A0A087YES5_POEFO Loading...

Rho GTPase activating protein 27

AlphaFold DB , UniProt , Accession A0A087YES5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 810 aa.

						>A0A087YES5_POEFO|A0A087YES5
MAFVLVEFDFEYKAKDGRHICIKPNERYVLVSKTNDHWWRVSKDQDSKPFYIPAEYVKEVSAPPGTSSGPKKTESPKSLTKRKPADATANLIQCLNEASLVCTSKTSGYRTGRIRILMQNLNLNFNTKQCLNNGKYLPVPLCHNNKFCTSGYSPDLESKVRNHLFGTRPSCEFVILQMFKFPSRKTIYQCSFKLEENANVGDIELSASLEQRVHACNVQNENLRSAVYVNVAELRQSISESPPSDPSPCSPSYLKQEGWEVHVDQESGQEYYYHPDTGSTTWDNPFLDSPTDPEPLPPEVPFPPPSPQSDWASDWEQLVDETTGSTPPGWNLTVEPSGTWVFTSENSPDQWIKSVDDQGQTYYYLRDGTKSEWNLPEYKPREPRENQSLKIRKMCRRKFHPLKSTTHYKRSSCEVISKHVQNLEKAGILNKTKISENGKKVSRKNWVPTWTVLHGGVLTFHKDPKPSPGAVNKTNQIVPEFTVELKGATIGWATKDKSSKKNVLELKGKNGVEFLIQYDTESIIHDWHKILKDTIQQLVSPGSDQNHQQEVVKDYQEHHSEEEDGDLPRPSISQSPNNAGETDPKKVRTKLMKFLMKRPTLQSVKEKGYIRENVFGCHLHTLCAHERTTVPSFVDKCIKAVERRGLDIDGLYRVSGNLAVIQKLRFKADHAEELDLEDGQWEDVHVITGALKLFFRELPEPLFPFSHFNEFVTAIRNPDYNSKLSHIYELVKSLPPVNHDTMKLLFGHLQSDRVIEYGEDNRMTVQNVAIVFGPTLLRPETETANITMHMVFQNQIVEFILNEYSRLFYS
					

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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	63.3	Low	88.8	Confident	148 Å²	148	71.4 Å²	71.4	73%	0.729	35%	0.349	S	S	*	.				0	141.2	0	-71	164.4	177	0	0	107.3	F3	M1-F3 HydrophobicContact CB-CE2 4.33Å
2	A	84.3	Confident	89	Confident	30 Å²	30	70 Å²	70	25%	0.248	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	137.3	171.3	0	0	0	0	0	109.1	L30 E59	A2-L30 HydrophobicContact CB-CB 4.04Å; A2-L30 HydrophobicContact CB-CD2 4.08Å; A2-L30 PolarHBondContact O-N 2.64Å; A2-E59 HydrophobicContact CB-CG 4.43Å; A2-E59 VanDerWaalsContact CB-OE1 3.31Å; A2-E59 WeakPolarHBondContact CB-OE1 3.31Å
3	F	90.9	Very high	89.2	Confident	70 Å²	70	75.2 Å²	75.2	31%	0.307	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	158.3	171	-66	-88.6	0	0	0	108.8	M1 Y28 V29 E59 V60 A62	M1-F3 HydrophobicContact CB-CE2 4.33Å; F3-Y28 CarbonylContact C-O 3.52Å; F3-Y28 VanDerWaalsContact CA-O 3.31Å; F3-Y28 WeakPolarHBondContact CA-O 3.19Å; F3-V29 HydrophobicContact CD1-CG2 4.29Å; F3-V29 HydrophobicContact CE1-CG2 3.94Å; F3-E59 WeakPolarHBondContact O-CA 3.28Å; F3-V60 PolarHBondContact N-O 3.09Å; F3-V60 PolarHBondContact O-N 2.91Å; F3-A62 HydrophobicContact CD2-CB 4.31Å; F3-A62 HydrophobicContact CE2-CB 4.11Å
4	V	93.4	Very high	88.9	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	143.7	162.8	-62.6	0	0	0	0	109.9	R27 Y28 L30 W39 V41 V57 K58	V4-R27 VanDerWaalsContact O-CA 3.26Å; V4-R27 WeakPolarHBondContact O-CA 3.24Å; V4-Y28 PolarHBondContact N-O 3.35Å; V4-Y28 PolarHBondContact O-N 2.67Å; V4-L30 HydrophobicContact CG1-CB 4.27Å; V4-L30 HydrophobicContact CG1-CD1 4.25Å; V4-W39 HydrophobicContact CG1-CE3 3.85Å; V4-W39 HydrophobicContact CG1-CZ3 3.94Å; V4-V41 HydrophobicContact CG2-CG1 3.88Å; V4-V57 HydrophobicContact CB-CB 4.1Å; V4-V57 HydrophobicContact CB-CG1 4.48Å; V4-V57 HydrophobicContact CG2-CB 4.42Å; V4-V57 HydrophobicContact CG2-CG1 4.32Å; V4-K58 CarbonylContact C-O 3.53Å; V4-K58 VanDerWaalsContact CA-O 3.26Å; V4-K58 WeakPolarHBondContact CA-O 3.38Å
5	L	94	Very high	88.3	Confident	31 Å²	31	81.3 Å²	81.3	16%	0.162	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	133	168.2	-174.9	73.2	0	0	0	107.8	E26 R27 V57 K58 V60	L5-E26 WeakPolarHBondContact CA-O 3.49Å; L5-R27 HydrophobicContact CD1-CG 3.61Å; L5-V57 CarbonylContact O-C 3.56Å; L5-V57 VanDerWaalsContact O-CA 3.32Å; L5-V57 WeakPolarHBondContact O-CA 3.32Å; L5-K58 PolarHBondContact N-O 3.48Å; L5-K58 PolarHBondContact O-N 3.05Å; L5-V60 HydrophobicContact CB-CG2 3.77Å
6	V	94.4	Very high	87.9	Confident	1 Å²	1	80.6 Å²	80.6	1%	0.006	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	125.4	173	-178.6	0	0	0	0	109.1	F8 I22 K23 N25 E26 Y28 V57	V6-F8 WeakPolarHBondContact CG1-O 3.35Å; V6-I22 HydrophobicContact CG1-CB 4.44Å; V6-I22 HydrophobicContact CG1-CD1 3.83Å; V6-I22 HydrophobicContact CG1-CG1 3.97Å; V6-I22 HydrophobicContact CG2-CB 4.24Å; V6-I22 HydrophobicContact CG2-CD1 4.03Å; V6-I22 HydrophobicContact CG2-CG1 4.42Å; V6-K23 WeakPolarHBondContact CB-O 3.21Å; V6-K23 WeakPolarHBondContact CG1-O 3.4Å; V6-N25 PolarHBondContact O-N 2.82Å; V6-E26 HydrophobicContact CB-CB 4.48Å; V6-E26 HydrophobicContact CG2-CB 4.08Å; V6-E26 PolarHBondContact N-O 2.82Å; V6-Y28 HydrophobicContact CG2-CD2 3.91Å; V6-Y28 HydrophobicContact CG2-CE2 3.68Å; V6-V57 HydrophobicContact CG2-CG1 4.12Å
7	E	91.5	Very high	87.6	Confident	79 Å²	79	78.5 Å²	78.5	37%	0.369	39%	0.388	S	S	.	.			trans	-95.8	-31.8	174.9	-66.6	-166.4	128.8	0	0	111.7	Y56 K58	E7-Y56 PolarHBondContact N-O 3.03Å; E7-K58 HydrophobicContact CG-CB 4.15Å; E7-K58 HydrophobicContact CG-CD 4.38Å; E7-K58 WeakPolarHBondContact OE1-CD 2.99Å; E7-K58 WeakPolarHBondContact OE1-CE 3.39Å; E7-K58 IonicContact OE1-NZ 3.41Å; E7-K58 PolarHBondContact OE1-NZ 2.83Å; E7-K58 WeakPolarHBondContact OE2-CD 3.48Å; E7-K58 IonicContact OE2-NZ 3.87Å
8	F	90.1	Very high	87.6	Confident	120 Å²	120	78.4 Å²	78.4	53%	0.526	38%	0.383	S	S	.	.	S	Bend	trans	-130.1	146.5	179.8	-57.5	-79.4	0	0	0	111.8	V6 Y56	V6-F8 WeakPolarHBondContact CG1-O 3.35Å; F8-Y56 HydrophobicContact CB-CD1 3.66Å; F8-Y56 HydrophobicContact CB-CE1 4.13Å; F8-Y56 HydrophobicContact CB-CG 4.3Å
9	D	90.2	Very high	87.6	Confident	114 Å²	114	81.4 Å²	81.4	61%	0.61	40%	0.396	S	S	*	.			trans	-66.8	147.4	172.9	45.9	-41.8	0	0	0	112.2	I22 Y56	D9-I22 WeakPolarHBondContact CA-O 3.32Å; D9-I22 WeakPolarHBondContact CB-O 3.36Å; D9-Y56 WeakPolarHBondContact O-CE1 3.36Å
10	F	91.4	Very high	87.9	Confident	50 Å²	50	78.3 Å²	78.3	22%	0.219	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	139.2	177.1	-177.3	-106.9	0	0	0	109.8	Y12 C21 I22 W38 P53 Y56	F10-Y12 HydrophobicContact CD1-CD1 4.11Å; F10-Y12 AromaticContact CE1-CD1 3.53Å; F10-Y12 HydrophobicContact CE1-CD1 3.53Å; F10-Y12 HydrophobicContact CE1-CE1 4.28Å; F10-Y12 HydrophobicContact CE1-CG 4.04Å; F10-Y12 HydrophobicContact CZ-CD1 4.46Å; F10-C21 WeakPolarHBondContact O-CA 3.5Å; F10-I22 HydrophobicContact CB-CD1 3.97Å; F10-I22 HydrophobicContact CB-CG1 3.88Å; F10-I22 PolarHBondContact N-O 3.03Å; F10-I22 PolarHBondContact O-N 2.72Å; F10-W38 HydrophobicContact CE1-CH2 4.13Å; F10-W38 HydrophobicContact CE1-CZ3 4.21Å; F10-W38 AromaticContact CZ-CH2 3.97Å; F10-W38 HydrophobicContact CZ-CH2 3.97Å; F10-W38 HydrophobicContact CZ-CZ3 4.5Å; F10-P53 HydrophobicContact CD1-CG 3.99Å; F10-P53 HydrophobicContact CD2-CG 4.19Å; F10-P53 HydrophobicContact CE1-CG 3.76Å; F10-P53 HydrophobicContact CE2-CG 3.98Å; F10-P53 HydrophobicContact CG-CG 4.2Å; F10-P53 HydrophobicContact CZ-CG 3.76Å; F10-Y56 HydrophobicContact CB-CD1 3.86Å; F10-Y56 HydrophobicContact CB-CE1 4.19Å; F10-Y56 HydrophobicContact CD2-CD1 4.38Å; F10-Y56 HydrophobicContact CD2-CE1 4.06Å; F10-Y56 HydrophobicContact CG-CD1 4.43Å
11	E	93.3	Very high	88.1	Confident	142 Å²	142	77.5 Å²	77.5	66%	0.664	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.1	145.3	170.8	62.4	169.5	-149.3	0	0	113.2	I20 C21	E11-I20 CarbonylContact C-O 3.6Å; E11-I20 WeakPolarHBondContact CA-O 3.48Å; E11-I20 WeakPolarHBondContact CB-O 3.26Å; E11-C21 HydrophobicContact CB-CB 4.01Å
12	Y	91	Very high	89.5	Confident	55 Å²	55	70.5 Å²	70.5	22%	0.216	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	158.2	175.8	80.4	-73.9	0	0	0	111.7	F10 A14 I20 Y51	F10-Y12 HydrophobicContact CD1-CD1 4.11Å; F10-Y12 AromaticContact CE1-CD1 3.53Å; F10-Y12 HydrophobicContact CE1-CD1 3.53Å; F10-Y12 HydrophobicContact CE1-CE1 4.28Å; F10-Y12 HydrophobicContact CE1-CG 4.04Å; F10-Y12 HydrophobicContact CZ-CD1 4.46Å; Y12-A14 HydrophobicContact CE2-CB 3.96Å; Y12-I20 HydrophobicContact CD1-CB 3.83Å; Y12-I20 HydrophobicContact CD1-CG1 4.44Å; Y12-I20 HydrophobicContact CD1-CG2 4.21Å; Y12-I20 HydrophobicContact CE1-CB 3.57Å; Y12-I20 HydrophobicContact CE1-CG1 3.83Å; Y12-I20 HydrophobicContact CE1-CG2 3.75Å; Y12-I20 PolarHBondContact N-O 3.33Å; Y12-I20 PolarHBondContact O-N 3.02Å; Y12-Y51 VanDerWaalsContact CE1-O 3.31Å; Y12-Y51 WeakPolarHBondContact CE1-O 3.02Å; Y12-Y51 PolarHBondContact OH-N 2.91Å; Y12-Y51 PolarHBondContact OH-O 3.32Å
13	K	91.4	Very high	89.9	Confident	138 Å²	138	75.1 Å²	75.1	60%	0.6	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.3	115.4	171.4	-164.4	170.7	-169.5	153.3	0	109.8	H19	K13-H19 WeakPolarHBondContact CD-NE2 3.31Å; K13-H19 VanDerWaalsContact CE-NE2 3.34Å; K13-H19 WeakPolarHBondContact CE-NE2 3.46Å; K13-H19 PolarHBondContact NZ-NE2 3.36Å
14	A	85.8	Confident	90	Very high	12 Å²	12	74.5 Å²	74.5	10%	0.099	37%	0.365	C	S	.	.			trans	-72	155.9	177.8	0	0	0	0	0	111.7	Y12 D16 G17 R18 I20	Y12-A14 HydrophobicContact CE2-CB 3.96Å; A14-D16 WeakPolarHBondContact CB-OD1 3.49Å; A14-D16 PolarHBondContact O-N 2.86Å; A14-G17 PolarHBondContact O-N 3.18Å; A14-R18 PolarHBondContact N-O 3.26Å; A14-I20 HydrophobicContact CB-CG1 4.29Å
15	K	80.1	Confident	89.8	Confident	229 Å²	229	80.6 Å²	80.6	100%	0.996	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-10.7	178.8	-63.4	-167.2	177.4	-168.5	0	114.7
16	D	81.9	Confident	89.8	Confident	70 Å²	70	82 Å²	82	37%	0.374	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	19.4	172	66.2	4.8	0	0	0	113.4	A14 R18 K48	A14-D16 WeakPolarHBondContact CB-OD1 3.49Å; A14-D16 PolarHBondContact O-N 2.86Å; D16-R18 VanDerWaalsContact CG-NE 3.3Å; D16-R18 PolarHBondContact O-N 3.43Å; D16-R18 WeakPolarHBondContact OD1-CB 3.43Å; D16-R18 WeakPolarHBondContact OD1-CG 3.32Å; D16-R18 IonicContact OD1-CZ 2.7Å; D16-R18 IonicContact OD1-NE 2.75Å; D16-R18 PolarHBondContact OD1-NE 2.99Å; D16-R18 IonicContact OD1-NH2 2.79Å; D16-R18 IonicContact OD2-CZ 2.63Å; D16-R18 VanDerWaalsContact OD2-CZ 3.28Å; D16-R18 IonicContact OD2-NE 3.73Å; D16-R18 PolarHBondContact OD2-NE 3.39Å; D16-R18 IonicContact OD2-NH2 2.74Å; D16-R18 PolarHBondContact OD2-NH2 2.85Å; D16-K48 WeakPolarHBondContact OD2-CE 3.47Å; D16-K48 IonicContact OD2-NZ 2.72Å; D16-K48 PolarHBondContact OD2-NZ 3.3Å
17	G	82.8	Confident	89.7	Confident	46 Å²	46	90.2 Å²	90.2	47%	0.474	44%	0.435	S	S	.	.	S	Bend	trans	79.2	-13.2	176.1	0	0	0	0	0	115.1	A14 H19	A14-G17 PolarHBondContact O-N 3.18Å; G17-H19 PolarHBondContact O-N 2.72Å
18	R	87.7	Confident	89.9	Confident	76 Å²	76	87 Å²	87	29%	0.287	42%	0.419	S	S	.	.			trans	-67.5	129.7	179.1	-66.3	-175.7	-67.5	158.1	-4	111	A14 D16 I20 K48 P49	A14-R18 PolarHBondContact N-O 3.26Å; D16-R18 VanDerWaalsContact CG-NE 3.3Å; D16-R18 PolarHBondContact O-N 3.43Å; D16-R18 WeakPolarHBondContact OD1-CB 3.43Å; D16-R18 WeakPolarHBondContact OD1-CG 3.32Å; D16-R18 IonicContact OD1-CZ 2.7Å; D16-R18 IonicContact OD1-NE 2.75Å; D16-R18 PolarHBondContact OD1-NE 2.99Å; D16-R18 IonicContact OD1-NH2 2.79Å; D16-R18 IonicContact OD2-CZ 2.63Å; D16-R18 VanDerWaalsContact OD2-CZ 3.28Å; D16-R18 IonicContact OD2-NE 3.73Å; D16-R18 PolarHBondContact OD2-NE 3.39Å; D16-R18 IonicContact OD2-NH2 2.74Å; D16-R18 PolarHBondContact OD2-NH2 2.85Å; R18-I20 HydrophobicContact CB-CD1 4.32Å; R18-K48 PolarHBondContact NH1-O 3.04Å; R18-P49 PolarHBondContact NH2-O 3.43Å
19	H	87.6	Confident	90	Very high	136 Å²	136	82.5 Å²	82.5	63%	0.63	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.9	126.6	160.3	-73.5	-112.6	0	0	0	108.3	K13 G17	K13-H19 WeakPolarHBondContact CD-NE2 3.31Å; K13-H19 VanDerWaalsContact CE-NE2 3.34Å; K13-H19 WeakPolarHBondContact CE-NE2 3.46Å; K13-H19 PolarHBondContact NZ-NE2 3.36Å; G17-H19 PolarHBondContact O-N 2.72Å
20	I	93.1	Very high	90.1	Very high	18 Å²	18	78.4 Å²	78.4	9%	0.092	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	125.7	171.5	-56.2	-59.9	0	0	0	106.1	E11 Y12 A14 R18 I22 F50	E11-I20 CarbonylContact C-O 3.6Å; E11-I20 WeakPolarHBondContact CA-O 3.48Å; E11-I20 WeakPolarHBondContact CB-O 3.26Å; Y12-I20 HydrophobicContact CD1-CB 3.83Å; Y12-I20 HydrophobicContact CD1-CG1 4.44Å; Y12-I20 HydrophobicContact CD1-CG2 4.21Å; Y12-I20 HydrophobicContact CE1-CB 3.57Å; Y12-I20 HydrophobicContact CE1-CG1 3.83Å; Y12-I20 HydrophobicContact CE1-CG2 3.75Å; Y12-I20 PolarHBondContact N-O 3.33Å; Y12-I20 PolarHBondContact O-N 3.02Å; A14-I20 HydrophobicContact CB-CG1 4.29Å; R18-I20 HydrophobicContact CB-CD1 4.32Å; I20-I22 HydrophobicContact CG2-CG2 4.33Å; I20-F50 HydrophobicContact CD1-CB 3.98Å; I20-F50 HydrophobicContact CD1-CD2 4.38Å; I20-F50 HydrophobicContact CD1-CG 4.1Å; I20-F50 HydrophobicContact CG1-CB 4.31Å; I20-F50 HydrophobicContact CG1-CD2 4.45Å; I20-F50 HydrophobicContact CG2-CD2 3.51Å; I20-F50 HydrophobicContact CG2-CE2 3.66Å; I20-F50 HydrophobicContact CG2-CG 4.3Å
21	C	92.6	Very high	90.2	Very high	63 Å²	63	79.2 Å²	79.2	43%	0.426	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	132.6	171.6	175.9	0	0	0	0	106.4	F10 E11	F10-C21 WeakPolarHBondContact O-CA 3.5Å; E11-C21 HydrophobicContact CB-CB 4.01Å
22	I	92.6	Very high	90	Very high	1 Å²	1	74.5 Å²	74.5	1%	0.005	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	151.6	174.6	70.9	178.8	0	0	0	109.4	V6 D9 F10 I20 E26 Y28 F50 I52	V6-I22 HydrophobicContact CG1-CB 4.44Å; V6-I22 HydrophobicContact CG1-CD1 3.83Å; V6-I22 HydrophobicContact CG1-CG1 3.97Å; V6-I22 HydrophobicContact CG2-CB 4.24Å; V6-I22 HydrophobicContact CG2-CD1 4.03Å; V6-I22 HydrophobicContact CG2-CG1 4.42Å; D9-I22 WeakPolarHBondContact CA-O 3.32Å; D9-I22 WeakPolarHBondContact CB-O 3.36Å; F10-I22 HydrophobicContact CB-CD1 3.97Å; F10-I22 HydrophobicContact CB-CG1 3.88Å; F10-I22 PolarHBondContact N-O 3.03Å; F10-I22 PolarHBondContact O-N 2.72Å; I20-I22 HydrophobicContact CG2-CG2 4.33Å; I22-E26 WeakPolarHBondContact CA-OE2 3.29Å; I22-Y28 HydrophobicContact CB-CE2 4.24Å; I22-Y28 HydrophobicContact CG2-CE2 3.91Å; I22-F50 HydrophobicContact CG2-CE2 4.04Å; I22-F50 HydrophobicContact CG2-CZ 4.49Å; I22-I52 HydrophobicContact CD1-CB 4.33Å; I22-I52 HydrophobicContact CD1-CD1 3.8Å; I22-I52 HydrophobicContact CD1-CG1 4.02Å; I22-I52 HydrophobicContact CD1-CG2 3.36Å; I22-I52 HydrophobicContact CG2-CD1 3.96Å; I22-I52 HydrophobicContact CG2-CG1 4.34Å
23	K	91.8	Very high	90	Very high	126 Å²	126	76.9 Å²	76.9	55%	0.548	38%	0.383	S	S	.	.			trans	-128.5	148.9	-176.9	-58.8	-167.2	176.8	-164.3	0	112.2	V6 N25 E26	V6-K23 WeakPolarHBondContact CB-O 3.21Å; V6-K23 WeakPolarHBondContact CG1-O 3.4Å; K23-N25 PolarHBondContact O-N 2.88Å; K23-E26 HydrophobicContact CB-CG 4.24Å; K23-E26 PolarHBondContact N-OE2 2.84Å; K23-E26 VanDerWaalsContact O-CB 3.28Å; K23-E26 WeakPolarHBondContact O-CB 3.45Å; K23-E26 WeakPolarHBondContact O-CG 3.49Å; K23-E26 PolarHBondContact O-N 3.41Å
24	P	93.4	Very high	89.7	Confident	57 Å²	57	73.8 Å²	73.8	37%	0.37	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.5	139.7	176.1	-29.8	34.8	0	0	0	112.7	E26	P24-E26 VanDerWaalsContact C-N 3.25Å; P24-E26 PolarHBondContact O-N 3.42Å
25	N	90	Very high	89.8	Confident	128 Å²	128	77 Å²	77	68%	0.684	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.2	-1.2	-174	-52.8	-83.7	0	0	0	116.7	V6 K23	V6-N25 PolarHBondContact O-N 2.82Å; K23-N25 PolarHBondContact O-N 2.88Å
26	E	93.5	Very high	90.1	Very high	62 Å²	62	73 Å²	73	29%	0.29	38%	0.38	S	S	.	.			trans	-64.1	153.1	166.6	-71.1	-170.7	130.6	0	0	111.4	L5 V6 I22 K23 P24 Y28	L5-E26 WeakPolarHBondContact CA-O 3.49Å; V6-E26 HydrophobicContact CB-CB 4.48Å; V6-E26 HydrophobicContact CG2-CB 4.08Å; V6-E26 PolarHBondContact N-O 2.82Å; I22-E26 WeakPolarHBondContact CA-OE2 3.29Å; K23-E26 HydrophobicContact CB-CG 4.24Å; K23-E26 PolarHBondContact N-OE2 2.84Å; K23-E26 VanDerWaalsContact O-CB 3.28Å; K23-E26 WeakPolarHBondContact O-CB 3.45Å; K23-E26 WeakPolarHBondContact O-CG 3.49Å; K23-E26 PolarHBondContact O-N 3.41Å; P24-E26 VanDerWaalsContact C-N 3.25Å; P24-E26 PolarHBondContact O-N 3.42Å; E26-Y28 HydrophobicContact CB-CE2 3.97Å; E26-Y28 PolarHBondContact OE2-OH 2.73Å
27	R	92.6	Very high	90.4	Very high	173 Å²	173	74.9 Å²	74.9	65%	0.653	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.8	135.2	-178	-65.7	-178.4	-174.5	-174.7	-0.7	111.4	V4 L5	V4-R27 VanDerWaalsContact O-CA 3.26Å; V4-R27 WeakPolarHBondContact O-CA 3.24Å; L5-R27 HydrophobicContact CD1-CG 3.61Å
28	Y	94	Very high	90.9	Very high	12 Å²	12	77.3 Å²	77.3	5%	0.047	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	152.7	179	-61.1	-77.2	0	0	0	111.2	F3 V4 V6 I22 E26 V41 S42 K43 F50 I52	F3-Y28 CarbonylContact C-O 3.52Å; F3-Y28 VanDerWaalsContact CA-O 3.31Å; F3-Y28 WeakPolarHBondContact CA-O 3.19Å; V4-Y28 PolarHBondContact N-O 3.35Å; V4-Y28 PolarHBondContact O-N 2.67Å; V6-Y28 HydrophobicContact CG2-CD2 3.91Å; V6-Y28 HydrophobicContact CG2-CE2 3.68Å; I22-Y28 HydrophobicContact CB-CE2 4.24Å; I22-Y28 HydrophobicContact CG2-CE2 3.91Å; E26-Y28 HydrophobicContact CB-CE2 3.97Å; E26-Y28 PolarHBondContact OE2-OH 2.73Å; Y28-V41 HydrophobicContact CG-CG2 4.16Å; Y28-S42 CarbonylContact C-O 3.56Å; Y28-S42 WeakPolarHBondContact CA-O 3.18Å; Y28-S42 WeakPolarHBondContact CB-O 3.45Å; Y28-K43 HydrophobicContact CD1-CB 4.21Å; Y28-K43 HydrophobicContact CE1-CB 4.22Å; Y28-K43 HydrophobicContact CE1-CG 4.29Å; Y28-F50 HydrophobicContact CD1-CE1 4.19Å; Y28-F50 AromaticContact CD1-CZ 3.78Å; Y28-F50 HydrophobicContact CD1-CZ 3.78Å; Y28-F50 HydrophobicContact CE1-CE1 4.13Å; Y28-F50 AromaticContact CE1-CZ 3.58Å; Y28-F50 HydrophobicContact CE1-CZ 3.58Å; Y28-F50 HydrophobicContact CE2-CZ 4.44Å; Y28-F50 HydrophobicContact CG-CZ 4.34Å; Y28-F50 AromaticContact CZ-CZ 3.93Å; Y28-I52 HydrophobicContact CD2-CD1 3.83Å; Y28-I52 HydrophobicContact CE2-CD1 4.08Å; Y28-I52 HydrophobicContact CG-CD1 4.49Å
29	V	93.5	Very high	91.2	Very high	25 Å²	25	75.1 Å²	75.1	15%	0.152	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	126.3	170.6	-176.2	0	0	0	0	108.7	F3 V31 V41 S42	F3-V29 HydrophobicContact CD1-CG2 4.29Å; F3-V29 HydrophobicContact CE1-CG2 3.94Å; V29-V31 PolarHBondContact O-N 2.93Å; V29-V41 CarbonylContact O-C 3.52Å; V29-V41 VanDerWaalsContact O-CA 3.28Å; V29-V41 WeakPolarHBondContact O-CA 3.32Å; V29-S42 PolarHBondContact N-O 2.96Å; V29-S42 PolarHBondContact O-N 3.01Å
30	L	93.1	Very high	91.4	Very high	27 Å²	27	73 Å²	73	14%	0.141	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	120.1	175.1	-176.8	59.6	0	0	0	109.8	A2 V4 K33 W39 V41	A2-L30 HydrophobicContact CB-CB 4.04Å; A2-L30 HydrophobicContact CB-CD2 4.08Å; A2-L30 PolarHBondContact O-N 2.64Å; V4-L30 HydrophobicContact CG1-CB 4.27Å; V4-L30 HydrophobicContact CG1-CD1 4.25Å; L30-K33 HydrophobicContact CD1-CG 4.32Å; L30-K33 HydrophobicContact CD2-CG 4.13Å; L30-W39 HydrophobicContact CD1-CB 4.1Å; L30-W39 HydrophobicContact CD1-CD2 4.48Å; L30-W39 HydrophobicContact CD1-CE3 4.15Å; L30-W39 HydrophobicContact CD1-CG 4.49Å; L30-V41 HydrophobicContact CD1-CG1 4.3Å
31	V	91.6	Very high	91.5	Very high	68 Å²	68	72.1 Å²	72.1	41%	0.412	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	-44	-179.4	179.9	0	0	0	0	110.8	V29 R40 P49	V29-V31 PolarHBondContact O-N 2.93Å; V31-R40 WeakPolarHBondContact CA-O 3.45Å; V31-R40 HydrophobicContact CB-CG 4.46Å; V31-R40 WeakPolarHBondContact CB-O 3.5Å; V31-R40 PolarHBondContact N-O 3.18Å; V31-P49 HydrophobicContact CG2-CB 4.42Å
32	S	89.9	Confident	91.5	Very high	43 Å²	43	69.3 Å²	69.3	30%	0.301	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.3	135.3	172.5	58.3	0	0	0	0	111.5	T34 R40	S32-T34 PolarHBondContact O-N 3.09Å; S32-T34 PolarHBondContact OG-OG1 3.17Å; S32-R40 PolarHBondContact N-O 2.93Å; S32-R40 VanDerWaalsContact N-O 3.09Å; S32-R40 WeakPolarHBondContact O-CB 3.2Å; S32-R40 PolarHBondContact O-N 3.41Å; S32-R40 WeakPolarHBondContact OG-CB 3.27Å
33	K	91.1	Very high	91.3	Very high	104 Å²	104	75.3 Å²	75.3	45%	0.452	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	115.7	161.2	-56.7	-169.9	-179.7	-171.6	0	107.3	L30 W39 E59	L30-K33 HydrophobicContact CD1-CG 4.32Å; L30-K33 HydrophobicContact CD2-CG 4.13Å; K33-W39 HydrophobicContact CB-CG 4.28Å; K33-W39 HydrophobicContact CD-CD2 4.11Å; K33-W39 HydrophobicContact CD-CH2 4.39Å; K33-W39 HydrophobicContact CD-CZ2 3.78Å; K33-W39 HydrophobicContact CG-CD2 3.88Å; K33-W39 HydrophobicContact CG-CG 3.97Å; K33-W39 HydrophobicContact CG-CZ2 4.47Å; K33-E59 WeakPolarHBondContact CE-OE2 3.42Å; K33-E59 IonicContact NZ-OE2 3.27Å; K33-E59 PolarHBondContact NZ-OE2 3Å
34	T	84.1	Confident	90.9	Very high	74 Å²	74	73.3 Å²	73.3	45%	0.454	36%	0.358	S	S	.	.			trans	-94.6	-33.9	-171.1	-65.4	0	0	0	0	111.9	S32 W38 Y51	S32-T34 PolarHBondContact O-N 3.09Å; S32-T34 PolarHBondContact OG-OG1 3.17Å; T34-W38 WeakPolarHBondContact CB-O 3.5Å; T34-W38 PolarHBondContact N-O 2.82Å; T34-W38 VanDerWaalsContact N-O 3.16Å; T34-Y51 HydrophobicContact CG2-CE1 4.28Å
35	N	88.4	Confident	90.1	Very high	78 Å²	78	77.7 Å²	77.7	42%	0.417	37%	0.373	S	S	.	.	S	Bend	trans	-155.6	-175	160.9	56.3	46.4	0	0	0	108	H37 W38	N35-H37 PolarHBondContact O-N 3.06Å; N35-H37 PolarHBondContact OD1-N 2.87Å; N35-W38 PolarHBondContact N-O 2.87Å; N35-W38 PolarHBondContact OD1-N 3.45Å
36	D	86.8	Confident	89.3	Confident	145 Å²	145	79.3 Å²	79.3	78%	0.775	38%	0.382	S	S	*	.	S	Bend	trans	-68.7	-17.7	-176.5	-56.7	-47.9	0	0	0	113.7	A54	D36-A54 WeakPolarHBondContact O-CB 3.39Å
37	H	89.1	Confident	89	Confident	111 Å²	111	78.5 Å²	78.5	51%	0.514	38%	0.383	S	S	.	.	S	Bend	trans	-103.8	-20.8	-179.9	-55.3	-70.3	0	0	0	114.3	N35 P53 A54 E55	N35-H37 PolarHBondContact O-N 3.06Å; N35-H37 PolarHBondContact OD1-N 2.87Å; H37-P53 CarbonylContact O-C 3.58Å; H37-P53 VanDerWaalsContact O-CA 3.24Å; H37-P53 WeakPolarHBondContact O-CA 3.35Å; H37-A54 PolarHBondContact O-N 2.78Å; H37-E55 IonicContact ND1-OE1 3.82Å
38	W	91.6	Very high	88.7	Confident	96 Å²	96	76.5 Å²	76.5	36%	0.364	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	119.7	-173.4	-69.6	91.8	0	0	0	112.6	F10 T34 N35 P53	F10-W38 HydrophobicContact CE1-CH2 4.13Å; F10-W38 HydrophobicContact CE1-CZ3 4.21Å; F10-W38 AromaticContact CZ-CH2 3.97Å; F10-W38 HydrophobicContact CZ-CH2 3.97Å; F10-W38 HydrophobicContact CZ-CZ3 4.5Å; T34-W38 WeakPolarHBondContact CB-O 3.5Å; T34-W38 PolarHBondContact N-O 2.82Å; T34-W38 VanDerWaalsContact N-O 3.16Å; N35-W38 PolarHBondContact N-O 2.87Å; N35-W38 PolarHBondContact OD1-N 3.45Å; W38-P53 HydrophobicContact CE3-CG 4.29Å; W38-P53 HydrophobicContact CH2-CG 3.84Å; W38-P53 HydrophobicContact CZ2-CG 4.39Å; W38-P53 HydrophobicContact CZ3-CG 3.78Å
39	W	94.3	Very high	88.6	Confident	31 Å²	31	77.7 Å²	77.7	12%	0.117	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	139.7	176.7	-64.5	1.8	0	0	0	110.7	V4 L30 K33 Y51 I52 A54 V57 E59	V4-W39 HydrophobicContact CG1-CE3 3.85Å; V4-W39 HydrophobicContact CG1-CZ3 3.94Å; L30-W39 HydrophobicContact CD1-CB 4.1Å; L30-W39 HydrophobicContact CD1-CD2 4.48Å; L30-W39 HydrophobicContact CD1-CE3 4.15Å; L30-W39 HydrophobicContact CD1-CG 4.49Å; K33-W39 HydrophobicContact CB-CG 4.28Å; K33-W39 HydrophobicContact CD-CD2 4.11Å; K33-W39 HydrophobicContact CD-CH2 4.39Å; K33-W39 HydrophobicContact CD-CZ2 3.78Å; K33-W39 HydrophobicContact CG-CD2 3.88Å; K33-W39 HydrophobicContact CG-CG 3.97Å; K33-W39 HydrophobicContact CG-CZ2 4.47Å; W39-Y51 WeakPolarHBondContact O-CA 3.4Å; W39-I52 PolarHBondContact N-O 2.8Å; W39-I52 PolarHBondContact O-N 2.81Å; W39-A54 HydrophobicContact CD2-CB 4.16Å; W39-A54 HydrophobicContact CG-CB 4.19Å; W39-A54 HydrophobicContact CZ2-CB 4.17Å; W39-V57 HydrophobicContact CD2-CG2 4.45Å; W39-V57 HydrophobicContact CE3-CG2 3.78Å; W39-V57 HydrophobicContact CZ3-CG2 4.09Å; W39-E59 HydrophobicContact CZ3-CB 4.3Å
40	R	93.6	Very high	88.6	Confident	90 Å²	90	77.4 Å²	77.4	34%	0.34	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	125.8	178.3	-166.5	-177.1	-179.8	-140.2	3.8	109.4	V31 S32 P49 F50 Y51	V31-R40 WeakPolarHBondContact CA-O 3.45Å; V31-R40 HydrophobicContact CB-CG 4.46Å; V31-R40 WeakPolarHBondContact CB-O 3.5Å; V31-R40 PolarHBondContact N-O 3.18Å; S32-R40 PolarHBondContact N-O 2.93Å; S32-R40 VanDerWaalsContact N-O 3.09Å; S32-R40 WeakPolarHBondContact O-CB 3.2Å; S32-R40 PolarHBondContact O-N 3.41Å; S32-R40 WeakPolarHBondContact OG-CB 3.27Å; R40-P49 HydrophobicContact CG-CB 4.29Å; R40-F50 CarbonylContact C-O 3.53Å; R40-F50 WeakPolarHBondContact CA-O 3.24Å; R40-Y51 HydrophobicContact CB-CD1 3.91Å; R40-Y51 HydrophobicContact CB-CE1 3.66Å; R40-Y51 HydrophobicContact CG-CD1 4.25Å; R40-Y51 HydrophobicContact CG-CE1 3.86Å; R40-Y51 HydrophobicContact CG-CE2 4.46Å
41	V	93.8	Very high	88.6	Confident	0 Å²	0	80.5 Å²	80.5	0%	0	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	169.7	-173.5	-52.7	0	0	0	0	111.6	V4 Y28 V29 L30 P49 F50 I52	V4-V41 HydrophobicContact CG2-CG1 3.88Å; Y28-V41 HydrophobicContact CG-CG2 4.16Å; V29-V41 CarbonylContact O-C 3.52Å; V29-V41 VanDerWaalsContact O-CA 3.28Å; V29-V41 WeakPolarHBondContact O-CA 3.32Å; L30-V41 HydrophobicContact CD1-CG1 4.3Å; V41-P49 CarbonylContact O-C 3.57Å; V41-P49 WeakPolarHBondContact O-CA 3.28Å; V41-P49 WeakPolarHBondContact O-CB 3.28Å; V41-F50 HydrophobicContact CG2-CD1 4.45Å; V41-F50 HydrophobicContact CG2-CD2 4.08Å; V41-F50 HydrophobicContact CG2-CE1 4.08Å; V41-F50 HydrophobicContact CG2-CE2 3.7Å; V41-F50 HydrophobicContact CG2-CG 4.46Å; V41-F50 HydrophobicContact CG2-CZ 3.69Å; V41-F50 PolarHBondContact N-O 3.13Å; V41-F50 PolarHBondContact O-N 2.93Å; V41-I52 HydrophobicContact CG1-CD1 4.44Å; V41-I52 HydrophobicContact CG2-CD1 3.52Å; V41-I52 HydrophobicContact CG2-CG1 3.85Å
42	S	92.8	Very high	88.7	Confident	5 Å²	5	77.3 Å²	77.3	4%	0.035	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	154.8	169.1	-171.7	0	0	0	0	111.1	Y28 V29 D44 S47	Y28-S42 CarbonylContact C-O 3.56Å; Y28-S42 WeakPolarHBondContact CA-O 3.18Å; Y28-S42 WeakPolarHBondContact CB-O 3.45Å; V29-S42 PolarHBondContact N-O 2.96Å; V29-S42 PolarHBondContact O-N 3.01Å; S42-D44 WeakPolarHBondContact CB-O 3.47Å; S42-D44 PolarHBondContact OG-O 2.94Å; S42-S47 WeakPolarHBondContact OG-CB 3.18Å; S42-S47 PolarHBondContact OG-O 3.41Å
43	K	88.5	Confident	88.9	Confident	127 Å²	127	75.9 Å²	75.9	55%	0.552	37%	0.366	S	S	*	.	S	Bend	trans	-67.8	-38.9	174.2	-165.1	166.8	-175.5	161.3	0	112.1	Y28	Y28-K43 HydrophobicContact CD1-CB 4.21Å; Y28-K43 HydrophobicContact CE1-CB 4.22Å; Y28-K43 HydrophobicContact CE1-CG 4.29Å
44	D	84.4	Confident	89	Confident	84 Å²	84	71.5 Å²	71.5	45%	0.449	35%	0.349	S	S	.	.	S	Bend	trans	-144.1	170.1	-176.7	-47	-87	0	0	0	109.5	S42 D46 S47	S42-D44 WeakPolarHBondContact CB-O 3.47Å; S42-D44 PolarHBondContact OG-O 2.94Å; D44-D46 VanDerWaalsContact C-N 3.26Å; D44-D46 PolarHBondContact O-N 3.1Å; D44-S47 PolarHBondContact O-N 3.38Å; D44-S47 PolarHBondContact OD2-OG 2.93Å
45	Q	74.9	Confident	89.4	Confident	148 Å²	148	74.4 Å²	74.4	69%	0.692	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-32.9	178	-68.3	177	67.4	0	0	112.7
46	D	74.5	Confident	89.6	Confident	163 Å²	163	74.6 Å²	74.6	87%	0.872	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-7.8	-179.8	-53	-75.5	0	0	0	113.9	D44	D44-D46 VanDerWaalsContact C-N 3.26Å; D44-D46 PolarHBondContact O-N 3.1Å
47	S	86.2	Confident	89.9	Confident	45 Å²	45	68 Å²	68	32%	0.315	32%	0.318	S	S	.	.	S	Bend	trans	-73.9	147	-179	-88.8	0	0	0	0	111.8	S42 D44 P49	S42-S47 WeakPolarHBondContact OG-CB 3.18Å; S42-S47 PolarHBondContact OG-O 3.41Å; D44-S47 PolarHBondContact O-N 3.38Å; D44-S47 PolarHBondContact OD2-OG 2.93Å; S47-P49 WeakPolarHBondContact O-CD 3.26Å
48	K	86.2	Confident	90.1	Very high	131 Å²	131	68 Å²	68	57%	0.57	32%	0.317	S	S	*	.			trans	-71.6	115.6	179.9	-174.7	-176.2	-176.9	-170.3	0	110.5	D16 R18	D16-K48 WeakPolarHBondContact OD2-CE 3.47Å; D16-K48 IonicContact OD2-NZ 2.72Å; D16-K48 PolarHBondContact OD2-NZ 3.3Å; R18-K48 PolarHBondContact NH1-O 3.04Å
49	P	92.6	Very high	90	Very high	37 Å²	37	67.7 Å²	67.7	24%	0.24	32%	0.319	C	S	.	.			trans	-65.3	158.6	-173.8	26	-35.1	0	0	0	113.4	R18 V31 R40 V41 S47	R18-P49 PolarHBondContact NH2-O 3.43Å; V31-P49 HydrophobicContact CG2-CB 4.42Å; R40-P49 HydrophobicContact CG-CB 4.29Å; V41-P49 CarbonylContact O-C 3.57Å; V41-P49 WeakPolarHBondContact O-CA 3.28Å; V41-P49 WeakPolarHBondContact O-CB 3.28Å; S47-P49 WeakPolarHBondContact O-CD 3.26Å
