93.7	Very high	93.2	Very high	4 Å²	4	37.5 Å²	37.5	3%	0.033	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-7.1	176.7	0	0	0	0	0	114.5	C284 I286 L519	C284-A288 VanDerWaalsContact O-CB 3.31Å; C284-A288 WeakPolarHBondContact O-CB 3.49Å; C284-A288 PolarHBondContact O-N 3.34Å; C284-A288 VanDerWaalsContact O-N 3.13Å; I286-A288 PolarHBondContact O-N 3.11Å; A288-L519 HydrophobicContact CB-CB 3.8Å
289	R	93	Very high	93.4	Very high	37 Å²	37	33.5 Å²	33.5	14%	0.14	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.3	14.5	174.3	-73	172.6	174	69.6	1.3	112.8	L285 I286 Y287 K291 H523 D528 E699	L285-R289 WeakPolarHBondContact O-CD 3.36Å; L285-R289 WeakPolarHBondContact O-CG 3.46Å; L285-R289 PolarHBondContact O-NH1 3.46Å; I286-R289 CarbonylContact O-C 3.48Å; I286-R289 WeakPolarHBondContact O-CA 3.28Å; I286-R289 WeakPolarHBondContact O-CB 3.2Å; I286-R289 PolarHBondContact O-N 3.1Å; Y287-R289 PolarHBondContact O-N 3.42Å; R289-K291 PolarHBondContact O-N 2.83Å; R289-H523 WeakPolarHBondContact CG-ND1 3.42Å; R289-H523 PolarHBondContact NE-ND1 3.46Å; R289-D528 IonicContact CZ-OD1 3.35Å; R289-D528 IonicContact CZ-OD2 2.88Å; R289-D528 IonicContact NE-OD1 2.88Å; R289-D528 IonicContact NE-OD2 2.84Å; R289-D528 PolarHBondContact NE-OD2 3.4Å; R289-D528 IonicContact NH2-OD1 2.63Å; R289-D528 PolarHBondContact NH2-OD1 2.85Å; R289-D528 IonicContact NH2-OD2 3.53Å; R289-D528 PolarHBondContact NH2-OD2 2.79Å; R289-E699 IonicContact CZ-OE1 3.76Å; R289-E699 IonicContact NH1-OE1 3.7Å; R289-E699 PolarHBondContact NH1-OE1 3.09Å; R289-E699 IonicContact NH2-OE1 3.02Å; R289-E699 PolarHBondContact NH2-OE1 2.88Å; R289-E699 IonicContact NH2-OE2 2.71Å; R289-E699 PolarHBondContact NH2-OE2 3.43Å
290	G	90.8	Very high	93.5	Very high	54 Å²	54	34 Å²	34	56%	0.557	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.3	16.9	178.9	0	0	0	0	0	114.6	Y287	Y287-G290 PolarHBondContact O-N 2.84Å
291	K	90.4	Very high	93.7	Very high	110 Å²	110	34.9 Å²	34.9	48%	0.478	21%	0.209	S	C	.	.			trans	-96.4	150.4	177.7	-65.8	177.1	-178	178.1	0	110.4	I286 R289 A293	I286-K291 HydrophobicContact CG2-CB 3.49Å; I286-K291 VanDerWaalsContact CG2-CB 3.49Å; I286-K291 HydrophobicContact CG2-CD 4.27Å; I286-K291 WeakPolarHBondContact O-CB 3.39Å; I286-K291 PolarHBondContact O-N 3.3Å; R289-K291 PolarHBondContact O-N 2.83Å; K291-A293 PolarHBondContact O-N 3.2Å
292	P	90.3	Very high	93.9	Very high	116 Å²	116	34.7 Å²	34.7	75%	0.753	21%	0.207	S	C	*	.			trans	-63.6	130.5	175.5	27	-34.5	0	0	0	110.9
293	A	93	Very high	94.1	Very high	3 Å²	3	35.4 Å²	35.4	3%	0.025	21%	0.21	C	C	.	.			trans	-134.4	91.1	-176.8	0	0	0	0	0	108.4	D283 I286 K291 S295 V296 Q297	D283-A293 HydrophobicContact CB-CB 4.02Å; D283-A293 VanDerWaalsContact O-CB 3.3Å; D283-A293 WeakPolarHBondContact O-CB 3.36Å; D283-A293 VanDerWaalsContact OD2-C 3.28Å; I286-A293 HydrophobicContact CB-CB 4.41Å; I286-A293 HydrophobicContact CG2-CB 4.18Å; K291-A293 PolarHBondContact O-N 3.2Å; A293-S295 VanDerWaalsContact C-N 3.3Å; A293-S295 PolarHBondContact O-N 3.17Å; A293-V296 HydrophobicContact CB-CB 4.21Å; A293-V296 PolarHBondContact O-N 3.01Å; A293-Q297 WeakPolarHBondContact O-CB 3.43Å; A293-Q297 PolarHBondContact O-N 3.47Å
294	P	92.6	Very high	94.2	Very high	98 Å²	98	35.7 Å²	35.7	64%	0.636	21%	0.211	S	C	*	.	H	α-helix	trans	-58.8	-35.3	-165.2	-27.1	35.6	0	0	0	114.7	Q297 A298	P294-Q297 PolarHBondContact O-N 3.38Å; P294-A298 PolarHBondContact O-N 2.59Å
295	S	93.1	Very high	94.2	Very high	26 Å²	26	37.5 Å²	37.5	18%	0.182	22%	0.219	C	C	.	.	H	α-helix	trans	-77.4	-33.7	-175.5	72.7	0	0	0	0	112.5	E280 D283 A293 T299	E280-S295 PolarHBondContact N-OG 3.22Å; D283-S295 WeakPolarHBondContact CB-OG 3.24Å; D283-S295 WeakPolarHBondContact OD2-CB 3.26Å; D283-S295 PolarHBondContact OD2-N 3.26Å; D283-S295 PolarHBondContact OD2-OG 3.05Å; A293-S295 VanDerWaalsContact C-N 3.3Å; A293-S295 PolarHBondContact O-N 3.17Å; S295-T299 PolarHBondContact O-N 3.2Å; S295-T299 PolarHBondContact O-OG1 2.7Å; S295-T299 VanDerWaalsContact O-OG1 3.1Å
296	V	96.2	Very high	94.2	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-69.8	-41.9	169.3	169.2	0	0	0	0	110.7	M279 D283 C284 Y287 A293 A298 T299 I300 L512 L516	M279-V296 HydrophobicContact CG-CG2 4.14Å; M279-V296 HydrophobicContact SD-CG2 4.01Å; D283-V296 HydrophobicContact CB-CG2 4.04Å; C284-V296 HydrophobicContact CB-CG2 4.48Å; Y287-V296 HydrophobicContact CD1-CG1 4.25Å; Y287-V296 HydrophobicContact CD2-CG1 3.84Å; Y287-V296 HydrophobicContact CE2-CG1 4.41Å; Y287-V296 HydrophobicContact CG-CG1 3.76Å; A293-V296 HydrophobicContact CB-CB 4.21Å; A293-V296 PolarHBondContact O-N 3.01Å; V296-A298 PolarHBondContact O-N 2.99Å; V296-T299 WeakPolarHBondContact O-CB 3.48Å; V296-T299 PolarHBondContact O-N 3.47Å; V296-I300 HydrophobicContact CG1-CD1 3.8Å; V296-I300 WeakPolarHBondContact O-CG1 3.34Å; V296-I300 PolarHBondContact O-N 2.74Å; V296-L512 HydrophobicContact CG1-CD2 4.23Å; V296-L516 HydrophobicContact CG1-CD1 3.88Å; V296-L516 HydrophobicContact CG1-CD2 4.3Å
297	Q	95.7	Very high	94.4	Very high	49 Å²	49	37.1 Å²	37.1	23%	0.229	22%	0.216	C	C	.	.	H	α-helix	trans	-62.1	-44.8	179.5	-170.8	60.8	50.4	0	0	111.6	A293 P294 T299 I300 D301	A293-Q297 WeakPolarHBondContact O-CB 3.43Å; A293-Q297 PolarHBondContact O-N 3.47Å; P294-Q297 PolarHBondContact O-N 3.38Å; Q297-T299 PolarHBondContact O-N 2.77Å; Q297-I300 CarbonylContact O-C 3.57Å; Q297-I300 WeakPolarHBondContact O-CA 3.32Å; Q297-I300 WeakPolarHBondContact O-CB 3.38Å; Q297-I300 PolarHBondContact O-N 3.33Å; Q297-D301 PolarHBondContact NE2-OD1 2.98Å; Q297-D301 PolarHBondContact O-N 2.92Å
298	A	96.1	Very high	94.3	Very high	39 Å²	39	37.9 Å²	37.9	32%	0.322	22%	0.22	S	C	.	.	H	α-helix	trans	-58.1	-35.8	176.1	0	0	0	0	0	113	L275 P294 V296 Q302	L275-A298 HydrophobicContact CD2-CB 4.03Å; P294-A298 PolarHBondContact O-N 2.59Å; V296-A298 PolarHBondContact O-N 2.99Å; A298-Q302 WeakPolarHBondContact O-CB 3.33Å; A298-Q302 PolarHBondContact O-N 3.17Å; A298-Q302 VanDerWaalsContact O-N 3.09Å
299	T	96.9	Very high	94.2	Very high	14 Å²	14	37.8 Å²	37.8	9%	0.086	22%	0.218	C	C	.	.	H	α-helix	trans	-69.6	-36.9	175.1	-53.9	0	0	0	0	111.9	S295 V296 Q297 Y303 L512	S295-T299 PolarHBondContact O-N 3.2Å; S295-T299 PolarHBondContact O-OG1 2.7Å; S295-T299 VanDerWaalsContact O-OG1 3.1Å; V296-T299 WeakPolarHBondContact O-CB 3.48Å; V296-T299 PolarHBondContact O-N 3.47Å; Q297-T299 PolarHBondContact O-N 2.77Å; T299-Y303 PolarHBondContact O-N 3.27Å; T299-L512 HydrophobicContact CG2-CD2 3.9Å
300	I	96.2	Very high	94.2	Very high	10 Å²	10	36 Å²	36	5%	0.051	21%	0.212	C	C	.	.	H	α-helix	trans	-70.1	-40.1	174.9	-69.2	167.5	0	0	0	111.2	Y287 V296 Q297 Y303 N304 L516 P817	Y287-I300 HydrophobicContact CD2-CD1 4.4Å; Y287-I300 HydrophobicContact CE1-CD1 4.35Å; Y287-I300 HydrophobicContact CE2-CD1 3.68Å; V296-I300 HydrophobicContact CG1-CD1 3.8Å; V296-I300 WeakPolarHBondContact O-CG1 3.34Å; V296-I300 PolarHBondContact O-N 2.74Å; Q297-I300 CarbonylContact O-C 3.57Å; Q297-I300 WeakPolarHBondContact O-CA 3.32Å; Q297-I300 WeakPolarHBondContact O-CB 3.38Å; Q297-I300 PolarHBondContact O-N 3.33Å; I300-Y303 WeakPolarHBondContact O-CB 3.4Å; I300-Y303 PolarHBondContact O-N 2.92Å; I300-N304 WeakPolarHBondContact CG2-ND2 3.4Å; I300-N304 PolarHBondContact O-N 3.4Å; I300-N304 PolarHBondContact O-ND2 2.85Å; I300-L516 HydrophobicContact CD1-CD1 4.17Å; I300-P817 HydrophobicContact CD1-CB 4.24Å; I300-P817 HydrophobicContact CG1-CG 4.42Å; I300-P817 HydrophobicContact CG2-CG 3.88Å
301	D	95.5	Very high	94.2	Very high	79 Å²	79	33.4 Å²	33.4	42%	0.422	19%	0.185	S	C	.	.	H	α-helix	trans	-66.1	-41.9	180	-66.6	-21.9	0	0	0	111.2	Q297 Y303 N304 K305	Q297-D301 PolarHBondContact NE2-OD1 2.98Å; Q297-D301 PolarHBondContact O-N 2.92Å; D301-Y303 PolarHBondContact O-N 2.89Å; D301-N304 PolarHBondContact O-N 2.93Å; D301-K305 WeakPolarHBondContact O-CB 3.38Å; D301-K305 PolarHBondContact O-N 3.03Å
302	Q	95.8	Very high	94.1	Very high	14 Å²	14	28.2 Å²	28.2	7%	0.065	16%	0.163	C	C	.	.	H	α-helix	trans	-57.7	-45.6	171.4	170.1	66.6	-0	0	0	112.4	D272 L275 A298 K305 L306 F728	D272-Q302 WeakPolarHBondContact OD1-CG 3.24Å; D272-Q302 PolarHBondContact OD1-NE2 2.84Å; L275-Q302 HydrophobicContact CD1-CB 3.47Å; L275-Q302 VanDerWaalsContact CD1-CB 3.47Å; L275-Q302 HydrophobicContact CD1-CG 3.7Å; A298-Q302 WeakPolarHBondContact O-CB 3.33Å; A298-Q302 PolarHBondContact O-N 3.17Å; A298-Q302 VanDerWaalsContact O-N 3.09Å; Q302-K305 PolarHBondContact O-N 2.82Å; Q302-L306 PolarHBondContact O-N 2.88Å; Q302-F728 VanDerWaalsContact OE1-CE1 3.26Å
303	Y	97.2	Very high	94	Very high	21 Å²	21	22.8 Å²	22.8	8%	0.082	13%	0.127	C	C	.	.	H	α-helix	trans	-61.5	-47.1	176.4	176.8	-81.8	0	0	0	111.8	T299 I300 D301 L306 Y307 K398 A399 Y511	T299-Y303 PolarHBondContact O-N 3.27Å; I300-Y303 WeakPolarHBondContact O-CB 3.4Å; I300-Y303 PolarHBondContact O-N 2.92Å; D301-Y303 PolarHBondContact O-N 2.89Å; Y303-L306 PolarHBondContact O-N 3.2Å; Y303-Y307 PolarHBondContact O-N 2.88Å; Y303-K398 HydrophobicContact CE2-CB 4.34Å; Y303-A399 HydrophobicContact CD2-CB 3.78Å; Y303-A399 HydrophobicContact CE2-CB 3.64Å; Y303-A399 HydrophobicContact CG-CB 4.28Å; Y303-Y511 AromaticContact CD2-CD2 3.99Å; Y303-Y511 HydrophobicContact CD2-CD2 3.99Å; Y303-Y511 AromaticContact CD2-CE2 3.91Å; Y303-Y511 HydrophobicContact CD2-CE2 3.91Å; Y303-Y511 HydrophobicContact CE1-CE2 4.3Å; Y303-Y511 AromaticContact CE2-CD2 3.56Å; Y303-Y511 HydrophobicContact CE2-CD2 3.56Å; Y303-Y511 AromaticContact CE2-CE2 3.38Å; Y303-Y511 HydrophobicContact CE2-CE2 3.38Å; Y303-Y511 AromaticContact CZ-CE2 3.63Å
304	N	95.5	Very high	93.6	Very high	24 Å²	24	22.6 Å²	22.6	13%	0.128	13%	0.126	C	C	.	.	H	α-helix	trans	-65.1	-38.8	178.4	-73.1	-36.3	0	0	0	111.9	I300 D301 Y307 H308	I300-N304 WeakPolarHBondContact CG2-ND2 3.4Å; I300-N304 PolarHBondContact O-N 3.4Å; I300-N304 PolarHBondContact O-ND2 2.85Å; D301-N304 PolarHBondContact O-N 2.93Å; N304-Y307 PolarHBondContact O-N 2.85Å; N304-H308 PolarHBondContact O-CD2 3.33Å; N304-H308 PolarHBondContact O-N 2.89Å
305	K	94.5	Very high	93.3	Very high	37 Å²	37	18 Å²	18	16%	0.161	10%	0.096	C	C	.	.	H	α-helix	trans	-60.5	-46.6	175.9	-177.8	-170.5	-179.5	-157.8	0	111.2	D301 Q302 H308 L309 F728 H729 L733	D301-K305 WeakPolarHBondContact O-CB 3.38Å; D301-K305 PolarHBondContact O-N 3.03Å; Q302-K305 PolarHBondContact O-N 2.82Å; K305-H308 PolarHBondContact O-N 3.39Å; K305-L309 VanDerWaalsContact O-CB 3.27Å; K305-L309 WeakPolarHBondContact O-CB 3.41Å; K305-L309 PolarHBondContact O-N 3.06Å; K305-F728 HydrophobicContact CD-CE1 4.02Å; K305-F728 HydrophobicContact CD-CZ 3.92Å; K305-F728 WeakPolarHBondContact CE-O 3.36Å; K305-F728 HydrophobicContact CG-CZ 4.41Å; K305-F728 PolarHBondContact NZ-O 3.42Å; K305-H729 PolarHBondContact NZ-CD2 3.38Å; K305-H729 PolarHBondContact NZ-NE2 3.06Å; K305-L733 HydrophobicContact CG-CD1 4.2Å
306	L	95.7	Very high	92.5	Very high	2 Å²	2	18.4 Å²	18.4	1%	0.01	10%	0.096	C	C	.	.	H	α-helix	trans	-65.3	-43.3	175.9	179.3	58.3	0	0	0	111.9	L268 Q302 Y303 H308 L309 V310 W381 A396 A399 I400	L268-L306 HydrophobicContact CD1-CD1 4.03Å; L268-L306 HydrophobicContact CD1-CD2 4.25Å; L268-L306 HydrophobicContact CD2-CD1 4.02Å; L268-L306 HydrophobicContact CD2-CD2 4.31Å; Q302-L306 PolarHBondContact O-N 2.88Å; Y303-L306 PolarHBondContact O-N 3.2Å; L306-H308 VanDerWaalsContact C-N 3.35Å; L306-H308 PolarHBondContact O-N 2.92Å; L306-L309 PolarHBondContact O-N 2.71Å; L306-V310 HydrophobicContact CD1-CG2 4.49Å; L306-V310 WeakPolarHBondContact O-CG2 3.45Å; L306-V310 PolarHBondContact O-N 3.07Å; L306-W381 HydrophobicContact CD1-CH2 4.22Å; L306-W381 HydrophobicContact CD1-CZ3 4.28Å; L306-A396 HydrophobicContact CD2-CB 3.48Å; L306-A396 VanDerWaalsContact CD2-CB 3.48Å; L306-A399 HydrophobicContact CB-CB 4.28Å; L306-A399 HydrophobicContact CD2-CB 3.96Å; L306-A399 HydrophobicContact CG-CB 4.1Å; L306-I400 HydrophobicContact CD1-CG1 4.43Å; L306-I400 HydrophobicContact CD2-CD1 4.44Å; L306-I400 HydrophobicContact CD2-CG1 4.25Å; L306-I400 HydrophobicContact CG-CG1 4.3Å
307	Y	95.4	Very high	90.6	Very high	28 Å²	28	21.4 Å²	21.4	11%	0.11	12%	0.117	C	C	.	.	H	α-helix	trans	-55.3	-48	174.6	171.8	-86.9	0	0	0	111.9	Y303 N304 V310 Q311 M402 A403 S406 E736	Y303-Y307 PolarHBondContact O-N 2.88Å; N304-Y307 PolarHBondContact O-N 2.85Å; Y307-V310 PolarHBondContact O-N 3.03Å; Y307-Q311 PolarHBondContact O-N 3.3Å; Y307-Q311 PolarHBondContact OH-NE2 3.41Å; Y307-M402 HydrophobicContact CD2-CB 4.14Å; Y307-M402 HydrophobicContact CE2-CB 4.15Å; Y307-A403 HydrophobicContact CD2-CB 3.67Å; Y307-A403 HydrophobicContact CE2-CB 4.1Å; Y307-A403 HydrophobicContact CG-CB 4.16Å; Y307-A403 WeakPolarHBondContact O-CB 3.47Å; Y307-S406 VanDerWaalsContact OH-CB 3.3Å; Y307-S406 WeakPolarHBondContact OH-CB 3.37Å; Y307-E736 PolarHBondContact OH-OE1 3.03Å
308	H	92.9	Very high	88.5	Confident	30 Å²	30	25.7 Å²	25.7	14%	0.139	14%	0.142	C	C	.	.	H	α-helix	trans	-72.4	-30	177.6	-72.1	-54.9	0	0	0	113	N304 K305 L306 Q311 S312 L733 R816	N304-H308 PolarHBondContact O-CD2 3.33Å; N304-H308 PolarHBondContact O-N 2.89Å; K305-H308 PolarHBondContact O-N 3.39Å; L306-H308 VanDerWaalsContact C-N 3.35Å; L306-H308 PolarHBondContact O-N 2.92Å; H308-Q311 PolarHBondContact ND1-OE1 3.19Å; H308-Q311 PolarHBondContact O-N 2.79Å; H308-S312 VanDerWaalsContact O-CB 3.26Å; H308-S312 WeakPolarHBondContact O-CB 3.34Å; H308-S312 PolarHBondContact O-N 2.66Å; H308-S312 PolarHBondContact O-OG 3.41Å; H308-L733 HydrophobicContact CB-CD1 4.49Å; H308-L733 HydrophobicContact CB-CD2 4.41Å; H308-R816 PolarHBondContact CE1-NH2 3.26Å; H308-R816 PolarHBondContact NE2-NH2 2.75Å
309	L	92.5	Very high	86.2	Confident	2 Å²	2	32.1 Å²	32.1	1%	0.01	17%	0.165	C	C	.	.	H	α-helix	trans	-66.1	-38	175	-173.8	146.4	0	0	0	111.5	K305 L306 S312 S313 W381 W727 F728 Y731 L733	K305-L309 VanDerWaalsContact O-CB 3.27Å; K305-L309 WeakPolarHBondContact O-CB 3.41Å; K305-L309 PolarHBondContact O-N 3.06Å; L306-L309 PolarHBondContact O-N 2.71Å; L309-S312 PolarHBondContact O-N 2.91Å; L309-S313 WeakPolarHBondContact O-CB 3.46Å; L309-S313 PolarHBondContact O-N 3.37Å; L309-S313 PolarHBondContact O-OG 3.21Å; L309-W381 HydrophobicContact CD2-CH2 3.64Å; L309-W381 HydrophobicContact CD2-CZ2 3.71Å; L309-W727 HydrophobicContact CD1-CH2 4.21Å; L309-W727 HydrophobicContact CD2-CH2 4.26Å; L309-F728 HydrophobicContact CD1-CD2 3.72Å; L309-F728 HydrophobicContact CD1-CE2 3.94Å; L309-Y731 HydrophobicContact CD1-CD1 4.03Å; L309-Y731 HydrophobicContact CD1-CG 3.93Å; L309-Y731 HydrophobicContact CG-CD1 4.02Å; L309-Y731 HydrophobicContact CG-CE1 4.43Å; L309-Y731 HydrophobicContact CG-CG 4.34Å; L309-L733 HydrophobicContact CB-CD2 3.85Å; L309-L733 HydrophobicContact CG-CD2 4.49Å
310	V	92.5	Very high	83.8	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-58.6	-53.7	171.5	175	0	0	0	0	110.2	L306 Y307 S312 S313 M314 W381 I400 A403 L404	L306-V310 HydrophobicContact CD1-CG2 4.49Å; L306-V310 WeakPolarHBondContact O-CG2 3.45Å; L306-V310 PolarHBondContact O-N 3.07Å; Y307-V310 PolarHBondContact O-N 3.03Å; V310-S312 VanDerWaalsContact C-N 3.34Å; V310-S312 PolarHBondContact O-N 3.3Å; V310-S313 PolarHBondContact O-N 3.29Å; V310-S313 PolarHBondContact O-OG 2.86Å; V310-M314 WeakPolarHBondContact O-CG 3.42Å; V310-M314 PolarHBondContact O-N 3Å; V310-W381 HydrophobicContact CB-CD2 4.44Å; V310-W381 HydrophobicContact CB-CZ2 4.27Å; V310-W381 HydrophobicContact CG1-CD2 4.16Å; V310-W381 HydrophobicContact CG1-CG 4.1Å; V310-W381 HydrophobicContact CG2-CD2 3.83Å; V310-W381 HydrophobicContact CG2-CE3 3.84Å; V310-W381 HydrophobicContact CG2-CH2 3.78Å; V310-W381 HydrophobicContact CG2-CZ2 3.75Å; V310-W381 HydrophobicContact CG2-CZ3 3.81Å; V310-I400 HydrophobicContact CG2-CB 4.35Å; V310-I400 HydrophobicContact CG2-CG1 3.85Å; V310-I400 HydrophobicContact CG2-CG2 4.33Å; V310-A403 HydrophobicContact CB-CB 3.61Å; V310-A403 HydrophobicContact CG1-CB 3.59Å; V310-A403 HydrophobicContact CG2-CB 4.19Å; V310-L404 HydrophobicContact CG1-CD2 4.39Å
311	Q	90.2	Very high	81.8	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-56.8	-46.8	176.6	-67.4	-179.8	-34.7	0	0	111.8	Y307 H308 S313 M314 F315 S406 A739	Y307-Q311 PolarHBondContact O-N 3.3Å; Y307-Q311 PolarHBondContact OH-NE2 3.41Å; H308-Q311 PolarHBondContact ND1-OE1 3.19Å; H308-Q311 PolarHBondContact O-N 2.79Å; Q311-S313 PolarHBondContact O-N 2.99Å; Q311-M314 PolarHBondContact O-N 3.02Å; Q311-M314 VanDerWaalsContact O-N 3.13Å; Q311-F315 WeakPolarHBondContact O-CD2 3.38Å; Q311-F315 PolarHBondContact O-N 3.24Å; Q311-S406 PolarHBondContact NE2-OG 2.97Å; Q311-A739 HydrophobicContact CB-CB 4.38Å
312	S	89.1	Confident	79.6	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.3	-44.4	-178.4	-54.3	0	0	0	0	111.8	H308 L309 V310 M314 F315 N316 L733 I734	H308-S312 VanDerWaalsContact O-CB 3.26Å; H308-S312 WeakPolarHBondContact O-CB 3.34Å; H308-S312 PolarHBondContact O-N 2.66Å; H308-S312 PolarHBondContact O-OG 3.41Å; L309-S312 PolarHBondContact O-N 2.91Å; V310-S312 VanDerWaalsContact C-N 3.34Å; V310-S312 PolarHBondContact O-N 3.3Å; S312-M314 PolarHBondContact O-N 3.31Å; S312-F315 PolarHBondContact O-N 2.84Å; S312-N316 WeakPolarHBondContact O-CB 3.37Å; S312-N316 PolarHBondContact O-N 2.88Å; S312-N316 PolarHBondContact O-ND2 3.2Å; S312-L733 WeakPolarHBondContact OG-CA 3.43Å; S312-I734 PolarHBondContact OG-N 3.35Å
313	S	87.6	Confident	77.2	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.014	19%	0.193	C	C	.	.	H	α-helix	trans	-61.9	-29.1	176.1	72.6	0	0	0	0	113.2	W257 L309 V310 Q311 W381	W257-S313 WeakPolarHBondContact CZ2-O 3.45Å; L309-S313 WeakPolarHBondContact O-CB 3.46Å; L309-S313 PolarHBondContact O-N 3.37Å; L309-S313 PolarHBondContact O-OG 3.21Å; V310-S313 PolarHBondContact O-N 3.29Å; V310-S313 PolarHBondContact O-OG 2.86Å; Q311-S313 PolarHBondContact O-N 2.99Å; S313-W381 PolarHBondContact OG-NE1 2.84Å
314	M	85.1	Confident	74.8	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-79.6	-35.5	176.4	-68.7	-172.1	61.4	0	0	112.9	V310 Q311 S312 K374 C377 I378 L404 V409 L412	V310-M314 WeakPolarHBondContact O-CG 3.42Å; V310-M314 PolarHBondContact O-N 3Å; Q311-M314 PolarHBondContact O-N 3.02Å; Q311-M314 VanDerWaalsContact O-N 3.13Å; S312-M314 PolarHBondContact O-N 3.31Å; M314-K374 WeakPolarHBondContact O-CD 3.48Å; M314-K374 WeakPolarHBondContact O-CE 3.36Å; M314-K374 PolarHBondContact O-NZ 3.3Å; M314-C377 HydrophobicContact CG-CB 4.09Å; M314-I378 HydrophobicContact CE-CD1 3.87Å; M314-I378 HydrophobicContact CE-CG1 3.42Å; M314-I378 VanDerWaalsContact CE-CG1 3.42Å; M314-I378 HydrophobicContact SD-CG1 4.18Å; M314-L404 HydrophobicContact SD-CD2 4.11Å; M314-V409 HydrophobicContact CE-CB 4.48Å; M314-V409 HydrophobicContact CE-CG1 3.67Å; M314-V409 HydrophobicContact CE-CG2 4.17Å; M314-V409 HydrophobicContact SD-CB 4.49Å; M314-V409 HydrophobicContact SD-CG1 3.85Å; M314-V409 HydrophobicContact SD-CG2 3.76Å; M314-L412 HydrophobicContact CE-CD1 3.84Å
315	F	85	Confident	72.4	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-108.7	-1.2	-171.2	-60.7	-62.9	0	0	0	115.2	Q311 S312 S317 P408 V409 L412 I734 A739 R742 L746	Q311-F315 WeakPolarHBondContact O-CD2 3.38Å; Q311-F315 PolarHBondContact O-N 3.24Å; S312-F315 PolarHBondContact O-N 2.84Å; F315-S317 PolarHBondContact O-N 3.18Å; F315-P408 HydrophobicContact CE2-CB 3.84Å; F315-P408 HydrophobicContact CE2-CG 4.4Å; F315-P408 HydrophobicContact CZ-CB 4.07Å; F315-P408 WeakPolarHBondContact CZ-O 3.47Å; F315-V409 HydrophobicContact CE2-CG2 3.89Å; F315-V409 HydrophobicContact CZ-CG2 4.2Å; F315-L412 HydrophobicContact CE1-CD1 3.91Å; F315-L412 HydrophobicContact CE1-CD2 4.35Å; F315-L412 HydrophobicContact CE1-CG 4.46Å; F315-L412 HydrophobicContact CZ-CD1 3.92Å; F315-L412 HydrophobicContact CZ-CG 4.49Å; F315-I734 HydrophobicContact CB-CD1 3.6Å; F315-I734 HydrophobicContact CD2-CD1 4.26Å; F315-I734 HydrophobicContact CG-CD1 4.38Å; F315-A739 HydrophobicContact CD2-CB 3.88Å; F315-A739 HydrophobicContact CE2-CB 4.31Å; F315-R742 HydrophobicContact CB-CB 4.17Å; F315-R742 HydrophobicContact CD1-CB 4.46Å; F315-R742 WeakPolarHBondContact O-CD 3.33Å; F315-R742 PolarHBondContact O-NH1 2.93Å; F315-L746 HydrophobicContact CD1-CD1 3.64Å; F315-L746 HydrophobicContact CE1-CD1 3.95Å
316	N	76.3	Confident	69.6	Low	35 Å²	35	45.8 Å²	45.8	19%	0.187	24%	0.239	C	C	.	.			trans	-81.2	97.5	166.5	-74.2	-24.3	0	0	0	110.5	S312 P732 I734 R742	S312-N316 WeakPolarHBondContact O-CB 3.37Å; S312-N316 PolarHBondContact O-N 2.88Å; S312-N316 PolarHBondContact O-ND2 3.2Å; N316-P732 PolarHBondContact ND2-O 3.16Å; N316-I734 WeakPolarHBondContact OD1-CG2 3.32Å; N316-R742 PolarHBondContact OD1-NH1 3.21Å
317	S	57	Low	66.6	Low	64 Å²	64	48.5 Å²	48.5	45%	0.448	26%	0.256	S	S	.	.			trans	-74.1	155.6	161	-8.8	0	0	0	0	110	F315	F315-S317 PolarHBondContact O-N 3.18Å
318	D	51.7	Low	63.5	Low	139 Å²	139	52.6 Å²	52.6	74%	0.743	28%	0.284	S	S	*	.	S	Bend	cis	-134	17.6	8.8	-77.4	-59.9	0	0	0	113.2
319	Q	48.6	Very low	60.7	Low	174 Å²	174	56.8 Å²	56.8	81%	0.813	32%	0.315	S	S	*	.	S	Bend	trans	-115.5	119.7	-169.8	-61.3	-169.1	9.1	0	0	113
320	D	46.8	Very low	57.8	Low	108 Å²	108	64 Å²	64	58%	0.578	35%	0.351	S	S	*	.			trans	54.7	111.3	174	-62.5	-15	0	0	0	115.8	N255 W257	N255-D320 VanDerWaalsContact ND2-CB 3.27Å; N255-D320 WeakPolarHBondContact ND2-CB 3.44Å; N255-D320 PolarHBondContact ND2-O 3.25Å; W257-D320 PolarHBondContact NE1-O 3.05Å
321	F	52.1	Low	54.8	Low	44 Å²	44	75.1 Å²	75.1	19%	0.193	40%	0.395	C	S	.	.			trans	-119.1	158.2	-179.9	-70.5	-66.9	0	0	0	111.4	I323 L373	F321-I323 PolarHBondContact O-N 3.09Å; F321-L373 HydrophobicContact CB-CD2 3.77Å; F321-L373 HydrophobicContact CD2-CD1 4.07Å; F321-L373 HydrophobicContact CD2-CD2 4.14Å; F321-L373 HydrophobicContact CE2-CD1 4.4Å; F321-L373 HydrophobicContact CG-CD2 4.18Å
322	P	50.4	Low	51.9	Low	19 Å²	19	80.3 Å²	80.3	12%	0.123	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-71.4	117.4	175.9	29.7	-31.3	0	0	0	110.2	W257 L324	W257-P322 HydrophobicContact CB-CB 4.15Å; W257-P322 HydrophobicContact CD2-CB 4.33Å; W257-P322 HydrophobicContact CD2-CG 3.88Å; W257-P322 HydrophobicContact CE3-CB 4.18Å; W257-P322 HydrophobicContact CE3-CG 3.73Å; W257-P322 HydrophobicContact CG-CB 4.33Å; W257-P322 HydrophobicContact CG-CG 4.25Å; W257-P322 HydrophobicContact CZ3-CG 4.22Å; P322-L324 PolarHBondContact O-N 2.88Å
323	I	46.1	Very low	49	Very low	60 Å²	60	91.8 Å²	91.8	31%	0.308	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-76.6	119.8	-177.4	-57.2	173.3	0	0	0	109.7	F321 W356	F321-I323 PolarHBondContact O-N 3.09Å; I323-W356 HydrophobicContact CD1-CB 4.17Å
324	L	45.9	Very low	46.3	Very low	43 Å²	43	103 Å²	103	23%	0.225	52%	0.517	C	S	.	.	P	Polyproline II helix	trans	-83.3	123.2	171.1	-73.2	178.9	0	0	0	111.2	P322 T375 I379 Y423	P322-L324 PolarHBondContact O-N 2.88Å; L324-T375 HydrophobicContact CD1-CG2 3.95Å; L324-I379 HydrophobicContact CD1-CD1 4.15Å; L324-I379 HydrophobicContact CD2-CD1 3.83Å; L324-Y423 HydrophobicContact CD1-CE2 3.86Å; L324-Y423 HydrophobicContact CD2-CE1 4.33Å
325	V	44.6	Very low	43.7	Very low	90 Å²	90	112.4 Å²	112.4	55%	0.545	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-78.8	124.8	165.4	-178.2	0	0	0	0	108.2	Y423	V325-Y423 PolarHBondContact O-OH 2.74Å
326	E	35.8	Very low	41.2	Very low	122 Å²	122	120 Å²	120	57%	0.57	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-62.6	131.9	179.7	-66	-164.2	159.6	0	0	111.3	T328 K372	E326-T328 PolarHBondContact O-N 3.45Å; E326-T328 VanDerWaalsContact O-N 3.09Å; E326-K372 IonicContact OE1-NZ 2.68Å; E326-K372 PolarHBondContact OE1-NZ 3.21Å
327	P	33.8	Very low	39.1	Very low	58 Å²	58	127.6 Å²	127.6	38%	0.377	63%	0.63	S	S	.	*			trans	-67	113.1	176.2	26.4	-32.6	0	0	0	109.1	H422 Y423	P327-H422 HydrophobicContact CG-CB 4.14Å; P327-Y423 WeakPolarHBondContact CD-OH 3.41Å; P327-Y423 HydrophobicContact CG-CE1 4.26Å
328	T	30.3	Very low	37.9	Very low	114 Å²	114	136.3 Å²	136.3	70%	0.699	65%	0.653	S	S	*	*			trans	-51.3	123	-178.1	53.5	0	0	0	0	110.4	E326 I330	E326-T328 PolarHBondContact O-N 3.45Å; E326-T328 VanDerWaalsContact O-N 3.09Å; T328-I330 VanDerWaalsContact O-CG1 3.31Å; T328-I330 WeakPolarHBondContact O-CG1 3.02Å; T328-I330 PolarHBondContact O-N 3.06Å
329	P	34	Very low	37	Very low	119 Å²	119	133.3 Å²	133.3	77%	0.773	66%	0.655	S	S	*	*			trans	-69.9	102.6	-166.1	24.9	-34.4	0	0	0	112.2	Y331	P329-Y331 PolarHBondContact O-N 2.92Å
330	I	31.3	Very low	36.3	Very low	153 Å²	153	130.9 Å²	130.9	79%	0.785	65%	0.647	S	S	*	*			trans	-76.7	41.1	177.7	-37.8	-175.2	0	0	0	111.5	T328	T328-I330 VanDerWaalsContact O-CG1 3.31Å; T328-I330 WeakPolarHBondContact O-CG1 3.02Å; T328-I330 PolarHBondContact O-N 3.06Å
331	Y	28.7	Very low	35.6	Very low	234 Å²	234	134.4 Å²	134.4	92%	0.918	65%	0.654	S	S	*	*			trans	-139.2	41.9	-179.7	-87.1	-71.6	0	0	0	113.3	P329	P329-Y331 PolarHBondContact O-N 2.92Å
332	S	30.1	Very low	34.6	Very low	109 Å²	109	139.1 Å²	139.1	76%	0.762	68%	0.681	S	S	*	*			trans	-143.7	62.4	161.7	-159	0	0	0	0	113.5
333	R	28.1	Very low	33.8	Very low	241 Å²	241	144.1 Å²	144.1	91%	0.909	72%	0.717	S	S	*	*			trans	-111.9	84.6	154	-70.6	-165.7	-172.6	-164.9	4.5	109.1	F335	R333-F335 PolarHBondContact O-N 3.01Å
334	R	31.1	Very low	33	Very low	236 Å²	236	147.5 Å²	147.5	89%	0.891	74%	0.743	S	S	*	*			trans	-58.7	129.3	163.4	-86	-172.9	173.1	-176.9	-0.9	108.4	N336	R334-N336 PolarHBondContact O-N 3.16Å
335	F	29.3	Very low	32.3	Very low	198 Å²	198	150 Å²	150	87%	0.868	77%	0.769	S	S	*	*			trans	-67.5	95.4	175.6	-89.1	-102.5	0	0	0	111	R333	R333-F335 PolarHBondContact O-N 3.01Å
336	N	32.8	Very low	31.7	Very low	160 Å²	160	151.3 Å²	151.3	86%	0.856	78%	0.778	S	S	*	*			trans	-91.5	117.3	157.7	-88.3	-7.5	0	0	0	109	R334 R338	R334-N336 PolarHBondContact O-N 3.16Å; N336-R338 PolarHBondContact O-N 2.99Å
337	K	32.4	Very low	31.4	Very low	195 Å²	195	155 Å²	155	85%	0.848	79%	0.786	S	S	*	*			trans	-78.9	114.1	179.7	-66.6	175.5	176.6	177.1	0	110.8
338	R	32.3	Very low	31.2	Very low	247 Å²	247	158.3 Å²	158.3	93%	0.932	81%	0.805	S	S	*	*			trans	156.4	144.5	146.3	-86.7	156.7	-177.8	-165.5	0.4	110.5	N336	N336-R338 PolarHBondContact O-N 2.99Å
339	G	33.4	Very low	31.1	Very low	76 Å²	76	157.4 Å²	157.4	78%	0.784	80%	0.803	S	S	*	*			trans	78.4	95.9	-174.4	0	0	0	0	0	111.6
340	N	32.4	Very low	31.2	Very low	122 Å²	122	157.7 Å²	157.7	65%	0.652	81%	0.805	S	S	*	*			cis	86.4	116.6	36.1	-143.9	17.5	0	0	0	113.7
341	Y	32.2	Very low	31.2	Very low	183 Å²	183	157.6 Å²	157.6	72%	0.718	80%	0.801	S	S	*	*			trans	73.8	110.7	173.4	-50	-53.6	0	0	0	122.1
342	N	32.3	Very low	31.4	Very low	143 Å²	143	152 Å²	152	77%	0.765	79%	0.786	S	S	*	*				62.5	98.4	125.8	-52.4	-8.1	0	0	0	121.8
343	S	32.1	Very low	31.6	Very low	124 Å²	124	152.2 Å²	152.2	87%	0.867	78%	0.778	S	S	*	*				-177.5	153.5	120	-82	0	0	0	0	113.1
344	P	30.9	Very low	31.7	Very low	131 Å²	131	145.5 Å²	145.5	85%	0.851	76%	0.763	S	S	*	*			trans	-115.5	114.5	-175.4	37.1	-24.2	0	0	0	115.4
345	A	30.1	Very low	31.5	Very low	94 Å²	94	140.3 Å²	140.3	78%	0.777	75%	0.752	S	S	*	*			trans	-161.8	159.5	163.4	0	0	0	0	0	108.8
346	T	33.2	Very low	31.5	Very low	119 Å²	119	142.2 Å²	142.2	73%	0.73	75%	0.754	S	S	*	*			cis	-146.6	144.9	3.1	-34.2	0	0	0	0	108.4
347	R	27.8	Very low	31.3	Very low	200 Å²	200	139.5 Å²	139.5	76%	0.755	75%	0.747	S	S	*	*			trans	-78.5	127.5	160.3	-91	-172.4	173.7	176.6	0.9	108.3	T879	R347-T879 PolarHBondContact NH1-OG1 3.22Å; R347-T879 VanDerWaalsContact NH2-CG2 3.34Å; R347-T879 PolarHBondContact NH2-OG1 3.43Å
348	V	29.8	Very low	31	Very low	127 Å²	127	140 Å²	140	77%	0.77	75%	0.749	S	S	*	*			trans	-122.2	121.9	171.3	-177.7	0	0	0	0	108
349	S	28.1	Very low	30.8	Very low	95 Å²	95	133.4 Å²	133.4	66%	0.664	74%	0.742	S	S	*	*			trans	-79.3	138.9	171.9	-168.8	0	0	0	0	109.3	Q351	S349-Q351 PolarHBondContact O-N 3.01Å
350	P	36.5	Very low	30.5	Very low	124 Å²	124	134.5 Å²	134.5	81%	0.805	74%	0.737	S	S	*	*			trans	-65	104.2	170.7	-17.6	31.4	0	0	0	109.7
351	Q	32.7	Very low	30.4	Very low	152 Å²	152	134.7 Å²	134.7	71%	0.71	75%	0.745	S	S	*	*			trans	-87.3	127.6	164	-70.9	-177.9	-28.1	0	0	107.8	S349 I353	S349-Q351 PolarHBondContact O-N 3.01Å; Q351-I353 HydrophobicContact CB-CG1 4.43Å; Q351-I353 PolarHBondContact O-N 3.38Å
352	I	32.1	Very low	30.3	Very low	116 Å²	116	132.8 Å²	132.8	60%	0.595	75%	0.747	S	S	*	*			trans	-72.6	110.8	171.2	-61	176	0	0	0	106.9
353	I	34.4	Very low	30.3	Very low	114 Å²	114	134.7 Å²	134.7	59%	0.585	75%	0.751	S	S	*	*			trans	-105.9	118.6	177.7	-64.1	177	0	0	0	108.4	Q351 I355	Q351-I353 HydrophobicContact CB-CG1 4.43Å; Q351-I353 PolarHBondContact O-N 3.38Å; I353-I355 PolarHBondContact O-N 3.06Å
354	T	29.2	Very low	30.3	Very low	99 Å²	99	136.5 Å²	136.5	61%	0.607	75%	0.751	S	S	*	*			trans	-76.4	114.8	178.8	9.4	0	0	0	0	111.6
355	I	28.4	Very low	30.8	Very low	128 Å²	128	134.9 Å²	134.9	66%	0.656	74%	0.743	S	S	*	*			trans	-162.1	132.4	153.2	-91.7	135.6	0	0	0	107.2	I353	I353-I355 PolarHBondContact O-N 3.06Å
356	W	27.7	Very low	31.5	Very low	237 Å²	237	132.8 Å²	132.8	90%	0.898	72%	0.723	S	S	*	*			trans	-170.5	98.6	138.4	-112.4	50.5	0	0	0	106.7	I323	I323-W356 HydrophobicContact CD1-CB 4.17Å
357	S	29.1	Very low	32.4	Very low	104 Å²	104	130.9 Å²	130.9	73%	0.727	72%	0.718	S	S	*	*			trans	-88.4	119.6	-172.5	55.3	0	0	0	0	112.3	S359	S357-S359 PolarHBondContact O-N 3.13Å
358	K	27.1	Very low	33.8	Very low	204 Å²	204	123.4 Å²	123.4	89%	0.887	70%	0.697	S	S	*	*			trans	21.9	96	151.8	-65.2	178.1	178.1	176.5	0	115.8
359	S	27.4	Very low	35.4	Very low	110 Å²	110	120.6 Å²	120.6	77%	0.769	68%	0.678	S	S	*	*			trans	-152.4	128.2	165	-77.3	0	0	0	0	111.3	S357	S357-S359 PolarHBondContact O-N 3.13Å
360	S	27.6	Very low	37.4	Very low	98 Å²	98	118 Å²	118	69%	0.685	66%	0.658	S	S	*	*			trans	56.8	100.5	169.4	-60.3	0	0	0	0	119	N362	S360-N362 VanDerWaalsContact C-N 3.28Å; S360-N362 PolarHBondContact O-N 3.5Å
361	P	28.9	Very low	38.9	Very low	126 Å²	126	112.1 Å²	112.1	82%	0.818	62%	0.62	S	S	*	*			trans	-77.1	75.6	162.3	34.3	-33.8	0	0	0	110.8
362	N	30.9	Very low	40.8	Very low	143 Å²	143	109 Å²	109	77%	0.765	60%	0.604	S	S	*	*			trans	-89.5	118.6	168.5	-90.2	-4.6	0	0	0	109.9	S360 N364	S360-N362 VanDerWaalsContact C-N 3.28Å; S360-N362 PolarHBondContact O-N 3.5Å; N362-N364 PolarHBondContact O-N 3.08Å
363	H	33	Very low	42.9	Very low	184 Å²	184	106.5 Å²	106.5	85%	0.852	59%	0.591	S	S	*	*	S	Bend	trans	-66	89.4	178.6	-66.1	-90.3	0	0	0	111.8
364	N	32.2	Very low	45.3	Very low	162 Å²	162	101.3 Å²	101.3	87%	0.866	57%	0.565	S	S	*	*			trans	-171.4	34.5	161.3	-94.8	-27.7	0	0	0	111.6	N362 S366	N362-N364 PolarHBondContact O-N 3.08Å; N364-S366 PolarHBondContact O-N 3.07Å
365	S	40.4	Very low	48	Very low	96 Å²	96	96.6 Å²	96.6	67%	0.671	54%	0.536	S	S	*	.			trans	-58.8	121.8	174.6	53.1	0	0	0	0	110.2
366	S	45.8	Very low	50.8	Low	51 Å²	51	90.6 Å²	90.6	36%	0.357	51%	0.505	S	S	.	.			trans	-78.4	157.9	-172.3	76.7	0	0	0	0	111.7	N364 S368 D369 V370	N364-S366 PolarHBondContact O-N 3.07Å; S366-S368 PolarHBondContact O-N 3.37Å; S366-S368 VanDerWaalsContact O-N 3.13Å; S366-S368 WeakPolarHBondContact OG-CB 3.21Å; S366-S368 PolarHBondContact OG-N 3.23Å; S366-D369 WeakPolarHBondContact CB-OD2 3.43Å; S366-D369 PolarHBondContact N-OD2 2.67Å; S366-D369 PolarHBondContact O-N 3.09Å; S366-D369 PolarHBondContact OG-OD1 3.15Å; S366-D369 PolarHBondContact OG-OD2 3.38Å; S366-V370 PolarHBondContact O-N 3.06Å
367	A	50.8	Low	53.6	Low	78 Å²	78	79.3 Å²	79.3	65%	0.645	46%	0.462	S	S	*	.	H	α-helix	trans	-58.3	-25.5	174.1	0	0	0	0	0	112.9	D369 G371	A367-D369 VanDerWaalsContact C-N 3.3Å; A367-D369 PolarHBondContact O-N 3.49Å; A367-G371 PolarHBondContact O-N 2.9Å
368	S	57.4	Low	56.6	Low	43 Å²	43	74.3 Å²	74.3	30%	0.301	43%	0.428	S	S	.	.	H	α-helix	trans	-56.4	-44.3	170.6	137.9	0	0	0	0	111.5	S366 G371 K372	S366-S368 PolarHBondContact O-N 3.37Å; S366-S368 VanDerWaalsContact O-N 3.13Å; S366-S368 WeakPolarHBondContact OG-CB 3.21Å; S366-S368 PolarHBondContact OG-N 3.23Å; S368-G371 PolarHBondContact O-N 3.36Å; S368-K372 WeakPolarHBondContact O-CG 3.25Å; S368-K372 PolarHBondContact O-N 3.2Å
369	D	64.5	Low	59.7	Low	68 Å²	68	65 Å²	65	36%	0.364	39%	0.387	S	S	.	.	H	α-helix	trans	-74.8	-40.9	-168.4	-48.6	-42.1	0	0	0	110	S366 A367 K372 L373	S366-D369 WeakPolarHBondContact CB-OD2 3.43Å; S366-D369 PolarHBondContact N-OD2 2.67Å; S366-D369 PolarHBondContact O-N 3.09Å; S366-D369 PolarHBondContact OG-OD1 3.15Å; S366-D369 PolarHBondContact OG-OD2 3.38Å; A367-D369 VanDerWaalsContact C-N 3.3Å; A367-D369 PolarHBondContact O-N 3.49Å; D369-K372 PolarHBondContact O-N 2.88Å; D369-L373 VanDerWaalsContact O-CG 3.26Å; D369-L373 WeakPolarHBondContact O-CG 3.28Å; D369-L373 PolarHBondContact O-N 3.33Å
370	V	68.4	Low	62.7	Low	41 Å²	41	60.3 Å²	60.3	25%	0.248	35%	0.354	C	S	.	.	H	α-helix	trans	-58.6	-48.1	169.5	-179.9	0	0	0	0	110.9	S366 K372 L373 K374 L746	S366-V370 PolarHBondContact O-N 3.06Å; V370-K372 PolarHBondContact O-N 3.22Å; V370-L373 PolarHBondContact O-N 3.05Å; V370-K374 WeakPolarHBondContact O-CG 3.27Å; V370-K374 PolarHBondContact O-N 3.27Å; V370-L746 HydrophobicContact CG1-CD2 3.59Å
371	G	68.7	Low	65.8	Low	1 Å²	1	55.7 Å²	55.7	1%	0.01	32%	0.321	C	S	.	.	H	α-helix	trans	-61.2	-41.3	178	0	0	0	0	0	113.4	A367 S368 T375	A367-G371 PolarHBondContact O-N 2.9Å; S368-G371 PolarHBondContact O-N 3.36Å; G371-T375 WeakPolarHBondContact O-CB 3.48Å; G371-T375 PolarHBondContact O-N 2.91Å; G371-T375 PolarHBondContact O-OG1 3.39Å
372	K	72.5	Confident	69	Low	85 Å²	85	49.7 Å²	49.7	37%	0.37	28%	0.282	S	S	.	.	H	α-helix	trans	-60.9	-46.1	173.5	-74.2	-177.7	-172.8	-169.6	0	111.3	E326 S368 D369 V370 T375 G376	E326-K372 IonicContact OE1-NZ 2.68Å; E326-K372 PolarHBondContact OE1-NZ 3.21Å; S368-K372 WeakPolarHBondContact O-CG 3.25Å; S368-K372 PolarHBondContact O-N 3.2Å; D369-K372 PolarHBondContact O-N 2.88Å; V370-K372 PolarHBondContact O-N 3.22Å; K372-T375 WeakPolarHBondContact O-CB 3.48Å; K372-T375 PolarHBondContact O-N 3.45Å; K372-G376 PolarHBondContact O-N 3.28Å; K372-G376 VanDerWaalsContact O-N 3.07Å
373	L	76.1	Confident	72	Confident	64 Å²	64	44.4 Å²	44.4	34%	0.335	25%	0.254	S	S	.	.	H	α-helix	trans	-62	-46.4	178.9	-68.2	168.7	0	0	0	112.2	F321 D369 V370 T375 G376 C377	F321-L373 HydrophobicContact CB-CD2 3.77Å; F321-L373 HydrophobicContact CD2-CD1 4.07Å; F321-L373 HydrophobicContact CD2-CD2 4.14Å; F321-L373 HydrophobicContact CE2-CD1 4.4Å; F321-L373 HydrophobicContact CG-CD2 4.18Å; D369-L373 VanDerWaalsContact O-CG 3.26Å; D369-L373 WeakPolarHBondContact O-CG 3.28Å; D369-L373 PolarHBondContact O-N 3.33Å; V370-L373 PolarHBondContact O-N 3.05Å; L373-T375 VanDerWaalsContact C-N 3.33Å; L373-T375 PolarHBondContact O-N 2.78Å; L373-G376 PolarHBondContact O-N 3.09Å; L373-G376 VanDerWaalsContact O-N 3.13Å; L373-C377 PolarHBondContact O-N 3.23Å
374	K	84.8	Confident	74.9	Confident	6 Å²	6	35.7 Å²	35.7	3%	0.026	21%	0.214	C	C	.	.	H	α-helix	trans	-68.5	-31.6	177.7	-57.4	-47.2	177.2	-174.6	0	112.4	M314 V370 G376 C377 I378 L412	M314-K374 WeakPolarHBondContact O-CD 3.48Å; M314-K374 WeakPolarHBondContact O-CE 3.36Å; M314-K374 PolarHBondContact O-NZ 3.3Å; V370-K374 WeakPolarHBondContact O-CG 3.27Å; V370-K374 PolarHBondContact O-N 3.27Å; K374-G376 VanDerWaalsContact C-N 3.28Å; K374-G376 PolarHBondContact O-N 2.76Å; K374-C377 PolarHBondContact O-N 3.15Å; K374-I378 WeakPolarHBondContact O-CG1 3.49Å; K374-I378 PolarHBondContact O-N 3.42Å; K374-L412 HydrophobicContact CB-CD1 4.4Å
375	T	87	Confident	78	Confident	0 Å²	0	28 Å²	28	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-59.3	-40.1	169.8	-55.7	0	0	0	0	111.5	L324 G371 K372 L373 I378 I379 S415 V418 L419 Y423	L324-T375 HydrophobicContact CD1-CG2 3.95Å; G371-T375 WeakPolarHBondContact O-CB 3.48Å; G371-T375 PolarHBondContact O-N 2.91Å; G371-T375 PolarHBondContact O-OG1 3.39Å; K372-T375 WeakPolarHBondContact O-CB 3.48Å; K372-T375 PolarHBondContact O-N 3.45Å; L373-T375 VanDerWaalsContact C-N 3.33Å; L373-T375 PolarHBondContact O-N 2.78Å; T375-I378 PolarHBondContact O-N 3.36Å; T375-I379 HydrophobicContact CG2-CD1 3.89Å; T375-I379 HydrophobicContact CG2-CG1 4.49Å; T375-I379 WeakPolarHBondContact O-CG1 3.38Å; T375-I379 PolarHBondContact O-N 3.4Å; T375-S415 WeakPolarHBondContact OG1-CA 3.29Å; T375-S415 PolarHBondContact OG1-O 2.87Å; T375-V418 HydrophobicContact CG2-CB 4.36Å; T375-V418 HydrophobicContact CG2-CG1 4.01Å; T375-L419 HydrophobicContact CG2-CB 4.09Å; T375-Y423 HydrophobicContact CG2-CD2 4.13Å; T375-Y423 HydrophobicContact CG2-CE2 4.4Å
376	G	85.6	Confident	80.6	Confident	1 Å²	1	27.1 Å²	27.1	1%	0.01	16%	0.155	C	C	.	.	H	α-helix	trans	-59.6	-48.2	174.5	0	0	0	0	0	112.4	K372 L373 K374 I378 I379 T380	K372-G376 PolarHBondContact O-N 3.28Å; K372-G376 VanDerWaalsContact O-N 3.07Å; L373-G376 PolarHBondContact O-N 3.09Å; L373-G376 VanDerWaalsContact O-N 3.13Å; K374-G376 VanDerWaalsContact C-N 3.28Å; K374-G376 PolarHBondContact O-N 2.76Å; G376-I378 VanDerWaalsContact C-N 3.32Å; G376-I378 PolarHBondContact O-N 3.31Å; G376-I379 PolarHBondContact O-N 3.08Å; G376-T380 PolarHBondContact O-N 3.14Å; G376-T380 PolarHBondContact O-OG1 3.02Å
377	C	88.1	Confident	82.9	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-57.5	-43	175.2	-59	0	0	0	0	112.2	W257 M314 L373 K374 W381	W257-C377 HydrophobicContact CH2-CB 3.7Å; W257-C377 HydrophobicContact CZ2-CB 4.24Å; W257-C377 HydrophobicContact CZ3-CB 4.28Å; M314-C377 HydrophobicContact CG-CB 4.09Å; L373-C377 PolarHBondContact O-N 3.23Å; K374-C377 PolarHBondContact O-N 3.15Å; C377-W381 PolarHBondContact O-N 2.86Å; C377-W381 VanDerWaalsContact O-N 3.16Å
378	I	91.2	Very high	85.1	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-65	-44.5	179.3	-65	164.3	0	0	0	110.9	M314 K374 T375 G376 W381 I382 L404 W416 L419	M314-I378 HydrophobicContact CE-CD1 3.87Å; M314-I378 HydrophobicContact CE-CG1 3.42Å; M314-I378 VanDerWaalsContact CE-CG1 3.42Å; M314-I378 HydrophobicContact SD-CG1 4.18Å; K374-I378 WeakPolarHBondContact O-CG1 3.49Å; K374-I378 PolarHBondContact O-N 3.42Å; T375-I378 PolarHBondContact O-N 3.36Å; G376-I378 VanDerWaalsContact C-N 3.32Å; G376-I378 PolarHBondContact O-N 3.31Å; I378-W381 PolarHBondContact O-N 3.45Å; I378-I382 HydrophobicContact CG2-CD1 3.69Å; I378-I382 HydrophobicContact CG2-CG1 4.36Å; I378-I382 VanDerWaalsContact O-CG1 3.27Å; I378-I382 WeakPolarHBondContact O-CG1 3.45Å; I378-I382 PolarHBondContact O-N 3.47Å; I378-L404 HydrophobicContact CG1-CD2 4.43Å; I378-L404 HydrophobicContact CG2-CD2 4.28Å; I378-W416 HydrophobicContact CD1-CZ2 4.46Å; I378-W416 HydrophobicContact CG2-CH2 3.95Å; I378-W416 HydrophobicContact CG2-CZ2 4.33Å; I378-W416 HydrophobicContact CG2-CZ3 4.19Å; I378-L419 HydrophobicContact CG2-CD2 3.58Å
379	I	91.6	Very high	86.9	Confident	8 Å²	8	25.2 Å²	25.2	4%	0.041	12%	0.117	C	C	.	.	H	α-helix	trans	-59.8	-48.5	177.9	-74.6	167.1	0	0	0	110.9	L324 T375 G376 W381 I382 D383 L419 Y423 H426	L324-I379 HydrophobicContact CD1-CD1 4.15Å; L324-I379 HydrophobicContact CD2-CD1 3.83Å; T375-I379 HydrophobicContact CG2-CD1 3.89Å; T375-I379 HydrophobicContact CG2-CG1 4.49Å; T375-I379 WeakPolarHBondContact O-CG1 3.38Å; T375-I379 PolarHBondContact O-N 3.4Å; G376-I379 PolarHBondContact O-N 3.08Å; I379-W381 VanDerWaalsContact C-N 3.3Å; I379-W381 PolarHBondContact O-N 3.09Å; I379-I382 WeakPolarHBondContact O-CB 3.47Å; I379-I382 PolarHBondContact O-N 2.98Å; I379-D383 PolarHBondContact O-N 3Å; I379-L419 HydrophobicContact CD1-CD1 4.17Å; I379-L419 HydrophobicContact CG1-CD1 3.77Å; I379-Y423 HydrophobicContact CD1-CD1 3.83Å; I379-Y423 HydrophobicContact CD1-CD2 3.76Å; I379-Y423 HydrophobicContact CD1-CE1 4.39Å; I379-Y423 HydrophobicContact CD1-CE2 4.33Å; I379-Y423 HydrophobicContact CD1-CG 3.48Å; I379-Y423 VanDerWaalsContact CD1-CG 3.48Å; I379-H426 HydrophobicContact CG1-CB 4.22Å
380	T	90.6	Very high	88.2	Confident	11 Å²	11	26.2 Å²	26.2	7%	0.067	12%	0.119	C	C	.	.	H	α-helix	trans	-55.5	-44.8	176.8	-53.2	0	0	0	0	111.8	W257 L261 G376 I382 D383 I384	W257-T380 HydrophobicContact CE3-CG2 3.9Å; W257-T380 HydrophobicContact CZ3-CG2 3.92Å; L261-T380 HydrophobicContact CD2-CG2 3.59Å; G376-T380 PolarHBondContact O-N 3.14Å; G376-T380 PolarHBondContact O-OG1 3.02Å; T380-I382 PolarHBondContact O-N 3.47Å; T380-D383 PolarHBondContact O-N 2.78Å; T380-I384 HydrophobicContact CG2-CD1 3.97Å; T380-I384 WeakPolarHBondContact O-CG1 3.44Å; T380-I384 PolarHBondContact O-N 3.43Å