50	F	93.1	Very high	89.8	Confident	19 Å²	19	68.7 Å²	68.7	8%	0.083	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	-174.8	179.2	61.8	-84.8	0	0	0	109.6	I20 I22 Y28 R40 V41 I52	I20-F50 HydrophobicContact CD1-CB 3.98Å; I20-F50 HydrophobicContact CD1-CD2 4.38Å; I20-F50 HydrophobicContact CD1-CG 4.1Å; I20-F50 HydrophobicContact CG1-CB 4.31Å; I20-F50 HydrophobicContact CG1-CD2 4.45Å; I20-F50 HydrophobicContact CG2-CD2 3.51Å; I20-F50 HydrophobicContact CG2-CE2 3.66Å; I20-F50 HydrophobicContact CG2-CG 4.3Å; I22-F50 HydrophobicContact CG2-CE2 4.04Å; I22-F50 HydrophobicContact CG2-CZ 4.49Å; Y28-F50 HydrophobicContact CD1-CE1 4.19Å; Y28-F50 AromaticContact CD1-CZ 3.78Å; Y28-F50 HydrophobicContact CD1-CZ 3.78Å; Y28-F50 HydrophobicContact CE1-CE1 4.13Å; Y28-F50 AromaticContact CE1-CZ 3.58Å; Y28-F50 HydrophobicContact CE1-CZ 3.58Å; Y28-F50 HydrophobicContact CE2-CZ 4.44Å; Y28-F50 HydrophobicContact CG-CZ 4.34Å; Y28-F50 AromaticContact CZ-CZ 3.93Å; R40-F50 CarbonylContact C-O 3.53Å; R40-F50 WeakPolarHBondContact CA-O 3.24Å; V41-F50 HydrophobicContact CG2-CD1 4.45Å; V41-F50 HydrophobicContact CG2-CD2 4.08Å; V41-F50 HydrophobicContact CG2-CE1 4.08Å; V41-F50 HydrophobicContact CG2-CE2 3.7Å; V41-F50 HydrophobicContact CG2-CG 4.46Å; V41-F50 HydrophobicContact CG2-CZ 3.69Å; V41-F50 PolarHBondContact N-O 3.13Å; V41-F50 PolarHBondContact O-N 2.93Å; F50-I52 HydrophobicContact CD2-CG1 4.12Å; F50-I52 HydrophobicContact CE2-CD1 3.79Å; F50-I52 HydrophobicContact CE2-CG1 3.67Å; F50-I52 HydrophobicContact CZ-CD1 4.37Å
51	Y	94	Very high	88.7	Confident	91 Å²	91	69.4 Å²	69.4	36%	0.357	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	147.8	-177	-66.8	-90.4	0	0	0	111.1	Y12 T34 W39 R40	Y12-Y51 VanDerWaalsContact CE1-O 3.31Å; Y12-Y51 WeakPolarHBondContact CE1-O 3.02Å; Y12-Y51 PolarHBondContact OH-N 2.91Å; Y12-Y51 PolarHBondContact OH-O 3.32Å; T34-Y51 HydrophobicContact CG2-CE1 4.28Å; W39-Y51 WeakPolarHBondContact O-CA 3.4Å; R40-Y51 HydrophobicContact CB-CD1 3.91Å; R40-Y51 HydrophobicContact CB-CE1 3.66Å; R40-Y51 HydrophobicContact CG-CD1 4.25Å; R40-Y51 HydrophobicContact CG-CE1 3.86Å; R40-Y51 HydrophobicContact CG-CE2 4.46Å
52	I	93.9	Very high	87.2	Confident	1 Å²	1	72 Å²	72	1%	0.005	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	143.9	173.7	-58.8	176.8	0	0	0	108.1	I22 Y28 W39 V41 F50 A54 V57	I22-I52 HydrophobicContact CD1-CB 4.33Å; I22-I52 HydrophobicContact CD1-CD1 3.8Å; I22-I52 HydrophobicContact CD1-CG1 4.02Å; I22-I52 HydrophobicContact CD1-CG2 3.36Å; I22-I52 HydrophobicContact CG2-CD1 3.96Å; I22-I52 HydrophobicContact CG2-CG1 4.34Å; Y28-I52 HydrophobicContact CD2-CD1 3.83Å; Y28-I52 HydrophobicContact CE2-CD1 4.08Å; Y28-I52 HydrophobicContact CG-CD1 4.49Å; W39-I52 PolarHBondContact N-O 2.8Å; W39-I52 PolarHBondContact O-N 2.81Å; V41-I52 HydrophobicContact CG1-CD1 4.44Å; V41-I52 HydrophobicContact CG2-CD1 3.52Å; V41-I52 HydrophobicContact CG2-CG1 3.85Å; F50-I52 HydrophobicContact CD2-CG1 4.12Å; F50-I52 HydrophobicContact CE2-CD1 3.79Å; F50-I52 HydrophobicContact CE2-CG1 3.67Å; F50-I52 HydrophobicContact CZ-CD1 4.37Å; I52-A54 PolarHBondContact O-N 2.92Å; I52-V57 HydrophobicContact CB-CG1 4.4Å; I52-V57 HydrophobicContact CD1-CG1 4.21Å; I52-V57 HydrophobicContact CG2-CG1 3.59Å; I52-V57 HydrophobicContact CG2-CG2 4.31Å
53	P	93.9	Very high	85	Confident	13 Å²	13	77.2 Å²	77.2	8%	0.084	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	132.8	170.4	-23.5	34.6	0	0	0	111.8	F10 H37 W38 E55 Y56	F10-P53 HydrophobicContact CD1-CG 3.99Å; F10-P53 HydrophobicContact CD2-CG 4.19Å; F10-P53 HydrophobicContact CE1-CG 3.76Å; F10-P53 HydrophobicContact CE2-CG 3.98Å; F10-P53 HydrophobicContact CG-CG 4.2Å; F10-P53 HydrophobicContact CZ-CG 3.76Å; H37-P53 CarbonylContact O-C 3.58Å; H37-P53 VanDerWaalsContact O-CA 3.24Å; H37-P53 WeakPolarHBondContact O-CA 3.35Å; W38-P53 HydrophobicContact CE3-CG 4.29Å; W38-P53 HydrophobicContact CH2-CG 3.84Å; W38-P53 HydrophobicContact CZ2-CG 4.39Å; W38-P53 HydrophobicContact CZ3-CG 3.78Å; P53-E55 VanDerWaalsContact C-N 3.27Å; P53-E55 PolarHBondContact O-N 2.93Å; P53-Y56 HydrophobicContact CB-CD2 3.7Å; P53-Y56 HydrophobicContact CB-CE2 4.31Å; P53-Y56 HydrophobicContact CB-CG 4.23Å; P53-Y56 HydrophobicContact CG-CD2 4.3Å; P53-Y56 PolarHBondContact O-N 3.29Å; P53-Y56 VanDerWaalsContact O-N 3.1Å
54	A	91.9	Very high	82.7	Confident	12 Å²	12	77.7 Å²	77.7	10%	0.099	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-61.9	-33.7	-175.9	0	0	0	0	0	113	D36 H37 W39 I52 Y56 V57	D36-A54 WeakPolarHBondContact O-CB 3.39Å; H37-A54 PolarHBondContact O-N 2.78Å; W39-A54 HydrophobicContact CD2-CB 4.16Å; W39-A54 HydrophobicContact CG-CB 4.19Å; W39-A54 HydrophobicContact CZ2-CB 4.17Å; I52-A54 PolarHBondContact O-N 2.92Å; A54-Y56 PolarHBondContact O-N 2.95Å; A54-V57 PolarHBondContact O-N 3.37Å; A54-V57 VanDerWaalsContact O-O 3.04Å
55	E	93	Very high	80.6	Confident	136 Å²	136	77 Å²	77	64%	0.636	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-67	-17.8	177.9	-68.3	155.6	-154.5	0	0	113.2	H37 P53	H37-E55 IonicContact ND1-OE1 3.82Å; P53-E55 VanDerWaalsContact C-N 3.27Å; P53-E55 PolarHBondContact O-N 2.93Å
56	Y	92	Very high	78.4	Confident	82 Å²	82	77 Å²	77	32%	0.322	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-96.8	-3.1	-176.8	-72.8	-123	0	0	0	112.3	E7 F8 D9 F10 P53 A54	E7-Y56 PolarHBondContact N-O 3.03Å; F8-Y56 HydrophobicContact CB-CD1 3.66Å; F8-Y56 HydrophobicContact CB-CE1 4.13Å; F8-Y56 HydrophobicContact CB-CG 4.3Å; D9-Y56 WeakPolarHBondContact O-CE1 3.36Å; F10-Y56 HydrophobicContact CB-CD1 3.86Å; F10-Y56 HydrophobicContact CB-CE1 4.19Å; F10-Y56 HydrophobicContact CD2-CD1 4.38Å; F10-Y56 HydrophobicContact CD2-CE1 4.06Å; F10-Y56 HydrophobicContact CG-CD1 4.43Å; P53-Y56 HydrophobicContact CB-CD2 3.7Å; P53-Y56 HydrophobicContact CB-CE2 4.31Å; P53-Y56 HydrophobicContact CB-CG 4.23Å; P53-Y56 HydrophobicContact CG-CD2 4.3Å; P53-Y56 PolarHBondContact O-N 3.29Å; P53-Y56 VanDerWaalsContact O-N 3.1Å; A54-Y56 PolarHBondContact O-N 2.95Å
57	V	93.2	Very high	76.3	Confident	7 Å²	7	75.2 Å²	75.2	4%	0.042	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	140.2	-174.2	-73.1	0	0	0	0	114.2	V4 L5 V6 W39 I52 A54	V4-V57 HydrophobicContact CB-CB 4.1Å; V4-V57 HydrophobicContact CB-CG1 4.48Å; V4-V57 HydrophobicContact CG2-CB 4.42Å; V4-V57 HydrophobicContact CG2-CG1 4.32Å; L5-V57 CarbonylContact O-C 3.56Å; L5-V57 VanDerWaalsContact O-CA 3.32Å; L5-V57 WeakPolarHBondContact O-CA 3.32Å; V6-V57 HydrophobicContact CG2-CG1 4.12Å; W39-V57 HydrophobicContact CD2-CG2 4.45Å; W39-V57 HydrophobicContact CE3-CG2 3.78Å; W39-V57 HydrophobicContact CZ3-CG2 4.09Å; I52-V57 HydrophobicContact CB-CG1 4.4Å; I52-V57 HydrophobicContact CD1-CG1 4.21Å; I52-V57 HydrophobicContact CG2-CG1 3.59Å; I52-V57 HydrophobicContact CG2-CG2 4.31Å; A54-V57 PolarHBondContact O-N 3.37Å; A54-V57 VanDerWaalsContact O-O 3.04Å
58	K	92.8	Very high	73.7	Confident	109 Å²	109	78.9 Å²	78.9	47%	0.474	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	130.3	179.8	-165.7	154.3	178.3	167.5	0	111.2	V4 L5 E7 V60	V4-K58 CarbonylContact C-O 3.53Å; V4-K58 VanDerWaalsContact CA-O 3.26Å; V4-K58 WeakPolarHBondContact CA-O 3.38Å; L5-K58 PolarHBondContact N-O 3.48Å; L5-K58 PolarHBondContact O-N 3.05Å; E7-K58 HydrophobicContact CG-CB 4.15Å; E7-K58 HydrophobicContact CG-CD 4.38Å; E7-K58 WeakPolarHBondContact OE1-CD 2.99Å; E7-K58 WeakPolarHBondContact OE1-CE 3.39Å; E7-K58 IonicContact OE1-NZ 3.41Å; E7-K58 PolarHBondContact OE1-NZ 2.83Å; E7-K58 WeakPolarHBondContact OE2-CD 3.48Å; E7-K58 IonicContact OE2-NZ 3.87Å; K58-V60 PolarHBondContact O-N 2.91Å
59	E	91.1	Very high	70.8	Confident	91 Å²	91	76.1 Å²	76.1	43%	0.425	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	126.5	175.8	-171.6	170.2	-173.8	0	0	110.7	A2 F3 K33 W39	A2-E59 HydrophobicContact CB-CG 4.43Å; A2-E59 VanDerWaalsContact CB-OE1 3.31Å; A2-E59 WeakPolarHBondContact CB-OE1 3.31Å; F3-E59 WeakPolarHBondContact O-CA 3.28Å; K33-E59 WeakPolarHBondContact CE-OE2 3.42Å; K33-E59 IonicContact NZ-OE2 3.27Å; K33-E59 PolarHBondContact NZ-OE2 3Å; W39-E59 HydrophobicContact CZ3-CB 4.3Å
60	V	89.3	Confident	68.2	Low	52 Å²	52	80.8 Å²	80.8	32%	0.315	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	116.4	178.2	-178.5	0	0	0	0	108.8	F3 L5 K58	F3-V60 PolarHBondContact N-O 3.09Å; F3-V60 PolarHBondContact O-N 2.91Å; L5-V60 HydrophobicContact CB-CG2 3.77Å; K58-V60 PolarHBondContact O-N 2.91Å
61	S	70.6	Confident	65.3	Low	105 Å²	105	89.3 Å²	89.3	73%	0.734	54%	0.544	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.5	134.1	169.9	48.6	0	0	0	0	110.2
62	A	61.3	Low	61.9	Low	53 Å²	53	94.4 Å²	94.4	44%	0.438	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-69.7	138	174	0	0	0	0	0	110.4	F3	F3-A62 HydrophobicContact CD2-CB 4.31Å; F3-A62 HydrophobicContact CE2-CB 4.11Å
63	P	47.8	Very low	58.7	Low	115 Å²	115	100.5 Å²	100.5	75%	0.747	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-64.2	149.3	176.8	27.1	-34.5	0	0	0	111.3	G65	P63-G65 PolarHBondContact O-N 2.84Å
64	P	40.3	Very low	55.4	Low	137 Å²	137	108 Å²	108	89%	0.89	64%	0.639	S	S	*	*			trans	-77.3	79.1	-170.6	31.6	-36.7	0	0	0	113.5
65	G	39.5	Very low	52.2	Low	70 Å²	70	112.9 Å²	112.9	72%	0.722	67%	0.673	S	S	*	*			trans	62.8	125.3	142.4	0	0	0	0	0	120.3	P63	P63-G65 PolarHBondContact O-N 2.84Å
66	T	29	Very low	50.6	Low	149 Å²	149	111.5 Å²	111.5	91%	0.914	68%	0.675	S	S	*	*			trans	-108.1	127	147.3	46.2	0	0	0	0	109.4
67	S	31.6	Very low	47.4	Very low	124 Å²	124	117.2 Å²	117.2	87%	0.867	70%	0.702	S	S	*	*			trans	-99.9	128.7	-176.4	48.3	0	0	0	0	112.1
68	S	30.7	Very low	44.2	Very low	123 Å²	123	121.1 Å²	121.1	86%	0.86	73%	0.729	S	S	*	*			trans	-152.4	111.1	158	48.6	0	0	0	0	112.2
69	G	26	Very low	41	Very low	73 Å²	73	123.6 Å²	123.6	75%	0.753	75%	0.747	S	S	*	*			trans	-107.8	179.2	142.3	0	0	0	0	0	108.4
70	P	36.8	Very low	38	Very low	135 Å²	135	124.4 Å²	124.4	88%	0.877	76%	0.758	S	S	*	*			cis	-122.9	-178.6	16	40.5	-27.1	0	0	0	115.2
71	K	31.7	Very low	34.9	Very low	197 Å²	197	130.4 Å²	130.4	86%	0.857	78%	0.78	S	S	*	*			trans	-56.6	151.8	-179.6	-49.3	170.5	-179.4	179	0	114.4
72	K	24.4	Very low	32.7	Very low	198 Å²	198	136.4 Å²	136.4	86%	0.861	79%	0.786	S	S	*	*			trans	-168.9	144	132.1	-115.3	171.8	-175.7	-179.4	0	117
73	T	25.8	Very low	31	Very low	129 Å²	129	140.6 Å²	140.6	79%	0.791	80%	0.795	S	S	*	*			trans	76	160	150.8	-40.8	0	0	0	0	119.3
74	E	25.5	Very low	31.1	Very low	172 Å²	172	140.8 Å²	140.8	80%	0.804	80%	0.796	S	S	*	*			trans	-126.4	160.2	-157.6	-52.4	157.9	98.8	0	0	113.8
75	S	23.8	Very low	30.7	Very low	114 Å²	114	138.1 Å²	138.1	80%	0.797	79%	0.785	S	S	*	*			trans	80.9	168.8	143.2	94.7	0	0	0	0	117.9
76	P	58.9	Low	30.3	Very low	106 Å²	106	140.6 Å²	140.6	69%	0.688	78%	0.782	S	S	*	*				-138.5	177.6	-118.1	36.3	-13.4	0	0	0	116.8
77	K	26	Very low	30.4	Very low	203 Å²	203	137.7 Å²	137.7	88%	0.883	77%	0.774	S	S	*	*			trans	169.7	172.3	155.4	-93	146.2	-169.2	173.4	0	110.1
78	S	25.9	Very low	30.5	Very low	89 Å²	89	138.1 Å²	138.1	62%	0.622	77%	0.771	S	S	*	*				178.4	140.7	-53.2	59.4	0	0	0	0	110.3
79	L	26	Very low	30.4	Very low	160 Å²	160	136.3 Å²	136.3	84%	0.838	76%	0.764	S	S	*	*			trans	65.3	159.7	169.8	-79.3	70	0	0	0	114.9
80	T	26.9	Very low	30.6	Very low	108 Å²	108	140.6 Å²	140.6	66%	0.663	77%	0.769	S	S	*	*			cis	-152.5	163.2	-0.3	-6.5	0	0	0	0	112.5
81	K	25.2	Very low	30.1	Very low	178 Å²	178	140.9 Å²	140.9	77%	0.774	76%	0.762	S	S	*	*			trans	12.3	145.9	137.6	-69.9	169.3	-176.2	171.5	0	118.8
82	R	23.1	Very low	29.8	Very low	231 Å²	231	139.9 Å²	139.9	87%	0.872	77%	0.765	S	S	*	*			cis	-168.8	156	42.2	-140.6	164.7	-167.7	167.1	-0.7	113.9
83	K	26.1	Very low	30.2	Very low	141 Å²	141	137.9 Å²	137.9	61%	0.613	76%	0.759	S	S	*	*			trans	-67.4	177.1	152.7	-108.4	-163.9	-179.8	-153.9	0	109.9	D86	K83-D86 IonicContact NZ-OD1 2.64Å; K83-D86 PolarHBondContact NZ-OD1 2.81Å; K83-D86 IonicContact NZ-OD2 3.55Å; K83-D86 PolarHBondContact NZ-OD2 3.35Å
84	P	50.3	Low	30.3	Very low	120 Å²	120	136.6 Å²	136.6	78%	0.779	75%	0.754	S	S	*	*			cis	-93.6	-169.1	15.8	41	-33.9	0	0	0	111.4
85	A	31.1	Very low	30.6	Very low	80 Å²	80	135.9 Å²	135.9	66%	0.661	76%	0.755	S	S	*	*			cis	-142.2	-171.2	11.7	0	0	0	0	0	114.8
86	D	32.5	Very low	30.7	Very low	123 Å²	123	137.3 Å²	137.3	66%	0.658	75%	0.753	S	S	*	*			trans	-144.2	-176.8	-170.4	-55.3	-104.5	0	0	0	105.1	K83	K83-D86 IonicContact NZ-OD1 2.64Å; K83-D86 PolarHBondContact NZ-OD1 2.81Å; K83-D86 IonicContact NZ-OD2 3.55Å; K83-D86 PolarHBondContact NZ-OD2 3.35Å
87	A	30.9	Very low	29.3	Very low	88 Å²	88	140.9 Å²	140.9	73%	0.727	76%	0.761	S	S	*	*			cis	-144.1	-126.7	24.2	0	0	0	0	0	111.2
88	T	32.4	Very low	29.3	Very low	133 Å²	133	136.2 Å²	136.2	82%	0.816	76%	0.76	S	S	*	*			cis	-161.7	168.3	9.8	-25.3	0	0	0	0	110.8
89	A	30	Very low	29.2	Very low	85 Å²	85	137.2 Å²	137.2	70%	0.702	77%	0.767	S	S	*	*			trans	68.5	134.9	176.5	0	0	0	0	0	117.1
90	N	29.3	Very low	29.3	Very low	162 Å²	162	137 Å²	137	87%	0.866	77%	0.766	S	S	*	*			cis	-147.7	163.5	-7.1	-111.8	-10.5	0	0	0	112
91	L	26.1	Very low	29.2	Very low	141 Å²	141	138.4 Å²	138.4	74%	0.738	77%	0.774	S	S	*	*			trans	-101.8	159.3	-172.5	-86.3	96.5	0	0	0	115.1
92	I	26.2	Very low	29	Very low	176 Å²	176	135 Å²	135	90%	0.903	77%	0.771	S	S	*	*				-156.7	159.7	122.1	-100.9	159.2	0	0	0	108.8
93	Q	31.5	Very low	29.1	Very low	157 Å²	157	130.3 Å²	130.3	73%	0.734	77%	0.769	S	S	*	*			trans	-141.9	166.7	-159.1	-172.9	-175.7	-18	0	0	113.1
94	C	28.7	Very low	28.9	Very low	102 Å²	102	128.7 Å²	128.7	69%	0.689	78%	0.775	S	S	*	*			trans	108.2	134.4	157.8	-67	0	0	0	0	115.6
95	L	31.3	Very low	27.8	Very low	157 Å²	157	132.2 Å²	132.2	82%	0.822	78%	0.778	S	S	*	*			cis	-121.9	-168.3	-4.6	-65.2	91.4	0	0	0	108.9
96	N	26.3	Very low	27.6	Very low	144 Å²	144	134.2 Å²	134.2	77%	0.77	78%	0.782	S	S	*	*			cis	-154.6	178.7	7.1	-160.7	23.2	0	0	0	111.6
97	E	30.3	Very low	27.4	Very low	181 Å²	181	133.4 Å²	133.4	85%	0.846	79%	0.786	S	S	*	*			trans	-123.7	160.2	-177	-56.1	-174.4	139.2	0	0	114.9
98	A	24.6	Very low	27.2	Very low	105 Å²	105	131.8 Å²	131.8	87%	0.868	78%	0.778	S	S	*	*			trans	-164.6	158.2	145	0	0	0	0	0	110.4
99	S	24.7	Very low	26.9	Very low	109 Å²	109	135.1 Å²	135.1	76%	0.762	78%	0.777	S	S	*	*			trans	-157.7	161.1	-174.2	-166.3	0	0	0	0	115.1
100	L	27.3	Very low	26.7	Very low	157 Å²	157	141.4 Å²	141.4	82%	0.822	78%	0.782	S	S	*	*			trans	78	160.9	152.2	-88.5	161.2	0	0	0	123.3
101	V	25.9	Very low	26.6	Very low	137 Å²	137	140 Å²	140	83%	0.83	78%	0.78	S	S	*	*			trans	94.1	153	164.4	-163.1	0	0	0	0	118.1
102	C	19.9	Very low	26.7	Very low	106 Å²	106	137 Å²	137	72%	0.716	78%	0.783	S	S	*	*			trans	-130.5	167.8	-160	-42.3	0	0	0	0	113.4
103	T	25.3	Very low	26.8	Very low	133 Å²	133	140.3 Å²	140.3	82%	0.816	78%	0.784	S	S	*	*				159.1	155.9	123.7	43.1	0	0	0	0	115.3
104	S	22.9	Very low	26.5	Very low	106 Å²	106	140.4 Å²	140.4	74%	0.741	79%	0.788	S	S	*	*			trans	70.5	141.6	165	-31	0	0	0	0	117.4
105	K	26.7	Very low	26.4	Very low	194 Å²	194	146 Å²	146	84%	0.843	80%	0.795	S	S	*	*			cis	68.7	136.7	27.2	-67.2	-169.4	175.9	178.3	0	114.3
106	T	27.6	Very low	26.2	Very low	123 Å²	123	145.1 Å²	145.1	76%	0.755	79%	0.79	S	S	*	*			cis	-161.4	176.2	-2.7	7.9	0	0	0	0	107.4
107	S	28.1	Very low	26.1	Very low	105 Å²	105	145.5 Å²	145.5	73%	0.734	79%	0.791	S	S	*	*			cis	-162.8	-179.3	10.3	-122.6	0	0	0	0	108.1
108	G	25.6	Very low	25.9	Very low	54 Å²	54	144.4 Å²	144.4	56%	0.557	79%	0.787	S	S	*	*			cis	162.1	-175.5	-3.6	0	0	0	0	0	113.2
109	Y	25.9	Very low	26.1	Very low	203 Å²	203	147.9 Å²	147.9	80%	0.796	79%	0.786	S	S	*	*			trans	71	138.1	175.2	-47.4	-70.9	0	0	0	116.9
110	R	26.1	Very low	26.3	Very low	217 Å²	217	149.6 Å²	149.6	82%	0.819	79%	0.786	S	S	*	*			cis	-153.8	166.7	-7.8	-130.4	170.5	-164.4	-175.9	6.6	112.5
111	T	28.3	Very low	26.2	Very low	132 Å²	132	150 Å²	150	81%	0.81	79%	0.789	S	S	*	*			trans	-32.7	157	165.2	50	0	0	0	0	117.5
112	G	26.6	Very low	26.3	Very low	79 Å²	79	150.3 Å²	150.3	81%	0.814	79%	0.785	S	S	*	*			cis	-177.7	-159.5	13.1	0	0	0	0	0	115.3
113	R	29	Very low	26.6	Very low	245 Å²	245	152.8 Å²	152.8	93%	0.925	79%	0.791	S	S	*	*			trans	-96.6	176.2	-168.4	-69.7	175.6	165.9	172.4	-5.2	114.7
114	I	26.2	Very low	26.6	Very low	159 Å²	159	152.8 Å²	152.8	82%	0.815	79%	0.786	S	S	*	*			trans	95.6	112.1	162.5	-56.3	163.1	0	0	0	112.1
115	R	26.7	Very low	26.7	Very low	220 Å²	220	157.6 Å²	157.6	83%	0.83	79%	0.794	S	S	*	*			cis	86.6	138.9	31.1	-153.5	-157.8	-156.6	-164.9	7.8	112.6
116	I	26	Very low	26.5	Very low	139 Å²	139	154.6 Å²	154.6	71%	0.713	79%	0.787	S	S	*	*			trans	77.6	135.6	172.4	-59.3	174.1	0	0	0	112.3
117	L	25.2	Very low	26.4	Very low	151 Å²	151	153.1 Å²	153.1	79%	0.791	78%	0.778	S	S	*	*			cis	-142.2	-167.1	9.8	-131.4	161.7	0	0	0	112.6
118	M	26.1	Very low	26.3	Very low	158 Å²	158	156.7 Å²	156.7	78%	0.778	78%	0.78	S	S	*	*			trans	-63.4	176.5	172.7	-59.3	-157.8	-168.5	0	0	112.3
119	Q	27.3	Very low	26.4	Very low	178 Å²	178	161.8 Å²	161.8	83%	0.832	79%	0.79	S	S	*	*				-174	173.5	50.1	-147.8	157.3	11.1	0	0	114.3
120	N	29	Very low	26.3	Very low	145 Å²	145	157.3 Å²	157.3	78%	0.775	79%	0.787	S	S	*	*			trans	-56.8	153	175.2	-60.1	-56.1	0	0	0	113.2
121	L	26.8	Very low	26.5	Very low	167 Å²	167	154.3 Å²	154.3	87%	0.874	79%	0.786	S	S	*	*				-169.6	147.8	111.6	-103.8	167	0	0	0	114.8
122	N	26.4	Very low	26.5	Very low	142 Å²	142	154 Å²	154	76%	0.759	78%	0.779	S	S	*	*			trans	-54.6	144.2	164.5	-81.7	-45.6	0	0	0	112.5
123	L	27.1	Very low	26.4	Very low	158 Å²	158	157.2 Å²	157.2	83%	0.827	78%	0.778	S	S	*	*				-179.7	163.4	105.3	-100.1	165.7	0	0	0	113.9
124	N	26.1	Very low	26.3	Very low	133 Å²	133	149 Å²	149	71%	0.711	77%	0.77	S	S	*	*			trans	-63.9	156.2	168.2	-51.8	-81.4	0	0	0	111.5
125	F	23.9	Very low	26.4	Very low	208 Å²	208	149.8 Å²	149.8	91%	0.912	77%	0.767	S	S	*	*				-162.3	-177.1	103.1	-120.4	-90.2	0	0	0	112.2
126	N	22.8	Very low	26.4	Very low	130 Å²	130	149.2 Å²	149.2	70%	0.695	77%	0.767	S	S	*	*			trans	-131.4	162.9	-155.4	-158.6	-7.3	0	0	0	112.6
127	T	24.8	Very low	26.4	Very low	93 Å²	93	149.4 Å²	149.4	57%	0.571	77%	0.768	S	S	*	*			trans	62.5	124.7	158	45.5	0	0	0	0	122.7
128	K	25.9	Very low	27.2	Very low	179 Å²	179	148 Å²	148	78%	0.778	77%	0.768	S	S	*	*			trans	72.9	158.7	134.5	-62.2	170.5	-175.6	175.8	0	116.6
129	Q	28.3	Very low	27.3	Very low	162 Å²	162	145.6 Å²	145.6	76%	0.757	76%	0.762	S	S	*	*			cis	-158.8	140.9	21.2	-148.7	151.7	-12.8	0	0	112.6
130	C	24.6	Very low	28.2	Very low	108 Å²	108	141.8 Å²	141.8	73%	0.73	75%	0.753	S	S	*	*			trans	43.1	168.7	136.9	-55.9	0	0	0	0	122.4
131	L	28.9	Very low	28	Very low	154 Å²	154	141.8 Å²	141.8	81%	0.806	75%	0.752	S	S	*	*			cis	-150.3	174.1	19.3	-110.3	118.4	0	0	0	107.6
132	N	28.1	Very low	28	Very low	126 Å²	126	138.9 Å²	138.9	67%	0.674	75%	0.745	S	S	*	*			cis	-157.4	-176.9	2.7	-162.7	5.4	0	0	0	109.7
133	N	25.2	Very low	28	Very low	146 Å²	146	139.9 Å²	139.9	78%	0.781	74%	0.744	S	S	*	*			trans	72	128.5	164.8	-49.9	-21.3	0	0	0	116
134	G	26.7	Very low	28	Very low	73 Å²	73	138.4 Å²	138.4	75%	0.753	74%	0.737	S	S	*	*			cis	154.9	154.4	-0.5	0	0	0	0	0	109.1
135	K	28.1	Very low	28	Very low	176 Å²	176	138.6 Å²	138.6	77%	0.765	74%	0.738	S	S	*	*			cis	-154	175.8	6.5	-61	178.4	179.8	178	0	110.4
136	Y	27.7	Very low	28.3	Very low	208 Å²	208	136.7 Å²	136.7	82%	0.816	73%	0.73	S	S	*	*			trans	78	134.4	161.3	-64	-67	0	0	0	120.5
137	L	26.4	Very low	28.4	Very low	143 Å²	143	139.2 Å²	139.2	75%	0.749	74%	0.735	S	S	*	*			trans	-143.5	156.8	177	-79.3	165.6	0	0	0	105.8	V139	L137-V139 HydrophobicContact CB-CG2 4.01Å; L137-V139 HydrophobicContact CD1-CG2 4.26Å; L137-V139 HydrophobicContact CD2-CG2 4.25Å; L137-V139 HydrophobicContact CG-CG2 4.42Å
138	P	40.9	Very low	28.4	Very low	121 Å²	121	139 Å²	139	79%	0.786	74%	0.736	S	S	*	*				-137.1	159.7	84.2	16.7	7.3	0	0	0	115.2
139	V	29.3	Very low	28.3	Very low	107 Å²	107	136.9 Å²	136.9	65%	0.648	74%	0.738	S	S	*	*			cis	87.1	137.7	21.9	169.2	0	0	0	0	113	L137	L137-V139 HydrophobicContact CB-CG2 4.01Å; L137-V139 HydrophobicContact CD1-CG2 4.26Å; L137-V139 HydrophobicContact CD2-CG2 4.25Å; L137-V139 HydrophobicContact CG-CG2 4.42Å
140	P	44.3	Very low	28.2	Very low	99 Å²	99	134.9 Å²	134.9	64%	0.643	74%	0.742	S	S	*	*			cis	-151.6	-162	-23	43.8	-23.5	0	0	0	116.8
141	L	26.3	Very low	28.2	Very low	144 Å²	144	132.4 Å²	132.4	75%	0.754	74%	0.735	S	S	*	*			trans	71.8	131.1	157.7	-63	165.2	0	0	0	117.4
142	C	25.5	Very low	28	Very low	107 Å²	107	135.6 Å²	135.6	72%	0.723	74%	0.738	S	S	*	*			cis	83.9	105.8	33.2	-58.2	0	0	0	0	115.6
143	H	27.2	Very low	27.8	Very low	162 Å²	162	134.6 Å²	134.6	75%	0.75	74%	0.74	S	S	*	*				178	140.5	117.8	-97.4	86.6	0	0	0	114.7
144	N	27	Very low	29.3	Very low	128 Å²	128	132.5 Å²	132.5	68%	0.684	74%	0.735	S	S	*	*			trans	36.3	136.1	146	-66.2	-4.2	0	0	0	124.8
145	N	26.9	Very low	29.3	Very low	137 Å²	137	135.6 Å²	135.6	73%	0.733	73%	0.734	S	S	*	*			trans	92.4	128.6	131.7	-86.1	-25.1	0	0	0	123.1
146	K	28.5	Very low	29.3	Very low	168 Å²	168	133.7 Å²	133.7	73%	0.73	73%	0.732	S	S	*	*			trans	78.8	122.3	139.7	-75.5	-175.4	176.3	-174.4	0	121.7
147	F	25.1	Very low	29.2	Very low	183 Å²	183	130.4 Å²	130.4	80%	0.803	72%	0.724	S	S	*	*			trans	65.9	150.5	145.1	-77.4	-115.6	0	0	0	117.1
148	C	24.9	Very low	29.3	Very low	89 Å²	89	127.3 Å²	127.3	60%	0.601	71%	0.714	S	S	*	*			cis	-167.8	170.3	-25.3	-122.6	0	0	0	0	110.5
149	T	25	Very low	28.8	Very low	134 Å²	134	129.1 Å²	129.1	82%	0.822	71%	0.71	S	S	*	*			trans	65.3	147	151.2	47.9	0	0	0	0	122.4
150	S	24.6	Very low	28.7	Very low	119 Å²	119	129.2 Å²	129.2	83%	0.832	71%	0.71	S	S	*	*			trans	73.3	139.2	165	-153.3	0	0	0	0	118.1
151	G	24.8	Very low	28	Very low	56 Å²	56	134.7 Å²	134.7	58%	0.577	72%	0.718	S	S	*	*			cis	142	147.2	-9.7	0	0	0	0	0	114
152	Y	24.9	Very low	28.1	Very low	222 Å²	222	133.4 Å²	133.4	87%	0.871	71%	0.712	S	S	*	*			trans	66.3	129.4	180	-65.3	-96.2	0	0	0	114.2
153	S	23.8	Very low	28.3	Very low	104 Å²	104	136.3 Å²	136.3	73%	0.727	71%	0.714	S	S	*	*				70	145.1	58.6	-76	0	0	0	0	114.2
154	P	56.5	Low	28.4	Very low	103 Å²	103	134.3 Å²	134.3	67%	0.669	71%	0.709	S	S	*	*			cis	-140.6	-144.6	-25.4	34.2	-10.9	0	0	0	111.5
155	D	28.3	Very low	28.3	Very low	137 Å²	137	137.5 Å²	137.5	73%	0.733	72%	0.717	S	S	*	*			trans	98	136.6	138.9	-85.6	-16.3	0	0	0	124.9
156	L	27.5	Very low	28.1	Very low	136 Å²	136	133.8 Å²	133.8	71%	0.712	71%	0.711	S	S	*	*			trans	92.5	111.5	139.1	-106.1	72.5	0	0	0	124.6
157	E	26.1	Very low	28.1	Very low	140 Å²	140	133 Å²	133	65%	0.654	72%	0.72	S	S	*	*				104.1	139.5	118.4	-118.1	-165	149.9	0	0	122.9	K159	E157-K159 IonicContact OE1-NZ 3.9Å; E157-K159 PolarHBondContact OE1-NZ 3.44Å
158	S	28.1	Very low	28.3	Very low	78 Å²	78	136 Å²	136	55%	0.545	73%	0.726	S	S	.	*			trans	-60.9	167.5	159.2	63.4	0	0	0	0	112.5
159	K	30.1	Very low	29	Very low	159 Å²	159	137.2 Å²	137.2	69%	0.691	73%	0.733	S	S	*	*				-176.3	130.6	72.1	-117.5	141.7	-169.3	158	0	113.8	E157	E157-K159 IonicContact OE1-NZ 3.9Å; E157-K159 PolarHBondContact OE1-NZ 3.44Å
160	V	27.8	Very low	29.1	Very low	108 Å²	108	135.5 Å²	135.5	66%	0.655	73%	0.727	S	S	*	*				40.4	97.9	122.2	-171.1	0	0	0	0	120.3
161	R	29.6	Very low	29.2	Very low	214 Å²	214	135 Å²	135	81%	0.808	72%	0.722	S	S	*	*				78	160.2	117.8	-147.5	-163.1	-65.7	172.6	-0.8	121.8
162	N	28.9	Very low	29.5	Very low	118 Å²	118	139.6 Å²	139.6	63%	0.631	73%	0.728	S	S	*	*			trans	86	110.1	167.3	-60.6	-22.6	0	0	0	115.4
163	H	29.1	Very low	29.4	Very low	167 Å²	167	137.4 Å²	137.4	77%	0.773	72%	0.724	S	S	*	*				78.9	142.2	82.8	-76.7	-44.4	0	0	0	112.9
164	L	28.4	Very low	29.6	Very low	120 Å²	120	137.8 Å²	137.8	63%	0.628	72%	0.722	S	S	*	*			cis	-160.2	160.7	11.8	-126.6	172.7	0	0	0	110.9
165	F	26	Very low	28.2	Very low	195 Å²	195	140 Å²	140	86%	0.855	73%	0.726	S	S	*	*			trans	59.7	152.2	172.6	-57	-70.2	0	0	0	117.5
166	G	23.1	Very low	28.1	Very low	59 Å²	59	140.1 Å²	140.1	61%	0.608	73%	0.726	S	S	*	*			cis	159.6	137.3	-13.4	0	0	0	0	0	113.2
167	T	27.2	Very low	28.1	Very low	152 Å²	152	140.5 Å²	140.5	93%	0.933	72%	0.724	S	S	*	*			trans	166.2	150.3	140.6	32.7	0	0	0	0	111.6
168	R	28.9	Very low	28	Very low	245 Å²	245	140.6 Å²	140.6	93%	0.925	73%	0.726	S	S	*	*			trans	-158.1	134.9	170.3	-140.6	-171.7	-166.3	-161.4	5.8	109.9
169	P	40.9	Very low	27.8	Very low	116 Å²	116	144.7 Å²	144.7	75%	0.753	74%	0.735	S	S	*	*			trans	-130.8	163.1	148.3	36.9	-25.4	0	0	0	111
170	S	26.7	Very low	27.5	Very low	98 Å²	98	146 Å²	146	69%	0.685	74%	0.74	S	S	*	*			cis	-178.8	137.3	-23	51.4	0	0	0	0	109.4
171	C	26.9	Very low	27.2	Very low	108 Å²	108	150.4 Å²	150.4	73%	0.73	75%	0.751	S	S	*	*			trans	64.9	155	140.6	-60.9	0	0	0	0	120.2
172	E	29.9	Very low	27.8	Very low	152 Å²	152	145.6 Å²	145.6	71%	0.71	75%	0.748	S	S	*	*			cis	-165	-172.6	-7.1	-121.2	173	167.4	0	0	114.1
173	F	23.6	Very low	27.6	Very low	177 Å²	177	144.1 Å²	144.1	78%	0.776	75%	0.746	S	S	*	*			trans	75.6	119	170.9	-74.2	-83.9	0	0	0	118.2
174	V	27.6	Very low	27.7	Very low	112 Å²	112	146.7 Å²	146.7	68%	0.679	75%	0.749	S	S	*	*			cis	93.6	121	11.1	-171.6	0	0	0	0	117.5
175	I	26.4	Very low	27.6	Very low	150 Å²	150	150.7 Å²	150.7	77%	0.769	76%	0.762	S	S	*	*			trans	-173.8	107.2	138.6	-98.4	158.7	0	0	0	107.9
176	L	27.1	Very low	27.6	Very low	138 Å²	138	146.3 Å²	146.3	72%	0.723	75%	0.751	S	S	*	*				68.6	146.3	104.8	-60.5	175.1	0	0	0	115.5
177	Q	27.5	Very low	27.9	Very low	144 Å²	144	149.9 Å²	149.9	67%	0.673	76%	0.755	S	S	*	*			cis	-161	134.1	16.9	-153.3	169.2	-24.1	0	0	116.1
178	M	24.3	Very low	27.7	Very low	143 Å²	143	153.8 Å²	153.8	70%	0.704	75%	0.754	S	S	*	*			trans	59.9	161.9	148.5	-72	175.3	176.1	0	0	120.8
179	F	24.2	Very low	27.6	Very low	164 Å²	164	150.2 Å²	150.2	72%	0.719	75%	0.748	S	S	*	*			cis	-149.5	150.3	27	-110.1	-63.6	0	0	0	116.2
180	K	22.8	Very low	26.7	Very low	187 Å²	187	150.5 Å²	150.5	81%	0.813	75%	0.751	S	S	*	*			trans	60.9	111.3	146.6	-88.9	163	-178	176	0	124.2
181	F	22.9	Very low	26.7	Very low	199 Å²	199	151 Å²	151	87%	0.873	76%	0.755	S	S	*	*			trans	-70.6	176.5	133.9	-91.6	-79	0	0	0	111
182	P	40.6	Very low	26.4	Very low	114 Å²	114	155.8 Å²	155.8	74%	0.74	76%	0.764	S	S	*	*			cis	-140.8	-160.8	30.2	43.3	-19.8	0	0	0	114.4
183	S	26.3	Very low	26.2	Very low	86 Å²	86	155.9 Å²	155.9	60%	0.601	76%	0.762	S	S	*	*			cis	-165.3	144	12.8	-146	0	0	0	0	114.9
184	R	30.3	Very low	26.3	Very low	222 Å²	222	153.6 Å²	153.6	84%	0.838	76%	0.757	S	S	*	*			trans	40.9	131.3	140	-59.2	172.1	-176.7	-165.6	-2.3	120.2
185	K	26.5	Very low	26.2	Very low	204 Å²	204	154.8 Å²	154.8	89%	0.887	76%	0.755	S	S	*	*				-160.2	-173	71.5	-87.5	-176.6	176.1	-178.7	0	112.6
186	T	26.8	Very low	26.4	Very low	103 Å²	103	155 Å²	155	63%	0.632	75%	0.752	S	S	*	*				176.2	113.2	-57.8	-79.8	0	0	0	0	111.8
187	I	27.6	Very low	26.2	Very low	134 Å²	134	154.7 Å²	154.7	69%	0.687	75%	0.752	S	S	*	*			trans	58.9	128.2	146	-63.3	173.5	0	0	0	121.5
188	Y	24.4	Very low	26.2	Very low	234 Å²	234	151.8 Å²	151.8	92%	0.918	75%	0.752	S	S	*	*				-158	160.7	114.5	-104.8	-69.5	0	0	0	112.5
189	Q	26.2	Very low	26.4	Very low	170 Å²	170	151.8 Å²	151.8	79%	0.794	76%	0.755	S	S	*	*			trans	-160.2	137.1	-161.8	172.2	-171	2	0	0	110.3
190	C	22	Very low	26.6	Very low	121 Å²	121	150.3 Å²	150.3	82%	0.818	76%	0.759	S	S	*	*			trans	171.1	159.8	133.9	-100	0	0	0	0	113.6
191	S	26	Very low	26.7	Very low	109 Å²	109	144.9 Å²	144.9	76%	0.762	76%	0.756	S	S	*	*			trans	-112.2	168.3	177.4	-35	0	0	0	0	110.9
192	F	21.8	Very low	26.9	Very low	209 Å²	209	142.9 Å²	142.9	92%	0.917	76%	0.755	S	S	*	*			trans	-153.3	-179.7	140.5	-122.9	-85.3	0	0	0	111.6
193	K	25.5	Very low	26.3	Very low	154 Å²	154	145.9 Å²	145.9	67%	0.67	76%	0.763	S	S	*	*			trans	-148.8	164.5	-159.2	-175.6	-172.7	178.4	-99.4	0	110.5	E195	K193-E195 IonicContact NZ-OE1 2.78Å; K193-E195 PolarHBondContact NZ-OE1 2.75Å
194	L	25.4	Very low	26.4	Very low	129 Å²	129	149.8 Å²	149.8	68%	0.675	77%	0.772	S	S	*	*			trans	145.6	119.2	153.3	-77	164.6	0	0	0	108.2
195	E	26.3	Very low	26.2	Very low	137 Å²	137	145.9 Å²	145.9	64%	0.64	77%	0.766	S	S	*	*				77.9	145.9	82.9	-78.1	159.1	-137.5	0	0	112.9	K193	K193-E195 IonicContact NZ-OE1 2.78Å; K193-E195 PolarHBondContact NZ-OE1 2.75Å
196	E	29.3	Very low	26.1	Very low	153 Å²	153	141.4 Å²	141.4	72%	0.715	76%	0.761	S	S	*	*			cis	-161	178.1	21.9	-155.9	-167.4	-160.9	0	0	113.1
197	N	23.8	Very low	26	Very low	132 Å²	132	140.5 Å²	140.5	71%	0.706	76%	0.764	S	S	*	*			trans	74.9	153.3	161.2	-62	-59.2	0	0	0	119.5
198	A	28.2	Very low	25.9	Very low	83 Å²	83	139.5 Å²	139.5	69%	0.686	77%	0.769	S	S	*	*			cis	166.2	162.4	-20.7	0	0	0	0	0	105.3
199	N	27.2	Very low	26.1	Very low	143 Å²	143	134.5 Å²	134.5	77%	0.765	76%	0.758	S	S	*	*			cis	-160.5	155.8	3.7	-152	15	0	0	0	111.8
200	V	27.8	Very low	26.1	Very low	133 Å²	133	133.6 Å²	133.6	81%	0.806	75%	0.753	S	S	*	*			trans	41.1	137.7	148.9	166.8	0	0	0	0	123
201	G	25.6	Very low	26.3	Very low	73 Å²	73	134.8 Å²	134.8	75%	0.753	75%	0.747	S	S	*	*			trans	170.5	78.4	156.4	0	0	0	0	0	117.5
202	D	28	Very low	26.3	Very low	158 Å²	158	139.4 Å²	139.4	85%	0.845	75%	0.747	S	S	*	*			trans	-84.1	155.7	170.4	-66.7	-68.9	0	0	0	113
203	I	28.3	Very low	26.5	Very low	177 Å²	177	134.8 Å²	134.8	91%	0.908	74%	0.736	S	S	*	*			trans	-163.5	143.6	140.9	-103.2	153.2	0	0	0	112.6
204	E	26.4	Very low	26.5	Very low	168 Å²	168	136 Å²	136	79%	0.785	74%	0.744	S	S	*	*			trans	-63.3	158.3	179.4	-96.8	-179.6	136	0	0	117.6
205	L	26.8	Very low	26.4	Very low	139 Å²	139	133.7 Å²	133.7	73%	0.728	74%	0.744	S	S	*	*				146.1	128.8	103.9	-112.7	154	0	0	0	116.5
206	S	24	Very low	26.2	Very low	110 Å²	110	133.4 Å²	133.4	77%	0.769	76%	0.755	S	S	*	*			trans	63.8	163.3	147.9	69.2	0	0	0	0	121.4
207	A	26.2	Very low	26	Very low	85 Å²	85	132.6 Å²	132.6	70%	0.702	76%	0.756	S	S	*	*			cis	-173.8	159.5	-36.7	0	0	0	0	0	110.3
208	S	25.4	Very low	26	Very low	113 Å²	113	131.8 Å²	131.8	79%	0.79	76%	0.756	S	S	*	*			trans	66.6	159	152.6	-83.3	0	0	0	0	119.5
209	L	27.4	Very low	25.9	Very low	129 Å²	129	137.1 Å²	137.1	68%	0.675	77%	0.766	S	S	*	*			cis	-166.5	154.9	-19	-167.9	66.7	0	0	0	110
210	E	26.3	Very low	26	Very low	151 Å²	151	136.6 Å²	136.6	71%	0.706	76%	0.763	S	S	*	*			trans	60.5	143.1	159.3	-79.4	156.3	-161.3	0	0	119
211	Q	26.7	Very low	25.9	Very low	146 Å²	146	138.9 Å²	138.9	68%	0.682	77%	0.765	S	S	*	*				66.9	144	54.6	-64.3	-168.4	25.3	0	0	113.2
212	R	26.8	Very low	26	Very low	205 Å²	205	140.6 Å²	140.6	77%	0.774	76%	0.757	S	S	*	*			cis	-170.4	160.3	10.1	-128.6	175.8	174.4	157.2	-8	110
213	V	24	Very low	25.9	Very low	113 Å²	113	140 Å²	140	69%	0.685	75%	0.753	S	S	*	*			trans	69.7	155	142	161.6	0	0	0	0	117.1
214	H	25.6	Very low	25.9	Very low	178 Å²	178	143.5 Å²	143.5	82%	0.824	76%	0.755	S	S	*	*			cis	-136.1	-163.7	4.9	-138.4	-21.6	0	0	0	113.3
215	A	24.2	Very low	26.2	Very low	82 Å²	82	141.2 Å²	141.2	68%	0.678	76%	0.758	S	S	*	*			trans	-143.5	155.1	-179.1	0	0	0	0	0	112.6
216	C	22.4	Very low	26.4	Very low	130 Å²	130	139 Å²	139	88%	0.878	76%	0.759	S	S	*	*			trans	-179.9	164.8	159.6	-105	0	0	0	0	110.1
217	N	24.3	Very low	26.9	Very low	136 Å²	136	140 Å²	140	73%	0.727	76%	0.761	S	S	*	*			cis	-168.3	156.4	-45	-163.8	8.5	0	0	0	108.7
218	V	24.6	Very low	27	Very low	116 Å²	116	146 Å²	146	70%	0.703	77%	0.766	S	S	*	*			trans	42.8	115.4	167.6	-136.7	0	0	0	0	117.2
219	Q	26.2	Very low	27.3	Very low	195 Å²	195	146 Å²	146	91%	0.911	76%	0.761	S	S	*	*				-161.9	166.1	85.5	-97	-179.7	1.3	0	0	113.9
220	N	29.1	Very low	27.6	Very low	131 Å²	131	144.9 Å²	144.9	70%	0.701	76%	0.757	S	S	*	*			trans	-125.4	118.7	-170.3	162	80.6	0	0	0	109.6
221	E	26	Very low	28.2	Very low	181 Å²	181	143.8 Å²	143.8	85%	0.846	76%	0.76	S	S	*	*			trans	-128.7	156.4	159.2	-98.8	-56.6	165.3	0	0	111
222	N	27.2	Very low	28.7	Very low	110 Å²	110	140.3 Å²	140.3	59%	0.588	76%	0.756	S	S	*	*			trans	-133.5	163.5	-146.6	-163.7	2.5	0	0	0	112.6
223	L	26.6	Very low	29.3	Very low	144 Å²	144	137 Å²	137	75%	0.754	75%	0.749	S	S	*	*			trans	61.6	109.5	167	-60.9	140.3	0	0	0	117.1
224	R	28.7	Very low	30	Very low	251 Å²	251	138.6 Å²	138.6	95%	0.947	75%	0.753	S	S	*	*				-158.3	125.9	109.4	-106.9	164.2	-162.9	-162.6	4.7	112
225	S	31.7	Very low	30.5	Very low	121 Å²	121	141 Å²	141	85%	0.846	76%	0.755	S	S	*	*			trans	-92.7	128.2	162	62.1	0	0	0	0	109.3
226	A	30.6	Very low	31	Very low	92 Å²	92	145.7 Å²	145.7	76%	0.76	76%	0.763	S	S	*	*			trans	-143.3	148.4	163.3	0	0	0	0	0	109
227	V	34.3	Very low	31.5	Very low	132 Å²	132	143.7 Å²	143.7	80%	0.8	75%	0.751	S	S	*	*			trans	-127.5	115.2	-177.5	165.7	0	0	0	0	106
228	Y	29.4	Very low	32	Very low	209 Å²	209	144.9 Å²	144.9	82%	0.82	76%	0.755	S	S	*	*			trans	62.4	157.9	-165.5	-64.9	-120.5	0	0	0	111.8
229	V	31.8	Very low	32.3	Very low	113 Å²	113	144.5 Å²	144.5	69%	0.685	76%	0.758	S	S	*	*			cis	-139.6	151.8	16.7	178	0	0	0	0	108.6
230	N	32.3	Very low	32.3	Very low	107 Å²	107	144.9 Å²	144.9	57%	0.572	76%	0.759	S	S	*	*			trans	-168.5	88.8	140.3	-102.9	5.2	0	0	0	111.7	A232 E233	N230-A232 VanDerWaalsContact C-N 3.31Å; N230-E233 PolarHBondContact ND2-OE2 2.79Å
231	V	39.8	Very low	32.4	Very low	128 Å²	128	144 Å²	144	78%	0.776	76%	0.763	S	S	*	*			trans	-92.1	5.7	175.1	-176.7	0	0	0	0	111.6
232	A	36.1	Very low	33.7	Very low	73 Å²	73	140.8 Å²	140.8	60%	0.603	76%	0.758	S	S	*	*	S	Bend	trans	-90.7	-31.7	-177.2	0	0	0	0	0	114.2	N230 L234	N230-A232 VanDerWaalsContact C-N 3.31Å; A232-L234 PolarHBondContact O-N 2.92Å
233	E	40.4	Very low	34.5	Very low	135 Å²	135	140.7 Å²	140.7	63%	0.631	76%	0.764	S	S	*	*	G	3₁₀ helix	trans	-82.6	-14.5	-169.5	-69	170.8	130.9	0	0	113.9	N230 R235	N230-E233 PolarHBondContact ND2-OE2 2.79Å; E233-R235 PolarHBondContact O-N 3.41Å
234	L	38.5	Very low	34.5	Very low	146 Å²	146	138.1 Å²	138.1	76%	0.764	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-81.5	6.9	177.7	-108	165.4	0	0	0	114.4	A232	A232-L234 PolarHBondContact O-N 2.92Å
235	R	35.9	Very low	34.3	Very low	229 Å²	229	133.3 Å²	133.3	86%	0.864	75%	0.751	S	S	*	*	G	3₁₀ helix	trans	-111.7	8.1	180	-76.5	-175	172.7	-99.5	1.2	114.8	E233	E233-R235 PolarHBondContact O-N 3.41Å
236	Q	34.9	Very low	34.8	Very low	180 Å²	180	133.4 Å²	133.4	84%	0.841	75%	0.749	S	S	*	*	S	Bend	trans	-120.4	5.9	-179.2	-72	-172.4	-25.4	0	0	114.7
237	S	32.6	Very low	34.7	Very low	89 Å²	89	134.2 Å²	134.2	62%	0.622	75%	0.749	S	S	*	*	S	Bend	trans	-109.1	8.9	-173.8	53.7	0	0	0	0	115.6
238	I	34.4	Very low	35.1	Very low	161 Å²	161	133.4 Å²	133.4	83%	0.826	75%	0.746	S	S	*	*	S	Bend	trans	-131	70.8	177.4	-47.9	-179.8	0	0	0	109.9
239	S	30.9	Very low	34.7	Very low	108 Å²	108	129.4 Å²	129.4	76%	0.755	75%	0.748	S	S	*	*			trans	-167.5	80.3	170	174.6	0	0	0	0	112
240	E	27.7	Very low	34.6	Very low	202 Å²	202	129.1 Å²	129.1	94%	0.944	75%	0.751	S	S	*	*			trans	-172.9	136	148.8	-108.3	162.5	-149.6	0	0	111.9
241	S	31.2	Very low	34.8	Very low	112 Å²	112	130.5 Å²	130.5	78%	0.783	77%	0.765	S	S	*	*			trans	-176.1	-177.4	179	66.1	0	0	0	0	108.5
242	P	52.1	Low	34.3	Very low	114 Å²	114	129.5 Å²	129.5	74%	0.74	76%	0.764	S	S	*	*			cis	-113	-125.6	-12.6	33.5	-11.4	0	0	0	108
243	P	45.6	Very low	34.1	Very low	109 Å²	109	136.7 Å²	136.7	71%	0.708	78%	0.777	S	S	*	*			cis	-121.1	-154	-31.9	28.3	-2.5	0	0	0	110.3
244	S	26.8	Very low	33.5	Very low	90 Å²	90	137 Å²	137	63%	0.629	78%	0.782	S	S	*	*			cis	-157.2	157.1	5.4	-21.7	0	0	0	0	112.5
245	D	24.3	Very low	33.5	Very low	149 Å²	149	139.5 Å²	139.5	80%	0.797	79%	0.787	S	S	*	*				33.2	155.8	129.6	-58.5	-34.1	0	0	0	124.7
246	P	40.5	Very low	33.7	Very low	124 Å²	124	136 Å²	136	81%	0.805	78%	0.781	S	S	*	*			cis	-130.7	170.6	6.4	29.3	-6.8	0	0	0	118.5
247	S	28.3	Very low	34.2	Very low	109 Å²	109	133.7 Å²	133.7	76%	0.762	77%	0.77	S	S	*	*			trans	-49.3	176	165.3	-78.3	0	0	0	0	116.9
248	P	42.9	Very low	35.7	Very low	114 Å²	114	131.2 Å²	131.2	74%	0.74	76%	0.758	S	S	*	*			cis	-149.4	161.1	27.7	42.8	-22.5	0	0	0	121.2
249	C	21.7	Very low	37.6	Very low	126 Å²	126	127.3 Å²	127.3	85%	0.851	73%	0.733	S	S	*	*				172.2	153.3	119.8	-96.7	0	0	0	0	112.8
250	S	29	Very low	40	Very low	107 Å²	107	126.5 Å²	126.5	75%	0.748	72%	0.717	S	S	*	*			trans	-136.2	166.7	179.9	-48.6	0	0	0	0	111.5
251	P	37.9	Very low	42.8	Very low	136 Å²	136	120.9 Å²	120.9	88%	0.883	70%	0.696	S	S	*	*				-140	178.3	102	38.7	-26	0	0	0	114.3
252	S	28.9	Very low	45.1	Very low	107 Å²	107	118.7 Å²	118.7	75%	0.748	67%	0.674	S	S	*	*			trans	-123.8	151.2	-161.5	-36.7	0	0	0	0	114.5
253	Y	30.9	Very low	46.5	Very low	224 Å²	224	117.2 Å²	117.2	88%	0.878	66%	0.662	S	S	*	*			trans	172.6	150	142.3	-112.7	-119.5	0	0	0	106.7
254	L	28.2	Very low	48.1	Very low	141 Å²	141	114.5 Å²	114.5	74%	0.738	64%	0.642	S	S	*	*			cis	-125.2	166.3	22.2	-89.8	153.4	0	0	0	113.5
255	K	39.5	Very low	50.1	Low	199 Å²	199	119.4 Å²	119.4	87%	0.865	66%	0.655	S	S	*	*			trans	-119.8	133.7	164.2	-107.8	-166.2	173.6	-163.3	0	108.2
256	Q	39.5	Very low	51.9	Low	156 Å²	156	121.6 Å²	121.6	73%	0.729	66%	0.66	S	S	*	*			trans	-163.3	134.6	166.2	-94.1	-169.2	-76.6	0	0	107.7
257	E	45.7	Very low	53.4	Low	131 Å²	131	119 Å²	119	61%	0.612	65%	0.645	S	S	*	*			cis	-144.1	150.8	-12.6	-68.3	-166.9	167.7	0	0	111.6	W259	E257-W259 PolarHBondContact O-N 3.27Å
258	G	62.7	Low	55.4	Low	36 Å²	36	116.6 Å²	116.6	37%	0.371	64%	0.637	S	S	.	*			trans	73.4	-60.3	151.6	0	0	0	0	0	119.5	H274 P275	G258-H274 VanDerWaalsContact C-CD2 3.45Å; G258-H274 WeakPolarHBondContact CA-NE2 3.24Å; G258-P275 WeakPolarHBondContact O-CD 3.38Å
259	W	74.9	Confident	56.5	Low	80 Å²	80	116.8 Å²	116.8	30%	0.303	63%	0.628	S	S	.	*	P	Polyproline II helix	trans	-94.4	136.8	-158.4	-60	83.7	0	0	0	114.3	E257 H274 T281 P285 F286	E257-W259 PolarHBondContact O-N 3.27Å; W259-H274 AromaticContact CD1-CD2 3.89Å; W259-H274 HydrophobicContact CD2-CB 3.88Å; W259-H274 AromaticContact CD2-CD2 3.88Å; W259-H274 AromaticContact CE2-CD2 3.72Å; W259-H274 HydrophobicContact CE3-CB 3.67Å; W259-H274 AromaticContact CG-CD2 3.97Å; W259-H274 HydrophobicContact CH2-CB 3.92Å; W259-H274 HydrophobicContact CZ2-CB 4.11Å; W259-H274 HydrophobicContact CZ3-CB 3.69Å; W259-H274 AromaticContact NE1-CD2 3.72Å; W259-T281 HydrophobicContact CE3-CG2 4.28Å; W259-T281 HydrophobicContact CH2-CG2 4.09Å; W259-T281 HydrophobicContact CZ3-CG2 3.73Å; W259-P285 HydrophobicContact CB-CG 4.33Å; W259-P285 HydrophobicContact CD2-CG 3.93Å; W259-P285 HydrophobicContact CG-CG 3.75Å; W259-F286 HydrophobicContact CB-CE2 4.49Å; W259-F286 HydrophobicContact CB-CZ 3.98Å; W259-F286 HydrophobicContact CG-CZ 4.42Å
260	E	81.1	Confident	59.2	Low	91 Å²	91	116.2 Å²	116.2	43%	0.425	61%	0.613	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97	147.7	168.3	-60.3	-175.2	165.1	0	0	110.5	H262 Y272 Y273 P275	E260-H262 IonicContact OE2-CD2 2.65Å; E260-H262 IonicContact OE2-CE1 3.53Å; E260-H262 IonicContact OE2-NE2 3.25Å; E260-H262 PolarHBondContact OE2-NE2 2.72Å; E260-Y272 CarbonylContact O-C 3.59Å; E260-Y272 WeakPolarHBondContact O-CA 3.37Å; E260-Y273 PolarHBondContact N-O 2.9Å; E260-Y273 PolarHBondContact O-N 3.19Å; E260-P275 HydrophobicContact CG-CG 4.4Å
261	V	86.2	Confident	61.8	Low	83 Å²	83	113.7 Å²	113.7	50%	0.503	59%	0.588	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.7	126.3	173.4	-166.5	0	0	0	0	109.5	E270 Y272	V261-E270 HydrophobicContact CG1-CB 4.32Å; V261-E270 HydrophobicContact CG1-CG 4.29Å; V261-Y272 HydrophobicContact CG1-CE1 4.29Å; V261-Y272 HydrophobicContact CG2-CD1 3.86Å; V261-Y272 HydrophobicContact CG2-CE1 3.7Å
262	H	79.6	Confident	64.1	Low	67 Å²	67	108.7 Å²	108.7	31%	0.31	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-123.8	158.5	179.7	-72.4	-115.5	0	0	0	109.3	E260 E270 Y271	E260-H262 IonicContact OE2-CD2 2.65Å; E260-H262 IonicContact OE2-CE1 3.53Å; E260-H262 IonicContact OE2-NE2 3.25Å; E260-H262 PolarHBondContact OE2-NE2 2.72Å; H262-E270 CarbonylContact O-C 3.57Å; H262-E270 WeakPolarHBondContact O-CA 3.14Å; H262-Y271 HydrophobicContact CB-CD1 4.18Å; H262-Y271 HydrophobicContact CB-CD2 4.24Å; H262-Y271 HydrophobicContact CB-CE1 3.68Å; H262-Y271 HydrophobicContact CB-CE2 3.75Å; H262-Y271 HydrophobicContact CB-CG 4.44Å; H262-Y271 VanDerWaalsContact CB-CZ 3.45Å; H262-Y271 PolarHBondContact N-O 3.27Å; H262-Y271 PolarHBondContact O-N 2.85Å; H262-Y271 VanDerWaalsContact O-O 3.12Å
263	V	81.9	Confident	66.4	Low	82 Å²	82	106.9 Å²	106.9	50%	0.497	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	128.3	177.4	-176.6	0	0	0	0	108.7	E270	V263-E270 HydrophobicContact CG2-CG 3.87Å
264	D	80.6	Confident	68.8	Low	52 Å²	52	97.8 Å²	97.8	28%	0.278	49%	0.494	S	S	.	.			trans	-73.6	141.6	174.8	170.6	54.5	0	0	0	111.9	E266 S267 G268 Q269 Y271 W282	D264-E266 PolarHBondContact OD2-N 2.98Å; D264-S267 WeakPolarHBondContact CB-OG 3.38Å; D264-S267 VanDerWaalsContact OD2-CB 3.28Å; D264-S267 WeakPolarHBondContact OD2-CB 3.29Å; D264-S267 PolarHBondContact OD2-N 2.94Å; D264-S267 PolarHBondContact OD2-OG 2.89Å; D264-G268 WeakPolarHBondContact O-CA 3.36Å; D264-G268 PolarHBondContact O-N 3.43Å; D264-Q269 PolarHBondContact N-O 3.47Å; D264-Y271 HydrophobicContact CB-CD1 4.27Å; D264-Y271 HydrophobicContact CB-CE1 4.19Å; D264-W282 HydrophobicContact CB-CH2 3.72Å; D264-W282 HydrophobicContact CB-CZ3 4.24Å
265	Q	68.4	Low	70.8	Confident	193 Å²	193	93.8 Å²	93.8	90%	0.902	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-12.2	-170.3	-62.9	-172.3	3.7	0	0	114.2
266	E	60.7	Low	72.3	Confident	196 Å²	196	91.2 Å²	91.2	92%	0.916	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-37.5	171.9	-67.1	-161.4	136.1	0	0	112.6	D264	D264-E266 PolarHBondContact OD2-N 2.98Å
267	S	72.5	Confident	74	Confident	70 Å²	70	87.9 Å²	87.9	49%	0.49	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-26.7	179.6	64.5	0	0	0	0	114.6	D264 Q269	D264-S267 WeakPolarHBondContact CB-OG 3.38Å; D264-S267 VanDerWaalsContact OD2-CB 3.28Å; D264-S267 WeakPolarHBondContact OD2-CB 3.29Å; D264-S267 PolarHBondContact OD2-N 2.94Å; D264-S267 PolarHBondContact OD2-OG 2.89Å; S267-Q269 VanDerWaalsContact C-N 3.27Å; S267-Q269 PolarHBondContact OG-N 2.88Å
268	G	71	Confident	75.3	Confident	58 Å²	58	83.9 Å²	83.9	60%	0.598	46%	0.457	S	S	*	.			trans	73.3	14.2	-172.2	0	0	0	0	0	114.4	D264	D264-G268 WeakPolarHBondContact O-CA 3.36Å; D264-G268 PolarHBondContact O-N 3.43Å
269	Q	64.9	Low	75.6	Confident	118 Å²	118	84.8 Å²	84.8	55%	0.551	46%	0.457	S	S	*	.			trans	-97.2	144.2	-176.3	-174.1	167.2	-24.3	0	0	112	D264 S267 W282	D264-Q269 PolarHBondContact N-O 3.47Å; S267-Q269 VanDerWaalsContact C-N 3.27Å; S267-Q269 PolarHBondContact OG-N 2.88Å; Q269-W282 HydrophobicContact CB-CE3 4.49Å; Q269-W282 HydrophobicContact CB-CZ3 3.95Å; Q269-W282 HydrophobicContact CG-CE3 4.11Å; Q269-W282 HydrophobicContact CG-CZ3 4.08Å
270	E	79.8	Confident	76	Confident	114 Å²	114	85.1 Å²	85.1	53%	0.533	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	140.9	176.4	-77.3	170.6	-160.1	0	0	111.7	V261 H262 V263	V261-E270 HydrophobicContact CG1-CB 4.32Å; V261-E270 HydrophobicContact CG1-CG 4.29Å; H262-E270 CarbonylContact O-C 3.57Å; H262-E270 WeakPolarHBondContact O-CA 3.14Å; V263-E270 HydrophobicContact CG2-CG 3.87Å
271	Y	82.2	Confident	75.8	Confident	54 Å²	54	82.7 Å²	82.7	21%	0.212	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	159.2	172.2	71.6	-88.9	0	0	0	110.9	H262 D264 T280 T281 W282	H262-Y271 HydrophobicContact CB-CD1 4.18Å; H262-Y271 HydrophobicContact CB-CD2 4.24Å; H262-Y271 HydrophobicContact CB-CE1 3.68Å; H262-Y271 HydrophobicContact CB-CE2 3.75Å; H262-Y271 HydrophobicContact CB-CG 4.44Å; H262-Y271 VanDerWaalsContact CB-CZ 3.45Å; H262-Y271 PolarHBondContact N-O 3.27Å; H262-Y271 PolarHBondContact O-N 2.85Å; H262-Y271 VanDerWaalsContact O-O 3.12Å; D264-Y271 HydrophobicContact CB-CD1 4.27Å; D264-Y271 HydrophobicContact CB-CE1 4.19Å; Y271-T280 HydrophobicContact CD2-CG2 3.96Å; Y271-T280 HydrophobicContact CE2-CG2 3.73Å; Y271-T281 WeakPolarHBondContact CB-O 3.43Å; Y271-W282 HydrophobicContact CD1-CH2 4.18Å; Y271-W282 HydrophobicContact CD1-CZ3 4.15Å; Y271-W282 HydrophobicContact CG-CZ3 4.42Å
272	Y	86.3	Confident	75.4	Confident	30 Å²	30	84.7 Å²	84.7	12%	0.118	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	132.3	-177.1	-55.4	-90.4	0	0	0	109.9	E260 V261 T280 T281 D283 N284	E260-Y272 CarbonylContact O-C 3.59Å; E260-Y272 WeakPolarHBondContact O-CA 3.37Å; V261-Y272 HydrophobicContact CG1-CE1 4.29Å; V261-Y272 HydrophobicContact CG2-CD1 3.86Å; V261-Y272 HydrophobicContact CG2-CE1 3.7Å; Y272-T280 CarbonylContact O-C 3.55Å; Y272-T280 VanDerWaalsContact O-CA 3.31Å; Y272-T280 WeakPolarHBondContact O-CA 3.41Å; Y272-T281 PolarHBondContact N-O 2.7Å; Y272-T281 PolarHBondContact O-N 2.63Å; Y272-D283 WeakPolarHBondContact CD2-O 3.41Å; Y272-N284 VanDerWaalsContact CE2-CA 3.44Å; Y272-N284 HydrophobicContact CE2-CB 3.78Å; Y272-N284 PolarHBondContact OH-ND2 2.93Å
273	Y	77.1	Confident	74.9	Confident	70 Å²	70	87.5 Å²	87.5	28%	0.275	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	134	-180	175.6	-116.7	0	0	0	111	E260 P275 S279 T280	E260-Y273 PolarHBondContact N-O 2.9Å; E260-Y273 PolarHBondContact O-N 3.19Å; Y273-P275 HydrophobicContact CE1-CB 3.96Å; Y273-P275 WeakPolarHBondContact O-CD 3.43Å; Y273-S279 WeakPolarHBondContact CA-O 3.19Å; Y273-S279 WeakPolarHBondContact CD2-O 3.35Å; Y273-T280 HydrophobicContact CD2-CG2 3.62Å; Y273-T280 HydrophobicContact CE2-CG2 4.44Å; Y273-T280 HydrophobicContact CG-CG2 4.39Å
274	H	82.8	Confident	74.3	Confident	32 Å²	32	87.3 Å²	87.3	15%	0.148	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	101.8	178	-164.9	-81.7	0	0	0	110.6	G258 W259 D276 T277 G278 S279	G258-H274 VanDerWaalsContact C-CD2 3.45Å; G258-H274 WeakPolarHBondContact CA-NE2 3.24Å; W259-H274 AromaticContact CD1-CD2 3.89Å; W259-H274 HydrophobicContact CD2-CB 3.88Å; W259-H274 AromaticContact CD2-CD2 3.88Å; W259-H274 AromaticContact CE2-CD2 3.72Å; W259-H274 HydrophobicContact CE3-CB 3.67Å; W259-H274 AromaticContact CG-CD2 3.97Å; W259-H274 HydrophobicContact CH2-CB 3.92Å; W259-H274 HydrophobicContact CZ2-CB 4.11Å; W259-H274 HydrophobicContact CZ3-CB 3.69Å; W259-H274 AromaticContact NE1-CD2 3.72Å; H274-D276 VanDerWaalsContact C-N 3.31Å; H274-D276 PolarHBondContact O-N 2.84Å; H274-T277 WeakPolarHBondContact CB-OG1 3.42Å; H274-T277 PolarHBondContact ND1-OG1 3.28Å; H274-T277 PolarHBondContact O-N 2.82Å; H274-T277 VanDerWaalsContact O-N 3.14Å; H274-T277 PolarHBondContact O-OG1 2.85Å; H274-G278 PolarHBondContact O-N 3.49Å; H274-S279 PolarHBondContact N-O 2.98Å
275	P	69.2	Low	73.4	Confident	57 Å²	57	87.4 Å²	87.4	37%	0.37	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-30.4	-168.6	23.1	-33.4	0	0	0	114.3	G258 E260 Y273 T277	G258-P275 WeakPolarHBondContact O-CD 3.38Å; E260-P275 HydrophobicContact CG-CG 4.4Å; Y273-P275 HydrophobicContact CE1-CB 3.96Å; Y273-P275 WeakPolarHBondContact O-CD 3.43Å; P275-T277 VanDerWaalsContact C-N 3.3Å; P275-T277 PolarHBondContact O-N 2.85Å
276	D	70.4	Confident	73.2	Confident	145 Å²	145	83.4 Å²	83.4	78%	0.775	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-15.2	-179.9	-60	-45.9	0	0	0	113.8	H274	H274-D276 VanDerWaalsContact C-N 3.31Å; H274-D276 PolarHBondContact O-N 2.84Å
277	T	76.9	Confident	72.3	Confident	87 Å²	87	81.1 Å²	81.1	53%	0.534	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.6	-5.2	-177.5	59.6	0	0	0	0	113.5	H274 P275 S279	H274-T277 WeakPolarHBondContact CB-OG1 3.42Å; H274-T277 PolarHBondContact ND1-OG1 3.28Å; H274-T277 PolarHBondContact O-N 2.82Å; H274-T277 VanDerWaalsContact O-N 3.14Å; H274-T277 PolarHBondContact O-OG1 2.85Å; P275-T277 VanDerWaalsContact C-N 3.3Å; P275-T277 PolarHBondContact O-N 2.85Å; T277-S279 PolarHBondContact O-N 2.6Å; T277-S279 PolarHBondContact O-OG 3.06Å; T277-S279 PolarHBondContact OG1-OG 2.84Å
278	G	72.8	Confident	70.5	Confident	47 Å²	47	85.8 Å²	85.8	49%	0.485	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.9	14.5	-177.7	0	0	0	0	0	114.4	H274	H274-G278 PolarHBondContact O-N 3.49Å
279	S	68	Low	68.5	Low	54 Å²	54	88 Å²	88	38%	0.378	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	133.4	-172.6	-60	0	0	0	0	111.6	Y273 H274 T277	Y273-S279 WeakPolarHBondContact CA-O 3.19Å; Y273-S279 WeakPolarHBondContact CD2-O 3.35Å; H274-S279 PolarHBondContact N-O 2.98Å; T277-S279 PolarHBondContact O-N 2.6Å; T277-S279 PolarHBondContact O-OG 3.06Å; T277-S279 PolarHBondContact OG1-OG 2.84Å
280	T	84.3	Confident	67.4	Low	88 Å²	88	88.9 Å²	88.9	54%	0.54	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	144.9	169.9	47.7	0	0	0	0	111.2	Y271 Y272 Y273	Y271-T280 HydrophobicContact CD2-CG2 3.96Å; Y271-T280 HydrophobicContact CE2-CG2 3.73Å; Y272-T280 CarbonylContact O-C 3.55Å; Y272-T280 VanDerWaalsContact O-CA 3.31Å; Y272-T280 WeakPolarHBondContact O-CA 3.41Å; Y273-T280 HydrophobicContact CD2-CG2 3.62Å; Y273-T280 HydrophobicContact CE2-CG2 4.44Å; Y273-T280 HydrophobicContact CG-CG2 4.39Å
281	T	75.8	Confident	65.2	Low	39 Å²	39	90 Å²	90	24%	0.239	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	150.2	170.7	-178.8	0	0	0	0	110.3	W259 Y271 Y272 D283	W259-T281 HydrophobicContact CE3-CG2 4.28Å; W259-T281 HydrophobicContact CH2-CG2 4.09Å; W259-T281 HydrophobicContact CZ3-CG2 3.73Å; Y271-T281 WeakPolarHBondContact CB-O 3.43Å; Y272-T281 PolarHBondContact N-O 2.7Å; Y272-T281 PolarHBondContact O-N 2.63Å; T281-D283 VanDerWaalsContact CG2-O 3.32Å; T281-D283 WeakPolarHBondContact CG2-O 3.36Å; T281-D283 PolarHBondContact OG1-N 2.69Å
282	W	78.6	Confident	62.7	Low	125 Å²	125	94.9 Å²	94.9	47%	0.473	54%	0.535	S	S	.	.	S	Bend	trans	-91.5	-15.3	174.6	-62.2	90.6	0	0	0	112.4	D264 Q269 Y271	D264-W282 HydrophobicContact CB-CH2 3.72Å; D264-W282 HydrophobicContact CB-CZ3 4.24Å; Q269-W282 HydrophobicContact CB-CE3 4.49Å; Q269-W282 HydrophobicContact CB-CZ3 3.95Å; Q269-W282 HydrophobicContact CG-CE3 4.11Å; Q269-W282 HydrophobicContact CG-CZ3 4.08Å; Y271-W282 HydrophobicContact CD1-CH2 4.18Å; Y271-W282 HydrophobicContact CD1-CZ3 4.15Å; Y271-W282 HydrophobicContact CG-CZ3 4.42Å
283	D	68	Low	60.5	Low	126 Å²	126	99 Å²	99	67%	0.674	57%	0.565	S	S	*	*	S	Bend	trans	-93.4	139.3	179.7	-62.4	-64.9	0	0	0	111.6	Y272 T281 P285	Y272-D283 WeakPolarHBondContact CD2-O 3.41Å; T281-D283 VanDerWaalsContact CG2-O 3.32Å; T281-D283 WeakPolarHBondContact CG2-O 3.36Å; T281-D283 PolarHBondContact OG1-N 2.69Å; D283-P285 WeakPolarHBondContact O-CD 3.37Å
284	N	71.1	Confident	58.3	Low	78 Å²	78	103.8 Å²	103.8	42%	0.417	59%	0.59	S	S	.	*			trans	-71.2	117	-177.2	-177.9	-16.4	0	0	0	111.4	Y272 F286	Y272-N284 VanDerWaalsContact CE2-CA 3.44Å; Y272-N284 HydrophobicContact CE2-CB 3.78Å; Y272-N284 PolarHBondContact OH-ND2 2.93Å; N284-F286 PolarHBondContact O-N 2.99Å; N284-F286 VanDerWaalsContact OD1-CD2 3.25Å; N284-F286 WeakPolarHBondContact OD1-CD2 3.34Å; N284-F286 PolarHBondContact OD1-N 3.24Å; N284-F286 VanDerWaalsContact OD1-N 3.11Å
285	P	60.5	Low	56.2	Low	54 Å²	54	107.8 Å²	107.8	35%	0.351	62%	0.619	S	S	.	*	S	Bend	trans	-77.2	0.1	-172.7	31.9	-36.2	0	0	0	114.8	W259 D283	W259-P285 HydrophobicContact CB-CG 4.33Å; W259-P285 HydrophobicContact CD2-CG 3.93Å; W259-P285 HydrophobicContact CG-CG 3.75Å; D283-P285 WeakPolarHBondContact O-CD 3.37Å
286	F	64	Low	54.4	Low	109 Å²	109	112.9 Å²	112.9	48%	0.478	64%	0.642	S	S	.	*			trans	-99.9	34.9	-170.3	-55.9	-61	0	0	0	114.9	W259 N284	W259-F286 HydrophobicContact CB-CE2 4.49Å; W259-F286 HydrophobicContact CB-CZ 3.98Å; W259-F286 HydrophobicContact CG-CZ 4.42Å; N284-F286 PolarHBondContact O-N 2.99Å; N284-F286 VanDerWaalsContact OD1-CD2 3.25Å; N284-F286 WeakPolarHBondContact OD1-CD2 3.34Å; N284-F286 PolarHBondContact OD1-N 3.24Å; N284-F286 VanDerWaalsContact OD1-N 3.11Å
287	L	41.5	Very low	53	Low	149 Å²	149	111.2 Å²	111.2	78%	0.78	64%	0.639	S	S	*	*			trans	-122.7	93.4	178.3	-77.1	172.5	0	0	0	112.4
288	D	34.5	Very low	51.4	Low	167 Å²	167	113.2 Å²	113.2	89%	0.893	65%	0.654	S	S	*	*			trans	-70.1	144.5	175.8	-82.5	-46.9	0	0	0	113.6
289	S	30	Very low	49.8	Very low	106 Å²	106	119.4 Å²	119.4	74%	0.741	67%	0.67	S	S	*	*			trans	-123.3	119.4	167.8	-69.1	0	0	0	0	110	T291	S289-T291 PolarHBondContact O-N 2.95Å
290	P	42.8	Very low	48.1	Very low	135 Å²	135	122.7 Å²	122.7	88%	0.877	69%	0.687	S	S	*	*			trans	-76	116.8	-176.3	29.1	-33.4	0	0	0	111.9
291	T	32.8	Very low	46.1	Very low	138 Å²	138	124 Å²	124	85%	0.847	70%	0.697	S	S	*	*			trans	-100.5	135.6	159.6	-57.6	0	0	0	0	108	S289	S289-T291 PolarHBondContact O-N 2.95Å
292	D	29.4	Very low	44.1	Very low	157 Å²	157	131.9 Å²	131.9	84%	0.84	73%	0.729	S	S	*	*			trans	-122.7	144.3	-178.5	-140.2	12.5	0	0	0	110.1
293	P	40.7	Very low	42.2	Very low	116 Å²	116	131.5 Å²	131.5	75%	0.753	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-98.3	161.4	-160.2	37.5	-36.1	0	0	0	116.4
294	E	30.6	Very low	40.8	Very low	171 Å²	171	131.2 Å²	131.2	80%	0.799	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-92.6	143.6	179	-179.7	-179.7	-158	0	0	113.7
295	P	39.3	Very low	39.3	Very low	115 Å²	115	133.2 Å²	133.2	75%	0.747	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-103.1	138.4	166.5	36.2	-29.5	0	0	0	114.1
296	L	31.4	Very low	38.1	Very low	164 Å²	164	136 Å²	136	86%	0.859	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-80.9	150.9	-170.5	-62.9	167.8	0	0	0	116.3
297	P	40.5	Very low	36.7	Very low	110 Å²	110	136.9 Å²	136.9	71%	0.714	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-99.5	167.7	162.5	38.6	-33	0	0	0	113.7
298	P	43.4	Very low	36.2	Very low	130 Å²	130	138.9 Å²	138.9	84%	0.844	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-90.6	161.2	-177	35.4	-36	0	0	0	116.3
299	E	38	Very low	35.8	Very low	177 Å²	177	135.8 Å²	135.8	83%	0.827	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-70.3	171.9	178.8	-51.1	176.5	100.7	0	0	114.1
300	V	33.5	Very low	35.7	Very low	122 Å²	122	137.3 Å²	137.3	74%	0.739	80%	0.798	S	S	*	*			cis	-158.7	-176.9	11.1	-125.1	0	0	0	0	107.4
301	P	42.9	Very low	35	Very low	116 Å²	116	143.2 Å²	143.2	75%	0.753	80%	0.804	S	S	*	*			cis	-133.3	175.1	-10.5	37	-17.4	0	0	0	116.7
302	F	32	Very low	34.9	Very low	205 Å²	205	141 Å²	141	90%	0.899	80%	0.799	S	S	*	*			trans	-87.8	155.9	168.4	-73	-88.8	0	0	0	112.7
303	P	39.2	Very low	35.1	Very low	117 Å²	117	137.4 Å²	137.4	76%	0.76	79%	0.786	S	S	*	*				-157.9	-168.4	79.4	42.4	-21.4	0	0	0	116.1
304	P	39	Very low	34.8	Very low	119 Å²	119	139.1 Å²	139.1	77%	0.773	79%	0.789	S	S	*	*			cis	-118.6	-132.4	-44	33.1	-10.9	0	0	0	111.9
305	P	39.9	Very low	35.4	Very low	120 Å²	120	136.9 Å²	136.9	78%	0.779	77%	0.773	S	S	*	*				-116.2	-179.9	-128	33.5	-10.6	0	0	0	117.8
306	S	34.6	Very low	35.4	Very low	112 Å²	112	138.2 Å²	138.2	78%	0.783	77%	0.77	S	S	*	*			trans	-60.1	167.7	-168.3	-34.9	0	0	0	0	118.2
307	P	34	Very low	35.6	Very low	128 Å²	128	139.1 Å²	139.1	83%	0.831	77%	0.77	S	S	*	*				-133.7	165.8	99.5	39.4	-32	0	0	0	115.6
308	Q	30.8	Very low	35.6	Very low	192 Å²	192	138.3 Å²	138.3	90%	0.897	76%	0.758	S	S	*	*			trans	-80.7	150.2	171.1	-66.2	161.4	-101.4	0	0	112.1
309	S	27.5	Very low	35.6	Very low	102 Å²	102	134.5 Å²	134.5	71%	0.713	73%	0.733	S	S	*	*			trans	167.9	142.9	156	169.6	0	0	0	0	109.5
310	D	26.9	Very low	35.7	Very low	137 Å²	137	131 Å²	131	73%	0.733	72%	0.72	S	S	*	*			cis	-160.6	125	-25.7	-83.1	-46.5	0	0	0	107.2
311	W	28.8	Very low	36.3	Very low	260 Å²	260	132.2 Å²	132.2	99%	0.985	72%	0.718	S	S	*	*			trans	-177.3	41.5	152.2	62.1	-80.2	0	0	0	113.6
312	A	30.7	Very low	36.3	Very low	91 Å²	91	132.3 Å²	132.3	75%	0.752	72%	0.716	S	S	*	*			trans	-117.2	153.5	164.8	0	0	0	0	0	109.6
313	S	33.1	Very low	37.2	Very low	81 Å²	81	127.3 Å²	127.3	57%	0.566	70%	0.703	S	S	*	*			trans	60.9	101.4	175.9	-50.4	0	0	0	0	117	E316	S313-E316 PolarHBondContact OG-OE2 3.47Å
314	D	34.9	Very low	37.9	Very low	153 Å²	153	125.1 Å²	125.1	82%	0.818	70%	0.701	S	S	*	*	S	Bend	trans	-134.1	-11.2	154.4	-149.1	20.2	0	0	0	112.3