381	W	94.1	Very high	89.2	Confident	1 Å²	1	25 Å²	25	0%	0.004	11%	0.113	C	C	.	.	H	α-helix	trans	-68.1	-32.3	177.5	-80.5	119.5	0	0	0	113.8	L256 W257 L306 L309 V310 S313 C377 I378 I379 I384 A385 I400 L404	L256-W381 HydrophobicContact CD2-CH2 4.14Å; L256-W381 HydrophobicContact CD2-CZ2 3.46Å; L256-W381 VanDerWaalsContact CD2-CZ2 3.46Å; W257-W381 AromaticContact CH2-NE1 3.94Å; L306-W381 HydrophobicContact CD1-CH2 4.22Å; L306-W381 HydrophobicContact CD1-CZ3 4.28Å; L309-W381 HydrophobicContact CD2-CH2 3.64Å; L309-W381 HydrophobicContact CD2-CZ2 3.71Å; V310-W381 HydrophobicContact CB-CD2 4.44Å; V310-W381 HydrophobicContact CB-CZ2 4.27Å; V310-W381 HydrophobicContact CG1-CD2 4.16Å; V310-W381 HydrophobicContact CG1-CG 4.1Å; V310-W381 HydrophobicContact CG2-CD2 3.83Å; V310-W381 HydrophobicContact CG2-CE3 3.84Å; V310-W381 HydrophobicContact CG2-CH2 3.78Å; V310-W381 HydrophobicContact CG2-CZ2 3.75Å; V310-W381 HydrophobicContact CG2-CZ3 3.81Å; S313-W381 PolarHBondContact OG-NE1 2.84Å; C377-W381 PolarHBondContact O-N 2.86Å; C377-W381 VanDerWaalsContact O-N 3.16Å; I378-W381 PolarHBondContact O-N 3.45Å; I379-W381 VanDerWaalsContact C-N 3.3Å; I379-W381 PolarHBondContact O-N 3.09Å; W381-I384 HydrophobicContact CD2-CD1 4.5Å; W381-I384 HydrophobicContact CE3-CB 4.3Å; W381-I384 HydrophobicContact CE3-CD1 3.96Å; W381-I384 HydrophobicContact CE3-CG2 4.27Å; W381-I384 HydrophobicContact CZ3-CD1 4.07Å; W381-I384 HydrophobicContact CZ3-CG2 4.19Å; W381-A385 VanDerWaalsContact O-CB 3.23Å; W381-A385 WeakPolarHBondContact O-CB 3.46Å; W381-A385 PolarHBondContact O-N 2.73Å; W381-I400 HydrophobicContact CB-CG2 4.06Å; W381-I400 HydrophobicContact CD2-CG2 4.41Å; W381-I400 HydrophobicContact CE3-CD1 3.85Å; W381-I400 HydrophobicContact CE3-CG1 3.91Å; W381-I400 HydrophobicContact CE3-CG2 3.93Å; W381-I400 HydrophobicContact CZ3-CD1 3.84Å; W381-I400 HydrophobicContact CZ3-CG1 3.98Å; W381-L404 HydrophobicContact CB-CD1 4.23Å; W381-L404 HydrophobicContact CB-CD2 4.25Å
382	I	95.1	Very high	90.5	Very high	0 Å²	0	28 Å²	28	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-65.2	-41.7	173.5	-71.3	163.7	0	0	0	110.9	I378 I379 T380 A385 Y386 L404 L419 K429 F430	I378-I382 HydrophobicContact CG2-CD1 3.69Å; I378-I382 HydrophobicContact CG2-CG1 4.36Å; I378-I382 VanDerWaalsContact O-CG1 3.27Å; I378-I382 WeakPolarHBondContact O-CG1 3.45Å; I378-I382 PolarHBondContact O-N 3.47Å; I379-I382 WeakPolarHBondContact O-CB 3.47Å; I379-I382 PolarHBondContact O-N 2.98Å; T380-I382 PolarHBondContact O-N 3.47Å; I382-A385 PolarHBondContact O-N 3.03Å; I382-Y386 WeakPolarHBondContact O-CB 3.42Å; I382-Y386 PolarHBondContact O-N 2.97Å; I382-L404 HydrophobicContact CG1-CD1 4.02Å; I382-L419 HydrophobicContact CD1-CD2 3.8Å; I382-K429 HydrophobicContact CG2-CB 3.63Å; I382-K429 HydrophobicContact CG2-CD 4.25Å; I382-F430 HydrophobicContact CD1-CB 3.79Å; I382-F430 HydrophobicContact CD1-CG 4.37Å; I382-F430 HydrophobicContact CG1-CB 3.99Å; I382-F430 HydrophobicContact CG1-CD2 4.27Å; I382-F430 HydrophobicContact CG1-CG 4.5Å; I382-F430 HydrophobicContact CG2-CB 4.44Å
383	D	93.9	Very high	91.6	Very high	33 Å²	33	24 Å²	24	18%	0.176	11%	0.106	C	C	.	.	H	α-helix	trans	-74.8	-37.6	179.7	-74.8	-45.9	0	0	0	112.7	L261 I379 T380 A385 Y386 R387 H426 K429	L261-D383 HydrophobicContact CD1-CB 3.98Å; I379-D383 PolarHBondContact O-N 3Å; T380-D383 PolarHBondContact O-N 2.78Å; D383-A385 VanDerWaalsContact C-N 3.31Å; D383-A385 PolarHBondContact O-N 2.8Å; D383-Y386 WeakPolarHBondContact O-CB 3.38Å; D383-Y386 PolarHBondContact O-N 2.76Å; D383-Y386 VanDerWaalsContact O-N 3.14Å; D383-R387 PolarHBondContact O-N 3.01Å; D383-H426 IonicContact OD1-CD2 2.59Å; D383-H426 IonicContact OD2-CD2 2.67Å; D383-H426 PolarHBondContact OD2-CD2 3.22Å; D383-H426 IonicContact OD2-NE2 3.91Å; D383-H426 PolarHBondContact OD2-NE2 3.48Å; D383-K429 WeakPolarHBondContact OD1-CD 3.29Å; D383-K429 WeakPolarHBondContact OD1-CE 3.38Å; D383-K429 IonicContact OD1-NZ 3.71Å; D383-K429 PolarHBondContact OD1-NZ 2.81Å; D383-K429 IonicContact OD2-NZ 2.71Å
384	I	94.6	Very high	92.6	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-58.5	-44.5	168.3	-66.8	164.8	0	0	0	110.2	L256 L261 V264 L268 T380 W381 Y386 R387 L388 I400	L256-I384 HydrophobicContact CD1-CD1 4.46Å; L261-I384 HydrophobicContact CB-CG1 4.17Å; L261-I384 HydrophobicContact CD2-CD1 4.25Å; L261-I384 HydrophobicContact CD2-CG1 4.1Å; V264-I384 HydrophobicContact CG1-CD1 4.01Å; V264-I384 HydrophobicContact CG1-CG1 4.42Å; V264-I384 HydrophobicContact CG1-CG2 4.25Å; L268-I384 HydrophobicContact CD1-CG2 4.39Å; T380-I384 HydrophobicContact CG2-CD1 3.97Å; T380-I384 WeakPolarHBondContact O-CG1 3.44Å; T380-I384 PolarHBondContact O-N 3.43Å; W381-I384 HydrophobicContact CD2-CD1 4.5Å; W381-I384 HydrophobicContact CE3-CB 4.3Å; W381-I384 HydrophobicContact CE3-CD1 3.96Å; W381-I384 HydrophobicContact CE3-CG2 4.27Å; W381-I384 HydrophobicContact CZ3-CD1 4.07Å; W381-I384 HydrophobicContact CZ3-CG2 4.19Å; I384-Y386 VanDerWaalsContact C-N 3.34Å; I384-Y386 PolarHBondContact O-N 3.05Å; I384-R387 PolarHBondContact O-N 2.93Å; I384-L388 HydrophobicContact CG2-CD1 3.92Å; I384-L388 HydrophobicContact CG2-CG 4.49Å; I384-L388 WeakPolarHBondContact O-CB 3.4Å; I384-L388 WeakPolarHBondContact O-CG 3.18Å; I384-L388 PolarHBondContact O-N 3.07Å; I384-I400 HydrophobicContact CG2-CD1 3.99Å
385	A	96.6	Very high	93.2	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-64.3	-36.8	175	0	0	0	0	0	112.5	W381 I382 D383 L388 R389 L397 I400 L433	W381-A385 VanDerWaalsContact O-CB 3.23Å; W381-A385 WeakPolarHBondContact O-CB 3.46Å; W381-A385 PolarHBondContact O-N 2.73Å; I382-A385 PolarHBondContact O-N 3.03Å; D383-A385 VanDerWaalsContact C-N 3.31Å; D383-A385 PolarHBondContact O-N 2.8Å; A385-L388 PolarHBondContact O-N 3.28Å; A385-R389 PolarHBondContact O-N 3.33Å; A385-L397 HydrophobicContact CB-CD1 3.89Å; A385-I400 HydrophobicContact CB-CB 4.46Å; A385-I400 HydrophobicContact CB-CG2 4.1Å; A385-L433 HydrophobicContact CB-CD1 3.95Å
386	Y	95.6	Very high	93.7	Very high	79 Å²	79	21.7 Å²	21.7	31%	0.31	9%	0.094	S	C	.	.	H	α-helix	trans	-64.6	-40.6	175.3	-169.9	-103	0	0	0	111.8	I382 D383 I384 R389 Q390 K429 L433	I382-Y386 WeakPolarHBondContact O-CB 3.42Å; I382-Y386 PolarHBondContact O-N 2.97Å; D383-Y386 WeakPolarHBondContact O-CB 3.38Å; D383-Y386 PolarHBondContact O-N 2.76Å; D383-Y386 VanDerWaalsContact O-N 3.14Å; I384-Y386 VanDerWaalsContact C-N 3.34Å; I384-Y386 PolarHBondContact O-N 3.05Å; Y386-R389 WeakPolarHBondContact O-CB 3.35Å; Y386-R389 PolarHBondContact O-N 3.12Å; Y386-Q390 PolarHBondContact O-N 2.96Å; Y386-K429 HydrophobicContact CD2-CG 4.38Å; Y386-L433 HydrophobicContact CD2-CD1 4.43Å; Y386-L433 HydrophobicContact CD2-CD2 4.37Å
387	R	94.5	Very high	94.3	Very high	64 Å²	64	21.6 Å²	21.6	24%	0.242	9%	0.094	C	C	.	.	H	α-helix	trans	-67.6	-41.2	172.9	-177.9	60.4	173.7	-167	-11	112.3	D262 A265 E266 D383 I384 R389 Q390 T391	D262-R387 WeakPolarHBondContact OD1-CD 3.5Å; D262-R387 WeakPolarHBondContact OD1-CG 3.07Å; D262-R387 IonicContact OD1-CZ 2.71Å; D262-R387 VanDerWaalsContact OD1-CZ 3.31Å; D262-R387 IonicContact OD1-NE 3.3Å; D262-R387 PolarHBondContact OD1-NE 3.2Å; D262-R387 IonicContact OD1-NH1 3.83Å; D262-R387 IonicContact OD1-NH2 2.84Å; A265-R387 HydrophobicContact CB-CB 3.76Å; A265-R387 HydrophobicContact CB-CG 3.35Å; E266-R387 IonicContact OE1-CZ 3.21Å; E266-R387 IonicContact OE1-NE 3.57Å; E266-R387 IonicContact OE1-NH2 3.75Å; E266-R387 PolarHBondContact OE1-NH2 3.3Å; D383-R387 PolarHBondContact O-N 3.01Å; I384-R387 PolarHBondContact O-N 2.93Å; R387-R389 PolarHBondContact O-N 2.96Å; R387-Q390 VanDerWaalsContact CD-OE1 3.26Å; R387-Q390 CarbonylContact O-C 3.56Å; R387-Q390 WeakPolarHBondContact O-CA 3.44Å; R387-Q390 VanDerWaalsContact O-CB 3.28Å; R387-Q390 WeakPolarHBondContact O-CB 3.36Å; R387-Q390 PolarHBondContact O-N 3.2Å; R387-T391 PolarHBondContact O-N 3.17Å
388	L	96	Very high	94.7	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-62.2	-29.4	174.2	-73.1	164.6	0	0	0	113	A265 L268 I384 A385 T391 R392 N393 A396 L397 I400	A265-L388 HydrophobicContact CB-CD2 4.01Å; A265-L388 HydrophobicContact CB-CG 3.89Å; A265-L388 VanDerWaalsContact O-CD2 3.28Å; A265-L388 WeakPolarHBondContact O-CD2 3.17Å; L268-L388 HydrophobicContact CB-CD2 4.26Å; L268-L388 HydrophobicContact CD1-CD1 4.29Å; I384-L388 HydrophobicContact CG2-CD1 3.92Å; I384-L388 HydrophobicContact CG2-CG 4.49Å; I384-L388 WeakPolarHBondContact O-CB 3.4Å; I384-L388 WeakPolarHBondContact O-CG 3.18Å; I384-L388 PolarHBondContact O-N 3.07Å; A385-L388 PolarHBondContact O-N 3.28Å; L388-T391 WeakPolarHBondContact CA-OG1 3.49Å; L388-T391 PolarHBondContact O-OG1 3.11Å; L388-R392 PolarHBondContact O-N 2.85Å; L388-N393 HydrophobicContact CD2-CB 4.03Å; L388-N393 PolarHBondContact O-N 3.16Å; L388-A396 HydrophobicContact CD1-CB 3.73Å; L388-A396 HydrophobicContact CD2-CB 4Å; L388-A396 HydrophobicContact CG-CB 4.44Å; L388-L397 HydrophobicContact CB-CB 4.36Å; L388-I400 HydrophobicContact CD1-CD1 3.37Å
389	R	94.8	Very high	95	Very high	68 Å²	68	21.6 Å²	21.6	26%	0.257	9%	0.094	S	C	.	.	H	α-helix	trans	-65.9	-37.5	167.3	179.2	-170.9	154.6	-81.4	9.9	112	A385 Y386 R387 R392 L397 Y432 L433	A385-R389 PolarHBondContact O-N 3.33Å; Y386-R389 WeakPolarHBondContact O-CB 3.35Å; Y386-R389 PolarHBondContact O-N 3.12Å; R387-R389 PolarHBondContact O-N 2.96Å; R389-R392 PolarHBondContact O-N 3.39Å; R389-L397 HydrophobicContact CB-CD2 4.07Å; R389-Y432 VanDerWaalsContact NE-CE1 3.26Å; R389-Y432 PolarHBondContact NE-OH 2.99Å; R389-Y432 PolarHBondContact NH2-OH 3.33Å; R389-L433 HydrophobicContact CB-CD2 3.76Å; R389-L433 HydrophobicContact CG-CD2 4.21Å
390	Q	91.5	Very high	95.2	Very high	88 Å²	88	21.2 Å²	21.2	41%	0.411	9%	0.092	S	C	.	.	H	α-helix	trans	-69.1	-43.6	176	-62.2	175.8	-4.5	0	0	111.7	Y386 R387 R392	Y386-Q390 PolarHBondContact O-N 2.96Å; R387-Q390 VanDerWaalsContact CD-OE1 3.26Å; R387-Q390 CarbonylContact O-C 3.56Å; R387-Q390 WeakPolarHBondContact O-CA 3.44Å; R387-Q390 VanDerWaalsContact O-CB 3.28Å; R387-Q390 WeakPolarHBondContact O-CB 3.36Å; R387-Q390 PolarHBondContact O-N 3.2Å; Q390-R392 VanDerWaalsContact O-CG 3.31Å; Q390-R392 WeakPolarHBondContact O-CG 3.03Å; Q390-R392 PolarHBondContact O-N 3.22Å
391	T	91.1	Very high	95.6	Very high	17 Å²	17	20.7 Å²	20.7	10%	0.104	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-5.3	171.3	71.7	0	0	0	0	112.7	E266 T269 R387 L388 N393 Y716	E266-T391 HydrophobicContact CG-CG2 4.34Å; T269-T391 PolarHBondContact OG1-OG1 3.33Å; R387-T391 PolarHBondContact O-N 3.17Å; L388-T391 WeakPolarHBondContact CA-OG1 3.49Å; L388-T391 PolarHBondContact O-OG1 3.11Å; T391-N393 PolarHBondContact O-N 3.38Å; T391-Y716 WeakPolarHBondContact O-CE1 3.5Å; T391-Y716 PolarHBondContact O-OH 2.82Å
392	R	94.7	Very high	95.6	Very high	63 Å²	63	22.1 Å²	22.1	24%	0.238	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.5	25.2	175.1	-37.1	175.6	76.9	-147.2	5.3	112.6	L388 R389 Q390 Y394 C453 S506 G507 V508 I509	L388-R392 PolarHBondContact O-N 2.85Å; R389-R392 PolarHBondContact O-N 3.39Å; Q390-R392 VanDerWaalsContact O-CG 3.31Å; Q390-R392 WeakPolarHBondContact O-CG 3.03Å; Q390-R392 PolarHBondContact O-N 3.22Å; R392-Y394 HydrophobicContact CB-CE2 4.23Å; R392-Y394 WeakPolarHBondContact O-CD2 3.5Å; R392-Y394 PolarHBondContact O-N 3.45Å; R392-C453 PolarHBondContact NH2-SG 2.93Å; R392-S506 VanDerWaalsContact CD-OG 3.3Å; R392-S506 WeakPolarHBondContact CD-OG 3.34Å; R392-S506 PolarHBondContact NH1-O 2.88Å; R392-G507 WeakPolarHBondContact CB-O 3.46Å; R392-G507 WeakPolarHBondContact CD-O 3.38Å; R392-V508 HydrophobicContact CB-CB 4.35Å; R392-I509 PolarHBondContact O-N 3.22Å; R392-I509 VanDerWaalsContact O-N 3.15Å
393	N	96.4	Very high	95.6	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	10%	0.095	C	C	.	.	B	Isolated β-bridge	trans	-82.2	92.6	168.1	-177.5	-4.4	0	0	0	109.8	T269 D272 L388 T391 S395 A396 L397 I509	T269-N393 HydrophobicContact CG2-CB 4.35Å; D272-N393 PolarHBondContact OD2-ND2 3.33Å; D272-N393 PolarHBondContact OD2-OD1 3.5Å; L388-N393 HydrophobicContact CD2-CB 4.03Å; L388-N393 PolarHBondContact O-N 3.16Å; T391-N393 PolarHBondContact O-N 3.38Å; N393-S395 VanDerWaalsContact C-N 3.3Å; N393-S395 WeakPolarHBondContact OD1-CA 3.29Å; N393-S395 WeakPolarHBondContact OD1-CB 3.44Å; N393-S395 PolarHBondContact OD1-N 2.71Å; N393-A396 VanDerWaalsContact ND2-CB 3.29Å; N393-A396 WeakPolarHBondContact ND2-CB 3.43Å; N393-A396 PolarHBondContact OD1-N 3.31Å; N393-L397 WeakPolarHBondContact O-CB 3.42Å; N393-L397 PolarHBondContact O-N 2.97Å; N393-I509 HydrophobicContact CB-CB 4.4Å; N393-I509 HydrophobicContact CB-CD1 4.22Å
394	Y	97.3	Very high	95.7	Very high	13 Å²	13	20.5 Å²	20.5	5%	0.051	9%	0.087	C	C	.	.	H	α-helix	trans	-77	-13.9	177	-60.6	-75.3	0	0	0	113.4	R392 L397 K398 V436 L446 L450 V508 I509	R392-Y394 HydrophobicContact CB-CE2 4.23Å; R392-Y394 WeakPolarHBondContact O-CD2 3.5Å; R392-Y394 PolarHBondContact O-N 3.45Å; Y394-L397 HydrophobicContact CD1-CD2 4.06Å; Y394-K398 WeakPolarHBondContact O-CB 3.03Å; Y394-K398 PolarHBondContact O-N 2.84Å; Y394-V436 HydrophobicContact CE1-CG1 4.19Å; Y394-L446 HydrophobicContact CD1-CD1 3.61Å; Y394-L446 HydrophobicContact CD2-CD1 4.24Å; Y394-L446 HydrophobicContact CE1-CD1 4.32Å; Y394-L446 HydrophobicContact CG-CD1 3.58Å; Y394-L450 HydrophobicContact CD2-CD2 3.8Å; Y394-L450 HydrophobicContact CE2-CD2 4.21Å; Y394-V508 HydrophobicContact CD2-CG2 3.73Å; Y394-V508 HydrophobicContact CE2-CG2 3.69Å; Y394-I509 WeakPolarHBondContact CB-O 3.41Å; Y394-I509 PolarHBondContact N-O 3.29Å
395	S	97.1	Very high	95.6	Very high	8 Å²	8	23.5 Å²	23.5	6%	0.056	10%	0.101	C	C	.	.	H	α-helix	trans	-71	-64.1	174.4	-174.4	0	0	0	0	110.2	N393 L397 K398 A399	N393-S395 VanDerWaalsContact C-N 3.3Å; N393-S395 WeakPolarHBondContact OD1-CA 3.29Å; N393-S395 WeakPolarHBondContact OD1-CB 3.44Å; N393-S395 PolarHBondContact OD1-N 2.71Å; S395-L397 VanDerWaalsContact C-N 3.34Å; S395-L397 PolarHBondContact O-N 3.03Å; S395-K398 PolarHBondContact O-N 3.06Å; S395-K398 VanDerWaalsContact O-N 3.11Å; S395-A399 PolarHBondContact O-N 2.71Å
396	A	97.3	Very high	95.5	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.008	10%	0.103	C	C	.	.	H	α-helix	trans	-61.6	-38.4	178.6	0	0	0	0	0	113	D272 L306 L388 N393 K398 A399 I400	D272-A396 PolarHBondContact OD2-N 3.35Å; L306-A396 HydrophobicContact CD2-CB 3.48Å; L306-A396 VanDerWaalsContact CD2-CB 3.48Å; L388-A396 HydrophobicContact CD1-CB 3.73Å; L388-A396 HydrophobicContact CD2-CB 4Å; L388-A396 HydrophobicContact CG-CB 4.44Å; N393-A396 VanDerWaalsContact ND2-CB 3.29Å; N393-A396 WeakPolarHBondContact ND2-CB 3.43Å; N393-A396 PolarHBondContact OD1-N 3.31Å; A396-K398 VanDerWaalsContact C-N 3.34Å; A396-K398 PolarHBondContact O-N 2.97Å; A396-A399 WeakPolarHBondContact O-CB 3.28Å; A396-A399 PolarHBondContact O-N 3.44Å; A396-I400 WeakPolarHBondContact O-CG1 3.41Å; A396-I400 PolarHBondContact O-N 3.1Å
397	L	97.7	Very high	95.2	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-55.7	-47.2	172.5	169.1	59.9	0	0	0	111.6	A385 L388 R389 N393 Y394 S395 I401 L433 V437	A385-L397 HydrophobicContact CB-CD1 3.89Å; L388-L397 HydrophobicContact CB-CB 4.36Å; R389-L397 HydrophobicContact CB-CD2 4.07Å; N393-L397 WeakPolarHBondContact O-CB 3.42Å; N393-L397 PolarHBondContact O-N 2.97Å; Y394-L397 HydrophobicContact CD1-CD2 4.06Å; S395-L397 VanDerWaalsContact C-N 3.34Å; S395-L397 PolarHBondContact O-N 3.03Å; L397-I401 HydrophobicContact CD1-CG1 3.86Å; L397-I401 WeakPolarHBondContact O-CB 3.44Å; L397-I401 VanDerWaalsContact O-CG1 3.3Å; L397-I401 WeakPolarHBondContact O-CG1 3.43Å; L397-I401 PolarHBondContact O-N 3.13Å; L397-L433 HydrophobicContact CD1-CB 4.32Å; L397-L433 HydrophobicContact CD1-CD2 3.89Å; L397-V437 HydrophobicContact CD2-CG1 3.81Å; L397-V437 HydrophobicContact CG-CG1 3.91Å
398	K	97	Very high	95	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-70.7	-35.3	179.1	-169	163.4	178.6	141.5	0	111.6	Y303 Y394 S395 A396 I400 I401 M402 V437 F439 Y511	Y303-K398 HydrophobicContact CE2-CB 4.34Å; Y394-K398 WeakPolarHBondContact O-CB 3.03Å; Y394-K398 PolarHBondContact O-N 2.84Å; S395-K398 PolarHBondContact O-N 3.06Å; S395-K398 VanDerWaalsContact O-N 3.11Å; A396-K398 VanDerWaalsContact C-N 3.34Å; A396-K398 PolarHBondContact O-N 2.97Å; K398-I400 PolarHBondContact O-N 3.16Å; K398-I401 PolarHBondContact O-N 2.96Å; K398-M402 HydrophobicContact CG-CG 3.87Å; K398-M402 VanDerWaalsContact O-CB 3.26Å; K398-M402 WeakPolarHBondContact O-CB 3.46Å; K398-M402 WeakPolarHBondContact O-CG 3.49Å; K398-M402 PolarHBondContact O-N 2.93Å; K398-V437 HydrophobicContact CB-CB 4.24Å; K398-V437 HydrophobicContact CB-CG1 4.32Å; K398-V437 HydrophobicContact CB-CG2 4.47Å; K398-V437 HydrophobicContact CD-CB 4.16Å; K398-V437 HydrophobicContact CG-CB 4.16Å; K398-V437 HydrophobicContact CG-CG2 4.3Å; K398-V437 PolarHBondContact NZ-O 2.95Å; K398-F439 VanDerWaalsContact NZ-CE1 3.33Å; K398-F439 VanDerWaalsContact NZ-CZ 3.27Å; K398-Y511 HydrophobicContact CB-CD2 4.47Å; K398-Y511 HydrophobicContact CB-CG 4.47Å; K398-Y511 HydrophobicContact CD-CD1 3.62Å; K398-Y511 HydrophobicContact CD-CD2 4.27Å; K398-Y511 HydrophobicContact CD-CE1 3.89Å; K398-Y511 HydrophobicContact CD-CG 3.83Å
399	A	97	Very high	94.8	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-57.4	-48.9	174.1	0	0	0	0	0	112	Y303 L306 S395 A396 M402 A403	Y303-A399 HydrophobicContact CD2-CB 3.78Å; Y303-A399 HydrophobicContact CE2-CB 3.64Å; Y303-A399 HydrophobicContact CG-CB 4.28Å; L306-A399 HydrophobicContact CB-CB 4.28Å; L306-A399 HydrophobicContact CD2-CB 3.96Å; L306-A399 HydrophobicContact CG-CB 4.1Å; S395-A399 PolarHBondContact O-N 2.71Å; A396-A399 WeakPolarHBondContact O-CB 3.28Å; A396-A399 PolarHBondContact O-N 3.44Å; A399-M402 PolarHBondContact O-N 3Å; A399-A403 WeakPolarHBondContact O-CB 3.2Å; A399-A403 PolarHBondContact O-N 2.87Å
400	I	97.2	Very high	94.6	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-67.7	-45.7	-179.8	-62.9	160.3	0	0	0	111.3	L306 V310 W381 I384 A385 L388 A396 K398 M402 A403 L404	L306-I400 HydrophobicContact CD1-CG1 4.43Å; L306-I400 HydrophobicContact CD2-CD1 4.44Å; L306-I400 HydrophobicContact CD2-CG1 4.25Å; L306-I400 HydrophobicContact CG-CG1 4.3Å; V310-I400 HydrophobicContact CG2-CB 4.35Å; V310-I400 HydrophobicContact CG2-CG1 3.85Å; V310-I400 HydrophobicContact CG2-CG2 4.33Å; W381-I400 HydrophobicContact CB-CG2 4.06Å; W381-I400 HydrophobicContact CD2-CG2 4.41Å; W381-I400 HydrophobicContact CE3-CD1 3.85Å; W381-I400 HydrophobicContact CE3-CG1 3.91Å; W381-I400 HydrophobicContact CE3-CG2 3.93Å; W381-I400 HydrophobicContact CZ3-CD1 3.84Å; W381-I400 HydrophobicContact CZ3-CG1 3.98Å; I384-I400 HydrophobicContact CG2-CD1 3.99Å; A385-I400 HydrophobicContact CB-CB 4.46Å; A385-I400 HydrophobicContact CB-CG2 4.1Å; L388-I400 HydrophobicContact CD1-CD1 3.37Å; A396-I400 WeakPolarHBondContact O-CG1 3.41Å; A396-I400 PolarHBondContact O-N 3.1Å; K398-I400 PolarHBondContact O-N 3.16Å; I400-M402 VanDerWaalsContact C-N 3.33Å; I400-M402 PolarHBondContact O-N 3.49Å; I400-A403 PolarHBondContact O-N 3.34Å; I400-A403 VanDerWaalsContact O-N 3.17Å; I400-L404 HydrophobicContact CG2-CD1 4.14Å; I400-L404 HydrophobicContact CG2-CG 4.37Å; I400-L404 WeakPolarHBondContact O-CG 3.13Å; I400-L404 PolarHBondContact O-N 3.49Å
401	I	97.2	Very high	94.5	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-62.6	-40.4	178.3	-68.2	-67.4	0	0	0	111.3	L397 K398 L404 Q405 F430 L433 A434 V437	L397-I401 HydrophobicContact CD1-CG1 3.86Å; L397-I401 WeakPolarHBondContact O-CB 3.44Å; L397-I401 VanDerWaalsContact O-CG1 3.3Å; L397-I401 WeakPolarHBondContact O-CG1 3.43Å; L397-I401 PolarHBondContact O-N 3.13Å; K398-I401 PolarHBondContact O-N 2.96Å; I401-L404 PolarHBondContact O-N 3.16Å; I401-Q405 VanDerWaalsContact O-CB 3.27Å; I401-Q405 WeakPolarHBondContact O-CB 3.47Å; I401-Q405 VanDerWaalsContact O-CG 3.29Å; I401-Q405 WeakPolarHBondContact O-CG 3.24Å; I401-Q405 PolarHBondContact O-N 2.69Å; I401-F430 HydrophobicContact CD1-CD2 3.94Å; I401-F430 HydrophobicContact CD1-CE2 4.09Å; I401-L433 HydrophobicContact CD1-CB 3.73Å; I401-L433 HydrophobicContact CG1-CB 4.34Å; I401-A434 HydrophobicContact CG2-CB 4.24Å; I401-V437 HydrophobicContact CB-CG2 4Å; I401-V437 HydrophobicContact CG1-CG2 4.23Å; I401-V437 HydrophobicContact CG2-CG2 3.76Å
402	M	95.3	Very high	94.3	Very high	30 Å²	30	16.5 Å²	16.5	15%	0.148	8%	0.079	C	C	.	.	H	α-helix	trans	-67	-35.1	174.8	-66.3	-71.5	95.2	0	0	112.3	Y307 K398 A399 I400 Q405 S406 F439	Y307-M402 HydrophobicContact CD2-CB 4.14Å; Y307-M402 HydrophobicContact CE2-CB 4.15Å; K398-M402 HydrophobicContact CG-CG 3.87Å; K398-M402 VanDerWaalsContact O-CB 3.26Å; K398-M402 WeakPolarHBondContact O-CB 3.46Å; K398-M402 WeakPolarHBondContact O-CG 3.49Å; K398-M402 PolarHBondContact O-N 2.93Å; A399-M402 PolarHBondContact O-N 3Å; I400-M402 VanDerWaalsContact C-N 3.33Å; I400-M402 PolarHBondContact O-N 3.49Å; M402-Q405 CarbonylContact O-C 3.51Å; M402-Q405 PolarHBondContact O-N 3.36Å; M402-S406 PolarHBondContact O-N 3.13Å; M402-F439 HydrophobicContact CE-CE2 4.06Å; M402-F439 HydrophobicContact SD-CE2 3.65Å; M402-F439 HydrophobicContact SD-CZ 4.08Å
403	A	95	Very high	93.8	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-69.4	-42.1	175.4	0	0	0	0	0	112.1	Y307 V310 A399 I400 Q405 S406 V409	Y307-A403 HydrophobicContact CD2-CB 3.67Å; Y307-A403 HydrophobicContact CE2-CB 4.1Å; Y307-A403 HydrophobicContact CG-CB 4.16Å; Y307-A403 WeakPolarHBondContact O-CB 3.47Å; V310-A403 HydrophobicContact CB-CB 3.61Å; V310-A403 HydrophobicContact CG1-CB 3.59Å; V310-A403 HydrophobicContact CG2-CB 4.19Å; A399-A403 WeakPolarHBondContact O-CB 3.2Å; A399-A403 PolarHBondContact O-N 2.87Å; I400-A403 PolarHBondContact O-N 3.34Å; I400-A403 VanDerWaalsContact O-N 3.17Å; A403-Q405 VanDerWaalsContact C-N 3.26Å; A403-Q405 PolarHBondContact O-N 2.93Å; A403-S406 VanDerWaalsContact O-CB 3.23Å; A403-S406 WeakPolarHBondContact O-CB 3.31Å; A403-S406 PolarHBondContact O-N 3.4Å; A403-S406 VanDerWaalsContact O-N 3.09Å; A403-S406 PolarHBondContact O-OG 3.17Å; A403-V409 WeakPolarHBondContact O-CG2 2.84Å
404	L	95.7	Very high	93.2	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-65.2	-30.5	171.8	-67.9	178.1	0	0	0	112.2	V310 M314 I378 W381 I382 I400 I401 S406 V409 L410 W416 F430	V310-L404 HydrophobicContact CG1-CD2 4.39Å; M314-L404 HydrophobicContact SD-CD2 4.11Å; I378-L404 HydrophobicContact CG1-CD2 4.43Å; I378-L404 HydrophobicContact CG2-CD2 4.28Å; W381-L404 HydrophobicContact CB-CD1 4.23Å; W381-L404 HydrophobicContact CB-CD2 4.25Å; I382-L404 HydrophobicContact CG1-CD1 4.02Å; I400-L404 HydrophobicContact CG2-CD1 4.14Å; I400-L404 HydrophobicContact CG2-CG 4.37Å; I400-L404 WeakPolarHBondContact O-CG 3.13Å; I400-L404 PolarHBondContact O-N 3.49Å; I401-L404 PolarHBondContact O-N 3.16Å; L404-S406 VanDerWaalsContact C-N 3.32Å; L404-V409 HydrophobicContact CD2-CG1 4.19Å; L404-V409 WeakPolarHBondContact O-CG1 3.37Å; L404-L410 WeakPolarHBondContact O-CD2 3.12Å; L404-W416 HydrophobicContact CB-CH2 4.47Å; L404-F430 HydrophobicContact CB-CE2 3.88Å; L404-F430 HydrophobicContact CD1-CD2 4.16Å; L404-F430 HydrophobicContact CD1-CE2 4.12Å
405	Q	93.3	Very high	92.7	Very high	63 Å²	63	20.5 Å²	20.5	29%	0.294	10%	0.096	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	8.1	172.6	-68.7	-176.8	-29.8	0	0	114	I401 M402 A403 L410 F430	I401-Q405 VanDerWaalsContact O-CB 3.27Å; I401-Q405 WeakPolarHBondContact O-CB 3.47Å; I401-Q405 VanDerWaalsContact O-CG 3.29Å; I401-Q405 WeakPolarHBondContact O-CG 3.24Å; I401-Q405 PolarHBondContact O-N 2.69Å; M402-Q405 CarbonylContact O-C 3.51Å; M402-Q405 PolarHBondContact O-N 3.36Å; A403-Q405 VanDerWaalsContact C-N 3.26Å; A403-Q405 PolarHBondContact O-N 2.93Å; Q405-L410 HydrophobicContact CB-CD1 4.37Å; Q405-L410 WeakPolarHBondContact O-CD1 3.38Å; Q405-F430 HydrophobicContact CG-CE2 4.38Å; Q405-F430 HydrophobicContact CG-CZ 3.87Å
406	S	93.2	Very high	92.4	Very high	6 Å²	6	21.1 Å²	21.1	4%	0.042	10%	0.098	C	C	.	.	S	Bend	trans	-77.3	150.7	177.7	72.8	0	0	0	0	111.8	Y307 Q311 M402 A403 L404 P408 V409 L410	Y307-S406 VanDerWaalsContact OH-CB 3.3Å; Y307-S406 WeakPolarHBondContact OH-CB 3.37Å; Q311-S406 PolarHBondContact NE2-OG 2.97Å; M402-S406 PolarHBondContact O-N 3.13Å; A403-S406 VanDerWaalsContact O-CB 3.23Å; A403-S406 WeakPolarHBondContact O-CB 3.31Å; A403-S406 PolarHBondContact O-N 3.4Å; A403-S406 VanDerWaalsContact O-N 3.09Å; A403-S406 PolarHBondContact O-OG 3.17Å; L404-S406 VanDerWaalsContact C-N 3.32Å; S406-P408 VanDerWaalsContact C-CD 3.47Å; S406-P408 WeakPolarHBondContact OG-CG 3.47Å; S406-V409 PolarHBondContact O-N 3.06Å; S406-L410 PolarHBondContact O-N 3.31Å
407	T	90.5	Very high	91.9	Very high	56 Å²	56	24.7 Å²	24.7	34%	0.344	12%	0.116	S	C	.	.	H	α-helix	trans	-46.1	-46.7	178.7	-51.6	0	0	0	0	114.9	V409 R411 L740	T407-V409 VanDerWaalsContact C-N 3.34Å; T407-V409 PolarHBondContact O-N 3.5Å; T407-R411 WeakPolarHBondContact O-CG 3.3Å; T407-R411 PolarHBondContact O-N 3.04Å; T407-L740 HydrophobicContact CG2-CD1 4.07Å
408	P	90.7	Very high	91.4	Very high	2 Å²	2	25.7 Å²	25.7	1%	0.013	12%	0.123	C	C	.	.	H	α-helix	trans	-66.6	-31.5	177.9	26.3	-36	0	0	0	113.4	F315 S406 R411 A739 S743	F315-P408 HydrophobicContact CE2-CB 3.84Å; F315-P408 HydrophobicContact CE2-CG 4.4Å; F315-P408 HydrophobicContact CZ-CB 4.07Å; F315-P408 WeakPolarHBondContact CZ-O 3.47Å; S406-P408 VanDerWaalsContact C-CD 3.47Å; S406-P408 WeakPolarHBondContact OG-CG 3.47Å; P408-R411 VanDerWaalsContact O-CG 3.26Å; P408-R411 WeakPolarHBondContact O-CG 3.47Å; P408-A739 HydrophobicContact CB-CB 3.99Å; P408-A739 WeakPolarHBondContact CB-O 3.33Å; P408-A739 HydrophobicContact CG-CB 3.93Å; P408-S743 PolarHBondContact O-OG 2.64Å
409	V	91.1	Very high	91.1	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-83.7	-39.8	-179.5	179.9	0	0	0	0	111.9	M314 F315 A403 L404 S406 T407 R411 L412 W416	M314-V409 HydrophobicContact CE-CB 4.48Å; M314-V409 HydrophobicContact CE-CG1 3.67Å; M314-V409 HydrophobicContact CE-CG2 4.17Å; M314-V409 HydrophobicContact SD-CB 4.49Å; M314-V409 HydrophobicContact SD-CG1 3.85Å; M314-V409 HydrophobicContact SD-CG2 3.76Å; F315-V409 HydrophobicContact CE2-CG2 3.89Å; F315-V409 HydrophobicContact CZ-CG2 4.2Å; A403-V409 WeakPolarHBondContact O-CG2 2.84Å; L404-V409 HydrophobicContact CD2-CG1 4.19Å; L404-V409 WeakPolarHBondContact O-CG1 3.37Å; S406-V409 PolarHBondContact O-N 3.06Å; T407-V409 VanDerWaalsContact C-N 3.34Å; T407-V409 PolarHBondContact O-N 3.5Å; V409-R411 VanDerWaalsContact C-N 3.26Å; V409-R411 PolarHBondContact O-N 3.38Å; V409-L412 WeakPolarHBondContact O-CB 3.49Å; V409-L412 PolarHBondContact O-N 3.2Å; V409-W416 HydrophobicContact CG1-CZ2 4.03Å; V409-W416 PolarHBondContact O-NE1 2.85Å
410	L	89.7	Confident	90.7	Very high	43 Å²	43	28.1 Å²	28.1	23%	0.225	13%	0.134	C	C	.	.	H	α-helix	trans	-69	-19.4	-178.6	-73.8	-174.2	0	0	0	114.5	L404 Q405 S406 L412 W416 F761	L404-L410 WeakPolarHBondContact O-CD2 3.12Å; Q405-L410 HydrophobicContact CB-CD1 4.37Å; Q405-L410 WeakPolarHBondContact O-CD1 3.38Å; S406-L410 PolarHBondContact O-N 3.31Å; L410-L412 VanDerWaalsContact C-N 3.32Å; L410-W416 HydrophobicContact CD2-CZ2 4.12Å; L410-F761 HydrophobicContact CB-CZ 4.01Å; L410-F761 HydrophobicContact CD1-CE1 3.9Å; L410-F761 HydrophobicContact CD1-CZ 3.95Å; L410-F761 HydrophobicContact CD2-CE1 4.18Å; L410-F761 HydrophobicContact CD2-CZ 4Å; L410-F761 HydrophobicContact CG-CZ 4.21Å
411	R	89.6	Confident	90.2	Very high	62 Å²	62	37.1 Å²	37.1	23%	0.234	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-9	176.9	66.8	168.7	-71.9	168.8	7.2	114.4	T407 P408 V409 W413 S743 C744 E747	T407-R411 WeakPolarHBondContact O-CG 3.3Å; T407-R411 PolarHBondContact O-N 3.04Å; P408-R411 VanDerWaalsContact O-CG 3.26Å; P408-R411 WeakPolarHBondContact O-CG 3.47Å; V409-R411 VanDerWaalsContact C-N 3.26Å; V409-R411 PolarHBondContact O-N 3.38Å; R411-W413 PolarHBondContact O-N 3.37Å; R411-S743 WeakPolarHBondContact CD-OG 3.48Å; R411-S743 VanDerWaalsContact CG-OG 3.22Å; R411-S743 WeakPolarHBondContact CG-OG 3.38Å; R411-S743 VanDerWaalsContact CZ-O 3.27Å; R411-S743 PolarHBondContact NE-O 2.87Å; R411-C744 PolarHBondContact NH1-SG 3.39Å; R411-E747 PolarHBondContact NH2-O 3.37Å
412	L	87.3	Confident	89.7	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	19%	0.19	C	C	.	.			trans	-75.3	60.6	176.7	-62.9	178.2	0	0	0	110.6	M314 F315 K374 V409 L410 H414 S415 W416 S743 E747	M314-L412 HydrophobicContact CE-CD1 3.84Å; F315-L412 HydrophobicContact CE1-CD1 3.91Å; F315-L412 HydrophobicContact CE1-CD2 4.35Å; F315-L412 HydrophobicContact CE1-CG 4.46Å; F315-L412 HydrophobicContact CZ-CD1 3.92Å; F315-L412 HydrophobicContact CZ-CG 4.49Å; K374-L412 HydrophobicContact CB-CD1 4.4Å; V409-L412 WeakPolarHBondContact O-CB 3.49Å; V409-L412 PolarHBondContact O-N 3.2Å; L410-L412 VanDerWaalsContact C-N 3.32Å; L412-H414 PolarHBondContact O-N 3.32Å; L412-S415 WeakPolarHBondContact O-CB 3.38Å; L412-S415 PolarHBondContact O-N 3.32Å; L412-S415 VanDerWaalsContact O-N 3.1Å; L412-W416 PolarHBondContact O-N 2.96Å; L412-S743 WeakPolarHBondContact CD2-OG 3.38Å; L412-E747 VanDerWaalsContact C-OE1 3.31Å; L412-E747 VanDerWaalsContact CA-CD 3.43Å; L412-E747 VanDerWaalsContact CA-OE1 3.27Å; L412-E747 WeakPolarHBondContact CA-OE1 3.5Å; L412-E747 WeakPolarHBondContact CA-OE2 3.44Å; L412-E747 WeakPolarHBondContact CB-OE1 3.43Å; L412-E747 HydrophobicContact CD2-CB 4.24Å; L412-E747 HydrophobicContact CD2-CG 3.95Å
413	W	84.8	Confident	89.4	Confident	95 Å²	95	41.7 Å²	41.7	36%	0.36	19%	0.189	S	C	.	.	H	α-helix	trans	-62.2	-31.5	-169.3	72.7	-87.4	0	0	0	112.3	R411 N417 E747 M753	R411-W413 PolarHBondContact O-N 3.37Å; W413-N417 VanDerWaalsContact CE3-ND2 3.32Å; W413-N417 WeakPolarHBondContact CZ3-ND2 3.43Å; W413-N417 WeakPolarHBondContact O-CB 3.49Å; W413-N417 PolarHBondContact O-N 3.36Å; W413-E747 PolarHBondContact N-OE2 3.22Å; W413-M753 HydrophobicContact CE3-CE 4.35Å; W413-M753 HydrophobicContact CH2-CE 4.13Å; W413-M753 HydrophobicContact CH2-SD 3.58Å; W413-M753 VanDerWaalsContact CH2-SD 3.58Å; W413-M753 HydrophobicContact CZ2-CE 4.43Å; W413-M753 HydrophobicContact CZ2-SD 3.52Å; W413-M753 VanDerWaalsContact CZ2-SD 3.52Å; W413-M753 HydrophobicContact CZ3-CE 4.08Å; W413-M753 HydrophobicContact CZ3-SD 4.15Å
414	H	83.1	Confident	89.2	Confident	64 Å²	64	46.2 Å²	46.2	30%	0.296	21%	0.21	S	C	.	.	H	α-helix	trans	-66.9	-46.7	174.9	-161.6	93.8	0	0	0	110.1	L412 W416 N417 V418 E747	L412-H414 PolarHBondContact O-N 3.32Å; H414-W416 PolarHBondContact O-N 3.1Å; H414-N417 PolarHBondContact O-N 3.09Å; H414-V418 WeakPolarHBondContact O-CG2 3.44Å; H414-V418 PolarHBondContact O-N 3.13Å; H414-E747 PolarHBondContact N-OE2 3.3Å
415	S	87.8	Confident	89	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.2	-43.5	177.3	-50.4	0	0	0	0	112.3	T375 L412 V418 L419 E747	T375-S415 WeakPolarHBondContact OG1-CA 3.29Å; T375-S415 PolarHBondContact OG1-O 2.87Å; L412-S415 WeakPolarHBondContact O-CB 3.38Å; L412-S415 PolarHBondContact O-N 3.32Å; L412-S415 VanDerWaalsContact O-N 3.1Å; S415-V418 PolarHBondContact O-N 3.04Å; S415-L419 PolarHBondContact O-N 2.84Å; S415-L419 VanDerWaalsContact O-N 3.13Å; S415-E747 PolarHBondContact N-OE1 2.01Å; S415-E747 PolarHBondContact OG-OE1 3Å; S415-E747 VanDerWaalsContact OG-OE1 3.05Å
416	W	89.9	Confident	88.9	Confident	22 Å²	22	50.8 Å²	50.8	8%	0.083	23%	0.231	C	C	.	.	H	α-helix	trans	-67.9	-32.7	175.9	-75.2	105.3	0	0	0	113.3	I378 L404 V409 L410 L412 H414 L419 E420 F427 F430	I378-W416 HydrophobicContact CD1-CZ2 4.46Å; I378-W416 HydrophobicContact CG2-CH2 3.95Å; I378-W416 HydrophobicContact CG2-CZ2 4.33Å; I378-W416 HydrophobicContact CG2-CZ3 4.19Å; L404-W416 HydrophobicContact CB-CH2 4.47Å; V409-W416 HydrophobicContact CG1-CZ2 4.03Å; V409-W416 PolarHBondContact O-NE1 2.85Å; L410-W416 HydrophobicContact CD2-CZ2 4.12Å; L412-W416 PolarHBondContact O-N 2.96Å; H414-W416 PolarHBondContact O-N 3.1Å; W416-L419 HydrophobicContact CE3-CD2 3.7Å; W416-L419 HydrophobicContact CZ3-CD2 3.64Å; W416-L419 PolarHBondContact O-N 2.86Å; W416-E420 PolarHBondContact O-N 3.27Å; W416-F427 HydrophobicContact CE3-CE2 4.47Å; W416-F430 HydrophobicContact CH2-CD1 4.08Å; W416-F430 HydrophobicContact CH2-CD2 4.29Å; W416-F430 AromaticContact CH2-CE1 3.69Å; W416-F430 HydrophobicContact CH2-CE1 3.69Å; W416-F430 AromaticContact CH2-CE2 3.93Å; W416-F430 HydrophobicContact CH2-CE2 3.93Å; W416-F430 HydrophobicContact CH2-CG 4.36Å; W416-F430 AromaticContact CH2-CZ 3.6Å; W416-F430 HydrophobicContact CH2-CZ 3.6Å; W416-F430 HydrophobicContact CZ2-CZ 4.47Å; W416-F430 AromaticContact CZ3-CD1 3.73Å; W416-F430 HydrophobicContact CZ3-CD1 3.73Å; W416-F430 AromaticContact CZ3-CE1 3.64Å; W416-F430 HydrophobicContact CZ3-CE1 3.64Å; W416-F430 HydrophobicContact CZ3-CG 4.21Å; W416-F430 HydrophobicContact CZ3-CZ 4.07Å
417	N	87	Confident	88.9	Confident	76 Å²	76	50.6 Å²	50.6	41%	0.406	23%	0.229	S	C	.	.	H	α-helix	trans	-68.7	-42	174.3	-79.3	-9.1	0	0	0	112.3	W413 H414 L419 E420 Y421	W413-N417 VanDerWaalsContact CE3-ND2 3.32Å; W413-N417 WeakPolarHBondContact CZ3-ND2 3.43Å; W413-N417 WeakPolarHBondContact O-CB 3.49Å; W413-N417 PolarHBondContact O-N 3.36Å; H414-N417 PolarHBondContact O-N 3.09Å; N417-L419 VanDerWaalsContact C-N 3.26Å; N417-L419 PolarHBondContact O-N 3.34Å; N417-E420 PolarHBondContact O-N 3.5Å; N417-Y421 WeakPolarHBondContact O-CB 3.26Å; N417-Y421 PolarHBondContact O-N 3.49Å
418	V	87.9	Confident	89.1	Confident	21 Å²	21	51.9 Å²	51.9	13%	0.127	23%	0.232	C	C	.	.	H	α-helix	trans	-61.1	-39.5	175.1	175.7	0	0	0	0	110.1	T375 H414 S415 H422 Y423	T375-V418 HydrophobicContact CG2-CB 4.36Å; T375-V418 HydrophobicContact CG2-CG1 4.01Å; H414-V418 WeakPolarHBondContact O-CG2 3.44Å; H414-V418 PolarHBondContact O-N 3.13Å; S415-V418 PolarHBondContact O-N 3.04Å; V418-H422 WeakPolarHBondContact O-CB 3.36Å; V418-H422 PolarHBondContact O-N 2.85Å; V418-Y423 HydrophobicContact CG1-CD2 4.48Å; V418-Y423 HydrophobicContact CG1-CE2 4.23Å
419	L	89.7	Confident	89.2	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.3	-48.5	173.3	178.5	53.9	0	0	0	113.3	T375 I378 I379 I382 S415 W416 N417 Y421 Y423 H424 H426 F427	T375-L419 HydrophobicContact CG2-CB 4.09Å; I378-L419 HydrophobicContact CG2-CD2 3.58Å; I379-L419 HydrophobicContact CD1-CD1 4.17Å; I379-L419 HydrophobicContact CG1-CD1 3.77Å; I382-L419 HydrophobicContact CD1-CD2 3.8Å; S415-L419 PolarHBondContact O-N 2.84Å; S415-L419 VanDerWaalsContact O-N 3.13Å; W416-L419 HydrophobicContact CE3-CD2 3.7Å; W416-L419 HydrophobicContact CZ3-CD2 3.64Å; W416-L419 PolarHBondContact O-N 2.86Å; N417-L419 VanDerWaalsContact C-N 3.26Å; N417-L419 PolarHBondContact O-N 3.34Å; L419-Y421 PolarHBondContact O-N 3.36Å; L419-Y423 CarbonylContact O-C 3.12Å; L419-Y423 WeakPolarHBondContact O-CA 3.41Å; L419-Y423 PolarHBondContact O-N 3.35Å; L419-Y423 VanDerWaalsContact O-N 3.15Å; L419-H424 PolarHBondContact O-N 3.5Å; L419-H426 HydrophobicContact CD1-CB 3.83Å; L419-F427 HydrophobicContact CD1-CB 4.36Å; L419-F427 HydrophobicContact CD2-CD2 4.45Å; L419-F427 HydrophobicContact CG-CB 4.13Å; L419-F427 HydrophobicContact CG-CD2 4.13Å
420	E	89.6	Confident	89.5	Confident	50 Å²	50	53.4 Å²	53.4	23%	0.234	24%	0.239	C	C	.	.	H	α-helix	trans	-65.8	-35	-179.6	-178.7	161.6	-154.8	0	0	112.7	W416 N417 H424 F427	W416-E420 PolarHBondContact O-N 3.27Å; N417-E420 PolarHBondContact O-N 3.5Å; E420-H424 PolarHBondContact O-ND1 3.39Å; E420-F427 HydrophobicContact CB-CD1 4.02Å; E420-F427 HydrophobicContact CB-CD2 3.97Å; E420-F427 HydrophobicContact CB-CE1 3.87Å; E420-F427 HydrophobicContact CB-CE2 3.82Å; E420-F427 HydrophobicContact CB-CG 4.05Å; E420-F427 HydrophobicContact CB-CZ 3.75Å; E420-F427 HydrophobicContact CG-CD1 3.76Å; E420-F427 HydrophobicContact CG-CE1 3.39Å; E420-F427 HydrophobicContact CG-CE2 4.26Å; E420-F427 HydrophobicContact CG-CG 4.31Å; E420-F427 HydrophobicContact CG-CZ 3.67Å; E420-F427 WeakPolarHBondContact OE1-CE1 3.34Å; E420-F427 WeakPolarHBondContact OE1-CZ 3.26Å; E420-F427 WeakPolarHBondContact OE2-CZ 3.3Å
421	Y	86.9	Confident	89.7	Confident	190 Å²	190	53.7 Å²	53.7	75%	0.745	24%	0.238	S	C	*	.	H	α-helix	trans	-88.9	-49.4	-175.4	-172.5	-100.7	0	0	0	114.1	N417 L419	N417-Y421 WeakPolarHBondContact O-CB 3.26Å; N417-Y421 PolarHBondContact O-N 3.49Å; L419-Y421 PolarHBondContact O-N 3.36Å
422	H	86.7	Confident	90	Very high	94 Å²	94	55.2 Å²	55.2	44%	0.435	25%	0.245	S	C	.	.	H	α-helix	trans	-90.3	-33.8	-177	-67.3	-84.4	0	0	0	113.3	P327 V418	P327-H422 HydrophobicContact CG-CB 4.14Å; V418-H422 WeakPolarHBondContact O-CB 3.36Å; V418-H422 PolarHBondContact O-N 2.85Å
423	Y	89	Confident	90.4	Very high	32 Å²	32	55.2 Å²	55.2	13%	0.125	25%	0.245	C	C	.	.			trans	-118.1	40.4	-170.5	-58.1	-80.9	0	0	0	112	L324 V325 P327 T375 I379 V418 L419 E425 H426 F427	L324-Y423 HydrophobicContact CD1-CE2 3.86Å; L324-Y423 HydrophobicContact CD2-CE1 4.33Å; V325-Y423 PolarHBondContact O-OH 2.74Å; P327-Y423 WeakPolarHBondContact CD-OH 3.41Å; P327-Y423 HydrophobicContact CG-CE1 4.26Å; T375-Y423 HydrophobicContact CG2-CD2 4.13Å; T375-Y423 HydrophobicContact CG2-CE2 4.4Å; I379-Y423 HydrophobicContact CD1-CD1 3.83Å; I379-Y423 HydrophobicContact CD1-CD2 3.76Å; I379-Y423 HydrophobicContact CD1-CE1 4.39Å; I379-Y423 HydrophobicContact CD1-CE2 4.33Å; I379-Y423 HydrophobicContact CD1-CG 3.48Å; I379-Y423 VanDerWaalsContact CD1-CG 3.48Å; V418-Y423 HydrophobicContact CG1-CD2 4.48Å; V418-Y423 HydrophobicContact CG1-CE2 4.23Å; L419-Y423 CarbonylContact O-C 3.12Å; L419-Y423 WeakPolarHBondContact O-CA 3.41Å; L419-Y423 PolarHBondContact O-N 3.35Å; L419-Y423 VanDerWaalsContact O-N 3.15Å; Y423-E425 PolarHBondContact O-N 2.85Å; Y423-H426 WeakPolarHBondContact O-CB 2.73Å; Y423-H426 PolarHBondContact O-N 3.45Å; Y423-F427 PolarHBondContact O-N 2.9Å
424	H	89.3	Confident	90.8	Very high	94 Å²	94	51.3 Å²	51.3	44%	0.435	23%	0.232	S	C	.	.	H	α-helix	trans	-49.9	-34.6	-170.4	-164.5	80.8	0	0	0	115.1	L419 E420 H426 F427 M428	L419-H424 PolarHBondContact O-N 3.5Å; E420-H424 PolarHBondContact O-ND1 3.39Å; H424-H426 PolarHBondContact O-N 3.27Å; H424-F427 WeakPolarHBondContact O-CB 3.42Å; H424-F427 PolarHBondContact O-N 3.49Å; H424-M428 VanDerWaalsContact NE2-CE 3.27Å; H424-M428 WeakPolarHBondContact NE2-CE 3.28Å; H424-M428 WeakPolarHBondContact O-CG 3.5Å; H424-M428 PolarHBondContact O-N 2.92Å
425	E	91.1	Very high	91.3	Very high	125 Å²	125	49.1 Å²	49.1	58%	0.584	22%	0.224	S	C	*	.	H	α-helix	trans	-60	-45.2	174.2	-168.2	-163.5	128.4	0	0	111.9	Y423 M428 K429	Y423-E425 PolarHBondContact O-N 2.85Å; E425-M428 CarbonylContact O-C 3.33Å; E425-M428 PolarHBondContact O-N 3.06Å; E425-M428 VanDerWaalsContact O-N 3.13Å; E425-K429 WeakPolarHBondContact O-CG 3.49Å; E425-K429 PolarHBondContact O-N 3.02Å; E425-K429 WeakPolarHBondContact OE1-CE 3.38Å; E425-K429 IonicContact OE1-NZ 3.53Å; E425-K429 PolarHBondContact OE1-NZ 3.15Å
426	H	92.7	Very high	91.5	Very high	35 Å²	35	49.1 Å²	49.1	16%	0.162	22%	0.224	C	C	.	.	H	α-helix	trans	-69.4	-36	179.7	-58.8	82.7	0	0	0	111.2	I379 D383 L419 Y423 H424 M428 K429 F430	I379-H426 HydrophobicContact CG1-CB 4.22Å; D383-H426 IonicContact OD1-CD2 2.59Å; D383-H426 IonicContact OD2-CD2 2.67Å; D383-H426 PolarHBondContact OD2-CD2 3.22Å; D383-H426 IonicContact OD2-NE2 3.91Å; D383-H426 PolarHBondContact OD2-NE2 3.48Å; L419-H426 HydrophobicContact CD1-CB 3.83Å; Y423-H426 WeakPolarHBondContact O-CB 2.73Å; Y423-H426 PolarHBondContact O-N 3.45Å; H424-H426 PolarHBondContact O-N 3.27Å; H426-M428 VanDerWaalsContact C-N 3.28Å; H426-M428 PolarHBondContact O-N 3.49Å; H426-K429 PolarHBondContact CD2-NZ 2.94Å; H426-K429 PolarHBondContact NE2-NZ 2.98Å; H426-K429 WeakPolarHBondContact O-CB 3.23Å; H426-K429 PolarHBondContact O-N 2.88Å; H426-F430 WeakPolarHBondContact O-CB 3.46Å; H426-F430 PolarHBondContact O-N 3.25Å