315	W	42.2	Very low	38.4	Very low	124 Å²	124	123.4 Å²	123.4	47%	0.47	69%	0.692	S	S	.	*	S	Bend	trans	-101	-18.4	178.6	-73.4	122.6	0	0	0	114.9	P327 E377	W315-P327 HydrophobicContact CZ3-CB 4.42Å; W315-E377 HydrophobicContact CZ2-CG 4.25Å; W315-E377 PolarHBondContact NE1-OE1 3.09Å
316	E	40.8	Very low	39.3	Very low	142 Å²	142	120 Å²	120	66%	0.664	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	-15.5	-173.6	-68.7	173.8	117.3	0	0	114.7	S313	S313-E316 PolarHBondContact OG-OE2 3.47Å
317	Q	35.5	Very low	40.6	Very low	184 Å²	184	115.7 Å²	115.7	86%	0.86	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	4.4	179.7	-72.8	-167.3	-5.3	0	0	114.6
318	L	39.8	Very low	41.7	Very low	92 Å²	92	114.2 Å²	114.2	48%	0.482	63%	0.629	S	S	.	*	S	Bend	trans	-109.9	12.8	-171.7	-98.5	164.3	0	0	0	115.4
319	V	43.9	Very low	43.3	Very low	51 Å²	51	106.9 Å²	106.9	31%	0.309	60%	0.604	S	S	.	*			trans	-129.1	43.5	178.2	-68.1	0	0	0	0	113.4
320	D	38.8	Very low	45.6	Very low	103 Å²	103	102.9 Å²	102.9	55%	0.551	57%	0.574	S	S	*	*			trans	-73	132.4	168.8	-172.4	-41.7	0	0	0	110.7	T322	D320-T322 PolarHBondContact O-N 2.83Å; D320-T322 PolarHBondContact OD1-N 3.32Å; D320-T322 VanDerWaalsContact OD1-N 3.11Å; D320-T322 PolarHBondContact OD1-OG1 2.96Å
321	E	46.7	Very low	48	Very low	148 Å²	148	99.9 Å²	99.9	69%	0.692	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	-8.5	-172.4	-64.8	-166.4	111.8	0	0	114.9	W340	E321-W340 HydrophobicContact CB-CH2 4.34Å; E321-W340 HydrophobicContact CB-CZ2 4.49Å; E321-W340 HydrophobicContact CG-CH2 3.98Å; E321-W340 HydrophobicContact CG-CZ2 3.98Å
322	T	43	Very low	50.4	Low	117 Å²	117	89.8 Å²	89.8	72%	0.718	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	-9	-169.4	59	0	0	0	0	116	D320	D320-T322 PolarHBondContact O-N 2.83Å; D320-T322 PolarHBondContact OD1-N 3.32Å; D320-T322 VanDerWaalsContact OD1-N 3.11Å; D320-T322 PolarHBondContact OD1-OG1 2.96Å
323	T	51.5	Low	52.7	Low	101 Å²	101	89.2 Å²	89.2	62%	0.62	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.6	-4.7	-173	59	0	0	0	0	116.3	S325	T323-S325 PolarHBondContact O-N 2.79Å; T323-S325 PolarHBondContact O-OG 2.98Å
324	G	53.2	Low	54.9	Low	71 Å²	71	89.1 Å²	89.1	73%	0.732	51%	0.506	S	S	*	.			trans	57.7	21.9	164	0	0	0	0	0	116.6
325	S	49.7	Very low	56.9	Low	83 Å²	83	85 Å²	85	58%	0.58	48%	0.482	S	S	*	.			trans	-101	135.9	-177.7	-62.8	0	0	0	0	110.5	T323	T323-S325 PolarHBondContact O-N 2.79Å; T323-S325 PolarHBondContact O-OG 2.98Å
326	T	58.4	Low	58.1	Low	49 Å²	49	86 Å²	86	30%	0.301	50%	0.504	S	S	.	.			trans	-104.3	157.6	-175.4	46.6	0	0	0	0	113.7	W330 L332 F342	T326-W330 WeakPolarHBondContact CB-O 3.13Å; T326-W330 PolarHBondContact OG1-O 2.96Å; T326-L332 HydrophobicContact CG2-CB 3.33Å; T326-L332 HydrophobicContact CG2-CD2 4.47Å; T326-F342 HydrophobicContact CG2-CE1 4.43Å
327	P	62.5	Low	59.5	Low	21 Å²	21	83.3 Å²	83.3	14%	0.136	50%	0.501	C	S	.	.			trans	-56.4	143.5	170.4	-25.5	35.2	0	0	0	112.4	W315 G329 W330	W315-P327 HydrophobicContact CZ3-CB 4.42Å; P327-G329 PolarHBondContact O-N 3.37Å; P327-W330 PolarHBondContact O-N 3.34Å
328	P	56.9	Low	61.2	Low	97 Å²	97	76.8 Å²	76.8	63%	0.63	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	120.3	-176.6	-27.3	35.5	0	0	0	113.6
329	G	65	Low	62.9	Low	37 Å²	37	74.6 Å²	74.6	38%	0.381	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.6	-0.7	-177.7	0	0	0	0	0	115.1	P327 S344	P327-G329 PolarHBondContact O-N 3.37Å; G329-S344 WeakPolarHBondContact O-CB 3.47Å; G329-S344 PolarHBondContact O-OG 3.28Å
330	W	74.5	Confident	64.7	Low	19 Å²	19	75 Å²	75	7%	0.072	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	140.9	175.1	-68.4	97.9	0	0	0	112	T326 P327 F342 T343 W351 L375 P376	T326-W330 WeakPolarHBondContact CB-O 3.13Å; T326-W330 PolarHBondContact OG1-O 2.96Å; P327-W330 PolarHBondContact O-N 3.34Å; W330-F342 HydrophobicContact CE3-CB 4.13Å; W330-T343 CarbonylContact C-O 3.55Å; W330-T343 WeakPolarHBondContact CA-O 3.35Å; W330-W351 AromaticContact CH2-CD1 3.57Å; W330-W351 HydrophobicContact CH2-CG 4.42Å; W330-W351 AromaticContact CH2-NE1 3.75Å; W330-W351 AromaticContact CZ3-CD1 3.66Å; W330-W351 HydrophobicContact CZ3-CG 4.46Å; W330-L375 HydrophobicContact CH2-CD2 4.36Å; W330-L375 HydrophobicContact CZ2-CD2 4.47Å; W330-L375 HydrophobicContact CZ3-CD2 4.39Å; W330-P376 HydrophobicContact CZ2-CB 4.27Å; W330-P376 HydrophobicContact CZ2-CG 4.36Å; W330-P376 PolarHBondContact NE1-O 2.9Å
331	N	77.3	Confident	66.8	Low	74 Å²	74	70.3 Å²	70.3	40%	0.396	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	125.7	175.2	-71.9	-42.5	0	0	0	109.1	F342 T343	N331-F342 WeakPolarHBondContact O-CA 3.32Å; N331-T343 PolarHBondContact N-O 3.35Å; N331-T343 PolarHBondContact O-N 3.3Å; N331-T343 PolarHBondContact O-OG1 3.02Å; N331-T343 VanDerWaalsContact O-OG1 3.12Å
332	L	80.7	Confident	68.5	Low	48 Å²	48	63.4 Å²	63.4	25%	0.251	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	131.2	177.9	170	62.1	0	0	0	110	T326 V334 W340 V341 F342	T326-L332 HydrophobicContact CG2-CB 3.33Å; T326-L332 HydrophobicContact CG2-CD2 4.47Å; L332-V334 HydrophobicContact CD1-CG2 4.38Å; L332-V334 HydrophobicContact CG-CG2 4.46Å; L332-W340 HydrophobicContact CD1-CB 4.07Å; L332-W340 HydrophobicContact CD1-CD2 4.49Å; L332-W340 HydrophobicContact CD1-CE3 3.98Å; L332-W340 HydrophobicContact CD2-CE3 3.55Å; L332-W340 HydrophobicContact CD2-CZ3 3.67Å; L332-W340 HydrophobicContact CG-CE3 4.42Å; L332-V341 WeakPolarHBondContact CA-O 2.98Å; L332-F342 HydrophobicContact CB-CD1 4.25Å; L332-F342 HydrophobicContact CB-CE1 4.14Å; L332-F342 HydrophobicContact CD1-CD1 4.37Å; L332-F342 HydrophobicContact CD1-CD2 4.14Å; L332-F342 HydrophobicContact CD1-CE1 4.11Å; L332-F342 HydrophobicContact CD1-CE2 3.84Å; L332-F342 HydrophobicContact CD1-CG 4.39Å; L332-F342 HydrophobicContact CD1-CZ 3.84Å; L332-F342 HydrophobicContact CD2-CE1 4.35Å; L332-F342 HydrophobicContact CD2-CZ 4.25Å; L332-F342 HydrophobicContact CG-CE1 4.43Å; L332-F342 HydrophobicContact CG-CZ 4.47Å
333	T	77.9	Confident	70.2	Confident	79 Å²	79	59.5 Å²	59.5	49%	0.485	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	127.4	166.6	-56.6	0	0	0	0	108.1	V341	T333-V341 PolarHBondContact N-O 3.1Å; T333-V341 WeakPolarHBondContact O-CA 3.38Å; T333-V341 WeakPolarHBondContact O-CB 3.42Å; T333-V341 PolarHBondContact O-N 3.28Å
334	V	79.1	Confident	71.4	Confident	78 Å²	78	55.6 Å²	55.6	47%	0.473	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	122.5	169.2	-177.4	0	0	0	0	107.8	L332 T339 W340	L332-V334 HydrophobicContact CD1-CG2 4.38Å; L332-V334 HydrophobicContact CG-CG2 4.46Å; V334-T339 WeakPolarHBondContact CA-O 3.49Å; V334-W340 HydrophobicContact CG2-CD2 4.24Å; V334-W340 HydrophobicContact CG2-CG 4.27Å
335	E	78.2	Confident	72	Confident	67 Å²	67	60.2 Å²	60.2	31%	0.313	37%	0.368	S	S	.	.			trans	-82	161.9	-180	-80.6	-176.9	176.5	0	0	112.3	S337 G338 T339 V341 R366	E335-S337 PolarHBondContact O-N 3.49Å; E335-G338 PolarHBondContact O-N 2.96Å; E335-T339 PolarHBondContact N-O 3.29Å; E335-V341 HydrophobicContact CG-CG2 4.31Å; E335-R366 IonicContact OE1-CZ 2.65Å; E335-R366 IonicContact OE1-NH1 2.93Å; E335-R366 PolarHBondContact OE1-NH1 3.12Å; E335-R366 IonicContact OE1-NH2 3.78Å; E335-R366 PolarHBondContact OE1-NH2 2.86Å; E335-R366 VanDerWaalsContact OE1-NH2 3.09Å; E335-R366 IonicContact OE2-CZ 2.98Å; E335-R366 IonicContact OE2-NH1 2.62Å; E335-R366 IonicContact OE2-NH2 3.28Å; E335-R366 PolarHBondContact OE2-NH2 2.99Å
336	P	67.2	Low	72.3	Confident	145 Å²	145	61.4 Å²	61.4	94%	0.942	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-12.2	-177.9	-25.8	35.9	0	0	0	115.7	G338	P336-G338 VanDerWaalsContact C-N 3.3Å
337	S	69.5	Low	72.8	Confident	85 Å²	85	60.8 Å²	60.8	59%	0.594	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-6.9	170.5	51.8	0	0	0	0	114.3	E335 T339	E335-S337 PolarHBondContact O-N 3.49Å; S337-T339 VanDerWaalsContact C-N 3.32Å; S337-T339 WeakPolarHBondContact OG-CB 3.35Å; S337-T339 PolarHBondContact OG-N 2.94Å; S337-T339 PolarHBondContact OG-OG1 3.16Å
338	G	70.5	Confident	73	Confident	48 Å²	48	65.6 Å²	65.6	50%	0.495	40%	0.396	S	S	.	.	S	Bend	trans	82.5	4.5	-168.7	0	0	0	0	0	114.1	E335 P336 W340	E335-G338 PolarHBondContact O-N 2.96Å; P336-G338 VanDerWaalsContact C-N 3.3Å; G338-W340 VanDerWaalsContact O-CD1 3.31Å
339	T	76.6	Confident	74.1	Confident	46 Å²	46	64 Å²	64	28%	0.282	38%	0.382	S	S	.	.			trans	-78.7	131	-177.4	-49.4	0	0	0	0	111.6	V334 E335 S337 V341 I352	V334-T339 WeakPolarHBondContact CA-O 3.49Å; E335-T339 PolarHBondContact N-O 3.29Å; S337-T339 VanDerWaalsContact C-N 3.32Å; S337-T339 WeakPolarHBondContact OG-CB 3.35Å; S337-T339 PolarHBondContact OG-N 2.94Å; S337-T339 PolarHBondContact OG-OG1 3.16Å; T339-V341 HydrophobicContact CG2-CG2 4.43Å; T339-I352 HydrophobicContact CG2-CG2 3.55Å
340	W	81.9	Confident	75	Confident	60 Å²	60	65.9 Å²	65.9	23%	0.227	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	116.9	-178.8	-69.1	55.7	0	0	0	111	E321 L332 V334 G338 F342 I352 K353	E321-W340 HydrophobicContact CB-CH2 4.34Å; E321-W340 HydrophobicContact CB-CZ2 4.49Å; E321-W340 HydrophobicContact CG-CH2 3.98Å; E321-W340 HydrophobicContact CG-CZ2 3.98Å; L332-W340 HydrophobicContact CD1-CB 4.07Å; L332-W340 HydrophobicContact CD1-CD2 4.49Å; L332-W340 HydrophobicContact CD1-CE3 3.98Å; L332-W340 HydrophobicContact CD2-CE3 3.55Å; L332-W340 HydrophobicContact CD2-CZ3 3.67Å; L332-W340 HydrophobicContact CG-CE3 4.42Å; V334-W340 HydrophobicContact CG2-CD2 4.24Å; V334-W340 HydrophobicContact CG2-CG 4.27Å; G338-W340 VanDerWaalsContact O-CD1 3.31Å; W340-F342 HydrophobicContact CB-CE2 4.28Å; W340-F342 HydrophobicContact CE3-CZ 4.28Å; W340-I352 WeakPolarHBondContact O-CA 3.13Å; W340-K353 HydrophobicContact CB-CB 4.17Å; W340-K353 PolarHBondContact O-N 3.01Å; W340-K353 VanDerWaalsContact O-N 3.13Å
341	V	83.4	Confident	75.6	Confident	3 Å²	3	65.3 Å²	65.3	2%	0.018	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	117.9	-174.1	-167.2	0	0	0	0	111.1	L332 T333 E335 T339 T343 Q350 W351	L332-V341 WeakPolarHBondContact CA-O 2.98Å; T333-V341 PolarHBondContact N-O 3.1Å; T333-V341 WeakPolarHBondContact O-CA 3.38Å; T333-V341 WeakPolarHBondContact O-CB 3.42Å; T333-V341 PolarHBondContact O-N 3.28Å; E335-V341 HydrophobicContact CG-CG2 4.31Å; T339-V341 HydrophobicContact CG2-CG2 4.43Å; V341-T343 HydrophobicContact CG1-CG2 4.36Å; V341-Q350 HydrophobicContact CG1-CB 4Å; V341-W351 CarbonylContact C-O 3.51Å; V341-W351 WeakPolarHBondContact CA-O 3.46Å
342	F	82.3	Confident	76	Confident	4 Å²	4	62.4 Å²	62.4	2%	0.018	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	134.3	177.7	-63.8	-98.7	0	0	0	110.3	T326 W330 N331 L332 W340 W351 K353 Y363 L375	T326-F342 HydrophobicContact CG2-CE1 4.43Å; W330-F342 HydrophobicContact CE3-CB 4.13Å; N331-F342 WeakPolarHBondContact O-CA 3.32Å; L332-F342 HydrophobicContact CB-CD1 4.25Å; L332-F342 HydrophobicContact CB-CE1 4.14Å; L332-F342 HydrophobicContact CD1-CD1 4.37Å; L332-F342 HydrophobicContact CD1-CD2 4.14Å; L332-F342 HydrophobicContact CD1-CE1 4.11Å; L332-F342 HydrophobicContact CD1-CE2 3.84Å; L332-F342 HydrophobicContact CD1-CG 4.39Å; L332-F342 HydrophobicContact CD1-CZ 3.84Å; L332-F342 HydrophobicContact CD2-CE1 4.35Å; L332-F342 HydrophobicContact CD2-CZ 4.25Å; L332-F342 HydrophobicContact CG-CE1 4.43Å; L332-F342 HydrophobicContact CG-CZ 4.47Å; W340-F342 HydrophobicContact CB-CE2 4.28Å; W340-F342 HydrophobicContact CE3-CZ 4.28Å; F342-W351 HydrophobicContact CB-CB 4.32Å; F342-W351 PolarHBondContact N-O 2.81Å; F342-W351 PolarHBondContact O-N 2.83Å; F342-K353 HydrophobicContact CE2-CB 4.1Å; F342-Y363 HydrophobicContact CD2-CD1 4.29Å; F342-Y363 HydrophobicContact CD2-CE1 4.14Å; F342-Y363 HydrophobicContact CE2-CD1 4.42Å; F342-Y363 AromaticContact CE2-CE1 3.85Å; F342-Y363 HydrophobicContact CE2-CE1 3.85Å; F342-Y363 HydrophobicContact CZ-CE1 4.36Å; F342-L375 HydrophobicContact CB-CD1 4.07Å; F342-L375 HydrophobicContact CB-CD2 3.98Å; F342-L375 HydrophobicContact CD1-CD1 3.58Å; F342-L375 HydrophobicContact CD2-CD1 4.19Å; F342-L375 HydrophobicContact CE1-CD1 4.01Å; F342-L375 HydrophobicContact CG-CD1 3.68Å; F342-L375 HydrophobicContact CG-CD2 4.37Å; F342-L375 HydrophobicContact CZ-CD1 4.49Å
343	T	78.9	Confident	76.2	Confident	35 Å²	35	62.5 Å²	62.5	22%	0.215	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	153.8	-177.1	59.5	0	0	0	0	109.8	W330 N331 V341 Q350	W330-T343 CarbonylContact C-O 3.55Å; W330-T343 WeakPolarHBondContact CA-O 3.35Å; N331-T343 PolarHBondContact N-O 3.35Å; N331-T343 PolarHBondContact O-N 3.3Å; N331-T343 PolarHBondContact O-OG1 3.02Å; N331-T343 VanDerWaalsContact O-OG1 3.12Å; V341-T343 HydrophobicContact CG1-CG2 4.36Å; T343-Q350 HydrophobicContact CG2-CB 4.36Å; T343-Q350 HydrophobicContact CG2-CG 3.96Å
344	S	75.2	Confident	76.4	Confident	18 Å²	18	60.4 Å²	60.4	13%	0.126	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	152.2	174	-170.1	0	0	0	0	110.8	G329 N346	G329-S344 WeakPolarHBondContact O-CB 3.47Å; G329-S344 PolarHBondContact O-OG 3.28Å; S344-N346 PolarHBondContact O-N 3.04Å; S344-N346 PolarHBondContact OG-N 3.3Å
345	E	66.6	Low	76.5	Confident	168 Å²	168	60.4 Å²	60.4	79%	0.785	35%	0.351	S	S	*	.	S	Bend	trans	-70.4	-13.5	169.5	-60	-171.2	165.2	0	0	112.3
346	N	56.7	Low	76.5	Confident	108 Å²	108	59.1 Å²	59.1	58%	0.578	35%	0.346	S	S	*	.	S	Bend	trans	-102.6	-9.8	-174.2	-64.9	-66.1	0	0	0	114.8	S344 Y378	S344-N346 PolarHBondContact O-N 3.04Å; S344-N346 PolarHBondContact OG-N 3.3Å; N346-Y378 HydrophobicContact CB-CE2 4.35Å; N346-Y378 WeakPolarHBondContact ND2-CE2 3.47Å; N346-Y378 PolarHBondContact ND2-OH 3.15Å
347	S	67.7	Low	76.8	Confident	37 Å²	37	60.8 Å²	60.8	26%	0.259	35%	0.347	S	S	.	.			trans	-144.5	150.9	171.8	79.8	0	0	0	0	110.8	D349	S347-D349 WeakPolarHBondContact CB-OD2 3.15Å; S347-D349 PolarHBondContact O-N 2.91Å; S347-D349 VanDerWaalsContact O-N 3.15Å; S347-D349 VanDerWaalsContact OG-CG 3.28Å; S347-D349 PolarHBondContact OG-OD2 2.74Å
348	P	66.6	Low	76.4	Confident	121 Å²	121	64.3 Å²	64.3	79%	0.786	35%	0.354	S	S	*	.			trans	-76.2	5.6	-178	34.8	-37.1	0	0	0	113.3
349	D	80.1	Confident	76.2	Confident	63 Å²	63	64.6 Å²	64.6	34%	0.337	36%	0.357	S	S	.	.			trans	-81.3	135.2	-163.7	-44.7	-39.2	0	0	0	111	S347 L365	S347-D349 WeakPolarHBondContact CB-OD2 3.15Å; S347-D349 PolarHBondContact O-N 2.91Å; S347-D349 VanDerWaalsContact O-N 3.15Å; S347-D349 VanDerWaalsContact OG-CG 3.28Å; S347-D349 PolarHBondContact OG-OD2 2.74Å; D349-L365 HydrophobicContact CB-CD2 3.8Å
350	Q	85.1	Confident	75.6	Confident	77 Å²	77	67.4 Å²	67.4	36%	0.36	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	110.5	178.6	-54.5	-166.1	-1.3	0	0	109.2	V341 T343 L365 R366	V341-Q350 HydrophobicContact CG1-CB 4Å; T343-Q350 HydrophobicContact CG2-CB 4.36Å; T343-Q350 HydrophobicContact CG2-CG 3.96Å; Q350-L365 WeakPolarHBondContact O-CA 3.15Å; Q350-R366 HydrophobicContact CB-CB 4.01Å; Q350-R366 WeakPolarHBondContact O-CB 3.49Å; Q350-R366 PolarHBondContact O-N 3.48Å; Q350-R366 VanDerWaalsContact OE1-CD 3.23Å
351	W	85.4	Confident	75.5	Confident	7 Å²	7	66.9 Å²	66.9	3%	0.027	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	125.2	-177.9	-71.1	84.7	0	0	0	110.5	W330 V341 F342 Y364 L365 K370 E372 L375 P376	W330-W351 AromaticContact CH2-CD1 3.57Å; W330-W351 HydrophobicContact CH2-CG 4.42Å; W330-W351 AromaticContact CH2-NE1 3.75Å; W330-W351 AromaticContact CZ3-CD1 3.66Å; W330-W351 HydrophobicContact CZ3-CG 4.46Å; V341-W351 CarbonylContact C-O 3.51Å; V341-W351 WeakPolarHBondContact CA-O 3.46Å; F342-W351 HydrophobicContact CB-CB 4.32Å; F342-W351 PolarHBondContact N-O 2.81Å; F342-W351 PolarHBondContact O-N 2.83Å; W351-Y364 CarbonylContact C-O 3.48Å; W351-Y364 WeakPolarHBondContact CA-O 3.5Å; W351-L365 HydrophobicContact CD2-CD2 3.69Å; W351-L365 HydrophobicContact CD2-CG 4.25Å; W351-L365 HydrophobicContact CE3-CD2 4.33Å; W351-L365 HydrophobicContact CE3-CG 4.41Å; W351-L365 HydrophobicContact CG-CD2 3.98Å; W351-L365 HydrophobicContact CH2-CD2 4.43Å; W351-L365 HydrophobicContact CH2-CG 4.19Å; W351-L365 HydrophobicContact CZ2-CD2 3.79Å; W351-L365 HydrophobicContact CZ2-CG 3.99Å; W351-L365 HydrophobicContact CZ3-CG 4.39Å; W351-K370 HydrophobicContact CH2-CB 4.48Å; W351-K370 HydrophobicContact CH2-CD 3.87Å; W351-K370 HydrophobicContact CH2-CG 4.2Å; W351-K370 HydrophobicContact CZ2-CD 4.38Å; W351-E372 HydrophobicContact CH2-CB 4.38Å; W351-E372 HydrophobicContact CH2-CG 4.19Å; W351-E372 WeakPolarHBondContact CH2-OE2 3.28Å; W351-E372 HydrophobicContact CZ3-CB 4.21Å; W351-E372 HydrophobicContact CZ3-CG 4.44Å; W351-L375 HydrophobicContact CB-CD2 3.61Å; W351-L375 HydrophobicContact CD2-CD2 4.36Å; W351-L375 HydrophobicContact CG-CD2 3.87Å; W351-P376 HydrophobicContact CZ2-CG 4.02Å
352	I	85.8	Confident	75.3	Confident	13 Å²	13	69.7 Å²	69.7	7%	0.067	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	132	178.9	-59.4	176.6	0	0	0	108.8	T339 W340 Y363 Y364 R366	T339-I352 HydrophobicContact CG2-CG2 3.55Å; W340-I352 WeakPolarHBondContact O-CA 3.13Å; I352-Y363 CarbonylContact O-C 3.57Å; I352-Y363 VanDerWaalsContact O-CA 3.3Å; I352-Y363 WeakPolarHBondContact O-CA 3.45Å; I352-Y364 HydrophobicContact CB-CD1 4.11Å; I352-Y364 HydrophobicContact CB-CE1 3.63Å; I352-Y364 HydrophobicContact CB-CE2 4.45Å; I352-Y364 HydrophobicContact CD1-CE2 4.27Å; I352-Y364 HydrophobicContact CG2-CD1 4.43Å; I352-Y364 HydrophobicContact CG2-CE1 3.58Å; I352-Y364 PolarHBondContact N-O 3.34Å; I352-Y364 WeakPolarHBondContact O-CD1 3.5Å; I352-Y364 PolarHBondContact O-N 3.27Å; I352-R366 HydrophobicContact CD1-CB 3.99Å; I352-R366 HydrophobicContact CD1-CG 4.29Å; I352-R366 HydrophobicContact CG1-CB 4.32Å
353	K	85.2	Confident	75.4	Confident	50 Å²	50	70.3 Å²	70.3	22%	0.217	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	130.3	170.4	-170.5	-172.6	-176.5	-167.8	0	109.7	W340 F342 T361 Y363	W340-K353 HydrophobicContact CB-CB 4.17Å; W340-K353 PolarHBondContact O-N 3.01Å; W340-K353 VanDerWaalsContact O-N 3.13Å; F342-K353 HydrophobicContact CE2-CB 4.1Å; K353-T361 HydrophobicContact CD-CG2 4.18Å; K353-T361 VanDerWaalsContact CE-CG2 3.42Å; K353-T361 HydrophobicContact CG-CG2 3.72Å; K353-Y363 HydrophobicContact CB-CD1 3.94Å; K353-Y363 HydrophobicContact CB-CE1 3.7Å; K353-Y363 HydrophobicContact CD-CE1 4.22Å; K353-Y363 HydrophobicContact CG-CD1 4.21Å; K353-Y363 HydrophobicContact CG-CE1 3.65Å
354	S	83.4	Confident	75.7	Confident	36 Å²	36	72.2 Å²	72.2	25%	0.252	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	174.9	169.9	-161.2	0	0	0	0	110.2	T361 Y362	S354-T361 WeakPolarHBondContact O-CA 3.19Å; S354-Y362 PolarHBondContact N-O 3.03Å; S354-Y362 PolarHBondContact O-N 2.89Å; S354-Y362 VanDerWaalsContact O-O 3.09Å; S354-Y362 PolarHBondContact OG-OH 3.17Å
355	V	79.9	Confident	76.1	Confident	78 Å²	78	72.2 Å²	72.2	47%	0.473	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	143.7	171.2	-173.1	0	0	0	0	107.5	G359 Q360	V355-G359 VanDerWaalsContact CG1-CA 3.49Å; V355-G359 WeakPolarHBondContact CG1-O 3.43Å; V355-Q360 CarbonylContact C-O 3.55Å; V355-Q360 WeakPolarHBondContact CA-O 3.31Å
356	D	79.3	Confident	76.7	Confident	40 Å²	40	68.6 Å²	68.6	21%	0.214	37%	0.365	C	S	.	.			trans	-88.2	177.1	176	80.6	-10.7	0	0	0	112.9	Q358 G359 Q360 Y362 W373	D356-Q358 PolarHBondContact O-N 2.75Å; D356-Q358 VanDerWaalsContact O-N 3.09Å; D356-Q358 WeakPolarHBondContact OD1-CA 3.32Å; D356-Q358 WeakPolarHBondContact OD1-CB 3.4Å; D356-Q358 PolarHBondContact OD1-N 3.34Å; D356-G359 PolarHBondContact O-N 3.32Å; D356-G359 PolarHBondContact OD1-N 3.07Å; D356-Q360 PolarHBondContact N-O 3.5Å; D356-Q360 PolarHBondContact OD1-N 2.8Å; D356-Y362 HydrophobicContact CB-CD1 4.2Å; D356-Y362 HydrophobicContact CB-CE1 4.13Å; D356-W373 HydrophobicContact CB-CH2 4.48Å; D356-W373 WeakPolarHBondContact OD2-CH2 3.23Å
357	D	71.8	Confident	77.5	Confident	179 Å²	179	68.8 Å²	68.8	96%	0.957	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-7.9	-179.9	-53.7	-50.9	0	0	0	113.7
358	Q	62.8	Low	77.8	Confident	159 Å²	159	69.8 Å²	69.8	74%	0.743	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-0.1	174.2	-55.7	-169.6	17.1	0	0	112.8	D356	D356-Q358 PolarHBondContact O-N 2.75Å; D356-Q358 VanDerWaalsContact O-N 3.09Å; D356-Q358 WeakPolarHBondContact OD1-CA 3.32Å; D356-Q358 WeakPolarHBondContact OD1-CB 3.4Å; D356-Q358 PolarHBondContact OD1-N 3.34Å
359	G	65.8	Low	78.2	Confident	55 Å²	55	68.9 Å²	68.9	57%	0.567	38%	0.375	S	S	*	.	S	Bend	trans	84.7	7.6	-178.3	0	0	0	0	0	114.7	V355 D356	V355-G359 VanDerWaalsContact CG1-CA 3.49Å; V355-G359 WeakPolarHBondContact CG1-O 3.43Å; D356-G359 PolarHBondContact O-N 3.32Å; D356-G359 PolarHBondContact OD1-N 3.07Å
360	Q	64.3	Low	78.1	Confident	104 Å²	104	70.1 Å²	70.1	49%	0.486	38%	0.377	S	S	.	.			trans	-85.2	132.8	178	-66.2	-174.9	50.6	0	0	111.2	V355 D356 W373	V355-Q360 CarbonylContact C-O 3.55Å; V355-Q360 WeakPolarHBondContact CA-O 3.31Å; D356-Q360 PolarHBondContact N-O 3.5Å; D356-Q360 PolarHBondContact OD1-N 2.8Å; Q360-W373 HydrophobicContact CB-CE3 4.37Å; Q360-W373 HydrophobicContact CB-CZ3 3.78Å
361	T	78.8	Confident	78	Confident	49 Å²	49	70.2 Å²	70.2	30%	0.301	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	134	175.8	-70.9	0	0	0	0	110.6	K353 S354 Y363	K353-T361 HydrophobicContact CD-CG2 4.18Å; K353-T361 VanDerWaalsContact CE-CG2 3.42Å; K353-T361 HydrophobicContact CG-CG2 3.72Å; S354-T361 WeakPolarHBondContact O-CA 3.19Å; T361-Y363 HydrophobicContact CG2-CD2 4.41Å; T361-Y363 HydrophobicContact CG2-CE2 3.68Å
362	Y	80	Confident	77.8	Confident	63 Å²	63	73 Å²	73	25%	0.247	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	160.6	164.8	70.8	-86.3	0	0	0	111.2	S354 D356 Y364 W373	S354-Y362 PolarHBondContact N-O 3.03Å; S354-Y362 PolarHBondContact O-N 2.89Å; S354-Y362 VanDerWaalsContact O-O 3.09Å; S354-Y362 PolarHBondContact OG-OH 3.17Å; D356-Y362 HydrophobicContact CB-CD1 4.2Å; D356-Y362 HydrophobicContact CB-CE1 4.13Å; Y362-Y364 HydrophobicContact CD2-CD1 4.44Å; Y362-Y364 AromaticContact CE2-CD1 3.89Å; Y362-Y364 HydrophobicContact CE2-CD1 3.89Å; Y362-Y364 HydrophobicContact CE2-CG 4.31Å; Y362-W373 HydrophobicContact CD1-CZ3 4.36Å
363	Y	84.4	Confident	77.6	Confident	17 Å²	17	79.1 Å²	79.1	7%	0.067	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	138.4	178.4	-58.3	-93.3	0	0	0	109.2	F342 I352 K353 T361 S371 E372 L375	F342-Y363 HydrophobicContact CD2-CD1 4.29Å; F342-Y363 HydrophobicContact CD2-CE1 4.14Å; F342-Y363 HydrophobicContact CE2-CD1 4.42Å; F342-Y363 AromaticContact CE2-CE1 3.85Å; F342-Y363 HydrophobicContact CE2-CE1 3.85Å; F342-Y363 HydrophobicContact CZ-CE1 4.36Å; I352-Y363 CarbonylContact O-C 3.57Å; I352-Y363 VanDerWaalsContact O-CA 3.3Å; I352-Y363 WeakPolarHBondContact O-CA 3.45Å; K353-Y363 HydrophobicContact CB-CD1 3.94Å; K353-Y363 HydrophobicContact CB-CE1 3.7Å; K353-Y363 HydrophobicContact CD-CE1 4.22Å; K353-Y363 HydrophobicContact CG-CD1 4.21Å; K353-Y363 HydrophobicContact CG-CE1 3.65Å; T361-Y363 HydrophobicContact CG2-CD2 4.41Å; T361-Y363 HydrophobicContact CG2-CE2 3.68Å; Y363-S371 CarbonylContact O-C 3.59Å; Y363-S371 WeakPolarHBondContact O-CA 3.21Å; Y363-E372 PolarHBondContact N-O 2.8Å; Y363-E372 PolarHBondContact O-N 2.88Å; Y363-L375 HydrophobicContact CD1-CD1 4.05Å; Y363-L375 HydrophobicContact CD1-CD2 3.94Å; Y363-L375 HydrophobicContact CD1-CG 3.71Å; Y363-L375 HydrophobicContact CD2-CG 4.18Å; Y363-L375 HydrophobicContact CE1-CD1 3.85Å; Y363-L375 HydrophobicContact CE1-CG 3.95Å; Y363-L375 HydrophobicContact CE2-CG 4.41Å; Y363-L375 HydrophobicContact CG-CD2 4.11Å; Y363-L375 HydrophobicContact CG-CG 3.83Å
364	Y	84.4	Confident	77.1	Confident	74 Å²	74	81.7 Å²	81.7	29%	0.29	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	147.6	178.6	72.4	-77.1	0	0	0	111.9	W351 I352 Y362 K370	W351-Y364 CarbonylContact C-O 3.48Å; W351-Y364 WeakPolarHBondContact CA-O 3.5Å; I352-Y364 HydrophobicContact CB-CD1 4.11Å; I352-Y364 HydrophobicContact CB-CE1 3.63Å; I352-Y364 HydrophobicContact CB-CE2 4.45Å; I352-Y364 HydrophobicContact CD1-CE2 4.27Å; I352-Y364 HydrophobicContact CG2-CD1 4.43Å; I352-Y364 HydrophobicContact CG2-CE1 3.58Å; I352-Y364 PolarHBondContact N-O 3.34Å; I352-Y364 WeakPolarHBondContact O-CD1 3.5Å; I352-Y364 PolarHBondContact O-N 3.27Å; Y362-Y364 HydrophobicContact CD2-CD1 4.44Å; Y362-Y364 AromaticContact CE2-CD1 3.89Å; Y362-Y364 HydrophobicContact CE2-CD1 3.89Å; Y362-Y364 HydrophobicContact CE2-CG 4.31Å; Y364-K370 CarbonylContact C-O 3.57Å; Y364-K370 VanDerWaalsContact CA-O 3.28Å; Y364-K370 WeakPolarHBondContact CA-O 3.35Å; Y364-K370 WeakPolarHBondContact CB-O 3.14Å
365	L	84.5	Confident	76.7	Confident	18 Å²	18	81.1 Å²	81.1	9%	0.094	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	139.4	175.3	-71.1	177.9	0	0	0	110.2	D349 Q350 W351 D367 G368 T369 K370	D349-L365 HydrophobicContact CB-CD2 3.8Å; Q350-L365 WeakPolarHBondContact O-CA 3.15Å; W351-L365 HydrophobicContact CD2-CD2 3.69Å; W351-L365 HydrophobicContact CD2-CG 4.25Å; W351-L365 HydrophobicContact CE3-CD2 4.33Å; W351-L365 HydrophobicContact CE3-CG 4.41Å; W351-L365 HydrophobicContact CG-CD2 3.98Å; W351-L365 HydrophobicContact CH2-CD2 4.43Å; W351-L365 HydrophobicContact CH2-CG 4.19Å; W351-L365 HydrophobicContact CZ2-CD2 3.79Å; W351-L365 HydrophobicContact CZ2-CG 3.99Å; W351-L365 HydrophobicContact CZ3-CG 4.39Å; L365-D367 VanDerWaalsContact CB-OD1 3.23Å; L365-D367 WeakPolarHBondContact CB-OD1 3.37Å; L365-D367 PolarHBondContact O-N 2.76Å; L365-G368 WeakPolarHBondContact O-CA 3.29Å; L365-G368 PolarHBondContact O-N 2.69Å; L365-T369 WeakPolarHBondContact CD1-OG1 3.31Å; L365-K370 HydrophobicContact CD1-CB 3.71Å; L365-K370 HydrophobicContact CG-CB 4.1Å; L365-K370 PolarHBondContact N-O 2.83Å
366	R	78.9	Confident	76.2	Confident	93 Å²	93	79.8 Å²	79.8	35%	0.351	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-20.7	178.8	170.5	163.5	-79.7	-157.1	-27.1	114.6	E335 Q350 I352	E335-R366 IonicContact OE1-CZ 2.65Å; E335-R366 IonicContact OE1-NH1 2.93Å; E335-R366 PolarHBondContact OE1-NH1 3.12Å; E335-R366 IonicContact OE1-NH2 3.78Å; E335-R366 PolarHBondContact OE1-NH2 2.86Å; E335-R366 VanDerWaalsContact OE1-NH2 3.09Å; E335-R366 IonicContact OE2-CZ 2.98Å; E335-R366 IonicContact OE2-NH1 2.62Å; E335-R366 IonicContact OE2-NH2 3.28Å; E335-R366 PolarHBondContact OE2-NH2 2.99Å; Q350-R366 HydrophobicContact CB-CB 4.01Å; Q350-R366 WeakPolarHBondContact O-CB 3.49Å; Q350-R366 PolarHBondContact O-N 3.48Å; Q350-R366 VanDerWaalsContact OE1-CD 3.23Å; I352-R366 HydrophobicContact CD1-CB 3.99Å; I352-R366 HydrophobicContact CD1-CG 4.29Å; I352-R366 HydrophobicContact CG1-CB 4.32Å
367	D	74	Confident	75	Confident	112 Å²	112	84 Å²	84	60%	0.599	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-1.1	174	62.2	14.1	0	0	0	113.9	L365 T369	L365-D367 VanDerWaalsContact CB-OD1 3.23Å; L365-D367 WeakPolarHBondContact CB-OD1 3.37Å; L365-D367 PolarHBondContact O-N 2.76Å; D367-T369 VanDerWaalsContact C-N 3.26Å; D367-T369 HydrophobicContact CB-CG2 4.25Å; D367-T369 VanDerWaalsContact CG-CG2 3.49Å; D367-T369 VanDerWaalsContact CG-OG1 3.3Å; D367-T369 PolarHBondContact O-N 2.9Å; D367-T369 VanDerWaalsContact OD1-CB 3.31Å; D367-T369 WeakPolarHBondContact OD1-CB 3.26Å; D367-T369 WeakPolarHBondContact OD1-CG2 3.45Å; D367-T369 PolarHBondContact OD1-N 2.84Å; D367-T369 PolarHBondContact OD1-OG1 2.76Å; D367-T369 PolarHBondContact OD2-OG1 3.11Å
368	G	73.1	Confident	74.1	Confident	58 Å²	58	80.3 Å²	80.3	60%	0.598	42%	0.417	S	S	*	.	S	Bend	trans	75.5	3.1	-178.4	0	0	0	0	0	114.9	L365 K370	L365-G368 WeakPolarHBondContact O-CA 3.29Å; L365-G368 PolarHBondContact O-N 2.69Å; G368-K370 PolarHBondContact O-N 3.02Å
369	T	74.1	Confident	72.9	Confident	101 Å²	101	80.9 Å²	80.9	62%	0.62	42%	0.417	S	S	*	.	S	Bend	trans	-77.8	-16.1	-169.9	61.8	0	0	0	0	114.8	L365 D367	L365-T369 WeakPolarHBondContact CD1-OG1 3.31Å; D367-T369 VanDerWaalsContact C-N 3.26Å; D367-T369 HydrophobicContact CB-CG2 4.25Å; D367-T369 VanDerWaalsContact CG-CG2 3.49Å; D367-T369 VanDerWaalsContact CG-OG1 3.3Å; D367-T369 PolarHBondContact O-N 2.9Å; D367-T369 VanDerWaalsContact OD1-CB 3.31Å; D367-T369 WeakPolarHBondContact OD1-CB 3.26Å; D367-T369 WeakPolarHBondContact OD1-CG2 3.45Å; D367-T369 PolarHBondContact OD1-N 2.84Å; D367-T369 PolarHBondContact OD1-OG1 2.76Å; D367-T369 PolarHBondContact OD2-OG1 3.11Å
370	K	78.1	Confident	71.7	Confident	89 Å²	89	83.1 Å²	83.1	39%	0.387	42%	0.422	S	S	.	.			trans	-154.7	142.2	-177.9	-163.3	-179.3	-179.5	-149.3	0	111.5	W351 Y364 L365 G368 E372	W351-K370 HydrophobicContact CH2-CB 4.48Å; W351-K370 HydrophobicContact CH2-CD 3.87Å; W351-K370 HydrophobicContact CH2-CG 4.2Å; W351-K370 HydrophobicContact CZ2-CD 4.38Å; Y364-K370 CarbonylContact C-O 3.57Å; Y364-K370 VanDerWaalsContact CA-O 3.28Å; Y364-K370 WeakPolarHBondContact CA-O 3.35Å; Y364-K370 WeakPolarHBondContact CB-O 3.14Å; L365-K370 HydrophobicContact CD1-CB 3.71Å; L365-K370 HydrophobicContact CG-CB 4.1Å; L365-K370 PolarHBondContact N-O 2.83Å; G368-K370 PolarHBondContact O-N 3.02Å; K370-E372 WeakPolarHBondContact CE-OE1 3.44Å; K370-E372 WeakPolarHBondContact CE-OE2 3.44Å; K370-E372 IonicContact NZ-OE1 3.6Å; K370-E372 PolarHBondContact NZ-OE1 2.79Å; K370-E372 IonicContact NZ-OE2 3.73Å; K370-E372 PolarHBondContact NZ-OE2 3.29Å
371	S	84.6	Confident	70.1	Confident	80 Å²	80	89.5 Å²	89.5	56%	0.559	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.8	143.3	166.4	51.9	0	0	0	0	110.7	Y363	Y363-S371 CarbonylContact O-C 3.59Å; Y363-S371 WeakPolarHBondContact O-CA 3.21Å
372	E	80.9	Confident	67.7	Low	66 Å²	66	95.5 Å²	95.5	31%	0.308	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	141.4	178.3	-69.7	-176.8	135.6	0	0	109.5	W351 Y363 K370 N374	W351-E372 HydrophobicContact CH2-CB 4.38Å; W351-E372 HydrophobicContact CH2-CG 4.19Å; W351-E372 WeakPolarHBondContact CH2-OE2 3.28Å; W351-E372 HydrophobicContact CZ3-CB 4.21Å; W351-E372 HydrophobicContact CZ3-CG 4.44Å; Y363-E372 PolarHBondContact N-O 2.8Å; Y363-E372 PolarHBondContact O-N 2.88Å; K370-E372 WeakPolarHBondContact CE-OE1 3.44Å; K370-E372 WeakPolarHBondContact CE-OE2 3.44Å; K370-E372 IonicContact NZ-OE1 3.6Å; K370-E372 PolarHBondContact NZ-OE1 2.79Å; K370-E372 IonicContact NZ-OE2 3.73Å; K370-E372 PolarHBondContact NZ-OE2 3.29Å; E372-N374 PolarHBondContact O-N 3.16Å
373	W	80.8	Confident	65.7	Low	140 Å²	140	98 Å²	98	53%	0.53	49%	0.49	S	S	.	.	S	Bend	trans	-64.1	-22.4	-179.2	-63.2	102.3	0	0	0	113.7	D356 Q360 Y362	D356-W373 HydrophobicContact CB-CH2 4.48Å; D356-W373 WeakPolarHBondContact OD2-CH2 3.23Å; Q360-W373 HydrophobicContact CB-CE3 4.37Å; Q360-W373 HydrophobicContact CB-CZ3 3.78Å; Y362-W373 HydrophobicContact CD1-CZ3 4.36Å
374	N	75.9	Confident	62.9	Low	104 Å²	104	107.9 Å²	107.9	56%	0.556	53%	0.527	S	S	*	.	S	Bend	trans	-131.4	148.8	178.7	-69.2	-73.4	0	0	0	110.8	E372	E372-N374 PolarHBondContact O-N 3.16Å
375	L	74.3	Confident	60.2	Low	25 Å²	25	113 Å²	113	13%	0.131	55%	0.553	C	S	.	*	P	Polyproline II helix	trans	-63.4	138.8	168.5	-76	164.6	0	0	0	110.2	W330 F342 W351 Y363 E377	W330-L375 HydrophobicContact CH2-CD2 4.36Å; W330-L375 HydrophobicContact CZ2-CD2 4.47Å; W330-L375 HydrophobicContact CZ3-CD2 4.39Å; F342-L375 HydrophobicContact CB-CD1 4.07Å; F342-L375 HydrophobicContact CB-CD2 3.98Å; F342-L375 HydrophobicContact CD1-CD1 3.58Å; F342-L375 HydrophobicContact CD2-CD1 4.19Å; F342-L375 HydrophobicContact CE1-CD1 4.01Å; F342-L375 HydrophobicContact CG-CD1 3.68Å; F342-L375 HydrophobicContact CG-CD2 4.37Å; F342-L375 HydrophobicContact CZ-CD1 4.49Å; W351-L375 HydrophobicContact CB-CD2 3.61Å; W351-L375 HydrophobicContact CD2-CD2 4.36Å; W351-L375 HydrophobicContact CG-CD2 3.87Å; Y363-L375 HydrophobicContact CD1-CD1 4.05Å; Y363-L375 HydrophobicContact CD1-CD2 3.94Å; Y363-L375 HydrophobicContact CD1-CG 3.71Å; Y363-L375 HydrophobicContact CD2-CG 4.18Å; Y363-L375 HydrophobicContact CE1-CD1 3.85Å; Y363-L375 HydrophobicContact CE1-CG 3.95Å; Y363-L375 HydrophobicContact CE2-CG 4.41Å; Y363-L375 HydrophobicContact CG-CD2 4.11Å; Y363-L375 HydrophobicContact CG-CG 3.83Å; L375-E377 PolarHBondContact O-N 2.87Å
376	P	68.9	Low	57.5	Low	49 Å²	49	119 Å²	119	32%	0.318	59%	0.586	S	S	.	*	P	Polyproline II helix	trans	-56.4	128	-179.2	-28.4	34.7	0	0	0	114.3	W330 W351 Y378	W330-P376 HydrophobicContact CZ2-CB 4.27Å; W330-P376 HydrophobicContact CZ2-CG 4.36Å; W330-P376 PolarHBondContact NE1-O 2.9Å; W351-P376 HydrophobicContact CZ2-CG 4.02Å; P376-Y378 PolarHBondContact O-N 3.37Å
377	E	55.1	Low	54.9	Low	129 Å²	129	124 Å²	124	60%	0.603	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-62.9	122.4	177.1	-74	-166.6	154.6	0	0	112.1	W315 L375	W315-E377 HydrophobicContact CZ2-CG 4.25Å; W315-E377 PolarHBondContact NE1-OE1 3.09Å; L375-E377 PolarHBondContact O-N 2.87Å
378	Y	51.6	Low	52.5	Low	101 Å²	101	124 Å²	124	40%	0.396	62%	0.622	S	S	.	*	P	Polyproline II helix	trans	-92.6	123.9	173.9	-175.6	-97.2	0	0	0	111.4	N346 P376 P380	N346-Y378 HydrophobicContact CB-CE2 4.35Å; N346-Y378 WeakPolarHBondContact ND2-CE2 3.47Å; N346-Y378 PolarHBondContact ND2-OH 3.15Å; P376-Y378 PolarHBondContact O-N 3.37Å; Y378-P380 WeakPolarHBondContact O-CD 3.34Å
379	K	38.6	Very low	50.4	Low	171 Å²	171	129.3 Å²	129.3	74%	0.743	64%	0.636	S	S	*	*			trans	-94.8	112.3	175.7	-66.9	-174.2	179.3	-179.5	0	110.5
380	P	40.3	Very low	48.1	Very low	103 Å²	103	133.7 Å²	133.7	67%	0.669	65%	0.646	S	S	*	*			trans	-63.7	141.3	-177.4	-22.8	34.6	0	0	0	113.2	Y378	Y378-P380 WeakPolarHBondContact O-CD 3.34Å
381	R	30	Very low	45.7	Very low	238 Å²	238	136.7 Å²	136.7	90%	0.898	67%	0.665	S	S	*	*			trans	-92.7	111	170.9	-112.8	-179	173.7	174.3	-0.5	110.3
382	E	29.3	Very low	42.9	Very low	175 Å²	175	143.8 Å²	143.8	82%	0.818	68%	0.68	S	S	*	*			trans	-64.9	140.9	173	-77.1	-154.3	145.2	0	0	112.4
383	P	37.8	Very low	40.3	Very low	116 Å²	116	150.7 Å²	150.7	75%	0.753	71%	0.709	S	S	*	*			trans	-97.9	140.7	-178.4	36.5	-33.8	0	0	0	113.5
384	R	26.9	Very low	37.6	Very low	224 Å²	224	152 Å²	152	85%	0.845	72%	0.722	S	S	*	*			trans	-148.3	146.3	157.7	-67.9	-168.9	-172.7	-177	3.5	109.1
385	E	27.4	Very low	35.2	Very low	181 Å²	181	152.3 Å²	152.3	85%	0.846	73%	0.732	S	S	*	*			cis	-179.5	157.3	-25.4	-120	-159.2	130.4	0	0	103.8
386	N	26.8	Very low	33	Very low	145 Å²	145	163.3 Å²	163.3	78%	0.775	77%	0.771	S	S	*	*			trans	-74.2	140.6	-170	-68	-78	0	0	0	114.5
387	Q	24.8	Very low	30.9	Very low	197 Å²	197	171.5 Å²	171.5	92%	0.921	80%	0.796	S	S	*	*			trans	-137.6	88.4	148.9	-77.1	-156.9	17.3	0	0	114
388	S	24.2	Very low	29.6	Very low	113 Å²	113	174.1 Å²	174.1	79%	0.79	81%	0.805	S	S	*	*			trans	-162.8	32	149.9	49.3	0	0	0	0	114.1	K390	S388-K390 PolarHBondContact O-N 2.62Å
389	L	28.3	Very low	28.3	Very low	169 Å²	169	179 Å²	179	89%	0.885	83%	0.829	S	S	*	*			trans	-84.2	69.9	177.2	-110.5	175.8	0	0	0	113.8
390	K	25.9	Very low	27.6	Very low	192 Å²	192	179.5 Å²	179.5	84%	0.835	83%	0.833	S	S	*	*			trans	-136.8	124	153	-64.8	-178.7	-177.7	171.5	0	105.2	S388	S388-K390 PolarHBondContact O-N 2.62Å
391	I	28.1	Very low	27.7	Very low	153 Å²	153	180 Å²	180	79%	0.785	84%	0.837	S	S	*	*	S	Bend		-143.5	139.4	52.3	-79.5	167.8	0	0	0	112.9
392	R	26.1	Very low	27.4	Very low	229 Å²	229	177 Å²	177	86%	0.864	84%	0.838	S	S	*	*			trans	35.5	112.8	155.7	-69.4	176.3	166.1	153.7	-4.2	120.4
393	K	26.4	Very low	27.1	Very low	211 Å²	211	177.9 Å²	177.9	92%	0.917	84%	0.839	S	S	*	*			trans	-57	146.2	138.3	-63.1	171.2	-179.6	172.1	0	110.2
394	M	24.2	Very low	26.4	Very low	167 Å²	167	177.5 Å²	177.5	82%	0.823	84%	0.839	S	S	*	*			trans	-135.7	135.6	149.1	-141.8	-170.3	-59.5	0	0	109.7
395	C	24.9	Very low	26.2	Very low	111 Å²	111	172.1 Å²	172.1	75%	0.75	83%	0.831	S	S	*	*			trans	38.1	91.2	166.9	-65	0	0	0	0	119.8
396	R	27.2	Very low	26.1	Very low	256 Å²	256	168.4 Å²	168.4	97%	0.966	82%	0.821	S	S	*	*			trans	-79.8	126.8	131.8	-101.1	-172	175.5	-175.9	-0.5	108.2
397	R	26.2	Very low	26	Very low	221 Å²	221	169.1 Å²	169.1	83%	0.834	82%	0.819	S	S	*	*			trans	-139.7	99.5	155.1	-110.2	176.8	165.1	136.3	-4.6	106
398	K	27.4	Very low	26	Very low	184 Å²	184	169.4 Å²	169.4	80%	0.8	81%	0.813	S	S	*	*				75.5	109.4	104.4	-81.2	-161.9	174.1	-164.5	0	112.8
399	F	23.3	Very low	26.1	Very low	202 Å²	202	173 Å²	173	89%	0.886	82%	0.815	S	S	*	*				-167.3	148.1	118.7	-101	-68.1	0	0	0	111.3
400	H	23.6	Very low	25.9	Very low	182 Å²	182	177.2 Å²	177.2	84%	0.843	82%	0.819	S	S	*	*			trans	-155.8	167.8	168.5	-77.8	-75.3	0	0	0	105.5
401	P	43.5	Very low	25.8	Very low	113 Å²	113	173.3 Å²	173.3	73%	0.734	82%	0.816	S	S	*	*				-126.1	176.7	-59	38.3	-24.2	0	0	0	110.3
402	L	23.6	Very low	25.6	Very low	177 Å²	177	170.8 Å²	170.8	93%	0.927	81%	0.812	S	S	*	*			trans	-158.9	166.2	159.3	-111.9	154.7	0	0	0	111.6
403	K	23.8	Very low	25.6	Very low	192 Å²	192	166.3 Å²	166.3	84%	0.835	81%	0.814	S	S	*	*			trans	-121.5	160.5	-164.3	-60.6	178.3	178.8	179.2	0	112.2
404	S	21.1	Very low	25.7	Very low	109 Å²	109	164.1 Å²	164.1	76%	0.762	81%	0.807	S	S	*	*			trans	75.4	152.5	160.9	-145.2	0	0	0	0	114.9
405	T	23.8	Very low	26.1	Very low	110 Å²	110	162.6 Å²	162.6	68%	0.675	81%	0.807	S	S	*	*			cis	-149.1	122.9	19.8	-45.1	0	0	0	0	113.7
406	T	24.4	Very low	26.3	Very low	104 Å²	104	163.3 Å²	163.3	64%	0.638	80%	0.802	S	S	*	*			trans	59.5	148.8	147.8	62.6	0	0	0	0	125.3
407	H	25.3	Very low	26.5	Very low	160 Å²	160	156.7 Å²	156.7	74%	0.741	80%	0.795	S	S	*	*			trans	66.9	127.9	157.8	-55.7	-56	0	0	0	117.4
408	Y	25.1	Very low	26.6	Very low	202 Å²	202	154.9 Å²	154.9	79%	0.792	79%	0.793	S	S	*	*			cis	-142.9	161.1	29.2	-110.6	-88.9	0	0	0	114.3
409	K	25.2	Very low	26.9	Very low	189 Å²	189	154.2 Å²	154.2	82%	0.822	79%	0.792	S	S	*	*			trans	1.6	122.2	163.1	-69	174.4	178	-179.7	0	119.3
410	R	24.7	Very low	27.7	Very low	257 Å²	257	148.2 Å²	148.2	97%	0.97	77%	0.772	S	S	*	*				-145.5	153.2	108.4	-147.5	164.9	-172.4	154.1	2.4	110.3
411	S	24.7	Very low	28.6	Very low	111 Å²	111	147.8 Å²	147.8	78%	0.776	77%	0.771	S	S	*	*			trans	-113	153.9	-168.9	-169.8	0	0	0	0	112.2
412	S	23.6	Very low	28.7	Very low	99 Å²	99	150 Å²	150	69%	0.692	78%	0.776	S	S	*	*			trans	39.4	115.9	159.3	-160	0	0	0	0	119.6
413	C	25.3	Very low	30.2	Very low	135 Å²	135	144.7 Å²	144.7	91%	0.912	75%	0.748	S	S	*	*			trans	-148.1	67.8	133.5	-115	0	0	0	0	108.6
414	E	29.5	Very low	32.4	Very low	166 Å²	166	142.6 Å²	142.6	78%	0.776	74%	0.742	S	S	*	*			trans	-77.7	172.8	151.8	-73.8	-164.3	104.1	0	0	109.7
415	V	32.9	Very low	35.5	Very low	134 Å²	134	140 Å²	140	81%	0.812	72%	0.717	S	S	*	*	S	Bend	trans	76.7	150	-169.6	-165.4	0	0	0	0	112.8
416	I	28.6	Very low	38.6	Very low	127 Å²	127	137.2 Å²	137.2	65%	0.651	71%	0.705	S	S	*	*	S	Bend	trans	64.2	45.3	-175.1	-29.6	-178.8	0	0	0	115.5
417	S	30.4	Very low	41.6	Very low	116 Å²	116	132.9 Å²	132.9	81%	0.811	68%	0.681	S	S	*	*	S	Bend	trans	-147.5	28.6	168.9	-146.2	0	0	0	0	115
418	K	29.7	Very low	44.7	Very low	184 Å²	184	130.1 Å²	130.1	80%	0.8	67%	0.67	S	S	*	*	S	Bend	trans	-138.2	28.1	-174.1	-69.3	-171.4	175.4	177.3	0	115.2
419	H	33.8	Very low	47.8	Very low	170 Å²	170	120.6 Å²	120.6	79%	0.787	63%	0.633	S	S	*	*	S	Bend	trans	-146.4	23	-172	-112.4	49.8	0	0	0	116.6
420	V	39.7	Very low	51	Low	76 Å²	76	113.1 Å²	113.1	46%	0.461	60%	0.602	S	S	.	*	S	Bend	trans	-136.4	44.6	-178.5	-157.7	0	0	0	0	111.7	Q537	V420-Q537 HydrophobicContact CG1-CB 4.33Å; V420-Q537 HydrophobicContact CG2-CB 4.2Å
421	Q	41	Very low	54.2	Low	173 Å²	173	101.4 Å²	101.4	81%	0.808	56%	0.558	S	S	*	*	S	Bend	trans	-123.2	-13.4	-171.9	-93.1	-176.3	-42.2	0	0	117.4
422	N	46.8	Very low	57.3	Low	158 Å²	158	96.2 Å²	96.2	85%	0.845	52%	0.522	S	S	*	.			trans	-129.6	61.4	-174.9	-75.9	-14.5	0	0	0	113
423	L	54.4	Low	60.4	Low	66 Å²	66	93 Å²	93	35%	0.346	50%	0.495	S	S	.	.			trans	-137.4	66.2	170	-70	179.4	0	0	0	110.8	I530	L423-I530 HydrophobicContact CB-CD1 4.24Å; L423-I530 HydrophobicContact CB-CG1 4.35Å; L423-I530 HydrophobicContact CD1-CG1 4.1Å; L423-I530 HydrophobicContact CD2-CD1 3.89Å; L423-I530 HydrophobicContact CD2-CG1 3.96Å; L423-I530 HydrophobicContact CG-CG1 4.37Å
424	E	70	Confident	63.2	Low	149 Å²	149	87.4 Å²	87.4	70%	0.696	46%	0.456	S	S	*	.			trans	-86.7	117.5	164.9	-63	-170	-165.2	0	0	109.1	L453 H454	E424-L453 WeakPolarHBondContact CA-O 3.12Å; E424-H454 IonicContact OE1-CD2 2.73Å; E424-H454 PolarHBondContact OE1-CD2 2.69Å; E424-H454 IonicContact OE1-NE2 2.67Å
425	K	86.8	Confident	65.6	Low	55 Å²	55	79.8 Å²	79.8	24%	0.239	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	125.3	172.1	-169.2	171.2	-173.7	151.3	0	110.3	L453 D526 W527 I530	K425-L453 PolarHBondContact N-O 2.94Å; K425-L453 PolarHBondContact O-N 2.76Å; K425-D526 IonicContact NZ-OD2 2.79Å; K425-W527 HydrophobicContact CB-CH2 4.14Å; K425-W527 HydrophobicContact CB-CZ3 4.25Å; K425-W527 HydrophobicContact CD-CD2 4.06Å; K425-W527 HydrophobicContact CD-CE3 4.23Å; K425-W527 HydrophobicContact CD-CH2 4.35Å; K425-W527 HydrophobicContact CD-CZ2 4.15Å; K425-W527 HydrophobicContact CD-CZ3 4.36Å; K425-W527 HydrophobicContact CG-CH2 3.81Å; K425-W527 HydrophobicContact CG-CZ2 3.8Å; K425-W527 HydrophobicContact CG-CZ3 4.16Å; K425-W527 VanDerWaalsContact O-CH2 3.31Å; K425-W527 WeakPolarHBondContact O-CH2 3.49Å; K425-I530 HydrophobicContact CB-CD1 3.71Å; K425-I530 HydrophobicContact CD-CD1 3.97Å; K425-I530 HydrophobicContact CD-CG2 4.11Å; K425-I530 HydrophobicContact CG-CD1 4.44Å
426	A	88.4	Confident	67.8	Low	51 Å²	51	77.3 Å²	77.3	42%	0.421	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	154.2	176.6	0	0	0	0	0	110.9	W450 T451 V452	A426-W450 HydrophobicContact CB-CH2 4Å; A426-W450 HydrophobicContact CB-CZ2 3.5Å; A426-W450 VanDerWaalsContact CB-CZ2 3.5Å; A426-T451 CarbonylContact C-O 3.56Å; A426-T451 VanDerWaalsContact CA-O 3.29Å; A426-T451 WeakPolarHBondContact CA-O 3.26Å; A426-V452 HydrophobicContact CB-CG2 4.03Å
427	G	87.7	Confident	69.8	Low	13 Å²	13	77.3 Å²	77.3	13%	0.134	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.8	167.5	175	0	0	0	0	0	113.7	T451	G427-T451 PolarHBondContact N-O 2.85Å; G427-T451 PolarHBondContact O-N 3.45Å
428	I	89.9	Confident	71.3	Confident	102 Å²	102	74.9 Å²	74.9	52%	0.523	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	124.8	177.2	-57.3	174.8	0	0	0	109.1	P448 W450 Y518	I428-P448 HydrophobicContact CG2-CB 4.08Å; I428-W450 HydrophobicContact CG1-CE3 3.93Å; I428-W450 HydrophobicContact CG1-CZ3 4.37Å; I428-Y518 WeakPolarHBondContact O-CD2 3.2Å; I428-Y518 VanDerWaalsContact O-CE2 3.28Å; I428-Y518 WeakPolarHBondContact O-CE2 3.3Å
429	L	91.4	Very high	73.3	Confident	1 Å²	1	74.2 Å²	74.2	1%	0.005	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	144	174.6	-65.4	174.8	0	0	0	110.8	K431 T449 T451 I516 Y518 W527	L429-K431 PolarHBondContact O-N 2.93Å; L429-T449 PolarHBondContact N-O 2.92Å; L429-T449 PolarHBondContact O-N 3.05Å; L429-T449 PolarHBondContact O-OG1 2.91Å; L429-T451 HydrophobicContact CD1-CG2 4.03Å; L429-I516 HydrophobicContact CB-CG2 4.1Å; L429-I516 HydrophobicContact CD1-CG2 3.73Å; L429-I516 HydrophobicContact CG-CG2 4.37Å; L429-Y518 HydrophobicContact CD2-CD2 3.93Å; L429-Y518 HydrophobicContact CD2-CG 4.36Å; L429-W527 HydrophobicContact CD1-CD2 3.76Å; L429-W527 HydrophobicContact CD1-CE3 4.03Å; L429-W527 HydrophobicContact CD1-CG 4.16Å; L429-W527 HydrophobicContact CD1-CH2 4.28Å; L429-W527 HydrophobicContact CD1-CZ2 4.05Å; L429-W527 HydrophobicContact CD1-CZ3 4.28Å; L429-W527 HydrophobicContact CD2-CG 4.27Å; L429-W527 HydrophobicContact CG-CZ2 4.43Å
430	N	91.4	Very high	75.1	Confident	32 Å²	32	75.3 Å²	75.3	17%	0.171	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	113.9	171.8	-70.8	-53.3	0	0	0	109.5	W446 I516 Q517	N430-W446 HydrophobicContact CB-CE3 4.07Å; N430-W446 WeakPolarHBondContact O-CZ3 3.31Å; N430-I516 CarbonylContact O-C 3.57Å; N430-I516 WeakPolarHBondContact O-CA 3.19Å; N430-Q517 HydrophobicContact CB-CB 4.38Å; N430-Q517 WeakPolarHBondContact CB-O 3.47Å; N430-Q517 PolarHBondContact N-O 2.84Å; N430-Q517 PolarHBondContact ND2-OE1 2.98Å; N430-Q517 PolarHBondContact O-N 3.35Å
431	K	91.3	Very high	76.8	Confident	11 Å²	11	74.3 Å²	74.3	5%	0.048	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	154.2	174.3	74.3	177.8	-176.5	-173.6	0	112.4	L429 W446 V447 T449 F460 E480 L515	L429-K431 PolarHBondContact O-N 2.93Å; K431-W446 WeakPolarHBondContact O-CA 3.39Å; K431-V447 PolarHBondContact N-O 3.15Å; K431-V447 PolarHBondContact O-N 2.62Å; K431-T449 HydrophobicContact CD-CG2 4.12Å; K431-T449 WeakPolarHBondContact CD-OG1 3.24Å; K431-T449 VanDerWaalsContact CE-CG2 3.49Å; K431-T449 HydrophobicContact CG-CG2 4.4Å; K431-F460 HydrophobicContact CB-CD1 4.46Å; K431-F460 HydrophobicContact CB-CE1 4.24Å; K431-F460 HydrophobicContact CD-CB 3.85Å; K431-F460 HydrophobicContact CD-CD1 3.62Å; K431-F460 HydrophobicContact CD-CD2 4.15Å; K431-F460 HydrophobicContact CD-CE1 4.13Å; K431-F460 HydrophobicContact CD-CG 3.62Å; K431-E480 IonicContact NZ-OE2 3.81Å; K431-E480 PolarHBondContact NZ-OE2 2.85Å; K431-L515 CarbonylContact C-O 3.59Å; K431-L515 VanDerWaalsContact CA-O 3.32Å; K431-L515 WeakPolarHBondContact CA-O 3.49Å
432	T	90.8	Very high	77.5	Confident	3 Å²	3	71.5 Å²	71.5	2%	0.018	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	137.2	155.1	178.4	0	0	0	0	109.8	I434 K444 N445 W446 F514 L515	T432-I434 HydrophobicContact CG2-CG2 4.26Å; T432-K444 HydrophobicContact CG2-CB 4.25Å; T432-K444 WeakPolarHBondContact OG1-CA 3.46Å; T432-N445 VanDerWaalsContact CB-O 3.31Å; T432-N445 WeakPolarHBondContact CB-O 3.46Å; T432-N445 PolarHBondContact OG1-N 2.9Å; T432-N445 PolarHBondContact OG1-O 2.86Å; T432-W446 HydrophobicContact CG2-CD2 3.76Å; T432-W446 HydrophobicContact CG2-CE3 3.91Å; T432-W446 HydrophobicContact CG2-CG 4.43Å; T432-W446 HydrophobicContact CG2-CH2 3.9Å; T432-W446 HydrophobicContact CG2-CZ2 3.72Å; T432-W446 HydrophobicContact CG2-CZ3 3.97Å; T432-F514 CarbonylContact O-C 3.55Å; T432-F514 WeakPolarHBondContact O-CA 3.37Å; T432-L515 HydrophobicContact CG2-CB 3.85Å; T432-L515 HydrophobicContact CG2-CD1 4.24Å; T432-L515 HydrophobicContact CG2-CG 4.4Å; T432-L515 PolarHBondContact N-O 2.65Å; T432-L515 PolarHBondContact O-N 3.04Å
433	K	88.4	Confident	78.3	Confident	32 Å²	32	70.3 Å²	70.3	14%	0.139	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	144	166.7	-151.1	173.1	-166	177.1	0	108.9	E436 F481 V512 F514	K433-E436 WeakPolarHBondContact CE-OE2 3.38Å; K433-E436 IonicContact NZ-OE1 2.73Å; K433-E436 PolarHBondContact NZ-OE1 2.9Å; K433-E436 IonicContact NZ-OE2 3.36Å; K433-E436 PolarHBondContact NZ-OE2 3.31Å; K433-F481 VanDerWaalsContact NZ-CE1 3.31Å; K433-V512 HydrophobicContact CG-CG1 4.41Å; K433-F514 HydrophobicContact CB-CD1 4.07Å; K433-F514 HydrophobicContact CB-CE1 3.85Å; K433-F514 HydrophobicContact CD-CE1 4.23Å; K433-F514 HydrophobicContact CD-CZ 4.29Å; K433-F514 HydrophobicContact CG-CD1 4.17Å; K433-F514 HydrophobicContact CG-CE1 3.76Å; K433-F514 HydrophobicContact CG-CZ 4.1Å
434	I	85	Confident	79.5	Confident	17 Å²	17	71.6 Å²	71.6	9%	0.087	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	-21.3	177.7	69.7	173.7	0	0	0	113.8	T432 V441 K444 E513 L515	T432-I434 HydrophobicContact CG2-CG2 4.26Å; I434-V441 PolarHBondContact O-N 3.33Å; I434-K444 HydrophobicContact CG2-CD 4.1Å; I434-K444 HydrophobicContact CG2-CG 4.15Å; I434-E513 HydrophobicContact CD1-CB 3.99Å; I434-E513 HydrophobicContact CG1-CB 3.49Å; I434-E513 VanDerWaalsContact CG1-CB 3.49Å; I434-E513 PolarHBondContact N-O 3.44Å; I434-L515 HydrophobicContact CD1-CD2 4.07Å; I434-L515 HydrophobicContact CD1-CG 4.08Å; I434-L515 HydrophobicContact CG2-CD1 3.72Å; I434-L515 HydrophobicContact CG2-CG 3.69Å
435	S	80.1	Confident	80	Confident	5 Å²	5	69.9 Å²	69.9	4%	0.035	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	158.1	168.7	66.1	0	0	0	0	112	K439 E513	S435-K439 VanDerWaalsContact CA-O 3.28Å; S435-K439 WeakPolarHBondContact CA-O 3.45Å; S435-E513 WeakPolarHBondContact CB-OE2 3.33Å; S435-E513 PolarHBondContact O-N 3.43Å; S435-E513 VanDerWaalsContact OG-CB 3.29Å; S435-E513 WeakPolarHBondContact OG-CB 3.16Å; S435-E513 WeakPolarHBondContact OG-CG 3.48Å; S435-E513 PolarHBondContact OG-N 3.44Å; S435-E513 PolarHBondContact OG-OE2 3.32Å
436	E	78.8	Confident	80	Confident	83 Å²	83	70.6 Å²	70.6	39%	0.388	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	125.3	174.4	176.7	150.6	-130.3	0	0	109.1	K433 G438 K439	K433-E436 WeakPolarHBondContact CE-OE2 3.38Å; K433-E436 IonicContact NZ-OE1 2.73Å; K433-E436 PolarHBondContact NZ-OE1 2.9Å; K433-E436 IonicContact NZ-OE2 3.36Å; K433-E436 PolarHBondContact NZ-OE2 3.31Å; E436-G438 PolarHBondContact O-N 3.26Å; E436-K439 PolarHBondContact N-O 2.84Å; E436-K439 WeakPolarHBondContact O-CB 3.16Å; E436-K439 PolarHBondContact O-N 3.39Å
437	N	70.5	Confident	79.9	Confident	127 Å²	127	70.4 Å²	70.4	68%	0.679	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.2	43.7	-176	-59.5	1.6	0	0	0	112.3	K439 N510 G511	N437-K439 PolarHBondContact O-N 2.89Å; N437-N510 PolarHBondContact OD1-O 2.86Å; N437-G511 PolarHBondContact N-O 3.09Å; N437-G511 VanDerWaalsContact N-O 3.09Å
438	G	61.3	Low	80	Confident	64 Å²	64	72.7 Å²	72.7	66%	0.66	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.8	-10.1	-178.7	0	0	0	0	0	116	E436	E436-G438 PolarHBondContact O-N 3.26Å
439	K	71.3	Confident	79.9	Confident	171 Å²	171	68 Å²	68	74%	0.743	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.1	121.1	175.1	-66.4	-178.8	179.9	177.4	0	109.8	S435 E436 N437 V441	S435-K439 VanDerWaalsContact CA-O 3.28Å; S435-K439 WeakPolarHBondContact CA-O 3.45Å; E436-K439 PolarHBondContact N-O 2.84Å; E436-K439 WeakPolarHBondContact O-CB 3.16Å; E436-K439 PolarHBondContact O-N 3.39Å; N437-K439 PolarHBondContact O-N 2.89Å; K439-V441 PolarHBondContact O-N 3.33Å
440	K	73.2	Confident	79.7	Confident	192 Å²	192	73.9 Å²	73.9	84%	0.835	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.1	125.1	176.9	-67.3	-178.8	179.3	177.6	0	110.4	S442	K440-S442 PolarHBondContact O-N 2.9Å
441	V	74	Confident	79.7	Confident	56 Å²	56	72.3 Å²	72.3	34%	0.339	37%	0.367	S	S	.	.			trans	-74.5	111.6	176.8	-178	0	0	0	0	108.7	I434 K439 R443	I434-V441 PolarHBondContact O-N 3.33Å; K439-V441 PolarHBondContact O-N 3.33Å; V441-R443 VanDerWaalsContact C-N 3.28Å; V441-R443 WeakPolarHBondContact CG1-O 3.49Å; V441-R443 PolarHBondContact O-N 3.17Å
442	S	56	Low	79.6	Confident	113 Å²	113	73.5 Å²	73.5	79%	0.79	38%	0.375	S	S	*	.	S	Bend	trans	-68.3	-21.8	-170.3	61.9	0	0	0	0	114.6	K440	K440-S442 PolarHBondContact O-N 2.9Å
443	R	64.6	Low	79.6	Confident	134 Å²	134	73.4 Å²	73.4	51%	0.506	38%	0.375	S	S	.	.	S	Bend	trans	-123.8	111.7	177	-64.5	-171	-179	-165.6	0.7	110.4	V441 N445 T582 P584	V441-R443 VanDerWaalsContact C-N 3.28Å; V441-R443 WeakPolarHBondContact CG1-O 3.49Å; V441-R443 PolarHBondContact O-N 3.17Å; R443-N445 PolarHBondContact O-N 2.83Å; R443-T582 PolarHBondContact NH2-O 3.19Å; R443-P584 HydrophobicContact CG-CG 4.1Å
444	K	78.4	Confident	79.4	Confident	92 Å²	92	76.9 Å²	76.9	40%	0.4	39%	0.391	S	S	.	.			trans	-75.8	119.5	173.5	-63.7	177.6	-179.4	170.5	0	109	T432 I434 K497 L515	T432-K444 HydrophobicContact CG2-CB 4.25Å; T432-K444 WeakPolarHBondContact OG1-CA 3.46Å; I434-K444 HydrophobicContact CG2-CD 4.1Å; I434-K444 HydrophobicContact CG2-CG 4.15Å; K444-K497 PolarHBondContact NZ-O 3.04Å; K444-L515 HydrophobicContact CD-CD1 4.46Å
445	N	80.3	Confident	79.1	Confident	114 Å²	114	79.1 Å²	79.1	61%	0.61	42%	0.419	S	S	*	.			trans	-113.5	103	-179.8	-172.1	45.8	0	0	0	108.7	T432 R443 V447	T432-N445 VanDerWaalsContact CB-O 3.31Å; T432-N445 WeakPolarHBondContact CB-O 3.46Å; T432-N445 PolarHBondContact OG1-N 2.9Å; T432-N445 PolarHBondContact OG1-O 2.86Å; R443-N445 PolarHBondContact O-N 2.83Å; N445-V447 WeakPolarHBondContact ND2-CG2 3.46Å
446	W	86.7	Confident	79.3	Confident	69 Å²	69	79.2 Å²	79.2	26%	0.261	42%	0.42	S	S	.	.			trans	-77.1	122	177.9	-69.7	97.2	0	0	0	109.7	N430 K431 T432 K500 V503 L515 Q517	N430-W446 HydrophobicContact CB-CE3 4.07Å; N430-W446 WeakPolarHBondContact O-CZ3 3.31Å; K431-W446 WeakPolarHBondContact O-CA 3.39Å; T432-W446 HydrophobicContact CG2-CD2 3.76Å; T432-W446 HydrophobicContact CG2-CE3 3.91Å; T432-W446 HydrophobicContact CG2-CG 4.43Å; T432-W446 HydrophobicContact CG2-CH2 3.9Å; T432-W446 HydrophobicContact CG2-CZ2 3.72Å; T432-W446 HydrophobicContact CG2-CZ3 3.97Å; W446-K500 HydrophobicContact CD2-CD 4.43Å; W446-K500 HydrophobicContact CH2-CD 4.48Å; W446-K500 HydrophobicContact CZ2-CD 4.18Å; W446-V503 HydrophobicContact CH2-CG1 3.95Å; W446-V503 HydrophobicContact CH2-CG2 4.47Å; W446-L515 HydrophobicContact CH2-CB 3.61Å; W446-L515 HydrophobicContact CH2-CD1 4.42Å; W446-L515 HydrophobicContact CZ2-CB 4.24Å; W446-L515 HydrophobicContact CZ2-CD1 4.28Å; W446-L515 HydrophobicContact CZ3-CB 4.23Å; W446-Q517 HydrophobicContact CE3-CB 4.43Å; W446-Q517 HydrophobicContact CH2-CB 3.94Å; W446-Q517 HydrophobicContact CZ3-CB 3.59Å
447	V	87.5	Confident	79.7	Confident	47 Å²	47	77.5 Å²	77.5	29%	0.285	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	128	-179.5	-176.6	0	0	0	0	108.3	K431 N445 T449	K431-V447 PolarHBondContact N-O 3.15Å; K431-V447 PolarHBondContact O-N 2.62Å; N445-V447 WeakPolarHBondContact ND2-CG2 3.46Å; V447-T449 HydrophobicContact CG1-CG2 4.1Å
448	P	88.6	Confident	80.7	Confident	62 Å²	62	71.5 Å²	71.5	40%	0.403	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	133.1	168	29.8	-33.4	0	0	0	108.8	I428	I428-P448 HydrophobicContact CG2-CB 4.08Å
449	T	88.1	Confident	82	Confident	3 Å²	3	69.6 Å²	69.6	2%	0.018	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	138.4	177.5	47	0	0	0	0	111.7	L429 K431 V447 T451 H461	L429-T449 PolarHBondContact N-O 2.92Å; L429-T449 PolarHBondContact O-N 3.05Å; L429-T449 PolarHBondContact O-OG1 2.91Å; K431-T449 HydrophobicContact CD-CG2 4.12Å; K431-T449 WeakPolarHBondContact CD-OG1 3.24Å; K431-T449 VanDerWaalsContact CE-CG2 3.49Å; K431-T449 HydrophobicContact CG-CG2 4.4Å; V447-T449 HydrophobicContact CG1-CG2 4.1Å; T449-T451 PolarHBondContact O-N 2.93Å; T449-T451 PolarHBondContact O-OG1 2.87Å; T449-H461 WeakPolarHBondContact CB-O 3.28Å; T449-H461 WeakPolarHBondContact CG2-O 3.37Å
450	W	87.9	Confident	82.9	Confident	124 Å²	124	61.4 Å²	61.4	47%	0.47	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	108.4	167.6	-177.1	-108.1	0	0	0	109.3	A426 I428 H461	A426-W450 HydrophobicContact CB-CH2 4Å; A426-W450 HydrophobicContact CB-CZ2 3.5Å; A426-W450 VanDerWaalsContact CB-CZ2 3.5Å; I428-W450 HydrophobicContact CG1-CE3 3.93Å; I428-W450 HydrophobicContact CG1-CZ3 4.37Å; W450-H461 HydrophobicContact CB-CB 4.3Å; W450-H461 AromaticContact CD1-ND1 3.62Å; W450-H461 WeakPolarHBondContact O-CB 3.35Å; W450-H461 PolarHBondContact O-N 2.57Å; W450-H461 PolarHBondContact O-ND1 2.95Å
451	T	91.5	Very high	83.3	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	127.4	-171.9	-54.3	0	0	0	0	108.5	A426 G427 L429 T449 L458 T459 F460	A426-T451 CarbonylContact C-O 3.56Å; A426-T451 VanDerWaalsContact CA-O 3.29Å; A426-T451 WeakPolarHBondContact CA-O 3.26Å; G427-T451 PolarHBondContact N-O 2.85Å; G427-T451 PolarHBondContact O-N 3.45Å; L429-T451 HydrophobicContact CD1-CG2 4.03Å; T449-T451 PolarHBondContact O-N 2.93Å; T449-T451 PolarHBondContact O-OG1 2.87Å; T451-L458 HydrophobicContact CG2-CD1 3.55Å; T451-L458 HydrophobicContact CG2-CD2 4.5Å; T451-L458 HydrophobicContact CG2-CG 4.02Å; T451-T459 WeakPolarHBondContact CA-O 3.5Å; T451-F460 HydrophobicContact CG2-CD1 3.65Å; T451-F460 HydrophobicContact CG2-CE1 3.57Å; T451-F460 WeakPolarHBondContact OG1-CD1 3.45Å
452	V	89.6	Confident	83.2	Confident	35 Å²	35	56.5 Å²	56.5	21%	0.212	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	122.6	179.9	-176.7	0	0	0	0	109.2	A426 H454 T459	A426-V452 HydrophobicContact CB-CG2 4.03Å; V452-H454 HydrophobicContact CG1-CB 4.31Å; V452-T459 PolarHBondContact N-O 3.06Å; V452-T459 PolarHBondContact O-N 2.91Å