427	F	92.8	Very high	91.6	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.009	22%	0.221	C	C	.	.	H	α-helix	trans	-60.9	-37.2	170.1	-171.9	-111.3	0	0	0	112.5	W416 L419 E420 Y423 H424 F430 K431 F764	W416-F427 HydrophobicContact CE3-CE2 4.47Å; L419-F427 HydrophobicContact CD1-CB 4.36Å; L419-F427 HydrophobicContact CD2-CD2 4.45Å; L419-F427 HydrophobicContact CG-CB 4.13Å; L419-F427 HydrophobicContact CG-CD2 4.13Å; E420-F427 HydrophobicContact CB-CD1 4.02Å; E420-F427 HydrophobicContact CB-CD2 3.97Å; E420-F427 HydrophobicContact CB-CE1 3.87Å; E420-F427 HydrophobicContact CB-CE2 3.82Å; E420-F427 HydrophobicContact CB-CG 4.05Å; E420-F427 HydrophobicContact CB-CZ 3.75Å; E420-F427 HydrophobicContact CG-CD1 3.76Å; E420-F427 HydrophobicContact CG-CE1 3.39Å; E420-F427 HydrophobicContact CG-CE2 4.26Å; E420-F427 HydrophobicContact CG-CG 4.31Å; E420-F427 HydrophobicContact CG-CZ 3.67Å; E420-F427 WeakPolarHBondContact OE1-CE1 3.34Å; E420-F427 WeakPolarHBondContact OE1-CZ 3.26Å; E420-F427 WeakPolarHBondContact OE2-CZ 3.3Å; Y423-F427 PolarHBondContact O-N 2.9Å; H424-F427 WeakPolarHBondContact O-CB 3.42Å; H424-F427 PolarHBondContact O-N 3.49Å; F427-F430 PolarHBondContact O-N 3.25Å; F427-K431 HydrophobicContact CD1-CD 4.37Å; F427-K431 HydrophobicContact CE1-CD 4.03Å; F427-K431 VanDerWaalsContact CZ-CE 3.45Å; F427-K431 PolarHBondContact O-N 2.92Å; F427-F764 HydrophobicContact CE2-CE1 4.47Å; F427-F764 HydrophobicContact CE2-CE2 4.44Å; F427-F764 AromaticContact CE2-CZ 3.64Å; F427-F764 HydrophobicContact CE2-CZ 3.64Å; F427-F764 HydrophobicContact CZ-CE1 4.37Å; F427-F764 HydrophobicContact CZ-CE2 4.26Å; F427-F764 AromaticContact CZ-CZ 3.63Å; F427-F764 HydrophobicContact CZ-CZ 3.63Å
428	M	93.6	Very high	91.7	Very high	82 Å²	82	45.3 Å²	45.3	40%	0.404	21%	0.207	S	C	.	.	H	α-helix	trans	-76.6	-35.1	174.3	-68.3	-60.1	174.4	0	0	113.2	H424 E425 H426 F430 K431 Y432	H424-M428 VanDerWaalsContact NE2-CE 3.27Å; H424-M428 WeakPolarHBondContact NE2-CE 3.28Å; H424-M428 WeakPolarHBondContact O-CG 3.5Å; H424-M428 PolarHBondContact O-N 2.92Å; E425-M428 CarbonylContact O-C 3.33Å; E425-M428 PolarHBondContact O-N 3.06Å; E425-M428 VanDerWaalsContact O-N 3.13Å; H426-M428 VanDerWaalsContact C-N 3.28Å; H426-M428 PolarHBondContact O-N 3.49Å; M428-F430 VanDerWaalsContact C-N 3.3Å; M428-F430 PolarHBondContact O-N 3.15Å; M428-K431 PolarHBondContact O-N 3.29Å; M428-K431 HydrophobicContact SD-CD 4.15Å; M428-Y432 VanDerWaalsContact O-CB 3.28Å; M428-Y432 WeakPolarHBondContact O-CB 3.32Å; M428-Y432 PolarHBondContact O-N 2.63Å
429	K	94.6	Very high	91.7	Very high	33 Å²	33	47 Å²	47	14%	0.143	21%	0.213	C	C	.	.	H	α-helix	trans	-53.8	-49.3	166.2	-69.3	175.4	-171.5	169.4	0	109.6	I382 D383 Y386 E425 H426 Y432 L433	I382-K429 HydrophobicContact CG2-CB 3.63Å; I382-K429 HydrophobicContact CG2-CD 4.25Å; D383-K429 WeakPolarHBondContact OD1-CD 3.29Å; D383-K429 WeakPolarHBondContact OD1-CE 3.38Å; D383-K429 IonicContact OD1-NZ 3.71Å; D383-K429 PolarHBondContact OD1-NZ 2.81Å; D383-K429 IonicContact OD2-NZ 2.71Å; Y386-K429 HydrophobicContact CD2-CG 4.38Å; E425-K429 WeakPolarHBondContact O-CG 3.49Å; E425-K429 PolarHBondContact O-N 3.02Å; E425-K429 WeakPolarHBondContact OE1-CE 3.38Å; E425-K429 IonicContact OE1-NZ 3.53Å; E425-K429 PolarHBondContact OE1-NZ 3.15Å; H426-K429 PolarHBondContact CD2-NZ 2.94Å; H426-K429 PolarHBondContact NE2-NZ 2.98Å; H426-K429 WeakPolarHBondContact O-CB 3.23Å; H426-K429 PolarHBondContact O-N 2.88Å; K429-Y432 PolarHBondContact O-N 2.85Å; K429-L433 WeakPolarHBondContact O-CB 3.28Å; K429-L433 WeakPolarHBondContact O-CG 3.43Å; K429-L433 PolarHBondContact O-N 3.09Å
430	F	96.3	Very high	91.5	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.009	23%	0.232	C	C	.	.	H	α-helix	trans	-60.2	-52.5	177.8	174.7	-109.8	0	0	0	112.8	I382 I401 L404 Q405 W416 H426 F427 M428 Y432 L433 A434 F764	I382-F430 HydrophobicContact CD1-CB 3.79Å; I382-F430 HydrophobicContact CD1-CG 4.37Å; I382-F430 HydrophobicContact CG1-CB 3.99Å; I382-F430 HydrophobicContact CG1-CD2 4.27Å; I382-F430 HydrophobicContact CG1-CG 4.5Å; I382-F430 HydrophobicContact CG2-CB 4.44Å; I401-F430 HydrophobicContact CD1-CD2 3.94Å; I401-F430 HydrophobicContact CD1-CE2 4.09Å; L404-F430 HydrophobicContact CB-CE2 3.88Å; L404-F430 HydrophobicContact CD1-CD2 4.16Å; L404-F430 HydrophobicContact CD1-CE2 4.12Å; Q405-F430 HydrophobicContact CG-CE2 4.38Å; Q405-F430 HydrophobicContact CG-CZ 3.87Å; W416-F430 HydrophobicContact CH2-CD1 4.08Å; W416-F430 HydrophobicContact CH2-CD2 4.29Å; W416-F430 AromaticContact CH2-CE1 3.69Å; W416-F430 HydrophobicContact CH2-CE1 3.69Å; W416-F430 AromaticContact CH2-CE2 3.93Å; W416-F430 HydrophobicContact CH2-CE2 3.93Å; W416-F430 HydrophobicContact CH2-CG 4.36Å; W416-F430 AromaticContact CH2-CZ 3.6Å; W416-F430 HydrophobicContact CH2-CZ 3.6Å; W416-F430 HydrophobicContact CZ2-CZ 4.47Å; W416-F430 AromaticContact CZ3-CD1 3.73Å; W416-F430 HydrophobicContact CZ3-CD1 3.73Å; W416-F430 AromaticContact CZ3-CE1 3.64Å; W416-F430 HydrophobicContact CZ3-CE1 3.64Å; W416-F430 HydrophobicContact CZ3-CG 4.21Å; W416-F430 HydrophobicContact CZ3-CZ 4.07Å; H426-F430 WeakPolarHBondContact O-CB 3.46Å; H426-F430 PolarHBondContact O-N 3.25Å; F427-F430 PolarHBondContact O-N 3.25Å; M428-F430 VanDerWaalsContact C-N 3.3Å; M428-F430 PolarHBondContact O-N 3.15Å; F430-Y432 VanDerWaalsContact C-N 3.28Å; F430-Y432 PolarHBondContact O-N 2.8Å; F430-L433 PolarHBondContact O-N 3.11Å; F430-A434 WeakPolarHBondContact O-CB 3.09Å; F430-A434 PolarHBondContact O-N 2.7Å; F430-F764 HydrophobicContact CD1-CE1 4.35Å; F430-F764 HydrophobicContact CE1-CE1 4.02Å; F430-F764 HydrophobicContact CE1-CZ 4.4Å
431	K	94	Very high	91.4	Very high	48 Å²	48	54 Å²	54	21%	0.209	25%	0.252	C	S	.	.	H	α-helix	trans	-57.1	-41.8	177.4	-79	-176	175.1	-179.1	0	112.1	F427 M428 S435 F764	F427-K431 HydrophobicContact CD1-CD 4.37Å; F427-K431 HydrophobicContact CE1-CD 4.03Å; F427-K431 VanDerWaalsContact CZ-CE 3.45Å; F427-K431 PolarHBondContact O-N 2.92Å; M428-K431 PolarHBondContact O-N 3.29Å; M428-K431 HydrophobicContact SD-CD 4.15Å; K431-S435 PolarHBondContact O-N 2.86Å; K431-S435 VanDerWaalsContact O-N 3.1Å; K431-F764 HydrophobicContact CD-CE1 4.16Å; K431-F764 HydrophobicContact CG-CD1 4.29Å; K431-F764 HydrophobicContact CG-CE1 3.74Å
432	Y	95	Very high	91.5	Very high	95 Å²	95	49.4 Å²	49.4	37%	0.373	24%	0.24	S	C	.	.	H	α-helix	trans	-64.3	-50.6	176.1	173.2	-113.6	0	0	0	112.1	R389 M428 K429 F430 A434 S435 V436	R389-Y432 VanDerWaalsContact NE-CE1 3.26Å; R389-Y432 PolarHBondContact NE-OH 2.99Å; R389-Y432 PolarHBondContact NH2-OH 3.33Å; M428-Y432 VanDerWaalsContact O-CB 3.28Å; M428-Y432 WeakPolarHBondContact O-CB 3.32Å; M428-Y432 PolarHBondContact O-N 2.63Å; K429-Y432 PolarHBondContact O-N 2.85Å; F430-Y432 VanDerWaalsContact C-N 3.28Å; F430-Y432 PolarHBondContact O-N 2.8Å; Y432-A434 VanDerWaalsContact C-N 3.33Å; Y432-A434 PolarHBondContact O-N 3.12Å; Y432-S435 PolarHBondContact O-N 2.73Å; Y432-S435 VanDerWaalsContact O-N 3.14Å; Y432-S435 PolarHBondContact O-OG 3.39Å; Y432-V436 HydrophobicContact CE1-CG2 4.42Å; Y432-V436 HydrophobicContact CE2-CG2 4.13Å; Y432-V436 WeakPolarHBondContact O-CG2 3.41Å; Y432-V436 PolarHBondContact O-N 3.28Å
433	L	95.9	Very high	91.7	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-60.1	-42.2	178.5	-69.6	167.2	0	0	0	111.8	A385 Y386 R389 L397 I401 K429 F430 S435 V436 V437	A385-L433 HydrophobicContact CB-CD1 3.95Å; Y386-L433 HydrophobicContact CD2-CD1 4.43Å; Y386-L433 HydrophobicContact CD2-CD2 4.37Å; R389-L433 HydrophobicContact CB-CD2 3.76Å; R389-L433 HydrophobicContact CG-CD2 4.21Å; L397-L433 HydrophobicContact CD1-CB 4.32Å; L397-L433 HydrophobicContact CD1-CD2 3.89Å; I401-L433 HydrophobicContact CD1-CB 3.73Å; I401-L433 HydrophobicContact CG1-CB 4.34Å; K429-L433 WeakPolarHBondContact O-CB 3.28Å; K429-L433 WeakPolarHBondContact O-CG 3.43Å; K429-L433 PolarHBondContact O-N 3.09Å; F430-L433 PolarHBondContact O-N 3.11Å; L433-S435 VanDerWaalsContact C-N 3.33Å; L433-S435 PolarHBondContact O-N 3.07Å; L433-V436 WeakPolarHBondContact O-CB 3.45Å; L433-V436 PolarHBondContact O-N 3.1Å; L433-V436 VanDerWaalsContact O-N 3.08Å; L433-V437 PolarHBondContact O-N 3.44Å
434	A	94.6	Very high	91.8	Very high	12 Å²	12	46.9 Å²	46.9	10%	0.099	23%	0.23	C	C	.	.	H	α-helix	trans	-57.7	-43.3	174.1	0	0	0	0	0	112.1	I401 F430 Y432 V436 V437 S438	I401-A434 HydrophobicContact CG2-CB 4.24Å; F430-A434 WeakPolarHBondContact O-CB 3.09Å; F430-A434 PolarHBondContact O-N 2.7Å; Y432-A434 VanDerWaalsContact C-N 3.33Å; Y432-A434 PolarHBondContact O-N 3.12Å; A434-V436 VanDerWaalsContact C-N 3.26Å; A434-V436 PolarHBondContact O-N 3.42Å; A434-V437 PolarHBondContact O-N 2.58Å; A434-S438 WeakPolarHBondContact O-CB 3.48Å; A434-S438 PolarHBondContact O-N 3.31Å
435	S	93.1	Very high	91.9	Very high	18 Å²	18	45.7 Å²	45.7	13%	0.126	22%	0.224	C	C	.	.	H	α-helix	trans	-64.5	-26.6	176	81.3	0	0	0	0	113.9	K431 Y432 L433 S438 Q445	K431-S435 PolarHBondContact O-N 2.86Å; K431-S435 VanDerWaalsContact O-N 3.1Å; Y432-S435 PolarHBondContact O-N 2.73Å; Y432-S435 VanDerWaalsContact O-N 3.14Å; Y432-S435 PolarHBondContact O-OG 3.39Å; L433-S435 VanDerWaalsContact C-N 3.33Å; L433-S435 PolarHBondContact O-N 3.07Å; S435-S438 PolarHBondContact O-OG 3.4Å; S435-Q445 WeakPolarHBondContact O-CG 3.3Å; S435-Q445 PolarHBondContact O-NE2 3.14Å
436	V	91.5	Very high	92	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-73.9	-30.5	179.6	172.7	0	0	0	0	112	Y394 Y432 L433 A434	Y394-V436 HydrophobicContact CE1-CG1 4.19Å; Y432-V436 HydrophobicContact CE1-CG2 4.42Å; Y432-V436 HydrophobicContact CE2-CG2 4.13Å; Y432-V436 WeakPolarHBondContact O-CG2 3.41Å; Y432-V436 PolarHBondContact O-N 3.28Å; L433-V436 WeakPolarHBondContact O-CB 3.45Å; L433-V436 PolarHBondContact O-N 3.1Å; L433-V436 VanDerWaalsContact O-N 3.08Å; A434-V436 VanDerWaalsContact C-N 3.26Å; A434-V436 PolarHBondContact O-N 3.42Å
437	V	91.3	Very high	92.1	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.006	20%	0.197	C	C	.	.	H	α-helix	trans	-115.6	11.1	-177.4	-59.3	0	0	0	0	114	L397 K398 I401 L433 A434	L397-V437 HydrophobicContact CD2-CG1 3.81Å; L397-V437 HydrophobicContact CG-CG1 3.91Å; K398-V437 HydrophobicContact CB-CB 4.24Å; K398-V437 HydrophobicContact CB-CG1 4.32Å; K398-V437 HydrophobicContact CB-CG2 4.47Å; K398-V437 HydrophobicContact CD-CB 4.16Å; K398-V437 HydrophobicContact CG-CB 4.16Å; K398-V437 HydrophobicContact CG-CG2 4.3Å; K398-V437 PolarHBondContact NZ-O 2.95Å; I401-V437 HydrophobicContact CB-CG2 4Å; I401-V437 HydrophobicContact CG1-CG2 4.23Å; I401-V437 HydrophobicContact CG2-CG2 3.76Å; L433-V437 PolarHBondContact O-N 3.44Å; A434-V437 PolarHBondContact O-N 2.58Å
438	S	89.6	Confident	92.1	Very high	17 Å²	17	46 Å²	46	12%	0.119	22%	0.222	C	C	.	.			trans	-63.2	164.7	-179	71	0	0	0	0	112.6	A434 S435 D440 Q443	A434-S438 WeakPolarHBondContact O-CB 3.48Å; A434-S438 PolarHBondContact O-N 3.31Å; S435-S438 PolarHBondContact O-OG 3.4Å; S438-D440 VanDerWaalsContact C-N 3.33Å; S438-D440 WeakPolarHBondContact CB-OD2 3.38Å; S438-D440 PolarHBondContact OG-OD2 3.31Å; S438-Q443 WeakPolarHBondContact O-CA 3.46Å; S438-Q443 WeakPolarHBondContact O-CG 3.28Å
439	F	88.2	Confident	92.1	Very high	58 Å²	58	45.2 Å²	45.2	25%	0.254	22%	0.215	S	C	.	.			trans	-85.2	-6.8	178.9	-69	-80.9	0	0	0	113.8	K398 M402 N442 Q443 T815	K398-F439 VanDerWaalsContact NZ-CE1 3.33Å; K398-F439 VanDerWaalsContact NZ-CZ 3.27Å; M402-F439 HydrophobicContact CE-CE2 4.06Å; M402-F439 HydrophobicContact SD-CE2 3.65Å; M402-F439 HydrophobicContact SD-CZ 4.08Å; F439-N442 PolarHBondContact O-N 3.19Å; F439-Q443 HydrophobicContact CD1-CG 3.91Å; F439-Q443 PolarHBondContact O-N 3.08Å; F439-Q443 VanDerWaalsContact O-N 3.16Å; F439-T815 WeakPolarHBondContact CE1-OG1 3.38Å
440	D	84.9	Confident	92	Very high	73 Å²	73	43.9 Å²	43.9	39%	0.39	21%	0.209	S	C	.	.	H	α-helix	trans	-54.9	138.8	-175.3	-45.1	-44.1	0	0	0	112	S438 N442 Q443 E444	S438-D440 VanDerWaalsContact C-N 3.33Å; S438-D440 WeakPolarHBondContact CB-OD2 3.38Å; S438-D440 PolarHBondContact OG-OD2 3.31Å; D440-N442 PolarHBondContact O-N 3.12Å; D440-N442 VanDerWaalsContact O-N 3.17Å; D440-Q443 PolarHBondContact O-N 2.8Å; D440-E444 PolarHBondContact O-N 3.07Å; D440-E444 VanDerWaalsContact O-N 3.17Å
441	N	88.6	Confident	91.8	Very high	123 Å²	123	46.8 Å²	46.8	66%	0.658	22%	0.224	S	C	*	.	H	α-helix	trans	48.1	39.9	-176.5	-65.8	-9.1	0	0	0	113.9	E444	N441-E444 HydrophobicContact CB-CB 3.7Å; N441-E444 HydrophobicContact CB-CG 4.48Å; N441-E444 VanDerWaalsContact CB-OE2 3.26Å; N441-E444 WeakPolarHBondContact CB-OE2 3.35Å; N441-E444 PolarHBondContact ND2-OE2 3.23Å
442	N	89.4	Confident	91.6	Very high	93 Å²	93	51.3 Å²	51.3	50%	0.497	24%	0.244	S	C	.	.	H	α-helix	trans	58.3	53.2	-173.2	-177.6	12.3	0	0	0	111.8	F439 D440 E444 R447	F439-N442 PolarHBondContact O-N 3.19Å; D440-N442 PolarHBondContact O-N 3.12Å; D440-N442 VanDerWaalsContact O-N 3.17Å; N442-E444 VanDerWaalsContact C-N 3.29Å; N442-E444 PolarHBondContact O-N 2.64Å; N442-R447 PolarHBondContact ND2-NH2 3.13Å; N442-R447 VanDerWaalsContact O-CD 3.24Å; N442-R447 WeakPolarHBondContact O-CD 3.4Å; N442-R447 PolarHBondContact O-NE 3.4Å; N442-R447 PolarHBondContact OD1-NE 3.31Å; N442-R447 PolarHBondContact OD1-NH2 3.07Å
443	Q	90.5	Very high	91.4	Very high	9 Å²	9	46.9 Å²	46.9	4%	0.042	23%	0.227	C	C	.	.	H	α-helix	trans	58.4	36.5	178.6	-55.3	179.6	75.7	0	0	113.2	S438 F439 D440 Q445 L446 R447	S438-Q443 WeakPolarHBondContact O-CA 3.46Å; S438-Q443 WeakPolarHBondContact O-CG 3.28Å; F439-Q443 HydrophobicContact CD1-CG 3.91Å; F439-Q443 PolarHBondContact O-N 3.08Å; F439-Q443 VanDerWaalsContact O-N 3.16Å; D440-Q443 PolarHBondContact O-N 2.8Å; Q443-Q445 VanDerWaalsContact C-N 3.29Å; Q443-Q445 PolarHBondContact O-N 2.82Å; Q443-L446 HydrophobicContact CB-CB 4.39Å; Q443-L446 PolarHBondContact O-N 3.05Å; Q443-R447 PolarHBondContact O-N 2.96Å
444	E	91.5	Very high	91.1	Very high	65 Å²	65	47 Å²	47	30%	0.304	23%	0.228	S	C	.	.	H	α-helix	trans	-54	-42.6	-173	-175.2	-173.7	175	0	0	112.8	D440 N441 N442 L446 R447 K448	D440-E444 PolarHBondContact O-N 3.07Å; D440-E444 VanDerWaalsContact O-N 3.17Å; N441-E444 HydrophobicContact CB-CB 3.7Å; N441-E444 HydrophobicContact CB-CG 4.48Å; N441-E444 VanDerWaalsContact CB-OE2 3.26Å; N441-E444 WeakPolarHBondContact CB-OE2 3.35Å; N441-E444 PolarHBondContact ND2-OE2 3.23Å; N442-E444 VanDerWaalsContact C-N 3.29Å; N442-E444 PolarHBondContact O-N 2.64Å; E444-L446 VanDerWaalsContact C-N 3.3Å; E444-L446 PolarHBondContact O-N 3.21Å; E444-R447 PolarHBondContact O-N 2.84Å; E444-K448 HydrophobicContact CG-CD 4.13Å; E444-K448 HydrophobicContact CG-CG 4.45Å; E444-K448 WeakPolarHBondContact O-CB 3.45Å; E444-K448 WeakPolarHBondContact O-CG 3.34Å; E444-K448 PolarHBondContact O-N 3.02Å; E444-K448 WeakPolarHBondContact OE1-CE 3.31Å; E444-K448 IonicContact OE1-NZ 2.81Å; E444-K448 PolarHBondContact OE1-NZ 3.15Å
445	Q	90.9	Very high	90.7	Very high	68 Å²	68	48.5 Å²	48.5	32%	0.318	23%	0.234	S	C	.	.	H	α-helix	trans	-58.2	-39.3	176.6	-80.5	-126.4	47.1	0	0	112.8	S435 Q443 R449	S435-Q445 WeakPolarHBondContact O-CG 3.3Å; S435-Q445 PolarHBondContact O-NE2 3.14Å; Q443-Q445 VanDerWaalsContact C-N 3.29Å; Q443-Q445 PolarHBondContact O-N 2.82Å; Q445-R449 WeakPolarHBondContact O-CG 3.22Å; Q445-R449 PolarHBondContact O-NH1 3.17Å; Q445-R449 VanDerWaalsContact OE1-NH2 3.1Å
446	L	92.7	Very high	90.3	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-78.9	-46.8	179.6	178.5	56	0	0	0	110.6	Y394 Q443 E444 K448 R449 L450 V514	Y394-L446 HydrophobicContact CD1-CD1 3.61Å; Y394-L446 HydrophobicContact CD2-CD1 4.24Å; Y394-L446 HydrophobicContact CE1-CD1 4.32Å; Y394-L446 HydrophobicContact CG-CD1 3.58Å; Q443-L446 HydrophobicContact CB-CB 4.39Å; Q443-L446 PolarHBondContact O-N 3.05Å; E444-L446 VanDerWaalsContact C-N 3.3Å; E444-L446 PolarHBondContact O-N 3.21Å; L446-K448 PolarHBondContact O-N 3.43Å; L446-R449 WeakPolarHBondContact O-CB 3.5Å; L446-R449 PolarHBondContact O-N 3.4Å; L446-L450 HydrophobicContact CD1-CD1 4.19Å; L446-L450 HydrophobicContact CD1-CG 4.12Å; L446-L450 HydrophobicContact CG-CD1 4.14Å; L446-L450 HydrophobicContact CG-CG 4.46Å; L446-L450 WeakPolarHBondContact O-CG 3.38Å; L446-L450 PolarHBondContact O-N 3.12Å; L446-V514 HydrophobicContact CD2-CG2 3.8Å; L446-V514 HydrophobicContact CG-CG2 4.46Å
447	R	95	Very high	90.1	Very high	46 Å²	46	51.4 Å²	51.4	17%	0.174	25%	0.245	C	C	.	.	H	α-helix	trans	-54.2	-51.6	177.7	-69.6	-179.7	-176.2	-91.1	5.5	111.5	N442 Q443 E444 R449 L450 D451 V514 D518	N442-R447 PolarHBondContact ND2-NH2 3.13Å; N442-R447 VanDerWaalsContact O-CD 3.24Å; N442-R447 WeakPolarHBondContact O-CD 3.4Å; N442-R447 PolarHBondContact O-NE 3.4Å; N442-R447 PolarHBondContact OD1-NE 3.31Å; N442-R447 PolarHBondContact OD1-NH2 3.07Å; Q443-R447 PolarHBondContact O-N 2.96Å; E444-R447 PolarHBondContact O-N 2.84Å; R447-R449 PolarHBondContact O-N 3.26Å; R447-R449 VanDerWaalsContact O-N 3.14Å; R447-L450 PolarHBondContact O-N 2.76Å; R447-L450 VanDerWaalsContact O-N 3.11Å; R447-D451 WeakPolarHBondContact O-CB 3.42Å; R447-D451 PolarHBondContact O-N 2.9Å; R447-V514 HydrophobicContact CG-CG1 3.95Å; R447-V514 VanDerWaalsContact CZ-CG1 3.48Å; R447-D518 IonicContact CZ-OD1 3.61Å; R447-D518 IonicContact CZ-OD2 2.72Å; R447-D518 IonicContact NH1-OD1 2.69Å; R447-D518 PolarHBondContact NH1-OD1 3.49Å; R447-D518 IonicContact NH1-OD2 3.31Å; R447-D518 PolarHBondContact NH1-OD2 3.46Å; R447-D518 IonicContact NH2-OD1 3.89Å; R447-D518 PolarHBondContact NH2-OD1 3.01Å; R447-D518 IonicContact NH2-OD2 3.89Å
448	K	93.1	Very high	89.7	Confident	124 Å²	124	51.6 Å²	51.6	54%	0.539	25%	0.245	S	C	.	.	H	α-helix	trans	-55.3	-33.1	176.6	-76.7	179.9	177.5	173.6	0	113.9	E444 L446 K452	E444-K448 HydrophobicContact CG-CD 4.13Å; E444-K448 HydrophobicContact CG-CG 4.45Å; E444-K448 WeakPolarHBondContact O-CB 3.45Å; E444-K448 WeakPolarHBondContact O-CG 3.34Å; E444-K448 PolarHBondContact O-N 3.02Å; E444-K448 WeakPolarHBondContact OE1-CE 3.31Å; E444-K448 IonicContact OE1-NZ 2.81Å; E444-K448 PolarHBondContact OE1-NZ 3.15Å; L446-K448 PolarHBondContact O-N 3.43Å; K448-K452 WeakPolarHBondContact O-CB 3.17Å; K448-K452 PolarHBondContact O-N 2.82Å
449	R	92.6	Very high	89.2	Confident	65 Å²	65	57.3 Å²	57.3	25%	0.245	26%	0.264	C	S	.	.	H	α-helix	trans	-76.1	-43.9	177.7	-72	175.6	175.9	91.1	-5	111.6	Q445 L446 R447 K452 C453	Q445-R449 WeakPolarHBondContact O-CG 3.22Å; Q445-R449 PolarHBondContact O-NH1 3.17Å; Q445-R449 VanDerWaalsContact OE1-NH2 3.1Å; L446-R449 WeakPolarHBondContact O-CB 3.5Å; L446-R449 PolarHBondContact O-N 3.4Å; R447-R449 PolarHBondContact O-N 3.26Å; R447-R449 VanDerWaalsContact O-N 3.14Å; R449-K452 PolarHBondContact O-N 2.85Å; R449-C453 PolarHBondContact O-N 2.98Å; R449-C453 PolarHBondContact O-SG 3.06Å; R449-C453 VanDerWaalsContact O-SG 3.39Å
450	L	94.2	Very high	88.8	Confident	4 Å²	4	58 Å²	58	2%	0.021	27%	0.266	C	S	.	.	H	α-helix	trans	-65	-44.8	176	-63.2	179.9	0	0	0	111.8	Y394 L446 R447 K452 C453 A454 V508 P510 F515 L709	Y394-L450 HydrophobicContact CD2-CD2 3.8Å; Y394-L450 HydrophobicContact CE2-CD2 4.21Å; L446-L450 HydrophobicContact CD1-CD1 4.19Å; L446-L450 HydrophobicContact CD1-CG 4.12Å; L446-L450 HydrophobicContact CG-CD1 4.14Å; L446-L450 HydrophobicContact CG-CG 4.46Å; L446-L450 WeakPolarHBondContact O-CG 3.38Å; L446-L450 PolarHBondContact O-N 3.12Å; R447-L450 PolarHBondContact O-N 2.76Å; R447-L450 VanDerWaalsContact O-N 3.11Å; L450-K452 VanDerWaalsContact C-N 3.28Å; L450-K452 PolarHBondContact O-N 2.94Å; L450-C453 WeakPolarHBondContact O-CB 3.43Å; L450-C453 PolarHBondContact O-N 3.04Å; L450-C453 VanDerWaalsContact O-N 3.09Å; L450-A454 PolarHBondContact O-N 3.37Å; L450-V508 HydrophobicContact CD2-CG2 3.81Å; L450-P510 HydrophobicContact CD1-CB 3.79Å; L450-P510 HydrophobicContact CD2-CB 3.88Å; L450-P510 HydrophobicContact CG-CB 4.5Å; L450-F515 HydrophobicContact CD1-CE2 4.32Å; L450-F515 HydrophobicContact CD1-CZ 4.11Å; L450-L709 HydrophobicContact CB-CD1 4.33Å; L450-L709 HydrophobicContact CD2-CD1 4.45Å
451	D	91.2	Very high	88.6	Confident	63 Å²	63	55.3 Å²	55.3	34%	0.337	25%	0.251	S	S	.	.	H	α-helix	trans	-58.2	-39	174.3	-83.6	-53.6	0	0	0	111.8	R447 C453 A454 N455 R475	R447-D451 WeakPolarHBondContact O-CB 3.42Å; R447-D451 PolarHBondContact O-N 2.9Å; D451-C453 VanDerWaalsContact C-N 3.32Å; D451-C453 PolarHBondContact O-N 2.83Å; D451-A454 PolarHBondContact O-N 2.84Å; D451-N455 VanDerWaalsContact O-CB 3.24Å; D451-N455 WeakPolarHBondContact O-CB 3.48Å; D451-N455 VanDerWaalsContact O-CG 3.25Å; D451-N455 PolarHBondContact O-N 3.35Å; D451-N455 PolarHBondContact O-ND2 3.43Å; D451-R475 IonicContact OD1-NH2 3Å
452	K	90.7	Very high	87.9	Confident	144 Å²	144	53.6 Å²	53.6	63%	0.626	24%	0.238	S	C	*	.	H	α-helix	trans	-63.9	-35.8	176.3	-170.2	171.9	-177.9	175.3	0	112.3	K448 R449 L450 K456	K448-K452 WeakPolarHBondContact O-CB 3.17Å; K448-K452 PolarHBondContact O-N 2.82Å; R449-K452 PolarHBondContact O-N 2.85Å; L450-K452 VanDerWaalsContact C-N 3.28Å; L450-K452 PolarHBondContact O-N 2.94Å; K452-K456 PolarHBondContact O-N 2.88Å; K452-K456 VanDerWaalsContact O-N 3.13Å
453	C	90.7	Very high	87.2	Confident	2 Å²	2	55.7 Å²	55.7	1%	0.014	25%	0.249	C	C	.	.	H	α-helix	trans	-72.8	-45.4	174.3	-59.3	0	0	0	0	112.5	R392 R449 L450 D451 N455 K456 M457 V508 L709 N712	R392-C453 PolarHBondContact NH2-SG 2.93Å; R449-C453 PolarHBondContact O-N 2.98Å; R449-C453 PolarHBondContact O-SG 3.06Å; R449-C453 VanDerWaalsContact O-SG 3.39Å; L450-C453 WeakPolarHBondContact O-CB 3.43Å; L450-C453 PolarHBondContact O-N 3.04Å; L450-C453 VanDerWaalsContact O-N 3.09Å; D451-C453 VanDerWaalsContact C-N 3.32Å; D451-C453 PolarHBondContact O-N 2.83Å; C453-N455 VanDerWaalsContact C-N 3.33Å; C453-N455 PolarHBondContact O-N 2.92Å; C453-K456 PolarHBondContact O-N 3.21Å; C453-M457 PolarHBondContact O-N 3.42Å; C453-V508 HydrophobicContact CB-CG1 3.63Å; C453-L709 HydrophobicContact CB-CD2 3.88Å; C453-N712 PolarHBondContact O-ND2 2.94Å
454	A	88.5	Confident	86.3	Confident	2 Å²	2	59 Å²	59	2%	0.017	27%	0.266	C	S	.	.	H	α-helix	trans	-61.1	-42	177.2	0	0	0	0	0	111.2	L450 D451 M457 Y458 L708 L709	L450-A454 PolarHBondContact O-N 3.37Å; D451-A454 PolarHBondContact O-N 2.84Å; A454-M457 PolarHBondContact O-N 2.91Å; A454-Y458 VanDerWaalsContact O-CB 3.23Å; A454-Y458 WeakPolarHBondContact O-CB 3.16Å; A454-Y458 PolarHBondContact O-N 3.33Å; A454-L708 HydrophobicContact CB-CB 4.11Å; A454-L708 HydrophobicContact CB-CD1 4.36Å; A454-L709 HydrophobicContact CB-CD2 4.45Å
455	N	85.8	Confident	84.9	Confident	44 Å²	44	58.1 Å²	58.1	24%	0.235	26%	0.264	C	S	.	.	H	α-helix	trans	-64.1	-41.6	173.8	-76.8	-52.2	0	0	0	112.9	D451 C453 Y458 W459 R475	D451-N455 VanDerWaalsContact O-CB 3.24Å; D451-N455 WeakPolarHBondContact O-CB 3.48Å; D451-N455 VanDerWaalsContact O-CG 3.25Å; D451-N455 PolarHBondContact O-N 3.35Å; D451-N455 PolarHBondContact O-ND2 3.43Å; C453-N455 VanDerWaalsContact C-N 3.33Å; C453-N455 PolarHBondContact O-N 2.92Å; N455-Y458 WeakPolarHBondContact O-CB 3.24Å; N455-Y458 PolarHBondContact O-N 3.45Å; N455-W459 PolarHBondContact O-N 3.29Å; N455-R475 VanDerWaalsContact OD1-CZ 3.31Å; N455-R475 PolarHBondContact OD1-NH1 2.84Å
456	K	86	Confident	82.8	Confident	76 Å²	76	58.9 Å²	58.9	33%	0.33	27%	0.274	S	S	.	.	H	α-helix	trans	-59.7	-48.7	174.9	-89.4	-160	172.6	-155.3	0	111.2	K452 C453 W459 Y460 S503 Y504	K452-K456 PolarHBondContact O-N 2.88Å; K452-K456 VanDerWaalsContact O-N 3.13Å; C453-K456 PolarHBondContact O-N 3.21Å; K456-W459 PolarHBondContact O-N 2.92Å; K456-Y460 WeakPolarHBondContact O-CB 3.42Å; K456-Y460 PolarHBondContact O-N 3.25Å; K456-S503 PolarHBondContact NZ-O 2.86Å; K456-S503 VanDerWaalsContact NZ-O 3.09Å; K456-Y504 HydrophobicContact CD-CD1 4.06Å
457	M	87	Confident	80.5	Confident	3 Å²	3	61.7 Å²	61.7	2%	0.015	29%	0.289	C	S	.	.	H	α-helix	trans	-67.6	-37	-179.4	-177.2	51.6	62.8	0	0	112.6	C453 A454 W459 Y460 L461 L505 L708 Q711 N712 F715	C453-M457 PolarHBondContact O-N 3.42Å; A454-M457 PolarHBondContact O-N 2.91Å; M457-W459 PolarHBondContact O-N 2.92Å; M457-Y460 HydrophobicContact CE-CD1 4.27Å; M457-Y460 PolarHBondContact O-N 3.32Å; M457-Y460 HydrophobicContact SD-CD1 3.74Å; M457-Y460 HydrophobicContact SD-CG 4.45Å; M457-L461 HydrophobicContact CG-CD1 3.93Å; M457-L461 HydrophobicContact CG-CG 4.28Å; M457-L461 WeakPolarHBondContact O-CG 3.28Å; M457-L461 PolarHBondContact O-N 2.93Å; M457-L461 HydrophobicContact SD-CD1 3.91Å; M457-L461 HydrophobicContact SD-CD2 4.09Å; M457-L461 HydrophobicContact SD-CG 3.7Å; M457-L505 HydrophobicContact CE-CD2 4.26Å; M457-L708 HydrophobicContact CG-CD2 4.23Å; M457-L708 WeakPolarHBondContact CG-O 3.34Å; M457-Q711 HydrophobicContact CG-CB 3.77Å; M457-Q711 HydrophobicContact SD-CB 3.99Å; M457-N712 WeakPolarHBondContact CB-ND2 3.31Å; M457-F715 HydrophobicContact CE-CD2 3.9Å; M457-F715 HydrophobicContact CE-CE2 3.47Å; M457-F715 VanDerWaalsContact CE-CE2 3.47Å; M457-F715 HydrophobicContact CE-CZ 4.37Å
458	Y	81.9	Confident	77.8	Confident	4 Å²	4	65.2 Å²	65.2	2%	0.016	32%	0.319	C	S	.	.	H	α-helix	trans	-52.3	-53.4	172.6	177.5	-86.9	0	0	0	111.6	A454 N455 L461 K462 I473 R475 D478 L708	A454-Y458 VanDerWaalsContact O-CB 3.23Å; A454-Y458 WeakPolarHBondContact O-CB 3.16Å; A454-Y458 PolarHBondContact O-N 3.33Å; N455-Y458 WeakPolarHBondContact O-CB 3.24Å; N455-Y458 PolarHBondContact O-N 3.45Å; Y458-L461 PolarHBondContact O-N 3.25Å; Y458-K462 HydrophobicContact CE1-CD 3.63Å; Y458-K462 VanDerWaalsContact O-CB 3.3Å; Y458-K462 WeakPolarHBondContact O-CB 3.37Å; Y458-K462 PolarHBondContact O-N 2.85Å; Y458-K462 WeakPolarHBondContact OH-CD 3.34Å; Y458-K462 PolarHBondContact OH-NZ 2.94Å; Y458-I473 HydrophobicContact CD2-CG2 3.64Å; Y458-I473 HydrophobicContact CE2-CB 4.2Å; Y458-I473 HydrophobicContact CE2-CG2 3.63Å; Y458-I473 WeakPolarHBondContact CE2-O 3.48Å; Y458-I473 PolarHBondContact OH-O 3.49Å; Y458-R475 HydrophobicContact CD2-CG 3.85Å; Y458-R475 HydrophobicContact CE2-CB 3.97Å; Y458-R475 HydrophobicContact CE2-CG 3.69Å; Y458-D478 PolarHBondContact OH-OD2 3.24Å; Y458-L708 HydrophobicContact CD2-CD1 4.23Å
459	W	79.2	Confident	75	Confident	138 Å²	138	61.4 Å²	61.4	52%	0.523	30%	0.304	S	S	.	.	H	α-helix	trans	-69.6	-36.5	179.3	-72.9	111	0	0	0	112.6	N455 K456 M457 K462 L463	N455-W459 PolarHBondContact O-N 3.29Å; K456-W459 PolarHBondContact O-N 2.92Å; M457-W459 PolarHBondContact O-N 2.92Å; W459-K462 HydrophobicContact CE3-CD 4.32Å; W459-K462 HydrophobicContact CZ3-CD 4.1Å; W459-K462 PolarHBondContact O-N 3.43Å; W459-L463 WeakPolarHBondContact O-CB 3.37Å; W459-L463 WeakPolarHBondContact O-CD1 3.47Å; W459-L463 WeakPolarHBondContact O-CG 3.12Å; W459-L463 PolarHBondContact O-N 3.09Å
460	Y	80.8	Confident	72.4	Confident	73 Å²	73	59.6 Å²	59.6	29%	0.286	30%	0.301	S	S	.	.	H	α-helix	trans	-58.2	-48.1	174.1	177	-95.7	0	0	0	112.1	K456 M457 L463 N464 L505 F715	K456-Y460 WeakPolarHBondContact O-CB 3.42Å; K456-Y460 PolarHBondContact O-N 3.25Å; M457-Y460 HydrophobicContact CE-CD1 4.27Å; M457-Y460 PolarHBondContact O-N 3.32Å; M457-Y460 HydrophobicContact SD-CD1 3.74Å; M457-Y460 HydrophobicContact SD-CG 4.45Å; Y460-L463 PolarHBondContact O-N 3.33Å; Y460-N464 VanDerWaalsContact CD2-ND2 3.25Å; Y460-N464 WeakPolarHBondContact CD2-ND2 3.34Å; Y460-N464 WeakPolarHBondContact CE2-ND2 3.28Å; Y460-N464 VanDerWaalsContact CZ-ND2 3.33Å; Y460-N464 WeakPolarHBondContact O-CB 3.27Å; Y460-N464 PolarHBondContact O-N 2.86Å; Y460-N464 VanDerWaalsContact O-N 3.07Å; Y460-N464 PolarHBondContact O-ND2 3.26Å; Y460-L505 HydrophobicContact CD1-CD2 4.34Å; Y460-L505 HydrophobicContact CD2-CD2 3.86Å; Y460-L505 HydrophobicContact CE1-CD2 4.23Å; Y460-L505 HydrophobicContact CE2-CD1 3.84Å; Y460-L505 HydrophobicContact CE2-CD2 3.72Å; Y460-L505 HydrophobicContact CE2-CG 4.27Å; Y460-L505 HydrophobicContact CG-CD2 4.16Å; Y460-F715 HydrophobicContact CE1-CZ 4.05Å
461	L	79.8	Confident	69.8	Low	16 Å²	16	59.9 Å²	59.9	8%	0.084	31%	0.305	C	S	.	.	H	α-helix	trans	-69	-42.5	178.7	-63.7	170.2	0	0	0	111.7	M457 Y458 L463 N464 N465 I473 L708 Q711	M457-L461 HydrophobicContact CG-CD1 3.93Å; M457-L461 HydrophobicContact CG-CG 4.28Å; M457-L461 WeakPolarHBondContact O-CG 3.28Å; M457-L461 PolarHBondContact O-N 2.93Å; M457-L461 HydrophobicContact SD-CD1 3.91Å; M457-L461 HydrophobicContact SD-CD2 4.09Å; M457-L461 HydrophobicContact SD-CG 3.7Å; Y458-L461 PolarHBondContact O-N 3.25Å; L461-L463 PolarHBondContact O-N 2.87Å; L461-N464 PolarHBondContact O-N 3.27Å; L461-N465 WeakPolarHBondContact O-CB 3.48Å; L461-N465 PolarHBondContact O-N 3.49Å; L461-I473 HydrophobicContact CB-CD1 3.34Å; L461-I473 HydrophobicContact CD1-CD1 4.01Å; L461-I473 HydrophobicContact CG-CD1 4.3Å; L461-L708 HydrophobicContact CD1-CD2 4.02Å; L461-Q711 HydrophobicContact CD1-CB 4.34Å; L461-Q711 HydrophobicContact CD1-CG 4.17Å
462	K	75.2	Confident	67.5	Low	87 Å²	87	60.8 Å²	60.8	38%	0.378	31%	0.31	S	S	.	.	H	α-helix	trans	-64.7	-22.2	177.9	-165.3	170.8	-169.8	173.4	0	113.5	Y458 W459 D478	Y458-K462 HydrophobicContact CE1-CD 3.63Å; Y458-K462 VanDerWaalsContact O-CB 3.3Å; Y458-K462 WeakPolarHBondContact O-CB 3.37Å; Y458-K462 PolarHBondContact O-N 2.85Å; Y458-K462 WeakPolarHBondContact OH-CD 3.34Å; Y458-K462 PolarHBondContact OH-NZ 2.94Å; W459-K462 HydrophobicContact CE3-CD 4.32Å; W459-K462 HydrophobicContact CZ3-CD 4.1Å; W459-K462 PolarHBondContact O-N 3.43Å; K462-D478 IonicContact NZ-OD2 3.49Å; K462-D478 PolarHBondContact NZ-OD2 3.07Å
463	L	74.9	Confident	65.4	Low	137 Å²	137	56.2 Å²	56.2	72%	0.717	29%	0.291	S	S	*	.	H	α-helix	trans	-90.7	-30.1	174.3	-71	169	0	0	0	113.4	W459 Y460 L461	W459-L463 WeakPolarHBondContact O-CB 3.37Å; W459-L463 WeakPolarHBondContact O-CD1 3.47Å; W459-L463 WeakPolarHBondContact O-CG 3.12Å; W459-L463 PolarHBondContact O-N 3.09Å; Y460-L463 PolarHBondContact O-N 3.33Å; L461-L463 PolarHBondContact O-N 2.87Å
464	N	70.3	Confident	63.1	Low	78 Å²	78	57 Å²	57	42%	0.417	30%	0.297	S	S	.	.	H	α-helix	trans	-99.3	-14.6	-173.6	-71.4	-41.8	0	0	0	114.9	Y460 L461 P466	Y460-N464 VanDerWaalsContact CD2-ND2 3.25Å; Y460-N464 WeakPolarHBondContact CD2-ND2 3.34Å; Y460-N464 WeakPolarHBondContact CE2-ND2 3.28Å; Y460-N464 VanDerWaalsContact CZ-ND2 3.33Å; Y460-N464 WeakPolarHBondContact O-CB 3.27Å; Y460-N464 PolarHBondContact O-N 2.86Å; Y460-N464 VanDerWaalsContact O-N 3.07Å; Y460-N464 PolarHBondContact O-ND2 3.26Å; L461-N464 PolarHBondContact O-N 3.27Å; N464-P466 VanDerWaalsContact O-CD 3.27Å; N464-P466 WeakPolarHBondContact O-CD 3.19Å
465	N	62	Low	60.7	Low	47 Å²	47	59.9 Å²	59.9	25%	0.251	31%	0.307	S	S	.	.			trans	-106.7	98.5	176	-165.7	-20	0	0	0	111.1	L461 N467 C470	L461-N465 WeakPolarHBondContact O-CB 3.48Å; L461-N465 PolarHBondContact O-N 3.49Å; N465-N467 PolarHBondContact OD1-N 3.28Å; N465-C470 PolarHBondContact ND2-SG 3.26Å
466	P	47	Very low	58.2	Low	83 Å²	83	58.3 Å²	58.3	54%	0.539	30%	0.3	S	S	.	.			trans	-89.3	7.5	-177.1	37.7	-38.5	0	0	0	114	N464 P468	N464-P466 VanDerWaalsContact O-CD 3.27Å; N464-P466 WeakPolarHBondContact O-CD 3.19Å; P466-P468 WeakPolarHBondContact O-CD 3.17Å
467	N	44.9	Very low	55.7	Low	59 Å²	59	57.6 Å²	57.6	32%	0.316	31%	0.314	S	S	.	.			trans	-72.1	124.2	-176.2	-85.9	4.2	0	0	0	110.9	Y185 N465 L469 C470	Y185-N467 PolarHBondContact OH-ND2 3.26Å; N465-N467 PolarHBondContact OD1-N 3.28Å; N467-L469 PolarHBondContact O-N 3Å; N467-C470 HydrophobicContact CB-CB 3.85Å; N467-C470 VanDerWaalsContact O-CB 3.29Å; N467-C470 WeakPolarHBondContact O-CB 3.41Å; N467-C470 PolarHBondContact O-N 3.36Å
468	P	37.2	Very low	53.2	Low	121 Å²	121	62 Å²	62	79%	0.786	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-14.9	173.2	29.9	-35.7	0	0	0	112.9	P466	P466-P468 WeakPolarHBondContact O-CD 3.17Å
469	L	34.8	Very low	50.9	Low	43 Å²	43	65.7 Å²	65.7	23%	0.225	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	3.4	169.8	-67.8	171.4	0	0	0	112.9	Y95 Q102 Y185 N467 G471	Y95-L469 HydrophobicContact CD2-CD2 4.34Å; Q102-L469 PolarHBondContact NE2-O 2.96Å; Y185-L469 HydrophobicContact CD1-CD1 3.53Å; Y185-L469 HydrophobicContact CE1-CB 4.47Å; Y185-L469 HydrophobicContact CE1-CD1 3.7Å; N467-L469 PolarHBondContact O-N 3Å; L469-G471 PolarHBondContact O-N 2.95Å
470	C	37.8	Very low	48.4	Very low	28 Å²	28	63.2 Å²	63.2	19%	0.189	36%	0.361	C	S	.	.	S	Bend	trans	-74.5	107.7	156.5	-176.2	0	0	0	0	106.1	N465 N467 D472	N465-C470 PolarHBondContact ND2-SG 3.26Å; N467-C470 HydrophobicContact CB-CB 3.85Å; N467-C470 VanDerWaalsContact O-CB 3.29Å; N467-C470 WeakPolarHBondContact O-CB 3.41Å; N467-C470 PolarHBondContact O-N 3.36Å; C470-D472 PolarHBondContact O-N 2.64Å
471	G	40	Very low	46	Very low	10 Å²	10	67.3 Å²	67.3	10%	0.103	38%	0.382	C	S	.	.			trans	-57.8	134	179.5	0	0	0	0	0	110	Y95 L469 I473	Y95-G471 WeakPolarHBondContact OH-CA 3.48Å; L469-G471 PolarHBondContact O-N 2.95Å; G471-I473 PolarHBondContact O-N 3.07Å
472	D	43.4	Very low	43.4	Very low	82 Å²	82	75.6 Å²	75.6	44%	0.439	42%	0.418	S	S	.	.			trans	-38.8	126.6	-173.1	-81.6	-57.7	0	0	0	110.5	T45 N49 C470 S474	T45-D472 WeakPolarHBondContact CG2-OD2 3.33Å; T45-D472 PolarHBondContact OG1-OD2 3.26Å; N49-D472 PolarHBondContact ND2-O 3.26Å; N49-D472 VanDerWaalsContact ND2-O 3.09Å; C470-D472 PolarHBondContact O-N 2.64Å; D472-S474 WeakPolarHBondContact O-CB 3.28Å; D472-S474 PolarHBondContact O-N 2.85Å
473	I	46.5	Very low	41.2	Very low	47 Å²	47	79.5 Å²	79.5	24%	0.241	44%	0.437	C	S	.	.			trans	-68.3	82	157.9	-52.5	179.6	0	0	0	104.5	Y458 L461 G471 R475 L708	Y458-I473 HydrophobicContact CD2-CG2 3.64Å; Y458-I473 HydrophobicContact CE2-CB 4.2Å; Y458-I473 HydrophobicContact CE2-CG2 3.63Å; Y458-I473 WeakPolarHBondContact CE2-O 3.48Å; Y458-I473 PolarHBondContact OH-O 3.49Å; L461-I473 HydrophobicContact CB-CD1 3.34Å; L461-I473 HydrophobicContact CD1-CD1 4.01Å; L461-I473 HydrophobicContact CG-CD1 4.3Å; G471-I473 PolarHBondContact O-N 3.07Å; I473-R475 PolarHBondContact O-N 3.36Å; I473-L708 HydrophobicContact CG2-CD2 4.37Å
474	S	42.3	Very low	38.9	Very low	19 Å²	19	80 Å²	80	13%	0.133	44%	0.441	C	S	.	.			trans	-100	90.5	-164.6	-147.4	0	0	0	0	106.8	V46 D472 P476	V46-S474 WeakPolarHBondContact CG2-OG 3.48Å; D472-S474 WeakPolarHBondContact O-CB 3.28Å; D472-S474 PolarHBondContact O-N 2.85Å; S474-P476 WeakPolarHBondContact O-CD 3.46Å; S474-P476 WeakPolarHBondContact O-CG 3.33Å; S474-P476 VanDerWaalsContact O-N 3.15Å
475	R	37.2	Very low	37	Very low	62 Å²	62	79.3 Å²	79.3	23%	0.234	44%	0.442	C	S	.	.			trans	-60.2	115.9	164	-95.2	-174.8	156.9	-132.1	-11.4	105.6	D451 N455 Y458 I473 G477 D478 N705	D451-R475 IonicContact OD1-NH2 3Å; N455-R475 VanDerWaalsContact OD1-CZ 3.31Å; N455-R475 PolarHBondContact OD1-NH1 2.84Å; Y458-R475 HydrophobicContact CD2-CG 3.85Å; Y458-R475 HydrophobicContact CE2-CB 3.97Å; Y458-R475 HydrophobicContact CE2-CG 3.69Å; I473-R475 PolarHBondContact O-N 3.36Å; R475-G477 PolarHBondContact O-N 3.42Å; R475-D478 PolarHBondContact O-N 2.88Å; R475-N705 PolarHBondContact NH2-OD1 3.01Å
476	P	33.9	Very low	35.5	Very low	11 Å²	11	82.4 Å²	82.4	7%	0.071	46%	0.459	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	82.1	-171.3	-13.8	29.6	0	0	0	110.3	V46 S474 F700 K701	V46-P476 HydrophobicContact CG1-CB 4.02Å; V46-P476 HydrophobicContact CG1-CG 4.28Å; S474-P476 WeakPolarHBondContact O-CD 3.46Å; S474-P476 WeakPolarHBondContact O-CG 3.33Å; S474-P476 VanDerWaalsContact O-N 3.15Å; P476-F700 HydrophobicContact CG-CD1 4.07Å; P476-F700 HydrophobicContact CG-CE1 3.7Å; P476-K701 HydrophobicContact CB-CG 4.47Å; P476-K701 HydrophobicContact CG-CG 3.93Å; P476-K701 WeakPolarHBondContact O-CE 3.36Å; P476-K701 PolarHBondContact O-NZ 3.45Å
477	G	33.1	Very low	34.9	Very low	61 Å²	61	81.6 Å²	81.6	63%	0.629	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-172.3	-36.1	-166.8	0	0	0	0	0	109.8	R475 I479	R475-G477 PolarHBondContact O-N 3.42Å; G477-I479 PolarHBondContact O-N 2.91Å
478	D	35.5	Very low	34.2	Very low	96 Å²	96	85.1 Å²	85.1	51%	0.513	47%	0.474	S	S	.	.			trans	-70.5	15.9	173.2	-66.5	20.9	0	0	0	113.7	Y458 K462 R475 S480	Y458-D478 PolarHBondContact OH-OD2 3.24Å; K462-D478 IonicContact NZ-OD2 3.49Å; K462-D478 PolarHBondContact NZ-OD2 3.07Å; R475-D478 PolarHBondContact O-N 2.88Å; D478-S480 PolarHBondContact O-N 3.14Å
479	I	32.5	Very low	34.1	Very low	82 Å²	82	88 Å²	88	42%	0.421	47%	0.47	S	S	.	.	S	Bend	trans	-82.4	112.3	171.3	-61.1	180	0	0	0	108.1	V46 G477 Q481	V46-I479 HydrophobicContact CG2-CD1 4.31Å; G477-I479 PolarHBondContact O-N 2.91Å; I479-Q481 PolarHBondContact O-N 3.42Å
480	S	28.1	Very low	34.1	Very low	86 Å²	86	89.7 Å²	89.7	60%	0.601	49%	0.486	S	S	*	.	S	Bend	trans	-49.6	98.7	178.1	37.6	0	0	0	0	113.5	D478	D478-S480 PolarHBondContact O-N 3.14Å
481	Q	29.2	Very low	33.8	Very low	159 Å²	159	96.6 Å²	96.6	74%	0.743	51%	0.508	S	S	*	.	S	Bend	trans	-128.2	3.1	159.7	-65.2	-152.2	-42.9	0	0	113.4	I479	I479-Q481 PolarHBondContact O-N 3.42Å
482	F	26.4	Very low	33.6	Very low	190 Å²	190	105.7 Å²	105.7	83%	0.833	54%	0.539	S	S	*	.			trans	-145	66.7	167.4	-74.6	-71.7	0	0	0	110.7	D484	F482-D484 PolarHBondContact O-N 3.21Å
483	E	27.8	Very low	33.5	Very low	168 Å²	168	106.8 Å²	106.8	79%	0.785	55%	0.549	S	S	*	.			trans	-69.6	79.8	151	-68.4	-175.9	135.9	0	0	107.5
484	D	26.8	Very low	33	Very low	149 Å²	149	112.3 Å²	112.3	80%	0.797	57%	0.571	S	S	*	*	S	Bend	trans	171	72.2	161.6	-92.3	-20.9	0	0	0	110.9	F482	F482-D484 PolarHBondContact O-N 3.21Å
485	S	30	Very low	32.4	Very low	62 Å²	62	121.5 Å²	121.5	43%	0.434	60%	0.604	S	S	.	*	S	Bend	trans	-167.4	-51.4	159.6	-82.7	0	0	0	0	113	A487 K591	S485-A487 PolarHBondContact O-N 3.38Å; S485-K591 PolarHBondContact OG-NZ 2.88Å
486	D	31.1	Very low	32	Very low	112 Å²	112	122 Å²	122	60%	0.599	62%	0.618	S	S	*	*			trans	-94.1	16.8	-155.5	-64.5	-14.6	0	0	0	115.3	E488 Y489	D486-E488 PolarHBondContact O-N 3.32Å; D486-Y489 PolarHBondContact O-N 3.05Å
487	A	34.1	Very low	31.8	Very low	67 Å²	67	125 Å²	125	55%	0.554	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	3.5	179.6	0	0	0	0	0	114.8	S485 R491	S485-A487 PolarHBondContact O-N 3.38Å; A487-R491 PolarHBondContact O-NE 2.92Å; A487-R491 PolarHBondContact O-NH2 3.19Å; A487-R491 VanDerWaalsContact O-NH2 3.14Å
488	E	31.2	Very low	31.6	Very low	132 Å²	132	127.2 Å²	127.2	62%	0.617	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	-37.1	177.7	-163.7	174.8	173.1	0	0	112.5	D486 S490 R491	D486-E488 PolarHBondContact O-N 3.32Å; E488-S490 PolarHBondContact O-N 3.42Å; E488-R491 PolarHBondContact O-N 2.98Å; E488-R491 VanDerWaalsContact O-N 3.15Å
489	Y	33.5	Very low	31.5	Very low	181 Å²	181	126.3 Å²	126.3	71%	0.71	64%	0.641	S	S	*	*	H	α-helix	trans	-67.4	-40	-177.5	-150	-92.2	0	0	0	111.6	D486 R491 R492	D486-Y489 PolarHBondContact O-N 3.05Å; Y489-R491 PolarHBondContact O-N 3.33Å; Y489-R492 PolarHBondContact O-N 3.32Å
490	S	35.2	Very low	31.4	Very low	79 Å²	79	128.5 Å²	128.5	55%	0.552	65%	0.653	S	S	*	*	H	α-helix	trans	-72.3	-2.5	175.7	-59.8	0	0	0	0	114.7	E488	E488-S490 PolarHBondContact O-N 3.42Å
491	R	32.1	Very low	32.2	Very low	173 Å²	173	131.7 Å²	131.7	65%	0.653	66%	0.659	S	S	*	*	H	α-helix	trans	-93.2	-33	171.1	-85.3	-175.1	-87	-176.9	-4.6	112.7	A487 E488 Y489 T493 K494	A487-R491 PolarHBondContact O-NE 2.92Å; A487-R491 PolarHBondContact O-NH2 3.19Å; A487-R491 VanDerWaalsContact O-NH2 3.14Å; E488-R491 PolarHBondContact O-N 2.98Å; E488-R491 VanDerWaalsContact O-N 3.15Å; Y489-R491 PolarHBondContact O-N 3.33Å; R491-T493 PolarHBondContact O-N 2.96Å; R491-K494 PolarHBondContact O-N 3.25Å
492	R	34.7	Very low	33	Very low	202 Å²	202	128.6 Å²	128.6	76%	0.762	66%	0.655	S	S	*	*	H	α-helix	trans	-69.3	-15.1	179.3	-76	-168.6	179.8	-164.4	1	114.8	Y489	Y489-R492 PolarHBondContact O-N 3.32Å
493	T	41.7	Very low	33.9	Very low	104 Å²	104	122.9 Å²	122.9	64%	0.638	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-4.9	179.4	50.9	0	0	0	0	114.6	R491	R491-T493 PolarHBondContact O-N 2.96Å
494	K	36.2	Very low	35	Very low	163 Å²	163	120.3 Å²	120.3	71%	0.709	62%	0.622	S	S	*	*	S	Bend	trans	-89.1	-7.9	-174.5	-77.3	-170.5	172.6	-173.6	0	115.9	R491	R491-K494 PolarHBondContact O-N 3.25Å
495	Y	29.7	Very low	36.6	Very low	212 Å²	212	114.9 Å²	114.9	83%	0.831	59%	0.593	S	S	*	*	S	Bend	trans	-133.8	12	-171.7	-69.2	-70.1	0	0	0	115.6
496	S	28.3	Very low	38.8	Very low	74 Å²	74	114.4 Å²	114.4	52%	0.517	59%	0.59	S	S	.	*	S	Bend	trans	-111.9	101.4	177.7	-63.8	0	0	0	0	111.3
497	T	31.2	Very low	41.4	Very low	73 Å²	73	109.1 Å²	109.1	45%	0.448	56%	0.562	S	S	.	*			trans	50.9	126.4	153	-23.5	0	0	0	0	118.2	P499	T497-P499 WeakPolarHBondContact O-CD 3.26Å; T497-P499 VanDerWaalsContact O-N 3.11Å
498	S	29.1	Very low	44.3	Very low	108 Å²	108	105.9 Å²	105.9	76%	0.755	54%	0.535	S	S	*	.			trans	-52.4	114.8	174.1	50	0	0	0	0	111.7	N500	S498-N500 PolarHBondContact O-N 3.36Å
499	P	32.2	Very low	47.5	Very low	76 Å²	76	99.8 Å²	99.8	49%	0.494	51%	0.507	S	S	.	.			trans	-76	126.7	-171.3	26.9	-32.7	0	0	0	111.8	T497 Q501 Y504	T497-P499 WeakPolarHBondContact O-CD 3.26Å; T497-P499 VanDerWaalsContact O-N 3.11Å; P499-Q501 PolarHBondContact O-N 3.45Å; P499-Y504 HydrophobicContact CB-CD2 4.13Å; P499-Y504 HydrophobicContact CB-CE2 3.46Å; P499-Y504 VanDerWaalsContact CB-CE2 3.46Å
500	N	30.5	Very low	50.5	Low	129 Å²	129	91.3 Å²	91.3	69%	0.69	47%	0.474	S	S	*	.			trans	-56.7	105.2	166.7	-91.7	-11.3	0	0	0	109.3	S498 S502 S503	S498-N500 PolarHBondContact O-N 3.36Å; N500-S502 PolarHBondContact O-N 2.99Å; N500-S502 VanDerWaalsContact O-N 3.16Å; N500-S503 PolarHBondContact O-N 3.43Å; N500-S503 PolarHBondContact O-OG 2.85Å
501	Q	44.9	Very low	53.4	Low	152 Å²	152	88.2 Å²	88.2	71%	0.71	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-58.5	-34.4	-166.7	-64.4	179	-6.5	0	0	112.6	P499 S503 Y504 L505	P499-Q501 PolarHBondContact O-N 3.45Å; Q501-S503 VanDerWaalsContact C-N 3.25Å; Q501-S503 PolarHBondContact O-N 3.44Å; Q501-Y504 PolarHBondContact O-N 3.47Å; Q501-L505 PolarHBondContact O-N 3.37Å
502	S	46.2	Very low	56.4	Low	94 Å²	94	80.4 Å²	80.4	66%	0.657	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-49.7	-40.4	173.6	53.2	0	0	0	0	113.6	N500 Y504 L505	N500-S502 PolarHBondContact O-N 2.99Å; N500-S502 VanDerWaalsContact O-N 3.16Å; S502-Y504 PolarHBondContact O-N 3.47Å; S502-L505 PolarHBondContact O-N 3.47Å
503	S	46.4	Very low	59.2	Low	71 Å²	71	71.4 Å²	71.4	50%	0.497	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-73.8	-8.2	-177.6	70.8	0	0	0	0	114.7	K456 N500 Q501	K456-S503 PolarHBondContact NZ-O 2.86Å; K456-S503 VanDerWaalsContact NZ-O 3.09Å; N500-S503 PolarHBondContact O-N 3.43Å; N500-S503 PolarHBondContact O-OG 2.85Å; Q501-S503 VanDerWaalsContact C-N 3.25Å; Q501-S503 PolarHBondContact O-N 3.44Å
504	Y	49.2	Very low	61.7	Low	113 Å²	113	66.5 Å²	66.5	44%	0.443	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-23.3	177.4	-70.7	-106	0	0	0	112.6	K456 P499 Q501 S502	K456-Y504 HydrophobicContact CD-CD1 4.06Å; P499-Y504 HydrophobicContact CB-CD2 4.13Å; P499-Y504 HydrophobicContact CB-CE2 3.46Å; P499-Y504 VanDerWaalsContact CB-CE2 3.46Å; Q501-Y504 PolarHBondContact O-N 3.47Å; S502-Y504 PolarHBondContact O-N 3.47Å
505	L	62.2	Low	64.6	Low	35 Å²	35	59.5 Å²	59.5	18%	0.183	33%	0.331	C	S	.	.			trans	-112.7	48.8	-167.6	-60.6	176.1	0	0	0	111.9	M457 Y460 Q501 S502 F715	M457-L505 HydrophobicContact CE-CD2 4.26Å; Y460-L505 HydrophobicContact CD1-CD2 4.34Å; Y460-L505 HydrophobicContact CD2-CD2 3.86Å; Y460-L505 HydrophobicContact CE1-CD2 4.23Å; Y460-L505 HydrophobicContact CE2-CD1 3.84Å; Y460-L505 HydrophobicContact CE2-CD2 3.72Å; Y460-L505 HydrophobicContact CE2-CG 4.27Å; Y460-L505 HydrophobicContact CG-CD2 4.16Å; Q501-L505 PolarHBondContact O-N 3.37Å; S502-L505 PolarHBondContact O-N 3.47Å; L505-F715 HydrophobicContact CB-CD1 3.79Å; L505-F715 HydrophobicContact CB-CE1 4.2Å; L505-F715 HydrophobicContact CB-CG 4.15Å; L505-F715 HydrophobicContact CD1-CD1 4.23Å; L505-F715 HydrophobicContact CD1-CE1 3.83Å; L505-F715 HydrophobicContact CD1-CZ 4.49Å; L505-F715 HydrophobicContact CD2-CD1 4.24Å; L505-F715 HydrophobicContact CD2-CD2 4.47Å; L505-F715 HydrophobicContact CD2-CE1 3.93Å; L505-F715 HydrophobicContact CD2-CE2 4.19Å; L505-F715 HydrophobicContact CD2-CZ 3.9Å; L505-F715 HydrophobicContact CG-CD1 4.3Å; L505-F715 HydrophobicContact CG-CE1 4.2Å; L505-F715 WeakPolarHBondContact O-CB 3.08Å
506	S	74.7	Confident	67.7	Low	52 Å²	52	49.7 Å²	49.7	36%	0.364	29%	0.293	S	S	.	.			trans	-99.6	121.9	170.9	172.9	0	0	0	0	109.2	R392	R392-S506 VanDerWaalsContact CD-OG 3.3Å; R392-S506 WeakPolarHBondContact CD-OG 3.34Å; R392-S506 PolarHBondContact NH1-O 2.88Å
507	G	87.2	Confident	70.9	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.01	29%	0.286	C	S	.	.			trans	-56.8	165.4	-175.7	0	0	0	0	0	114.8	R392 N712 Y716	R392-G507 WeakPolarHBondContact CB-O 3.46Å; R392-G507 WeakPolarHBondContact CD-O 3.38Å; G507-N712 VanDerWaalsContact CA-O 3.32Å; G507-N712 WeakPolarHBondContact CA-O 3.16Å; G507-Y716 VanDerWaalsContact C-CZ 3.4Å; G507-Y716 PolarHBondContact O-OH 3.42Å
508	V	94.6	Very high	73.9	Confident	0 Å²	0	47 Å²	47	0%	0	27%	0.274	C	S	.	.			trans	-150.2	139.1	174.3	49.8	0	0	0	0	110.1	R392 Y394 L450 C453 L709 N712 Y716	R392-V508 HydrophobicContact CB-CB 4.35Å; Y394-V508 HydrophobicContact CD2-CG2 3.73Å; Y394-V508 HydrophobicContact CE2-CG2 3.69Å; L450-V508 HydrophobicContact CD2-CG2 3.81Å; C453-V508 HydrophobicContact CB-CG1 3.63Å; V508-L709 HydrophobicContact CG1-CD2 3.64Å; V508-N712 HydrophobicContact CG1-CB 3.47Å; V508-N712 VanDerWaalsContact CG1-CB 3.47Å; V508-Y716 VanDerWaalsContact CA-OH 3.23Å; V508-Y716 WeakPolarHBondContact CA-OH 3.45Å; V508-Y716 PolarHBondContact N-OH 3.11Å
509	I	96.9	Very high	77	Confident	4 Å²	4	41.8 Å²	41.8	2%	0.021	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-115.8	120.6	171	-50.5	176	0	0	0	107.9	T269 D272 Q273 F276 R392 N393 Y394 Y716	T269-I509 HydrophobicContact CG2-CD1 3.89Å; T269-I509 WeakPolarHBondContact O-CD1 3.29Å; D272-I509 HydrophobicContact CB-CD1 3.65Å; D272-I509 HydrophobicContact CB-CG2 4.23Å; Q273-I509 HydrophobicContact CB-CD1 4.03Å; F276-I509 HydrophobicContact CB-CG2 4.33Å; F276-I509 HydrophobicContact CD1-CG2 4.47Å; F276-I509 HydrophobicContact CG-CG2 4.38Å; R392-I509 PolarHBondContact O-N 3.22Å; R392-I509 VanDerWaalsContact O-N 3.15Å; N393-I509 HydrophobicContact CB-CB 4.4Å; N393-I509 HydrophobicContact CB-CD1 4.22Å; Y394-I509 WeakPolarHBondContact CB-O 3.41Å; Y394-I509 PolarHBondContact N-O 3.29Å; I509-Y716 HydrophobicContact CD1-CE2 4.13Å; I509-Y716 HydrophobicContact CG1-CE2 3.66Å; I509-Y716 PolarHBondContact N-OH 2.95Å
510	P	96.7	Very high	80	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.013	23%	0.228	C	C	.	.			trans	-79.5	153.2	178.3	32.2	-33.8	0	0	0	112.2	F276 L450 L512 F515 L709	F276-P510 HydrophobicContact CD2-CG 4.3Å; F276-P510 HydrophobicContact CE1-CG 4.11Å; F276-P510 HydrophobicContact CE2-CG 3.55Å; F276-P510 VanDerWaalsContact CZ-CD 3.41Å; F276-P510 HydrophobicContact CZ-CG 3.45Å; F276-P510 VanDerWaalsContact CZ-CG 3.45Å; L450-P510 HydrophobicContact CD1-CB 3.79Å; L450-P510 HydrophobicContact CD2-CB 3.88Å; L450-P510 HydrophobicContact CG-CB 4.5Å; P510-L512 PolarHBondContact O-N 3.19Å; P510-L512 VanDerWaalsContact O-N 3.13Å; P510-F515 HydrophobicContact CB-CE2 3.76Å; P510-F515 HydrophobicContact CG-CE2 4.07Å; P510-L709 HydrophobicContact CB-CD1 4.14Å; P510-L709 HydrophobicContact CG-CD1 4.15Å
511	Y	96.8	Very high	83	Confident	15 Å²	15	39 Å²	39	6%	0.059	22%	0.22	C	C	.	.			trans	-69	106.3	157.3	173.7	-119.8	0	0	0	109	Y303 K398 G513 V514	Y303-Y511 AromaticContact CD2-CD2 3.99Å; Y303-Y511 HydrophobicContact CD2-CD2 3.99Å; Y303-Y511 AromaticContact CD2-CE2 3.91Å; Y303-Y511 HydrophobicContact CD2-CE2 3.91Å; Y303-Y511 HydrophobicContact CE1-CE2 4.3Å; Y303-Y511 AromaticContact CE2-CD2 3.56Å; Y303-Y511 HydrophobicContact CE2-CD2 3.56Å; Y303-Y511 AromaticContact CE2-CE2 3.38Å; Y303-Y511 HydrophobicContact CE2-CE2 3.38Å; Y303-Y511 AromaticContact CZ-CE2 3.63Å; K398-Y511 HydrophobicContact CB-CD2 4.47Å; K398-Y511 HydrophobicContact CB-CG 4.47Å; K398-Y511 HydrophobicContact CD-CD1 3.62Å; K398-Y511 HydrophobicContact CD-CD2 4.27Å; K398-Y511 HydrophobicContact CD-CE1 3.89Å; K398-Y511 HydrophobicContact CD-CG 3.83Å; Y511-G513 PolarHBondContact O-N 3.1Å; Y511-G513 VanDerWaalsContact O-N 3.12Å; Y511-V514 HydrophobicContact CD1-CG2 3.87Å; Y511-V514 WeakPolarHBondContact O-CG2 3.47Å; Y511-V514 PolarHBondContact O-N 3.24Å
512	L	95.9	Very high	85.3	Confident	9 Å²	9	33.1 Å²	33.1	5%	0.047	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-28.9	-172.4	-175.3	61	0	0	0	113.5	M279 V296 T299 P510 V514 F515 L516	M279-L512 HydrophobicContact CE-CD1 3.91Å; M279-L512 HydrophobicContact SD-CD1 3.85Å; M279-L512 HydrophobicContact SD-CD2 3.58Å; M279-L512 VanDerWaalsContact SD-CD2 3.58Å; M279-L512 HydrophobicContact SD-CG 4.39Å; V296-L512 HydrophobicContact CG1-CD2 4.23Å; T299-L512 HydrophobicContact CG2-CD2 3.9Å; P510-L512 PolarHBondContact O-N 3.19Å; P510-L512 VanDerWaalsContact O-N 3.13Å; L512-V514 PolarHBondContact O-N 3.12Å; L512-V514 VanDerWaalsContact O-N 3.12Å; L512-F515 PolarHBondContact O-N 3.22Å; L512-L516 HydrophobicContact CD1-CG 4.45Å; L512-L516 HydrophobicContact CD2-CD1 3.99Å; L512-L516 HydrophobicContact CG-CD1 3.8Å; L512-L516 HydrophobicContact CG-CD2 4.49Å; L512-L516 HydrophobicContact CG-CG 3.94Å; L512-L516 PolarHBondContact O-N 3.35Å; L512-L516 VanDerWaalsContact O-N 3.13Å
513	G	93.7	Very high	87.5	Confident	13 Å²	13	30.9 Å²	30.9	13%	0.134	17%	0.172	C	C	.	.	H	α-helix	trans	-58.4	-24	178.7	0	0	0	0	0	115	Y511 F515 S517	Y511-G513 PolarHBondContact O-N 3.1Å; Y511-G513 VanDerWaalsContact O-N 3.12Å; G513-F515 VanDerWaalsContact C-N 3.33Å; G513-F515 PolarHBondContact O-N 3.49Å; G513-S517 WeakPolarHBondContact O-CB 3.46Å; G513-S517 PolarHBondContact O-N 2.77Å; G513-S517 VanDerWaalsContact O-N 3.1Å; G513-S517 PolarHBondContact O-OG 2.99Å
514	V	93.9	Very high	89.7	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.006	18%	0.18	C	C	.	.	H	α-helix	trans	-59.4	-46.5	172.1	-176.8	0	0	0	0	110.5	L446 R447 Y511 L512 S517 D518	L446-V514 HydrophobicContact CD2-CG2 3.8Å; L446-V514 HydrophobicContact CG-CG2 4.46Å; R447-V514 HydrophobicContact CG-CG1 3.95Å; R447-V514 VanDerWaalsContact CZ-CG1 3.48Å; Y511-V514 HydrophobicContact CD1-CG2 3.87Å; Y511-V514 WeakPolarHBondContact O-CG2 3.47Å; Y511-V514 PolarHBondContact O-N 3.24Å; L512-V514 PolarHBondContact O-N 3.12Å; L512-V514 VanDerWaalsContact O-N 3.12Å; V514-S517 PolarHBondContact O-OG 3.04Å; V514-D518 VanDerWaalsContact O-CG 3.28Å; V514-D518 PolarHBondContact O-N 2.91Å
515	F	96.1	Very high	91.7	Very high	15 Å²	15	32.1 Å²	32.1	7%	0.066	18%	0.181	C	C	.	.	H	α-helix	trans	-82.4	-34.7	-175.7	-57.7	-59.8	0	0	0	112.7	L450 P510 L512 G513 S517 D518 L519 I702 I706 L709	L450-F515 HydrophobicContact CD1-CE2 4.32Å; L450-F515 HydrophobicContact CD1-CZ 4.11Å; P510-F515 HydrophobicContact CB-CE2 3.76Å; P510-F515 HydrophobicContact CG-CE2 4.07Å; L512-F515 PolarHBondContact O-N 3.22Å; G513-F515 VanDerWaalsContact C-N 3.33Å; G513-F515 PolarHBondContact O-N 3.49Å; F515-S517 VanDerWaalsContact C-N 3.33Å; F515-S517 PolarHBondContact O-N 3.31Å; F515-D518 PolarHBondContact O-N 3.01Å; F515-L519 WeakPolarHBondContact O-CB 3.48Å; F515-L519 WeakPolarHBondContact O-CG 3.46Å; F515-L519 PolarHBondContact O-N 2.92Å; F515-I702 HydrophobicContact CB-CG2 3.76Å; F515-I702 HydrophobicContact CD1-CG2 3.85Å; F515-I702 HydrophobicContact CG-CG2 4.15Å; F515-I706 HydrophobicContact CB-CD1 3.83Å; F515-I706 HydrophobicContact CB-CG1 4.14Å; F515-I706 HydrophobicContact CD1-CG1 4.38Å; F515-I706 HydrophobicContact CD2-CD1 4.23Å; F515-I706 HydrophobicContact CD2-CG1 3.71Å; F515-I706 HydrophobicContact CE2-CG1 4.16Å; F515-I706 HydrophobicContact CG-CD1 4.09Å; F515-I706 HydrophobicContact CG-CG1 3.82Å; F515-L709 HydrophobicContact CE2-CD1 3.78Å; F515-L709 HydrophobicContact CZ-CD1 3.62Å
516	L	96.1	Very high	92.9	Very high	7 Å²	7	31.2 Å²	31.2	4%	0.037	18%	0.178	C	C	.	.	H	α-helix	trans	-66.1	-35.4	176.4	-61.3	176.4	0	0	0	111.8	C284 Y287 V296 I300 L512 T520	C284-L516 HydrophobicContact CB-CD2 4.1Å; Y287-L516 HydrophobicContact CD1-CB 4.4Å; Y287-L516 HydrophobicContact CD1-CD1 3.94Å; Y287-L516 HydrophobicContact CD1-CD2 3.92Å; Y287-L516 HydrophobicContact CD1-CG 4.3Å; Y287-L516 HydrophobicContact CE1-CB 4.31Å; Y287-L516 HydrophobicContact CE1-CD1 3.81Å; Y287-L516 HydrophobicContact CE1-CG 4.44Å; V296-L516 HydrophobicContact CG1-CD1 3.88Å; V296-L516 HydrophobicContact CG1-CD2 4.3Å; I300-L516 HydrophobicContact CD1-CD1 4.17Å; L512-L516 HydrophobicContact CD1-CG 4.45Å; L512-L516 HydrophobicContact CD2-CD1 3.99Å; L512-L516 HydrophobicContact CG-CD1 3.8Å; L512-L516 HydrophobicContact CG-CD2 4.49Å; L512-L516 HydrophobicContact CG-CG 3.94Å; L512-L516 PolarHBondContact O-N 3.35Å; L512-L516 VanDerWaalsContact O-N 3.13Å; L516-T520 VanDerWaalsContact O-CB 3.3Å; L516-T520 WeakPolarHBondContact O-CB 3.24Å; L516-T520 PolarHBondContact O-N 3.3Å; L516-T520 PolarHBondContact O-OG1 2.67Å
517	S	93.9	Very high	93.6	Very high	54 Å²	54	32.5 Å²	32.5	38%	0.378	19%	0.185	S	C	.	.	H	α-helix	trans	-66.6	-43.4	173.6	57.5	0	0	0	0	112	G513 V514 F515 T520 L521	G513-S517 WeakPolarHBondContact O-CB 3.46Å; G513-S517 PolarHBondContact O-N 2.77Å; G513-S517 VanDerWaalsContact O-N 3.1Å; G513-S517 PolarHBondContact O-OG 2.99Å; V514-S517 PolarHBondContact O-OG 3.04Å; F515-S517 VanDerWaalsContact C-N 3.33Å; F515-S517 PolarHBondContact O-N 3.31Å; S517-T520 PolarHBondContact O-N 3.21Å; S517-L521 WeakPolarHBondContact O-CB 3.45Å; S517-L521 PolarHBondContact O-N 2.91Å
518	D	93.9	Very high	93.6	Very high	35 Å²	35	33.9 Å²	33.9	19%	0.187	19%	0.192	C	C	.	.	H	α-helix	trans	-61.4	-44.9	175.3	-64.8	-14.8	0	0	0	112.3	R447 V514 F515 L521 L522 I702	R447-D518 IonicContact CZ-OD1 3.61Å; R447-D518 IonicContact CZ-OD2 2.72Å; R447-D518 IonicContact NH1-OD1 2.69Å; R447-D518 PolarHBondContact NH1-OD1 3.49Å; R447-D518 IonicContact NH1-OD2 3.31Å; R447-D518 PolarHBondContact NH1-OD2 3.46Å; R447-D518 IonicContact NH2-OD1 3.89Å; R447-D518 PolarHBondContact NH2-OD1 3.01Å; R447-D518 IonicContact NH2-OD2 3.89Å; V514-D518 VanDerWaalsContact O-CG 3.28Å; V514-D518 PolarHBondContact O-N 2.91Å; F515-D518 PolarHBondContact O-N 3.01Å; D518-L521 PolarHBondContact O-N 3.18Å; D518-L522 WeakPolarHBondContact O-CB 3.29Å; D518-L522 WeakPolarHBondContact O-CG 3.05Å; D518-L522 PolarHBondContact O-N 3.07Å; D518-I702 HydrophobicContact CB-CD1 3.61Å; D518-I702 HydrophobicContact CB-CG1 4.41Å
519	L	95.5	Very high	93.4	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-65.2	-40.5	177.3	-72.8	172.1	0	0	0	112.1	C284 L285 A288 F515 L522 H523 E699 I702 L703	C284-L519 HydrophobicContact CB-CD1 3.79Å; L285-L519 HydrophobicContact CD2-CD1 4.15Å; L285-L519 HydrophobicContact CD2-CD2 3.64Å; L285-L519 HydrophobicContact CD2-CG 4.46Å; A288-L519 HydrophobicContact CB-CB 3.8Å; F515-L519 WeakPolarHBondContact O-CB 3.48Å; F515-L519 WeakPolarHBondContact O-CG 3.46Å; F515-L519 PolarHBondContact O-N 2.92Å; L519-L522 PolarHBondContact O-N 3.03Å; L519-H523 WeakPolarHBondContact O-CB 3.45Å; L519-H523 PolarHBondContact O-N 3.38Å; L519-E699 HydrophobicContact CD2-CB 4.03Å; L519-E699 HydrophobicContact CD2-CG 4.32Å; L519-I702 HydrophobicContact CD1-CG2 4.19Å; L519-I702 HydrophobicContact CD2-CB 4.01Å; L519-I702 HydrophobicContact CD2-CD1 3.84Å; L519-I702 HydrophobicContact CD2-CG2 4.09Å; L519-I702 HydrophobicContact CG-CB 4.35Å; L519-I702 HydrophobicContact CG-CD1 4.15Å; L519-I702 HydrophobicContact CG-CG2 3.9Å; L519-L703 HydrophobicContact CD1-CD2 4Å
520	T	94.6	Very high	93	Very high	48 Å²	48	38.7 Å²	38.7	29%	0.294	21%	0.213	S	C	.	.	H	α-helix	trans	-65.3	-40.7	176.5	-56.3	0	0	0	0	110.8	L516 S517 H523 H524	L516-T520 VanDerWaalsContact O-CB 3.3Å; L516-T520 WeakPolarHBondContact O-CB 3.24Å; L516-T520 PolarHBondContact O-N 3.3Å; L516-T520 PolarHBondContact O-OG1 2.67Å; S517-T520 PolarHBondContact O-N 3.21Å; T520-H523 PolarHBondContact O-N 3.46Å; T520-H524 PolarHBondContact O-N 3.27Å; T520-H524 PolarHBondContact O-ND1 2.81Å
521	L	93.2	Very high	92.4	Very high	99 Å²	99	40.6 Å²	40.6	52%	0.518	23%	0.226	S	C	.	.	H	α-helix	trans	-67.1	-42.6	175.9	-174	62	0	0	0	111.7	S517 D518 H523 H524 S525 L599	S517-L521 WeakPolarHBondContact O-CB 3.45Å; S517-L521 PolarHBondContact O-N 2.91Å; D518-L521 PolarHBondContact O-N 3.18Å; L521-H523 VanDerWaalsContact C-N 3.29Å; L521-H523 PolarHBondContact O-N 2.87Å; L521-H524 PolarHBondContact O-N 2.83Å; L521-S525 WeakPolarHBondContact O-CB 3.44Å; L521-S525 PolarHBondContact O-N 3.07Å; L521-L599 HydrophobicContact CD2-CD1 3.62Å
522	L	92.9	Very high	91.5	Very high	28 Å²	28	43.1 Å²	43.1	15%	0.147	24%	0.235	C	C	.	.	H	α-helix	trans	-60.4	-38.8	172.6	-78.7	-178.4	0	0	0	112.1	D518 L519 H524 S525 R698 E699 I702	D518-L522 WeakPolarHBondContact O-CB 3.29Å; D518-L522 WeakPolarHBondContact O-CG 3.05Å; D518-L522 PolarHBondContact O-N 3.07Å; L519-L522 PolarHBondContact O-N 3.03Å; L522-H524 VanDerWaalsContact C-N 3.34Å; L522-H524 PolarHBondContact O-N 2.99Å; L522-S525 WeakPolarHBondContact CA-OG 3.18Å; L522-S525 PolarHBondContact O-N 2.93Å; L522-S525 PolarHBondContact O-OG 2.69Å; L522-R698 HydrophobicContact CD1-CB 3.84Å; L522-R698 WeakPolarHBondContact CD1-O 3.41Å; L522-R698 HydrophobicContact CD2-CB 3.96Å; L522-E699 HydrophobicContact CB-CG 4.43Å; L522-E699 HydrophobicContact CD1-CG 4.26Å; L522-I702 HydrophobicContact CD1-CD1 3.51Å; L522-I702 HydrophobicContact CG-CD1 4.47Å
523	H	92.6	Very high	90.3	Very high	47 Å²	47	46.6 Å²	46.6	22%	0.218	26%	0.261	C	S	.	.	H	α-helix	trans	-58.8	-45.6	178.2	179.7	66.1	0	0	0	111.6	R289 L519 T520 L521 D528 K695	R289-H523 WeakPolarHBondContact CG-ND1 3.42Å; R289-H523 PolarHBondContact NE-ND1 3.46Å; L519-H523 WeakPolarHBondContact O-CB 3.45Å; L519-H523 PolarHBondContact O-N 3.38Å; T520-H523 PolarHBondContact O-N 3.46Å; L521-H523 VanDerWaalsContact C-N 3.29Å; L521-H523 PolarHBondContact O-N 2.87Å; H523-D528 IonicContact CE1-OD2 3.39Å; H523-D528 IonicContact ND1-OD1 2.81Å; H523-D528 IonicContact ND1-OD2 3.98Å; H523-K695 PolarHBondContact ND1-NZ 3.42Å; H523-K695 PolarHBondContact O-NZ 3.17Å
524	H	92.3	Very high	89	Confident	142 Å²	142	54 Å²	54	66%	0.657	29%	0.289	S	S	*	.	H	α-helix	trans	-76.4	-27.1	178.2	-64.8	89	0	0	0	113.3	T520 L521 L522 S526	T520-H524 PolarHBondContact O-N 3.27Å; T520-H524 PolarHBondContact O-ND1 2.81Å; L521-H524 PolarHBondContact O-N 2.83Å; L522-H524 VanDerWaalsContact C-N 3.34Å; L522-H524 PolarHBondContact O-N 2.99Å; H524-S526 PolarHBondContact O-N 2.7Å
525	S	91.1	Very high	87.3	Confident	67 Å²	67	57.6 Å²	57.6	47%	0.469	30%	0.303	S	S	.	.	H	α-helix	trans	-67.5	-14.2	-177.6	75.6	0	0	0	0	115.8	L521 L522	L521-S525 WeakPolarHBondContact O-CB 3.44Å; L521-S525 PolarHBondContact O-N 3.07Å; L522-S525 WeakPolarHBondContact CA-OG 3.18Å; L522-S525 PolarHBondContact O-N 2.93Å; L522-S525 PolarHBondContact O-OG 2.69Å
526	S	88.6	Confident	84.5	Confident	17 Å²	17	61 Å²	61	12%	0.119	33%	0.329	C	S	.	.	S	Bend	trans	-164.7	148.2	-176.8	46.6	0	0	0	0	111.1	H524 K695 R698	H524-S526 PolarHBondContact O-N 2.7Å; S526-K695 WeakPolarHBondContact O-CD 3.34Å; S526-K695 VanDerWaalsContact O-CE 3.27Å; S526-K695 WeakPolarHBondContact O-CE 3.47Å; S526-K695 PolarHBondContact O-NZ 2.87Å; S526-K695 WeakPolarHBondContact OG-CD 3.41Å; S526-K695 WeakPolarHBondContact OG-CG 3.44Å; S526-R698 PolarHBondContact OG-NH2 3.28Å
527	P	89.1	Confident	81.7	Confident	78 Å²	78	66.3 Å²	66.3	51%	0.506	36%	0.364	S	S	.	.			trans	-75.9	151.5	180	33.6	-37.2	0	0	0	111.8	Y529 I530 N692	P527-Y529 VanDerWaalsContact C-N 3.27Å; P527-Y529 WeakPolarHBondContact CB-O 3.32Å; P527-Y529 WeakPolarHBondContact CG-O 3.41Å; P527-I530 HydrophobicContact CG-CG1 4.25Å; P527-N692 PolarHBondContact O-ND2 2.79Å
528	D	87.6	Confident	78.6	Confident	31 Å²	31	67.8 Å²	67.8	17%	0.166	37%	0.374	C	S	.	.	S	Bend	trans	-67.6	-28.8	172.8	-71.9	-18.5	0	0	0	112	R289 H523 N692 K695 H696	R289-D528 IonicContact CZ-OD1 3.35Å; R289-D528 IonicContact CZ-OD2 2.88Å; R289-D528 IonicContact NE-OD1 2.88Å; R289-D528 IonicContact NE-OD2 2.84Å; R289-D528 PolarHBondContact NE-OD2 3.4Å; R289-D528 IonicContact NH2-OD1 2.63Å; R289-D528 PolarHBondContact NH2-OD1 2.85Å; R289-D528 IonicContact NH2-OD2 3.53Å; R289-D528 PolarHBondContact NH2-OD2 2.79Å; H523-D528 IonicContact CE1-OD2 3.39Å; H523-D528 IonicContact ND1-OD1 2.81Å; H523-D528 IonicContact ND1-OD2 3.98Å; D528-N692 WeakPolarHBondContact O-CB 3.41Å; D528-N692 PolarHBondContact O-N 3.38Å; D528-K695 WeakPolarHBondContact OD1-CD 3.41Å; D528-K695 WeakPolarHBondContact OD1-CE 3.46Å; D528-K695 IonicContact OD1-NZ 3.75Å; D528-K695 PolarHBondContact OD1-NZ 3.19Å; D528-H696 IonicContact OD1-CE1 2.83Å
529	Y	90	Very high	75.5	Confident	74 Å²	74	70.9 Å²	70.9	29%	0.29	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	148.8	-179.8	-57.3	-91.5	0	0	0	111.4	F58 P527 K689 L690 I691	F58-Y529 HydrophobicContact CB-CE1 4.42Å; F58-Y529 VanDerWaalsContact CB-OH 3.31Å; F58-Y529 WeakPolarHBondContact CB-OH 3.5Å; P527-Y529 VanDerWaalsContact C-N 3.27Å; P527-Y529 WeakPolarHBondContact CB-O 3.32Å; P527-Y529 WeakPolarHBondContact CG-O 3.41Å; Y529-K689 HydrophobicContact CD1-CB 4.21Å; Y529-L690 CarbonylContact C-O 3.52Å; Y529-L690 WeakPolarHBondContact CA-O 3.45Å; Y529-I691 HydrophobicContact CD1-CG1 4.4Å; Y529-I691 HydrophobicContact CE1-CG1 4.1Å
530	I	87.7	Confident	72.5	Confident	31 Å²	31	78.5 Å²	78.5	16%	0.159	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	141.4	174.1	-46.3	167.5	0	0	0	109.9	V25 P527 K534 Y535 L690 N692	V25-I530 HydrophobicContact CG1-CD1 4.35Å; V25-I530 HydrophobicContact CG2-CD1 4.11Å; P527-I530 HydrophobicContact CG-CG1 4.25Å; I530-K534 HydrophobicContact CG2-CB 4.49Å; I530-K534 HydrophobicContact CG2-CD 4.49Å; I530-Y535 HydrophobicContact CB-CD2 4.47Å; I530-Y535 HydrophobicContact CB-CE2 4.08Å; I530-Y535 HydrophobicContact CD1-CE2 3.86Å; I530-Y535 HydrophobicContact CG2-CD2 3.99Å; I530-Y535 HydrophobicContact CG2-CE2 3.69Å; I530-L690 PolarHBondContact N-O 3Å; I530-L690 PolarHBondContact O-N 3.41Å; I530-N692 HydrophobicContact CD1-CB 4.2Å; I530-N692 HydrophobicContact CG1-CB 4.26Å
531	S	84.1	Confident	69.5	Low	42 Å²	42	83.2 Å²	83.2	29%	0.294	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	134.2	-177	-45.2	0	0	0	0	112.6	S533 K534 D688	S531-S533 WeakPolarHBondContact CB-OG 3.37Å; S531-S533 PolarHBondContact O-N 2.72Å; S531-K534 WeakPolarHBondContact O-CB 3.02Å; S531-K534 PolarHBondContact O-N 3.1Å; S531-D688 CarbonylContact C-O 3.29Å; S531-D688 WeakPolarHBondContact CA-O 3.07Å
532	R	78.4	Confident	66.6	Low	67 Å²	67	85.5 Å²	85.5	25%	0.253	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-61.7	-34.5	177.3	-172.1	-177	-75.5	-91.8	-1.5	110.7	E30 K534 Y535 S536 D688 L690	E30-R532 IonicContact OE1-CZ 2.89Å; E30-R532 VanDerWaalsContact OE1-CZ 3.31Å; E30-R532 IonicContact OE1-NH1 3.55Å; E30-R532 PolarHBondContact OE1-NH1 2.89Å; E30-R532 IonicContact OE1-NH2 3.88Å; E30-R532 PolarHBondContact OE1-NH2 3.48Å; E30-R532 IonicContact OE2-CZ 3.07Å; E30-R532 IonicContact OE2-NH1 3.41Å; E30-R532 IonicContact OE2-NH2 3.59Å; E30-R532 PolarHBondContact OE2-NH2 3.15Å; R532-K534 PolarHBondContact O-N 3.15Å; R532-K534 VanDerWaalsContact O-N 3.15Å; R532-Y535 PolarHBondContact O-N 3.04Å; R532-S536 PolarHBondContact O-N 3.35Å; R532-D688 WeakPolarHBondContact CB-OD1 3.36Å; R532-D688 PolarHBondContact N-O 2.91Å; R532-D688 PolarHBondContact N-OD1 2.67Å; R532-L690 HydrophobicContact CB-CD1 4.21Å; R532-L690 HydrophobicContact CB-CD2 4.25Å; R532-L690 HydrophobicContact CB-CG 4.13Å; R532-L690 HydrophobicContact CG-CD1 4.27Å; R532-L690 HydrophobicContact CG-CD2 4.41Å
533	S	70.4	Confident	63.6	Low	83 Å²	83	90.5 Å²	90.5	58%	0.58	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-54.8	-21.8	169	50.7	0	0	0	0	116	S531 D688	S531-S533 WeakPolarHBondContact CB-OG 3.37Å; S531-S533 PolarHBondContact O-N 2.72Å; S533-D688 PolarHBondContact N-OD1 2.8Å
534	K	66.5	Low	60.7	Low	167 Å²	167	96.1 Å²	96.1	73%	0.726	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-91.3	-1.7	174.2	-66	179.1	179.6	178.9	0	113.8	I530 S531 R532	I530-K534 HydrophobicContact CG2-CB 4.49Å; I530-K534 HydrophobicContact CG2-CD 4.49Å; S531-K534 WeakPolarHBondContact O-CB 3.02Å; S531-K534 PolarHBondContact O-N 3.1Å; R532-K534 PolarHBondContact O-N 3.15Å; R532-K534 VanDerWaalsContact O-N 3.15Å
535	Y	58.1	Low	57.8	Low	78 Å²	78	96.1 Å²	96.1	31%	0.306	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.6	-19.5	-173.9	-94.5	-81.8	0	0	0	115	K23 V25 I530 R532	K23-Y535 HydrophobicContact CB-CE1 4.15Å; K23-Y535 HydrophobicContact CD-CE1 3.96Å; K23-Y535 WeakPolarHBondContact CD-OH 3.42Å; V25-Y535 HydrophobicContact CG1-CD2 4.31Å; V25-Y535 HydrophobicContact CG1-CE2 4.01Å; V25-Y535 HydrophobicContact CG2-CE2 4.45Å; I530-Y535 HydrophobicContact CB-CD2 4.47Å; I530-Y535 HydrophobicContact CB-CE2 4.08Å; I530-Y535 HydrophobicContact CD1-CE2 3.86Å; I530-Y535 HydrophobicContact CG2-CD2 3.99Å; I530-Y535 HydrophobicContact CG2-CE2 3.69Å; R532-Y535 PolarHBondContact O-N 3.04Å
536	S	38.6	Very low	54.9	Low	87 Å²	87	99.3 Å²	99.3	61%	0.608	52%	0.516	S	S	*	.	S	Bend	trans	-58.5	124.1	169.8	-171.2	0	0	0	0	109.5	R532 S538	R532-S536 PolarHBondContact O-N 3.35Å; S536-S538 PolarHBondContact O-N 2.91Å
537	P	35.6	Very low	52.2	Low	118 Å²	118	103.7 Å²	103.7	77%	0.766	54%	0.542	S	S	*	.			trans	-65.8	102.7	178.2	26.8	-32.9	0	0	0	108.4	N539	P537-N539 PolarHBondContact O-N 3.36Å
538	S	29.6	Very low	49.4	Very low	84 Å²	84	107 Å²	107	59%	0.587	56%	0.555	S	S	*	*			trans	-58.8	123.2	-171.1	61.3	0	0	0	0	110.5	S536 K540	S536-S538 PolarHBondContact O-N 2.91Å; S538-K540 PolarHBondContact O-N 2.94Å
539	N	29.9	Very low	46.6	Very low	101 Å²	101	112.7 Å²	112.7	54%	0.54	59%	0.586	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.3	25.5	-172.6	-133.5	3.3	0	0	0	113.8	P537 N541 K542 Q543	P537-N539 PolarHBondContact O-N 3.36Å; N539-N541 PolarHBondContact O-N 3.29Å; N539-K542 PolarHBondContact O-N 2.94Å; N539-Q543 PolarHBondContact O-N 2.59Å
540	K	31.9	Very low	43.8	Very low	159 Å²	159	118.3 Å²	118.3	69%	0.691	62%	0.615	S	S	*	*	H	α-helix	trans	-61.3	-23.3	-175.8	-72.5	-169.1	169.6	-166.8	0	113.4	S538	S538-K540 PolarHBondContact O-N 2.94Å
541	N	30.3	Very low	40.9	Very low	148 Å²	148	126.8 Å²	126.8	79%	0.791	65%	0.65	S	S	*	*	H	α-helix	trans	-94	15.6	174.3	-63.4	45.4	0	0	0	113.3	N539	N539-N541 PolarHBondContact O-N 3.29Å
542	K	32.4	Very low	38.5	Very low	147 Å²	147	130.8 Å²	130.8	64%	0.639	68%	0.679	S	S	*	*	H	α-helix	trans	-134.9	-5.7	176	-78	-164.1	171.8	-171.5	0	116.1	N539	N539-K542 PolarHBondContact O-N 2.94Å
543	Q	31.5	Very low	36.2	Very low	133 Å²	133	131.7 Å²	131.7	62%	0.621	70%	0.7	S	S	*	*	H	α-helix	trans	-95.6	-22	174.4	-74.6	-176.6	-68.1	0	0	114.3	N539 I545 I546 T547	N539-Q543 PolarHBondContact O-N 2.59Å; Q543-I545 PolarHBondContact O-N 2.69Å; Q543-I546 PolarHBondContact O-N 3.02Å; Q543-T547 PolarHBondContact O-OG1 2.97Å
544	E	30.7	Very low	34.3	Very low	165 Å²	165	135.9 Å²	135.9	77%	0.771	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	-3.5	174.2	-70.3	-176.3	144.4	0	0	114.6
545	I	30.7	Very low	32.5	Very low	141 Å²	141	133.4 Å²	133.4	72%	0.723	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.2	-8.7	-179.6	-64.3	176.2	0	0	0	112.3	Q543	Q543-I545 PolarHBondContact O-N 2.69Å
546	I	31.9	Very low	31.2	Very low	134 Å²	134	134.7 Å²	134.7	69%	0.687	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.4	-24.2	-175.8	-60.5	-178.7	0	0	0	112.6	Q543 N548	Q543-I546 PolarHBondContact O-N 3.02Å; I546-N548 PolarHBondContact O-N 3.39Å
547	T	30.7	Very low	30.7	Very low	110 Å²	110	135.8 Å²	135.8	68%	0.675	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	55.7	177.5	56.9	0	0	0	0	113.8	Q543	Q543-T547 PolarHBondContact O-OG1 2.97Å
548	N	30.3	Very low	30.3	Very low	146 Å²	146	136.9 Å²	136.9	78%	0.781	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.1	-5.9	162.5	-106.7	-18.7	0	0	0	114.6	I546	I546-N548 PolarHBondContact O-N 3.39Å
549	N	29.4	Very low	30.2	Very low	151 Å²	151	138.4 Å²	138.4	81%	0.807	75%	0.745	S	S	*	*	S	Bend	trans	-109.4	43.2	-176.5	-75.9	-13.2	0	0	0	113.8
550	Q	30.1	Very low	30.1	Very low	192 Å²	192	139.2 Å²	139.2	90%	0.897	75%	0.754	S	S	*	*	S	Bend	trans	-143.6	53.9	170.6	-72.9	-163.4	-17.2	0	0	112.4
551	K	28.5	Very low	30	Very low	209 Å²	209	136.7 Å²	136.7	91%	0.909	75%	0.752	S	S	*	*			trans	-156.4	44.9	173.3	-127.9	173	-171.6	-179.3	0	117.5
552	S	32.1	Very low	29.9	Very low	127 Å²	127	136.6 Å²	136.6	89%	0.888	75%	0.75	S	S	*	*			trans	-144.1	145.2	161.7	51.8	0	0	0	0	110.1
553	A	30.2	Very low	29.7	Very low	86 Å²	86	134.5 Å²	134.5	71%	0.711	75%	0.749	S	S	*	*			trans	-109.1	172.7	-176.8	0	0	0	0	0	111.8
554	L	30.8	Very low	29.7	Very low	171 Å²	171	134 Å²	134	90%	0.895	75%	0.751	S	S	*	*			trans	77.9	139.2	174.8	-61.3	129.9	0	0	0	116.3
555	P	30.1	Very low	29.6	Very low	114 Å²	114	132.4 Å²	132.4	74%	0.74	75%	0.748	S	S	*	*			trans	-98.8	156.5	-179.9	38.5	-34.2	0	0	0	112.7
556	S	28.9	Very low	29.5	Very low	106 Å²	106	132.7 Å²	132.7	74%	0.741	75%	0.751	S	S	*	*				169.1	144.8	115.7	47.2	0	0	0	0	114.1
557	T	28.9	Very low	29.5	Very low	110 Å²	110	134.2 Å²	134.2	68%	0.675	76%	0.759	S	S	*	*			trans	45.8	100.2	149.8	51.6	0	0	0	0	122
558	N	27	Very low	29.4	Very low	141 Å²	141	135.5 Å²	135.5	75%	0.754	76%	0.762	S	S	*	*				86.8	151.4	111.4	-64.5	-3.9	0	0	0	123.1
559	T	28.7	Very low	29.3	Very low	116 Å²	116	135.6 Å²	135.6	71%	0.712	76%	0.762	S	S	*	*			trans	78.7	101.1	147.7	26.4	0	0	0	0	120.2
560	T	27.8	Very low	29.3	Very low	117 Å²	117	135.6 Å²	135.6	72%	0.718	76%	0.762	S	S	*	*				57.9	142.7	118.7	58.7	0	0	0	0	119.9
561	T	28.2	Very low	29.4	Very low	107 Å²	107	134.6 Å²	134.6	66%	0.656	76%	0.761	S	S	*	*			cis	-178.4	163.5	5.3	19.7	0	0	0	0	109.5
562	I	29.5	Very low	29.4	Very low	145 Å²	145	131.2 Å²	131.2	74%	0.744	75%	0.753	S	S	*	*			trans	67.4	144.6	145.9	-70.8	161	0	0	0	116.4
563	T	28.4	Very low	29.2	Very low	103 Å²	103	130.4 Å²	130.4	63%	0.632	75%	0.747	S	S	*	*			cis	-156.8	-174.5	-31.1	35.2	0	0	0	0	107.6
564	D	30.9	Very low	29.1	Very low	123 Å²	123	131.7 Å²	131.7	66%	0.658	75%	0.751	S	S	*	*			trans	82.1	92.8	149.5	-63.8	-56.6	0	0	0	121.4
565	N	28.8	Very low	28.9	Very low	132 Å²	132	129.7 Å²	129.7	71%	0.706	75%	0.745	S	S	*	*				57.9	128.3	105.8	-66.9	-46.6	0	0	0	121.3
566	N	28.8	Very low	28.9	Very low	146 Å²	146	131.8 Å²	131.8	78%	0.781	75%	0.749	S	S	*	*			trans	63.2	118.5	154.3	-61.9	-19.9	0	0	0	119
567	I	32.3	Very low	28.8	Very low	166 Å²	166	132.5 Å²	132.5	85%	0.851	75%	0.754	S	S	*	*				-165.9	146.4	100.5	-95.1	155.6	0	0	0	108.4
568	N	26.8	Very low	28.6	Very low	138 Å²	138	132 Å²	132	74%	0.738	76%	0.761	S	S	*	*			trans	-86.6	142.9	169	-65.7	-25.7	0	0	0	109.6
569	D	29.2	Very low	28.6	Very low	148 Å²	148	132.1 Å²	132.1	79%	0.791	76%	0.76	S	S	*	*				153	150.5	122.7	-76.5	-27.6	0	0	0	110.7
570	D	28.6	Very low	28.5	Very low	151 Å²	151	133.7 Å²	133.7	81%	0.807	76%	0.764	S	S	*	*			trans	34.5	115.6	169	-65.2	-23.1	0	0	0	120.1
571	I	32.7	Very low	28.4	Very low	171 Å²	171	135.7 Å²	135.7	88%	0.877	77%	0.77	S	S	*	*				-157.7	146.3	118.1	-104.9	153.7	0	0	0	113
572	N	28.6	Very low	28.5	Very low	137 Å²	137	137 Å²	137	73%	0.733	78%	0.778	S	S	*	*			trans	-62.9	157.2	-169.6	-68.3	-79.9	0	0	0	117.1
573	S	27.7	Very low	28.3	Very low	111 Å²	111	137.4 Å²	137.4	78%	0.776	78%	0.782	S	S	*	*			trans	55.2	102.6	139.3	64.1	0	0	0	0	119.5
574	S	27.7	Very low	28.3	Very low	112 Å²	112	142.5 Å²	142.5	78%	0.783	79%	0.791	S	S	*	*				-177.4	172.8	100.9	49.7	0	0	0	0	111.5
575	V	27.7	Very low	28.1	Very low	129 Å²	129	145.6 Å²	145.6	78%	0.782	80%	0.799	S	S	*	*			trans	59.7	87.5	170	-165.7	0	0	0	0	116.5
576	I	28.9	Very low	28	Very low	158 Å²	158	144.4 Å²	144.4	81%	0.81	80%	0.801	S	S	*	*			trans	-167.2	110.6	131.4	-94.3	147.7	0	0	0	106.8
577	S	26.7	Very low	27.9	Very low	122 Å²	122	147.4 Å²	147.4	85%	0.853	81%	0.808	S	S	*	*			trans	-140.5	64.5	-170.4	61.3	0	0	0	0	112.5
578	A	26.1	Very low	27.6	Very low	99 Å²	99	149 Å²	149	82%	0.818	81%	0.811	S	S	*	*	S	Bend	trans	-158.3	19.6	175.5	0	0	0	0	0	115.5
579	I	26.9	Very low	27.5	Very low	143 Å²	143	148 Å²	148	73%	0.733	82%	0.815	S	S	*	*			trans	-134	146.2	179.8	-55.8	-178.4	0	0	0	109.2
580	N	25.8	Very low	27.3	Very low	150 Å²	150	147.5 Å²	147.5	80%	0.802	82%	0.817	S	S	*	*			trans	76.1	71.2	-179.3	-59	-28.1	0	0	0	117.5
581	N	26.7	Very low	27.1	Very low	158 Å²	158	148.7 Å²	148.7	85%	0.845	82%	0.815	S	S	*	*			trans	-150.9	127.8	138.2	-93.6	-47.2	0	0	0	105.6
582	T	28.8	Very low	26.9	Very low	134 Å²	134	145.9 Å²	145.9	82%	0.822	80%	0.802	S	S	*	*			cis	-135.7	140.8	49	42.9	0	0	0	0	114.4
583	N	26.7	Very low	26.9	Very low	154 Å²	154	144.1 Å²	144.1	82%	0.824	80%	0.798	S	S	*	*			trans	-122.3	93.9	171.3	-111.5	-20.9	0	0	0	110.2
584	Y	27.1	Very low	27.1	Very low	210 Å²	210	145.7 Å²	145.7	82%	0.824	79%	0.788	S	S	*	*			trans	-158.2	129.7	164.8	-87.9	-81.5	0	0	0	105.6
585	F	27.4	Very low	27.1	Very low	188 Å²	188	144.4 Å²	144.4	83%	0.825	79%	0.792	S	S	*	*			cis	-116.7	168.3	14.2	-97.5	-100.8	0	0	0	114.4
586	S	27.4	Very low	27.3	Very low	108 Å²	108	144.4 Å²	144.4	76%	0.755	79%	0.787	S	S	*	*			trans	-72.1	158.4	-173.1	46.3	0	0	0	0	115.5
587	K	26	Very low	27.3	Very low	209 Å²	209	143.5 Å²	143.5	91%	0.909	78%	0.782	S	S	*	*			trans	-69.7	131.1	167.1	-62.8	171.6	-179.8	173.4	0	110.3
588	Q	26.2	Very low	27.3	Very low	199 Å²	199	147.1 Å²	147.1	93%	0.93	78%	0.782	S	S	*	*			trans	-141.5	136.5	141.4	-112.6	-177.6	1.5	0	0	108.5
589	S	24.3	Very low	27.4	Very low	117 Å²	117	148.6 Å²	148.6	82%	0.818	78%	0.776	S	S	*	*			trans	-101.8	126.1	-165.3	52.9	0	0	0	0	112.8
590	V	25.7	Very low	27.4	Very low	138 Å²	138	149.3 Å²	149.3	84%	0.836	78%	0.78	S	S	*	*			trans	-129.3	119	152.7	-178.2	0	0	0	0	106.9	N592	V590-N592 PolarHBondContact O-N 3.32Å
591	K	24.7	Very low	27.4	Very low	175 Å²	175	150.2 Å²	150.2	76%	0.761	78%	0.779	S	S	*	*			trans	-63.6	125.1	175.2	-71.2	-168.5	178.5	-169.5	0	108.8	S485	S485-K591 PolarHBondContact OG-NZ 2.88Å
592	N	28.6	Very low	27.3	Very low	113 Å²	113	149.6 Å²	149.6	60%	0.604	77%	0.774	S	S	*	*			trans	-148.4	112.4	171.9	-171.1	-12	0	0	0	109.2	V590 Y594	V590-N592 PolarHBondContact O-N 3.32Å; N592-Y594 PolarHBondContact O-N 3.14Å
593	P	28	Very low	27.1	Very low	100 Å²	100	146.5 Å²	146.5	65%	0.649	76%	0.758	S	S	*	*			trans	-77.4	15.5	-168.6	31.7	-36.6	0	0	0	114.8
594	Y	31.8	Very low	27.1	Very low	144 Å²	144	146 Å²	146	57%	0.565	76%	0.756	S	S	*	*	S	Bend	trans	-114.6	105.8	179.7	-63.7	-70.1	0	0	0	111.5	N592 I596	N592-Y594 PolarHBondContact O-N 3.14Å; Y594-I596 VanDerWaalsContact C-N 3.26Å; Y594-I596 PolarHBondContact O-N 2.82Å
595	G	27.4	Very low	27.2	Very low	85 Å²	85	143.2 Å²	143.2	88%	0.876	75%	0.75	S	S	*	*			trans	-69.9	69.1	-177.7	0	0	0	0	0	114.6
596	I	32.5	Very low	27.2	Very low	129 Å²	129	141.3 Å²	141.3	66%	0.662	75%	0.748	S	S	*	*			trans	-76.4	120.6	170.1	-62.6	172.9	0	0	0	108.7	Y594 K598	Y594-I596 VanDerWaalsContact C-N 3.26Å; Y594-I596 PolarHBondContact O-N 2.82Å; I596-K598 PolarHBondContact O-N 2.87Å
597	I	29.7	Very low	27.2	Very low	139 Å²	139	139 Å²	139	71%	0.713	74%	0.741	S	S	*	*			trans	-71.9	100.9	169.9	-59.1	177.3	0	0	0	108	L599	I597-L599 VanDerWaalsContact C-N 3.29Å; I597-L599 HydrophobicContact CG2-CD1 4.5Å; I597-L599 HydrophobicContact CG2-CG 4.11Å; I597-L599 PolarHBondContact O-N 3.47Å
598	K	25	Very low	27.2	Very low	198 Å²	198	136.1 Å²	136.1	86%	0.861	74%	0.735	S	S	*	*			trans	-67.1	89.5	162.5	-80.8	-171.1	174.8	-176.8	0	108.9	I596	I596-K598 PolarHBondContact O-N 2.87Å
599	L	28.6	Very low	27.3	Very low	129 Å²	129	136.5 Å²	136.5	68%	0.675	73%	0.734	S	S	*	*			trans	-72	133.8	160.7	-92.3	158.4	0	0	0	108.9	L521 I597	L521-L599 HydrophobicContact CD2-CD1 3.62Å; I597-L599 VanDerWaalsContact C-N 3.29Å; I597-L599 HydrophobicContact CG2-CD1 4.5Å; I597-L599 HydrophobicContact CG2-CG 4.11Å; I597-L599 PolarHBondContact O-N 3.47Å
600	L	27.2	Very low	27.4	Very low	158 Å²	158	136.2 Å²	136.2	83%	0.827	73%	0.728	S	S	*	*			trans	-70.2	152.7	-178.4	-81.2	161.2	0	0	0	111.7	I602	L600-I602 PolarHBondContact O-N 2.99Å; L600-I602 VanDerWaalsContact O-N 3.12Å
601	H	24.9	Very low	27.4	Very low	170 Å²	170	140.9 Å²	140.9	79%	0.787	73%	0.73	S	S	*	*			trans	-74	98	-175.1	-156.4	-96	0	0	0	110.3	S603	H601-S603 PolarHBondContact CE1-OG 3.37Å; H601-S603 PolarHBondContact ND1-OG 2.69Å
602	I	26.2	Very low	27.4	Very low	144 Å²	144	138 Å²	138	74%	0.738	73%	0.733	S	S	*	*			trans	-106.3	92.9	173.6	-56	177.6	0	0	0	108.1	L600	L600-I602 PolarHBondContact O-N 2.99Å; L600-I602 VanDerWaalsContact O-N 3.12Å
603	S	24.4	Very low	27.3	Very low	70 Å²	70	139.1 Å²	139.1	49%	0.49	74%	0.744	S	S	.	*			trans	-88.5	-21.6	-177.2	-64	0	0	0	0	114.2	H601	H601-S603 PolarHBondContact CE1-OG 3.37Å; H601-S603 PolarHBondContact ND1-OG 2.69Å
604	D	26.7	Very low	27.3	Very low	143 Å²	143	139.6 Å²	139.6	77%	0.765	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.9	29.1	-156.4	-53.6	-46	0	0	0	114.9
605	Q	28.8	Very low	26.9	Very low	152 Å²	152	139.4 Å²	139.4	71%	0.71	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.7	-7.8	177.9	-74.1	-64.8	-75.8	0	0	115.7	G607	Q605-G607 VanDerWaalsContact C-N 3.31Å; Q605-G607 PolarHBondContact O-N 3.02Å
606	L	27.1	Very low	26.9	Very low	148 Å²	148	143.9 Å²	143.9	78%	0.775	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-83.6	1	-177.1	-125.7	76.3	0	0	0	115	N608	L606-N608 VanDerWaalsContact C-N 3.35Å; L606-N608 PolarHBondContact O-N 3Å
607	G	28.1	Very low	26.5	Very low	59 Å²	59	141.4 Å²	141.4	61%	0.608	75%	0.753	S	S	*	*	G	3₁₀ helix	trans	-76.8	-8.2	-173.7	0	0	0	0	0	116.6	Q605	Q605-G607 VanDerWaalsContact C-N 3.31Å; Q605-G607 PolarHBondContact O-N 3.02Å
608	N	25.8	Very low	26.3	Very low	148 Å²	148	141.4 Å²	141.4	79%	0.791	76%	0.759	S	S	*	*	G	3₁₀ helix	trans	-106.1	8.2	-167.9	-77.6	-19.1	0	0	0	115.8	L606	L606-N608 VanDerWaalsContact C-N 3.35Å; L606-N608 PolarHBondContact O-N 3Å
609	F	27.7	Very low	26.3	Very low	207 Å²	207	138.7 Å²	138.7	91%	0.908	76%	0.758	S	S	*	*	S	Bend	trans	-110	11.2	175.6	-96	-80.3	0	0	0	114.7
610	T	26.7	Very low	26.1	Very low	112 Å²	112	139.6 Å²	139.6	69%	0.687	77%	0.769	S	S	*	*	S	Bend	trans	-112.2	58.6	175.8	56.8	0	0	0	0	112
611	R	24.6	Very low	25.9	Very low	235 Å²	235	136.2 Å²	136.2	89%	0.887	76%	0.764	S	S	*	*	S	Bend	trans	-149.2	151.6	167.2	-120.4	175	177.7	178.2	-1.3	110.3
612	S	25	Very low	25.9	Very low	115 Å²	115	133.5 Å²	133.5	80%	0.804	76%	0.764	S	S	*	*			trans	52.2	72	-179.5	62.9	0	0	0	0	117
613	T	27.4	Very low	25.9	Very low	137 Å²	137	131.8 Å²	131.8	84%	0.84	77%	0.765	S	S	*	*			trans	-95.7	112.5	130.7	48.5	0	0	0	0	107.4
614	P	27	Very low	26	Very low	109 Å²	109	133.5 Å²	133.5	71%	0.708	78%	0.777	S	S	*	*			trans	-69.3	157	163.9	31.8	-33.7	0	0	0	109.8
615	D	24.5	Very low	25.8	Very low	140 Å²	140	133.2 Å²	133.2	75%	0.749	78%	0.781	S	S	*	*			trans	-60.2	140.5	-178.8	-63.3	-79.2	0	0	0	113.1
616	L	26.1	Very low	25.9	Very low	179 Å²	179	132.6 Å²	132.6	94%	0.937	79%	0.787	S	S	*	*			trans	-137.1	38.3	169	-109.3	166.9	0	0	0	112
617	S	24.1	Very low	25.8	Very low	78 Å²	78	133.9 Å²	133.9	55%	0.545	79%	0.789	S	S	.	*			trans	-109.5	144.8	155.1	52.2	0	0	0	0	109
618	V	25.5	Very low	25.8	Very low	139 Å²	139	135 Å²	135	84%	0.842	79%	0.788	S	S	*	*			trans	77.1	82.2	-176.9	-166.2	0	0	0	0	115.7
619	V	25.3	Very low	26	Very low	140 Å²	140	134.1 Å²	134.1	85%	0.848	78%	0.783	S	S	*	*			trans	-145.6	70.5	136.1	-168.8	0	0	0	0	109.9
620	V	24.6	Very low	26	Very low	148 Å²	148	129.9 Å²	129.9	90%	0.897	77%	0.77	S	S	*	*			trans	-143.3	66.7	167.2	-169.2	0	0	0	0	110.7
621	A	24.4	Very low	26.2	Very low	88 Å²	88	131.6 Å²	131.6	73%	0.727	77%	0.774	S	S	*	*	S	Bend	trans	-173.4	156.8	159.5	0	0	0	0	0	111.6
622	S	24.2	Very low	26.4	Very low	112 Å²	112	125 Å²	125	78%	0.783	76%	0.764	S	S	*	*			trans	76.3	149.9	159.3	-55	0	0	0	0	120
623	S	26	Very low	26.8	Very low	108 Å²	108	124.9 Å²	124.9	76%	0.755	76%	0.759	S	S	*	*			trans	52.3	105.2	168.2	44.9	0	0	0	0	118
624	S	25.7	Very low	26.9	Very low	106 Å²	106	126.8 Å²	126.8	74%	0.741	76%	0.756	S	S	*	*				88.9	96.5	56.9	72.2	0	0	0	0	115.1
625	T	23.9	Very low	27.1	Very low	138 Å²	138	128.6 Å²	128.6	85%	0.847	76%	0.755	S	S	*	*			trans	12.8	110.9	147.4	51.9	0	0	0	0	119.7
626	V	30.3	Very low	27.3	Very low	138 Å²	138	125.9 Å²	125.9	84%	0.836	75%	0.746	S	S	*	*			trans	-141.7	146.3	138	-173.2	0	0	0	0	110.1