453	L	89.9	Confident	83.1	Confident	1 Å²	1	56 Å²	56	1%	0.005	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	119.7	165.1	176.8	61.2	0	0	0	108.1	E424 K425 L458 L485 W527 I530 L531 T534	E424-L453 WeakPolarHBondContact CA-O 3.12Å; K425-L453 PolarHBondContact N-O 2.94Å; K425-L453 PolarHBondContact O-N 2.76Å; L453-L458 HydrophobicContact CB-CD1 3.97Å; L453-L458 HydrophobicContact CD1-CD1 4.4Å; L453-L485 HydrophobicContact CD1-CD1 3.46Å; L453-L485 VanDerWaalsContact CD1-CD1 3.46Å; L453-W527 HydrophobicContact CB-CZ3 4.21Å; L453-I530 HydrophobicContact CD2-CD1 4.13Å; L453-I530 HydrophobicContact CD2-CG1 3.95Å; L453-I530 HydrophobicContact CD2-CG2 3.98Å; L453-L531 HydrophobicContact CD1-CD2 4.17Å; L453-L531 HydrophobicContact CD2-CD2 4.1Å; L453-T534 HydrophobicContact CD1-CG2 4.35Å
454	H	84.5	Confident	82.4	Confident	106 Å²	106	55.3 Å²	55.3	49%	0.491	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	136	176	165.3	-76.1	0	0	0	109.4	E424 V452 G456 V457	E424-H454 IonicContact OE1-CD2 2.73Å; E424-H454 PolarHBondContact OE1-CD2 2.69Å; E424-H454 IonicContact OE1-NE2 2.67Å; V452-H454 HydrophobicContact CG1-CB 4.31Å; H454-G456 VanDerWaalsContact C-N 3.25Å; H454-G456 PolarHBondContact O-N 2.83Å; H454-G456 VanDerWaalsContact O-N 3.13Å; H454-V457 PolarHBondContact N-O 2.72Å; H454-V457 WeakPolarHBondContact O-CB 3.23Å; H454-V457 PolarHBondContact O-N 3.24Å; H454-V457 VanDerWaalsContact O-O 3.12Å
455	G	77.6	Confident	80.8	Confident	64 Å²	64	59.4 Å²	59.4	66%	0.66	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	30.3	171.2	0	0	0	0	0	115.6	V457	G455-V457 VanDerWaalsContact C-N 3.33Å
456	G	84.4	Confident	79	Confident	7 Å²	7	60.1 Å²	60.1	7%	0.072	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.7	13.8	-175.8	0	0	0	0	0	115.2	H454 L485	H454-G456 VanDerWaalsContact C-N 3.25Å; H454-G456 PolarHBondContact O-N 2.83Å; H454-G456 VanDerWaalsContact O-N 3.13Å; G456-L485 VanDerWaalsContact O-CB 3.29Å; G456-L485 WeakPolarHBondContact O-CB 3.36Å; G456-L485 PolarHBondContact O-N 2.87Å
457	V	88.4	Confident	76.5	Confident	47 Å²	47	61.1 Å²	61.1	29%	0.285	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	131.6	-178.2	179.1	0	0	0	0	109.6	H454 G455 T482	H454-V457 PolarHBondContact N-O 2.72Å; H454-V457 WeakPolarHBondContact O-CB 3.23Å; H454-V457 PolarHBondContact O-N 3.24Å; H454-V457 VanDerWaalsContact O-O 3.12Å; G455-V457 VanDerWaalsContact C-N 3.33Å; V457-T482 HydrophobicContact CG1-CG2 3.2Å
458	L	90.9	Very high	74.2	Confident	1 Å²	1	65 Å²	65	1%	0.005	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	114.6	176.5	-170.1	68.1	0	0	0	109.9	T451 L453 F460 V483 L485 L506 I516 W527 L531	T451-L458 HydrophobicContact CG2-CD1 3.55Å; T451-L458 HydrophobicContact CG2-CD2 4.5Å; T451-L458 HydrophobicContact CG2-CG 4.02Å; L453-L458 HydrophobicContact CB-CD1 3.97Å; L453-L458 HydrophobicContact CD1-CD1 4.4Å; L458-F460 HydrophobicContact CD2-CE1 4.25Å; L458-F460 HydrophobicContact CD2-CE2 4.25Å; L458-F460 HydrophobicContact CD2-CZ 3.66Å; L458-F460 HydrophobicContact CG-CE2 4.47Å; L458-F460 HydrophobicContact CG-CZ 4.15Å; L458-V483 PolarHBondContact N-O 2.81Å; L458-V483 PolarHBondContact O-N 3.46Å; L458-L485 HydrophobicContact CB-CD1 4.31Å; L458-L485 HydrophobicContact CB-CD2 4.02Å; L458-L485 HydrophobicContact CB-CG 4.23Å; L458-L506 HydrophobicContact CD2-CD2 3.58Å; L458-I516 HydrophobicContact CD2-CD1 4.03Å; L458-W527 HydrophobicContact CD1-CZ3 4.47Å; L458-L531 HydrophobicContact CD1-CD2 4Å; L458-L531 HydrophobicContact CD2-CD2 4.04Å
459	T	89.1	Confident	72.4	Confident	23 Å²	23	66 Å²	66	14%	0.141	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	130.3	-177.9	-60.5	0	0	0	0	111.2	T451 V452 H461 P479 T482	T451-T459 WeakPolarHBondContact CA-O 3.5Å; V452-T459 PolarHBondContact N-O 3.06Å; V452-T459 PolarHBondContact O-N 2.91Å; T459-H461 WeakPolarHBondContact CG2-NE2 3.38Å; T459-P479 HydrophobicContact CG2-CB 3.52Å; T459-T482 PolarHBondContact OG1-OG1 2.95Å
460	F	89.4	Confident	69.9	Low	0 Å²	0	69.7 Å²	69.7	0%	0	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	116.1	176.2	-55.7	-79.6	0	0	0	110.3	K431 T451 L458 E480 F481 V483 F514 I516	K431-F460 HydrophobicContact CB-CD1 4.46Å; K431-F460 HydrophobicContact CB-CE1 4.24Å; K431-F460 HydrophobicContact CD-CB 3.85Å; K431-F460 HydrophobicContact CD-CD1 3.62Å; K431-F460 HydrophobicContact CD-CD2 4.15Å; K431-F460 HydrophobicContact CD-CE1 4.13Å; K431-F460 HydrophobicContact CD-CG 3.62Å; T451-F460 HydrophobicContact CG2-CD1 3.65Å; T451-F460 HydrophobicContact CG2-CE1 3.57Å; T451-F460 WeakPolarHBondContact OG1-CD1 3.45Å; L458-F460 HydrophobicContact CD2-CE1 4.25Å; L458-F460 HydrophobicContact CD2-CE2 4.25Å; L458-F460 HydrophobicContact CD2-CZ 3.66Å; L458-F460 HydrophobicContact CG-CE2 4.47Å; L458-F460 HydrophobicContact CG-CZ 4.15Å; F460-E480 WeakPolarHBondContact O-CB 3.42Å; F460-E480 PolarHBondContact O-N 3.15Å; F460-F481 PolarHBondContact N-O 2.83Å; F460-F481 PolarHBondContact O-N 3.15Å; F460-V483 HydrophobicContact CE2-CG2 4.09Å; F460-F514 HydrophobicContact CE2-CD2 4.4Å; F460-F514 HydrophobicContact CE2-CE2 4.39Å; F460-F514 HydrophobicContact CE2-CG 4.5Å; F460-F514 HydrophobicContact CE2-CZ 4.49Å; F460-I516 HydrophobicContact CE1-CD1 4.4Å; F460-I516 HydrophobicContact CZ-CD1 4.04Å; F460-I516 HydrophobicContact CZ-CG1 4.43Å
461	H	82	Confident	67.9	Low	33 Å²	33	70 Å²	70	15%	0.153	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	159.7	177.2	-48.5	86.1	0	0	0	110.6	T449 W450 T459 I477	T449-H461 WeakPolarHBondContact CB-O 3.28Å; T449-H461 WeakPolarHBondContact CG2-O 3.37Å; W450-H461 HydrophobicContact CB-CB 4.3Å; W450-H461 AromaticContact CD1-ND1 3.62Å; W450-H461 WeakPolarHBondContact O-CB 3.35Å; W450-H461 PolarHBondContact O-N 2.57Å; W450-H461 PolarHBondContact O-ND1 2.95Å; T459-H461 WeakPolarHBondContact CG2-NE2 3.38Å; H461-I477 HydrophobicContact CB-CG2 3.9Å
462	K	71.4	Confident	65.5	Low	111 Å²	111	77.2 Å²	77.2	48%	0.483	48%	0.478	S	S	.	.			trans	-122.4	138.7	-174.7	-177.2	-157.1	-161.9	112.8	0	109.5	E480	K462-E480 HydrophobicContact CB-CB 4.09Å; K462-E480 HydrophobicContact CB-CG 4.45Å; K462-E480 IonicContact NZ-OE1 2.8Å; K462-E480 PolarHBondContact NZ-OE1 3.07Å
463	D	54.8	Low	62.9	Low	104 Å²	104	85.2 Å²	85.2	56%	0.556	51%	0.51	S	S	*	.			trans	-58.1	133.6	176	-50.9	-44.3	0	0	0	111.1	K465	D463-K465 PolarHBondContact O-N 3.38Å
464	P	49.4	Very low	60.4	Low	119 Å²	119	90.9 Å²	90.9	77%	0.773	54%	0.544	S	S	*	.			trans	-70.4	93.6	177.2	28.9	-33.9	0	0	0	109.9	P466	P464-P466 WeakPolarHBondContact O-CD 3.42Å
465	K	45.4	Very low	58.2	Low	178 Å²	178	93.8 Å²	93.8	77%	0.774	56%	0.563	S	S	*	*			trans	-63.5	122.5	174.7	-69.8	-164.1	173.8	-165.2	0	110.3	D463 S467	D463-K465 PolarHBondContact O-N 3.38Å; K465-S467 PolarHBondContact O-N 3.45Å
466	P	42.8	Very low	56.5	Low	129 Å²	129	97.8 Å²	97.8	84%	0.838	57%	0.565	S	S	*	*			trans	-67.6	107.7	173.8	27.4	-33.3	0	0	0	109.5	P464	P464-P466 WeakPolarHBondContact O-CD 3.42Å
467	S	32.7	Very low	54.9	Low	90 Å²	90	103.4 Å²	103.4	63%	0.629	59%	0.592	S	S	*	*			trans	-89.4	119.3	172.5	-172.8	0	0	0	0	109.2	K465 G469	K465-S467 PolarHBondContact O-N 3.45Å; S467-G469 PolarHBondContact O-N 2.9Å
468	P	40.2	Very low	53	Low	127 Å²	127	105.8 Å²	105.8	83%	0.825	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	127.6	173.6	27	-32.7	0	0	0	109.7
469	G	49.7	Very low	51.4	Low	83 Å²	83	109 Å²	109	86%	0.856	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	110.7	2.1	170.9	0	0	0	0	0	117.9	S467	S467-G469 PolarHBondContact O-N 2.9Å
470	A	35.5	Very low	50.3	Low	82 Å²	82	110.9 Å²	110.9	68%	0.678	64%	0.635	S	S	*	*			trans	-115	86	178.2	0	0	0	0	0	112.6
471	V	46.7	Very low	49.5	Very low	130 Å²	130	115 Å²	115	79%	0.788	65%	0.653	S	S	*	*			trans	-77.9	139.3	172.4	-180	0	0	0	0	109.8
472	N	41.6	Very low	49.5	Very low	151 Å²	151	117.1 Å²	117.1	81%	0.807	67%	0.668	S	S	*	*			trans	68.1	71.5	176.4	-59	-18.3	0	0	0	117.5
473	K	34.9	Very low	50.2	Low	204 Å²	204	112.5 Å²	112.5	89%	0.887	65%	0.649	S	S	*	*			trans	-134.8	152.4	138.2	-73.5	-162.9	176.5	-176.2	0	110.2
474	T	36.4	Very low	51.6	Low	119 Å²	119	113.3 Å²	113.3	73%	0.73	65%	0.65	S	S	*	*			trans	-68.6	156.4	-177.6	41	0	0	0	0	112.7	Q476	T474-Q476 PolarHBondContact O-N 3.31Å
475	N	39.7	Very low	53.5	Low	167 Å²	167	107.7 Å²	107.7	89%	0.893	61%	0.613	S	S	*	*			trans	-69.2	67.4	169.6	-81.6	-4	0	0	0	111.2
476	Q	40.4	Very low	55.3	Low	148 Å²	148	104.2 Å²	104.2	69%	0.692	60%	0.598	S	S	*	*			trans	-89.8	113.4	173.3	-167.7	165.4	68.7	0	0	108.4	T474 V478	T474-Q476 PolarHBondContact O-N 3.31Å; Q476-V478 PolarHBondContact O-N 2.82Å
477	I	51.8	Low	57.2	Low	126 Å²	126	99.4 Å²	99.4	65%	0.646	57%	0.572	S	S	*	*			trans	-68.8	96.2	174.7	-53.4	177.2	0	0	0	107.5	H461 P479	H461-I477 HydrophobicContact CB-CG2 3.9Å; I477-P479 WeakPolarHBondContact O-CD 3.46Å
478	V	48.6	Very low	59.9	Low	97 Å²	97	95.3 Å²	95.3	59%	0.588	54%	0.543	S	S	*	.			trans	-74.5	120.8	179.3	-176.3	0	0	0	0	108.7	Q476 E480	Q476-V478 PolarHBondContact O-N 2.82Å; V478-E480 PolarHBondContact O-N 2.92Å
479	P	57.6	Low	62.3	Low	68 Å²	68	93.1 Å²	93.1	44%	0.442	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	123.5	172.6	27.2	-33.6	0	0	0	108.9	T459 I477	T459-P479 HydrophobicContact CG2-CB 3.52Å; I477-P479 WeakPolarHBondContact O-CD 3.46Å
480	E	64.6	Low	64.4	Low	62 Å²	62	90.5 Å²	90.5	29%	0.29	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	-42.6	-175.2	-168.3	-170	-126.5	0	0	110.9	K431 F460 K462 V478	K431-E480 IonicContact NZ-OE2 3.81Å; K431-E480 PolarHBondContact NZ-OE2 2.85Å; F460-E480 WeakPolarHBondContact O-CB 3.42Å; F460-E480 PolarHBondContact O-N 3.15Å; K462-E480 HydrophobicContact CB-CB 4.09Å; K462-E480 HydrophobicContact CB-CG 4.45Å; K462-E480 IonicContact NZ-OE1 2.8Å; K462-E480 PolarHBondContact NZ-OE1 3.07Å; V478-E480 PolarHBondContact O-N 2.92Å
481	F	74.2	Confident	67.1	Low	86 Å²	86	87.7 Å²	87.7	38%	0.377	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	140.6	171.7	-78.3	-80.4	0	0	0	110.2	K433 F460 F514	K433-F481 VanDerWaalsContact NZ-CE1 3.31Å; F460-F481 PolarHBondContact N-O 2.83Å; F460-F481 PolarHBondContact O-N 3.15Å; F481-F514 HydrophobicContact CB-CZ 4.3Å; F481-F514 HydrophobicContact CG-CZ 4.44Å
482	T	82.3	Confident	69.3	Low	79 Å²	79	86.6 Å²	86.6	49%	0.485	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	136.7	177.9	-63.6	0	0	0	0	109.1	V457 T459	V457-T482 HydrophobicContact CG1-CG2 3.2Å; T459-T482 PolarHBondContact OG1-OG1 2.95Å
483	V	84.4	Confident	71.6	Confident	14 Å²	14	80.4 Å²	80.4	9%	0.085	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	116.2	-178.1	-174.5	0	0	0	0	109.1	L458 F460 L485 L506 F514	L458-V483 PolarHBondContact N-O 2.81Å; L458-V483 PolarHBondContact O-N 3.46Å; F460-V483 HydrophobicContact CE2-CG2 4.09Å; V483-L485 HydrophobicContact CG1-CD2 4.35Å; V483-L485 PolarHBondContact O-N 3.2Å; V483-L506 HydrophobicContact CG1-CD2 4.31Å; V483-F514 HydrophobicContact CG2-CD2 4.07Å; V483-F514 HydrophobicContact CG2-CE2 3.61Å
484	E	85.8	Confident	74.1	Confident	121 Å²	121	73.8 Å²	73.8	57%	0.565	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.5	123.7	168.4	-170.4	-172.7	167.6	0	0	109	K486	E484-K486 VanDerWaalsContact C-N 3.34Å; E484-K486 HydrophobicContact CG-CB 4Å; E484-K486 WeakPolarHBondContact OE1-CB 3.38Å
485	L	88.2	Confident	76.1	Confident	0 Å²	0	77.3 Å²	77.3	0%	0	41%	0.406	C	S	.	.			trans	-85.3	-6.5	-177.1	-61	-176.4	0	0	0	113.5	L453 G456 L458 V483 G487 A488 L506 L531 T534 I535 L538	L453-L485 HydrophobicContact CD1-CD1 3.46Å; L453-L485 VanDerWaalsContact CD1-CD1 3.46Å; G456-L485 VanDerWaalsContact O-CB 3.29Å; G456-L485 WeakPolarHBondContact O-CB 3.36Å; G456-L485 PolarHBondContact O-N 2.87Å; L458-L485 HydrophobicContact CB-CD1 4.31Å; L458-L485 HydrophobicContact CB-CD2 4.02Å; L458-L485 HydrophobicContact CB-CG 4.23Å; V483-L485 HydrophobicContact CG1-CD2 4.35Å; V483-L485 PolarHBondContact O-N 3.2Å; L485-G487 PolarHBondContact O-N 2.98Å; L485-A488 HydrophobicContact CD2-CB 4.4Å; L485-A488 WeakPolarHBondContact O-CB 3.49Å; L485-A488 PolarHBondContact O-N 2.88Å; L485-L506 HydrophobicContact CD2-CD1 3.89Å; L485-L506 HydrophobicContact CD2-CD2 4.15Å; L485-L531 HydrophobicContact CD1-CD2 3.69Å; L485-T534 HydrophobicContact CD1-CG2 4.19Å; L485-I535 HydrophobicContact CB-CG1 3.9Å; L485-L538 HydrophobicContact CB-CD1 3.93Å
486	K	83.9	Confident	78	Confident	106 Å²	106	75.3 Å²	75.3	46%	0.461	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	96.4	-176.2	-175.7	173.4	-175.9	174	0	111.5	E484 A488 K509 L538	E484-K486 VanDerWaalsContact C-N 3.34Å; E484-K486 HydrophobicContact CG-CB 4Å; E484-K486 WeakPolarHBondContact OE1-CB 3.38Å; K486-A488 VanDerWaalsContact C-N 3.33Å; K486-K509 WeakPolarHBondContact O-CD 3.4Å; K486-K509 WeakPolarHBondContact O-CE 3.46Å; K486-K509 PolarHBondContact O-NZ 2.82Å; K486-L538 HydrophobicContact CB-CB 4.28Å; K486-L538 HydrophobicContact CB-CD1 4.33Å; K486-L538 HydrophobicContact CG-CB 4.26Å
487	G	81.6	Confident	79.9	Confident	28 Å²	28	70.9 Å²	70.9	29%	0.289	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.4	29.7	-172.1	0	0	0	0	0	113.8	L485 K509	L485-G487 PolarHBondContact O-N 2.98Å; G487-K509 WeakPolarHBondContact O-CE 3.3Å; G487-K509 WeakPolarHBondContact O-CG 3.48Å
488	A	89.3	Confident	81.5	Confident	3 Å²	3	65.5 Å²	65.5	3%	0.025	35%	0.348	C	S	.	.			trans	-70.8	171.1	153	0	0	0	0	0	109.8	L485 K486 L506 K507 I535	L485-A488 HydrophobicContact CD2-CB 4.4Å; L485-A488 WeakPolarHBondContact O-CB 3.49Å; L485-A488 PolarHBondContact O-N 2.88Å; K486-A488 VanDerWaalsContact C-N 3.33Å; A488-L506 HydrophobicContact CB-CD1 4.16Å; A488-K507 CarbonylContact C-O 3.52Å; A488-K507 WeakPolarHBondContact CA-O 3.43Å; A488-K507 VanDerWaalsContact CB-O 3.24Å; A488-K507 WeakPolarHBondContact CB-O 3.45Å; A488-I535 HydrophobicContact CB-CD1 4.2Å; A488-I535 HydrophobicContact CB-CG1 4.44Å; A488-I535 WeakPolarHBondContact O-CG2 3.23Å
489	T	90.3	Very high	83.1	Confident	81 Å²	81	65.2 Å²	65.2	50%	0.497	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	142.3	167.5	59.5	0	0	0	0	111.2	L506 K507	T489-L506 CarbonylContact O-C 3.55Å; T489-L506 WeakPolarHBondContact O-CA 3.37Å; T489-K507 PolarHBondContact N-O 3.2Å; T489-K507 PolarHBondContact O-N 2.85Å
490	I	93.8	Very high	84.5	Confident	29 Å²	29	65.5 Å²	65.5	15%	0.149	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	142.9	176.2	-168.9	72.5	0	0	0	108.8	L504 E505 L506 L531 K532 I535	I490-L504 HydrophobicContact CD1-CB 3.96Å; I490-L504 HydrophobicContact CD1-CD1 4.39Å; I490-E505 WeakPolarHBondContact CA-O 3.38Å; I490-L506 HydrophobicContact CD1-CB 3.79Å; I490-L506 HydrophobicContact CD1-CD1 4.11Å; I490-L531 HydrophobicContact CD1-CD1 4.13Å; I490-L531 HydrophobicContact CG1-CB 4.26Å; I490-K532 HydrophobicContact CG2-CB 3.76Å; I490-K532 HydrophobicContact CG2-CG 4.29Å; I490-I535 HydrophobicContact CB-CD1 3.77Å; I490-I535 HydrophobicContact CG2-CD1 3.72Å
491	G	92.6	Very high	85.6	Confident	23 Å²	23	71 Å²	71	24%	0.237	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.7	-178.6	172.1	0	0	0	0	0	111.6	L504 E505	G491-L504 CarbonylContact O-C 3.53Å; G491-L504 VanDerWaalsContact O-CA 3.31Å; G491-L504 WeakPolarHBondContact O-CA 3.27Å; G491-E505 PolarHBondContact N-O 3.17Å; G491-E505 VanDerWaalsContact N-O 3.15Å; G491-E505 PolarHBondContact O-N 2.76Å
492	W	93.2	Very high	86.5	Confident	107 Å²	107	68.4 Å²	68.4	41%	0.405	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	132	175.6	-67.3	105.2	0	0	0	111.4	L504 I524 H525 H528	W492-L504 HydrophobicContact CD2-CD2 3.85Å; W492-L504 HydrophobicContact CE3-CD2 3.51Å; W492-L504 HydrophobicContact CH2-CD2 3.67Å; W492-L504 HydrophobicContact CZ2-CD2 4.01Å; W492-L504 HydrophobicContact CZ3-CD2 3.41Å; W492-L504 VanDerWaalsContact CZ3-CD2 3.41Å; W492-L504 HydrophobicContact CZ3-CG 4.45Å; W492-I524 HydrophobicContact CH2-CG1 4.45Å; W492-I524 HydrophobicContact CH2-CG2 3.95Å; W492-I524 HydrophobicContact CZ3-CG1 4.4Å; W492-I524 HydrophobicContact CZ3-CG2 4.24Å; W492-H525 AromaticContact CH2-CD2 3.45Å; W492-H525 VanDerWaalsContact CH2-CD2 3.45Å; W492-H525 WeakPolarHBondContact CH2-CD2 3.31Å; W492-H525 AromaticContact CH2-NE2 3.43Å; W492-H525 WeakPolarHBondContact CH2-NE2 3.39Å; W492-H525 AromaticContact CZ2-CD2 3.62Å; W492-H525 AromaticContact CZ2-CE1 3.67Å; W492-H525 AromaticContact CZ2-NE2 3.33Å; W492-H525 VanDerWaalsContact CZ2-NE2 3.33Å; W492-H525 WeakPolarHBondContact CZ2-NE2 3.41Å; W492-H528 AromaticContact CE2-ND1 3.94Å; W492-H528 HydrophobicContact CZ2-CB 4.22Å; W492-H528 AromaticContact CZ2-ND1 3.94Å; W492-H528 AromaticContact NE1-CE1 3.58Å; W492-H528 AromaticContact NE1-ND1 3.7Å
493	A	90.1	Very high	87	Confident	20 Å²	20	64.9 Å²	64.9	17%	0.165	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-75.1	128.3	-179.7	0	0	0	0	0	111.1	V503 E505 L515	A493-V503 HydrophobicContact CB-CB 3.96Å; A493-V503 HydrophobicContact CB-CG1 3.59Å; A493-V503 PolarHBondContact N-O 3.15Å; A493-E505 HydrophobicContact CB-CB 4.05Å; A493-L515 HydrophobicContact CB-CD2 3.7Å
494	T	86.6	Confident	87.5	Confident	66 Å²	66	64.2 Å²	64.2	41%	0.405	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-67.5	155.9	178.8	52.5	0	0	0	0	112.5	D496 K497 S498	T494-D496 WeakPolarHBondContact CB-OD1 3.08Å; T494-D496 PolarHBondContact O-N 3.3Å; T494-D496 VanDerWaalsContact O-N 3.15Å; T494-D496 PolarHBondContact OG1-OD1 2.88Å; T494-K497 WeakPolarHBondContact O-CA 3.41Å; T494-K497 WeakPolarHBondContact O-CB 3.47Å; T494-K497 PolarHBondContact O-N 3.44Å; T494-K497 WeakPolarHBondContact OG1-CD 3.4Å; T494-K497 VanDerWaalsContact OG1-CE 3.28Å; T494-K497 WeakPolarHBondContact OG1-CE 3.45Å; T494-K497 WeakPolarHBondContact OG1-CG 3.38Å; T494-S498 PolarHBondContact O-N 3.01Å
495	K	79.1	Confident	87.9	Confident	193 Å²	193	59.2 Å²	59.2	84%	0.839	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-21.8	-170.3	-166.4	174.9	-179.8	179.8	0	114.4	S498	K495-S498 CarbonylContact C-O 3.57Å; K495-S498 WeakPolarHBondContact CA-O 3.43Å; K495-S498 CarbonylContact O-C 3.26Å
496	D	80.7	Confident	88.2	Confident	125 Å²	125	59.2 Å²	59.2	67%	0.668	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-31.1	170	66.7	-63.5	0	0	0	112.5	T494	T494-D496 WeakPolarHBondContact CB-OD1 3.08Å; T494-D496 PolarHBondContact O-N 3.3Å; T494-D496 VanDerWaalsContact O-N 3.15Å; T494-D496 PolarHBondContact OG1-OD1 2.88Å
497	K	80.3	Confident	88.5	Confident	54 Å²	54	57.2 Å²	57.2	24%	0.235	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-34.8	178.4	-58.6	-179.6	-165.4	174.5	0	111.7	K444 T494 E505 L515	K444-K497 PolarHBondContact NZ-O 3.04Å; T494-K497 WeakPolarHBondContact O-CA 3.41Å; T494-K497 WeakPolarHBondContact O-CB 3.47Å; T494-K497 PolarHBondContact O-N 3.44Å; T494-K497 WeakPolarHBondContact OG1-CD 3.4Å; T494-K497 VanDerWaalsContact OG1-CE 3.28Å; T494-K497 WeakPolarHBondContact OG1-CE 3.45Å; T494-K497 WeakPolarHBondContact OG1-CG 3.38Å; K497-E505 WeakPolarHBondContact CD-OE1 3.37Å; K497-E505 VanDerWaalsContact CD-OE2 3.23Å; K497-E505 WeakPolarHBondContact CD-OE2 3.33Å; K497-E505 IonicContact NZ-OE1 2.68Å; K497-E505 PolarHBondContact NZ-OE1 2.95Å; K497-E505 IonicContact NZ-OE2 3.08Å; K497-E505 PolarHBondContact NZ-OE2 2.77Å; K497-L515 WeakPolarHBondContact O-CD1 3.39Å
498	S	84.3	Confident	88.8	Confident	14 Å²	14	56.4 Å²	56.4	10%	0.098	29%	0.291	C	S	.	.			trans	-146.7	139.5	171.6	-161.6	0	0	0	0	113.4	T494 K495 K500	T494-S498 PolarHBondContact O-N 3.01Å; K495-S498 CarbonylContact C-O 3.57Å; K495-S498 WeakPolarHBondContact CA-O 3.43Å; K495-S498 CarbonylContact O-C 3.26Å; S498-K500 PolarHBondContact OG-N 2.88Å
499	S	82.6	Confident	88.3	Confident	91 Å²	91	62.9 Å²	62.9	64%	0.636	32%	0.319	S	S	*	.	S	Bend	trans	-94.4	7.1	168.5	86.2	0	0	0	0	113	R588	S499-R588 PolarHBondContact OG-NH2 2.84Å; S499-R588 VanDerWaalsContact OG-NH2 3.17Å
500	K	87	Confident	87.6	Confident	73 Å²	73	65.2 Å²	65.2	32%	0.317	33%	0.328	S	S	.	.	S	Bend	trans	-83.8	148.2	168.7	-74.4	-169	168.1	-168.1	0	108.8	W446 S498 V503 Q517	W446-K500 HydrophobicContact CD2-CD 4.43Å; W446-K500 HydrophobicContact CH2-CD 4.48Å; W446-K500 HydrophobicContact CZ2-CD 4.18Å; S498-K500 PolarHBondContact OG-N 2.88Å; K500-V503 HydrophobicContact CB-CG2 3.62Å; K500-V503 WeakPolarHBondContact O-CG2 3.48Å; K500-Q517 HydrophobicContact CB-CG 4.42Å; K500-Q517 HydrophobicContact CD-CG 3.86Å
501	K	88.1	Confident	86.7	Confident	177 Å²	177	65.5 Å²	65.5	77%	0.77	34%	0.338	S	S	*	.	S	Bend	trans	-68.5	166.1	160.5	-64.9	-172.8	176.8	-172.2	0	109.8	V503	K501-V503 WeakPolarHBondContact O-CG2 3.31Å; K501-V503 PolarHBondContact O-N 3.1Å
502	N	91.9	Very high	86.4	Confident	32 Å²	32	65.5 Å²	65.5	17%	0.171	33%	0.333	C	S	.	.	S	Bend	trans	61.7	46.3	164.2	-62.4	3.7	0	0	0	113	Q517 Y518 D519 E521 I524	N502-Q517 WeakPolarHBondContact O-CA 3.4Å; N502-Q517 VanDerWaalsContact O-CG 3.3Å; N502-Q517 WeakPolarHBondContact O-CG 3.18Å; N502-Y518 WeakPolarHBondContact CB-O 3.41Å; N502-D519 PolarHBondContact ND2-O 2.96Å; N502-E521 WeakPolarHBondContact ND2-CA 3.45Å; N502-I524 HydrophobicContact CB-CG2 3.69Å
503	V	93.7	Very high	86.2	Confident	6 Å²	6	62.6 Å²	62.6	4%	0.036	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	127.1	-174.5	-171.2	0	0	0	0	112.4	W446 A493 K500 K501 L515 I516 Q517	W446-V503 HydrophobicContact CH2-CG1 3.95Å; W446-V503 HydrophobicContact CH2-CG2 4.47Å; A493-V503 HydrophobicContact CB-CB 3.96Å; A493-V503 HydrophobicContact CB-CG1 3.59Å; A493-V503 PolarHBondContact N-O 3.15Å; K500-V503 HydrophobicContact CB-CG2 3.62Å; K500-V503 WeakPolarHBondContact O-CG2 3.48Å; K501-V503 WeakPolarHBondContact O-CG2 3.31Å; K501-V503 PolarHBondContact O-N 3.1Å; V503-L515 HydrophobicContact CG1-CB 3.94Å; V503-L515 HydrophobicContact CG1-CD2 4.23Å; V503-L515 HydrophobicContact CG1-CG 4.48Å; V503-I516 CarbonylContact C-O 3.59Å; V503-I516 WeakPolarHBondContact CA-O 3.34Å; V503-Q517 HydrophobicContact CG2-CB 4.17Å; V503-Q517 HydrophobicContact CG2-CG 3.94Å
504	L	94.9	Very high	86.3	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	146.4	170.1	-48.9	178.5	0	0	0	110.9	I490 G491 W492 L515 I516 I524 H528	I490-L504 HydrophobicContact CD1-CB 3.96Å; I490-L504 HydrophobicContact CD1-CD1 4.39Å; G491-L504 CarbonylContact O-C 3.53Å; G491-L504 VanDerWaalsContact O-CA 3.31Å; G491-L504 WeakPolarHBondContact O-CA 3.27Å; W492-L504 HydrophobicContact CD2-CD2 3.85Å; W492-L504 HydrophobicContact CE3-CD2 3.51Å; W492-L504 HydrophobicContact CH2-CD2 3.67Å; W492-L504 HydrophobicContact CZ2-CD2 4.01Å; W492-L504 HydrophobicContact CZ3-CD2 3.41Å; W492-L504 VanDerWaalsContact CZ3-CD2 3.41Å; W492-L504 HydrophobicContact CZ3-CG 4.45Å; L504-L515 CarbonylContact O-C 3.58Å; L504-L515 VanDerWaalsContact O-CA 3.26Å; L504-L515 WeakPolarHBondContact O-CA 3.45Å; L504-I516 HydrophobicContact CB-CB 4.43Å; L504-I516 PolarHBondContact N-O 2.69Å; L504-I516 PolarHBondContact O-N 2.66Å; L504-I524 HydrophobicContact CD1-CD1 3.73Å; L504-I524 HydrophobicContact CD1-CG1 4.03Å; L504-I524 HydrophobicContact CD2-CG1 4.3Å; L504-I524 HydrophobicContact CG-CD1 3.89Å; L504-I524 HydrophobicContact CG-CG1 3.87Å; L504-H528 HydrophobicContact CD1-CB 3.77Å; L504-H528 HydrophobicContact CD2-CB 3.7Å; L504-H528 HydrophobicContact CG-CB 4.4Å
505	E	94.1	Very high	86.7	Confident	15 Å²	15	58.8 Å²	58.8	7%	0.07	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	115	169.4	-178.1	178.7	-172	0	0	108.9	I490 G491 A493 K497 K507 L515	I490-E505 WeakPolarHBondContact CA-O 3.38Å; G491-E505 PolarHBondContact N-O 3.17Å; G491-E505 VanDerWaalsContact N-O 3.15Å; G491-E505 PolarHBondContact O-N 2.76Å; A493-E505 HydrophobicContact CB-CB 4.05Å; K497-E505 WeakPolarHBondContact CD-OE1 3.37Å; K497-E505 VanDerWaalsContact CD-OE2 3.23Å; K497-E505 WeakPolarHBondContact CD-OE2 3.33Å; K497-E505 IonicContact NZ-OE1 2.68Å; K497-E505 PolarHBondContact NZ-OE1 2.95Å; K497-E505 IonicContact NZ-OE2 3.08Å; K497-E505 PolarHBondContact NZ-OE2 2.77Å; E505-K507 HydrophobicContact CG-CG 4.36Å; E505-K507 WeakPolarHBondContact OE1-CE 3.3Å; E505-K507 IonicContact OE1-NZ 2.81Å; E505-K507 PolarHBondContact OE1-NZ 2.72Å; E505-L515 HydrophobicContact CB-CD2 3.9Å; E505-L515 HydrophobicContact CG-CD2 4.11Å
506	L	93.6	Very high	87.4	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	122.4	175.3	175.3	64.4	0	0	0	109.3	L458 V483 L485 A488 T489 I490 E513 F514 I516 I535	L458-L506 HydrophobicContact CD2-CD2 3.58Å; V483-L506 HydrophobicContact CG1-CD2 4.31Å; L485-L506 HydrophobicContact CD2-CD1 3.89Å; L485-L506 HydrophobicContact CD2-CD2 4.15Å; A488-L506 HydrophobicContact CB-CD1 4.16Å; T489-L506 CarbonylContact O-C 3.55Å; T489-L506 WeakPolarHBondContact O-CA 3.37Å; I490-L506 HydrophobicContact CD1-CB 3.79Å; I490-L506 HydrophobicContact CD1-CD1 4.11Å; L506-E513 WeakPolarHBondContact O-CA 3.43Å; L506-F514 PolarHBondContact N-O 3.22Å; L506-F514 PolarHBondContact O-N 3.27Å; L506-I516 HydrophobicContact CB-CD1 4.16Å; L506-I516 HydrophobicContact CD2-CD1 4.03Å; L506-I535 HydrophobicContact CD1-CD1 4.25Å
507	K	90.9	Very high	88.1	Confident	65 Å²	65	43.8 Å²	43.8	28%	0.283	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	111.6	175.5	-48.4	-176	-179	-93.4	0	109.9	A488 T489 E505 E513	A488-K507 CarbonylContact C-O 3.52Å; A488-K507 WeakPolarHBondContact CA-O 3.43Å; A488-K507 VanDerWaalsContact CB-O 3.24Å; A488-K507 WeakPolarHBondContact CB-O 3.45Å; T489-K507 PolarHBondContact N-O 3.2Å; T489-K507 PolarHBondContact O-N 2.85Å; E505-K507 HydrophobicContact CG-CG 4.36Å; E505-K507 WeakPolarHBondContact OE1-CE 3.3Å; E505-K507 IonicContact OE1-NZ 2.81Å; E505-K507 PolarHBondContact OE1-NZ 2.72Å; K507-E513 HydrophobicContact CB-CG 4.29Å; K507-E513 HydrophobicContact CG-CG 4.03Å; K507-E513 IonicContact NZ-OE1 3.16Å; K507-E513 PolarHBondContact NZ-OE1 2.77Å
508	G	86.9	Confident	88.8	Confident	11 Å²	11	44.7 Å²	44.7	11%	0.113	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	151.9	172.1	0	0	0	0	0	111.9	N510 G511 V512	G508-N510 PolarHBondContact O-N 3.13Å; G508-G511 PolarHBondContact O-N 3.09Å; G508-V512 PolarHBondContact N-O 3.19Å
509	K	80.2	Confident	89	Confident	139 Å²	139	49.7 Å²	49.7	60%	0.604	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-31.5	-178.9	-80.9	-178.3	164.7	161.9	0	114.9	K486 G487 G511	K486-K509 WeakPolarHBondContact O-CD 3.4Å; K486-K509 WeakPolarHBondContact O-CE 3.46Å; K486-K509 PolarHBondContact O-NZ 2.82Å; G487-K509 WeakPolarHBondContact O-CE 3.3Å; G487-K509 WeakPolarHBondContact O-CG 3.48Å; K509-G511 PolarHBondContact O-N 3.34Å
510	N	75.9	Confident	89.4	Confident	130 Å²	130	48.5 Å²	48.5	70%	0.695	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.2	18.9	-174.8	-58	0.5	0	0	0	113.4	N437 G508 V512	N437-N510 PolarHBondContact OD1-O 2.86Å; G508-N510 PolarHBondContact O-N 3.13Å; N510-V512 VanDerWaalsContact C-N 3.26Å; N510-V512 HydrophobicContact CB-CG2 4.4Å; N510-V512 PolarHBondContact O-N 2.71Å
511	G	74.9	Confident	89.6	Confident	34 Å²	34	50.7 Å²	50.7	35%	0.351	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.4	32.2	-175.4	0	0	0	0	0	113	N437 G508 K509	N437-G511 PolarHBondContact N-O 3.09Å; N437-G511 VanDerWaalsContact N-O 3.09Å; G508-G511 PolarHBondContact O-N 3.09Å; K509-G511 PolarHBondContact O-N 3.34Å
512	V	84.9	Confident	89.6	Confident	23 Å²	23	45.9 Å²	45.9	14%	0.139	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	122.2	177.7	178.1	0	0	0	0	108.8	K433 G508 N510 F514	K433-V512 HydrophobicContact CG-CG1 4.41Å; G508-V512 PolarHBondContact N-O 3.19Å; N510-V512 VanDerWaalsContact C-N 3.26Å; N510-V512 HydrophobicContact CB-CG2 4.4Å; N510-V512 PolarHBondContact O-N 2.71Å; V512-F514 HydrophobicContact CG1-CD2 4.05Å; V512-F514 HydrophobicContact CG1-CE2 3.47Å; V512-F514 VanDerWaalsContact CG1-CE2 3.47Å; V512-F514 HydrophobicContact CG1-CZ 4.03Å