627	Q	26	Very low	27.4	Very low	175 Å²	175	127.8 Å²	127.8	82%	0.818	74%	0.742	S	S	*	*			trans	-54	170.6	166.9	-80.8	143.8	-77.3	0	0	115.3
628	S	27.3	Very low	27.5	Very low	84 Å²	84	133.4 Å²	133.4	59%	0.587	76%	0.756	S	S	*	*			cis	-166	179.9	-5.8	42	0	0	0	0	111.2
629	D	29	Very low	27.6	Very low	128 Å²	128	133.5 Å²	133.5	68%	0.684	75%	0.751	S	S	*	*			trans	72.2	146.4	152.3	-53.3	-43.2	0	0	0	119.5
630	N	28.9	Very low	27.8	Very low	119 Å²	119	134.2 Å²	134.2	64%	0.636	75%	0.749	S	S	*	*			cis	-163.4	152.1	-22.9	-113.5	-33.2	0	0	0	111.7
631	N	30.1	Very low	27.8	Very low	147 Å²	147	135.7 Å²	135.7	79%	0.786	74%	0.744	S	S	*	*			trans	59.4	154.7	157.9	-62.1	-37.9	0	0	0	118.7
632	S	29.8	Very low	27.8	Very low	97 Å²	97	138.6 Å²	138.6	68%	0.678	75%	0.747	S	S	*	*			cis	-157.7	173.6	-25.9	61	0	0	0	0	106.5
633	T	32.4	Very low	28.1	Very low	113 Å²	113	139.5 Å²	139.5	69%	0.693	75%	0.747	S	S	*	*			cis	-160.1	141.8	22.6	-26.3	0	0	0	0	110.5
634	K	30.8	Very low	28.2	Very low	177 Å²	177	139.1 Å²	139.1	77%	0.77	75%	0.745	S	S	*	*			trans	7.4	152.3	141.1	-57.6	171.6	172.5	177.9	0	119.1
635	Q	30.9	Very low	28.1	Very low	146 Å²	146	141 Å²	141	68%	0.682	75%	0.747	S	S	*	*			cis	-172.3	-178.6	4.2	-114.3	171	-121.8	0	0	108.3
636	S	29.1	Very low	28.4	Very low	83 Å²	83	141 Å²	141	58%	0.58	75%	0.747	S	S	*	*			cis	-163	146.5	-5.8	33	0	0	0	0	112.9
637	W	27.4	Very low	28.2	Very low	220 Å²	220	142.4 Å²	142.4	83%	0.833	75%	0.75	S	S	*	*			trans	48.2	134.3	134.8	-57	49.6	0	0	0	120.5
638	K	26.7	Very low	28.4	Very low	195 Å²	195	139 Å²	139	85%	0.848	75%	0.751	S	S	*	*			cis	95.5	149.1	20.3	-156.1	178.3	-170.2	-177.4	0	114.7
639	L	26.8	Very low	28.5	Very low	142 Å²	142	140.7 Å²	140.7	74%	0.743	76%	0.763	S	S	*	*			trans	90.4	143.1	-169.9	-54.2	165.7	0	0	0	113.1
640	L	28.7	Very low	28.6	Very low	154 Å²	154	140.3 Å²	140.3	81%	0.806	77%	0.768	S	S	*	*			cis	-150.3	171.9	-1.8	-122.6	166.7	0	0	0	111.4
641	K	25.7	Very low	28.7	Very low	180 Å²	180	141.6 Å²	141.6	78%	0.783	78%	0.779	S	S	*	*			trans	-119	151.5	171.4	-69.4	-178.3	176	179.9	0	110.5
642	N	25.1	Very low	28.7	Very low	148 Å²	148	143.7 Å²	143.7	79%	0.791	78%	0.781	S	S	*	*				162.3	173.2	120.5	-83.1	-16.9	0	0	0	114
643	V	30.2	Very low	28.9	Very low	131 Å²	131	144.3 Å²	144.3	79%	0.794	78%	0.783	S	S	*	*			trans	85.3	88.3	161.5	-161.7	0	0	0	0	119.5
644	S	26.7	Very low	28.7	Very low	101 Å²	101	144.3 Å²	144.3	71%	0.706	79%	0.788	S	S	*	*				42.8	130.4	120.2	-47.6	0	0	0	0	124.6
645	N	25.3	Very low	28.6	Very low	145 Å²	145	142.4 Å²	142.4	78%	0.775	79%	0.791	S	S	*	*			trans	44.7	129.4	141.2	-55.9	-1.7	0	0	0	120.2
646	T	29.6	Very low	28.5	Very low	139 Å²	139	140.7 Å²	140.7	85%	0.853	80%	0.795	S	S	*	*				-170.1	-178.6	77.9	29.2	0	0	0	0	112.7
647	N	26.5	Very low	28.4	Very low	167 Å²	167	141.5 Å²	141.5	89%	0.893	81%	0.807	S	S	*	*			trans	-91.4	149.8	-169.5	-49	-48.4	0	0	0	115.1
648	A	29.8	Very low	28.4	Very low	103 Å²	103	137 Å²	137	85%	0.851	80%	0.799	S	S	*	*			trans	-155.4	163.6	150.6	0	0	0	0	0	111.1
649	S	28.8	Very low	28.5	Very low	119 Å²	119	137.9 Å²	137.9	83%	0.832	80%	0.797	S	S	*	*			trans	-108.3	166.3	-169	-85.4	0	0	0	0	114.9
650	P	32.2	Very low	28.5	Very low	121 Å²	121	138.3 Å²	138.3	79%	0.786	80%	0.8	S	S	*	*			trans	-102.4	167.9	-161.2	39.7	-36.7	0	0	0	115.9
651	V	31	Very low	28.7	Very low	145 Å²	145	138.4 Å²	138.4	88%	0.879	80%	0.801	S	S	*	*			trans	-133.8	153.3	169.7	-177.7	0	0	0	0	111
652	K	28.3	Very low	28.6	Very low	191 Å²	191	137.5 Å²	137.5	83%	0.83	81%	0.805	S	S	*	*			trans	-154	177.7	-177.4	-110.5	-168.3	175.8	-174.5	0	107.1
653	P	34.3	Very low	28.9	Very low	110 Å²	110	137.3 Å²	137.3	71%	0.714	80%	0.803	S	S	*	*			cis	-138	168.6	-33.5	39.3	-23.4	0	0	0	114.4
654	S	29	Very low	28.7	Very low	113 Å²	113	139.9 Å²	139.9	79%	0.79	81%	0.806	S	S	*	*			trans	-173.3	126.4	154.1	45.3	0	0	0	0	108.7
655	V	27.9	Very low	28.8	Very low	137 Å²	137	142.8 Å²	142.8	83%	0.83	81%	0.813	S	S	*	*				99.1	139	57.5	164.1	0	0	0	0	111.7
656	S	29.6	Very low	28.8	Very low	111 Å²	111	143.8 Å²	143.8	78%	0.776	82%	0.818	S	S	*	*			trans	63.1	131.3	-165.2	68	0	0	0	0	114.2
657	A	26.8	Very low	28.8	Very low	100 Å²	100	140.5 Å²	140.5	83%	0.826	81%	0.812	S	S	*	*			cis	77.8	90.6	17.4	0	0	0	0	0	116
658	D	27.4	Very low	28.7	Very low	126 Å²	126	143.6 Å²	143.6	67%	0.674	81%	0.811	S	S	*	*				-162.3	167.2	115.8	-155.4	5.1	0	0	0	111.8
659	R	30.1	Very low	28.7	Very low	212 Å²	212	144.9 Å²	144.9	80%	0.8	81%	0.808	S	S	*	*			trans	69.5	135.7	158.3	-72.1	151.9	-150.9	-139.1	-3.3	121.7
660	N	26.1	Very low	28.6	Very low	151 Å²	151	148.1 Å²	148.1	81%	0.807	81%	0.807	S	S	*	*			trans	-67.4	148.5	160.6	-53.1	-56.3	0	0	0	110.5
661	D	31.6	Very low	28.6	Very low	156 Å²	156	151.9 Å²	151.9	83%	0.834	81%	0.811	S	S	*	*			trans	-151.6	142.8	139.4	-117.2	-36.2	0	0	0	111.8	I663	D661-I663 PolarHBondContact O-N 2.85Å
662	N	25.2	Very low	28.4	Very low	161 Å²	161	154 Å²	154	86%	0.861	81%	0.812	S	S	*	*			trans	-92.9	98.8	-175.5	-77.9	-67.6	0	0	0	111
663	I	30.6	Very low	28.4	Very low	145 Å²	145	153.9 Å²	153.9	74%	0.744	81%	0.811	S	S	*	*			trans	-120.5	119.1	172.4	-60	-176.9	0	0	0	111	D661	D661-I663 PolarHBondContact O-N 2.85Å
664	Q	25.8	Very low	28	Very low	184 Å²	184	158.5 Å²	158.5	86%	0.86	82%	0.82	S	S	*	*			trans	-73.1	123.6	173.3	-60.5	176.2	3.9	0	0	110.5
665	L	29	Very low	27.8	Very low	163 Å²	163	156.5 Å²	156.5	85%	0.853	82%	0.818	S	S	*	*			trans	-133.6	119.3	163.7	-83.4	174.5	0	0	0	111.6	G667	L665-G667 PolarHBondContact O-N 3.34Å
666	N	24.8	Very low	27.9	Very low	165 Å²	165	158.3 Å²	158.3	88%	0.882	82%	0.822	S	S	*	*			trans	-78.7	104.2	-176.4	-84.9	-61.7	0	0	0	112.3
667	G	29.8	Very low	27.7	Very low	71 Å²	71	157.8 Å²	157.8	73%	0.732	82%	0.818	S	S	*	*			trans	-107.6	78.3	175.8	0	0	0	0	0	113.8	L665 V669	L665-G667 PolarHBondContact O-N 3.34Å; G667-V669 PolarHBondContact O-N 2.84Å
668	R	24.4	Very low	27.9	Very low	232 Å²	232	162.4 Å²	162.4	88%	0.875	81%	0.814	S	S	*	*			trans	-82.4	74.3	-167.4	-164.9	-175.9	-170.4	176.6	5.6	114.9
669	V	30.5	Very low	28.1	Very low	130 Å²	130	168 Å²	168	79%	0.788	83%	0.826	S	S	*	*			trans	-80.4	117.4	171.9	-177.6	0	0	0	0	111.2	G667	G667-V669 PolarHBondContact O-N 2.84Å
670	K	26.6	Very low	28.5	Very low	187 Å²	187	161.7 Å²	161.7	81%	0.813	81%	0.805	S	S	*	*			trans	-75.7	125.6	171.1	-64.2	175.7	-178	173.5	0	109.8
671	K	31.7	Very low	29.1	Very low	200 Å²	200	157.8 Å²	157.8	87%	0.87	79%	0.79	S	S	*	*			trans	-110.5	144.6	155.8	-85.5	-172.9	173.7	-179.5	0	109.4
672	E	28	Very low	29.9	Very low	190 Å²	190	150.6 Å²	150.6	89%	0.888	75%	0.752	S	S	*	*			trans	-81.8	153.2	-165.8	-66.3	170.4	125.7	0	0	112.7
673	K	26.7	Very low	31.2	Very low	187 Å²	187	145.4 Å²	145.4	81%	0.813	72%	0.723	S	S	*	*			trans	-83	116.7	-176.5	-71.4	178.4	175.6	178.5	0	111
674	F	25.9	Very low	31.7	Very low	208 Å²	208	143.4 Å²	143.4	91%	0.912	71%	0.714	S	S	*	*			trans	-107.1	143.7	141.8	-87.7	-88.8	0	0	0	109.7	L676	F674-L676 PolarHBondContact O-N 3.05Å
675	G	25.6	Very low	32.7	Very low	71 Å²	71	138.9 Å²	138.9	73%	0.732	70%	0.703	S	S	*	*	S	Bend	trans	-87.3	66	-149.3	0	0	0	0	0	117.8
676	L	29.2	Very low	33.8	Very low	175 Å²	175	137 Å²	137	92%	0.916	70%	0.698	S	S	*	*			trans	-104.9	44.1	159.3	-68.5	177.3	0	0	0	111.3	F674 R678	F674-L676 PolarHBondContact O-N 3.05Å; L676-R678 PolarHBondContact O-N 3.48Å
677	S	26.3	Very low	35.4	Very low	100 Å²	100	131.2 Å²	131.2	70%	0.699	67%	0.667	S	S	*	*			trans	-86.8	69.2	-169.2	-163.6	0	0	0	0	113.4
678	R	30.9	Very low	37.3	Very low	197 Å²	197	131.7 Å²	131.7	74%	0.743	65%	0.653	S	S	*	*			trans	-156.9	98	149.6	-132.9	179.3	-75.3	-156	-1.1	111.7	L676 H680	L676-R678 PolarHBondContact O-N 3.48Å; R678-H680 WeakPolarHBondContact CD-CE1 3.5Å; R678-H680 PolarHBondContact O-N 3.11Å
679	R	30.8	Very low	40.1	Very low	242 Å²	242	124.4 Å²	124.4	91%	0.913	63%	0.628	S	S	*	*			trans	-61.9	115.1	159.8	-69.5	179.3	176.4	176.8	-4.5	107.2
680	H	40	Very low	42.9	Very low	80 Å²	80	118.6 Å²	118.6	37%	0.37	59%	0.592	S	S	.	*			trans	-124.5	67.1	170.6	-87.2	11.2	0	0	0	107.8	R678 T682	R678-H680 WeakPolarHBondContact CD-CE1 3.5Å; R678-H680 PolarHBondContact O-N 3.11Å; H680-T682 VanDerWaalsContact C-N 3.31Å; H680-T682 PolarHBondContact O-N 3.43Å
681	S	38.3	Very low	45.9	Very low	69 Å²	69	109.7 Å²	109.7	48%	0.483	55%	0.553	S	S	.	*			trans	-70.1	82.6	177.5	46.7	0	0	0	0	110.1	I683	S681-I683 PolarHBondContact O-N 2.84Å
682	T	47	Very low	48.7	Very low	6 Å²	6	100.8 Å²	100.8	4%	0.037	52%	0.515	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	43.6	172.2	52.6	0	0	0	0	111.9	H680	H680-T682 VanDerWaalsContact C-N 3.31Å; H680-T682 PolarHBondContact O-N 3.43Å
683	I	52.8	Low	51.7	Low	51 Å²	51	91.8 Å²	91.8	26%	0.262	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-38.8	-175.4	-54.8	179.1	0	0	0	109.9	L63 S681	L63-I683 HydrophobicContact CD1-CD1 3.44Å; L63-I683 VanDerWaalsContact CD1-CD1 3.44Å; L63-I683 HydrophobicContact CD1-CG1 3.76Å; L63-I683 HydrophobicContact CD2-CD1 4.42Å; L63-I683 HydrophobicContact CD2-CG1 4.31Å; S681-I683 PolarHBondContact O-N 2.84Å
684	D	41.2	Very low	54.5	Low	103 Å²	103	85.2 Å²	85.2	55%	0.551	45%	0.447	S	S	*	.	S	Bend	trans	-101.1	153.2	-177.2	-64.9	-49.7	0	0	0	112.6	T686	D684-T686 PolarHBondContact O-N 3.04Å; D684-T686 VanDerWaalsContact O-N 3.09Å
685	S	47.8	Very low	57.6	Low	89 Å²	89	75.4 Å²	75.4	62%	0.622	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-5.7	-179.3	56.8	0	0	0	0	114.7
686	T	50.6	Low	60.7	Low	123 Å²	123	72 Å²	72	76%	0.755	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-19.8	-177.6	50.8	0	0	0	0	114.3	D684 D688	D684-T686 PolarHBondContact O-N 3.04Å; D684-T686 VanDerWaalsContact O-N 3.09Å; T686-D688 PolarHBondContact O-N 3.13Å
687	D	59.6	Low	63.6	Low	44 Å²	44	67.1 Å²	67.1	24%	0.235	34%	0.338	C	S	.	.	S	Bend	trans	-79.4	118.6	178	-151.8	-5.2	0	0	0	109.5	K689	D687-K689 PolarHBondContact O-N 2.97Å; D687-K689 IonicContact OD1-NZ 3.86Å
688	D	70.4	Confident	66.7	Low	81 Å²	81	67.5 Å²	67.5	43%	0.433	33%	0.325	S	S	.	.	S	Bend	trans	-73.7	19.1	-171.4	-166.1	25.3	0	0	0	112.9	S531 R532 S533 T686	S531-D688 CarbonylContact C-O 3.29Å; S531-D688 WeakPolarHBondContact CA-O 3.07Å; R532-D688 WeakPolarHBondContact CB-OD1 3.36Å; R532-D688 PolarHBondContact N-O 2.91Å; R532-D688 PolarHBondContact N-OD1 2.67Å; S533-D688 PolarHBondContact N-OD1 2.8Å; T686-D688 PolarHBondContact O-N 3.13Å
689	K	83.1	Confident	69.6	Low	79 Å²	79	58.1 Å²	58.1	34%	0.343	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	114.2	-175	-62.9	174.4	-162.1	129.6	0	111.1	Y529 D687	Y529-K689 HydrophobicContact CD1-CB 4.21Å; D687-K689 PolarHBondContact O-N 2.97Å; D687-K689 IonicContact OD1-NZ 3.86Å
690	L	88	Confident	72.6	Confident	8 Å²	8	46.8 Å²	46.8	4%	0.042	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	140	175.9	-51.3	-177.7	0	0	0	110.6	V25 Y529 I530 R532	V25-L690 HydrophobicContact CG1-CB 3.5Å; V25-L690 HydrophobicContact CG1-CD1 3.96Å; V25-L690 HydrophobicContact CG1-CG 4.38Å; Y529-L690 CarbonylContact C-O 3.52Å; Y529-L690 WeakPolarHBondContact CA-O 3.45Å; I530-L690 PolarHBondContact N-O 3Å; I530-L690 PolarHBondContact O-N 3.41Å; R532-L690 HydrophobicContact CB-CD1 4.21Å; R532-L690 HydrophobicContact CB-CD2 4.25Å; R532-L690 HydrophobicContact CB-CG 4.13Å; R532-L690 HydrophobicContact CG-CD1 4.27Å; R532-L690 HydrophobicContact CG-CD2 4.41Å
691	I	90.7	Very high	74.9	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	134	178.6	-60.6	156.6	0	0	0	109.6	V25 G26 L31 F58 Y529 L693	V25-I691 VanDerWaalsContact CA-O 3.32Å; V25-I691 WeakPolarHBondContact CA-O 3.49Å; G26-I691 PolarHBondContact N-O 2.78Å; G26-I691 WeakPolarHBondContact O-CB 3.47Å; G26-I691 PolarHBondContact O-N 3.5Å; L31-I691 HydrophobicContact CD1-CB 4.04Å; L31-I691 HydrophobicContact CD1-CD1 3.84Å; L31-I691 HydrophobicContact CD1-CG2 3.96Å; F58-I691 HydrophobicContact CB-CD1 4.49Å; F58-I691 HydrophobicContact CB-CG1 4.42Å; F58-I691 HydrophobicContact CD1-CG2 3.82Å; F58-I691 HydrophobicContact CD2-CD1 3.61Å; F58-I691 HydrophobicContact CD2-CG1 4.27Å; F58-I691 HydrophobicContact CD2-CG2 4.34Å; F58-I691 HydrophobicContact CE1-CG2 3.77Å; F58-I691 HydrophobicContact CE2-CD1 3.96Å; F58-I691 HydrophobicContact CE2-CG2 4.29Å; F58-I691 HydrophobicContact CG-CD1 4.11Å; F58-I691 HydrophobicContact CG-CG1 4.27Å; F58-I691 HydrophobicContact CG-CG2 4.11Å; F58-I691 HydrophobicContact CZ-CG2 4Å; Y529-I691 HydrophobicContact CD1-CG1 4.4Å; Y529-I691 HydrophobicContact CE1-CG1 4.1Å; I691-L693 PolarHBondContact O-N 3.5Å
692	N	90.8	Very high	77.5	Confident	13 Å²	13	44.9 Å²	44.9	7%	0.07	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	77.8	-177.1	-173.3	4.2	0	0	0	112.3	P527 D528 I530 D694 K695 H696	P527-N692 PolarHBondContact O-ND2 2.79Å; D528-N692 WeakPolarHBondContact O-CB 3.41Å; D528-N692 PolarHBondContact O-N 3.38Å; I530-N692 HydrophobicContact CD1-CB 4.2Å; I530-N692 HydrophobicContact CG1-CB 4.26Å; N692-D694 PolarHBondContact O-N 2.95Å; N692-K695 HydrophobicContact CB-CB 4.21Å; N692-K695 WeakPolarHBondContact ND2-CB 3.32Å; N692-K695 WeakPolarHBondContact O-CB 3.5Å; N692-K695 PolarHBondContact O-N 2.84Å; N692-K695 PolarHBondContact OD1-N 3.1Å; N692-H696 PolarHBondContact O-CD2 3.25Å; N692-H696 PolarHBondContact O-N 2.99Å
693	L	89.2	Confident	79.7	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-63.8	-26	-178.9	-158.3	74.6	0	0	0	112.4	R24 L31 F35 T50 I691 K695 H696 R697	R24-L693 HydrophobicContact CB-CB 3.9Å; R24-L693 HydrophobicContact CB-CD2 4.26Å; R24-L693 WeakPolarHBondContact O-CA 3.5Å; R24-L693 WeakPolarHBondContact O-CB 3.28Å; R24-L693 PolarHBondContact O-N 3.45Å; L31-L693 HydrophobicContact CD1-CD1 4.4Å; L31-L693 HydrophobicContact CD2-CB 4.08Å; L31-L693 HydrophobicContact CD2-CD2 4.36Å; F35-L693 HydrophobicContact CE1-CD2 4.3Å; T50-L693 HydrophobicContact CG2-CD1 3.72Å; T50-L693 HydrophobicContact CG2-CG 3.83Å; I691-L693 PolarHBondContact O-N 3.5Å; L693-K695 VanDerWaalsContact C-N 3.32Å; L693-K695 PolarHBondContact O-N 2.89Å; L693-H696 HydrophobicContact CD1-CB 4.41Å; L693-H696 PolarHBondContact O-N 3.3Å; L693-R697 WeakPolarHBondContact O-CB 3.5Å; L693-R697 PolarHBondContact O-N 3.4Å
694	D	86.8	Confident	81.5	Confident	50 Å²	50	43.1 Å²	43.1	27%	0.267	22%	0.223	S	C	.	.	H	α-helix	trans	-66.2	-27.8	171.7	-85.8	-46.2	0	0	0	113.5	K23 R24 N692	K23-D694 WeakPolarHBondContact CA-OD2 3.4Å; R24-D694 PolarHBondContact N-OD2 2.83Å; R24-D694 PolarHBondContact O-N 3.38Å; N692-D694 PolarHBondContact O-N 2.95Å
695	K	90.5	Very high	83.9	Confident	1 Å²	1	39.7 Å²	39.7	0%	0.004	20%	0.204	C	C	.	.	H	α-helix	trans	-69.7	-54	165.5	173	180	-174.3	175.9	0	110.2	H523 S526 D528 N692 L693 R697 R698 E699	H523-K695 PolarHBondContact ND1-NZ 3.42Å; H523-K695 PolarHBondContact O-NZ 3.17Å; S526-K695 WeakPolarHBondContact O-CD 3.34Å; S526-K695 VanDerWaalsContact O-CE 3.27Å; S526-K695 WeakPolarHBondContact O-CE 3.47Å; S526-K695 PolarHBondContact O-NZ 2.87Å; S526-K695 WeakPolarHBondContact OG-CD 3.41Å; S526-K695 WeakPolarHBondContact OG-CG 3.44Å; D528-K695 WeakPolarHBondContact OD1-CD 3.41Å; D528-K695 WeakPolarHBondContact OD1-CE 3.46Å; D528-K695 IonicContact OD1-NZ 3.75Å; D528-K695 PolarHBondContact OD1-NZ 3.19Å; N692-K695 HydrophobicContact CB-CB 4.21Å; N692-K695 WeakPolarHBondContact ND2-CB 3.32Å; N692-K695 WeakPolarHBondContact O-CB 3.5Å; N692-K695 PolarHBondContact O-N 2.84Å; N692-K695 PolarHBondContact OD1-N 3.1Å; L693-K695 VanDerWaalsContact C-N 3.32Å; L693-K695 PolarHBondContact O-N 2.89Å; K695-R697 PolarHBondContact O-N 3.03Å; K695-R698 WeakPolarHBondContact O-CB 3.23Å; K695-R698 PolarHBondContact O-N 3.24Å; K695-E699 PolarHBondContact O-N 3.4Å
696	H	91.5	Very high	86.1	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-59.1	-31.6	-175.7	-67	-46	0	0	0	112.4	T50 T54 F58 D528 N692 L693 R698 E699 F700	T50-H696 VanDerWaalsContact CG2-C 3.45Å; T50-H696 HydrophobicContact CG2-CB 3.84Å; T54-H696 HydrophobicContact CG2-CB 3.85Å; F58-H696 AromaticContact CD1-NE2 3.7Å; F58-H696 AromaticContact CE1-CD2 3.66Å; F58-H696 AromaticContact CE1-NE2 3.68Å; D528-H696 IonicContact OD1-CE1 2.83Å; N692-H696 PolarHBondContact O-CD2 3.25Å; N692-H696 PolarHBondContact O-N 2.99Å; L693-H696 HydrophobicContact CD1-CB 4.41Å; L693-H696 PolarHBondContact O-N 3.3Å; H696-R698 PolarHBondContact O-N 3.48Å; H696-E699 IonicContact CE1-OE2 3.31Å; H696-E699 IonicContact CG-OE2 3.15Å; H696-E699 IonicContact ND1-OE2 3.73Å; H696-E699 PolarHBondContact ND1-OE2 3.35Å; H696-E699 PolarHBondContact O-N 3.03Å; H696-E699 VanDerWaalsContact O-N 3.13Å; H696-F700 WeakPolarHBondContact O-CB 3.29Å; H696-F700 PolarHBondContact O-N 3.47Å
697	R	90	Very high	88.2	Confident	71 Å²	71	30.8 Å²	30.8	27%	0.268	14%	0.144	S	C	.	.	H	α-helix	trans	-60.8	-26.9	173.2	-178.6	172.6	168.9	-110.4	-0.7	113.3	V46 T50 L693 K695	V46-R697 HydrophobicContact CG1-CG 4.34Å; T50-R697 VanDerWaalsContact CG2-CA 3.49Å; T50-R697 HydrophobicContact CG2-CB 3.97Å; T50-R697 VanDerWaalsContact CG2-N 3.25Å; L693-R697 WeakPolarHBondContact O-CB 3.5Å; L693-R697 PolarHBondContact O-N 3.4Å; K695-R697 PolarHBondContact O-N 3.03Å
698	R	90.7	Very high	89.7	Confident	108 Å²	108	28.9 Å²	28.9	41%	0.408	13%	0.134	S	C	.	.	H	α-helix	trans	-82.2	-37	174	-61.3	-174.8	-69.7	-166.5	3.7	111.9	L522 S526 K695 H696 K701	L522-R698 HydrophobicContact CD1-CB 3.84Å; L522-R698 WeakPolarHBondContact CD1-O 3.41Å; L522-R698 HydrophobicContact CD2-CB 3.96Å; S526-R698 PolarHBondContact OG-NH2 3.28Å; K695-R698 WeakPolarHBondContact O-CB 3.23Å; K695-R698 PolarHBondContact O-N 3.24Å; H696-R698 PolarHBondContact O-N 3.48Å; R698-K701 WeakPolarHBondContact O-CB 3.13Å; R698-K701 PolarHBondContact O-N 2.95Å
699	E	92.9	Very high	90.7	Very high	0 Å²	0	25 Å²	25	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-65.7	-43.9	174.1	-61.4	179.3	136.8	0	0	110.9	L285 R289 L519 L522 K695 H696 K701 I702 L703	L285-E699 HydrophobicContact CD2-CB 3.91Å; L285-E699 HydrophobicContact CD2-CG 4.46Å; R289-E699 IonicContact CZ-OE1 3.76Å; R289-E699 IonicContact NH1-OE1 3.7Å; R289-E699 PolarHBondContact NH1-OE1 3.09Å; R289-E699 IonicContact NH2-OE1 3.02Å; R289-E699 PolarHBondContact NH2-OE1 2.88Å; R289-E699 IonicContact NH2-OE2 2.71Å; R289-E699 PolarHBondContact NH2-OE2 3.43Å; L519-E699 HydrophobicContact CD2-CB 4.03Å; L519-E699 HydrophobicContact CD2-CG 4.32Å; L522-E699 HydrophobicContact CB-CG 4.43Å; L522-E699 HydrophobicContact CD1-CG 4.26Å; K695-E699 PolarHBondContact O-N 3.4Å; H696-E699 IonicContact CE1-OE2 3.31Å; H696-E699 IonicContact CG-OE2 3.15Å; H696-E699 IonicContact ND1-OE2 3.73Å; H696-E699 PolarHBondContact ND1-OE2 3.35Å; H696-E699 PolarHBondContact O-N 3.03Å; H696-E699 VanDerWaalsContact O-N 3.13Å; E699-K701 VanDerWaalsContact C-N 3.3Å; E699-K701 PolarHBondContact O-N 2.98Å; E699-I702 PolarHBondContact O-N 3.49Å; E699-L703 PolarHBondContact O-N 3.4Å; E699-L703 VanDerWaalsContact O-N 3.17Å
700	F	92.1	Very high	91.3	Very high	4 Å²	4	21.6 Å²	21.6	2%	0.018	10%	0.099	C	C	.	.	H	α-helix	trans	-52.3	-41.3	173.3	163.9	-127.5	0	0	0	112.9	N49 T50 Y53 P476 H696 I702 L703 A704	N49-F700 HydrophobicContact CB-CE1 4.07Å; N49-F700 HydrophobicContact CB-CE2 3.86Å; N49-F700 HydrophobicContact CB-CZ 3.49Å; N49-F700 VanDerWaalsContact CB-CZ 3.49Å; T50-F700 HydrophobicContact CG2-CB 4.42Å; T50-F700 VanDerWaalsContact OG1-CD1 3.27Å; T50-F700 WeakPolarHBondContact OG1-CD1 3.43Å; Y53-F700 HydrophobicContact CD1-CD2 4.02Å; Y53-F700 HydrophobicContact CD1-CE2 4.48Å; Y53-F700 AromaticContact CD2-CD2 3.61Å; Y53-F700 HydrophobicContact CD2-CD2 3.61Å; Y53-F700 AromaticContact CD2-CE2 3.58Å; Y53-F700 HydrophobicContact CD2-CE2 3.58Å; Y53-F700 HydrophobicContact CE1-CD2 4.38Å; Y53-F700 HydrophobicContact CE1-CE2 4.46Å; Y53-F700 HydrophobicContact CE2-CD2 4.05Å; Y53-F700 AromaticContact CE2-CE2 3.6Å; Y53-F700 HydrophobicContact CE2-CE2 3.6Å; Y53-F700 AromaticContact CG-CD2 3.59Å; Y53-F700 HydrophobicContact CG-CD2 3.59Å; Y53-F700 HydrophobicContact CG-CE2 4.04Å; P476-F700 HydrophobicContact CG-CD1 4.07Å; P476-F700 HydrophobicContact CG-CE1 3.7Å; H696-F700 WeakPolarHBondContact O-CB 3.29Å; H696-F700 PolarHBondContact O-N 3.47Å; F700-I702 PolarHBondContact O-N 3.03Å; F700-L703 PolarHBondContact O-N 3.33Å; F700-A704 HydrophobicContact CD2-CB 4.3Å; F700-A704 HydrophobicContact CE2-CB 3.91Å; F700-A704 HydrophobicContact CZ-CB 4.46Å; F700-A704 WeakPolarHBondContact O-CB 3.3Å; F700-A704 PolarHBondContact O-N 3.21Å
701	K	89.4	Confident	91.4	Very high	91 Å²	91	21.7 Å²	21.7	40%	0.396	10%	0.099	S	C	.	.	H	α-helix	trans	-54.8	-39.3	176.4	-74	-169.7	169.2	-161.6	0	113.1	P476 R698 E699 N705	P476-K701 HydrophobicContact CB-CG 4.47Å; P476-K701 HydrophobicContact CG-CG 3.93Å; P476-K701 WeakPolarHBondContact O-CE 3.36Å; P476-K701 PolarHBondContact O-NZ 3.45Å; R698-K701 WeakPolarHBondContact O-CB 3.13Å; R698-K701 PolarHBondContact O-N 2.95Å; E699-K701 VanDerWaalsContact C-N 3.3Å; E699-K701 PolarHBondContact O-N 2.98Å; K701-N705 PolarHBondContact O-N 2.86Å
702	I	92.6	Very high	91.3	Very high	19 Å²	19	21.9 Å²	21.9	10%	0.097	10%	0.1	C	C	.	.	H	α-helix	trans	-75	-46	-179.5	-67.5	156.5	0	0	0	109.5	F515 D518 L519 L522 E699 F700 A704 N705 I706	F515-I702 HydrophobicContact CB-CG2 3.76Å; F515-I702 HydrophobicContact CD1-CG2 3.85Å; F515-I702 HydrophobicContact CG-CG2 4.15Å; D518-I702 HydrophobicContact CB-CD1 3.61Å; D518-I702 HydrophobicContact CB-CG1 4.41Å; L519-I702 HydrophobicContact CD1-CG2 4.19Å; L519-I702 HydrophobicContact CD2-CB 4.01Å; L519-I702 HydrophobicContact CD2-CD1 3.84Å; L519-I702 HydrophobicContact CD2-CG2 4.09Å; L519-I702 HydrophobicContact CG-CB 4.35Å; L519-I702 HydrophobicContact CG-CD1 4.15Å; L519-I702 HydrophobicContact CG-CG2 3.9Å; L522-I702 HydrophobicContact CD1-CD1 3.51Å; L522-I702 HydrophobicContact CG-CD1 4.47Å; E699-I702 PolarHBondContact O-N 3.49Å; F700-I702 PolarHBondContact O-N 3.03Å; I702-A704 VanDerWaalsContact C-N 3.32Å; I702-A704 PolarHBondContact O-N 2.8Å; I702-N705 WeakPolarHBondContact O-CB 3.42Å; I702-N705 PolarHBondContact O-N 3.49Å; I702-N705 VanDerWaalsContact O-N 3.1Å; I702-I706 HydrophobicContact CG2-CD1 4.21Å; I702-I706 WeakPolarHBondContact O-CG1 3.39Å; I702-I706 PolarHBondContact O-N 2.94Å
703	L	93.8	Very high	91.5	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-62.2	-37.2	177.9	-60.3	-169.1	0	0	0	113.1	Y53 L281 C284 L285 L519 E699 F700 N705 I706 F707	Y53-L703 HydrophobicContact CD1-CB 3.48Å; Y53-L703 VanDerWaalsContact CD1-CB 3.48Å; Y53-L703 HydrophobicContact CD1-CD1 3.91Å; Y53-L703 HydrophobicContact CD1-CG 4.38Å; Y53-L703 HydrophobicContact CE1-CB 3.81Å; L281-L703 HydrophobicContact CB-CD1 4.48Å; L281-L703 WeakPolarHBondContact O-CD1 3.12Å; L281-L703 VanDerWaalsContact O-CD2 3.28Å; L281-L703 WeakPolarHBondContact O-CD2 3.41Å; C284-L703 HydrophobicContact CB-CD2 3.93Å; L285-L703 HydrophobicContact CD1-CD1 3.78Å; L285-L703 HydrophobicContact CD2-CD1 3.96Å; L285-L703 HydrophobicContact CD2-CD2 4.17Å; L285-L703 HydrophobicContact CD2-CG 4.18Å; L285-L703 HydrophobicContact CG-CD1 3.83Å; L519-L703 HydrophobicContact CD1-CD2 4Å; E699-L703 PolarHBondContact O-N 3.4Å; E699-L703 VanDerWaalsContact O-N 3.17Å; F700-L703 PolarHBondContact O-N 3.33Å; L703-N705 VanDerWaalsContact C-N 3.33Å; L703-N705 PolarHBondContact O-N 3.49Å; L703-I706 HydrophobicContact CD2-CD1 4.05Å; L703-I706 PolarHBondContact O-N 2.93Å; L703-F707 WeakPolarHBondContact O-CB 3.49Å; L703-F707 PolarHBondContact O-N 2.8Å
704	A	90.5	Very high	91.6	Very high	19 Å²	19	25.9 Å²	25.9	16%	0.157	12%	0.118	C	C	.	.	H	α-helix	trans	-64	-37.7	174	0	0	0	0	0	111.9	F700 I702 F707 L708	F700-A704 HydrophobicContact CD2-CB 4.3Å; F700-A704 HydrophobicContact CE2-CB 3.91Å; F700-A704 HydrophobicContact CZ-CB 4.46Å; F700-A704 WeakPolarHBondContact O-CB 3.3Å; F700-A704 PolarHBondContact O-N 3.21Å; I702-A704 VanDerWaalsContact C-N 3.32Å; I702-A704 PolarHBondContact O-N 2.8Å; A704-F707 PolarHBondContact O-N 2.85Å; A704-L708 VanDerWaalsContact O-CG 3.3Å; A704-L708 WeakPolarHBondContact O-CG 3.46Å; A704-L708 PolarHBondContact O-N 3.03Å
705	N	91.4	Very high	91.7	Very high	31 Å²	31	26.8 Å²	26.8	17%	0.166	12%	0.12	C	C	.	.	H	α-helix	trans	-67.6	-38.3	171.9	-85.1	-15.4	0	0	0	112.2	R475 K701 I702 L703 L708 L709	R475-N705 PolarHBondContact NH2-OD1 3.01Å; K701-N705 PolarHBondContact O-N 2.86Å; I702-N705 WeakPolarHBondContact O-CB 3.42Å; I702-N705 PolarHBondContact O-N 3.49Å; I702-N705 VanDerWaalsContact O-N 3.1Å; L703-N705 VanDerWaalsContact C-N 3.33Å; L703-N705 PolarHBondContact O-N 3.49Å; N705-L708 PolarHBondContact O-N 3.49Å; N705-L709 WeakPolarHBondContact O-CG 3.27Å; N705-L709 PolarHBondContact O-N 3.43Å; N705-L709 VanDerWaalsContact O-N 3.14Å
706	I	94.4	Very high	91.7	Very high	0 Å²	0	28 Å²	28	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-62.5	-45.6	173	-62.1	171.4	0	0	0	110.2	F276 M279 L281 F515 I702 L703 L708 L709 Q710	F276-I706 HydrophobicContact CE2-CG2 3.95Å; F276-I706 HydrophobicContact CZ-CG2 4.17Å; M279-I706 HydrophobicContact CE-CG2 3.61Å; L281-I706 HydrophobicContact CD2-CB 3.88Å; L281-I706 HydrophobicContact CD2-CG2 3.49Å; L281-I706 VanDerWaalsContact CD2-CG2 3.49Å; F515-I706 HydrophobicContact CB-CD1 3.83Å; F515-I706 HydrophobicContact CB-CG1 4.14Å; F515-I706 HydrophobicContact CD1-CG1 4.38Å; F515-I706 HydrophobicContact CD2-CD1 4.23Å; F515-I706 HydrophobicContact CD2-CG1 3.71Å; F515-I706 HydrophobicContact CE2-CG1 4.16Å; F515-I706 HydrophobicContact CG-CD1 4.09Å; F515-I706 HydrophobicContact CG-CG1 3.82Å; I702-I706 HydrophobicContact CG2-CD1 4.21Å; I702-I706 WeakPolarHBondContact O-CG1 3.39Å; I702-I706 PolarHBondContact O-N 2.94Å; L703-I706 HydrophobicContact CD2-CD1 4.05Å; L703-I706 PolarHBondContact O-N 2.93Å; I706-L708 PolarHBondContact O-N 2.77Å; I706-L709 CarbonylContact O-C 3.59Å; I706-L709 WeakPolarHBondContact O-CA 3.34Å; I706-L709 WeakPolarHBondContact O-CB 3.29Å; I706-L709 PolarHBondContact O-N 2.73Å; I706-Q710 PolarHBondContact O-N 3.3Å
707	F	93.4	Very high	91.5	Very high	25 Å²	25	33.6 Å²	33.6	11%	0.11	16%	0.164	C	C	.	.	H	α-helix	trans	-59.4	-45.4	177.1	177.6	-121	0	0	0	112.2	Y53 Q103 P104 L281 L703 A704 L709 Q710 Q711	Y53-F707 WeakPolarHBondContact OH-CD1 3.5Å; Q103-F707 HydrophobicContact CB-CZ 4.25Å; P104-F707 HydrophobicContact CB-CD2 3.84Å; P104-F707 HydrophobicContact CB-CE2 3.79Å; P104-F707 HydrophobicContact CB-CG 4.49Å; P104-F707 HydrophobicContact CB-CZ 4.39Å; P104-F707 HydrophobicContact CG-CD2 4.17Å; P104-F707 HydrophobicContact CG-CE2 4.27Å; P104-F707 HydrophobicContact CG-CG 4.35Å; L281-F707 HydrophobicContact CD1-CB 3.84Å; L281-F707 HydrophobicContact CD1-CD2 4.21Å; L281-F707 HydrophobicContact CD1-CG 4.32Å; L703-F707 WeakPolarHBondContact O-CB 3.49Å; L703-F707 PolarHBondContact O-N 2.8Å; A704-F707 PolarHBondContact O-N 2.85Å; F707-L709 PolarHBondContact O-N 3.48Å; F707-Q710 WeakPolarHBondContact O-CB 3.43Å; F707-Q710 PolarHBondContact O-N 3.31Å; F707-Q710 VanDerWaalsContact O-N 3.09Å; F707-Q711 HydrophobicContact CD2-CG 4.38Å; F707-Q711 HydrophobicContact CE1-CG 4.23Å; F707-Q711 HydrophobicContact CE2-CG 3.93Å; F707-Q711 HydrophobicContact CZ-CG 3.86Å; F707-Q711 WeakPolarHBondContact O-CG 3.15Å; F707-Q711 PolarHBondContact O-N 2.75Å
708	L	90.9	Very high	91.4	Very high	4 Å²	4	32.3 Å²	32.3	2%	0.021	16%	0.162	C	C	.	.	H	α-helix	trans	-59.1	-31.8	173.8	-72	168.6	0	0	0	112.3	A454 M457 Y458 L461 I473 A704 N705 I706 N712	A454-L708 HydrophobicContact CB-CB 4.11Å; A454-L708 HydrophobicContact CB-CD1 4.36Å; M457-L708 HydrophobicContact CG-CD2 4.23Å; M457-L708 WeakPolarHBondContact CG-O 3.34Å; Y458-L708 HydrophobicContact CD2-CD1 4.23Å; L461-L708 HydrophobicContact CD1-CD2 4.02Å; I473-L708 HydrophobicContact CG2-CD2 4.37Å; A704-L708 VanDerWaalsContact O-CG 3.3Å; A704-L708 WeakPolarHBondContact O-CG 3.46Å; A704-L708 PolarHBondContact O-N 3.03Å; N705-L708 PolarHBondContact O-N 3.49Å; I706-L708 PolarHBondContact O-N 2.77Å; L708-N712 PolarHBondContact O-N 3.1Å; L708-N712 VanDerWaalsContact O-N 3.15Å; L708-N712 PolarHBondContact O-ND2 3.37Å
709	L	92.9	Very high	91.2	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-77.5	-35.9	174	-66.3	168.5	0	0	0	112.2	F276 L450 C453 A454 V508 P510 F515 N705 I706 F707 Q711 N712 A713	F276-L709 HydrophobicContact CE1-CB 4.12Å; F276-L709 HydrophobicContact CZ-CB 3.89Å; L450-L709 HydrophobicContact CB-CD1 4.33Å; L450-L709 HydrophobicContact CD2-CD1 4.45Å; C453-L709 HydrophobicContact CB-CD2 3.88Å; A454-L709 HydrophobicContact CB-CD2 4.45Å; V508-L709 HydrophobicContact CG1-CD2 3.64Å; P510-L709 HydrophobicContact CB-CD1 4.14Å; P510-L709 HydrophobicContact CG-CD1 4.15Å; F515-L709 HydrophobicContact CE2-CD1 3.78Å; F515-L709 HydrophobicContact CZ-CD1 3.62Å; N705-L709 WeakPolarHBondContact O-CG 3.27Å; N705-L709 PolarHBondContact O-N 3.43Å; N705-L709 VanDerWaalsContact O-N 3.14Å; I706-L709 CarbonylContact O-C 3.59Å; I706-L709 WeakPolarHBondContact O-CA 3.34Å; I706-L709 WeakPolarHBondContact O-CB 3.29Å; I706-L709 PolarHBondContact O-N 2.73Å; F707-L709 PolarHBondContact O-N 3.48Å; L709-Q711 VanDerWaalsContact C-N 3.29Å; L709-Q711 PolarHBondContact O-N 3.22Å; L709-N712 WeakPolarHBondContact O-CA 3.13Å; L709-N712 WeakPolarHBondContact O-CB 3.41Å; L709-N712 PolarHBondContact O-N 3.32Å; L709-N712 VanDerWaalsContact O-N 3.08Å; L709-A713 PolarHBondContact O-N 3.27Å
710	Q	94.2	Very high	91.1	Very high	7 Å²	7	42.2 Å²	42.2	3%	0.033	21%	0.212	C	C	.	.	H	α-helix	trans	-59.3	-41.9	169	-71.5	-179.8	-41.3	0	0	110.9	F276 L277 M279 I706 F707 N712 A713 Q714	F276-Q710 HydrophobicContact CD1-CG 4.26Å; F276-Q710 HydrophobicContact CE1-CB 4.38Å; F276-Q710 HydrophobicContact CE1-CG 3.82Å; F276-Q710 HydrophobicContact CE2-CG 4.21Å; F276-Q710 HydrophobicContact CZ-CG 3.76Å; F276-Q710 PolarHBondContact O-NE2 3.14Å; L277-Q710 HydrophobicContact CD2-CB 4.21Å; L277-Q710 VanDerWaalsContact CD2-O 3.28Å; L277-Q710 WeakPolarHBondContact CD2-O 3.4Å; M279-Q710 PolarHBondContact O-NE2 2.95Å; M279-Q710 VanDerWaalsContact O-NE2 3.12Å; I706-Q710 PolarHBondContact O-N 3.3Å; F707-Q710 WeakPolarHBondContact O-CB 3.43Å; F707-Q710 PolarHBondContact O-N 3.31Å; F707-Q710 VanDerWaalsContact O-N 3.09Å; Q710-N712 VanDerWaalsContact C-N 3.31Å; Q710-N712 PolarHBondContact O-N 2.95Å; Q710-A713 PolarHBondContact O-N 3.29Å; Q710-Q714 PolarHBondContact O-N 3.1Å
711	Q	90.2	Very high	90.9	Very high	10 Å²	10	45.8 Å²	45.8	5%	0.047	23%	0.229	C	C	.	.	H	α-helix	trans	-64.2	-30.7	173.1	-68.2	-54.2	118.5	0	0	112.9	M457 L461 F707 L709 F715	M457-Q711 HydrophobicContact CG-CB 3.77Å; M457-Q711 HydrophobicContact SD-CB 3.99Å; L461-Q711 HydrophobicContact CD1-CB 4.34Å; L461-Q711 HydrophobicContact CD1-CG 4.17Å; F707-Q711 HydrophobicContact CD2-CG 4.38Å; F707-Q711 HydrophobicContact CE1-CG 4.23Å; F707-Q711 HydrophobicContact CE2-CG 3.93Å; F707-Q711 HydrophobicContact CZ-CG 3.86Å; F707-Q711 WeakPolarHBondContact O-CG 3.15Å; F707-Q711 PolarHBondContact O-N 2.75Å; L709-Q711 VanDerWaalsContact C-N 3.29Å; L709-Q711 PolarHBondContact O-N 3.22Å; Q711-F715 VanDerWaalsContact O-CD2 3.25Å; Q711-F715 WeakPolarHBondContact O-CD2 3.4Å; Q711-F715 VanDerWaalsContact O-CE2 3.28Å; Q711-F715 WeakPolarHBondContact O-CE2 3.49Å
712	N	90.1	Very high	90.7	Very high	3 Å²	3	45.9 Å²	45.9	2%	0.016	24%	0.239	C	C	.	.	H	α-helix	trans	-67.9	-42.9	167.5	-77	-100.9	0	0	0	111.4	C453 M457 G507 V508 L708 L709 Q710 Q714 F715	C453-N712 PolarHBondContact O-ND2 2.94Å; M457-N712 WeakPolarHBondContact CB-ND2 3.31Å; G507-N712 VanDerWaalsContact CA-O 3.32Å; G507-N712 WeakPolarHBondContact CA-O 3.16Å; V508-N712 HydrophobicContact CG1-CB 3.47Å; V508-N712 VanDerWaalsContact CG1-CB 3.47Å; L708-N712 PolarHBondContact O-N 3.1Å; L708-N712 VanDerWaalsContact O-N 3.15Å; L708-N712 PolarHBondContact O-ND2 3.37Å; L709-N712 WeakPolarHBondContact O-CA 3.13Å; L709-N712 WeakPolarHBondContact O-CB 3.41Å; L709-N712 PolarHBondContact O-N 3.32Å; L709-N712 VanDerWaalsContact O-N 3.08Å; Q710-N712 VanDerWaalsContact C-N 3.31Å; Q710-N712 PolarHBondContact O-N 2.95Å; N712-Q714 PolarHBondContact O-N 2.94Å; N712-Q714 VanDerWaalsContact O-N 3.15Å; N712-F715 PolarHBondContact O-N 3.06Å
713	A	93.5	Very high	90.2	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-66.7	-12.2	-176.3	0	0	0	0	0	114.3	Q273 F276 L277 L709 Q710 F715 Y716	Q273-A713 PolarHBondContact NE2-O 3.42Å; F276-A713 HydrophobicContact CD1-CB 3.86Å; F276-A713 HydrophobicContact CE1-CB 4.15Å; L277-A713 HydrophobicContact CD2-CB 4.01Å; L277-A713 HydrophobicContact CG-CB 4.36Å; L709-A713 PolarHBondContact O-N 3.27Å; Q710-A713 PolarHBondContact O-N 3.29Å; A713-F715 PolarHBondContact O-N 2.9Å; A713-Y716 HydrophobicContact CB-CD2 4.41Å; A713-Y716 HydrophobicContact CB-CE2 4.39Å; A713-Y716 WeakPolarHBondContact O-CD2 3.3Å
714	Q	91.1	Very high	89.9	Confident	98 Å²	98	49.5 Å²	49.5	46%	0.458	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-20.1	169.1	-72.4	163.5	10.9	0	0	113.1	L277 Q710 N712 Y716	L277-Q714 HydrophobicContact CD1-CG 4.47Å; L277-Q714 HydrophobicContact CD2-CG 3.93Å; Q710-Q714 PolarHBondContact O-N 3.1Å; N712-Q714 PolarHBondContact O-N 2.94Å; N712-Q714 VanDerWaalsContact O-N 3.15Å; Q714-Y716 PolarHBondContact O-N 3.28Å
715	F	89	Confident	89.7	Confident	70 Å²	70	51.2 Å²	51.2	31%	0.307	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	11.7	-177.3	-65.9	-87.6	0	0	0	114.7	M457 Y460 L505 Q711 N712 A713 S717	M457-F715 HydrophobicContact CE-CD2 3.9Å; M457-F715 HydrophobicContact CE-CE2 3.47Å; M457-F715 VanDerWaalsContact CE-CE2 3.47Å; M457-F715 HydrophobicContact CE-CZ 4.37Å; Y460-F715 HydrophobicContact CE1-CZ 4.05Å; L505-F715 HydrophobicContact CB-CD1 3.79Å; L505-F715 HydrophobicContact CB-CE1 4.2Å; L505-F715 HydrophobicContact CB-CG 4.15Å; L505-F715 HydrophobicContact CD1-CD1 4.23Å; L505-F715 HydrophobicContact CD1-CE1 3.83Å; L505-F715 HydrophobicContact CD1-CZ 4.49Å; L505-F715 HydrophobicContact CD2-CD1 4.24Å; L505-F715 HydrophobicContact CD2-CD2 4.47Å; L505-F715 HydrophobicContact CD2-CE1 3.93Å; L505-F715 HydrophobicContact CD2-CE2 4.19Å; L505-F715 HydrophobicContact CD2-CZ 3.9Å; L505-F715 HydrophobicContact CG-CD1 4.3Å; L505-F715 HydrophobicContact CG-CE1 4.2Å; L505-F715 WeakPolarHBondContact O-CB 3.08Å; Q711-F715 VanDerWaalsContact O-CD2 3.25Å; Q711-F715 WeakPolarHBondContact O-CD2 3.4Å; Q711-F715 VanDerWaalsContact O-CE2 3.28Å; Q711-F715 WeakPolarHBondContact O-CE2 3.49Å; N712-F715 PolarHBondContact O-N 3.06Å; A713-F715 PolarHBondContact O-N 2.9Å; F715-S717 PolarHBondContact O-N 3.44Å
716	Y	90.4	Very high	89.4	Confident	25 Å²	25	52.5 Å²	52.5	10%	0.098	28%	0.278	C	S	.	.			trans	-81.2	112.1	168.6	-73.4	-70.5	0	0	0	110.8	T269 Q273 T391 G507 V508 I509 A713 Q714 L718	T269-Y716 HydrophobicContact CG2-CD1 3.94Å; T269-Y716 HydrophobicContact CG2-CE1 3.58Å; T269-Y716 HydrophobicContact CG2-CE2 4.24Å; T269-Y716 HydrophobicContact CG2-CG 4.39Å; Q273-Y716 HydrophobicContact CB-CD2 4.42Å; Q273-Y716 HydrophobicContact CG-CD2 4Å; T391-Y716 WeakPolarHBondContact O-CE1 3.5Å; T391-Y716 PolarHBondContact O-OH 2.82Å; G507-Y716 VanDerWaalsContact C-CZ 3.4Å; G507-Y716 PolarHBondContact O-OH 3.42Å; V508-Y716 VanDerWaalsContact CA-OH 3.23Å; V508-Y716 WeakPolarHBondContact CA-OH 3.45Å; V508-Y716 PolarHBondContact N-OH 3.11Å; I509-Y716 HydrophobicContact CD1-CE2 4.13Å; I509-Y716 HydrophobicContact CG1-CE2 3.66Å; I509-Y716 PolarHBondContact N-OH 2.95Å; A713-Y716 HydrophobicContact CB-CD2 4.41Å; A713-Y716 HydrophobicContact CB-CE2 4.39Å; A713-Y716 WeakPolarHBondContact O-CD2 3.3Å; Q714-Y716 PolarHBondContact O-N 3.28Å; Y716-L718 VanDerWaalsContact C-N 3.3Å; Y716-L718 HydrophobicContact CD1-CD1 4.14Å; Y716-L718 PolarHBondContact O-N 3.48Å
717	S	87.2	Confident	89	Confident	119 Å²	119	53.1 Å²	53.1	83%	0.832	28%	0.28	S	S	*	.			trans	-91.5	49.5	175.8	62.8	0	0	0	0	112.4	F715	F715-S717 PolarHBondContact O-N 3.44Å
718	L	88.1	Confident	88.7	Confident	44 Å²	44	52.2 Å²	52.2	23%	0.23	28%	0.276	C	S	.	.			trans	-100.9	147.2	-176.9	-60	178.2	0	0	0	111	E266 T269 V270 Y716	E266-L718 HydrophobicContact CB-CD1 4.31Å; E266-L718 HydrophobicContact CB-CD2 4.24Å; E266-L718 HydrophobicContact CG-CD1 4.4Å; E266-L718 HydrophobicContact CG-CD2 3.94Å; T269-L718 HydrophobicContact CG2-CD1 3.73Å; V270-L718 HydrophobicContact CG2-CB 3.37Å; V270-L718 HydrophobicContact CG2-CD1 4.15Å; V270-L718 HydrophobicContact CG2-CG 4.41Å; Y716-L718 VanDerWaalsContact C-N 3.3Å; Y716-L718 HydrophobicContact CD1-CD1 4.14Å; Y716-L718 PolarHBondContact O-N 3.48Å
719	R	88	Confident	88.5	Confident	217 Å²	217	57.9 Å²	57.9	82%	0.819	30%	0.302	S	S	*	.			trans	-105	130.5	-179.2	-70.1	-178.9	176.7	164.1	-0.6	111	Q267	Q267-R719 PolarHBondContact NE2-O 2.85Å; Q267-R719 PolarHBondContact OE1-O 2.92Å
720	P	89.2	Confident	88.1	Confident	99 Å²	99	60.2 Å²	60.2	64%	0.643	32%	0.319	S	S	*	.			trans	-70.5	131.9	175.5	27.2	-32.9	0	0	0	112	V270	V270-P720 HydrophobicContact CG1-CB 3.92Å
721	E	88	Confident	87.7	Confident	80 Å²	80	61.9 Å²	61.9	37%	0.374	33%	0.325	S	S	.	.			trans	-96.2	121.8	169.9	-78.8	160.4	-135.1	0	0	110.8	T263 Q267 D723 F724 S725	T263-E721 VanDerWaalsContact CG2-OE1 3.24Å; T263-E721 WeakPolarHBondContact CG2-OE1 3.47Å; T263-E721 WeakPolarHBondContact CG2-OE2 3.35Å; Q267-E721 HydrophobicContact CG-CB 4.26Å; Q267-E721 VanDerWaalsContact NE2-CG 3.31Å; Q267-E721 PolarHBondContact NE2-OE1 2.86Å; E721-D723 VanDerWaalsContact C-N 3.32Å; E721-D723 PolarHBondContact O-N 3.22Å; E721-F724 HydrophobicContact CB-CB 4.11Å; E721-S725 WeakPolarHBondContact O-CB 3.46Å; E721-S725 PolarHBondContact O-N 2.69Å
722	P	86	Confident	87.5	Confident	92 Å²	92	65.6 Å²	65.6	60%	0.597	35%	0.35	S	S	*	.	H	α-helix	trans	-68.1	-33	-177.3	27.8	-34.2	0	0	0	112.4	S725 T726	P722-S725 PolarHBondContact O-N 3.39Å; P722-T726 WeakPolarHBondContact O-CB 3.09Å; P722-T726 PolarHBondContact O-N 3.21Å; P722-T726 PolarHBondContact O-OG1 2.99Å
723	D	81.7	Confident	87.4	Confident	84 Å²	84	69.3 Å²	69.3	45%	0.449	37%	0.37	S	S	.	.	H	α-helix	trans	-67.3	-49.9	179.8	-77.6	33.3	0	0	0	111.4	I254 E721 S725 T726 W727	I254-D723 HydrophobicContact CD1-CB 3.82Å; E721-D723 VanDerWaalsContact C-N 3.32Å; E721-D723 PolarHBondContact O-N 3.22Å; D723-S725 VanDerWaalsContact C-N 3.32Å; D723-S725 PolarHBondContact O-N 3.49Å; D723-T726 PolarHBondContact O-N 2.99Å; D723-W727 WeakPolarHBondContact O-CB 3.36Å; D723-W727 PolarHBondContact O-N 3.43Å
724	F	87.5	Confident	87.1	Confident	11 Å²	11	69.8 Å²	69.8	5%	0.048	37%	0.372	C	S	.	.	H	α-helix	trans	-58.2	-45.4	172	179.4	-85.5	0	0	0	111.1	L259 V264 Q267 L268 E721 T726 W727 F728	L259-F724 HydrophobicContact CD1-CD2 4.03Å; L259-F724 HydrophobicContact CD1-CE2 4.32Å; V264-F724 HydrophobicContact CB-CE2 4.37Å; V264-F724 HydrophobicContact CG1-CE2 4.14Å; V264-F724 HydrophobicContact CG1-CZ 4.43Å; V264-F724 HydrophobicContact CG2-CE2 4.2Å; Q267-F724 HydrophobicContact CB-CB 4.4Å; Q267-F724 HydrophobicContact CB-CD1 3.34Å; Q267-F724 HydrophobicContact CB-CD2 4.17Å; Q267-F724 HydrophobicContact CB-CE1 3.51Å; Q267-F724 HydrophobicContact CB-CE2 4.31Å; Q267-F724 HydrophobicContact CB-CG 3.7Å; Q267-F724 HydrophobicContact CB-CZ 4Å; Q267-F724 HydrophobicContact CG-CB 4.13Å; Q267-F724 HydrophobicContact CG-CD1 4.02Å; Q267-F724 HydrophobicContact CG-CD2 4.41Å; Q267-F724 HydrophobicContact CG-CG 3.91Å; L268-F724 HydrophobicContact CD2-CZ 4.21Å; L268-F724 HydrophobicContact CG-CZ 4.17Å; E721-F724 HydrophobicContact CB-CB 4.11Å; F724-T726 VanDerWaalsContact C-N 3.32Å; F724-T726 PolarHBondContact O-N 3.44Å; F724-W727 AromaticContact CD2-CE3 3.98Å; F724-W727 HydrophobicContact CD2-CE3 3.98Å; F724-W727 HydrophobicContact CD2-CZ3 4.14Å; F724-W727 AromaticContact CE2-CE3 3.87Å; F724-W727 HydrophobicContact CE2-CE3 3.87Å; F724-W727 AromaticContact CE2-CZ3 3.55Å; F724-W727 HydrophobicContact CE2-CZ3 3.55Å; F724-W727 HydrophobicContact CG-CE3 4.49Å; F724-W727 HydrophobicContact CZ-CE3 4.31Å; F724-W727 AromaticContact CZ-CZ3 3.85Å; F724-W727 HydrophobicContact CZ-CZ3 3.85Å; F724-W727 PolarHBondContact O-N 3.06Å; F724-F728 HydrophobicContact CD1-CB 4.27Å; F724-F728 HydrophobicContact CE1-CB 3.97Å; F724-F728 HydrophobicContact CE1-CG 4.15Å; F724-F728 HydrophobicContact CZ-CB 4.43Å; F724-F728 WeakPolarHBondContact O-CB 3.46Å; F724-F728 PolarHBondContact O-N 3.02Å