513	E	90.4	Very high	89.5	Confident	47 Å²	47	47.1 Å²	47.1	22%	0.22	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	135.2	-179.4	-58.2	171.1	134.8	0	0	110.6	I434 S435 L506 K507	I434-E513 HydrophobicContact CD1-CB 3.99Å; I434-E513 HydrophobicContact CG1-CB 3.49Å; I434-E513 VanDerWaalsContact CG1-CB 3.49Å; I434-E513 PolarHBondContact N-O 3.44Å; S435-E513 WeakPolarHBondContact CB-OE2 3.33Å; S435-E513 PolarHBondContact O-N 3.43Å; S435-E513 VanDerWaalsContact OG-CB 3.29Å; S435-E513 WeakPolarHBondContact OG-CB 3.16Å; S435-E513 WeakPolarHBondContact OG-CG 3.48Å; S435-E513 PolarHBondContact OG-N 3.44Å; S435-E513 PolarHBondContact OG-OE2 3.32Å; L506-E513 WeakPolarHBondContact O-CA 3.43Å; K507-E513 HydrophobicContact CB-CG 4.29Å; K507-E513 HydrophobicContact CG-CG 4.03Å; K507-E513 IonicContact NZ-OE1 3.16Å; K507-E513 PolarHBondContact NZ-OE1 2.77Å
514	F	92.1	Very high	89.6	Confident	5 Å²	5	46.9 Å²	46.9	2%	0.022	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	146.9	174.3	-70.5	-83.2	0	0	0	110.6	T432 K433 F460 F481 V483 L506 V512	T432-F514 CarbonylContact O-C 3.55Å; T432-F514 WeakPolarHBondContact O-CA 3.37Å; K433-F514 HydrophobicContact CB-CD1 4.07Å; K433-F514 HydrophobicContact CB-CE1 3.85Å; K433-F514 HydrophobicContact CD-CE1 4.23Å; K433-F514 HydrophobicContact CD-CZ 4.29Å; K433-F514 HydrophobicContact CG-CD1 4.17Å; K433-F514 HydrophobicContact CG-CE1 3.76Å; K433-F514 HydrophobicContact CG-CZ 4.1Å; F460-F514 HydrophobicContact CE2-CD2 4.4Å; F460-F514 HydrophobicContact CE2-CE2 4.39Å; F460-F514 HydrophobicContact CE2-CG 4.5Å; F460-F514 HydrophobicContact CE2-CZ 4.49Å; F481-F514 HydrophobicContact CB-CZ 4.3Å; F481-F514 HydrophobicContact CG-CZ 4.44Å; V483-F514 HydrophobicContact CG2-CD2 4.07Å; V483-F514 HydrophobicContact CG2-CE2 3.61Å; L506-F514 PolarHBondContact N-O 3.22Å; L506-F514 PolarHBondContact O-N 3.27Å; V512-F514 HydrophobicContact CG1-CD2 4.05Å; V512-F514 HydrophobicContact CG1-CE2 3.47Å; V512-F514 VanDerWaalsContact CG1-CE2 3.47Å; V512-F514 HydrophobicContact CG1-CZ 4.03Å
515	L	93.8	Very high	89.4	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	134.1	158.9	-58.3	175.5	0	0	0	108.6	K431 T432 I434 K444 W446 A493 K497 V503 L504 E505	K431-L515 CarbonylContact C-O 3.59Å; K431-L515 VanDerWaalsContact CA-O 3.32Å; K431-L515 WeakPolarHBondContact CA-O 3.49Å; T432-L515 HydrophobicContact CG2-CB 3.85Å; T432-L515 HydrophobicContact CG2-CD1 4.24Å; T432-L515 HydrophobicContact CG2-CG 4.4Å; T432-L515 PolarHBondContact N-O 2.65Å; T432-L515 PolarHBondContact O-N 3.04Å; I434-L515 HydrophobicContact CD1-CD2 4.07Å; I434-L515 HydrophobicContact CD1-CG 4.08Å; I434-L515 HydrophobicContact CG2-CD1 3.72Å; I434-L515 HydrophobicContact CG2-CG 3.69Å; K444-L515 HydrophobicContact CD-CD1 4.46Å; W446-L515 HydrophobicContact CH2-CB 3.61Å; W446-L515 HydrophobicContact CH2-CD1 4.42Å; W446-L515 HydrophobicContact CZ2-CB 4.24Å; W446-L515 HydrophobicContact CZ2-CD1 4.28Å; W446-L515 HydrophobicContact CZ3-CB 4.23Å; A493-L515 HydrophobicContact CB-CD2 3.7Å; K497-L515 WeakPolarHBondContact O-CD1 3.39Å; V503-L515 HydrophobicContact CG1-CB 3.94Å; V503-L515 HydrophobicContact CG1-CD2 4.23Å; V503-L515 HydrophobicContact CG1-CG 4.48Å; L504-L515 CarbonylContact O-C 3.58Å; L504-L515 VanDerWaalsContact O-CA 3.26Å; L504-L515 WeakPolarHBondContact O-CA 3.45Å; E505-L515 HydrophobicContact CB-CD2 3.9Å; E505-L515 HydrophobicContact CG-CD2 4.11Å
516	I	94.5	Very high	89.3	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	135.4	-178.5	-57.3	175.1	0	0	0	107.5	L429 N430 L458 F460 V503 L504 L506 I524 L531	L429-I516 HydrophobicContact CB-CG2 4.1Å; L429-I516 HydrophobicContact CD1-CG2 3.73Å; L429-I516 HydrophobicContact CG-CG2 4.37Å; N430-I516 CarbonylContact O-C 3.57Å; N430-I516 WeakPolarHBondContact O-CA 3.19Å; L458-I516 HydrophobicContact CD2-CD1 4.03Å; F460-I516 HydrophobicContact CE1-CD1 4.4Å; F460-I516 HydrophobicContact CZ-CD1 4.04Å; F460-I516 HydrophobicContact CZ-CG1 4.43Å; V503-I516 CarbonylContact C-O 3.59Å; V503-I516 WeakPolarHBondContact CA-O 3.34Å; L504-I516 HydrophobicContact CB-CB 4.43Å; L504-I516 PolarHBondContact N-O 2.69Å; L504-I516 PolarHBondContact O-N 2.66Å; L506-I516 HydrophobicContact CB-CD1 4.16Å; L506-I516 HydrophobicContact CD2-CD1 4.03Å; I516-I524 HydrophobicContact CG2-CD1 4.47Å; I516-L531 HydrophobicContact CD1-CD1 4.49Å
517	Q	95.2	Very high	89.4	Confident	3 Å²	3	54.6 Å²	54.6	1%	0.014	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	145.8	-175.8	-177.1	-96	-35.5	0	0	111.9	N430 W446 K500 N502 V503 D519	N430-Q517 HydrophobicContact CB-CB 4.38Å; N430-Q517 WeakPolarHBondContact CB-O 3.47Å; N430-Q517 PolarHBondContact N-O 2.84Å; N430-Q517 PolarHBondContact ND2-OE1 2.98Å; N430-Q517 PolarHBondContact O-N 3.35Å; W446-Q517 HydrophobicContact CE3-CB 4.43Å; W446-Q517 HydrophobicContact CH2-CB 3.94Å; W446-Q517 HydrophobicContact CZ3-CB 3.59Å; K500-Q517 HydrophobicContact CB-CG 4.42Å; K500-Q517 HydrophobicContact CD-CG 3.86Å; N502-Q517 WeakPolarHBondContact O-CA 3.4Å; N502-Q517 VanDerWaalsContact O-CG 3.3Å; N502-Q517 WeakPolarHBondContact O-CG 3.18Å; V503-Q517 HydrophobicContact CG2-CB 4.17Å; V503-Q517 HydrophobicContact CG2-CG 3.94Å; Q517-D519 PolarHBondContact NE2-OD1 3.23Å
518	Y	94	Very high	89.5	Confident	74 Å²	74	53 Å²	53	29%	0.29	28%	0.28	S	S	.	.			trans	-135.5	155.9	165.8	-159.2	-99.4	0	0	0	108.8	I428 L429 N502 I523	I428-Y518 WeakPolarHBondContact O-CD2 3.2Å; I428-Y518 VanDerWaalsContact O-CE2 3.28Å; I428-Y518 WeakPolarHBondContact O-CE2 3.3Å; L429-Y518 HydrophobicContact CD2-CD2 3.93Å; L429-Y518 HydrophobicContact CD2-CG 4.36Å; N502-Y518 WeakPolarHBondContact CB-O 3.41Å; Y518-I523 HydrophobicContact CD1-CB 3.79Å; Y518-I523 HydrophobicContact CD1-CD1 4.25Å; Y518-I523 HydrophobicContact CD1-CG2 3.57Å; Y518-I523 HydrophobicContact CD2-CG2 4.43Å; Y518-I523 HydrophobicContact CE1-CB 4.06Å; Y518-I523 HydrophobicContact CE1-CD1 3.61Å; Y518-I523 HydrophobicContact CE1-CG1 4.41Å; Y518-I523 HydrophobicContact CE1-CG2 3.84Å; Y518-I523 HydrophobicContact CG-CG2 3.9Å
519	D	89.9	Confident	89.8	Confident	118 Å²	118	58.6 Å²	58.6	63%	0.631	30%	0.302	S	S	*	.	S	Bend	trans	-80.5	-42.4	-174.8	-64.4	-51.8	0	0	0	111.3	N502 Q517	N502-D519 PolarHBondContact ND2-O 2.96Å; Q517-D519 PolarHBondContact NE2-OD1 3.23Å
520	T	91.1	Very high	90.3	Very high	66 Å²	66	53 Å²	53	41%	0.405	28%	0.279	S	S	.	.	S	Bend	trans	-69.7	131	172.6	-44.5	0	0	0	0	112.4	I523 I524	T520-I523 HydrophobicContact CG2-CD1 4.22Å; T520-I523 HydrophobicContact CG2-CG1 4.33Å; T520-I524 PolarHBondContact O-N 3.4Å
521	E	90.1	Very high	91.1	Very high	120 Å²	120	46.9 Å²	46.9	56%	0.561	25%	0.246	S	C	*	.	H	α-helix	trans	-68.8	-50	-175.3	-171.7	167.2	174	0	0	113.3	N502 I523 I524 H525	N502-E521 WeakPolarHBondContact ND2-CA 3.45Å; E521-I523 VanDerWaalsContact C-N 3.32Å; E521-I523 PolarHBondContact O-N 3.08Å; E521-I524 WeakPolarHBondContact O-CG2 3.19Å; E521-I524 PolarHBondContact O-N 2.89Å; E521-H525 PolarHBondContact O-CD2 2.84Å; E521-H525 VanDerWaalsContact O-CD2 3.27Å; E521-H525 PolarHBondContact O-N 2.83Å
522	S	88.8	Confident	91.8	Very high	75 Å²	75	49.7 Å²	49.7	52%	0.524	25%	0.248	S	C	.	.	H	α-helix	trans	-54.2	-47.3	177.8	51.8	0	0	0	0	112.3	I524 H525 D526	S522-I524 PolarHBondContact O-N 3.2Å; S522-H525 PolarHBondContact O-N 2.83Å; S522-H525 VanDerWaalsContact O-N 3.15Å; S522-D526 PolarHBondContact O-N 3.41Å
523	I	90.3	Very high	91.9	Very high	59 Å²	59	51 Å²	51	30%	0.303	26%	0.255	S	S	.	.	H	α-helix	trans	-60.8	-44.8	179.7	-68.3	172	0	0	0	111.3	Y518 T520 E521 H525 D526 W527	Y518-I523 HydrophobicContact CD1-CB 3.79Å; Y518-I523 HydrophobicContact CD1-CD1 4.25Å; Y518-I523 HydrophobicContact CD1-CG2 3.57Å; Y518-I523 HydrophobicContact CD2-CG2 4.43Å; Y518-I523 HydrophobicContact CE1-CB 4.06Å; Y518-I523 HydrophobicContact CE1-CD1 3.61Å; Y518-I523 HydrophobicContact CE1-CG1 4.41Å; Y518-I523 HydrophobicContact CE1-CG2 3.84Å; Y518-I523 HydrophobicContact CG-CG2 3.9Å; T520-I523 HydrophobicContact CG2-CD1 4.22Å; T520-I523 HydrophobicContact CG2-CG1 4.33Å; E521-I523 VanDerWaalsContact C-N 3.32Å; E521-I523 PolarHBondContact O-N 3.08Å; I523-H525 VanDerWaalsContact C-N 3.34Å; I523-D526 PolarHBondContact O-N 3.38Å; I523-W527 PolarHBondContact O-N 2.65Å; I523-W527 VanDerWaalsContact O-N 3.07Å
524	I	94.1	Very high	91.8	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-71.2	-30.2	177.2	-163	65.1	0	0	0	112.4	W492 N502 L504 I516 T520 E521 S522 W527 H528	W492-I524 HydrophobicContact CH2-CG1 4.45Å; W492-I524 HydrophobicContact CH2-CG2 3.95Å; W492-I524 HydrophobicContact CZ3-CG1 4.4Å; W492-I524 HydrophobicContact CZ3-CG2 4.24Å; N502-I524 HydrophobicContact CB-CG2 3.69Å; L504-I524 HydrophobicContact CD1-CD1 3.73Å; L504-I524 HydrophobicContact CD1-CG1 4.03Å; L504-I524 HydrophobicContact CD2-CG1 4.3Å; L504-I524 HydrophobicContact CG-CD1 3.89Å; L504-I524 HydrophobicContact CG-CG1 3.87Å; I516-I524 HydrophobicContact CG2-CD1 4.47Å; T520-I524 PolarHBondContact O-N 3.4Å; E521-I524 WeakPolarHBondContact O-CG2 3.19Å; E521-I524 PolarHBondContact O-N 2.89Å; S522-I524 PolarHBondContact O-N 3.2Å; I524-W527 HydrophobicContact CD1-CB 4.36Å; I524-W527 PolarHBondContact O-N 3Å; I524-H528 WeakPolarHBondContact O-CB 3.4Å; I524-H528 PolarHBondContact O-N 2.83Å
525	H	92.4	Very high	91.6	Very high	83 Å²	83	49.6 Å²	49.6	38%	0.384	25%	0.249	S	C	.	.	H	α-helix	trans	-66.6	-40.4	174.3	-88.5	-114.4	0	0	0	111.8	W492 E521 S522 I523 H528 K529	W492-H525 AromaticContact CH2-CD2 3.45Å; W492-H525 VanDerWaalsContact CH2-CD2 3.45Å; W492-H525 WeakPolarHBondContact CH2-CD2 3.31Å; W492-H525 AromaticContact CH2-NE2 3.43Å; W492-H525 WeakPolarHBondContact CH2-NE2 3.39Å; W492-H525 AromaticContact CZ2-CD2 3.62Å; W492-H525 AromaticContact CZ2-CE1 3.67Å; W492-H525 AromaticContact CZ2-NE2 3.33Å; W492-H525 VanDerWaalsContact CZ2-NE2 3.33Å; W492-H525 WeakPolarHBondContact CZ2-NE2 3.41Å; E521-H525 PolarHBondContact O-CD2 2.84Å; E521-H525 VanDerWaalsContact O-CD2 3.27Å; E521-H525 PolarHBondContact O-N 2.83Å; S522-H525 PolarHBondContact O-N 2.83Å; S522-H525 VanDerWaalsContact O-N 3.15Å; I523-H525 VanDerWaalsContact C-N 3.34Å; H525-H528 WeakPolarHBondContact O-CB 3.41Å; H525-H528 PolarHBondContact O-N 2.83Å; H525-K529 WeakPolarHBondContact O-CB 3.44Å; H525-K529 PolarHBondContact O-N 3.07Å
526	D	91.8	Very high	91.3	Very high	86 Å²	86	55 Å²	55	46%	0.46	27%	0.274	S	S	.	.	H	α-helix	trans	-63.7	-42.8	172.1	-74.5	-12.5	0	0	0	112.1	K425 S522 I523 H528 K529 I530	K425-D526 IonicContact NZ-OD2 2.79Å; S522-D526 PolarHBondContact O-N 3.41Å; I523-D526 PolarHBondContact O-N 3.38Å; D526-H528 VanDerWaalsContact C-N 3.32Å; D526-K529 PolarHBondContact O-N 2.92Å; D526-I530 WeakPolarHBondContact O-CB 3.37Å; D526-I530 WeakPolarHBondContact O-CG2 3.39Å; D526-I530 PolarHBondContact O-N 3.39Å
527	W	94.2	Very high	90.7	Very high	8 Å²	8	58.3 Å²	58.3	3%	0.03	29%	0.29	C	S	.	.	H	α-helix	trans	-64.7	-36.7	175.4	-83.8	109.2	0	0	0	111.9	K425 L429 L453 L458 I523 I524 I530 L531	K425-W527 HydrophobicContact CB-CH2 4.14Å; K425-W527 HydrophobicContact CB-CZ3 4.25Å; K425-W527 HydrophobicContact CD-CD2 4.06Å; K425-W527 HydrophobicContact CD-CE3 4.23Å; K425-W527 HydrophobicContact CD-CH2 4.35Å; K425-W527 HydrophobicContact CD-CZ2 4.15Å; K425-W527 HydrophobicContact CD-CZ3 4.36Å; K425-W527 HydrophobicContact CG-CH2 3.81Å; K425-W527 HydrophobicContact CG-CZ2 3.8Å; K425-W527 HydrophobicContact CG-CZ3 4.16Å; K425-W527 VanDerWaalsContact O-CH2 3.31Å; K425-W527 WeakPolarHBondContact O-CH2 3.49Å; L429-W527 HydrophobicContact CD1-CD2 3.76Å; L429-W527 HydrophobicContact CD1-CE3 4.03Å; L429-W527 HydrophobicContact CD1-CG 4.16Å; L429-W527 HydrophobicContact CD1-CH2 4.28Å; L429-W527 HydrophobicContact CD1-CZ2 4.05Å; L429-W527 HydrophobicContact CD1-CZ3 4.28Å; L429-W527 HydrophobicContact CD2-CG 4.27Å; L429-W527 HydrophobicContact CG-CZ2 4.43Å; L453-W527 HydrophobicContact CB-CZ3 4.21Å; L458-W527 HydrophobicContact CD1-CZ3 4.47Å; I523-W527 PolarHBondContact O-N 2.65Å; I523-W527 VanDerWaalsContact O-N 3.07Å; I524-W527 HydrophobicContact CD1-CB 4.36Å; I524-W527 PolarHBondContact O-N 3Å; W527-I530 HydrophobicContact CE3-CG2 4.22Å; W527-L531 VanDerWaalsContact O-CB 3.26Å; W527-L531 WeakPolarHBondContact O-CB 3.32Å; W527-L531 WeakPolarHBondContact O-CD1 3.28Å; W527-L531 WeakPolarHBondContact O-CG 3.5Å; W527-L531 PolarHBondContact O-N 3.47Å; W527-L531 VanDerWaalsContact O-N 3.16Å
528	H	94.4	Very high	89.9	Confident	31 Å²	31	60.1 Å²	60.1	14%	0.144	30%	0.299	C	S	.	.	H	α-helix	trans	-63.5	-48.7	172.4	179.1	-125.7	0	0	0	111.6	W492 L504 I524 H525 D526 K532	W492-H528 AromaticContact CE2-ND1 3.94Å; W492-H528 HydrophobicContact CZ2-CB 4.22Å; W492-H528 AromaticContact CZ2-ND1 3.94Å; W492-H528 AromaticContact NE1-CE1 3.58Å; W492-H528 AromaticContact NE1-ND1 3.7Å; L504-H528 HydrophobicContact CD1-CB 3.77Å; L504-H528 HydrophobicContact CD2-CB 3.7Å; L504-H528 HydrophobicContact CG-CB 4.4Å; I524-H528 WeakPolarHBondContact O-CB 3.4Å; I524-H528 PolarHBondContact O-N 2.83Å; H525-H528 WeakPolarHBondContact O-CB 3.41Å; H525-H528 PolarHBondContact O-N 2.83Å; D526-H528 VanDerWaalsContact C-N 3.32Å; H528-K532 WeakPolarHBondContact O-CB 3.36Å; H528-K532 PolarHBondContact O-N 3.23Å
529	K	92	Very high	88.8	Confident	129 Å²	129	60.8 Å²	60.8	56%	0.561	31%	0.31	S	S	*	.	H	α-helix	trans	-58.1	-57.8	178.6	-179.1	179	177	-172.5	0	111	H525 D526 L531 K532 D533	H525-K529 WeakPolarHBondContact O-CB 3.44Å; H525-K529 PolarHBondContact O-N 3.07Å; D526-K529 PolarHBondContact O-N 2.92Å; K529-L531 VanDerWaalsContact C-N 3.32Å; K529-L531 PolarHBondContact O-N 2.88Å; K529-K532 WeakPolarHBondContact O-CB 3.48Å; K529-K532 PolarHBondContact O-N 3.35Å; K529-K532 VanDerWaalsContact O-N 3.09Å; K529-D533 VanDerWaalsContact CG-OD2 3.3Å; K529-D533 WeakPolarHBondContact CG-OD2 3.33Å; K529-D533 WeakPolarHBondContact O-CB 3.43Å; K529-D533 PolarHBondContact O-N 2.66Å
530	I	90.8	Very high	86.8	Confident	23 Å²	23	58.6 Å²	58.6	12%	0.118	30%	0.304	C	S	.	.	H	α-helix	trans	-63	-36.4	-175.6	-159.4	175.5	0	0	0	112.8	L423 K425 L453 D526 W527 T534	L423-I530 HydrophobicContact CB-CD1 4.24Å; L423-I530 HydrophobicContact CB-CG1 4.35Å; L423-I530 HydrophobicContact CD1-CG1 4.1Å; L423-I530 HydrophobicContact CD2-CD1 3.89Å; L423-I530 HydrophobicContact CD2-CG1 3.96Å; L423-I530 HydrophobicContact CG-CG1 4.37Å; K425-I530 HydrophobicContact CB-CD1 3.71Å; K425-I530 HydrophobicContact CD-CD1 3.97Å; K425-I530 HydrophobicContact CD-CG2 4.11Å; K425-I530 HydrophobicContact CG-CD1 4.44Å; L453-I530 HydrophobicContact CD2-CD1 4.13Å; L453-I530 HydrophobicContact CD2-CG1 3.95Å; L453-I530 HydrophobicContact CD2-CG2 3.98Å; D526-I530 WeakPolarHBondContact O-CB 3.37Å; D526-I530 WeakPolarHBondContact O-CG2 3.39Å; D526-I530 PolarHBondContact O-N 3.39Å; W527-I530 HydrophobicContact CE3-CG2 4.22Å; I530-T534 VanDerWaalsContact O-CB 3.24Å; I530-T534 WeakPolarHBondContact O-CB 3.31Å; I530-T534 PolarHBondContact O-N 2.91Å; I530-T534 PolarHBondContact O-OG1 2.9Å
531	L	92.4	Very high	84.8	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-68.4	-41.2	174.9	-72.1	171.8	0	0	0	111.5	L453 L458 L485 I490 I516 W527 K529 I535	L453-L531 HydrophobicContact CD1-CD2 4.17Å; L453-L531 HydrophobicContact CD2-CD2 4.1Å; L458-L531 HydrophobicContact CD1-CD2 4Å; L458-L531 HydrophobicContact CD2-CD2 4.04Å; L485-L531 HydrophobicContact CD1-CD2 3.69Å; I490-L531 HydrophobicContact CD1-CD1 4.13Å; I490-L531 HydrophobicContact CG1-CB 4.26Å; I516-L531 HydrophobicContact CD1-CD1 4.49Å; W527-L531 VanDerWaalsContact O-CB 3.26Å; W527-L531 WeakPolarHBondContact O-CB 3.32Å; W527-L531 WeakPolarHBondContact O-CD1 3.28Å; W527-L531 WeakPolarHBondContact O-CG 3.5Å; W527-L531 PolarHBondContact O-N 3.47Å; W527-L531 VanDerWaalsContact O-N 3.16Å; K529-L531 VanDerWaalsContact C-N 3.32Å; K529-L531 PolarHBondContact O-N 2.88Å; L531-I535 WeakPolarHBondContact O-CB 3.35Å; L531-I535 WeakPolarHBondContact O-CD1 3.46Å; L531-I535 WeakPolarHBondContact O-CG1 3.46Å; L531-I535 PolarHBondContact O-N 3.41Å
532	K	90.9	Very high	82.1	Confident	92 Å²	92	58.7 Å²	58.7	40%	0.4	33%	0.329	S	S	.	.	H	α-helix	trans	-65.2	-48.7	177.5	-176.1	-173.4	175.7	-168.1	0	111.3	I490 H528 K529 T534 I535 Q536	I490-K532 HydrophobicContact CG2-CB 3.76Å; I490-K532 HydrophobicContact CG2-CG 4.29Å; H528-K532 WeakPolarHBondContact O-CB 3.36Å; H528-K532 PolarHBondContact O-N 3.23Å; K529-K532 WeakPolarHBondContact O-CB 3.48Å; K529-K532 PolarHBondContact O-N 3.35Å; K529-K532 VanDerWaalsContact O-N 3.09Å; K532-T534 VanDerWaalsContact C-N 3.34Å; K532-T534 PolarHBondContact O-N 3.25Å; K532-I535 PolarHBondContact O-N 2.91Å; K532-Q536 WeakPolarHBondContact O-CG 3.33Å; K532-Q536 PolarHBondContact O-N 3.16Å
533	D	86.8	Confident	79.4	Confident	52 Å²	52	60.3 Å²	60.3	28%	0.278	34%	0.34	S	S	.	.	H	α-helix	trans	-62.3	-43.2	-179.9	-61.3	-8.7	0	0	0	110.1	K529 Q536 Q537	K529-D533 VanDerWaalsContact CG-OD2 3.3Å; K529-D533 WeakPolarHBondContact CG-OD2 3.33Å; K529-D533 WeakPolarHBondContact O-CB 3.43Å; K529-D533 PolarHBondContact O-N 2.66Å; D533-Q536 PolarHBondContact O-N 3.18Å; D533-Q537 WeakPolarHBondContact O-CB 3.48Å; D533-Q537 VanDerWaalsContact O-CG 3.27Å; D533-Q537 WeakPolarHBondContact O-CG 3.33Å; D533-Q537 PolarHBondContact O-N 3.05Å
534	T	87.2	Confident	76.7	Confident	5 Å²	5	64.9 Å²	64.9	3%	0.031	37%	0.365	C	S	.	.	H	α-helix	trans	-62.3	-45.9	174	-57.9	0	0	0	0	112.1	L453 L485 I530 K532 Q536 Q537 L538	L453-T534 HydrophobicContact CD1-CG2 4.35Å; L485-T534 HydrophobicContact CD1-CG2 4.19Å; I530-T534 VanDerWaalsContact O-CB 3.24Å; I530-T534 WeakPolarHBondContact O-CB 3.31Å; I530-T534 PolarHBondContact O-N 2.91Å; I530-T534 PolarHBondContact O-OG1 2.9Å; K532-T534 VanDerWaalsContact C-N 3.34Å; K532-T534 PolarHBondContact O-N 3.25Å; T534-Q536 VanDerWaalsContact C-N 3.3Å; T534-Q536 PolarHBondContact O-N 2.87Å; T534-Q537 PolarHBondContact O-N 3.06Å; T534-L538 HydrophobicContact CG2-CD1 3.99Å; T534-L538 WeakPolarHBondContact O-CD1 3.22Å; T534-L538 VanDerWaalsContact O-CG 3.24Å; T534-L538 WeakPolarHBondContact O-CG 3.49Å; T534-L538 PolarHBondContact O-N 3.23Å; T534-L538 VanDerWaalsContact O-N 3.1Å
535	I	88.9	Confident	73.8	Confident	16 Å²	16	73 Å²	73	8%	0.082	40%	0.403	C	S	.	.	H	α-helix	trans	-59.4	-42.5	176.8	-76.8	165.9	0	0	0	110.8	L485 A488 I490 L506 L531 K532 L538 V539	L485-I535 HydrophobicContact CB-CG1 3.9Å; A488-I535 HydrophobicContact CB-CD1 4.2Å; A488-I535 HydrophobicContact CB-CG1 4.44Å; A488-I535 WeakPolarHBondContact O-CG2 3.23Å; I490-I535 HydrophobicContact CB-CD1 3.77Å; I490-I535 HydrophobicContact CG2-CD1 3.72Å; L506-I535 HydrophobicContact CD1-CD1 4.25Å; L531-I535 WeakPolarHBondContact O-CB 3.35Å; L531-I535 WeakPolarHBondContact O-CD1 3.46Å; L531-I535 WeakPolarHBondContact O-CG1 3.46Å; L531-I535 PolarHBondContact O-N 3.41Å; K532-I535 PolarHBondContact O-N 2.91Å; I535-L538 PolarHBondContact O-N 2.85Å; I535-V539 WeakPolarHBondContact O-CG2 3.46Å
536	Q	86.4	Confident	70.7	Confident	114 Å²	114	75.8 Å²	75.8	53%	0.533	42%	0.42	S	S	.	.	H	α-helix	trans	-67.1	-44.2	178.9	-72.9	-179	-26	0	0	112	K532 D533 T534 L538 V539	K532-Q536 WeakPolarHBondContact O-CG 3.33Å; K532-Q536 PolarHBondContact O-N 3.16Å; D533-Q536 PolarHBondContact O-N 3.18Å; T534-Q536 VanDerWaalsContact C-N 3.3Å; T534-Q536 PolarHBondContact O-N 2.87Å; Q536-L538 VanDerWaalsContact C-N 3.26Å; Q536-L538 PolarHBondContact O-N 3.47Å; Q536-V539 PolarHBondContact O-N 2.9Å
537	Q	82.1	Confident	67.8	Low	70 Å²	70	78.4 Å²	78.4	33%	0.327	43%	0.43	S	S	.	.	H	α-helix	trans	-60.4	-33.5	176.3	-72.9	169.8	11.9	0	0	112.9	V420 D533 T534 V539	V420-Q537 HydrophobicContact CG1-CB 4.33Å; V420-Q537 HydrophobicContact CG2-CB 4.2Å; D533-Q537 WeakPolarHBondContact O-CB 3.48Å; D533-Q537 VanDerWaalsContact O-CG 3.27Å; D533-Q537 WeakPolarHBondContact O-CG 3.33Å; D533-Q537 PolarHBondContact O-N 3.05Å; T534-Q537 PolarHBondContact O-N 3.06Å; Q537-V539 PolarHBondContact O-N 3.48Å
538	L	79.6	Confident	64.7	Low	41 Å²	41	85.7 Å²	85.7	22%	0.215	46%	0.464	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-6.1	176.3	-66.6	168	0	0	0	114.2	L485 K486 T534 I535 Q536	L485-L538 HydrophobicContact CB-CD1 3.93Å; K486-L538 HydrophobicContact CB-CB 4.28Å; K486-L538 HydrophobicContact CB-CD1 4.33Å; K486-L538 HydrophobicContact CG-CB 4.26Å; T534-L538 HydrophobicContact CG2-CD1 3.99Å; T534-L538 WeakPolarHBondContact O-CD1 3.22Å; T534-L538 VanDerWaalsContact O-CG 3.24Å; T534-L538 WeakPolarHBondContact O-CG 3.49Å; T534-L538 PolarHBondContact O-N 3.23Å; T534-L538 VanDerWaalsContact O-N 3.1Å; I535-L538 PolarHBondContact O-N 2.85Å; Q536-L538 VanDerWaalsContact C-N 3.26Å; Q536-L538 PolarHBondContact O-N 3.47Å
539	V	70.6	Confident	61.4	Low	87 Å²	87	91.9 Å²	91.9	53%	0.527	49%	0.493	S	S	.	.			trans	-115.3	71.1	178.9	-176.8	0	0	0	0	109.4	I535 Q536 Q537	I535-V539 WeakPolarHBondContact O-CG2 3.46Å; Q536-V539 PolarHBondContact O-N 2.9Å; Q537-V539 PolarHBondContact O-N 3.48Å
540	S	48.3	Very low	58.2	Low	72 Å²	72	93.2 Å²	93.2	50%	0.503	50%	0.501	S	S	.	.			trans	-73.3	141.1	168.1	-65.2	0	0	0	0	111
541	P	48.9	Very low	55.1	Low	124 Å²	124	98.4 Å²	98.4	81%	0.805	53%	0.534	S	S	*	.			trans	-84.2	138.6	-170.1	32.3	-35.5	0	0	0	114
542	G	33	Very low	52.1	Low	65 Å²	65	104.5 Å²	104.5	67%	0.67	57%	0.571	S	S	*	*			trans	174.5	123.8	169.8	0	0	0	0	0	113.7
543	S	32.7	Very low	49	Very low	109 Å²	109	109.9 Å²	109.9	76%	0.762	59%	0.594	S	S	*	*	S	Bend	trans	52.3	130.6	-179.8	54.7	0	0	0	0	117.6
544	D	32.7	Very low	46	Very low	154 Å²	154	113 Å²	113	82%	0.824	61%	0.61	S	S	*	*			cis	-149.8	169.1	-1.2	-104.4	-34.7	0	0	0	112.8
545	Q	32.7	Very low	43.2	Very low	172 Å²	172	121 Å²	121	80%	0.804	64%	0.642	S	S	*	*			trans	-73.9	150.2	-172.7	-55.4	171	2.5	0	0	112.9
546	N	28.9	Very low	40.2	Very low	140 Å²	140	127.3 Å²	127.3	75%	0.749	67%	0.67	S	S	*	*				-165.1	131.4	124.2	-105.3	-37.1	0	0	0	116
547	H	30.7	Very low	37.3	Very low	142 Å²	142	128.4 Å²	128.4	66%	0.657	68%	0.676	S	S	*	*			trans	73.4	115.3	147.2	-78	52.7	0	0	0	122.5
548	Q	27.7	Very low	34.6	Very low	161 Å²	161	131.6 Å²	131.6	75%	0.752	69%	0.69	S	S	*	*			trans	76.7	78.8	134.5	-64	177	-4.9	0	0	120.2
549	Q	25.1	Very low	32.1	Very low	160 Å²	160	137.1 Å²	137.1	75%	0.748	72%	0.715	S	S	*	*				42.4	127.9	102.2	-171.3	171	-1.1	0	0	120.1
550	E	26.3	Very low	29.9	Very low	158 Å²	158	137.4 Å²	137.4	74%	0.738	72%	0.72	S	S	*	*			trans	66.8	152.9	163.1	-75.1	160.7	-139.6	0	0	116.5
551	V	25.5	Very low	28.8	Very low	131 Å²	131	140.5 Å²	140.5	79%	0.794	73%	0.727	S	S	*	*			cis	-126.9	147.8	20.1	171.2	0	0	0	0	112.1
552	V	29.8	Very low	27.9	Very low	129 Å²	129	142.5 Å²	142.5	78%	0.782	73%	0.726	S	S	*	*			trans	-84.7	133.6	168.3	174	0	0	0	0	110.8
553	K	24.8	Very low	27.8	Very low	206 Å²	206	147.4 Å²	147.4	90%	0.896	73%	0.731	S	S	*	*			trans	-159.7	161.7	144.1	-113.6	159.7	-171.3	178.9	0	113.5
554	D	23.7	Very low	27.7	Very low	116 Å²	116	150 Å²	150	62%	0.62	74%	0.736	S	S	*	*			trans	-134.3	177.6	-163.9	-171.3	11.6	0	0	0	109
555	Y	28.1	Very low	27.7	Very low	175 Å²	175	145.2 Å²	145.2	69%	0.686	72%	0.724	S	S	*	*			trans	80.9	125	168.4	-54.7	-70.5	0	0	0	119.6
556	Q	27.3	Very low	27.5	Very low	147 Å²	147	144.8 Å²	144.8	69%	0.687	73%	0.727	S	S	*	*			trans	65	151.8	130.1	-65.1	168.9	-86.5	0	0	118.2
557	E	24.3	Very low	28.1	Very low	138 Å²	138	145.5 Å²	145.5	65%	0.645	73%	0.73	S	S	*	*			cis	-160.6	178	-0.9	-126.6	168.1	-152	0	0	113.8
558	H	25.7	Very low	28.9	Very low	136 Å²	136	143.9 Å²	143.9	63%	0.63	73%	0.732	S	S	*	*			trans	19	140.8	150.2	-75.5	-61.4	0	0	0	124.6
559	H	27.3	Very low	29.2	Very low	158 Å²	158	147.3 Å²	147.3	73%	0.731	74%	0.738	S	S	*	*			trans	52.9	161	143.2	-62.2	-70.7	0	0	0	118.7
560	S	23.6	Very low	30	Very low	92 Å²	92	144.3 Å²	144.3	64%	0.643	73%	0.733	S	S	*	*			cis	-141.1	160.6	16.8	-97.8	0	0	0	0	112.8
561	E	26.6	Very low	30.3	Very low	138 Å²	138	141.7 Å²	141.7	65%	0.645	73%	0.732	S	S	*	*			trans	13.4	151.4	135.3	-66.6	122.5	-177.5	0	0	124.5
562	E	28.4	Very low	30.7	Very low	166 Å²	166	143.7 Å²	143.7	78%	0.776	74%	0.736	S	S	*	*			trans	78.2	151.4	135.6	-80.8	162	-148.3	0	0	121
563	E	31.9	Very low	30.9	Very low	167 Å²	167	142.4 Å²	142.4	78%	0.78	73%	0.733	S	S	*	*			cis	-157.3	170.8	-24.9	-142.7	-178.3	-166.9	0	0	109.6
564	D	31.1	Very low	31.3	Very low	163 Å²	163	142 Å²	142	87%	0.872	73%	0.734	S	S	*	*			trans	57	170.7	162	-122.1	9.3	0	0	0	118.8
565	G	31.5	Very low	31.8	Very low	55 Å²	55	141.8 Å²	141.8	57%	0.567	74%	0.742	S	S	*	*			cis	-169.5	147.8	-6.5	0	0	0	0	0	113.5
566	D	29.8	Very low	33.2	Very low	163 Å²	163	138.5 Å²	138.5	87%	0.872	74%	0.742	S	S	*	*			trans	63.7	158.4	158	-112.4	-24.6	0	0	0	125.4
567	L	39.9	Very low	33.5	Very low	155 Å²	155	138.7 Å²	138.7	81%	0.812	75%	0.747	S	S	*	*			trans	-124.9	-162.8	175	-71.2	169.3	0	0	0	107.7
568	P	47.9	Very low	34	Very low	108 Å²	108	140.2 Å²	140.2	70%	0.701	76%	0.76	S	S	*	*			cis	-143.1	149.3	-3.1	40.3	-19.7	0	0	0	118.7
569	R	34.1	Very low	34.6	Very low	233 Å²	233	138.4 Å²	138.4	88%	0.879	77%	0.769	S	S	*	*			trans	62.8	177.6	143.9	-94.2	-176.4	-178.5	-110.2	-1.4	119.3
570	P	43	Very low	35.3	Very low	97 Å²	97	134.2 Å²	134.2	63%	0.63	77%	0.768	S	S	*	*			cis	-128.3	152.3	-13.3	34.3	-16.8	0	0	0	116.9
571	S	31.8	Very low	36.3	Very low	103 Å²	103	138.4 Å²	138.4	72%	0.72	78%	0.778	S	S	*	*			trans	35	134.4	143.6	65.3	0	0	0	0	123.7
572	I	33.1	Very low	37.9	Very low	172 Å²	172	136.2 Å²	136.2	88%	0.882	77%	0.774	S	S	*	*				-144.5	163.2	124.2	-109.3	161	0	0	0	109.7
573	S	35.1	Very low	40	Very low	102 Å²	102	130.5 Å²	130.5	71%	0.713	75%	0.749	S	S	*	*			trans	-88	153.8	-164.3	51.2	0	0	0	0	115.6
574	Q	32.7	Very low	42.1	Very low	198 Å²	198	125.1 Å²	125.1	93%	0.925	73%	0.728	S	S	*	*			trans	-162.1	148.1	130.9	-113.1	169.7	61.7	0	0	113.1
575	S	35.4	Very low	44.3	Very low	111 Å²	111	124.9 Å²	124.9	78%	0.776	72%	0.719	S	S	*	*			trans	-165.3	171.3	174.2	64.3	0	0	0	0	108.1
576	P	55.7	Low	46.8	Very low	106 Å²	106	129 Å²	129	69%	0.688	72%	0.722	S	S	*	*			cis	-116.7	162.8	-17	39.3	-28.3	0	0	0	112.2
577	N	33.9	Very low	49.6	Very low	151 Å²	151	125 Å²	125	81%	0.807	70%	0.703	S	S	*	*			trans	167.8	123.1	139.5	-91.4	-29.2	0	0	0	111.8
578	N	35	Very low	51.7	Low	170 Å²	170	124.1 Å²	124.1	91%	0.909	69%	0.689	S	S	*	*				-173.8	146.2	121	-106.4	-29.2	0	0	0	111.7
579	A	38.1	Very low	53.6	Low	98 Å²	98	122.6 Å²	122.6	81%	0.81	68%	0.678	S	S	*	*			trans	-83.9	127.8	-177.6	0	0	0	0	0	112.5	E581	A579-E581 PolarHBondContact O-N 3.33Å; A579-E581 VanDerWaalsContact O-N 3.09Å
580	G	42.8	Very low	56.3	Low	70 Å²	70	119.4 Å²	119.4	72%	0.722	67%	0.67	S	S	*	*			trans	81.5	-7	130.7	0	0	0	0	0	120.1	T582	G580-T582 PolarHBondContact O-N 2.83Å
581	E	44.1	Very low	58.4	Low	180 Å²	180	119.5 Å²	119.5	84%	0.841	67%	0.665	S	S	*	*			trans	-70.2	96.2	171.2	-163.7	179.5	-161.8	0	0	110.3	A579 D583	A579-E581 PolarHBondContact O-N 3.33Å; A579-E581 VanDerWaalsContact O-N 3.09Å; E581-D583 PolarHBondContact O-N 2.82Å
582	T	59.7	Low	61	Low	92 Å²	92	118.9 Å²	118.9	56%	0.564	65%	0.652	S	S	*	*			trans	-71.4	90.2	179.3	54.8	0	0	0	0	110.1	R443 G580 P584	R443-T582 PolarHBondContact NH2-O 3.19Å; G580-T582 PolarHBondContact O-N 2.83Å; T582-P584 WeakPolarHBondContact O-CD 3.39Å; T582-P584 VanDerWaalsContact O-N 3.12Å
583	D	74.3	Confident	63.8	Low	47 Å²	47	117.5 Å²	117.5	25%	0.251	64%	0.639	S	S	.	*			trans	-49.2	115.5	172.8	171.6	7.1	0	0	0	110.3	E581 K585 K586 V587	E581-D583 PolarHBondContact O-N 2.82Å; D583-K585 PolarHBondContact O-N 3.39Å; D583-K585 VanDerWaalsContact O-N 3.15Å; D583-K585 VanDerWaalsContact OD1-CB 3.23Å; D583-K585 WeakPolarHBondContact OD1-CB 3.43Å; D583-K585 WeakPolarHBondContact OD1-CG 3.5Å; D583-K585 PolarHBondContact OD1-N 3.39Å; D583-K586 HydrophobicContact CB-CB 4.19Å; D583-K586 HydrophobicContact CB-CD 3.91Å; D583-K586 HydrophobicContact CB-CG 4.09Å; D583-K586 WeakPolarHBondContact O-CB 3.45Å; D583-K586 PolarHBondContact O-N 3Å; D583-K586 VanDerWaalsContact OD2-CE 3.27Å; D583-K586 WeakPolarHBondContact OD2-CE 3.34Å; D583-K586 WeakPolarHBondContact OD2-CG 3.47Å; D583-V587 PolarHBondContact O-N 2.96Å