725	S	85.7	Confident	87	Confident	56 Å²	56	68.1 Å²	68.1	39%	0.392	37%	0.371	S	S	.	.	H	α-helix	trans	-60.1	-43.1	178.7	-173.3	0	0	0	0	111.7	E721 P722 D723 F728 H729	E721-S725 WeakPolarHBondContact O-CB 3.46Å; E721-S725 PolarHBondContact O-N 2.69Å; P722-S725 PolarHBondContact O-N 3.39Å; D723-S725 VanDerWaalsContact C-N 3.32Å; D723-S725 PolarHBondContact O-N 3.49Å; S725-F728 PolarHBondContact O-N 3.34Å; S725-H729 PolarHBondContact O-N 3.23Å; S725-H729 PolarHBondContact O-ND1 3.41Å
726	T	85.2	Confident	86.9	Confident	57 Å²	57	67.5 Å²	67.5	35%	0.35	37%	0.369	S	S	.	.	H	α-helix	trans	-63.6	-51.5	178.1	-57.6	0	0	0	0	110.8	P248 P722 D723 F724 F728 H729 S730	P248-T726 HydrophobicContact CB-CG2 4.48Å; P248-T726 HydrophobicContact CG-CG2 4.49Å; P722-T726 WeakPolarHBondContact O-CB 3.09Å; P722-T726 PolarHBondContact O-N 3.21Å; P722-T726 PolarHBondContact O-OG1 2.99Å; D723-T726 PolarHBondContact O-N 2.99Å; F724-T726 VanDerWaalsContact C-N 3.32Å; F724-T726 PolarHBondContact O-N 3.44Å; T726-F728 PolarHBondContact O-N 3.01Å; T726-H729 PolarHBondContact O-N 2.95Å; T726-H729 VanDerWaalsContact O-N 3.17Å; T726-S730 PolarHBondContact O-N 2.84Å; T726-S730 PolarHBondContact O-OG 3.37Å; T726-S730 VanDerWaalsContact O-OG 3.13Å
727	W	86	Confident	86.9	Confident	14 Å²	14	71.3 Å²	71.3	5%	0.053	39%	0.391	C	S	.	.	H	α-helix	trans	-54.6	-49.5	175	166.2	86	0	0	0	112.2	I254 L256 L309 D723 F724 H729 S730 Y731	I254-W727 HydrophobicContact CB-CG 4.45Å; I254-W727 HydrophobicContact CG2-CB 3.88Å; I254-W727 HydrophobicContact CG2-CD2 4.19Å; I254-W727 HydrophobicContact CG2-CG 3.6Å; I254-W727 PolarHBondContact O-NE1 2.84Å; L256-W727 HydrophobicContact CB-CH2 4.35Å; L256-W727 HydrophobicContact CB-CZ2 3.93Å; L256-W727 HydrophobicContact CD1-CH2 4.02Å; L256-W727 HydrophobicContact CD1-CZ2 4.45Å; L309-W727 HydrophobicContact CD1-CH2 4.21Å; L309-W727 HydrophobicContact CD2-CH2 4.26Å; D723-W727 WeakPolarHBondContact O-CB 3.36Å; D723-W727 PolarHBondContact O-N 3.43Å; F724-W727 AromaticContact CD2-CE3 3.98Å; F724-W727 HydrophobicContact CD2-CE3 3.98Å; F724-W727 HydrophobicContact CD2-CZ3 4.14Å; F724-W727 AromaticContact CE2-CE3 3.87Å; F724-W727 HydrophobicContact CE2-CE3 3.87Å; F724-W727 AromaticContact CE2-CZ3 3.55Å; F724-W727 HydrophobicContact CE2-CZ3 3.55Å; F724-W727 HydrophobicContact CG-CE3 4.49Å; F724-W727 HydrophobicContact CZ-CE3 4.31Å; F724-W727 AromaticContact CZ-CZ3 3.85Å; F724-W727 HydrophobicContact CZ-CZ3 3.85Å; F724-W727 PolarHBondContact O-N 3.06Å; W727-H729 PolarHBondContact O-N 3.5Å; W727-S730 PolarHBondContact O-N 3.15Å; W727-S730 VanDerWaalsContact O-N 3.14Å; W727-S730 PolarHBondContact O-OG 2.95Å; W727-Y731 AromaticContact CE2-CD2 3.78Å; W727-Y731 AromaticContact CZ2-CD2 3.64Å; W727-Y731 HydrophobicContact CZ2-CD2 3.64Å; W727-Y731 HydrophobicContact CZ2-CE2 4.05Å; W727-Y731 HydrophobicContact CZ2-CG 4.47Å; W727-Y731 AromaticContact NE1-CD2 3.73Å; W727-Y731 PolarHBondContact O-N 3.31Å
728	F	88.3	Confident	87	Confident	5 Å²	5	68.9 Å²	68.9	2%	0.022	37%	0.367	C	S	.	.	H	α-helix	trans	-65.3	-24.4	-178.4	178.1	-112.8	0	0	0	112.3	L268 Q302 K305 L309 F724 S725 T726	L268-F728 HydrophobicContact CD2-CD2 4.4Å; L268-F728 HydrophobicContact CD2-CE2 3.86Å; L268-F728 HydrophobicContact CD2-CZ 4.05Å; Q302-F728 VanDerWaalsContact OE1-CE1 3.26Å; K305-F728 HydrophobicContact CD-CE1 4.02Å; K305-F728 HydrophobicContact CD-CZ 3.92Å; K305-F728 WeakPolarHBondContact CE-O 3.36Å; K305-F728 HydrophobicContact CG-CZ 4.41Å; K305-F728 PolarHBondContact NZ-O 3.42Å; L309-F728 HydrophobicContact CD1-CD2 3.72Å; L309-F728 HydrophobicContact CD1-CE2 3.94Å; F724-F728 HydrophobicContact CD1-CB 4.27Å; F724-F728 HydrophobicContact CE1-CB 3.97Å; F724-F728 HydrophobicContact CE1-CG 4.15Å; F724-F728 HydrophobicContact CZ-CB 4.43Å; F724-F728 WeakPolarHBondContact O-CB 3.46Å; F724-F728 PolarHBondContact O-N 3.02Å; S725-F728 PolarHBondContact O-N 3.34Å; T726-F728 PolarHBondContact O-N 3.01Å
729	H	86.3	Confident	87.1	Confident	123 Å²	123	66.8 Å²	66.8	57%	0.569	36%	0.356	S	S	*	.	H	α-helix	trans	-90.5	-21.6	174.3	-73.1	86.8	0	0	0	114.1	K305 S725 T726 W727	K305-H729 PolarHBondContact NZ-CD2 3.38Å; K305-H729 PolarHBondContact NZ-NE2 3.06Å; S725-H729 PolarHBondContact O-N 3.23Å; S725-H729 PolarHBondContact O-ND1 3.41Å; T726-H729 PolarHBondContact O-N 2.95Å; T726-H729 VanDerWaalsContact O-N 3.17Å; W727-H729 PolarHBondContact O-N 3.5Å
730	S	85.3	Confident	87.1	Confident	51 Å²	51	59.1 Å²	59.1	36%	0.357	33%	0.33	S	S	.	.	H	α-helix	trans	-94.3	-11.7	176.3	62	0	0	0	0	114.7	I250 T726 W727	I250-S730 WeakPolarHBondContact CD1-OG 3.45Å; T726-S730 PolarHBondContact O-N 2.84Å; T726-S730 PolarHBondContact O-OG 3.37Å; T726-S730 VanDerWaalsContact O-OG 3.13Å; W727-S730 PolarHBondContact O-N 3.15Å; W727-S730 VanDerWaalsContact O-N 3.14Å; W727-S730 PolarHBondContact O-OG 2.95Å
731	Y	84.7	Confident	87.2	Confident	41 Å²	41	59 Å²	59	16%	0.161	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-59.3	127.4	-174.2	-164.9	-84	0	0	0	112.8	L309 W727 L733	L309-Y731 HydrophobicContact CD1-CD1 4.03Å; L309-Y731 HydrophobicContact CD1-CG 3.93Å; L309-Y731 HydrophobicContact CG-CD1 4.02Å; L309-Y731 HydrophobicContact CG-CE1 4.43Å; L309-Y731 HydrophobicContact CG-CG 4.34Å; W727-Y731 AromaticContact CE2-CD2 3.78Å; W727-Y731 AromaticContact CZ2-CD2 3.64Å; W727-Y731 HydrophobicContact CZ2-CD2 3.64Å; W727-Y731 HydrophobicContact CZ2-CE2 4.05Å; W727-Y731 HydrophobicContact CZ2-CG 4.47Å; W727-Y731 AromaticContact NE1-CD2 3.73Å; W727-Y731 PolarHBondContact O-N 3.31Å; Y731-L733 HydrophobicContact CD1-CD2 4.26Å; Y731-L733 PolarHBondContact O-N 3.28Å
732	P	85.4	Confident	87.1	Confident	89 Å²	89	58.3 Å²	58.3	58%	0.578	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-71.7	118.2	-177.4	28.4	-34.3	0	0	0	111.7	N316	N316-P732 PolarHBondContact ND2-O 3.16Å
733	L	88.9	Confident	87.2	Confident	81 Å²	81	53.9 Å²	53.9	42%	0.424	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-95.3	135.6	179.7	-57.6	179.7	0	0	0	111.7	K305 H308 L309 S312 Y731	K305-L733 HydrophobicContact CG-CD1 4.2Å; H308-L733 HydrophobicContact CB-CD1 4.49Å; H308-L733 HydrophobicContact CB-CD2 4.41Å; L309-L733 HydrophobicContact CB-CD2 3.85Å; L309-L733 HydrophobicContact CG-CD2 4.49Å; S312-L733 WeakPolarHBondContact OG-CA 3.43Å; Y731-L733 HydrophobicContact CD1-CD2 4.26Å; Y731-L733 PolarHBondContact O-N 3.28Å
734	I	87.9	Confident	87.5	Confident	10 Å²	10	52.2 Å²	52.2	5%	0.051	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-93.5	156.2	172.3	70	-178.8	0	0	0	111.4	S312 F315 N316 E738 A739	S312-I734 PolarHBondContact OG-N 3.35Å; F315-I734 HydrophobicContact CB-CD1 3.6Å; F315-I734 HydrophobicContact CD2-CD1 4.26Å; F315-I734 HydrophobicContact CG-CD1 4.38Å; N316-I734 WeakPolarHBondContact OD1-CG2 3.32Å; I734-E738 WeakPolarHBondContact CA-OE2 3.48Å; I734-E738 HydrophobicContact CB-CB 4.35Å; I734-E738 HydrophobicContact CB-CG 4.03Å; I734-E738 WeakPolarHBondContact CB-OE2 3.25Å; I734-E738 HydrophobicContact CG2-CG 4.42Å; I734-A739 HydrophobicContact CD1-CB 3.67Å; I734-A739 HydrophobicContact CG1-CB 4.16Å
735	S	88.8	Confident	87.4	Confident	62 Å²	62	57.6 Å²	57.6	43%	0.434	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-75.2	161	173.8	72	0	0	0	0	112.5	N737 E738 A739	S735-N737 VanDerWaalsContact C-N 3.29Å; S735-N737 PolarHBondContact O-N 2.88Å; S735-E738 PolarHBondContact N-OE2 3.13Å; S735-E738 VanDerWaalsContact N-OE2 3.12Å; S735-E738 WeakPolarHBondContact O-CB 3.4Å; S735-E738 PolarHBondContact O-N 3.01Å; S735-E738 VanDerWaalsContact O-N 3.16Å; S735-E738 WeakPolarHBondContact OG-CB 3.32Å; S735-E738 PolarHBondContact OG-N 3.46Å; S735-E738 VanDerWaalsContact OG-N 3.12Å; S735-A739 PolarHBondContact O-N 3.32Å
736	E	86.5	Confident	87.3	Confident	58 Å²	58	57.2 Å²	57.2	27%	0.271	31%	0.307	S	S	.	.	H	α-helix	trans	-64.4	-33.7	178.1	-170.6	156	-153.6	0	0	112.6	Y307 L740 R816	Y307-E736 PolarHBondContact OH-OE1 3.03Å; E736-L740 WeakPolarHBondContact O-CB 3.48Å; E736-L740 PolarHBondContact O-N 3.42Å; E736-L740 VanDerWaalsContact O-N 3.1Å; E736-R816 IonicContact OE2-CZ 2.75Å; E736-R816 IonicContact OE2-NH1 3.62Å; E736-R816 PolarHBondContact OE2-NH1 3.41Å; E736-R816 IonicContact OE2-NH2 3.93Å
737	N	89.3	Confident	87.2	Confident	104 Å²	104	55.5 Å²	55.5	56%	0.556	30%	0.295	S	S	*	.	H	α-helix	trans	-69.4	-39.2	172.7	-68	-6.9	0	0	0	111.6	S735 L740 N741	S735-N737 VanDerWaalsContact C-N 3.29Å; S735-N737 PolarHBondContact O-N 2.88Å; N737-L740 WeakPolarHBondContact O-CB 3.44Å; N737-L740 PolarHBondContact O-N 3.45Å; N737-N741 VanDerWaalsContact O-CG 3.23Å; N737-N741 PolarHBondContact O-N 3.24Å; N737-N741 PolarHBondContact O-OD1 2.92Å
738	E	90.4	Very high	86.8	Confident	69 Å²	69	59 Å²	59	32%	0.322	32%	0.319	S	S	.	.	H	α-helix	trans	-69.1	-40.4	177.1	179.9	178.6	-167.3	0	0	112.1	I734 S735 L740 N741 R742	I734-E738 WeakPolarHBondContact CA-OE2 3.48Å; I734-E738 HydrophobicContact CB-CB 4.35Å; I734-E738 HydrophobicContact CB-CG 4.03Å; I734-E738 WeakPolarHBondContact CB-OE2 3.25Å; I734-E738 HydrophobicContact CG2-CG 4.42Å; S735-E738 PolarHBondContact N-OE2 3.13Å; S735-E738 VanDerWaalsContact N-OE2 3.12Å; S735-E738 WeakPolarHBondContact O-CB 3.4Å; S735-E738 PolarHBondContact O-N 3.01Å; S735-E738 VanDerWaalsContact O-N 3.16Å; S735-E738 WeakPolarHBondContact OG-CB 3.32Å; S735-E738 PolarHBondContact OG-N 3.46Å; S735-E738 VanDerWaalsContact OG-N 3.12Å; E738-L740 VanDerWaalsContact C-N 3.27Å; E738-L740 PolarHBondContact O-N 3.19Å; E738-N741 PolarHBondContact O-N 3.2Å; E738-R742 HydrophobicContact CG-CG 4.5Å; E738-R742 WeakPolarHBondContact O-CB 3.27Å; E738-R742 WeakPolarHBondContact O-CG 3.43Å; E738-R742 PolarHBondContact O-N 2.78Å; E738-R742 IonicContact OE1-CZ 3.88Å; E738-R742 IonicContact OE1-NE 3.78Å; E738-R742 IonicContact OE1-NH2 3.38Å; E738-R742 PolarHBondContact OE1-NH2 3.23Å
739	A	89.2	Confident	85.8	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-58.8	-39.9	169.9	0	0	0	0	0	111.5	Q311 F315 P408 I734 S735 S743	Q311-A739 HydrophobicContact CB-CB 4.38Å; F315-A739 HydrophobicContact CD2-CB 3.88Å; F315-A739 HydrophobicContact CE2-CB 4.31Å; P408-A739 HydrophobicContact CB-CB 3.99Å; P408-A739 WeakPolarHBondContact CB-O 3.33Å; P408-A739 HydrophobicContact CG-CB 3.93Å; I734-A739 HydrophobicContact CD1-CB 3.67Å; I734-A739 HydrophobicContact CG1-CB 4.16Å; S735-A739 PolarHBondContact O-N 3.32Å; A739-S743 VanDerWaalsContact O-CB 3.25Å; A739-S743 WeakPolarHBondContact O-CB 3.38Å; A739-S743 PolarHBondContact O-N 2.96Å
740	L	89.3	Confident	84.4	Confident	55 Å²	55	61.2 Å²	61.2	29%	0.288	35%	0.346	S	S	.	.	H	α-helix	trans	-67.1	-43.5	176.1	-175.9	62.1	0	0	0	112.4	T407 E736 N737 E738 S743 C744	T407-L740 HydrophobicContact CG2-CD1 4.07Å; E736-L740 WeakPolarHBondContact O-CB 3.48Å; E736-L740 PolarHBondContact O-N 3.42Å; E736-L740 VanDerWaalsContact O-N 3.1Å; N737-L740 WeakPolarHBondContact O-CB 3.44Å; N737-L740 PolarHBondContact O-N 3.45Å; E738-L740 VanDerWaalsContact C-N 3.27Å; E738-L740 PolarHBondContact O-N 3.19Å; L740-S743 CarbonylContact O-C 3.53Å; L740-S743 PolarHBondContact O-N 3.42Å; L740-C744 PolarHBondContact O-N 3.09Å; L740-C744 PolarHBondContact O-SG 3.01Å
741	N	90	Very high	82.6	Confident	96 Å²	96	66.8 Å²	66.8	51%	0.513	37%	0.367	S	S	.	.	H	α-helix	trans	-64.9	-52.5	177.8	-70.1	-6.2	0	0	0	111.3	N737 E738 S743 C744 D745	N737-N741 VanDerWaalsContact O-CG 3.23Å; N737-N741 PolarHBondContact O-N 3.24Å; N737-N741 PolarHBondContact O-OD1 2.92Å; E738-N741 PolarHBondContact O-N 3.2Å; N741-S743 PolarHBondContact O-N 3Å; N741-S743 VanDerWaalsContact O-N 3.1Å; N741-C744 VanDerWaalsContact O-CA 3.3Å; N741-C744 WeakPolarHBondContact O-CA 3.23Å; N741-C744 WeakPolarHBondContact O-CB 3.41Å; N741-C744 PolarHBondContact O-N 3.48Å; N741-D745 PolarHBondContact O-N 3.33Å
742	R	87.5	Confident	80.7	Confident	66 Å²	66	73.8 Å²	73.8	25%	0.249	40%	0.401	C	S	.	.	H	α-helix	trans	-58.5	-29.5	175.9	-65.2	-174.9	-168.3	-171.4	7.8	112.1	F315 N316 E738 D745 L746	F315-R742 HydrophobicContact CB-CB 4.17Å; F315-R742 HydrophobicContact CD1-CB 4.46Å; F315-R742 WeakPolarHBondContact O-CD 3.33Å; F315-R742 PolarHBondContact O-NH1 2.93Å; N316-R742 PolarHBondContact OD1-NH1 3.21Å; E738-R742 HydrophobicContact CG-CG 4.5Å; E738-R742 WeakPolarHBondContact O-CB 3.27Å; E738-R742 WeakPolarHBondContact O-CG 3.43Å; E738-R742 PolarHBondContact O-N 2.78Å; E738-R742 IonicContact OE1-CZ 3.88Å; E738-R742 IonicContact OE1-NE 3.78Å; E738-R742 IonicContact OE1-NH2 3.38Å; E738-R742 PolarHBondContact OE1-NH2 3.23Å; R742-D745 WeakPolarHBondContact CA-OD2 3.47Å; R742-D745 PolarHBondContact O-N 2.84Å; R742-L746 WeakPolarHBondContact O-CD1 3.5Å; R742-L746 VanDerWaalsContact O-CG 3.22Å; R742-L746 WeakPolarHBondContact O-CG 3.34Å; R742-L746 PolarHBondContact O-N 3.44Å; R742-L746 VanDerWaalsContact O-N 3.11Å
743	S	88.2	Confident	78.7	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-79.7	-18.7	171.5	-169.2	0	0	0	0	114.8	P408 R411 L412 A739 L740 N741 E747	P408-S743 PolarHBondContact O-OG 2.64Å; R411-S743 WeakPolarHBondContact CD-OG 3.48Å; R411-S743 VanDerWaalsContact CG-OG 3.22Å; R411-S743 WeakPolarHBondContact CG-OG 3.38Å; R411-S743 VanDerWaalsContact CZ-O 3.27Å; R411-S743 PolarHBondContact NE-O 2.87Å; L412-S743 WeakPolarHBondContact CD2-OG 3.38Å; A739-S743 VanDerWaalsContact O-CB 3.25Å; A739-S743 WeakPolarHBondContact O-CB 3.38Å; A739-S743 PolarHBondContact O-N 2.96Å; L740-S743 CarbonylContact O-C 3.53Å; L740-S743 PolarHBondContact O-N 3.42Å; N741-S743 PolarHBondContact O-N 3Å; N741-S743 VanDerWaalsContact O-N 3.1Å; S743-E747 PolarHBondContact O-N 2.94Å
744	C	86.7	Confident	76.4	Confident	49 Å²	49	73.8 Å²	73.8	33%	0.331	39%	0.392	S	S	.	.	H	α-helix	trans	-64.7	-44.1	161.6	-62.4	0	0	0	0	110.6	R411 L740 N741 E747 P748	R411-C744 PolarHBondContact NH1-SG 3.39Å; L740-C744 PolarHBondContact O-N 3.09Å; L740-C744 PolarHBondContact O-SG 3.01Å; N741-C744 VanDerWaalsContact O-CA 3.3Å; N741-C744 WeakPolarHBondContact O-CA 3.23Å; N741-C744 WeakPolarHBondContact O-CB 3.41Å; N741-C744 PolarHBondContact O-N 3.48Å; C744-E747 CarbonylContact O-C 3.49Å; C744-P748 WeakPolarHBondContact O-CA 3.34Å
745	D	85.4	Confident	74.1	Confident	124 Å²	124	80.9 Å²	80.9	66%	0.663	43%	0.425	S	S	*	.	H	α-helix	trans	-71.1	-34.1	-173.3	-49.5	-32.9	0	0	0	111.8	N741 R742	N741-D745 PolarHBondContact O-N 3.33Å; R742-D745 WeakPolarHBondContact CA-OD2 3.47Å; R742-D745 PolarHBondContact O-N 2.84Å
746	L	83.7	Confident	71.9	Confident	47 Å²	47	81.8 Å²	81.8	25%	0.246	42%	0.422	C	S	.	.	H	α-helix	trans	-78.8	-42.9	178.7	-69.1	165	0	0	0	114.4	F315 V370 R742	F315-L746 HydrophobicContact CD1-CD1 3.64Å; F315-L746 HydrophobicContact CE1-CD1 3.95Å; V370-L746 HydrophobicContact CG1-CD2 3.59Å; R742-L746 WeakPolarHBondContact O-CD1 3.5Å; R742-L746 VanDerWaalsContact O-CG 3.22Å; R742-L746 WeakPolarHBondContact O-CG 3.34Å; R742-L746 PolarHBondContact O-N 3.44Å; R742-L746 VanDerWaalsContact O-N 3.11Å
747	E	82.6	Confident	69.7	Low	21 Å²	21	83.6 Å²	83.6	10%	0.098	44%	0.436	C	S	.	.	S	Bend	trans	-133.3	87.1	177.5	-70.2	-169.2	-143.6	0	0	109.2	R411 L412 W413 H414 S415 S743 C744	R411-E747 PolarHBondContact NH2-O 3.37Å; L412-E747 VanDerWaalsContact C-OE1 3.31Å; L412-E747 VanDerWaalsContact CA-CD 3.43Å; L412-E747 VanDerWaalsContact CA-OE1 3.27Å; L412-E747 WeakPolarHBondContact CA-OE1 3.5Å; L412-E747 WeakPolarHBondContact CA-OE2 3.44Å; L412-E747 WeakPolarHBondContact CB-OE1 3.43Å; L412-E747 HydrophobicContact CD2-CB 4.24Å; L412-E747 HydrophobicContact CD2-CG 3.95Å; W413-E747 PolarHBondContact N-OE2 3.22Å; H414-E747 PolarHBondContact N-OE2 3.3Å; S415-E747 PolarHBondContact N-OE1 2.01Å; S415-E747 PolarHBondContact OG-OE1 3Å; S415-E747 VanDerWaalsContact OG-OE1 3.05Å; S743-E747 PolarHBondContact O-N 2.94Å; C744-E747 CarbonylContact O-C 3.49Å
748	P	77.8	Confident	67.2	Low	88 Å²	88	83 Å²	83	57%	0.571	43%	0.433	S	S	*	.			trans	-57.3	158.8	179.7	-28.2	36.8	0	0	0	114.5	C744 D750	C744-P748 WeakPolarHBondContact O-CA 3.34Å; P748-D750 PolarHBondContact O-N 3.44Å; P748-D750 VanDerWaalsContact O-N 3.15Å
749	A	68.7	Low	64.7	Low	78 Å²	78	87.2 Å²	87.2	65%	0.645	45%	0.446	S	S	*	.			trans	-87.2	80.4	-173.4	0	0	0	0	0	112.6	E751	A749-E751 PolarHBondContact O-N 2.91Å; A749-E751 VanDerWaalsContact O-N 3.17Å
750	D	56.7	Low	62.1	Low	96 Å²	96	89.1 Å²	89.1	51%	0.513	46%	0.459	S	S	.	.			trans	-55.6	116.5	174.8	-85.2	-35.7	0	0	0	112.3	P748 Q752 M753	P748-D750 PolarHBondContact O-N 3.44Å; P748-D750 VanDerWaalsContact O-N 3.15Å; D750-Q752 PolarHBondContact O-N 3.48Å; D750-M753 HydrophobicContact CB-CB 3.97Å; D750-M753 HydrophobicContact CB-CG 4.03Å; D750-M753 PolarHBondContact O-N 2.96Å
751	E	47.9	Very low	59.7	Low	168 Å²	168	89.7 Å²	89.7	79%	0.785	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-57.9	-33.6	177.3	-62.6	-168.2	137.4	0	0	112.2	A749 M753	A749-E751 PolarHBondContact O-N 2.91Å; A749-E751 VanDerWaalsContact O-N 3.17Å; E751-M753 VanDerWaalsContact C-N 3.31Å; E751-M753 PolarHBondContact O-N 3.29Å
752	Q	43.1	Very low	57	Low	188 Å²	188	94.5 Å²	94.5	88%	0.879	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-71.9	-22	177.7	-58.2	-168.6	14.1	0	0	113.2	D750	D750-Q752 PolarHBondContact O-N 3.48Å
753	M	43.3	Very low	54.6	Low	50 Å²	50	100.5 Å²	100.5	25%	0.246	49%	0.493	C	S	.	.	G	3₁₀ helix	trans	-94.9	0.4	-179.5	-68.6	-141.9	65.9	0	0	114.4	W413 D750 E751 Q755 H756 V757	W413-M753 HydrophobicContact CE3-CE 4.35Å; W413-M753 HydrophobicContact CH2-CE 4.13Å; W413-M753 HydrophobicContact CH2-SD 3.58Å; W413-M753 VanDerWaalsContact CH2-SD 3.58Å; W413-M753 HydrophobicContact CZ2-CE 4.43Å; W413-M753 HydrophobicContact CZ2-SD 3.52Å; W413-M753 VanDerWaalsContact CZ2-SD 3.52Å; W413-M753 HydrophobicContact CZ3-CE 4.08Å; W413-M753 HydrophobicContact CZ3-SD 4.15Å; D750-M753 HydrophobicContact CB-CB 3.97Å; D750-M753 HydrophobicContact CB-CG 4.03Å; D750-M753 PolarHBondContact O-N 2.96Å; E751-M753 VanDerWaalsContact C-N 3.31Å; E751-M753 PolarHBondContact O-N 3.29Å; M753-Q755 PolarHBondContact O-N 2.99Å; M753-Q755 VanDerWaalsContact O-N 3.13Å; M753-H756 HydrophobicContact CE-CB 3.57Å; M753-H756 WeakPolarHBondContact O-CA 3.42Å; M753-H756 WeakPolarHBondContact O-CB 3.31Å; M753-H756 PolarHBondContact O-N 3.02Å; M753-V757 PolarHBondContact O-N 2.81Å
754	Q	40.5	Very low	52.3	Low	120 Å²	120	102.7 Å²	102.7	56%	0.561	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-23.9	178.3	-62.5	-170.7	15.2	0	0	113.4	H756	Q754-H756 VanDerWaalsContact C-N 3.31Å; Q754-H756 PolarHBondContact O-N 2.89Å
755	Q	40.6	Very low	49.8	Very low	159 Å²	159	104 Å²	104	74%	0.743	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-25.6	170.1	-60.2	-169.7	20.2	0	0	113.3	M753	M753-Q755 PolarHBondContact O-N 2.99Å; M753-Q755 VanDerWaalsContact O-N 3.13Å
756	H	41.6	Very low	47.4	Very low	82 Å²	82	102.4 Å²	102.4	38%	0.38	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-21.2	-179.4	-100.7	-120.8	0	0	0	113.9	M753 Q754 N758 R759 P760	M753-H756 HydrophobicContact CE-CB 3.57Å; M753-H756 WeakPolarHBondContact O-CA 3.42Å; M753-H756 WeakPolarHBondContact O-CB 3.31Å; M753-H756 PolarHBondContact O-N 3.02Å; Q754-H756 VanDerWaalsContact C-N 3.31Å; Q754-H756 PolarHBondContact O-N 2.89Å; H756-N758 PolarHBondContact O-N 3.5Å; H756-N758 VanDerWaalsContact O-N 3.1Å; H756-R759 PolarHBondContact NE2-NH1 3.43Å; H756-R759 WeakPolarHBondContact O-CB 3.34Å; H756-R759 PolarHBondContact O-N 3.13Å; H756-P760 WeakPolarHBondContact O-CD 3.4Å
757	V	41.7	Very low	44.8	Very low	95 Å²	95	106.1 Å²	106.1	58%	0.576	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-29.4	173.8	-177.4	0	0	0	0	111.6	M753 R759	M753-V757 PolarHBondContact O-N 2.81Å; V757-R759 PolarHBondContact O-N 3.43Å
758	N	36.1	Very low	42.6	Very low	92 Å²	92	111.1 Å²	111.1	49%	0.492	55%	0.549	S	S	.	.	H	α-helix	trans	-76.2	-11.7	175.1	-79.5	-71.8	0	0	0	115.1	H756 R762	H756-N758 PolarHBondContact O-N 3.5Å; H756-N758 VanDerWaalsContact O-N 3.1Å; N758-R762 WeakPolarHBondContact O-CB 3.47Å; N758-R762 VanDerWaalsContact O-CG 3.24Å; N758-R762 WeakPolarHBondContact O-CG 3.48Å
759	R	37.8	Very low	40.4	Very low	158 Å²	158	111.3 Å²	111.3	60%	0.596	55%	0.553	S	S	*	*	H	α-helix	trans	-86.1	-46.7	-170.4	-69.1	-175.1	171.4	-171	-10	115.2	H756 V757	H756-R759 PolarHBondContact NE2-NH1 3.43Å; H756-R759 WeakPolarHBondContact O-CB 3.34Å; H756-R759 PolarHBondContact O-N 3.13Å; V757-R759 PolarHBondContact O-N 3.43Å
760	P	34.2	Very low	38.8	Very low	39 Å²	39	111.7 Å²	111.7	25%	0.253	56%	0.556	S	S	.	*	H	α-helix	trans	-68	-44.4	175	24.8	-29.8	0	0	0	110.8	H756 R762 R763 F764	H756-P760 WeakPolarHBondContact O-CD 3.4Å; P760-R762 PolarHBondContact O-N 3.03Å; P760-R763 CarbonylContact O-C 3.58Å; P760-R763 WeakPolarHBondContact O-CA 3.42Å; P760-R763 WeakPolarHBondContact O-CB 3.4Å; P760-R763 PolarHBondContact O-N 3.25Å; P760-F764 HydrophobicContact CB-CE2 4.34Å; P760-F764 VanDerWaalsContact O-CD2 3.29Å; P760-F764 WeakPolarHBondContact O-CD2 3.24Å; P760-F764 PolarHBondContact O-N 3.17Å
761	F	39.5	Very low	37.6	Very low	68 Å²	68	112.6 Å²	112.6	30%	0.298	57%	0.565	S	S	.	*	H	α-helix	trans	-70.6	-26.5	-172.6	-68.2	-72.3	0	0	0	115.1	L410 R763 F764 S765	L410-F761 HydrophobicContact CB-CZ 4.01Å; L410-F761 HydrophobicContact CD1-CE1 3.9Å; L410-F761 HydrophobicContact CD1-CZ 3.95Å; L410-F761 HydrophobicContact CD2-CE1 4.18Å; L410-F761 HydrophobicContact CD2-CZ 4Å; L410-F761 HydrophobicContact CG-CZ 4.21Å; F761-R763 PolarHBondContact O-N 2.8Å; F761-F764 HydrophobicContact CD1-CB 4.24Å; F761-F764 HydrophobicContact CD1-CD2 4Å; F761-F764 HydrophobicContact CD1-CG 4.43Å; F761-F764 HydrophobicContact CE1-CD2 4.17Å; F761-F764 PolarHBondContact O-N 2.9Å; F761-S765 PolarHBondContact O-N 3.48Å
762	R	33.6	Very low	36.6	Very low	197 Å²	197	113.8 Å²	113.8	74%	0.743	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-13.7	167.6	-76.7	-178.2	-176.4	-143.5	2.1	113.8	N758 P760	N758-R762 WeakPolarHBondContact O-CB 3.47Å; N758-R762 VanDerWaalsContact O-CG 3.24Å; N758-R762 WeakPolarHBondContact O-CG 3.48Å; P760-R762 PolarHBondContact O-N 3.03Å
763	R	36.7	Very low	36.1	Very low	192 Å²	192	110.6 Å²	110.6	73%	0.725	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	1.7	168.6	-76.1	-177.9	167.6	-176.4	-2.9	114	P760 F761	P760-R763 CarbonylContact O-C 3.58Å; P760-R763 WeakPolarHBondContact O-CA 3.42Å; P760-R763 WeakPolarHBondContact O-CB 3.4Å; P760-R763 PolarHBondContact O-N 3.25Å; F761-R763 PolarHBondContact O-N 2.8Å
764	F	40.8	Very low	35.4	Very low	46 Å²	46	113.3 Å²	113.3	20%	0.202	59%	0.593	C	S	.	*	T	Hydrogen-bonded Turn	trans	-102.1	-13.8	170.9	-79.3	-75.3	0	0	0	113.2	F427 F430 K431 P760 F761 I766	F427-F764 HydrophobicContact CE2-CE1 4.47Å; F427-F764 HydrophobicContact CE2-CE2 4.44Å; F427-F764 AromaticContact CE2-CZ 3.64Å; F427-F764 HydrophobicContact CE2-CZ 3.64Å; F427-F764 HydrophobicContact CZ-CE1 4.37Å; F427-F764 HydrophobicContact CZ-CE2 4.26Å; F427-F764 AromaticContact CZ-CZ 3.63Å; F427-F764 HydrophobicContact CZ-CZ 3.63Å; F430-F764 HydrophobicContact CD1-CE1 4.35Å; F430-F764 HydrophobicContact CE1-CE1 4.02Å; F430-F764 HydrophobicContact CE1-CZ 4.4Å; K431-F764 HydrophobicContact CD-CE1 4.16Å; K431-F764 HydrophobicContact CG-CD1 4.29Å; K431-F764 HydrophobicContact CG-CE1 3.74Å; P760-F764 HydrophobicContact CB-CE2 4.34Å; P760-F764 VanDerWaalsContact O-CD2 3.29Å; P760-F764 WeakPolarHBondContact O-CD2 3.24Å; P760-F764 PolarHBondContact O-N 3.17Å; F761-F764 HydrophobicContact CD1-CB 4.24Å; F761-F764 HydrophobicContact CD1-CD2 4Å; F761-F764 HydrophobicContact CD1-CG 4.43Å; F761-F764 HydrophobicContact CE1-CD2 4.17Å; F761-F764 PolarHBondContact O-N 2.9Å; F764-I766 PolarHBondContact O-N 2.98Å
765	S	33.1	Very low	35	Very low	75 Å²	75	113 Å²	113	52%	0.524	60%	0.604	S	S	.	*	S	Bend	trans	-60.4	105.5	157	-69.9	0	0	0	0	109.1	F761 D767	F761-S765 PolarHBondContact O-N 3.48Å; S765-D767 PolarHBondContact O-N 2.98Å
766	I	36	Very low	34.6	Very low	92 Å²	92	109.7 Å²	109.7	47%	0.472	60%	0.596	S	S	.	*			trans	-73.4	98.4	173.9	-56.2	176.5	0	0	0	107.3	F764 L768	F764-I766 PolarHBondContact O-N 2.98Å; I766-L768 HydrophobicContact CG2-CB 4.33Å; I766-L768 HydrophobicContact CG2-CD1 3.73Å; I766-L768 PolarHBondContact O-N 3.37Å
767	D	29.4	Very low	34.1	Very low	124 Å²	124	116.5 Å²	116.5	66%	0.663	62%	0.62	S	S	*	*			trans	-76.4	73.9	176.4	-152.1	-28.1	0	0	0	110.2	S765 S769 A770	S765-D767 PolarHBondContact O-N 2.98Å; D767-S769 PolarHBondContact O-N 2.84Å; D767-S769 WeakPolarHBondContact OD1-CB 3.41Å; D767-S769 PolarHBondContact OD1-OG 2.96Å; D767-A770 PolarHBondContact O-N 3.37Å
768	L	35.8	Very low	33.4	Very low	126 Å²	126	117.6 Å²	117.6	66%	0.66	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-69	3	-174.7	-149.6	74.4	0	0	0	113	I766 A770	I766-L768 HydrophobicContact CG2-CB 4.33Å; I766-L768 HydrophobicContact CG2-CD1 3.73Å; I766-L768 PolarHBondContact O-N 3.37Å; L768-A770 PolarHBondContact O-N 3.44Å
769	S	32.3	Very low	33.2	Very low	93 Å²	93	123.2 Å²	123.2	65%	0.65	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-66.3	-24.6	172.3	67.7	0	0	0	0	113.2	D767 V771	D767-S769 PolarHBondContact O-N 2.84Å; D767-S769 WeakPolarHBondContact OD1-CB 3.41Å; D767-S769 PolarHBondContact OD1-OG 2.96Å; S769-V771 PolarHBondContact O-N 3.06Å
770	A	33.3	Very low	32.6	Very low	86 Å²	86	121.7 Å²	121.7	71%	0.711	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-83	-4.3	-171.6	0	0	0	0	0	115.5	D767 L768	D767-A770 PolarHBondContact O-N 3.37Å; L768-A770 PolarHBondContact O-N 3.44Å
771	V	32.6	Very low	32.6	Very low	115 Å²	115	126.9 Å²	126.9	70%	0.697	68%	0.682	S	S	*	*			trans	-116	79.5	-177.3	-171.2	0	0	0	0	111	S769 P773	S769-V771 PolarHBondContact O-N 3.06Å; V771-P773 WeakPolarHBondContact O-CD 3.15Å
772	K	27	Very low	32.1	Very low	193 Å²	193	128.2 Å²	128.2	84%	0.839	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-70.7	124.4	166.8	-74.7	-177.1	177.2	178.3	0	109.8	A774	K772-A774 PolarHBondContact O-N 2.92Å
773	P	32.5	Very low	32	Very low	121 Å²	121	125.6 Å²	125.6	79%	0.786	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-70.4	124.8	164.9	29.5	-31.8	0	0	0	109	V771 S775	V771-P773 WeakPolarHBondContact O-CD 3.15Å; P773-S775 PolarHBondContact O-N 3.29Å
774	A	28.5	Very low	31.9	Very low	106 Å²	106	121 Å²	121	88%	0.876	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-69.9	120.7	176.3	0	0	0	0	0	110.5	K772	K772-A774 PolarHBondContact O-N 2.92Å
775	S	32.2	Very low	31.3	Very low	113 Å²	113	124.6 Å²	124.6	79%	0.79	73%	0.729	S	S	*	*			trans	-109.2	120.6	167.4	-172.3	0	0	0	0	108.4	P773	P773-S775 PolarHBondContact O-N 3.29Å
776	P	31.4	Very low	31.3	Very low	90 Å²	90	125 Å²	125	58%	0.584	75%	0.746	S	S	*	*			trans	-78.9	171.1	173.3	33.3	-34.3	0	0	0	111.9
777	Y	32.3	Very low	31	Very low	225 Å²	225	125.4 Å²	125.4	88%	0.882	76%	0.763	S	S	*	*			trans	77.1	93	173.6	-54.4	-66.4	0	0	0	116.8
778	T	26.3	Very low	31.2	Very low	118 Å²	118	126.5 Å²	126.5	72%	0.724	77%	0.773	S	S	*	*			trans	-72.5	156.6	160.8	43.1	0	0	0	0	111.9
779	F	31.7	Very low	30.9	Very low	210 Å²	210	126.8 Å²	126.8	92%	0.921	78%	0.776	S	S	*	*			trans	-148.1	136.3	135.5	-137.9	-89.1	0	0	0	108.5
780	D	26.5	Very low	30.9	Very low	127 Å²	127	129.2 Å²	129.2	68%	0.679	78%	0.78	S	S	*	*			trans	-88.8	152.3	-167.7	-60.3	-75.8	0	0	0	113.6
781	T	32.5	Very low	30.9	Very low	147 Å²	147	132.3 Å²	132.3	90%	0.902	78%	0.783	S	S	*	*			trans	-163.9	150.6	131.4	5.9	0	0	0	0	110.1
782	S	28.7	Very low	30.7	Very low	97 Å²	97	133.5 Å²	133.5	68%	0.678	79%	0.785	S	S	*	*			trans	-89.2	162.8	-176.1	52.5	0	0	0	0	112.7
783	D	32.8	Very low	31.1	Very low	142 Å²	142	130.3 Å²	130.3	76%	0.759	78%	0.782	S	S	*	*				-176.3	146.9	108	-90	-3.3	0	0	0	115.5
784	S	34	Very low	31.2	Very low	95 Å²	95	131.9 Å²	131.9	66%	0.664	78%	0.784	S	S	*	*			trans	-2.5	117.2	157.7	52.9	0	0	0	0	118
785	S	29.4	Very low	31.4	Very low	121 Å²	121	136 Å²	136	85%	0.846	78%	0.782	S	S	*	*				77.3	124.9	74	80.6	0	0	0	0	115.8
786	G	32.4	Very low	31.4	Very low	85 Å²	85	136.7 Å²	136.7	88%	0.876	78%	0.784	S	S	*	*			trans	176.9	112.8	170	0	0	0	0	0	111
787	A	28.8	Very low	31.1	Very low	100 Å²	100	143.4 Å²	143.4	83%	0.826	80%	0.798	S	S	*	*			trans	-134.9	130.7	-175.8	0	0	0	0	0	111.3
788	V	33.5	Very low	31.1	Very low	146 Å²	146	142 Å²	142	89%	0.885	80%	0.799	S	S	*	*			trans	-152.8	162.3	167.4	-166.4	0	0	0	0	107.5
789	D	30.7	Very low	31.3	Very low	133 Å²	133	144.5 Å²	144.5	71%	0.711	80%	0.802	S	S	*	*				-164.8	171.7	-78	-164.9	0.6	0	0	0	107
790	I	32.1	Very low	31	Very low	143 Å²	143	144.9 Å²	144.9	73%	0.733	80%	0.797	S	S	*	*			trans	71.3	140.1	165.5	-51.5	148.6	0	0	0	112.6
791	I	33.9	Very low	31	Very low	151 Å²	151	145.2 Å²	145.2	77%	0.774	80%	0.799	S	S	*	*			cis	-126.1	153.2	28.1	-61	164.8	0	0	0	111.6	T793	I791-T793 HydrophobicContact CG2-CG2 4.31Å
792	N	28	Very low	31	Very low	141 Å²	141	145.7 Å²	145.7	75%	0.754	80%	0.796	S	S	*	*			trans	-125.9	137	174.3	-178.5	16.3	0	0	0	110.9
793	T	35.6	Very low	30.8	Very low	125 Å²	125	147.4 Å²	147.4	77%	0.767	80%	0.803	S	S	*	*			trans	-138.9	154.5	175	54	0	0	0	0	112.7	I791	I791-T793 HydrophobicContact CG2-CG2 4.31Å
794	N	33.6	Very low	30.6	Very low	155 Å²	155	147.6 Å²	147.6	83%	0.829	80%	0.804	S	S	*	*			trans	-97	161.5	-152.4	-78.8	-62.4	0	0	0	117
795	K	32.9	Very low	30.2	Very low	192 Å²	192	150.9 Å²	150.9	84%	0.835	81%	0.812	S	S	*	*			trans	-66.1	170.2	169.5	-60.6	169.5	-179.4	168.1	0	112.1
796	P	32.2	Very low	30.1	Very low	128 Å²	128	153.2 Å²	153.2	83%	0.831	81%	0.809	S	S	*	*				-128.2	169.5	113.2	36.9	-32.2	0	0	0	114.5
797	R	25.4	Very low	29.9	Very low	231 Å²	231	154 Å²	154	87%	0.872	80%	0.797	S	S	*	*			trans	-92.2	148	171	-69.8	168.2	163	156	-8.1	109.9
798	H	33.1	Very low	29.7	Very low	196 Å²	196	158.3 Å²	158.3	91%	0.907	80%	0.8	S	S	*	*			trans	-144.1	175.1	143.5	-103.8	-79.7	0	0	0	110.4
799	Q	29.9	Very low	29.5	Very low	169 Å²	169	160.2 Å²	160.2	79%	0.79	79%	0.791	S	S	*	*			trans	-114.7	161	-160.8	-59.5	176.7	-20.3	0	0	113.1
800	R	25.9	Very low	29.4	Very low	218 Å²	218	157.2 Å²	157.2	82%	0.823	78%	0.781	S	S	*	*			trans	29.3	124.1	140	-77.3	-177.8	175.9	164.6	-3.9	117.7
801	N	26.3	Very low	29.3	Very low	135 Å²	135	160 Å²	160	72%	0.722	79%	0.788	S	S	*	*			cis	-151.6	162.3	21.3	-65.4	-54.3	0	0	0	110.1
802	D	31	Very low	29.1	Very low	156 Å²	156	158.6 Å²	158.6	83%	0.834	77%	0.773	S	S	*	*				-169.9	154.5	123.4	-103.3	-19.5	0	0	0	112.5	N804	D802-N804 PolarHBondContact O-N 2.96Å
803	T	25.9	Very low	29	Very low	133 Å²	133	156 Å²	156	82%	0.816	77%	0.771	S	S	*	*			trans	-87.6	99.7	-172.9	49.5	0	0	0	0	112.4
804	N	28.4	Very low	28.7	Very low	147 Å²	147	155.5 Å²	155.5	79%	0.786	76%	0.763	S	S	*	*			trans	-139.8	106.1	162.7	-88.8	-69.2	0	0	0	110.2	D802 H806	D802-N804 PolarHBondContact O-N 2.96Å; N804-H806 PolarHBondContact O-N 3.37Å
805	I	26.1	Very low	28.7	Very low	163 Å²	163	152 Å²	152	84%	0.836	75%	0.747	S	S	*	*			trans	-78.6	78.3	175.6	-56.1	178.8	0	0	0	108.2	V807	I805-V807 HydrophobicContact CG2-CG2 4.26Å; I805-V807 PolarHBondContact O-N 3.02Å
806	H	25.5	Very low	29	Very low	171 Å²	171	149 Å²	149	79%	0.792	73%	0.73	S	S	*	*			trans	-76.8	88.7	-180	-155.4	-65.8	0	0	0	109.9	N804 E808	N804-H806 PolarHBondContact O-N 3.37Å; H806-E808 PolarHBondContact O-N 3.05Å; H806-E808 VanDerWaalsContact O-N 3.07Å
807	V	28.2	Very low	28.9	Very low	102 Å²	102	143.7 Å²	143.7	62%	0.618	70%	0.696	S	S	*	*			trans	-62	110.7	-179.3	179.6	0	0	0	0	110.2	I805 R809	I805-V807 HydrophobicContact CG2-CG2 4.26Å; I805-V807 PolarHBondContact O-N 3.02Å; V807-R809 HydrophobicContact CG1-CG 4.32Å; V807-R809 PolarHBondContact O-N 2.81Å
808	E	25.8	Very low	29.3	Very low	190 Å²	190	137.4 Å²	137.4	89%	0.888	69%	0.685	S	S	*	*			trans	-67.3	81.4	169	-73.9	-167	105.4	0	0	110.5	H806 S810	H806-E808 PolarHBondContact O-N 3.05Å; H806-E808 VanDerWaalsContact O-N 3.07Å; E808-S810 PolarHBondContact O-N 3.45Å
809	R	28.5	Very low	29.2	Very low	186 Å²	186	131.8 Å²	131.8	70%	0.702	67%	0.668	S	S	*	*			trans	-73.3	90	177.8	-120	179.1	-177.7	176.3	1.9	110.6	V807 K811	V807-R809 HydrophobicContact CG1-CG 4.32Å; V807-R809 PolarHBondContact O-N 2.81Å; R809-K811 PolarHBondContact O-N 3.4Å
810	S	29.6	Very low	29.2	Very low	70 Å²	70	125.9 Å²	125.9	49%	0.49	65%	0.648	S	S	.	*			trans	-11.7	105.5	169.7	57.2	0	0	0	0	117.3	E808 Y812	E808-S810 PolarHBondContact O-N 3.45Å; S810-Y812 PolarHBondContact O-N 3.48Å
811	K	29.4	Very low	29.6	Very low	202 Å²	202	120.7 Å²	120.7	88%	0.878	64%	0.641	S	S	*	*	S	Bend	trans	32.7	2.2	132.4	-61.9	-173.1	178.9	-179.2	0	123.1	R809	R809-K811 PolarHBondContact O-N 3.4Å
812	Y	30.3	Very low	29.7	Very low	121 Å²	121	119.2 Å²	119.2	48%	0.475	64%	0.639	S	S	.	*			trans	-121.7	7.2	-173.6	-64.1	-70.5	0	0	0	113.6	S810	S810-Y812 PolarHBondContact O-N 3.48Å
813	A	25.7	Very low	29.7	Very low	85 Å²	85	119 Å²	119	70%	0.702	64%	0.635	S	S	*	*			trans	-113.7	29.9	-173.1	0	0	0	0	0	114.7
814	I	28.3	Very low	29.8	Very low	115 Å²	115	123 Å²	123	59%	0.59	64%	0.638	S	S	*	*			trans	-134.6	102.4	168	-64.6	90.1	0	0	0	109.8
815	T	34.7	Very low	29.9	Very low	81 Å²	81	120 Å²	120	50%	0.497	63%	0.633	S	S	.	*				173.8	76	122	49	0	0	0	0	108.5	F439	F439-T815 WeakPolarHBondContact CE1-OG1 3.38Å
816	R	38.4	Very low	30.1	Very low	130 Å²	130	118.4 Å²	118.4	49%	0.491	63%	0.631	S	S	.	*	P	Polyproline II helix	trans	-69	137.6	158.5	-154	175.2	-162.9	146.2	0.8	106.4	H308 E736	H308-R816 PolarHBondContact CE1-NH2 3.26Å; H308-R816 PolarHBondContact NE2-NH2 2.75Å; E736-R816 IonicContact OE2-CZ 2.75Å; E736-R816 IonicContact OE2-NH1 3.62Å; E736-R816 PolarHBondContact OE2-NH1 3.41Å; E736-R816 IonicContact OE2-NH2 3.93Å
817	P	29.7	Very low	30.1	Very low	17 Å²	17	117 Å²	117	11%	0.11	63%	0.634	C	S	.	*	P	Polyproline II helix	trans	-58.5	127.4	169.8	25.6	-32.9	0	0	0	107.9	I300 S819	I300-P817 HydrophobicContact CD1-CB 4.24Å; I300-P817 HydrophobicContact CG1-CG 4.42Å; I300-P817 HydrophobicContact CG2-CG 3.88Å; P817-S819 PolarHBondContact O-N 3.07Å
818	P	33.6	Very low	30.2	Very low	98 Å²	98	118 Å²	118	64%	0.636	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-67.6	124.1	-172.8	25.9	-33.4	0	0	0	110.3	Y287 A820	Y287-P818 PolarHBondContact OH-O 2.9Å; P818-A820 PolarHBondContact O-N 3.44Å
819	S	31.5	Very low	30.2	Very low	78 Å²	78	115.1 Å²	115.1	55%	0.545	64%	0.637	S	S	.	*	P	Polyproline II helix	trans	-61.7	117.4	167.8	-57	0	0	0	0	108.4	P817 T821	P817-S819 PolarHBondContact O-N 3.07Å; S819-T821 VanDerWaalsContact C-N 3.33Å; S819-T821 PolarHBondContact O-N 3.03Å
820	A	30.8	Very low	30.3	Very low	46 Å²	46	112.3 Å²	112.3	38%	0.38	64%	0.64	S	S	.	*			trans	-75.9	79.2	-171.4	0	0	0	0	0	112.1	P818	P818-A820 PolarHBondContact O-N 3.44Å
821	T	33.7	Very low	30.3	Very low	109 Å²	109	114.7 Å²	114.7	67%	0.669	65%	0.652	S	S	*	*			trans	-81.9	125.2	171.2	47.4	0	0	0	0	110.6	S819 I823	S819-T821 VanDerWaalsContact C-N 3.33Å; S819-T821 PolarHBondContact O-N 3.03Å; T821-I823 PolarHBondContact O-N 3.44Å; T821-I823 VanDerWaalsContact O-N 3.07Å
822	P	29.3	Very low	30.2	Very low	104 Å²	104	110 Å²	110	68%	0.675	65%	0.645	S	S	*	*			trans	-81.9	91.3	-173.8	31.6	-34.9	0	0	0	111.9	Y824	P822-Y824 HydrophobicContact CB-CD2 4.42Å; P822-Y824 HydrophobicContact CB-CE2 4.37Å; P822-Y824 PolarHBondContact O-N 3.13Å
823	I	30.3	Very low	30.2	Very low	150 Å²	150	112.4 Å²	112.4	77%	0.769	66%	0.664	S	S	*	*			trans	-75.2	93.3	172.9	-58.6	175.9	0	0	0	109.8	T821 A825	T821-I823 PolarHBondContact O-N 3.44Å; T821-I823 VanDerWaalsContact O-N 3.07Å; I823-A825 HydrophobicContact CG2-CB 4.41Å; I823-A825 PolarHBondContact O-N 3.15Å
824	Y	28.1	Very low	30.1	Very low	219 Å²	219	116.1 Å²	116.1	86%	0.859	67%	0.669	S	S	*	*			trans	-81	102.8	162.7	-80.2	-87	0	0	0	109.8	P822	P822-Y824 HydrophobicContact CB-CD2 4.42Å; P822-Y824 HydrophobicContact CB-CE2 4.37Å; P822-Y824 PolarHBondContact O-N 3.13Å
825	A	30.7	Very low	30.2	Very low	84 Å²	84	122.9 Å²	122.9	69%	0.694	69%	0.687	S	S	*	*			trans	-119.2	107.3	167.1	0	0	0	0	0	109.2	I823	I823-A825 HydrophobicContact CG2-CB 4.41Å; I823-A825 PolarHBondContact O-N 3.15Å
826	T	30.2	Very low	29.9	Very low	129 Å²	129	126.5 Å²	126.5	79%	0.791	70%	0.703	S	S	*	*			trans	-72.7	126.9	177.8	39.1	0	0	0	0	111.3	T828	T826-T828 PolarHBondContact O-N 2.67Å
827	T	26.2	Very low	29.8	Very low	140 Å²	140	124.9 Å²	124.9	86%	0.859	71%	0.71	S	S	*	*			trans	-68.5	118.3	169.9	47	0	0	0	0	111.3
828	T	30.4	Very low	29.7	Very low	125 Å²	125	130.9 Å²	130.9	77%	0.767	74%	0.741	S	S	*	*			trans	-127.3	126.4	163.3	-45.9	0	0	0	0	108.4	T826	T826-T828 PolarHBondContact O-N 2.67Å
829	T	25.8	Very low	29.7	Very low	129 Å²	129	133.3 Å²	133.3	79%	0.791	75%	0.754	S	S	*	*			trans	-96.8	124.7	-173.9	46.8	0	0	0	0	112.5
830	T	30.5	Very low	29.6	Very low	127 Å²	127	137.9 Å²	137.9	78%	0.779	77%	0.766	S	S	*	*			trans	-157.5	112.4	156.9	10.8	0	0	0	0	113.4
831	T	29.1	Very low	29.6	Very low	120 Å²	120	143.4 Å²	143.4	74%	0.736	79%	0.788	S	S	*	*			trans	33.1	106.1	136.2	56.5	0	0	0	0	121.1
832	S	26.3	Very low	29.6	Very low	104 Å²	104	142.3 Å²	142.3	73%	0.727	79%	0.785	S	S	*	*				33.8	129.6	124.8	61.7	0	0	0	0	122.1
833	I	31.2	Very low	29.6	Very low	170 Å²	170	144.9 Å²	144.9	87%	0.872	79%	0.793	S	S	*	*				-169.2	149.4	121.1	-98.7	154.1	0	0	0	110.2
834	M	24.5	Very low	29.7	Very low	164 Å²	164	145.9 Å²	145.9	81%	0.808	80%	0.798	S	S	*	*			trans	-92.6	153.6	176.9	-60	164.5	62.5	0	0	112.2
835	R	29.1	Very low	29.7	Very low	256 Å²	256	140.5 Å²	140.5	97%	0.966	79%	0.792	S	S	*	*			trans	-171.5	155.3	132.2	-102.9	155.7	-164.5	-172.5	5.2	115.5
836	N	29.5	Very low	29.8	Very low	157 Å²	157	141.8 Å²	141.8	84%	0.84	80%	0.796	S	S	*	*			trans	-62.3	175.5	-165.4	-104.7	9.4	0	0	0	119.6
837	P	35.7	Very low	29.8	Very low	97 Å²	97	140.7 Å²	140.7	63%	0.63	79%	0.794	S	S	*	*			trans	-104.5	-167	-177.6	42.9	-36.3	0	0	0	115
838	N	27.9	Very low	30.1	Very low	142 Å²	142	141.2 Å²	141.2	76%	0.759	80%	0.797	S	S	*	*			trans	96.4	121.8	161.9	-59.8	-14	0	0	0	119.2
839	T	32.2	Very low	29.9	Very low	149 Å²	149	141.1 Å²	141.1	91%	0.914	80%	0.802	S	S	*	*			trans	-150	158.2	145.6	22.5	0	0	0	0	110.1
840	H	29.7	Very low	30.2	Very low	174 Å²	174	138.8 Å²	138.8	81%	0.806	80%	0.803	S	S	*	*			trans	-103.3	-173.7	-169	-83.9	-110.7	0	0	0	113.8
841	I	31.4	Very low	30	Very low	163 Å²	163	138.4 Å²	138.4	84%	0.836	81%	0.805	S	S	*	*			trans	117.3	133.4	149.7	-61.9	158	0	0	0	113.7
842	S	33.5	Very low	30.1	Very low	86 Å²	86	141.1 Å²	141.1	60%	0.601	81%	0.814	S	S	*	*			cis	-172.5	140.4	-30.5	60.2	0	0	0	0	111.6
843	N	28.7	Very low	30.2	Very low	158 Å²	158	140 Å²	140	85%	0.845	81%	0.807	S	S	*	*			trans	57.1	169.1	152.4	-54.1	-11.9	0	0	0	117.3
844	I	32.2	Very low	30.1	Very low	170 Å²	170	142.4 Å²	142.4	87%	0.872	81%	0.805	S	S	*	*			cis	-135.4	166.7	21	-71.7	172.2	0	0	0	110.8
845	S	29.9	Very low	30.4	Very low	106 Å²	106	141.5 Å²	141.5	74%	0.741	80%	0.803	S	S	*	*			trans	-112.6	151	-166.3	54	0	0	0	0	116.8
846	S	32.4	Very low	30.3	Very low	112 Å²	112	136.2 Å²	136.2	78%	0.783	79%	0.794	S	S	*	*			trans	179.9	141.5	137.5	39.2	0	0	0	0	109.7
847	S	29.8	Very low	30.3	Very low	105 Å²	105	138.6 Å²	138.6	73%	0.734	80%	0.797	S	S	*	*			cis	111.4	90.6	7.7	76.4	0	0	0	0	115.2
848	T	31.6	Very low	30.1	Very low	151 Å²	151	138.8 Å²	138.8	93%	0.926	80%	0.801	S	S	*	*			trans	-157.8	157.4	145.8	-9.6	0	0	0	0	110.3
849	S	27.7	Very low	30	Very low	124 Å²	124	142.3 Å²	142.3	87%	0.867	80%	0.804	S	S	*	*			trans	-151.6	146.4	-170.4	53.1	0	0	0	0	111.2
850	G	31.6	Very low	30	Very low	80 Å²	80	143.3 Å²	143.3	83%	0.825	80%	0.801	S	S	*	*			trans	-149.6	123.8	176	0	0	0	0	0	111.3
851	S	26.1	Very low	29.8	Very low	118 Å²	118	141.2 Å²	141.2	83%	0.825	80%	0.796	S	S	*	*			trans	-141.1	119.2	-172.5	61.8	0	0	0	0	113
852	L	31	Very low	29.6	Very low	177 Å²	177	137.1 Å²	137.1	93%	0.927	79%	0.794	S	S	*	*			trans	-155	153.5	169	-80.8	160.4	0	0	0	107.4
853	S	29.4	Very low	29.2	Very low	80 Å²	80	138.9 Å²	138.9	56%	0.559	80%	0.802	S	S	*	*			cis	-172.6	142.6	-29.2	-172.3	0	0	0	0	108.1
854	R	28.1	Very low	29.2	Very low	221 Å²	221	142.6 Å²	142.6	83%	0.834	81%	0.805	S	S	*	*			trans	32	132.1	150.3	-61.4	172.6	-178.1	171.2	-0	118.6
855	N	30.8	Very low	28.8	Very low	145 Å²	145	139.8 Å²	139.8	78%	0.775	80%	0.801	S	S	*	*				-175.8	171.6	58.3	-123.1	-22.9	0	0	0	113.9
856	N	26.7	Very low	28.8	Very low	146 Å²	146	139.8 Å²	139.8	78%	0.781	80%	0.801	S	S	*	*			trans	-80.2	159.1	-179	-54.8	-63.4	0	0	0	115.2
857	K	30.7	Very low	28.6	Very low	206 Å²	206	138.6 Å²	138.6	90%	0.896	79%	0.793	S	S	*	*			trans	-164.7	156.5	131.5	-109.6	161.7	-173.6	179.2	0	115.7
858	S	31.5	Very low	28.5	Very low	102 Å²	102	140.8 Å²	140.8	71%	0.713	80%	0.796	S	S	*	*			trans	-29.2	140.6	173.7	43.8	0	0	0	0	118
859	R	25	Very low	28.3	Very low	216 Å²	216	141.7 Å²	141.7	82%	0.815	80%	0.795	S	S	*	*			cis	78.4	100.4	48.1	-170.4	-159.8	-163.6	-165.7	9.5	114
860	I	32	Very low	28.3	Very low	169 Å²	169	142.5 Å²	142.5	87%	0.867	79%	0.788	S	S	*	*			trans	-136.1	140.1	154.7	-64.2	-176.2	0	0	0	107.7
861	N	25.4	Very low	28.1	Very low	130 Å²	130	146 Å²	146	70%	0.695	79%	0.788	S	S	*	*			trans	-95.8	159	179.1	-70	-1.9	0	0	0	111.4
862	G	27.8	Very low	28.2	Very low	77 Å²	77	146.9 Å²	146.9	79%	0.794	78%	0.784	S	S	*	*			trans	-156.8	63.8	176.1	0	0	0	0	0	113
863	T	24.6	Very low	28.2	Very low	124 Å²	124	145.6 Å²	145.6	76%	0.761	78%	0.776	S	S	*	*			trans	-92.6	123	175.7	46.7	0	0	0	0	111.2
864	Y	28.3	Very low	28.1	Very low	235 Å²	235	150.2 Å²	150.2	92%	0.922	79%	0.786	S	S	*	*			trans	-134.4	139.2	157.9	-85.4	-77.2	0	0	0	109.7
865	S	23.6	Very low	28.1	Very low	112 Å²	112	150.1 Å²	150.1	78%	0.783	79%	0.787	S	S	*	*			trans	-132.1	122.2	178.6	178.6	0	0	0	0	108.2
866	S	30.7	Very low	27.8	Very low	105 Å²	105	150.4 Å²	150.4	73%	0.734	79%	0.789	S	S	*	*			trans	-151.5	108.1	167.4	-48.3	0	0	0	0	105.7
867	S	27.6	Very low	27.8	Very low	88 Å²	88	155.5 Å²	155.5	62%	0.615	80%	0.797	S	S	*	*				62.6	109.5	60.5	81	0	0	0	0	112.7
868	D	28.2	Very low	27.5	Very low	151 Å²	151	151 Å²	151	81%	0.807	79%	0.792	S	S	*	*			trans	58.3	106.1	146.6	-42	-32.9	0	0	0	118.9
869	L	27.5	Very low	27.3	Very low	170 Å²	170	150.6 Å²	150.6	89%	0.89	79%	0.785	S	S	*	*			trans	-171	153.4	133.6	-105.9	163.5	0	0	0	112
870	L	28.5	Very low	27.4	Very low	141 Å²	141	145.5 Å²	145.5	74%	0.738	78%	0.778	S	S	*	*			trans	74	72.2	168.6	-62.4	166.6	0	0	0	118.7
871	D	27	Very low	27.2	Very low	153 Å²	153	143.1 Å²	143.1	82%	0.818	77%	0.771	S	S	*	*				-62.4	173.7	124.9	-89.2	-56.8	0	0	0	111.1
872	D	27.6	Very low	27.3	Very low	137 Å²	137	143 Å²	143	73%	0.733	77%	0.77	S	S	*	*			trans	63.2	63.7	173.6	-80.1	-29.9	0	0	0	118
873	I	31	Very low	27.3	Very low	149 Å²	149	148 Å²	148	76%	0.764	77%	0.774	S	S	*	*			trans	-123.9	82.2	136	-53.3	-177.6	0	0	0	110.3	Y875	I873-Y875 PolarHBondContact O-N 3.28Å
874	K	27.2	Very low	27.3	Very low	177 Å²	177	150.6 Å²	150.6	77%	0.77	78%	0.782	S	S	*	*			trans	-70.2	117.5	150.1	-72.3	170.5	-177.7	155.9	0	107.9
875	Y	28.4	Very low	27.3	Very low	220 Å²	220	147.2 Å²	147.2	86%	0.863	78%	0.778	S	S	*	*			trans	-150.5	132.5	149.8	-122.7	-77.2	0	0	0	113.1	I873	I873-Y875 PolarHBondContact O-N 3.28Å
876	N	24.2	Very low	27.5	Very low	150 Å²	150	147.6 Å²	147.6	80%	0.802	78%	0.776	S	S	*	*			trans	-71.9	137.2	179.4	-64.1	-56.4	0	0	0	111.4
877	R	26.8	Very low	27.3	Very low	254 Å²	254	144.9 Å²	144.9	96%	0.958	76%	0.764	S	S	*	*			trans	-148.1	121.4	141.7	-118.4	173.6	-172.4	-174.1	1.8	111.3
878	S	24.4	Very low	27.4	Very low	112 Å²	112	146.8 Å²	146.8	78%	0.783	77%	0.767	S	S	*	*			trans	-85.9	147.4	-172.7	34.8	0	0	0	0	112.5
879	T	28.1	Very low	27.3	Very low	93 Å²	93	146 Å²	146	57%	0.571	77%	0.768	S	S	*	*			trans	-134.5	127.7	141.3	55.5	0	0	0	0	109.7	R347	R347-T879 PolarHBondContact NH1-OG1 3.22Å; R347-T879 VanDerWaalsContact NH2-CG2 3.34Å; R347-T879 PolarHBondContact NH2-OG1 3.43Å
880	T	26.4	Very low	27.3	Very low	109 Å²	109	145 Å²	145	67%	0.669	76%	0.763	S	S	*	*			trans	-50.4	162	162.6	39.6	0	0	0	0	111.5
881	T	28.2	Very low	27.3	Very low	118 Å²	118	144.3 Å²	144.3	72%	0.724	76%	0.76	S	S	*	*			cis	-133.2	126.7	37.5	53.8	0	0	0	0	112.4
882	D	26.9	Very low	27.5	Very low	127 Å²	127	143.2 Å²	143.2	68%	0.679	75%	0.752	S	S	*	*				79.9	137.6	90.2	-54.9	-44.4	0	0	0	113
883	E	27.5	Very low	27.4	Very low	184 Å²	184	141.4 Å²	141.4	86%	0.86	75%	0.751	S	S	*	*			cis	-127.3	140.3	7.7	-60.5	175.1	114.7	0	0	112.2
884	L	25.3	Very low	27.3	Very low	178 Å²	178	140.1 Å²	140.1	93%	0.932	75%	0.745	S	S	*	*			trans	-154.9	86.8	168.1	-97.2	-178.6	0	0	0	112.5
885	I	28.1	Very low	27.4	Very low	164 Å²	164	138.7 Å²	138.7	84%	0.841	74%	0.741	S	S	*	*			trans	-155.2	149.8	166.4	4.7	175.5	0	0	0	107.1
886	T	28.8	Very low	27.4	Very low	120 Å²	120	134.9 Å²	134.9	74%	0.736	73%	0.732	S	S	*	*			cis	-128.6	171.9	1.6	52.4	0	0	0	0	108.4
887	G	25.3	Very low	27.7	Very low	47 Å²	47	133.6 Å²	133.6	49%	0.485	72%	0.724	S	S	.	*			cis	163.1	157.6	-2.9	0	0	0	0	0	109.2
888	N	29.8	Very low	27.8	Very low	128 Å²	128	126.8 Å²	126.8	68%	0.684	71%	0.707	S	S	*	*			trans	-143	134.1	167.2	-94.8	-14.1	0	0	0	107.8
889	T	25.3	Very low	28.2	Very low	134 Å²	134	129.2 Å²	129.2	82%	0.822	71%	0.706	S	S	*	*			trans	-106.9	176	-173.8	-46.7	0	0	0	0	110.3
890	L	29.3	Very low	28.2	Very low	150 Å²	150	132.5 Å²	132.5	79%	0.785	71%	0.712	S	S	*	*			trans	94.3	131.5	-178.8	-75.5	90	0	0	0	115.5
891	D	27.6	Very low	28.4	Very low	126 Å²	126	135.5 Å²	135.5	67%	0.674	72%	0.718	S	S	*	*			cis	-165	178.2	-15.7	-141.6	-25.3	0	0	0	113.4
892	I	30.3	Very low	28.3	Very low	130 Å²	130	136.2 Å²	136.2	67%	0.667	72%	0.718	S	S	*	*			trans	71.6	95.7	151.5	-66.2	156.4	0	0	0	118
893	S	27.4	Very low	28.4	Very low	99 Å²	99	138.1 Å²	138.1	69%	0.692	72%	0.724	S	S	*	*			trans	73.1	161.6	136.7	88.2	0	0	0	0	118.7
894	N	27.3	Very low	28.3	Very low	122 Å²	122	137.1 Å²	137.1	65%	0.652	72%	0.717	S	S	*	*			cis	-154.9	143.6	-1.5	-139.3	-9.8	0	0	0	110.6
895	Q	29.6	Very low	28.3	Very low	148 Å²	148	134.9 Å²	134.9	69%	0.692	71%	0.711	S	S	*	*			trans	61.4	150.3	151.8	-69.9	168.8	24.9	0	0	118.8
896	Q	29.4	Very low	28.3	Very low	140 Å²	140	132.5 Å²	132.5	65%	0.654	71%	0.709	S	S	*	*			cis	-163.6	161.5	-16.7	-125.4	175	24.7	0	0	109.2
897	N	30.1	Very low	28.1	Very low	122 Å²	122	133.6 Å²	133.6	65%	0.652	72%	0.716	S	S	*	*			trans	67.3	147.9	153.8	-62	-28.4	0	0	0	119.6
898	N	28.2	Very low	28.3	Very low	111 Å²	111	136.3 Å²	136.3	59%	0.594	73%	0.728	S	S	*	*			cis	-164.6	171.1	-33.9	-131.8	-46	0	0	0	110.7
899	H	32.4	Very low	28	Very low	163 Å²	163	140.5 Å²	140.5	76%	0.755	73%	0.734	S	S	*	*			trans	70.8	153.7	171.8	-48.7	-74	0	0	0	118.5
900	K	28.3	Very low	28.1	Very low	163 Å²	163	144.7 Å²	144.7	71%	0.709	74%	0.735	S	S	*	*			cis	177.2	165.9	-47.7	-108.2	-178.4	175.7	-179.7	0	107.9
901	H	32.3	Very low	27.9	Very low	172 Å²	172	142.8 Å²	142.8	80%	0.796	73%	0.729	S	S	*	*			trans	70.3	107.4	174.5	-52	-74.6	0	0	0	115
902	N	25.5	Very low	27.8	Very low	133 Å²	133	141.5 Å²	141.5	71%	0.711	73%	0.726	S	S	*	*			cis	80.7	86	14.3	-163.2	21.2	0	0	0	117.6
903	M	28.4	Very low	27.6	Very low	166 Å²	166	143 Å²	143	82%	0.818	73%	0.73	S	S	*	*			trans	-156	128.2	141.1	-75.4	-51.5	170.8	0	0	106.3
904	K	26.4	Very low	27.6	Very low	163 Å²	163	148.7 Å²	148.7	71%	0.709	74%	0.742	S	S	*	*				90	123.3	51.3	-86.2	-164.7	172.6	-175.1	0	114.7
905	T	25.6	Very low	27.6	Very low	131 Å²	131	148 Å²	148	80%	0.804	75%	0.747	S	S	*	*			trans	62.2	139.8	156.3	53.8	0	0	0	0	117.3
906	S	27.1	Very low	27.3	Very low	114 Å²	114	146.2 Å²	146.2	80%	0.797	75%	0.751	S	S	*	*			cis	-151.2	168	36	-67.1	0	0	0	0	114.6
907	T	24.8	Very low	27.2	Very low	143 Å²	143	145.5 Å²	145.5	88%	0.877	76%	0.761	S	S	*	*			trans	-75.1	148.8	172.3	47.9	0	0	0	0	114.5
908	S	29	Very low	26.9	Very low	105 Å²	105	144.9 Å²	144.9	73%	0.734	76%	0.762	S	S	*	*			trans	-143.2	125.3	151.9	64.6	0	0	0	0	111.5
909	R	24	Very low	26.9	Very low	215 Å²	215	146 Å²	146	81%	0.811	77%	0.773	S	S	*	*			trans	-90.8	133.7	-177.6	178.8	-169.8	-63.7	129.5	-3.5	110.3	T911	R909-T911 HydrophobicContact CG-CG2 4.15Å
910	W	27.1	Very low	26.5	Very low	223 Å²	223	146.7 Å²	146.7	85%	0.845	77%	0.774	S	S	*	*			trans	-122.1	114.1	166.8	-79.4	88.4	0	0	0	110.4
911	T	24.2	Very low	26.4	Very low	110 Å²	110	145.1 Å²	145.1	68%	0.675	77%	0.774	S	S	*	*			trans	-141.1	104	178.1	46.6	0	0	0	0	108.6	R909	R909-T911 HydrophobicContact CG-CG2 4.15Å
912	T	26.5	Very low	26.1	Very low	99 Å²	99	141.7 Å²	141.7	61%	0.607	77%	0.765	S	S	*	*			trans	-154.2	125.8	176.3	30.8	0	0	0	0	113.1
913	H	26.1	Very low	26.1	Very low	160 Å²	160	145.5 Å²	145.5	74%	0.741	77%	0.769	S	S	*	*			trans	51.5	103.9	149.2	-47.7	-53.5	0	0	0	120.4
914	K	26.4	Very low	26.1	Very low	219 Å²	219	143.8 Å²	143.8	95%	0.952	76%	0.763	S	S	*	*				-104.1	124.8	124.8	-96	-172.7	172.8	-177.5	0	108.1
915	S	27.4	Very low	26	Very low	107 Å²	107	143.2 Å²	143.2	75%	0.748	77%	0.768	S	S	*	*			trans	-88.6	154.3	-175.4	-54.9	0	0	0	0	112.2
916	S	23.9	Very low	26.2	Very low	111 Å²	111	145.8 Å²	145.8	78%	0.776	77%	0.765	S	S	*	*			trans	-74.8	145.8	-176.1	-38.4	0	0	0	0	113.8
917	S	26.9	Very low	26.4	Very low	125 Å²	125	148.2 Å²	148.2	87%	0.874	77%	0.769	S	S	*	*			trans	-142.3	110	152.2	59.5	0	0	0	0	108.5
918	T	24.8	Very low	27.1	Very low	110 Å²	110	144.1 Å²	144.1	68%	0.675	75%	0.746	S	S	*	*			trans	-108.4	129.2	-163.4	47.7	0	0	0	0	113.6
919	T	27.5	Very low	28.1	Very low	134 Å²	134	145.3 Å²	145.3	82%	0.822	74%	0.744	S	S	*	*			trans	-141.8	105.7	150.1	47.5	0	0	0	0	109.9
920	F	24.2	Very low	29.5	Very low	177 Å²	177	136 Å²	136	78%	0.776	71%	0.71	S	S	*	*			trans	8.6	141.5	131.4	-64.5	-91.8	0	0	0	117.5
921	D	26.3	Very low	30.8	Very low	131 Å²	131	126 Å²	126	70%	0.701	67%	0.674	S	S	*	*			cis	-143.6	151.7	33.1	-101.1	-48.1	0	0	0	116.6
922	T	26.5	Very low	32.6	Very low	100 Å²	100	121 Å²	121	61%	0.613	64%	0.643	S	S	*	*			trans	19.8	139.4	154.3	73.9	0	0	0	0	120.9
923	R	25	Very low	34.2	Very low	212 Å²	212	117.3 Å²	117.3	80%	0.8	62%	0.621	S	S	*	*			cis	-171.4	145.1	40.5	-136.5	150.1	-173.3	149.2	-2.1	113.6
924	N	27.6	Very low	35.9	Very low	130 Å²	130	109.7 Å²	109.7	70%	0.695	59%	0.586	S	S	*	*			trans	67	94.1	158.4	-63.8	1.5	0	0	0	120.9
925	D	25.3	Very low	37.2	Very low	152 Å²	152	99.9 Å²	99.9	81%	0.813	55%	0.545	S	S	*	.			trans	-69.8	143.1	153.9	-65.8	-78.3	0	0	0	112.9
926	Y	30.7	Very low	38.8	Very low	184 Å²	184	95 Å²	95	72%	0.722	51%	0.51	S	S	*	.			trans	-147.3	30	165.8	-87	-60.9	0	0	0	114.4	S928	Y926-S928 VanDerWaalsContact C-N 3.35Å; Y926-S928 PolarHBondContact O-N 3.13Å
927	N	30.8	Very low	40.2	Very low	166 Å²	166	92.2 Å²	92.2	89%	0.888	49%	0.485	S	S	*	.			trans	-71.3	86.9	172	-90.1	-10.2	0	0	0	111.4
928	S	39.5	Very low	41.4	Very low	57 Å²	57	90.2 Å²	90.2	40%	0.399	46%	0.461	S	S	.	.			trans	-119.8	112.3	164.1	64.3	0	0	0	0	108.2	Y926 L930 K1029	Y926-S928 VanDerWaalsContact C-N 3.35Å; Y926-S928 PolarHBondContact O-N 3.13Å; S928-L930 PolarHBondContact O-N 3.28Å; S928-K1029 PolarHBondContact OG-NZ 3.07Å
929	N	49	Very low	42.5	Very low	130 Å²	130	87.6 Å²	87.6	70%	0.695	45%	0.445	S	S	*	.			trans	-62.9	102.1	-175.2	-69.7	-26.4	0	0	0	110.9
930	L	53.3	Low	43.4	Very low	19 Å²	19	84.6 Å²	84.6	10%	0.099	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	123	173	-174.7	68.8	0	0	0	108.3	S928 V986 P1059	S928-L930 PolarHBondContact O-N 3.28Å; L930-V986 HydrophobicContact CD2-CB 4.42Å; L930-V986 HydrophobicContact CD2-CG1 4.33Å; L930-V986 PolarHBondContact O-N 3.17Å; L930-P1059 HydrophobicContact CD1-CB 4.22Å
931	S	55.8	Low	43.9	Very low	13 Å²	13	81.4 Å²	81.4	9%	0.091	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	146.3	166.9	70	0	0	0	0	110	L984 P1059 T1060	S931-L984 CarbonylContact C-O 3.53Å; S931-L984 WeakPolarHBondContact CA-O 3.41Å; S931-P1059 CarbonylContact O-C 3.59Å; S931-P1059 WeakPolarHBondContact O-CA 3.49Å; S931-T1060 PolarHBondContact N-O 3.42Å; S931-T1060 PolarHBondContact O-N 3.33Å; S931-T1060 PolarHBondContact O-OG1 2.76Å; S931-T1060 VanDerWaalsContact OG-CB 3.29Å; S931-T1060 WeakPolarHBondContact OG-CB 3.38Å; S931-T1060 PolarHBondContact OG-O 3.46Å; S931-T1060 PolarHBondContact OG-OG1 3.46Å
932	I	60.1	Low	44.4	Very low	4 Å²	4	83 Å²	83	2%	0.021	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	123.3	171.2	-62.4	-172.4	0	0	0	108.1	V934 L984 V986 V995 L1027 F1033 C1057 T1058	I932-V934 HydrophobicContact CG2-CG2 4.1Å; I932-L984 PolarHBondContact N-O 3.29Å; I932-L984 PolarHBondContact O-N 2.94Å; I932-V986 HydrophobicContact CB-CG2 3.96Å; I932-V986 HydrophobicContact CD1-CB 4.36Å; I932-V986 HydrophobicContact CD1-CG1 4.19Å; I932-V986 HydrophobicContact CD1-CG2 3.96Å; I932-V986 HydrophobicContact CG1-CB 4.3Å; I932-V986 HydrophobicContact CG1-CG2 3.77Å; I932-V995 HydrophobicContact CD1-CG1 4.36Å; I932-V995 HydrophobicContact CD1-CG2 4.46Å; I932-V995 HydrophobicContact CG2-CG1 4.33Å; I932-L1027 HydrophobicContact CD1-CD1 3.87Å; I932-L1027 HydrophobicContact CD1-CD2 4.23Å; I932-F1033 HydrophobicContact CD1-CE1 4.4Å; I932-C1057 HydrophobicContact CG2-CB 3.96Å; I932-T1058 CarbonylContact C-O 3.48Å; I932-T1058 WeakPolarHBondContact CA-O 3.38Å
933	T	61	Low	44.6	Very low	23 Å²	23	87.7 Å²	87.7	14%	0.141	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	115.3	174.6	-58.7	0	0	0	0	108.1	I981 Q983 T1058 T1060	T933-I981 HydrophobicContact CG2-CG2 3.4Å; T933-I981 VanDerWaalsContact CG2-CG2 3.4Å; T933-Q983 HydrophobicContact CG2-CG 4.27Å; T933-Q983 PolarHBondContact OG1-NE2 2.93Å; T933-T1058 PolarHBondContact N-O 3.05Å; T933-T1058 PolarHBondContact O-N 3.01Å; T933-T1058 PolarHBondContact O-OG1 2.78Å; T933-T1060 PolarHBondContact OG1-OG1 2.86Å; T933-T1060 VanDerWaalsContact OG1-OG1 3.06Å
934	V	60.9	Low	45.2	Very low	0 Å²	0	83.4 Å²	83.4	0%	0	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	126.4	-179.3	-173.2	0	0	0	0	109	I932 I981 I982 L984 A999 F1003 F1055 I1056	I932-V934 HydrophobicContact CG2-CG2 4.1Å; V934-I981 CarbonylContact O-C 3.54Å; V934-I981 WeakPolarHBondContact O-CA 3.36Å; V934-I982 PolarHBondContact N-O 2.78Å; V934-I982 PolarHBondContact O-N 2.74Å; V934-L984 HydrophobicContact CG2-CD1 4.03Å; V934-A999 HydrophobicContact CB-CB 4.42Å; V934-A999 HydrophobicContact CG1-CB 4.08Å; V934-A999 HydrophobicContact CG2-CB 4.23Å; V934-F1003 HydrophobicContact CG1-CE2 3.98Å; V934-F1003 HydrophobicContact CG1-CZ 4.32Å; V934-F1055 HydrophobicContact CG1-CD1 4Å; V934-I1056 WeakPolarHBondContact CA-O 3.39Å
935	S	55.2	Low	45.6	Very low	13 Å²	13	81 Å²	81	9%	0.091	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	142.7	175.5	61	0	0	0	0	111.4	H937 I1056	S935-H937 WeakPolarHBondContact CB-NE2 3.33Å; S935-H937 PolarHBondContact OG-NE2 3.23Å; S935-I1056 PolarHBondContact N-O 2.76Å; S935-I1056 PolarHBondContact O-N 2.68Å
936	L	59.8	Low	46.4	Very low	4 Å²	4	83.6 Å²	83.6	2%	0.021	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	121.7	-177.1	-177.1	76	0	0	0	110.6	F950 V954 P980 F1003 L1053 F1055	L936-F950 HydrophobicContact CD2-CE1 3.92Å; L936-V954 HydrophobicContact CD2-CG1 4.29Å; L936-P980 HydrophobicContact CB-CG 4.13Å; L936-P980 HydrophobicContact CD2-CG 4.17Å; L936-P980 PolarHBondContact N-O 3.15Å; L936-F1003 HydrophobicContact CB-CE1 4.26Å; L936-F1003 HydrophobicContact CB-CZ 4.1Å; L936-L1053 HydrophobicContact CD1-CB 4.05Å; L936-L1053 HydrophobicContact CD1-CD1 4.33Å; L936-L1053 HydrophobicContact CD1-CD2 4.29Å; L936-L1053 HydrophobicContact CD1-CG 4.46Å; L936-L1053 HydrophobicContact CG-CD2 4.36Å; L936-F1055 HydrophobicContact CD1-CD1 4.27Å; L936-F1055 HydrophobicContact CD1-CD2 4.22Å; L936-F1055 HydrophobicContact CD1-CE1 3.77Å; L936-F1055 HydrophobicContact CD1-CE2 3.68Å; L936-F1055 HydrophobicContact CD1-CG 4.48Å; L936-F1055 HydrophobicContact CD1-CZ 3.43Å; L936-F1055 VanDerWaalsContact CD1-CZ 3.43Å
937	H	53	Low	47.1	Very low	52 Å²	52	78.5 Å²	78.5	24%	0.241	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	141.1	-176.8	-65.1	-108.5	0	0	0	111.5	S935 Q979 E1054	S935-H937 WeakPolarHBondContact CB-NE2 3.33Å; S935-H937 PolarHBondContact OG-NE2 3.23Å; H937-Q979 PolarHBondContact CE1-NE2 3.23Å; H937-Q979 VanDerWaalsContact CE1-NE2 3.3Å; H937-Q979 PolarHBondContact CE1-OE1 3.21Å; H937-Q979 PolarHBondContact ND1-NE2 2.81Å; H937-E1054 HydrophobicContact CB-CB 4.15Å; H937-E1054 PolarHBondContact N-O 3.3Å; H937-E1054 PolarHBondContact O-N 3.45Å
938	H	53.2	Low	48.1	Very low	83 Å²	83	71 Å²	71	38%	0.384	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	121.5	175.5	-175.9	-108.9	0	0	0	110.1	N940 I951	H938-N940 WeakPolarHBondContact CE1-CB 3.35Å; H938-I951 HydrophobicContact CB-CD1 3.56Å
939	T	47.9	Very low	48.6	Very low	55 Å²	55	73.5 Å²	73.5	34%	0.337	40%	0.403	S	S	.	.			trans	-108.6	20.4	-173.6	66.6	0	0	0	0	114.3	L1052 E1054	T939-L1052 PolarHBondContact N-O 2.78Å; T939-L1052 WeakPolarHBondContact OG1-CB 3.45Å; T939-L1052 WeakPolarHBondContact OG1-CD2 3.27Å; T939-L1052 PolarHBondContact OG1-O 2.86Å; T939-E1054 HydrophobicContact CG2-CB 3.65Å; T939-E1054 WeakPolarHBondContact CG2-OE2 3.34Å
940	N	45.5	Very low	48.7	Very low	71 Å²	71	69.7 Å²	69.7	38%	0.38	38%	0.38	S	S	.	.			trans	-95.4	123.2	172.9	-139.1	-29.6	0	0	0	111.3	H938 Y1050	H938-N940 WeakPolarHBondContact CE1-CB 3.35Å; N940-Y1050 PolarHBondContact ND2-O 2.78Å
941	S	35.8	Very low	48.7	Very low	111 Å²	111	69.9 Å²	69.9	78%	0.776	38%	0.381	S	S	*	.			trans	-113	18.8	-164.1	50.9	0	0	0	0	114.7
942	Q	37.4	Very low	48.5	Very low	165 Å²	165	71.2 Å²	71.2	77%	0.771	39%	0.392	S	S	*	.	S	Bend	trans	-104.1	80.5	177.3	-69.7	-160.3	-13	0	0	113.4	D944	Q942-D944 VanDerWaalsContact C-N 3.26Å; Q942-D944 PolarHBondContact O-N 2.85Å
943	H	29.8	Very low	48.1	Very low	197 Å²	197	78.3 Å²	78.3	91%	0.912	42%	0.423	S	S	*	.			trans	49.3	-10	139.1	-109	-65.7	0	0	0	124
944	D	37.2	Very low	47.7	Very low	122 Å²	122	77.4 Å²	77.4	65%	0.652	42%	0.418	S	S	*	.			trans	-92.1	123.5	174.7	-137.6	-1	0	0	0	109.5	Q942 R946	Q942-D944 VanDerWaalsContact C-N 3.26Å; Q942-D944 PolarHBondContact O-N 2.85Å; D944-R946 PolarHBondContact O-N 2.83Å
945	G	35.8	Very low	47.1	Very low	80 Å²	80	79 Å²	79	83%	0.825	43%	0.431	S	S	*	.			trans	-72.7	26.8	-167	0	0	0	0	0	116.3
946	R	42.2	Very low	46.8	Very low	207 Å²	207	85 Å²	85	78%	0.781	46%	0.457	S	S	*	.			trans	-97.2	109.8	-174.5	-62.8	179.8	-179	-168.6	0.3	110.3	D944	D944-R946 PolarHBondContact O-N 2.83Å
947	V	46.3	Very low	46.1	Very low	76 Å²	76	88.9 Å²	88.9	46%	0.461	48%	0.478	S	S	.	.			trans	-65.5	137.1	167.8	-178.8	0	0	0	0	108.7	I951 A952	V947-I951 HydrophobicContact CG1-CB 3.83Å; V947-I951 HydrophobicContact CG1-CG2 3.69Å; V947-A952 HydrophobicContact CG1-CB 4.37Å
948	S	50.3	Low	45.4	Very low	10 Å²	10	87.9 Å²	87.9	7%	0.07	48%	0.481	C	S	.	.			trans	-65.7	149.7	-178.9	82.5	0	0	0	0	112.3	F950 I951 A952 E1051	S948-F950 PolarHBondContact O-N 3.48Å; S948-F950 VanDerWaalsContact O-N 3.11Å; S948-I951 PolarHBondContact O-N 2.92Å; S948-I951 VanDerWaalsContact O-N 3.12Å; S948-I951 PolarHBondContact OG-N 3.1Å; S948-A952 PolarHBondContact O-N 3.13Å; S948-E1051 WeakPolarHBondContact CB-OE1 2.93Å; S948-E1051 WeakPolarHBondContact CB-OE2 3.36Å; S948-E1051 PolarHBondContact OG-OE2 3.43Å
949	P	51.2	Low	44.6	Very low	109 Å²	109	88.2 Å²	88.2	71%	0.708	49%	0.493	S	S	*	.	H	α-helix	trans	-57.7	-27	177.7	-24.8	34.8	0	0	0	113.1	K953	P949-K953 VanDerWaalsContact O-CB 3.26Å; P949-K953 WeakPolarHBondContact O-CB 3.39Å; P949-K953 PolarHBondContact O-N 3.26Å
950	F	49.9	Very low	43.9	Very low	49 Å²	49	92.4 Å²	92.4	22%	0.215	51%	0.512	C	S	.	.	H	α-helix	trans	-67.5	-57.2	172.7	-177	-103	0	0	0	111.2	L936 S948 A952 K953 V954 Y1039 L1053	L936-F950 HydrophobicContact CD2-CE1 3.92Å; S948-F950 PolarHBondContact O-N 3.48Å; S948-F950 VanDerWaalsContact O-N 3.11Å; F950-A952 VanDerWaalsContact C-N 3.31Å; F950-A952 PolarHBondContact O-N 3.22Å; F950-K953 WeakPolarHBondContact O-CB 3.49Å; F950-K953 PolarHBondContact O-N 3.47Å; F950-K953 VanDerWaalsContact O-N 3.08Å; F950-V954 HydrophobicContact CD1-CG2 4.22Å; F950-V954 HydrophobicContact CD2-CG2 4.37Å; F950-V954 HydrophobicContact CE1-CG2 3.9Å; F950-V954 HydrophobicContact CE2-CG2 4.06Å; F950-V954 HydrophobicContact CG-CG2 4.45Å; F950-V954 HydrophobicContact CZ-CG2 3.82Å; F950-V954 WeakPolarHBondContact O-CG2 3.35Å; F950-V954 PolarHBondContact O-N 3.35Å; F950-Y1039 HydrophobicContact CE1-CE1 4.4Å; F950-Y1039 HydrophobicContact CE2-CE1 4.31Å; F950-Y1039 HydrophobicContact CZ-CE1 4.07Å; F950-L1053 HydrophobicContact CD1-CD1 3.63Å; F950-L1053 HydrophobicContact CE1-CD1 3.57Å
951	I	54.3	Low	43.3	Very low	24 Å²	24	92.9 Å²	92.9	12%	0.123	52%	0.521	C	S	.	.	H	α-helix	trans	-62	-38.6	-178.4	-66	-179.1	0	0	0	111.6	H938 V947 S948 K953 V954 A955 L1053	H938-I951 HydrophobicContact CB-CD1 3.56Å; V947-I951 HydrophobicContact CG1-CB 3.83Å; V947-I951 HydrophobicContact CG1-CG2 3.69Å; S948-I951 PolarHBondContact O-N 2.92Å; S948-I951 VanDerWaalsContact O-N 3.12Å; S948-I951 PolarHBondContact OG-N 3.1Å; I951-K953 VanDerWaalsContact C-N 3.34Å; I951-K953 PolarHBondContact O-N 3.28Å; I951-V954 PolarHBondContact O-N 3.05Å; I951-A955 VanDerWaalsContact O-CB 3.28Å; I951-A955 WeakPolarHBondContact O-CB 3.26Å; I951-A955 PolarHBondContact O-N 2.86Å; I951-L1053 HydrophobicContact CD1-CD2 3.87Å; I951-L1053 HydrophobicContact CG1-CD2 4.24Å
952	A	52.4	Low	43.2	Very low	40 Å²	40	96.7 Å²	96.7	33%	0.331	53%	0.527	S	S	.	.	H	α-helix	trans	-59.5	-44.9	174.4	0	0	0	0	0	111.8	V947 S948 F950 A955 H956	V947-A952 HydrophobicContact CG1-CB 4.37Å; S948-A952 PolarHBondContact O-N 3.13Å; F950-A952 VanDerWaalsContact C-N 3.31Å; F950-A952 PolarHBondContact O-N 3.22Å; A952-A955 PolarHBondContact O-N 3.39Å; A952-H956 PolarHBondContact O-CD2 2.62Å; A952-H956 PolarHBondContact O-N 3.04Å
953	K	51.7	Low	42.5	Very low	153 Å²	153	93 Å²	93	67%	0.665	53%	0.533	S	S	*	.	H	α-helix	trans	-66.8	-36.3	177.8	-172	176.4	-178.5	-177.5	0	112.7	P949 F950 I951	P949-K953 VanDerWaalsContact O-CB 3.26Å; P949-K953 WeakPolarHBondContact O-CB 3.39Å; P949-K953 PolarHBondContact O-N 3.26Å; F950-K953 WeakPolarHBondContact O-CB 3.49Å; F950-K953 PolarHBondContact O-N 3.47Å; F950-K953 VanDerWaalsContact O-N 3.08Å; I951-K953 VanDerWaalsContact C-N 3.34Å; I951-K953 PolarHBondContact O-N 3.28Å
954	V	52	Low	42.5	Very low	4 Å²	4	89 Å²	89	2%	0.024	53%	0.526	C	S	.	.	H	α-helix	trans	-74.7	-37.7	177.5	179.4	0	0	0	0	111.7	L936 F950 I951 H956 L957 G958 P980 F1003	L936-V954 HydrophobicContact CD2-CG1 4.29Å; F950-V954 HydrophobicContact CD1-CG2 4.22Å; F950-V954 HydrophobicContact CD2-CG2 4.37Å; F950-V954 HydrophobicContact CE1-CG2 3.9Å; F950-V954 HydrophobicContact CE2-CG2 4.06Å; F950-V954 HydrophobicContact CG-CG2 4.45Å; F950-V954 HydrophobicContact CZ-CG2 3.82Å; F950-V954 WeakPolarHBondContact O-CG2 3.35Å; F950-V954 PolarHBondContact O-N 3.35Å; I951-V954 PolarHBondContact O-N 3.05Å; V954-H956 VanDerWaalsContact C-N 3.32Å; V954-H956 PolarHBondContact O-N 3.36Å; V954-L957 WeakPolarHBondContact O-CB 3.12Å; V954-L957 PolarHBondContact O-N 2.96Å; V954-G958 PolarHBondContact O-N 3.22Å; V954-P980 HydrophobicContact CB-CG 4.41Å; V954-P980 HydrophobicContact CG1-CB 3.79Å; V954-P980 HydrophobicContact CG1-CG 3.69Å; V954-F1003 HydrophobicContact CG1-CB 4.39Å; V954-F1003 HydrophobicContact CG1-CD1 3.48Å; V954-F1003 VanDerWaalsContact CG1-CD1 3.48Å; V954-F1003 HydrophobicContact CG1-CE1 4.18Å; V954-F1003 HydrophobicContact CG1-CG 4.33Å
955	A	48.6	Very low	42.1	Very low	33 Å²	33	92.1 Å²	92.1	27%	0.273	54%	0.537	S	S	.	.	H	α-helix	trans	-62	-38.4	175.3	0	0	0	0	0	112.3	I951 A952 L957 G958 S959	I951-A955 VanDerWaalsContact O-CB 3.28Å; I951-A955 WeakPolarHBondContact O-CB 3.26Å; I951-A955 PolarHBondContact O-N 2.86Å; A952-A955 PolarHBondContact O-N 3.39Å; A955-L957 VanDerWaalsContact C-N 3.27Å; A955-L957 PolarHBondContact O-N 3.02Å; A955-G958 PolarHBondContact O-N 3.38Å; A955-S959 PolarHBondContact O-N 2.8Å; A955-S959 VanDerWaalsContact O-N 3.16Å
956	H	48.9	Very low	41.6	Very low	139 Å²	139	91.6 Å²	91.6	64%	0.644	53%	0.532	S	S	*	.	H	α-helix	trans	-63.7	-27.9	172.1	-79.2	-59.4	0	0	0	113.9	A952 V954 S959	A952-H956 PolarHBondContact O-CD2 2.62Å; A952-H956 PolarHBondContact O-N 3.04Å; V954-H956 VanDerWaalsContact C-N 3.32Å; V954-H956 PolarHBondContact O-N 3.36Å; H956-S959 PolarHBondContact O-OG 2.94Å
957	L	44.7	Very low	41.1	Very low	87 Å²	87	90.6 Å²	90.6	46%	0.455	54%	0.535	S	S	.	.	H	α-helix	trans	-77.3	-41.3	173.4	-68.6	167.4	0	0	0	111.1	V954 A955 S959 L960	V954-L957 WeakPolarHBondContact O-CB 3.12Å; V954-L957 PolarHBondContact O-N 2.96Å; A955-L957 VanDerWaalsContact C-N 3.27Å; A955-L957 PolarHBondContact O-N 3.02Å; L957-S959 VanDerWaalsContact C-N 3.25Å; L957-S959 PolarHBondContact O-N 2.98Å; L957-L960 PolarHBondContact O-N 2.88Å
958	G	39.3	Very low	40.1	Very low	31 Å²	31	94.2 Å²	94.2	32%	0.32	55%	0.552	S	S	.	*	H	α-helix	trans	-65.2	-20.9	177.9	0	0	0	0	0	114.9	V954 A955 L960	V954-G958 PolarHBondContact O-N 3.22Å; A955-G958 PolarHBondContact O-N 3.38Å; G958-L960 VanDerWaalsContact C-N 3.26Å; G958-L960 PolarHBondContact O-N 2.85Å
959	S	35.8	Very low	39.1	Very low	89 Å²	89	101 Å²	101	62%	0.622	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-4.2	178.9	69.5	0	0	0	0	114.7	A955 H956 L957	A955-S959 PolarHBondContact O-N 2.8Å; A955-S959 VanDerWaalsContact O-N 3.16Å; H956-S959 PolarHBondContact O-OG 2.94Å; L957-S959 VanDerWaalsContact C-N 3.25Å; L957-S959 PolarHBondContact O-N 2.98Å
960	L	33.9	Very low	37.9	Very low	143 Å²	143	103.5 Å²	103.5	75%	0.749	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	5	-172.4	-71.5	166.4	0	0	0	114.7	L957 G958	L957-L960 PolarHBondContact O-N 2.88Å; G958-L960 VanDerWaalsContact C-N 3.26Å; G958-L960 PolarHBondContact O-N 2.85Å
961	S	32.2	Very low	37	Very low	82 Å²	82	109.7 Å²	109.7	57%	0.573	62%	0.624	S	S	*	*	S	Bend	trans	-115.5	32.6	-169.5	68.9	0	0	0	0	116.5
962	H	32.5	Very low	35.4	Very low	191 Å²	191	118 Å²	118	88%	0.884	66%	0.66	S	S	*	*			trans	-142	110.5	160.7	-84.2	-59.6	0	0	0	111.6
963	G	24.2	Very low	34.1	Very low	87 Å²	87	121.2 Å²	121.2	90%	0.897	68%	0.68	S	S	*	*			trans	-92.1	109.9	174.7	0	0	0	0	0	112.3
964	S	29.7	Very low	32.7	Very low	112 Å²	112	123.6 Å²	123.6	78%	0.783	69%	0.693	S	S	*	*			trans	-152.5	169.6	157	-162.7	0	0	0	0	110.7
965	H	29.1	Very low	31.5	Very low	188 Å²	188	128.7 Å²	128.7	87%	0.87	73%	0.729	S	S	*	*			trans	-55.8	141.2	-165.6	-58.7	-23.6	0	0	0	114.6
966	G	25.6	Very low	30.6	Very low	70 Å²	70	136.6 Å²	136.6	72%	0.722	76%	0.757	S	S	*	*			trans	-96.3	168.7	176.7	0	0	0	0	0	113.8
967	H	29.8	Very low	29.9	Very low	185 Å²	185	138 Å²	138	86%	0.856	77%	0.765	S	S	*	*			trans	-141.4	146.2	149.8	-132.6	-90	0	0	0	108.1
968	N	26	Very low	30	Very low	152 Å²	152	139.7 Å²	139.7	81%	0.813	78%	0.778	S	S	*	*			trans	-75.4	131.2	172.6	-66.1	-31	0	0	0	109.1
969	D	29.7	Very low	30.7	Very low	153 Å²	153	142.7 Å²	142.7	82%	0.818	78%	0.784	S	S	*	*			trans	-156.1	125	148.2	-98.7	-40.2	0	0	0	110.5
970	N	26.2	Very low	31.8	Very low	161 Å²	161	139 Å²	139	86%	0.861	76%	0.758	S	S	*	*			trans	-97.5	91.1	-178.9	-82.5	-44	0	0	0	110.4
971	H	30.1	Very low	33	Very low	179 Å²	179	136.4 Å²	136.4	83%	0.829	74%	0.744	S	S	*	*			trans	-139.3	145.6	168	-94	-76	0	0	0	114.4
972	F	22.2	Very low	34.6	Very low	198 Å²	198	134 Å²	134	87%	0.868	72%	0.724	S	S	*	*			trans	-56.2	140	179.6	-78.8	-121.5	0	0	0	113.1
973	S	23.1	Very low	36.1	Very low	108 Å²	108	130.4 Å²	130.4	76%	0.755	71%	0.708	S	S	*	*				166.1	170.3	111.1	53.8	0	0	0	0	112.6	S975	S973-S975 PolarHBondContact O-N 2.98Å; S973-S975 VanDerWaalsContact O-N 3.14Å
974	H	23.5	Very low	38.1	Very low	203 Å²	203	126.9 Å²	126.9	94%	0.94	67%	0.668	S	S	*	*			trans	-56.9	108.8	-171	-59.7	-89.5	0	0	0	114.7
975	S	26.4	Very low	39.9	Very low	112 Å²	112	126.7 Å²	126.7	78%	0.783	67%	0.667	S	S	*	*			trans	-120.9	124.1	171.5	62.3	0	0	0	0	112.4	S973	S973-S975 PolarHBondContact O-N 2.98Å; S973-S975 VanDerWaalsContact O-N 3.14Å
976	K	30.6	Very low	41.5	Very low	198 Å²	198	118.2 Å²	118.2	86%	0.861	63%	0.628	S	S	*	*			trans	-14.7	128.7	175.7	-63.8	173	179	176.1	0	117.3	T978	K976-T978 PolarHBondContact O-N 3.12Å
977	Q	33.7	Very low	43.3	Very low	170 Å²	170	117.2 Å²	117.2	79%	0.794	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-56.3	119.2	167.8	-68.9	168.6	-31.6	0	0	110.9
978	T	45.8	Very low	44.6	Very low	121 Å²	121	112.9 Å²	112.9	74%	0.742	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-88.4	120.5	173.7	49.6	0	0	0	0	110.4	K976	K976-T978 PolarHBondContact O-N 3.12Å
979	Q	54.3	Low	46.4	Very low	95 Å²	95	111.2 Å²	111.2	44%	0.444	59%	0.594	S	S	.	*	P	Polyproline II helix	trans	-66.9	140.9	171.4	-65.5	170.2	-30.6	0	0	109.6	H937	H937-Q979 PolarHBondContact CE1-NE2 3.23Å; H937-Q979 VanDerWaalsContact CE1-NE2 3.3Å; H937-Q979 PolarHBondContact CE1-OE1 3.21Å; H937-Q979 PolarHBondContact ND1-NE2 2.81Å
980	P	58.4	Low	47.8	Very low	10 Å²	10	104.8 Å²	104.8	7%	0.065	56%	0.559	C	S	.	*	P	Polyproline II helix	trans	-76.7	132.1	177	28.3	-28.1	0	0	0	110.4	L936 V954 F1003	L936-P980 HydrophobicContact CB-CG 4.13Å; L936-P980 HydrophobicContact CD2-CG 4.17Å; L936-P980 PolarHBondContact N-O 3.15Å; V954-P980 HydrophobicContact CB-CG 4.41Å; V954-P980 HydrophobicContact CG1-CB 3.79Å; V954-P980 HydrophobicContact CG1-CG 3.69Å; P980-F1003 HydrophobicContact CB-CE1 4.33Å
981	I	60	Low	49.6	Very low	89 Å²	89	97.9 Å²	97.9	46%	0.456	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	138.7	-174.6	-56.1	178.4	0	0	0	108.2	T933 V934	T933-I981 HydrophobicContact CG2-CG2 3.4Å; T933-I981 VanDerWaalsContact CG2-CG2 3.4Å; V934-I981 CarbonylContact O-C 3.54Å; V934-I981 WeakPolarHBondContact O-CA 3.36Å
982	I	64.9	Low	51	Low	31 Å²	31	90.8 Å²	90.8	16%	0.159	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	134.5	178.3	-60.9	-174.6	0	0	0	109.1	V934 L1002 F1003	V934-I982 PolarHBondContact N-O 2.78Å; V934-I982 PolarHBondContact O-N 2.74Å; I982-L1002 HydrophobicContact CD1-CB 3.69Å; I982-L1002 HydrophobicContact CG2-CB 4.03Å; I982-L1002 HydrophobicContact CG2-CD1 3.62Å; I982-L1002 HydrophobicContact CG2-CG 4.5Å; I982-F1003 HydrophobicContact CB-CE1 4.48Å; I982-F1003 HydrophobicContact CB-CZ 4.38Å; I982-F1003 HydrophobicContact CD1-CB 4.48Å; I982-F1003 HydrophobicContact CD1-CD1 3.31Å; I982-F1003 HydrophobicContact CD1-CD2 4.24Å; I982-F1003 HydrophobicContact CD1-CE1 3.46Å; I982-F1003 VanDerWaalsContact CD1-CE1 3.46Å; I982-F1003 HydrophobicContact CD1-CE2 4.34Å; I982-F1003 HydrophobicContact CD1-CG 3.74Å; I982-F1003 HydrophobicContact CD1-CZ 3.99Å; I982-F1003 HydrophobicContact CG1-CD1 4.02Å; I982-F1003 HydrophobicContact CG1-CE1 3.62Å; I982-F1003 HydrophobicContact CG1-CZ 4Å
983	Q	65.6	Low	52.8	Low	117 Å²	117	84.6 Å²	84.6	55%	0.547	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	130.5	171.8	-61.7	-162.9	-60.5	0	0	110.6	T933	T933-Q983 HydrophobicContact CG2-CG 4.27Å; T933-Q983 PolarHBondContact OG1-NE2 2.93Å
984	L	65.9	Low	54.7	Low	12 Å²	12	82.9 Å²	82.9	6%	0.063	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	132.5	177.5	-73.8	171.5	0	0	0	110.2	S931 I932 V934 V986 V995 K998 A999 L1002	S931-L984 CarbonylContact C-O 3.53Å; S931-L984 WeakPolarHBondContact CA-O 3.41Å; I932-L984 PolarHBondContact N-O 3.29Å; I932-L984 PolarHBondContact O-N 2.94Å; V934-L984 HydrophobicContact CG2-CD1 4.03Å; L984-V986 HydrophobicContact CB-CG2 4.01Å; L984-V995 HydrophobicContact CD1-CG1 3.78Å; L984-V995 WeakPolarHBondContact CD1-O 3.44Å; L984-K998 HydrophobicContact CD1-CB 4.01Å; L984-K998 HydrophobicContact CD2-CB 3.74Å; L984-A999 HydrophobicContact CD1-CB 3.98Å; L984-L1002 HydrophobicContact CD2-CD1 3.51Å
985	S	66.8	Low	56.7	Low	108 Å²	108	73.2 Å²	73.2	76%	0.755	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76	123.7	161.1	57.2	0	0	0	0	109.3
986	V	63.9	Low	58.5	Low	10 Å²	10	68.1 Å²	68.1	6%	0.061	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	132.8	-170.9	179.4	0	0	0	0	110.6	L930 I932 L984 D990 V995 L1027	L930-V986 HydrophobicContact CD2-CB 4.42Å; L930-V986 HydrophobicContact CD2-CG1 4.33Å; L930-V986 PolarHBondContact O-N 3.17Å; I932-V986 HydrophobicContact CB-CG2 3.96Å; I932-V986 HydrophobicContact CD1-CB 4.36Å; I932-V986 HydrophobicContact CD1-CG1 4.19Å; I932-V986 HydrophobicContact CD1-CG2 3.96Å; I932-V986 HydrophobicContact CG1-CB 4.3Å; I932-V986 HydrophobicContact CG1-CG2 3.77Å; L984-V986 HydrophobicContact CB-CG2 4.01Å; V986-D990 WeakPolarHBondContact CA-OD2 3.27Å; V986-D990 HydrophobicContact CG1-CB 3.84Å; V986-D990 WeakPolarHBondContact CG1-OD2 3.39Å; V986-V995 HydrophobicContact CB-CG2 4.42Å; V986-V995 HydrophobicContact CG1-CG2 3.67Å; V986-V995 HydrophobicContact CG2-CG1 4.47Å; V986-V995 HydrophobicContact CG2-CG2 3.78Å; V986-L1027 HydrophobicContact CG1-CD1 3.94Å
987	S	63.6	Low	59.9	Low	49 Å²	49	60.2 Å²	60.2	34%	0.343	35%	0.345	S	S	.	.			trans	-80.3	145.5	176.4	-173	0	0	0	0	110.8	V989 D990	S987-V989 PolarHBondContact O-N 3.05Å; S987-V989 WeakPolarHBondContact OG-CG2 3.22Å; S987-D990 PolarHBondContact N-OD2 2.88Å; S987-D990 WeakPolarHBondContact O-CB 3.17Å; S987-D990 PolarHBondContact O-N 3.3Å
988	P	56	Low	61.5	Low	94 Å²	94	55.3 Å²	55.3	61%	0.61	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-8.6	173.1	-24.8	35.1	0	0	0	115.5
989	V	63.1	Low	62.4	Low	117 Å²	117	49.5 Å²	49.5	71%	0.709	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.1	3.3	175.1	-64.5	0	0	0	0	113.9	S987	S987-V989 PolarHBondContact O-N 3.05Å; S987-V989 WeakPolarHBondContact OG-CG2 3.22Å
990	D	60.7	Low	62.9	Low	19 Å²	19	45.1 Å²	45.1	10%	0.102	27%	0.265	C	S	.	.			trans	-70.9	137.9	170.3	-72.6	-31.4	0	0	0	110	V986 S987 D994 V995 K998	V986-D990 WeakPolarHBondContact CA-OD2 3.27Å; V986-D990 HydrophobicContact CG1-CB 3.84Å; V986-D990 WeakPolarHBondContact CG1-OD2 3.39Å; S987-D990 PolarHBondContact N-OD2 2.88Å; S987-D990 WeakPolarHBondContact O-CB 3.17Å; S987-D990 PolarHBondContact O-N 3.3Å; D990-D994 HydrophobicContact CB-CB 4.16Å; D990-V995 HydrophobicContact CB-CG2 4.23Å; D990-K998 IonicContact OD1-NZ 3.22Å; D990-K998 PolarHBondContact OD1-NZ 3.09Å; D990-K998 IonicContact OD2-NZ 2.82Å; D990-K998 PolarHBondContact OD2-NZ 3.4Å
991	S	64.2	Low	63.1	Low	15 Å²	15	49.2 Å²	49.2	11%	0.105	28%	0.282	C	S	.	.			trans	-81.5	167.2	168	70.2	0	0	0	0	111.9	S993 D994 V995	S991-S993 PolarHBondContact O-N 3.32Å; S991-S993 PolarHBondContact OG-N 3.42Å; S991-D994 WeakPolarHBondContact CB-OD2 3.25Å; S991-D994 PolarHBondContact N-OD2 3.32Å; S991-D994 PolarHBondContact O-N 2.85Å; S991-D994 VanDerWaalsContact O-N 3.15Å; S991-D994 VanDerWaalsContact OG-CG 3.3Å; S991-D994 PolarHBondContact OG-N 3.16Å; S991-D994 PolarHBondContact OG-OD2 3.06Å; S991-V995 PolarHBondContact O-N 3.12Å; S991-V995 VanDerWaalsContact O-N 3.1Å
992	V	59	Low	63.4	Low	30 Å²	30	49.9 Å²	49.9	18%	0.182	29%	0.286	C	S	.	.	H	α-helix	trans	-52.5	-43.9	167.1	170.5	0	0	0	0	110.9	D994 V995 L996 L1027 F1033 E1035	V992-D994 VanDerWaalsContact C-N 3.35Å; V992-D994 PolarHBondContact O-N 3.28Å; V992-V995 PolarHBondContact O-N 3.1Å; V992-L996 HydrophobicContact CG1-CD1 4.04Å; V992-L996 HydrophobicContact CG1-CG 4.45Å; V992-L996 PolarHBondContact O-N 3.37Å; V992-L1027 HydrophobicContact CG2-CD2 4.01Å; V992-L1027 HydrophobicContact CG2-CG 4.44Å; V992-F1033 HydrophobicContact CG1-CD2 3.98Å; V992-F1033 HydrophobicContact CG1-CE2 3.57Å; V992-F1033 HydrophobicContact CG1-CZ 3.98Å; V992-F1033 HydrophobicContact CG2-CE1 4.48Å; V992-F1033 HydrophobicContact CG2-CZ 4.49Å; V992-E1035 WeakPolarHBondContact CG1-OE2 3.45Å
993	S	59.8	Low	63.2	Low	69 Å²	69	48.7 Å²	48.7	48%	0.483	28%	0.28	S	S	.	.	H	α-helix	trans	-61.6	-37.8	177.4	-50.1	0	0	0	0	113	S991 S997	S991-S993 PolarHBondContact O-N 3.32Å; S991-S993 PolarHBondContact OG-N 3.42Å; S993-S997 VanDerWaalsContact O-CB 3.24Å; S993-S997 WeakPolarHBondContact O-CB 3.37Å; S993-S997 PolarHBondContact O-N 2.97Å
994	D	63.2	Low	62.9	Low	71 Å²	71	45.7 Å²	45.7	38%	0.38	28%	0.28	S	S	.	.	H	α-helix	trans	-66.9	-42.1	175.1	-66.6	-64.8	0	0	0	111.4	D990 S991 V992 S997 K998	D990-D994 HydrophobicContact CB-CB 4.16Å; S991-D994 WeakPolarHBondContact CB-OD2 3.25Å; S991-D994 PolarHBondContact N-OD2 3.32Å; S991-D994 PolarHBondContact O-N 2.85Å; S991-D994 VanDerWaalsContact O-N 3.15Å; S991-D994 VanDerWaalsContact OG-CG 3.3Å; S991-D994 PolarHBondContact OG-N 3.16Å; S991-D994 PolarHBondContact OG-OD2 3.06Å; V992-D994 VanDerWaalsContact C-N 3.35Å; V992-D994 PolarHBondContact O-N 3.28Å; D994-S997 PolarHBondContact O-N 3.2Å; D994-K998 WeakPolarHBondContact O-CB 3.49Å; D994-K998 WeakPolarHBondContact O-CD 3.26Å; D994-K998 WeakPolarHBondContact O-CG 3.49Å; D994-K998 PolarHBondContact O-N 3.17Å
995	V	64.7	Low	62.3	Low	0 Å²	0	45.4 Å²	45.4	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-66.7	-43.6	177.7	174.5	0	0	0	0	111.1	I932 L984 V986 D990 S991 V992 K998 A999 L1027 F1033	I932-V995 HydrophobicContact CD1-CG1 4.36Å; I932-V995 HydrophobicContact CD1-CG2 4.46Å; I932-V995 HydrophobicContact CG2-CG1 4.33Å; L984-V995 HydrophobicContact CD1-CG1 3.78Å; L984-V995 WeakPolarHBondContact CD1-O 3.44Å; V986-V995 HydrophobicContact CB-CG2 4.42Å; V986-V995 HydrophobicContact CG1-CG2 3.67Å; V986-V995 HydrophobicContact CG2-CG1 4.47Å; V986-V995 HydrophobicContact CG2-CG2 3.78Å; D990-V995 HydrophobicContact CB-CG2 4.23Å; S991-V995 PolarHBondContact O-N 3.12Å; S991-V995 VanDerWaalsContact O-N 3.1Å; V992-V995 PolarHBondContact O-N 3.1Å; V995-K998 PolarHBondContact O-N 3.21Å; V995-A999 WeakPolarHBondContact O-CB 3.14Å; V995-A999 PolarHBondContact O-N 3.34Å; V995-L1027 HydrophobicContact CB-CD1 4.32Å; V995-L1027 HydrophobicContact CG2-CD1 3.45Å; V995-L1027 VanDerWaalsContact CG2-CD1 3.45Å; V995-F1033 HydrophobicContact CG1-CZ 4.26Å
996	L	63.7	Low	61.6	Low	6 Å²	6	42.3 Å²	42.3	3%	0.031	26%	0.26	C	S	.	.	H	α-helix	trans	-66.7	-37.8	174.5	-70.9	177.9	0	0	0	112.2	V992 K998 A999 L1000 F1033 E1035 F1055	V992-L996 HydrophobicContact CG1-CD1 4.04Å; V992-L996 HydrophobicContact CG1-CG 4.45Å; V992-L996 PolarHBondContact O-N 3.37Å; L996-K998 PolarHBondContact O-N 3.39Å; L996-A999 PolarHBondContact O-N 2.91Å; L996-L1000 WeakPolarHBondContact O-CB 3.39Å; L996-L1000 VanDerWaalsContact O-CG 3.26Å; L996-L1000 WeakPolarHBondContact O-CG 3.44Å; L996-L1000 PolarHBondContact O-N 2.98Å; L996-F1033 HydrophobicContact CD1-CE2 4.41Å; L996-F1033 HydrophobicContact CD2-CE2 4.23Å; L996-F1033 HydrophobicContact CG-CE2 4.21Å; L996-E1035 HydrophobicContact CD1-CB 4.26Å; L996-E1035 HydrophobicContact CD1-CG 4.32Å; L996-E1035 VanDerWaalsContact CD1-OE2 3.31Å; L996-E1035 WeakPolarHBondContact CD1-OE2 3.19Å; L996-F1055 HydrophobicContact CD2-CB 4.2Å; L996-F1055 HydrophobicContact CD2-CD1 4.37Å; L996-F1055 HydrophobicContact CD2-CG 4.4Å
997	S	61.2	Low	60.6	Low	31 Å²	31	46.3 Å²	46.3	22%	0.217	28%	0.281	C	S	.	.	H	α-helix	trans	-60.9	-45.3	172.7	-171.1	0	0	0	0	111.5	S993 D994 K1001	S993-S997 VanDerWaalsContact O-CB 3.24Å; S993-S997 WeakPolarHBondContact O-CB 3.37Å; S993-S997 PolarHBondContact O-N 2.97Å; D994-S997 PolarHBondContact O-N 3.2Å; S997-K1001 WeakPolarHBondContact O-CB 3.36Å; S997-K1001 WeakPolarHBondContact O-CD 3.49Å; S997-K1001 VanDerWaalsContact O-CG 3.26Å; S997-K1001 WeakPolarHBondContact O-CG 3.42Å; S997-K1001 PolarHBondContact O-N 2.76Å; S997-K1001 PolarHBondContact OG-NZ 2.85Å
998	K	66.5	Low	59.6	Low	67 Å²	67	49.1 Å²	49.1	29%	0.291	29%	0.289	S	S	.	.	H	α-helix	trans	-63.4	-40.6	174.9	-68.5	166.5	-163.5	-173.6	0	111.7	L984 D990 D994 V995 L996 L1002	L984-K998 HydrophobicContact CD1-CB 4.01Å; L984-K998 HydrophobicContact CD2-CB 3.74Å; D990-K998 IonicContact OD1-NZ 3.22Å; D990-K998 PolarHBondContact OD1-NZ 3.09Å; D990-K998 IonicContact OD2-NZ 2.82Å; D990-K998 PolarHBondContact OD2-NZ 3.4Å; D994-K998 WeakPolarHBondContact O-CB 3.49Å; D994-K998 WeakPolarHBondContact O-CD 3.26Å; D994-K998 WeakPolarHBondContact O-CG 3.49Å; D994-K998 PolarHBondContact O-N 3.17Å; V995-K998 PolarHBondContact O-N 3.21Å; L996-K998 PolarHBondContact O-N 3.39Å; K998-L1002 WeakPolarHBondContact O-CG 3.46Å; K998-L1002 PolarHBondContact O-N 3.41Å; K998-L1002 VanDerWaalsContact O-N 3.13Å
999	A	65.2	Low	59	Low	0 Å²	0	48.7 Å²	48.7	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-63.7	-51.7	177	0	0	0	0	0	111.5	V934 L984 V995 L996 K1001 L1002 F1003	V934-A999 HydrophobicContact CB-CB 4.42Å; V934-A999 HydrophobicContact CG1-CB 4.08Å; V934-A999 HydrophobicContact CG2-CB 4.23Å; L984-A999 HydrophobicContact CD1-CB 3.98Å; V995-A999 WeakPolarHBondContact O-CB 3.14Å; V995-A999 PolarHBondContact O-N 3.34Å; L996-A999 PolarHBondContact O-N 2.91Å; A999-K1001 VanDerWaalsContact C-N 3.29Å; A999-K1001 PolarHBondContact O-N 3.44Å; A999-L1002 PolarHBondContact O-N 3.38Å; A999-L1002 VanDerWaalsContact O-N 3.09Å; A999-F1003 HydrophobicContact CB-CD2 4.3Å; A999-F1003 HydrophobicContact CB-CE2 4.15Å; A999-F1003 WeakPolarHBondContact O-CD2 3.49Å; A999-F1003 PolarHBondContact O-N 3.28Å
1000	L	64	Low	57.9	Low	3 Å²	3	44.6 Å²	44.6	2%	0.016	25%	0.253	C	S	.	.	H	α-helix	trans	-57.1	-42	178.3	-72.9	169	0	0	0	111.6	L996 F1003 G1004 C1005 V1010 I1037 Y1039 F1055	L996-L1000 WeakPolarHBondContact O-CB 3.39Å; L996-L1000 VanDerWaalsContact O-CG 3.26Å; L996-L1000 WeakPolarHBondContact O-CG 3.44Å; L996-L1000 PolarHBondContact O-N 2.98Å; L1000-F1003 PolarHBondContact O-N 3.13Å; L1000-G1004 PolarHBondContact O-N 3.27Å; L1000-C1005 HydrophobicContact CB-CB 4.08Å; L1000-C1005 HydrophobicContact CD2-CB 4.28Å; L1000-C1005 WeakPolarHBondContact O-CB 3.41Å; L1000-C1005 PolarHBondContact O-N 3.17Å; L1000-V1010 HydrophobicContact CD1-CG1 4.45Å; L1000-I1037 HydrophobicContact CD1-CD1 4.44Å; L1000-Y1039 VanDerWaalsContact CD2-OH 3.32Å; L1000-Y1039 WeakPolarHBondContact CD2-OH 3.36Å; L1000-F1055 HydrophobicContact CD2-CE1 4.08Å; L1000-F1055 HydrophobicContact CD2-CZ 3.71Å
1001	K	63.7	Low	56.9	Low	95 Å²	95	49.3 Å²	49.3	41%	0.413	28%	0.278	S	S	.	.	H	α-helix	trans	-57.5	-47.7	173.3	-78	162	176.3	147.1	0	112.4	S997 A999 G1004 D1007	S997-K1001 WeakPolarHBondContact O-CB 3.36Å; S997-K1001 WeakPolarHBondContact O-CD 3.49Å; S997-K1001 VanDerWaalsContact O-CG 3.26Å; S997-K1001 WeakPolarHBondContact O-CG 3.42Å; S997-K1001 PolarHBondContact O-N 2.76Å; S997-K1001 PolarHBondContact OG-NZ 2.85Å; A999-K1001 VanDerWaalsContact C-N 3.29Å; A999-K1001 PolarHBondContact O-N 3.44Å; K1001-G1004 PolarHBondContact O-N 2.94Å; K1001-G1004 VanDerWaalsContact O-N 3.09Å; K1001-D1007 WeakPolarHBondContact CE-OD1 3.46Å; K1001-D1007 IonicContact NZ-OD1 2.73Å; K1001-D1007 PolarHBondContact NZ-OD1 2.84Å
1002	L	65.4	Low	55.7	Low	103 Å²	103	52.8 Å²	52.8	54%	0.539	30%	0.295	S	S	.	.	H	α-helix	trans	-73.4	-28.7	180	-64.4	179.6	0	0	0	113.3	I982 L984 K998 A999 G1004	I982-L1002 HydrophobicContact CD1-CB 3.69Å; I982-L1002 HydrophobicContact CG2-CB 4.03Å; I982-L1002 HydrophobicContact CG2-CD1 3.62Å; I982-L1002 HydrophobicContact CG2-CG 4.5Å; L984-L1002 HydrophobicContact CD2-CD1 3.51Å; K998-L1002 WeakPolarHBondContact O-CG 3.46Å; K998-L1002 PolarHBondContact O-N 3.41Å; K998-L1002 VanDerWaalsContact O-N 3.13Å; A999-L1002 PolarHBondContact O-N 3.38Å; A999-L1002 VanDerWaalsContact O-N 3.09Å; L1002-G1004 PolarHBondContact O-N 3.41Å
1003	F	61.5	Low	54.6	Low	6 Å²	6	53.3 Å²	53.3	3%	0.026	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-4.2	167.5	-70.2	-58.5	0	0	0	113.2	V934 L936 V954 P980 I982 A999 L1000 F1055	V934-F1003 HydrophobicContact CG1-CE2 3.98Å; V934-F1003 HydrophobicContact CG1-CZ 4.32Å; L936-F1003 HydrophobicContact CB-CE1 4.26Å; L936-F1003 HydrophobicContact CB-CZ 4.1Å; V954-F1003 HydrophobicContact CG1-CB 4.39Å; V954-F1003 HydrophobicContact CG1-CD1 3.48Å; V954-F1003 VanDerWaalsContact CG1-CD1 3.48Å; V954-F1003 HydrophobicContact CG1-CE1 4.18Å; V954-F1003 HydrophobicContact CG1-CG 4.33Å; P980-F1003 HydrophobicContact CB-CE1 4.33Å; I982-F1003 HydrophobicContact CB-CE1 4.48Å; I982-F1003 HydrophobicContact CB-CZ 4.38Å; I982-F1003 HydrophobicContact CD1-CB 4.48Å; I982-F1003 HydrophobicContact CD1-CD1 3.31Å; I982-F1003 HydrophobicContact CD1-CD2 4.24Å; I982-F1003 HydrophobicContact CD1-CE1 3.46Å; I982-F1003 VanDerWaalsContact CD1-CE1 3.46Å; I982-F1003 HydrophobicContact CD1-CE2 4.34Å; I982-F1003 HydrophobicContact CD1-CG 3.74Å; I982-F1003 HydrophobicContact CD1-CZ 3.99Å; I982-F1003 HydrophobicContact CG1-CD1 4.02Å; I982-F1003 HydrophobicContact CG1-CE1 3.62Å; I982-F1003 HydrophobicContact CG1-CZ 4Å; A999-F1003 HydrophobicContact CB-CD2 4.3Å; A999-F1003 HydrophobicContact CB-CE2 4.15Å; A999-F1003 WeakPolarHBondContact O-CD2 3.49Å; A999-F1003 PolarHBondContact O-N 3.28Å; L1000-F1003 PolarHBondContact O-N 3.13Å; F1003-F1055 AromaticContact CD2-CE1 3.85Å; F1003-F1055 HydrophobicContact CD2-CE1 3.85Å; F1003-F1055 HydrophobicContact CE2-CD1 4.11Å; F1003-F1055 AromaticContact CE2-CE1 3.72Å; F1003-F1055 HydrophobicContact CE2-CE1 3.72Å
1004	G	58.1	Low	53.4	Low	54 Å²	54	55.1 Å²	55.1	56%	0.557	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.5	13.1	176.8	0	0	0	0	0	115.3	L1000 K1001 L1002 A1006	L1000-G1004 PolarHBondContact O-N 3.27Å; K1001-G1004 PolarHBondContact O-N 2.94Å; K1001-G1004 VanDerWaalsContact O-N 3.09Å; L1002-G1004 PolarHBondContact O-N 3.41Å; G1004-A1006 PolarHBondContact O-N 2.98Å
1005	C	54.9	Low	52.1	Low	6 Å²	6	54.6 Å²	54.6	4%	0.041	30%	0.295	C	S	.	.			trans	-75.3	100.9	168.1	-77.3	0	0	0	0	109.6	L1000	L1000-C1005 HydrophobicContact CB-CB 4.08Å; L1000-C1005 HydrophobicContact CD2-CB 4.28Å; L1000-C1005 WeakPolarHBondContact O-CB 3.41Å; L1000-C1005 PolarHBondContact O-N 3.17Å
1006	A	52.4	Low	50.5	Low	44 Å²	44	59.6 Å²	59.6	36%	0.364	32%	0.321	S	S	.	.			trans	-60.6	144.5	179.9	0	0	0	0	0	112.8	G1004 Q1008 K1009	G1004-A1006 PolarHBondContact O-N 2.98Å; A1006-Q1008 PolarHBondContact O-N 3.13Å; A1006-K1009 PolarHBondContact O-N 3.38Å
1007	D	41.7	Very low	48.9	Very low	94 Å²	94	65.6 Å²	65.6	50%	0.503	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-49.4	-35	-171.9	-70.2	-74.6	0	0	0	115	K1001 K1009 V1010	K1001-D1007 WeakPolarHBondContact CE-OD1 3.46Å; K1001-D1007 IonicContact NZ-OD1 2.73Å; K1001-D1007 PolarHBondContact NZ-OD1 2.84Å; D1007-K1009 PolarHBondContact O-N 3.46Å; D1007-V1010 PolarHBondContact O-N 2.99Å
1008	Q	42.2	Very low	47.5	Very low	108 Å²	108	68.6 Å²	68.6	51%	0.505	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-72.8	5.5	-178.4	-64.6	-177.7	-15.8	0	0	114.7	A1006	A1006-Q1008 PolarHBondContact O-N 3.13Å
1009	K	43.4	Very low	45.7	Very low	85 Å²	85	70.7 Å²	70.7	37%	0.37	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-113	-16.2	175	-65.5	-163.5	173.4	-163.8	0	114.8	A1006 D1007 D1011 N1012 Y1013	A1006-K1009 PolarHBondContact O-N 3.38Å; D1007-K1009 PolarHBondContact O-N 3.46Å; K1009-D1011 VanDerWaalsContact C-N 3.31Å; K1009-D1011 PolarHBondContact O-N 3.24Å; K1009-N1012 PolarHBondContact O-N 3.01Å; K1009-Y1013 HydrophobicContact CB-CE2 4.02Å; K1009-Y1013 WeakPolarHBondContact O-CD2 3.33Å; K1009-Y1013 PolarHBondContact O-N 2.96Å
1010	V	41.7	Very low	44.1	Very low	30 Å²	30	80.4 Å²	80.4	18%	0.182	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-63.4	-39.6	-175.4	-174.9	0	0	0	0	111.1	L1000 D1007 N1012 Y1013	L1000-V1010 HydrophobicContact CD1-CG1 4.45Å; D1007-V1010 PolarHBondContact O-N 2.99Å; V1010-N1012 PolarHBondContact O-N 3.31Å; V1010-N1012 VanDerWaalsContact O-N 3.08Å; V1010-Y1013 PolarHBondContact O-N 3.2Å; V1010-Y1013 VanDerWaalsContact O-N 3.13Å
1011	D	39.5	Very low	42.6	Very low	119 Å²	119	86.9 Å²	86.9	64%	0.636	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-65.1	-9.6	176.6	-56.7	-19.8	0	0	0	114.6	K1009	K1009-D1011 VanDerWaalsContact C-N 3.31Å; K1009-D1011 PolarHBondContact O-N 3.24Å
1012	N	37.1	Very low	41.1	Very low	88 Å²	88	85.3 Å²	85.3	47%	0.471	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-109.8	1.1	178.2	-74.4	-58.7	0	0	0	113.2	K1009 V1010	K1009-N1012 PolarHBondContact O-N 3.01Å; V1010-N1012 PolarHBondContact O-N 3.31Å; V1010-N1012 VanDerWaalsContact O-N 3.08Å
1013	Y	36.5	Very low	39.6	Very low	40 Å²	40	91.1 Å²	91.1	16%	0.157	47%	0.473	C	S	.	.	S	Bend	trans	-89.1	133.7	171.3	-62.1	-47.7	0	0	0	110.5	K1009 V1010 L1015 I1037 Y1039	K1009-Y1013 HydrophobicContact CB-CE2 4.02Å; K1009-Y1013 WeakPolarHBondContact O-CD2 3.33Å; K1009-Y1013 PolarHBondContact O-N 2.96Å; V1010-Y1013 PolarHBondContact O-N 3.2Å; V1010-Y1013 VanDerWaalsContact O-N 3.13Å; Y1013-L1015 PolarHBondContact O-N 3.28Å; Y1013-I1037 HydrophobicContact CG-CG2 4.44Å; Y1013-Y1039 HydrophobicContact CD1-CD1 4.35Å; Y1013-Y1039 HydrophobicContact CD1-CE1 4.37Å; Y1013-Y1039 AromaticContact CE1-CD1 3.69Å; Y1013-Y1039 HydrophobicContact CE1-CD1 3.69Å; Y1013-Y1039 AromaticContact CE1-CE1 3.67Å; Y1013-Y1039 HydrophobicContact CE1-CE1 3.67Å; Y1013-Y1039 HydrophobicContact CE1-CG 4.36Å; Y1013-Y1039 HydrophobicContact CE2-CE1 4.27Å; Y1013-Y1039 AromaticContact CZ-CE1 3.61Å
1014	D	35	Very low	38.6	Very low	108 Å²	108	97.4 Å²	97.4	58%	0.578	51%	0.506	S	S	*	.	B	Isolated β-bridge	trans	-74.3	77	177.1	-108	-29.4	0	0	0	109.8	I1016	D1014-I1016 HydrophobicContact CB-CD1 3.71Å; D1014-I1016 HydrophobicContact CB-CG1 3.71Å; D1014-I1016 PolarHBondContact O-N 3.14Å
1015	L	34.8	Very low	38.1	Very low	59 Å²	59	100.1 Å²	100.1	31%	0.309	51%	0.507	S	S	.	.			trans	-71.4	63.1	160.2	-78.2	166.6	0	0	0	108.9	Y1013 H1017 V1018 E1035 I1037	Y1013-L1015 PolarHBondContact O-N 3.28Å; L1015-H1017 PolarHBondContact O-N 3.05Å; L1015-V1018 PolarHBondContact O-N 3.44Å; L1015-E1035 WeakPolarHBondContact CD2-OE1 3.41Å; L1015-I1037 HydrophobicContact CD2-CD1 3.91Å; L1015-I1037 HydrophobicContact CD2-CG1 3.96Å
1016	I	31.9	Very low	37.8	Very low	105 Å²	105	103.8 Å²	103.8	54%	0.538	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	125.2	179.7	-65.6	162.7	0	0	0	107.9	D1014	D1014-I1016 HydrophobicContact CB-CD1 3.71Å; D1014-I1016 HydrophobicContact CB-CG1 3.71Å; D1014-I1016 PolarHBondContact O-N 3.14Å
1017	H	30.6	Very low	37.7	Very low	133 Å²	133	102.4 Å²	102.4	62%	0.616	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.4	40.6	-175.5	-65.3	-72.4	0	0	0	118.6	L1015 H1019	L1015-H1017 PolarHBondContact O-N 3.05Å; H1017-H1019 PolarHBondContact O-N 2.78Å
1018	V	31.1	Very low	38	Very low	94 Å²	94	101.1 Å²	101.1	57%	0.57	51%	0.512	S	S	*	.			trans	-65.3	90.3	136.1	-176.8	0	0	0	0	107.8	L1015 K1020	L1015-V1018 PolarHBondContact O-N 3.44Å; V1018-K1020 PolarHBondContact O-N 2.78Å
1019	H	29.5	Very low	38.2	Very low	110 Å²	110	100 Å²	100	51%	0.509	51%	0.506	S	S	.	.			trans	-60	125.8	-177	-135.5	-82.4	0	0	0	109.8	H1017 D1021 A1022	H1017-H1019 PolarHBondContact O-N 2.78Å; H1019-D1021 IonicContact ND1-OD2 3.9Å; H1019-D1021 PolarHBondContact O-N 2.83Å; H1019-A1022 HydrophobicContact CB-CB 3.83Å; H1019-A1022 WeakPolarHBondContact O-CB 3.2Å; H1019-A1022 PolarHBondContact O-N 3.23Å
1020	K	30.2	Very low	38.4	Very low	204 Å²	204	103.5 Å²	103.5	89%	0.887	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-8.4	-176.2	-79.5	-172.7	171.2	-176.9	0	115.3	V1018	V1018-K1020 PolarHBondContact O-N 2.78Å
1021	D	32.6	Very low	38.6	Very low	140 Å²	140	108.2 Å²	108.2	75%	0.749	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.7	-1.6	177.5	-47.8	-78	0	0	0	112.5	H1019 R1023	H1019-D1021 IonicContact ND1-OD2 3.9Å; H1019-D1021 PolarHBondContact O-N 2.83Å; D1021-R1023 PolarHBondContact O-N 3.26Å
1022	A	33.4	Very low	38.8	Very low	62 Å²	62	106.5 Å²	106.5	51%	0.512	53%	0.532	S	S	.	.			trans	-75.3	116.1	172.1	0	0	0	0	0	109.2	H1019	H1019-A1022 HydrophobicContact CB-CB 3.83Å; H1019-A1022 WeakPolarHBondContact O-CB 3.2Å; H1019-A1022 PolarHBondContact O-N 3.23Å
1023	R	32.9	Very low	39.3	Very low	225 Å²	225	103.3 Å²	103.3	85%	0.849	51%	0.514	S	S	*	.			trans	-63.4	145.3	170.3	-59	175.9	-177	175.3	0	109.2	D1021 I1025	D1021-R1023 PolarHBondContact O-N 3.26Å; R1023-I1025 WeakPolarHBondContact O-CG1 3.22Å; R1023-I1025 PolarHBondContact O-N 3.38Å
1024	D	40.9	Very low	39.6	Very low	137 Å²	137	106.8 Å²	106.8	73%	0.733	53%	0.528	S	S	*	.			trans	-51.3	108.4	174.3	-59.9	-69.6	0	0	0	110.8	T1026	D1024-T1026 PolarHBondContact O-N 3.3Å
1025	I	47.4	Very low	40.3	Very low	112 Å²	112	104.2 Å²	104.2	57%	0.574	51%	0.512	S	S	*	.			trans	-79.9	94.9	-179.4	-54.3	-176.5	0	0	0	107.5	R1023 L1027	R1023-I1025 WeakPolarHBondContact O-CG1 3.22Å; R1023-I1025 PolarHBondContact O-N 3.38Å; I1025-L1027 PolarHBondContact O-N 3.38Å
1026	T	49.2	Very low	40.4	Very low	83 Å²	83	105.2 Å²	105.2	51%	0.509	53%	0.525	S	S	.	.			trans	-59.2	124	167.9	40	0	0	0	0	109.3	D1024 P1028	D1024-T1026 PolarHBondContact O-N 3.3Å; T1026-P1028 WeakPolarHBondContact O-CD 3.42Å; T1026-P1028 VanDerWaalsContact O-N 3.13Å
1027	L	50.3	Low	40.9	Very low	15 Å²	15	100.3 Å²	100.3	8%	0.079	50%	0.499	C	S	.	.			trans	-63.2	109.9	-167.9	-78.4	156	0	0	0	112.1	I932 V986 V992 V995 I1025 F1033	I932-L1027 HydrophobicContact CD1-CD1 3.87Å; I932-L1027 HydrophobicContact CD1-CD2 4.23Å; V986-L1027 HydrophobicContact CG1-CD1 3.94Å; V992-L1027 HydrophobicContact CG2-CD2 4.01Å; V992-L1027 HydrophobicContact CG2-CG 4.44Å; V995-L1027 HydrophobicContact CB-CD1 4.32Å; V995-L1027 HydrophobicContact CG2-CD1 3.45Å; V995-L1027 VanDerWaalsContact CG2-CD1 3.45Å; I1025-L1027 PolarHBondContact O-N 3.38Å; L1027-F1033 HydrophobicContact CD2-CD1 3.88Å; L1027-F1033 HydrophobicContact CD2-CE1 3.67Å
1028	P	48.7	Very low	41.2	Very low	66 Å²	66	96.8 Å²	96.8	43%	0.429	49%	0.485	S	S	.	.			trans	-71.5	146	177.3	-13.2	29.8	0	0	0	110	T1026 H1030 F1031	T1026-P1028 WeakPolarHBondContact O-CD 3.42Å; T1026-P1028 VanDerWaalsContact O-N 3.13Å; P1028-H1030 PolarHBondContact O-N 2.68Å; P1028-F1031 HydrophobicContact CB-CB 4.48Å; P1028-F1031 HydrophobicContact CG-CB 4.3Å; P1028-F1031 PolarHBondContact O-N 2.82Å
1029	K	45.7	Very low	41.5	Very low	86 Å²	86	93 Å²	93	37%	0.374	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-4.4	-174.7	-61.3	-167.5	-178	-171.4	0	116.4	S928	S928-K1029 PolarHBondContact OG-NZ 3.07Å
1030	H	47.3	Very low	41.7	Very low	158 Å²	158	92.2 Å²	92.2	73%	0.731	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.8	19	-172.5	-54.1	-53.8	0	0	0	114.1	P1028	P1028-H1030 PolarHBondContact O-N 2.68Å
1031	F	46	Very low	41.9	Very low	128 Å²	128	85.7 Å²	85.7	56%	0.561	45%	0.448	S	S	*	.			trans	-105.2	119.8	-175.5	-138.1	-93.2	0	0	0	112.4	P1028	P1028-F1031 HydrophobicContact CB-CB 4.48Å; P1028-F1031 HydrophobicContact CG-CB 4.3Å; P1028-F1031 PolarHBondContact O-N 2.82Å
1032	N	43.6	Very low	41.7	Very low	83 Å²	83	87.3 Å²	87.3	44%	0.444	45%	0.448	S	S	.	.			trans	-80.5	142.4	162.6	-71.3	-28.5	0	0	0	108.9	Y1034 P1059	N1032-Y1034 HydrophobicContact CB-CE2 4.42Å; N1032-P1059 WeakPolarHBondContact OD1-CD 3.36Å
1033	F	48.7	Very low	41.4	Very low	22 Å²	22	92 Å²	92	10%	0.096	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	153.3	169	71.6	-89.8	0	0	0	111.7	I932 V992 V995 L996 L1027 C1057	I932-F1033 HydrophobicContact CD1-CE1 4.4Å; V992-F1033 HydrophobicContact CG1-CD2 3.98Å; V992-F1033 HydrophobicContact CG1-CE2 3.57Å; V992-F1033 HydrophobicContact CG1-CZ 3.98Å; V992-F1033 HydrophobicContact CG2-CE1 4.48Å; V992-F1033 HydrophobicContact CG2-CZ 4.49Å; V995-F1033 HydrophobicContact CG1-CZ 4.26Å; L996-F1033 HydrophobicContact CD1-CE2 4.41Å; L996-F1033 HydrophobicContact CD2-CE2 4.23Å; L996-F1033 HydrophobicContact CG-CE2 4.21Å; L1027-F1033 HydrophobicContact CD2-CD1 3.88Å; L1027-F1033 HydrophobicContact CD2-CE1 3.67Å; F1033-C1057 HydrophobicContact CD1-CB 3.66Å; F1033-C1057 HydrophobicContact CD2-CB 3.92Å; F1033-C1057 HydrophobicContact CE1-CB 3.38Å; F1033-C1057 HydrophobicContact CE2-CB 3.65Å; F1033-C1057 WeakPolarHBondContact CE2-SG 3.25Å; F1033-C1057 HydrophobicContact CG-CB 3.93Å; F1033-C1057 HydrophobicContact CZ-CB 3.38Å; F1033-C1057 WeakPolarHBondContact CZ-SG 3.26Å; F1033-C1057 PolarHBondContact N-O 2.9Å; F1033-C1057 PolarHBondContact O-N 3.23Å
1034	Y	41.4	Very low	41.2	Very low	112 Å²	112	87.5 Å²	87.5	44%	0.439	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	129.7	-176.6	-57.7	-95.9	0	0	0	107.2	N1032 I1056 L1117	N1032-Y1034 HydrophobicContact CB-CE2 4.42Å; Y1034-I1056 HydrophobicContact CD1-CB 4.44Å; Y1034-I1056 HydrophobicContact CD1-CD1 4.45Å; Y1034-I1056 HydrophobicContact CD1-CG1 4.08Å; Y1034-I1056 HydrophobicContact CD1-CG2 4Å; Y1034-I1056 HydrophobicContact CE1-CD1 4.38Å; Y1034-I1056 HydrophobicContact CE1-CG1 4.39Å; Y1034-I1056 HydrophobicContact CE1-CG2 3.74Å; Y1034-L1117 HydrophobicContact CE2-CD1 4.18Å
1035	E	49.4	Very low	40.6	Very low	54 Å²	54	86.1 Å²	86.1	25%	0.252	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	130.3	179.3	-155.8	162.4	152.6	0	0	110.6	V992 L996 L1015 F1055	V992-E1035 WeakPolarHBondContact CG1-OE2 3.45Å; L996-E1035 HydrophobicContact CD1-CB 4.26Å; L996-E1035 HydrophobicContact CD1-CG 4.32Å; L996-E1035 VanDerWaalsContact CD1-OE2 3.31Å; L996-E1035 WeakPolarHBondContact CD1-OE2 3.19Å; L1015-E1035 WeakPolarHBondContact CD2-OE1 3.41Å; E1035-F1055 PolarHBondContact N-O 2.98Å; E1035-F1055 VanDerWaalsContact N-O 3.1Å; E1035-F1055 WeakPolarHBondContact O-CB 3.27Å; E1035-F1055 PolarHBondContact O-N 3.07Å
1036	S	37.8	Very low	39.7	Very low	81 Å²	81	87.9 Å²	87.9	57%	0.566	47%	0.468	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.7	116.4	-175.1	54.7	0	0	0	0	110.7
1037	I	42.4	Very low	38.7	Very low	1 Å²	1	90.7 Å²	90.7	1%	0.005	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	125.6	-178.9	-54.9	-176	0	0	0	109	L1000 Y1013 L1015 Y1039 L1053 F1055	L1000-I1037 HydrophobicContact CD1-CD1 4.44Å; Y1013-I1037 HydrophobicContact CG-CG2 4.44Å; L1015-I1037 HydrophobicContact CD2-CD1 3.91Å; L1015-I1037 HydrophobicContact CD2-CG1 3.96Å; I1037-Y1039 HydrophobicContact CB-CD2 4.43Å; I1037-Y1039 HydrophobicContact CB-CE2 3.98Å; I1037-Y1039 HydrophobicContact CG2-CD2 3.99Å; I1037-Y1039 HydrophobicContact CG2-CE2 3.61Å; I1037-L1053 PolarHBondContact N-O 3.28Å; I1037-L1053 PolarHBondContact O-N 3.12Å; I1037-F1055 HydrophobicContact CB-CD2 4.4Å; I1037-F1055 HydrophobicContact CB-CE2 4.06Å; I1037-F1055 HydrophobicContact CD1-CD2 3.91Å; I1037-F1055 HydrophobicContact CD1-CE2 3.68Å; I1037-F1055 HydrophobicContact CD1-CZ 4.27Å; I1037-F1055 HydrophobicContact CG1-CD2 3.96Å; I1037-F1055 HydrophobicContact CG1-CE2 3.95Å
1038	N	36.4	Very low	37.5	Very low	59 Å²	59	98.3 Å²	98.3	32%	0.316	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	122.4	175.1	-107	-37.8	0	0	0	110.6	L1052	N1038-L1052 WeakPolarHBondContact OD1-CG 3.14Å
1039	Y	37	Very low	36.8	Very low	14 Å²	14	102 Å²	102	6%	0.055	52%	0.524	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	108.6	174.3	-76.7	-116.4	0	0	0	109.6	F950 L1000 Y1013 I1037 E1051 L1053 F1055	F950-Y1039 HydrophobicContact CE1-CE1 4.4Å; F950-Y1039 HydrophobicContact CE2-CE1 4.31Å; F950-Y1039 HydrophobicContact CZ-CE1 4.07Å; L1000-Y1039 VanDerWaalsContact CD2-OH 3.32Å; L1000-Y1039 WeakPolarHBondContact CD2-OH 3.36Å; Y1013-Y1039 HydrophobicContact CD1-CD1 4.35Å; Y1013-Y1039 HydrophobicContact CD1-CE1 4.37Å; Y1013-Y1039 AromaticContact CE1-CD1 3.69Å; Y1013-Y1039 HydrophobicContact CE1-CD1 3.69Å; Y1013-Y1039 AromaticContact CE1-CE1 3.67Å; Y1013-Y1039 HydrophobicContact CE1-CE1 3.67Å; Y1013-Y1039 HydrophobicContact CE1-CG 4.36Å; Y1013-Y1039 HydrophobicContact CE2-CE1 4.27Å; Y1013-Y1039 AromaticContact CZ-CE1 3.61Å; I1037-Y1039 HydrophobicContact CB-CD2 4.43Å; I1037-Y1039 HydrophobicContact CB-CE2 3.98Å; I1037-Y1039 HydrophobicContact CG2-CD2 3.99Å; I1037-Y1039 HydrophobicContact CG2-CE2 3.61Å; Y1039-E1051 WeakPolarHBondContact CA-O 3.4Å; Y1039-E1051 WeakPolarHBondContact CB-O 3.3Å; Y1039-E1051 PolarHBondContact N-O 3.1Å; Y1039-E1051 PolarHBondContact O-N 3.06Å; Y1039-L1053 HydrophobicContact CD1-CD1 4.38Å; Y1039-L1053 HydrophobicContact CD2-CB 4.13Å; Y1039-L1053 HydrophobicContact CD2-CD1 3.65Å; Y1039-L1053 HydrophobicContact CD2-CG 4.18Å; Y1039-L1053 HydrophobicContact CE1-CD1 4.38Å; Y1039-L1053 HydrophobicContact CE2-CB 4.12Å; Y1039-L1053 HydrophobicContact CE2-CD1 3.67Å; Y1039-L1053 HydrophobicContact CE2-CG 4.4Å; Y1039-L1053 HydrophobicContact CG-CD1 4.03Å; Y1039-F1055 HydrophobicContact CE2-CE2 4.45Å
1040	S	35.3	Very low	36.2	Very low	94 Å²	94	105 Å²	105	66%	0.657	53%	0.534	S	S	*	.			trans	-86.9	115.5	162.6	52.3	0	0	0	0	108.7
1041	S	33.5	Very low	35.8	Very low	67 Å²	67	99.3 Å²	99.3	47%	0.469	51%	0.508	S	S	.	.			trans	-138.5	132.1	179.2	76.8	0	0	0	0	111.9
1042	F	28.4	Very low	35.5	Very low	174 Å²	174	96.2 Å²	96.2	76%	0.763	50%	0.497	S	S	*	.			trans	53.6	96.6	177.9	-70.5	-82.7	0	0	0	117.6	L1044	F1042-L1044 HydrophobicContact CB-CD1 4.39Å; F1042-L1044 HydrophobicContact CD1-CD1 3.82Å; F1042-L1044 PolarHBondContact O-N 3.08Å
1043	N	26.7	Very low	35.7	Very low	160 Å²	160	92.2 Å²	92.2	86%	0.856	48%	0.476	S	S	*	.			trans	-68.3	88	143.3	-101.7	-8.4	0	0	0	108.7
1044	L	28.9	Very low	35.6	Very low	132 Å²	132	94.2 Å²	94.2	69%	0.691	49%	0.485	S	S	*	.			trans	-96.5	155.4	141.1	-94	76.8	0	0	0	107.9	F1042 N1046	F1042-L1044 HydrophobicContact CB-CD1 4.39Å; F1042-L1044 HydrophobicContact CD1-CD1 3.82Å; F1042-L1044 PolarHBondContact O-N 3.08Å; L1044-N1046 PolarHBondContact O-N 3.11Å
1045	S	28.4	Very low	36.1	Very low	107 Å²	107	89 Å²	89	75%	0.748	47%	0.465	S	S	*	.	S	Bend	trans	-57.4	132.3	-173.4	50.9	0	0	0	0	113.8
1046	N	27.7	Very low	36	Very low	149 Å²	149	87.8 Å²	87.8	80%	0.797	46%	0.46	S	S	*	.	S	Bend	trans	76.8	134.4	171.7	-58.3	-31.2	0	0	0	117.7	L1044	L1044-N1046 PolarHBondContact O-N 3.11Å
1047	N	29.2	Very low	36.6	Very low	142 Å²	142	84 Å²	84	76%	0.759	43%	0.433	S	S	*	.			trans	69.7	108.5	-179.1	-63	-11.8	0	0	0	117.1	H1049	N1047-H1049 PolarHBondContact O-N 3.4Å
1048	K	26.1	Very low	36.9	Very low	176 Å²	176	86.2 Å²	86.2	77%	0.765	45%	0.447	S	S	*	.			trans	-70.6	116.7	174.1	-60.9	179.1	-178.6	-178.8	0	110.7
1049	H	31.9	Very low	37.3	Very low	143 Å²	143	84.9 Å²	84.9	66%	0.662	44%	0.442	S	S	*	.			trans	-129.4	127.2	163.4	-68.7	-81.1	0	0	0	109.7	N1047	N1047-H1049 PolarHBondContact O-N 3.4Å
1050	Y	34.9	Very low	37.8	Very low	150 Å²	150	86.4 Å²	86.4	59%	0.588	45%	0.452	S	S	*	.			trans	-97.8	135.7	170.5	-62	-91.1	0	0	0	108.4	N940	N940-Y1050 PolarHBondContact ND2-O 2.78Å
1051	E	38.9	Very low	38	Very low	38 Å²	38	86 Å²	86	18%	0.178	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	108.3	171.4	-78.1	-172.5	-140	0	0	109	S948 Y1039	S948-E1051 WeakPolarHBondContact CB-OE1 2.93Å; S948-E1051 WeakPolarHBondContact CB-OE2 3.36Å; S948-E1051 PolarHBondContact OG-OE2 3.43Å; Y1039-E1051 WeakPolarHBondContact CA-O 3.4Å; Y1039-E1051 WeakPolarHBondContact CB-O 3.3Å; Y1039-E1051 PolarHBondContact N-O 3.1Å; Y1039-E1051 PolarHBondContact O-N 3.06Å
1052	L	40	Very low	38.2	Very low	62 Å²	62	88.6 Å²	88.6	33%	0.325	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	115.7	178.3	-157.1	158.3	0	0	0	108.5	T939 N1038	T939-L1052 PolarHBondContact N-O 2.78Å; T939-L1052 WeakPolarHBondContact OG1-CB 3.45Å; T939-L1052 WeakPolarHBondContact OG1-CD2 3.27Å; T939-L1052 PolarHBondContact OG1-O 2.86Å; N1038-L1052 WeakPolarHBondContact OD1-CG 3.14Å
1053	L	46.5	Very low	38.4	Very low	0 Å²	0	86.9 Å²	86.9	0%	0	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	124.7	-173.4	-72.6	174.9	0	0	0	110.3	L936 F950 I951 I1037 Y1039 F1055	L936-L1053 HydrophobicContact CD1-CB 4.05Å; L936-L1053 HydrophobicContact CD1-CD1 4.33Å; L936-L1053 HydrophobicContact CD1-CD2 4.29Å; L936-L1053 HydrophobicContact CD1-CG 4.46Å; L936-L1053 HydrophobicContact CG-CD2 4.36Å; F950-L1053 HydrophobicContact CD1-CD1 3.63Å; F950-L1053 HydrophobicContact CE1-CD1 3.57Å; I951-L1053 HydrophobicContact CD1-CD2 3.87Å; I951-L1053 HydrophobicContact CG1-CD2 4.24Å; I1037-L1053 PolarHBondContact N-O 3.28Å; I1037-L1053 PolarHBondContact O-N 3.12Å; Y1039-L1053 HydrophobicContact CD1-CD1 4.38Å; Y1039-L1053 HydrophobicContact CD2-CB 4.13Å; Y1039-L1053 HydrophobicContact CD2-CD1 3.65Å; Y1039-L1053 HydrophobicContact CD2-CG 4.18Å; Y1039-L1053 HydrophobicContact CE1-CD1 4.38Å; Y1039-L1053 HydrophobicContact CE2-CB 4.12Å; Y1039-L1053 HydrophobicContact CE2-CD1 3.67Å; Y1039-L1053 HydrophobicContact CE2-CG 4.4Å; Y1039-L1053 HydrophobicContact CG-CD1 4.03Å; L1053-F1055 HydrophobicContact CB-CE2 4.31Å
1054	E	47.2	Very low	38.4	Very low	64 Å²	64	87.7 Å²	87.7	30%	0.299	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	125.7	-178	173.6	177.4	-159.4	0	0	110	H937 T939 I1056	H937-E1054 HydrophobicContact CB-CB 4.15Å; H937-E1054 PolarHBondContact N-O 3.3Å; H937-E1054 PolarHBondContact O-N 3.45Å; T939-E1054 HydrophobicContact CG2-CB 3.65Å; T939-E1054 WeakPolarHBondContact CG2-OE2 3.34Å; E1054-I1056 HydrophobicContact CG-CG1 4.07Å
1055	F	51.6	Low	38.4	Very low	1 Å²	1	87.3 Å²	87.3	0%	0.004	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	113.9	175.9	-70	-103.8	0	0	0	108.7	V934 L936 L996 L1000 F1003 E1035 I1037 Y1039 L1053	V934-F1055 HydrophobicContact CG1-CD1 4Å; L936-F1055 HydrophobicContact CD1-CD1 4.27Å; L936-F1055 HydrophobicContact CD1-CD2 4.22Å; L936-F1055 HydrophobicContact CD1-CE1 3.77Å; L936-F1055 HydrophobicContact CD1-CE2 3.68Å; L936-F1055 HydrophobicContact CD1-CG 4.48Å; L936-F1055 HydrophobicContact CD1-CZ 3.43Å; L936-F1055 VanDerWaalsContact CD1-CZ 3.43Å; L996-F1055 HydrophobicContact CD2-CB 4.2Å; L996-F1055 HydrophobicContact CD2-CD1 4.37Å; L996-F1055 HydrophobicContact CD2-CG 4.4Å; L1000-F1055 HydrophobicContact CD2-CE1 4.08Å; L1000-F1055 HydrophobicContact CD2-CZ 3.71Å; F1003-F1055 AromaticContact CD2-CE1 3.85Å; F1003-F1055 HydrophobicContact CD2-CE1 3.85Å; F1003-F1055 HydrophobicContact CE2-CD1 4.11Å; F1003-F1055 AromaticContact CE2-CE1 3.72Å; F1003-F1055 HydrophobicContact CE2-CE1 3.72Å; E1035-F1055 PolarHBondContact N-O 2.98Å; E1035-F1055 VanDerWaalsContact N-O 3.1Å; E1035-F1055 WeakPolarHBondContact O-CB 3.27Å; E1035-F1055 PolarHBondContact O-N 3.07Å; I1037-F1055 HydrophobicContact CB-CD2 4.4Å; I1037-F1055 HydrophobicContact CB-CE2 4.06Å; I1037-F1055 HydrophobicContact CD1-CD2 3.91Å; I1037-F1055 HydrophobicContact CD1-CE2 3.68Å; I1037-F1055 HydrophobicContact CD1-CZ 4.27Å; I1037-F1055 HydrophobicContact CG1-CD2 3.96Å; I1037-F1055 HydrophobicContact CG1-CE2 3.95Å; Y1039-F1055 HydrophobicContact CE2-CE2 4.45Å; L1053-F1055 HydrophobicContact CB-CE2 4.31Å
1056	I	48.2	Very low	38.4	Very low	30 Å²	30	88.2 Å²	88.2	15%	0.154	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	116.9	175.8	-53.1	-172.8	0	0	0	108.5	V934 S935 Y1034 E1054 T1058	V934-I1056 WeakPolarHBondContact CA-O 3.39Å; S935-I1056 PolarHBondContact N-O 2.76Å; S935-I1056 PolarHBondContact O-N 2.68Å; Y1034-I1056 HydrophobicContact CD1-CB 4.44Å; Y1034-I1056 HydrophobicContact CD1-CD1 4.45Å; Y1034-I1056 HydrophobicContact CD1-CG1 4.08Å; Y1034-I1056 HydrophobicContact CD1-CG2 4Å; Y1034-I1056 HydrophobicContact CE1-CD1 4.38Å; Y1034-I1056 HydrophobicContact CE1-CG1 4.39Å; Y1034-I1056 HydrophobicContact CE1-CG2 3.74Å; E1054-I1056 HydrophobicContact CG-CG1 4.07Å; I1056-T1058 HydrophobicContact CG2-CG2 4.31Å
1057	C	49.6	Very low	38.5	Very low	1 Å²	1	87.9 Å²	87.9	1%	0.007	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	117.7	-176.6	-67.2	0	0	0	0	110.8	I932 F1033	I932-C1057 HydrophobicContact CG2-CB 3.96Å; F1033-C1057 HydrophobicContact CD1-CB 3.66Å; F1033-C1057 HydrophobicContact CD2-CB 3.92Å; F1033-C1057 HydrophobicContact CE1-CB 3.38Å; F1033-C1057 HydrophobicContact CE2-CB 3.65Å; F1033-C1057 WeakPolarHBondContact CE2-SG 3.25Å; F1033-C1057 HydrophobicContact CG-CB 3.93Å; F1033-C1057 HydrophobicContact CZ-CB 3.38Å; F1033-C1057 WeakPolarHBondContact CZ-SG 3.26Å; F1033-C1057 PolarHBondContact N-O 2.9Å; F1033-C1057 PolarHBondContact O-N 3.23Å
1058	T	48	Very low	38.5	Very low	48 Å²	48	88.6 Å²	88.6	29%	0.294	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	129	-177.1	52.6	0	0	0	0	111	I932 T933 I1056	I932-T1058 CarbonylContact C-O 3.48Å; I932-T1058 WeakPolarHBondContact CA-O 3.38Å; T933-T1058 PolarHBondContact N-O 3.05Å; T933-T1058 PolarHBondContact O-N 3.01Å; T933-T1058 PolarHBondContact O-OG1 2.78Å; I1056-T1058 HydrophobicContact CG2-CG2 4.31Å
1059	P	46.1	Very low	38.7	Very low	31 Å²	31	86.8 Å²	86.8	20%	0.201	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	121.8	179.6	32	-30.1	0	0	0	110.7	L930 S931 N1032	L930-P1059 HydrophobicContact CD1-CB 4.22Å; S931-P1059 CarbonylContact O-C 3.59Å; S931-P1059 WeakPolarHBondContact O-CA 3.49Å; N1032-P1059 WeakPolarHBondContact OD1-CD 3.36Å
1060	T	46.3	Very low	38.7	Very low	46 Å²	46	85.9 Å²	85.9	28%	0.282	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	110	175.5	26.5	0	0	0	0	109.7	S931 T933	S931-T1060 PolarHBondContact N-O 3.42Å; S931-T1060 PolarHBondContact O-N 3.33Å; S931-T1060 PolarHBondContact O-OG1 2.76Å; S931-T1060 VanDerWaalsContact OG-CB 3.29Å; S931-T1060 WeakPolarHBondContact OG-CB 3.38Å; S931-T1060 PolarHBondContact OG-O 3.46Å; S931-T1060 PolarHBondContact OG-OG1 3.46Å; T933-T1060 PolarHBondContact OG1-OG1 2.86Å; T933-T1060 VanDerWaalsContact OG1-OG1 3.06Å
1061	I	40.3	Very low	38.4	Very low	84 Å²	84	85.4 Å²	85.4	43%	0.431	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	111.2	177	-55.6	176.8	0	0	0	108.7	N1063	I1061-N1063 PolarHBondContact O-N 3.13Å
1062	H	37.8	Very low	37.9	Very low	122 Å²	122	88.3 Å²	88.3	57%	0.565	47%	0.472	S	S	*	.			trans	-81.2	102.2	170.4	-76.1	-89.2	0	0	0	110.1	E1064	H1062-E1064 PolarHBondContact O-N 2.63Å
1063	N	31.1	Very low	37.4	Very low	139 Å²	139	92.1 Å²	92.1	74%	0.743	49%	0.492	S	S	*	.			trans	-79.1	92.3	164.5	-94	-3.9	0	0	0	109.1	I1061 N1065	I1061-N1063 PolarHBondContact O-N 3.13Å; N1063-N1065 PolarHBondContact O-N 3.5Å
1064	E	27.1	Very low	36.3	Very low	177 Å²	177	99.1 Å²	99.1	83%	0.827	53%	0.529	S	S	*	.			trans	-71.2	93.8	164.5	-70.9	-173.4	168.2	0	0	109.1	H1062	H1062-E1064 PolarHBondContact O-N 2.63Å
1065	N	29.9	Very low	35.5	Very low	124 Å²	124	101.5 Å²	101.5	66%	0.663	55%	0.553	S	S	*	*			trans	-144.1	100.2	176.1	-116.1	-42	0	0	0	111.8	N1063	N1063-N1065 PolarHBondContact O-N 3.5Å
1066	N	28.2	Very low	34.3	Very low	125 Å²	125	107.3 Å²	107.3	67%	0.668	59%	0.593	S	S	*	*			trans	66.6	112.9	156	-59	-53.1	0	0	0	120.3
1067	N	30.5	Very low	33.6	Very low	142 Å²	142	111.8 Å²	111.8	76%	0.759	62%	0.624	S	S	*	*			trans	65.5	104.7	131.9	-57	-25.5	0	0	0	119.1	N1069	N1067-N1069 PolarHBondContact O-N 2.93Å
1068	D	28	Very low	32.6	Very low	157 Å²	157	116.8 Å²	116.8	84%	0.84	66%	0.66	S	S	*	*			trans	-50.1	131.5	146.6	-61.1	-71	0	0	0	111.2
1069	N	31.4	Very low	31.7	Very low	139 Å²	139	119.7 Å²	119.7	74%	0.743	68%	0.682	S	S	*	*			trans	-162.7	101	141.6	-107.3	-65.2	0	0	0	111.8	N1067	N1067-N1069 PolarHBondContact O-N 2.93Å
1070	N	30.2	Very low	30.9	Very low	123 Å²	123	123.1 Å²	123.1	66%	0.658	71%	0.706	S	S	*	*			trans	55.3	125.5	134.7	-69.9	-52.6	0	0	0	121.2
1071	N	29	Very low	30.2	Very low	141 Å²	141	125.9 Å²	125.9	75%	0.754	73%	0.728	S	S	*	*			trans	62.5	114.4	139.2	-54.7	-23.1	0	0	0	117.2
1072	S	29.3	Very low	29.8	Very low	98 Å²	98	128 Å²	128	69%	0.685	74%	0.744	S	S	*	*				167.5	171.6	60.3	50.8	0	0	0	0	111.6
1073	L	28.9	Very low	29.5	Very low	143 Å²	143	127.8 Å²	127.8	75%	0.749	75%	0.752	S	S	*	*			trans	53.3	108.1	152.4	-65.9	160.6	0	0	0	118.1
1074	N	24.6	Very low	29.3	Very low	147 Å²	147	125.5 Å²	125.5	79%	0.786	75%	0.753	S	S	*	*				57	96.8	90.2	-71	-8.4	0	0	0	115.6
1075	S	29.9	Very low	29.5	Very low	113 Å²	113	121.4 Å²	121.4	79%	0.79	75%	0.749	S	S	*	*				177.8	120.3	116.9	45.5	0	0	0	0	114.6
1076	S	25.9	Very low	29.3	Very low	123 Å²	123	125.9 Å²	125.9	86%	0.86	76%	0.758	S	S	*	*				45.8	154.7	129.1	-52.1	0	0	0	0	124.3
1077	P	34.2	Very low	29.2	Very low	124 Å²	124	127.4 Å²	127.4	81%	0.805	76%	0.764	S	S	*	*			trans	-115.1	170.7	-169.3	43	-33.8	0	0	0	115.5
1078	S	27.5	Very low	29	Very low	107 Å²	107	129.5 Å²	129.5	75%	0.748	77%	0.767	S	S	*	*			trans	-167.1	145.4	157.3	54.1	0	0	0	0	115.2
1079	S	28.9	Very low	28.9	Very low	109 Å²	109	126 Å²	126	76%	0.762	76%	0.76	S	S	*	*			trans	61.9	145.5	150.6	43.9	0	0	0	0	120.9
1080	S	30.1	Very low	28.7	Very low	102 Å²	102	125.9 Å²	125.9	71%	0.713	76%	0.759	S	S	*	*			cis	-169.7	168.1	-5.1	43.5	0	0	0	0	113.4
1081	S	31.2	Very low	28.6	Very low	104 Å²	104	126.1 Å²	126.1	73%	0.727	76%	0.76	S	S	*	*			trans	69.7	139.9	161.4	62	0	0	0	0	118.7
1082	T	31.9	Very low	28.4	Very low	128 Å²	128	125.6 Å²	125.6	79%	0.785	76%	0.758	S	S	*	*			cis	-175.9	165.3	-9.7	28.3	0	0	0	0	106.4
1083	T	31	Very low	28.3	Very low	119 Å²	119	126.1 Å²	126.1	73%	0.73	76%	0.757	S	S	*	*			cis	-174.5	114	-19.4	-80.6	0	0	0	0	103.9
1084	A	26.8	Very low	28.2	Very low	91 Å²	91	125.3 Å²	125.3	75%	0.752	75%	0.754	S	S	*	*				86.1	104.5	63.4	0	0	0	0	0	115.8
1085	A	31.3	Very low	28.3	Very low	90 Å²	90	127.2 Å²	127.2	74%	0.744	75%	0.751	S	S	*	*			trans	-166.4	155.9	161.4	0	0	0	0	0	107.7
1086	Y	26	Very low	28.3	Very low	218 Å²	218	129.8 Å²	129.8	86%	0.855	75%	0.75	S	S	*	*			cis	85.2	140.8	12.5	-57.5	-50.8	0	0	0	116.8
1087	I	27.3	Very low	28.5	Very low	157 Å²	157	127.1 Å²	127.1	81%	0.805	74%	0.742	S	S	*	*			cis	-141.4	-158.9	8.1	-144.2	165.1	0	0	0	115.1
1088	K	25.8	Very low	28.3	Very low	186 Å²	186	130 Å²	130	81%	0.809	74%	0.742	S	S	*	*			trans	-72.9	137.6	-167.2	-75.4	177.1	174.3	178.1	0	118.8
1089	A	25.8	Very low	28.4	Very low	85 Å²	85	133.1 Å²	133.1	70%	0.702	74%	0.742	S	S	*	*				68.3	160.3	118.1	0	0	0	0	0	125.2
1090	N	27.7	Very low	28.6	Very low	136 Å²	136	136.5 Å²	136.5	73%	0.727	75%	0.745	S	S	*	*			trans	84.6	103.9	161.1	-75.3	12.4	0	0	0	121.9
1091	N	27	Very low	28.5	Very low	127 Å²	127	138.5 Å²	138.5	68%	0.679	75%	0.748	S	S	*	*				76.2	125.3	122	-63.7	1.1	0	0	0	122.9
1092	N	26.2	Very low	28.8	Very low	130 Å²	130	138 Å²	138	70%	0.695	74%	0.742	S	S	*	*			trans	85.9	107.7	130.6	-72	8	0	0	0	122.2
1093	T	27.2	Very low	28.7	Very low	109 Å²	109	141.2 Å²	141.2	67%	0.669	75%	0.745	S	S	*	*				80.7	127.3	121.6	59.8	0	0	0	0	122.4
1094	N	26.8	Very low	28.6	Very low	127 Å²	127	140.6 Å²	140.6	68%	0.679	74%	0.743	S	S	*	*				89.1	101.6	128.3	-68.9	2.3	0	0	0	122.5
1095	Y	25.8	Very low	28.6	Very low	187 Å²	187	144.3 Å²	144.3	73%	0.733	75%	0.751	S	S	*	*				86.3	137.2	118.3	-88.4	-71.7	0	0	0	124
1096	H	29.4	Very low	28.4	Very low	167 Å²	167	148 Å²	148	77%	0.773	76%	0.755	S	S	*	*			trans	87.9	130.2	142.7	-75.6	-41.9	0	0	0	122.7
1097	G	30.4	Very low	28.5	Very low	66 Å²	66	143.6 Å²	143.6	68%	0.68	75%	0.75	S	S	*	*			trans	135.2	81	172.3	0	0	0	0	0	111.5
1098	K	30	Very low	28.5	Very low	185 Å²	185	143 Å²	143	80%	0.804	75%	0.754	S	S	*	*				49.1	128	81.1	-64.2	-179.5	-178.4	170.8	0	112.7
1099	K	29.4	Very low	28.6	Very low	172 Å²	172	139 Å²	139	75%	0.748	75%	0.746	S	S	*	*			cis	-165.5	145.8	-4.5	-96.4	177.5	172.6	-175.7	0	107.1
1100	H	34.5	Very low	28.6	Very low	180 Å²	180	140 Å²	140	83%	0.833	74%	0.736	S	S	*	*				163	160.8	124.2	-97.1	-86.9	0	0	0	113
1101	N	28	Very low	28.6	Very low	144 Å²	144	144.3 Å²	144.3	77%	0.77	74%	0.743	S	S	*	*			trans	-149.1	174.2	-171.8	-138.1	-2.7	0	0	0	105.6
1102	P	35.6	Very low	28.5	Very low	95 Å²	95	144 Å²	144	62%	0.617	75%	0.747	S	S	*	*			cis	-144.4	167.6	1.5	42.5	-24.1	0	0	0	118.2
1103	K	30.1	Very low	28.6	Very low	194 Å²	194	145.8 Å²	145.8	84%	0.843	75%	0.748	S	S	*	*			trans	62.4	161.3	143.9	-78.6	-178.8	177.1	-173.7	0	120.1
1104	P	30	Very low	28.5	Very low	106 Å²	106	149.2 Å²	149.2	69%	0.688	76%	0.757	S	S	*	*				-138.4	124.4	-50.3	35.9	-17.6	0	0	0	112.9
1105	N	26.1	Very low	28.5	Very low	170 Å²	170	152.5 Å²	152.5	91%	0.909	76%	0.761	S	S	*	*			trans	-159	104.6	161.8	-102.8	-24.2	0	0	0	108.4
1106	M	27.3	Very low	28.4	Very low	168 Å²	168	152.1 Å²	152.1	83%	0.828	76%	0.763	S	S	*	*			trans	-136.5	114.5	171.2	-68.7	-149	80.3	0	0	110.7
1107	T	27.6	Very low	28.4	Very low	125 Å²	125	150.9 Å²	150.9	77%	0.767	76%	0.761	S	S	*	*			trans	-58.9	136.4	155.8	40.1	0	0	0	0	109.5	T1109	T1107-T1109 PolarHBondContact O-N 3.33Å; T1107-T1109 PolarHBondContact O-OG1 3.33Å
1108	T	26.9	Very low	28.1	Very low	144 Å²	144	153.3 Å²	153.3	88%	0.883	76%	0.763	S	S	*	*			trans	-58.9	133.8	170.4	33.5	0	0	0	0	110
1109	T	28.5	Very low	28.1	Very low	103 Å²	103	150.1 Å²	150.1	63%	0.632	76%	0.764	S	S	*	*			trans	-105	124	-163.7	-25.1	0	0	0	0	111	T1107	T1107-T1109 PolarHBondContact O-N 3.33Å; T1107-T1109 PolarHBondContact O-OG1 3.33Å
1110	E	25.9	Very low	28.1	Very low	106 Å²	106	151.8 Å²	151.8	50%	0.495	77%	0.771	S	S	.	*			trans	-71.5	133.5	178.6	-63.3	170.4	148.7	0	0	111.2	T1112 W1131	E1110-T1112 PolarHBondContact O-N 3.24Å; E1110-W1131 VanDerWaalsContact OE1-CE3 3.28Å
1111	Y	27.3	Very low	27.9	Very low	225 Å²	225	147.9 Å²	147.9	88%	0.882	76%	0.764	S	S	*	*			trans	-96.1	81.7	179	-89.4	-89.3	0	0	0	111.7	K1113	Y1111-K1113 PolarHBondContact O-N 2.89Å
1112	T	25.4	Very low	28.2	Very low	122 Å²	122	146.4 Å²	146.4	75%	0.748	77%	0.765	S	S	*	*			trans	-71.1	107.4	175.3	19.6	0	0	0	0	112.2	E1110	E1110-T1112 PolarHBondContact O-N 3.24Å
1113	K	27.5	Very low	27.9	Very low	166 Å²	166	149.7 Å²	149.7	72%	0.722	78%	0.778	S	S	*	*			trans	-94.9	101.2	165.8	-83.6	-173	175	180	0	111	Y1111 Y1115	Y1111-K1113 PolarHBondContact O-N 2.89Å; K1113-Y1115 HydrophobicContact CB-CE2 4.32Å; K1113-Y1115 PolarHBondContact O-N 3.05Å
1114	Q	25.4	Very low	27.9	Very low	182 Å²	182	150.2 Å²	150.2	85%	0.85	78%	0.78	S	S	*	*			trans	-74.5	110.2	170.6	-71	-173.3	-9.6	0	0	111.5
1115	Y	26.8	Very low	27.7	Very low	195 Å²	195	154.8 Å²	154.8	77%	0.765	79%	0.791	S	S	*	*			trans	-93.2	111	165	-70.7	-71.2	0	0	0	110.5	K1113 L1117	K1113-Y1115 HydrophobicContact CB-CE2 4.32Å; K1113-Y1115 PolarHBondContact O-N 3.05Å; Y1115-L1117 PolarHBondContact O-N 3.39Å
1116	K	24.6	Very low	27.7	Very low	180 Å²	180	152.1 Å²	152.1	78%	0.783	79%	0.785	S	S	*	*			trans	-97.8	77.7	-174.2	-168.6	178.8	179.8	174.8	0	111.8	T1118	K1116-T1118 HydrophobicContact CG-CG2 4.22Å; K1116-T1118 PolarHBondContact O-N 2.81Å; K1116-T1118 VanDerWaalsContact O-N 3.15Å
1117	L	28	Very low	27.6	Very low	140 Å²	140	150.3 Å²	150.3	73%	0.733	78%	0.784	S	S	*	*			trans	-69.2	106.5	173	-87.7	167.1	0	0	0	110.8	Y1034 Y1115	Y1034-L1117 HydrophobicContact CE2-CD1 4.18Å; Y1115-L1117 PolarHBondContact O-N 3.39Å
1118	T	26	Very low	27.6	Very low	118 Å²	118	150 Å²	150	72%	0.724	78%	0.781	S	S	*	*			trans	-100.2	117.8	175	51.5	0	0	0	0	110.6	K1116	K1116-T1118 HydrophobicContact CG-CG2 4.22Å; K1116-T1118 PolarHBondContact O-N 2.81Å; K1116-T1118 VanDerWaalsContact O-N 3.15Å
1119	S	29.9	Very low	27.5	Very low	117 Å²	117	150.2 Å²	150.2	82%	0.818	77%	0.772	S	S	*	*			trans	-132.6	142.8	167.9	-172	0	0	0	0	109.9	S1121	S1119-S1121 PolarHBondContact O-N 3.45Å
1120	K	27.9	Very low	27.4	Very low	207 Å²	207	152.4 Å²	152.4	90%	0.9	78%	0.779	S	S	*	*			trans	-99.7	77.5	-165.4	-68.2	-178.9	177.4	177.6	0	113.2
1121	S	32.1	Very low	27.3	Very low	99 Å²	99	155.8 Å²	155.8	69%	0.692	79%	0.788	S	S	*	*			trans	-169.4	139.3	157.7	53.1	0	0	0	0	114.7	S1119	S1119-S1121 PolarHBondContact O-N 3.45Å
1122	S	34.2	Very low	27.2	Very low	112 Å²	112	152.6 Å²	152.6	78%	0.783	80%	0.798	S	S	*	*			trans	71.4	125.3	168.4	76.9	0	0	0	0	118	K1124	S1122-K1124 PolarHBondContact O-N 2.99Å
1123	N	27.8	Very low	27.3	Very low	165 Å²	165	154.1 Å²	154.1	88%	0.882	80%	0.8	S	S	*	*			trans	-86.4	83	-164.8	-61.9	-14.2	0	0	0	113.6
1124	K	30.3	Very low	27.3	Very low	205 Å²	205	153.5 Å²	153.5	89%	0.891	81%	0.805	S	S	*	*			trans	-140.7	105.2	159.1	-70.5	-167.7	178.9	-178.9	0	111.3	S1122	S1122-K1124 PolarHBondContact O-N 2.99Å
1125	H	27.1	Very low	27.4	Very low	201 Å²	201	151.9 Å²	151.9	93%	0.931	80%	0.802	S	S	*	*			trans	-77.9	135.7	169.1	-75.7	-85.6	0	0	0	110.5
1126	C	25.3	Very low	27.4	Very low	115 Å²	115	149.4 Å²	149.4	78%	0.777	80%	0.804	S	S	*	*			trans	-137.2	122.8	162.3	-172.7	0	0	0	0	107.6
1127	T	25.5	Very low	27.6	Very low	130 Å²	130	147.4 Å²	147.4	80%	0.798	81%	0.806	S	S	*	*			trans	-95.8	124	174.2	40.7	0	0	0	0	108.9
1128	V	26.6	Very low	27.6	Very low	117 Å²	117	147.9 Å²	147.9	71%	0.709	81%	0.81	S	S	*	*			trans	-112	117.7	170	-179.6	0	0	0	0	107.3	L1130	V1128-L1130 HydrophobicContact CG1-CG 4.48Å
1129	E	24.7	Very low	27.7	Very low	149 Å²	149	150.1 Å²	150.1	70%	0.696	82%	0.817	S	S	*	*			trans	-90.7	121.8	170	-66.7	-179.4	175.7	0	0	108.5	W1131	E1129-W1131 PolarHBondContact OE2-NE1 2.88Å
1130	L	26.3	Very low	27.5	Very low	150 Å²	150	152.6 Å²	152.6	79%	0.785	82%	0.816	S	S	*	*			trans	-100.9	113.4	169.7	-74.6	167.8	0	0	0	108	V1128	V1128-L1130 HydrophobicContact CG1-CG 4.48Å
1131	W	23.9	Very low	27.5	Very low	177 Å²	177	148.1 Å²	148.1	67%	0.67	81%	0.809	S	S	*	*			trans	-89.9	149.1	171.4	-67.4	62.1	0	0	0	108.7	E1110 E1129	E1110-W1131 VanDerWaalsContact OE1-CE3 3.28Å; E1129-W1131 PolarHBondContact OE2-NE1 2.88Å
1132	S	26	Very low	27.1	Very low	157 Å²	157	152.5 Å²	152.5	100%	1.098	82%	0.82	S	S	*	*			trans	-100	0	-170.2	63.2	0	0	0	0	114.2

Retrieved 1,132 of 1,132 residues in 1706.3 ms (Link to these results)

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