584	P	75.8	Confident	66.6	Low	53 Å²	53	118 Å²	118	34%	0.344	63%	0.628	S	S	.	*	H	α-helix	trans	-64.4	-20.4	-177.1	28.2	-36.3	0	0	0	112.5	R443 T582 R588	R443-P584 HydrophobicContact CG-CG 4.1Å; T582-P584 WeakPolarHBondContact O-CD 3.39Å; T582-P584 VanDerWaalsContact O-N 3.12Å; P584-R588 VanDerWaalsContact O-CB 3.31Å; P584-R588 WeakPolarHBondContact O-CB 3.36Å; P584-R588 PolarHBondContact O-N 2.82Å
585	K	77.2	Confident	69.4	Low	158 Å²	158	112.8 Å²	112.8	69%	0.687	61%	0.607	S	S	*	*	H	α-helix	trans	-69.9	-45.1	171.5	-57.6	175.9	-179.8	177.2	0	110.6	D583 V587 R588 T589	D583-K585 PolarHBondContact O-N 3.39Å; D583-K585 VanDerWaalsContact O-N 3.15Å; D583-K585 VanDerWaalsContact OD1-CB 3.23Å; D583-K585 WeakPolarHBondContact OD1-CB 3.43Å; D583-K585 WeakPolarHBondContact OD1-CG 3.5Å; D583-K585 PolarHBondContact OD1-N 3.39Å; K585-V587 VanDerWaalsContact C-N 3.31Å; K585-V587 PolarHBondContact O-N 3.09Å; K585-R588 PolarHBondContact O-N 3.2Å; K585-T589 WeakPolarHBondContact O-CB 3.33Å; K585-T589 PolarHBondContact O-N 2.8Å; K585-T589 PolarHBondContact O-OG1 3.03Å; K585-T589 VanDerWaalsContact O-OG1 3.1Å
586	K	84.1	Confident	71.8	Confident	142 Å²	142	115.4 Å²	115.4	62%	0.617	61%	0.609	S	S	*	*	H	α-helix	trans	-61.9	-38.9	173.7	-69.9	171.6	-158.5	168.7	0	111.4	D583 K590	D583-K586 HydrophobicContact CB-CB 4.19Å; D583-K586 HydrophobicContact CB-CD 3.91Å; D583-K586 HydrophobicContact CB-CG 4.09Å; D583-K586 WeakPolarHBondContact O-CB 3.45Å; D583-K586 PolarHBondContact O-N 3Å; D583-K586 VanDerWaalsContact OD2-CE 3.27Å; D583-K586 WeakPolarHBondContact OD2-CE 3.34Å; D583-K586 WeakPolarHBondContact OD2-CG 3.47Å; K586-K590 WeakPolarHBondContact O-CB 3.49Å; K586-K590 WeakPolarHBondContact O-CG 3.45Å; K586-K590 PolarHBondContact O-N 2.93Å
587	V	87.4	Confident	73.4	Confident	78 Å²	78	118.8 Å²	118.8	47%	0.473	61%	0.613	S	S	.	*	H	α-helix	trans	-63.9	-50.2	173.4	179.8	0	0	0	0	111.1	D583 K585 T589 K590 L591	D583-V587 PolarHBondContact O-N 2.96Å; K585-V587 VanDerWaalsContact C-N 3.31Å; K585-V587 PolarHBondContact O-N 3.09Å; V587-T589 PolarHBondContact O-N 2.9Å; V587-K590 PolarHBondContact O-N 3.17Å; V587-L591 WeakPolarHBondContact O-CB 3.47Å; V587-L591 PolarHBondContact O-N 2.65Å
588	R	84.3	Confident	75.9	Confident	137 Å²	137	119.9 Å²	119.9	52%	0.517	61%	0.605	S	S	.	*	H	α-helix	trans	-57.7	-44.4	177.3	-179.3	177.6	173.9	90.2	-7.4	112.2	S499 P584 K585 L591 M592	S499-R588 PolarHBondContact OG-NH2 2.84Å; S499-R588 VanDerWaalsContact OG-NH2 3.17Å; P584-R588 VanDerWaalsContact O-CB 3.31Å; P584-R588 WeakPolarHBondContact O-CB 3.36Å; P584-R588 PolarHBondContact O-N 2.82Å; K585-R588 PolarHBondContact O-N 3.2Å; R588-L591 PolarHBondContact O-N 3.4Å; R588-M592 WeakPolarHBondContact O-CB 3.33Å; R588-M592 WeakPolarHBondContact O-CG 3.45Å; R588-M592 PolarHBondContact O-N 2.77Å
589	T	87.2	Confident	78.4	Confident	77 Å²	77	115 Å²	115	47%	0.472	58%	0.583	S	S	.	*	H	α-helix	trans	-68.5	-37.5	178.6	-60.6	0	0	0	0	112.2	K585 V587 K593	K585-T589 WeakPolarHBondContact O-CB 3.33Å; K585-T589 PolarHBondContact O-N 2.8Å; K585-T589 PolarHBondContact O-OG1 3.03Å; K585-T589 VanDerWaalsContact O-OG1 3.1Å; V587-T589 PolarHBondContact O-N 2.9Å; T589-K593 HydrophobicContact CG2-CD 4.47Å; T589-K593 WeakPolarHBondContact O-CB 3.44Å; T589-K593 WeakPolarHBondContact O-CG 3.38Å; T589-K593 PolarHBondContact O-N 3.09Å; T589-K593 VanDerWaalsContact O-N 3.08Å
590	K	90.8	Very high	80.8	Confident	165 Å²	165	114.8 Å²	114.8	72%	0.717	57%	0.572	S	S	*	*	H	α-helix	trans	-64.6	-43.9	171	-79.4	-174.5	174.9	-171.6	0	111.7	K586 V587 K593 F594	K586-K590 WeakPolarHBondContact O-CB 3.49Å; K586-K590 WeakPolarHBondContact O-CG 3.45Å; K586-K590 PolarHBondContact O-N 2.93Å; V587-K590 PolarHBondContact O-N 3.17Å; K590-K593 PolarHBondContact O-N 3.21Å; K590-F594 WeakPolarHBondContact O-CB 3.31Å; K590-F594 PolarHBondContact O-N 2.8Å
591	L	87.8	Confident	82.6	Confident	99 Å²	99	117 Å²	117	52%	0.518	57%	0.567	S	S	.	*	H	α-helix	trans	-65.9	-42.8	-179.9	-164.5	77.9	0	0	0	111.9	V587 R588 F594 L595	V587-L591 WeakPolarHBondContact O-CB 3.47Å; V587-L591 PolarHBondContact O-N 2.65Å; R588-L591 PolarHBondContact O-N 3.4Å; L591-F594 WeakPolarHBondContact O-CB 3.48Å; L591-F594 PolarHBondContact O-N 2.84Å; L591-L595 HydrophobicContact CG-CD1 4.32Å; L591-L595 WeakPolarHBondContact O-CG 3.49Å; L591-L595 PolarHBondContact O-N 3.21Å
592	M	87.5	Confident	84.3	Confident	91 Å²	91	113.8 Å²	113.8	45%	0.448	55%	0.552	S	S	.	*	H	α-helix	trans	-63	-44.5	175	-73.2	-66.7	175	0	0	111.6	R588 F594 L595 M596	R588-M592 WeakPolarHBondContact O-CB 3.33Å; R588-M592 WeakPolarHBondContact O-CG 3.45Å; R588-M592 PolarHBondContact O-N 2.77Å; M592-F594 VanDerWaalsContact C-N 3.28Å; M592-F594 PolarHBondContact O-N 2.98Å; M592-L595 PolarHBondContact O-N 2.94Å; M592-M596 WeakPolarHBondContact O-CB 3.39Å; M592-M596 WeakPolarHBondContact O-CG 3.49Å; M592-M596 PolarHBondContact O-N 2.91Å
593	K	92.1	Very high	85.5	Confident	142 Å²	142	110.8 Å²	110.8	62%	0.617	53%	0.534	S	S	*	.	H	α-helix	trans	-63.9	-32.1	173.5	-73.7	-176.2	177.1	-171.6	0	112.8	T589 K590 K597	T589-K593 HydrophobicContact CG2-CD 4.47Å; T589-K593 WeakPolarHBondContact O-CB 3.44Å; T589-K593 WeakPolarHBondContact O-CG 3.38Å; T589-K593 PolarHBondContact O-N 3.09Å; T589-K593 VanDerWaalsContact O-N 3.08Å; K590-K593 PolarHBondContact O-N 3.21Å; K593-K597 VanDerWaalsContact O-CB 3.29Å; K593-K597 WeakPolarHBondContact O-CB 3.38Å; K593-K597 WeakPolarHBondContact O-CG 3.38Å; K593-K597 PolarHBondContact O-N 3.39Å
594	F	92.5	Very high	86	Confident	112 Å²	112	110.2 Å²	110.2	49%	0.491	53%	0.532	S	S	.	.	H	α-helix	trans	-70.1	-45.4	173.9	171.4	-99	0	0	0	111.8	K590 L591 M592 K597 R598	K590-F594 WeakPolarHBondContact O-CB 3.31Å; K590-F594 PolarHBondContact O-N 2.8Å; L591-F594 WeakPolarHBondContact O-CB 3.48Å; L591-F594 PolarHBondContact O-N 2.84Å; M592-F594 VanDerWaalsContact C-N 3.28Å; M592-F594 PolarHBondContact O-N 2.98Å; F594-K597 CarbonylContact O-C 3.56Å; F594-K597 VanDerWaalsContact O-C 3.26Å; F594-K597 PolarHBondContact O-N 3.16Å; F594-R598 HydrophobicContact CZ-CG 4.47Å; F594-R598 VanDerWaalsContact O-CA 3.29Å; F594-R598 WeakPolarHBondContact O-CA 3.32Å; F594-R598 WeakPolarHBondContact O-CB 3.48Å; F594-R598 PolarHBondContact O-N 2.99Å
595	L	91.5	Very high	85.9	Confident	90 Å²	90	111 Å²	111	47%	0.471	53%	0.53	S	S	.	.	H	α-helix	trans	-65.2	-43.9	178.7	-69.5	170.9	0	0	0	111.6	L591 M592 K597 R598	L591-L595 HydrophobicContact CG-CD1 4.32Å; L591-L595 WeakPolarHBondContact O-CG 3.49Å; L591-L595 PolarHBondContact O-N 3.21Å; M592-L595 PolarHBondContact O-N 2.94Å; L595-K597 PolarHBondContact O-N 2.98Å; L595-R598 WeakPolarHBondContact O-CB 3.41Å; L595-R598 PolarHBondContact O-N 3.43Å
596	M	86	Confident	85.9	Confident	165 Å²	165	109.5 Å²	109.5	81%	0.813	53%	0.526	S	S	*	.	H	α-helix	trans	-69.5	-17.1	175.7	-66.2	-179.5	77	0	0	114.1	M592	M592-M596 WeakPolarHBondContact O-CB 3.39Å; M592-M596 WeakPolarHBondContact O-CG 3.49Å; M592-M596 PolarHBondContact O-N 2.91Å
597	K	90.1	Very high	85.8	Confident	178 Å²	178	108.1 Å²	108.1	77%	0.774	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.9	23.3	175.7	-61.7	-164.5	171.6	-156.5	0	112.3	K593 F594 L595 P599	K593-K597 VanDerWaalsContact O-CB 3.29Å; K593-K597 WeakPolarHBondContact O-CB 3.38Å; K593-K597 WeakPolarHBondContact O-CG 3.38Å; K593-K597 PolarHBondContact O-N 3.39Å; F594-K597 CarbonylContact O-C 3.56Å; F594-K597 VanDerWaalsContact O-C 3.26Å; F594-K597 PolarHBondContact O-N 3.16Å; L595-K597 PolarHBondContact O-N 2.98Å; K597-P599 VanDerWaalsContact O-CD 3.32Å; K597-P599 WeakPolarHBondContact O-CD 3.42Å
598	R	85.9	Confident	85.1	Confident	173 Å²	173	107.1 Å²	107.1	65%	0.653	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-69.2	121	-177.7	-173.5	178.9	178.4	-177.5	-0.8	107.6	F594 L595	F594-R598 HydrophobicContact CZ-CG 4.47Å; F594-R598 VanDerWaalsContact O-CA 3.29Å; F594-R598 WeakPolarHBondContact O-CA 3.32Å; F594-R598 WeakPolarHBondContact O-CB 3.48Å; F594-R598 PolarHBondContact O-N 2.99Å; L595-R598 WeakPolarHBondContact O-CB 3.41Å; L595-R598 PolarHBondContact O-N 3.43Å
599	P	87.4	Confident	84.8	Confident	68 Å²	68	109.3 Å²	109.3	44%	0.442	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-58.8	144.9	174.2	-22.3	34.1	0	0	0	110.2	K597 V604	K597-P599 VanDerWaalsContact O-CD 3.32Å; K597-P599 WeakPolarHBondContact O-CD 3.42Å; P599-V604 HydrophobicContact CB-CG2 3.88Å
600	T	88.6	Confident	83.9	Confident	93 Å²	93	108.7 Å²	108.7	57%	0.571	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-59.2	152.7	172.2	57.1	0	0	0	0	110	Q602 S603 V604	T600-Q602 PolarHBondContact O-N 2.81Å; T600-S603 PolarHBondContact O-N 3Å; T600-S603 WeakPolarHBondContact OG1-CB 3.32Å; T600-S603 PolarHBondContact OG1-N 3.42Å; T600-V604 PolarHBondContact O-N 2.86Å
601	L	80	Confident	82.8	Confident	118 Å²	118	108.9 Å²	108.9	62%	0.618	52%	0.524	S	S	*	.	H	α-helix	trans	-52.4	-42.3	176.6	-179.8	62.5	0	0	0	111	V604 K605 I610	L601-V604 PolarHBondContact O-N 2.8Å; L601-V604 VanDerWaalsContact O-N 3.14Å; L601-K605 PolarHBondContact O-N 3.36Å; L601-I610 HydrophobicContact CD1-CD1 3.73Å
602	Q	80.4	Confident	81.9	Confident	112 Å²	112	107.8 Å²	107.8	52%	0.523	52%	0.516	S	S	.	.	H	α-helix	trans	-56.5	-49.8	175	-167.6	64	9.6	0	0	112.4	T600 V604 K605 E606	T600-Q602 PolarHBondContact O-N 2.81Å; Q602-V604 PolarHBondContact O-N 2.99Å; Q602-V604 VanDerWaalsContact O-N 3.13Å; Q602-K605 WeakPolarHBondContact O-CB 3.27Å; Q602-K605 PolarHBondContact O-N 3.1Å; Q602-K605 VanDerWaalsContact O-N 3.09Å; Q602-E606 HydrophobicContact CG-CG 4.46Å; Q602-E606 WeakPolarHBondContact CG-OE1 3.43Å; Q602-E606 WeakPolarHBondContact O-CB 3.29Å; Q602-E606 VanDerWaalsContact O-CG 3.3Å; Q602-E606 WeakPolarHBondContact O-CG 3.45Å; Q602-E606 PolarHBondContact O-N 3.35Å
603	S	85.3	Confident	81.7	Confident	28 Å²	28	106.1 Å²	106.1	20%	0.196	51%	0.509	C	S	.	.	H	α-helix	trans	-72.3	-6.2	179.7	-155	0	0	0	0	114.8	T600 E606 K607	T600-S603 PolarHBondContact O-N 3Å; T600-S603 WeakPolarHBondContact OG1-CB 3.32Å; T600-S603 PolarHBondContact OG1-N 3.42Å; S603-E606 WeakPolarHBondContact CA-OE2 3.29Å; S603-E606 PolarHBondContact OG-OE2 2.84Å; S603-K607 WeakPolarHBondContact O-CD 3.29Å; S603-K607 WeakPolarHBondContact O-CG 3.44Å; S603-K607 PolarHBondContact O-NZ 2.84Å; S603-K607 PolarHBondContact OG-NZ 3.36Å
604	V	84.6	Confident	81.7	Confident	36 Å²	36	100.4 Å²	100.4	22%	0.218	49%	0.486	C	S	.	.	H	α-helix	trans	-91.8	-39	167.6	-175.5	0	0	0	0	110.9	P599 T600 L601 Q602 K607 Y609 I610	P599-V604 HydrophobicContact CB-CG2 3.88Å; T600-V604 PolarHBondContact O-N 2.86Å; L601-V604 PolarHBondContact O-N 2.8Å; L601-V604 VanDerWaalsContact O-N 3.14Å; Q602-V604 PolarHBondContact O-N 2.99Å; Q602-V604 VanDerWaalsContact O-N 3.13Å; V604-K607 PolarHBondContact O-N 3.45Å; V604-Y609 HydrophobicContact CG1-CD2 4.36Å; V604-Y609 PolarHBondContact O-N 2.89Å; V604-I610 HydrophobicContact CB-CD1 4.08Å; V604-I610 HydrophobicContact CG1-CB 4.48Å; V604-I610 HydrophobicContact CG1-CD1 3.54Å; V604-I610 HydrophobicContact CG1-CG1 3.77Å
605	K	72.9	Confident	81.8	Confident	68 Å²	68	95.2 Å²	95.2	30%	0.296	46%	0.463	S	S	.	.	H	α-helix	trans	-59.3	-51	169.8	-79.7	-171.5	161.4	-156	0	112	L601 Q602 K607 G608 I610 E612	L601-K605 PolarHBondContact O-N 3.36Å; Q602-K605 WeakPolarHBondContact O-CB 3.27Å; Q602-K605 PolarHBondContact O-N 3.1Å; Q602-K605 VanDerWaalsContact O-N 3.09Å; K605-K607 PolarHBondContact O-N 3.19Å; K605-G608 PolarHBondContact O-N 2.98Å; K605-I610 HydrophobicContact CG-CB 4.26Å; K605-I610 HydrophobicContact CG-CG2 4.08Å; K605-E612 IonicContact NZ-OE1 2.79Å; K605-E612 PolarHBondContact NZ-OE1 2.69Å
606	E	77.9	Confident	81.9	Confident	128 Å²	128	92.9 Å²	92.9	60%	0.598	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-26.8	178.9	-74	165.4	179.3	0	0	113.8	Q602 S603 G608	Q602-E606 HydrophobicContact CG-CG 4.46Å; Q602-E606 WeakPolarHBondContact CG-OE1 3.43Å; Q602-E606 WeakPolarHBondContact O-CB 3.29Å; Q602-E606 VanDerWaalsContact O-CG 3.3Å; Q602-E606 WeakPolarHBondContact O-CG 3.45Å; Q602-E606 PolarHBondContact O-N 3.35Å; S603-E606 WeakPolarHBondContact CA-OE2 3.29Å; S603-E606 PolarHBondContact OG-OE2 2.84Å; E606-G608 VanDerWaalsContact C-N 3.35Å
607	K	81.9	Confident	82.2	Confident	113 Å²	113	85.5 Å²	85.5	49%	0.491	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	5.9	178.9	-65.3	-176.5	-174.6	90.5	0	113.3	S603 V604 K605 Y609	S603-K607 WeakPolarHBondContact O-CD 3.29Å; S603-K607 WeakPolarHBondContact O-CG 3.44Å; S603-K607 PolarHBondContact O-NZ 2.84Å; S603-K607 PolarHBondContact OG-NZ 3.36Å; V604-K607 PolarHBondContact O-N 3.45Å; K605-K607 PolarHBondContact O-N 3.19Å; K607-Y609 HydrophobicContact CB-CD2 3.58Å; K607-Y609 HydrophobicContact CB-CE2 3.57Å; K607-Y609 HydrophobicContact CB-CG 4.34Å; K607-Y609 HydrophobicContact CD-CD2 4.39Å; K607-Y609 HydrophobicContact CD-CE2 3.85Å; K607-Y609 HydrophobicContact CG-CE2 4.35Å; K607-Y609 PolarHBondContact O-N 3.45Å
608	G	73.4	Confident	82.4	Confident	56 Å²	56	81.9 Å²	81.9	58%	0.577	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.4	7.5	-179.5	0	0	0	0	0	115.1	K605 E606	K605-G608 PolarHBondContact O-N 2.98Å; E606-G608 VanDerWaalsContact C-N 3.35Å
609	Y	76.1	Confident	82.8	Confident	183 Å²	183	74.2 Å²	74.2	72%	0.718	38%	0.383	S	S	*	.	S	Bend	trans	-76.6	-24.9	179.9	-61.4	-47.2	0	0	0	113	V604 K607	V604-Y609 HydrophobicContact CG1-CD2 4.36Å; V604-Y609 PolarHBondContact O-N 2.89Å; K607-Y609 HydrophobicContact CB-CD2 3.58Å; K607-Y609 HydrophobicContact CB-CE2 3.57Å; K607-Y609 HydrophobicContact CB-CG 4.34Å; K607-Y609 HydrophobicContact CD-CD2 4.39Å; K607-Y609 HydrophobicContact CD-CE2 3.85Å; K607-Y609 HydrophobicContact CG-CE2 4.35Å; K607-Y609 PolarHBondContact O-N 3.45Å
610	I	69.3	Low	83.2	Confident	64 Å²	64	76.9 Å²	76.9	33%	0.328	39%	0.389	S	S	.	.	S	Bend	trans	-119	110.8	168.7	-68.1	169.8	0	0	0	105.2	L601 V604 K605	L601-I610 HydrophobicContact CD1-CD1 3.73Å; V604-I610 HydrophobicContact CB-CD1 4.08Å; V604-I610 HydrophobicContact CG1-CB 4.48Å; V604-I610 HydrophobicContact CG1-CD1 3.54Å; V604-I610 HydrophobicContact CG1-CG1 3.77Å; K605-I610 HydrophobicContact CG-CB 4.26Å; K605-I610 HydrophobicContact CG-CG2 4.08Å
611	R	67.9	Low	83.4	Confident	169 Å²	169	74.7 Å²	74.7	64%	0.638	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-65.7	164.7	168.3	-65.6	-174.1	-178.8	-167.5	-0.6	108.9	E672	R611-E672 IonicContact CZ-OE1 3.58Å; R611-E672 IonicContact NH1-OE1 2.64Å; R611-E672 PolarHBondContact NH1-OE1 2.99Å; R611-E672 IonicContact NH2-OE1 3.75Å
612	E	68.3	Low	84.1	Confident	77 Å²	77	69.7 Å²	69.7	36%	0.36	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-76.7	130.5	168	-57.3	-138.5	123.4	0	0	109.7	K605 T621 H625	K605-E612 IonicContact NZ-OE1 2.79Å; K605-E612 PolarHBondContact NZ-OE1 2.69Å; E612-T621 VanDerWaalsContact OE2-CG2 3.29Å; E612-T621 WeakPolarHBondContact OE2-CG2 3.49Å; E612-H625 IonicContact OE2-CE1 3.88Å; E612-H625 PolarHBondContact OE2-CE1 2.88Å; E612-H625 IonicContact OE2-ND1 3.33Å; E612-H625 PolarHBondContact OE2-ND1 3.22Å
613	N	83.8	Confident	84.8	Confident	56 Å²	56	64.4 Å²	64.4	30%	0.299	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-76.2	158.6	174.8	-69.1	44.2	0	0	0	109.8	F615 C617 D669	N613-F615 VanDerWaalsContact CB-O 3.3Å; N613-F615 WeakPolarHBondContact CB-O 3.43Å; N613-C617 VanDerWaalsContact O-CB 3.29Å; N613-C617 WeakPolarHBondContact O-CB 3.32Å; N613-D669 HydrophobicContact CB-CB 4.33Å; N613-D669 PolarHBondContact ND2-OD2 3.05Å
614	V	91.8	Very high	85.2	Confident	22 Å²	22	66 Å²	66	13%	0.133	34%	0.34	C	S	.	.	S	Bend	trans	-74.8	-45.4	168.9	172.9	0	0	0	0	109	L622 F633 A668 D669 F694	V614-L622 HydrophobicContact CG1-CD2 4.1Å; V614-L622 HydrophobicContact CG2-CD1 4.4Å; V614-F633 HydrophobicContact CG1-CB 3.86Å; V614-F633 HydrophobicContact CG1-CG 4.23Å; V614-A668 VanDerWaalsContact CG2-O 3.31Å; V614-A668 WeakPolarHBondContact CG2-O 3.44Å; V614-D669 PolarHBondContact N-OD1 2.82Å; V614-F694 HydrophobicContact CG1-CD2 4.21Å; V614-F694 HydrophobicContact CG1-CE2 3.94Å; V614-F694 WeakPolarHBondContact O-CE2 3.28Å
615	F	95.3	Very high	85.5	Confident	3 Å²	3	70.4 Å²	70.4	1%	0.013	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	131.6	177.1	-75	-108.2	0	0	0	111.6	N613 F633 R665 A668 D669 L693 F694	N613-F615 VanDerWaalsContact CB-O 3.3Å; N613-F615 WeakPolarHBondContact CB-O 3.43Å; F615-F633 HydrophobicContact CE1-CE1 4.47Å; F615-F633 HydrophobicContact CE2-CD1 4.2Å; F615-F633 HydrophobicContact CE2-CD2 4.36Å; F615-F633 AromaticContact CE2-CE1 3.84Å; F615-F633 HydrophobicContact CE2-CE1 3.84Å; F615-F633 HydrophobicContact CE2-CE2 4.01Å; F615-F633 HydrophobicContact CE2-CG 4.46Å; F615-F633 AromaticContact CE2-CZ 3.75Å; F615-F633 HydrophobicContact CE2-CZ 3.75Å; F615-F633 HydrophobicContact CZ-CD1 4.22Å; F615-F633 AromaticContact CZ-CE1 3.48Å; F615-F633 HydrophobicContact CZ-CE1 3.48Å; F615-F633 VanDerWaalsContact CZ-CE1 3.48Å; F615-F633 HydrophobicContact CZ-CE2 4.21Å; F615-F633 AromaticContact CZ-CZ 3.49Å; F615-F633 HydrophobicContact CZ-CZ 3.49Å; F615-F633 VanDerWaalsContact CZ-CZ 3.49Å; F615-R665 HydrophobicContact CB-CG 4.06Å; F615-R665 VanDerWaalsContact CB-NH2 3.26Å; F615-R665 HydrophobicContact CD1-CG 3.66Å; F615-R665 HydrophobicContact CD2-CG 3.73Å; F615-R665 HydrophobicContact CE1-CB 4.48Å; F615-R665 HydrophobicContact CE1-CG 3.91Å; F615-R665 HydrophobicContact CE2-CB 4.36Å; F615-R665 HydrophobicContact CE2-CG 4.02Å; F615-R665 HydrophobicContact CG-CG 3.55Å; F615-R665 HydrophobicContact CZ-CB 4.33Å; F615-R665 HydrophobicContact CZ-CG 4.09Å; F615-A668 HydrophobicContact CD2-CB 4.31Å; F615-A668 HydrophobicContact CE2-CB 3.85Å; F615-D669 PolarHBondContact N-OD1 3.19Å; F615-L693 HydrophobicContact CD1-CG 4.32Å; F615-L693 HydrophobicContact CE1-CB 4.09Å; F615-L693 HydrophobicContact CE1-CD2 4.14Å; F615-L693 HydrophobicContact CE1-CG 4.02Å; F615-F694 HydrophobicContact CD1-CB 4.2Å; F615-F694 HydrophobicContact CD1-CD2 4.5Å; F615-F694 VanDerWaalsContact CE1-CA 3.47Å; F615-F694 HydrophobicContact CE1-CB 3.71Å; F615-F694 HydrophobicContact CG-CD2 4.48Å; F615-F694 HydrophobicContact CZ-CB 4.02Å
616	G	92.7	Very high	86.4	Confident	41 Å²	41	70 Å²	70	42%	0.423	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.5	9.6	-178	0	0	0	0	0	114.9	E697 P699	G616-E697 WeakPolarHBondContact CA-O 3.2Å; G616-P699 WeakPolarHBondContact O-CG 3.45Å
617	C	91.8	Very high	87.2	Confident	10 Å²	10	74.9 Å²	74.9	7%	0.068	37%	0.37	C	S	.	.	S	Bend	trans	-91.3	155.2	169.2	-164.7	0	0	0	0	111.1	N613 P699	N613-C617 VanDerWaalsContact O-CB 3.29Å; N613-C617 WeakPolarHBondContact O-CB 3.32Å; C617-P699 WeakPolarHBondContact O-CD 3.31Å
618	H	94.4	Very high	87.8	Confident	102 Å²	102	72.5 Å²	72.5	47%	0.472	37%	0.365	S	S	.	.			trans	-67.2	134.2	171	-71.2	-98.7	0	0	0	109.6	H620 T621 L622	H618-H620 VanDerWaalsContact C-N 3.28Å; H618-H620 PolarHBondContact O-N 2.97Å; H618-T621 PolarHBondContact O-N 2.67Å; H618-L622 PolarHBondContact O-N 2.82Å
619	L	95.8	Very high	88.9	Confident	12 Å²	12	72.7 Å²	72.7	6%	0.063	36%	0.355	C	S	.	.	H	α-helix	trans	-54.2	-44.6	-174	-165.5	71.3	0	0	0	112	T621 L622 C623 P631 F694 L698 L702 V737 T741	L619-T621 PolarHBondContact O-N 3.15Å; L619-L622 PolarHBondContact O-N 3.33Å; L619-C623 WeakPolarHBondContact O-CB 3.38Å; L619-C623 PolarHBondContact O-N 2.83Å; L619-C623 PolarHBondContact O-SG 2.78Å; L619-P631 HydrophobicContact CD1-CG 3.49Å; L619-P631 VanDerWaalsContact CD1-CG 3.49Å; L619-F694 HydrophobicContact CD1-CE1 3.99Å; L619-F694 HydrophobicContact CD1-CZ 3.98Å; L619-L698 HydrophobicContact CB-CD2 4.42Å; L619-L698 HydrophobicContact CD1-CD1 4.12Å; L619-L698 HydrophobicContact CD1-CD2 4.11Å; L619-L702 HydrophobicContact CD2-CD1 3.83Å; L619-V737 HydrophobicContact CB-CG1 4.27Å; L619-V737 HydrophobicContact CD2-CG1 3.85Å; L619-V737 HydrophobicContact CG-CG1 3.63Å; L619-T741 HydrophobicContact CD2-CG2 4.42Å
620	H	95.3	Very high	89.9	Confident	123 Å²	123	65.1 Å²	65.1	57%	0.569	33%	0.328	S	S	*	.	H	α-helix	trans	-60.1	-43.7	176	-174.1	86.6	0	0	0	113.2	H618 A624	H618-H620 VanDerWaalsContact C-N 3.28Å; H618-H620 PolarHBondContact O-N 2.97Å; H620-A624 VanDerWaalsContact O-CB 3.3Å; H620-A624 WeakPolarHBondContact O-CB 3.17Å; H620-A624 PolarHBondContact O-N 2.78Å
621	T	93.3	Very high	91.3	Very high	48 Å²	48	62.1 Å²	62.1	29%	0.294	31%	0.312	S	S	.	.	H	α-helix	trans	-67.7	-41.8	-179.6	-51.5	0	0	0	0	111.7	E612 H618 L619 A624 H625	E612-T621 VanDerWaalsContact OE2-CG2 3.29Å; E612-T621 WeakPolarHBondContact OE2-CG2 3.49Å; H618-T621 PolarHBondContact O-N 2.67Å; L619-T621 PolarHBondContact O-N 3.15Å; T621-A624 PolarHBondContact O-N 3.12Å; T621-H625 PolarHBondContact O-N 3.35Å; T621-H625 PolarHBondContact O-ND1 3.23Å
622	L	93.9	Very high	92.5	Very high	13 Å²	13	56.1 Å²	56.1	7%	0.068	30%	0.296	C	S	.	.	H	α-helix	trans	-61.3	-51.3	175.6	177.9	60.2	0	0	0	111.2	V614 H618 L619 A624 H625 E626 P631 F694	V614-L622 HydrophobicContact CG1-CD2 4.1Å; V614-L622 HydrophobicContact CG2-CD1 4.4Å; H618-L622 PolarHBondContact O-N 2.82Å; L619-L622 PolarHBondContact O-N 3.33Å; L622-A624 VanDerWaalsContact C-N 3.34Å; L622-A624 PolarHBondContact O-N 3.25Å; L622-H625 PolarHBondContact O-N 3.17Å; L622-H625 VanDerWaalsContact O-N 3.13Å; L622-E626 HydrophobicContact CD1-CG 4.23Å; L622-E626 PolarHBondContact O-N 2.9Å; L622-P631 HydrophobicContact CD2-CB 3.87Å; L622-P631 HydrophobicContact CD2-CG 4.13Å; L622-P631 HydrophobicContact CG-CB 4.49Å; L622-F694 HydrophobicContact CD2-CE2 3.74Å; L622-F694 HydrophobicContact CD2-CZ 3.82Å
623	C	95.6	Very high	93.9	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.007	28%	0.28	C	S	.	.	H	α-helix	trans	-61.1	-38.6	177.6	-75.2	0	0	0	0	112.9	L619 H625 E626 R627 T628 P631 V737	L619-C623 WeakPolarHBondContact O-CB 3.38Å; L619-C623 PolarHBondContact O-N 2.83Å; L619-C623 PolarHBondContact O-SG 2.78Å; C623-H625 VanDerWaalsContact C-N 3.34Å; C623-H625 PolarHBondContact O-N 2.96Å; C623-E626 PolarHBondContact O-N 3.43Å; C623-R627 WeakPolarHBondContact O-CA 3.25Å; C623-R627 PolarHBondContact O-N 3.41Å; C623-T628 CarbonylContact C-O 3.58Å; C623-T628 WeakPolarHBondContact CB-O 3.31Å; C623-T628 PolarHBondContact O-N 3.28Å; C623-P631 VanDerWaalsContact SG-CD 3.58Å; C623-V737 HydrophobicContact CB-CG1 3.93Å; C623-V737 HydrophobicContact CB-CG2 3.93Å
624	A	93.6	Very high	94.5	Very high	62 Å²	62	50 Å²	50	51%	0.512	27%	0.266	S	S	.	.	H	α-helix	trans	-63.6	-36.5	174.2	0	0	0	0	0	112.9	H620 T621 L622	H620-A624 VanDerWaalsContact O-CB 3.3Å; H620-A624 WeakPolarHBondContact O-CB 3.17Å; H620-A624 PolarHBondContact O-N 2.78Å; T621-A624 PolarHBondContact O-N 3.12Å; L622-A624 VanDerWaalsContact C-N 3.34Å; L622-A624 PolarHBondContact O-N 3.25Å
625	H	90.5	Very high	94.8	Very high	128 Å²	128	51.1 Å²	51.1	59%	0.593	27%	0.271	S	S	*	.	H	α-helix	trans	-74.6	-38.4	175.5	-70.8	146.1	0	0	0	113	E612 T621 L622 C623 R627	E612-H625 IonicContact OE2-CE1 3.88Å; E612-H625 PolarHBondContact OE2-CE1 2.88Å; E612-H625 IonicContact OE2-ND1 3.33Å; E612-H625 PolarHBondContact OE2-ND1 3.22Å; T621-H625 PolarHBondContact O-N 3.35Å; T621-H625 PolarHBondContact O-ND1 3.23Å; L622-H625 PolarHBondContact O-N 3.17Å; L622-H625 VanDerWaalsContact O-N 3.13Å; C623-H625 VanDerWaalsContact C-N 3.34Å; C623-H625 PolarHBondContact O-N 2.96Å; H625-R627 VanDerWaalsContact C-N 3.29Å
626	E	92.2	Very high	94.8	Very high	59 Å²	59	54.4 Å²	54.4	28%	0.276	29%	0.286	S	S	.	.	H	α-helix	trans	-75.6	-15.3	174.4	-67	-170.8	135.9	0	0	113.5	L622 C623 T628 P631 S632	L622-E626 HydrophobicContact CD1-CG 4.23Å; L622-E626 PolarHBondContact O-N 2.9Å; C623-E626 PolarHBondContact O-N 3.43Å; E626-T628 HydrophobicContact CB-CG2 4.36Å; E626-P631 VanDerWaalsContact OE2-CA 3.26Å; E626-P631 WeakPolarHBondContact OE2-CA 3.13Å; E626-S632 VanDerWaalsContact OE1-CB 3.23Å; E626-S632 WeakPolarHBondContact OE1-CB 3.31Å; E626-S632 PolarHBondContact OE1-OG 3.03Å; E626-S632 PolarHBondContact OE2-N 3.27Å
627	R	93.9	Very high	95	Very high	231 Å²	231	52.5 Å²	52.5	87%	0.872	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.7	38.4	-173.7	-52.1	179.6	-178.1	176	-0.2	113.5	C623 H625	C623-R627 WeakPolarHBondContact O-CA 3.25Å; C623-R627 PolarHBondContact O-N 3.41Å; H625-R627 VanDerWaalsContact C-N 3.29Å
628	T	95.5	Very high	95.2	Very high	62 Å²	62	52.1 Å²	52.1	38%	0.38	26%	0.263	S	S	.	.	S	Bend	trans	-121.9	172.6	177	59.2	0	0	0	0	110.2	C623 E626 V630	C623-T628 CarbonylContact C-O 3.58Å; C623-T628 WeakPolarHBondContact CB-O 3.31Å; C623-T628 PolarHBondContact O-N 3.28Å; E626-T628 HydrophobicContact CB-CG2 4.36Å; T628-V630 VanDerWaalsContact CB-O 3.25Å; T628-V630 WeakPolarHBondContact CB-O 3.49Å; T628-V630 PolarHBondContact OG1-O 3.46Å
629	T	96.6	Very high	95.2	Very high	61 Å²	61	51.9 Å²	51.9	37%	0.374	26%	0.261	S	S	.	.	S	Bend	trans	-97.5	-14.6	162.8	53.4	0	0	0	0	112.9	V737 D740	T629-V737 WeakPolarHBondContact O-CA 3.38Å; T629-D740 WeakPolarHBondContact CB-OD2 3.48Å; T629-D740 PolarHBondContact OG1-OD2 2.85Å
630	V	97.7	Very high	95.2	Very high	24 Å²	24	51.3 Å²	51.3	15%	0.145	26%	0.258	C	S	.	.	S	Bend	trans	-125.7	137.1	178	-172	0	0	0	0	109.8	T628 S632 V634 D740 T741 L744	T628-V630 VanDerWaalsContact CB-O 3.25Å; T628-V630 WeakPolarHBondContact CB-O 3.49Å; T628-V630 PolarHBondContact OG1-O 3.46Å; V630-S632 PolarHBondContact O-N 2.73Å; V630-V634 HydrophobicContact CG1-CB 4.4Å; V630-V634 HydrophobicContact CG1-CG1 4.22Å; V630-D740 HydrophobicContact CG2-CB 3.69Å; V630-T741 HydrophobicContact CG1-CG2 4.32Å; V630-L744 HydrophobicContact CG1-CB 4.46Å; V630-L744 HydrophobicContact CG1-CD2 3.75Å
631	P	96.8	Very high	95.2	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.231	C	C	.	.			trans	-61.8	136.3	-178.9	-23.8	33.2	0	0	0	113.2	L619 L622 C623 E626 F633 V634 D635 F694 T741	L619-P631 HydrophobicContact CD1-CG 3.49Å; L619-P631 VanDerWaalsContact CD1-CG 3.49Å; L622-P631 HydrophobicContact CD2-CB 3.87Å; L622-P631 HydrophobicContact CD2-CG 4.13Å; L622-P631 HydrophobicContact CG-CB 4.49Å; C623-P631 VanDerWaalsContact SG-CD 3.58Å; E626-P631 VanDerWaalsContact OE2-CA 3.26Å; E626-P631 WeakPolarHBondContact OE2-CA 3.13Å; P631-F633 PolarHBondContact O-N 2.84Å; P631-V634 HydrophobicContact CB-CB 4.36Å; P631-V634 HydrophobicContact CB-CG2 4.04Å; P631-V634 HydrophobicContact CG-CG2 4.17Å; P631-V634 WeakPolarHBondContact O-CB 3.22Å; P631-V634 PolarHBondContact O-N 2.96Å; P631-D635 PolarHBondContact O-N 3.03Å; P631-F694 HydrophobicContact CB-CE1 4.46Å; P631-F694 HydrophobicContact CB-CZ 3.94Å; P631-F694 HydrophobicContact CG-CE1 4.07Å; P631-F694 HydrophobicContact CG-CZ 3.72Å; P631-T741 WeakPolarHBondContact CD-OG1 3.33Å
632	S	94.9	Very high	95.2	Very high	43 Å²	43	45.6 Å²	45.6	30%	0.301	23%	0.228	S	C	.	.	H	α-helix	trans	-60.7	-30.7	-179.3	80	0	0	0	0	112.5	E626 V630 K636	E626-S632 VanDerWaalsContact OE1-CB 3.23Å; E626-S632 WeakPolarHBondContact OE1-CB 3.31Å; E626-S632 PolarHBondContact OE1-OG 3.03Å; E626-S632 PolarHBondContact OE2-N 3.27Å; V630-S632 PolarHBondContact O-N 2.73Å; S632-K636 VanDerWaalsContact O-CB 3.31Å; S632-K636 WeakPolarHBondContact O-CB 3.31Å; S632-K636 WeakPolarHBondContact O-CG 3.38Å; S632-K636 PolarHBondContact O-N 2.92Å
633	F	96.4	Very high	95.1	Very high	4 Å²	4	51.7 Å²	51.7	2%	0.018	25%	0.25	C	C	.	.	H	α-helix	trans	-64.7	-40.2	174.2	-179	-97.7	0	0	0	112.8	V614 F615 P631 C637 A668 L674 A690 F694	V614-F633 HydrophobicContact CG1-CB 3.86Å; V614-F633 HydrophobicContact CG1-CG 4.23Å; F615-F633 HydrophobicContact CE1-CE1 4.47Å; F615-F633 HydrophobicContact CE2-CD1 4.2Å; F615-F633 HydrophobicContact CE2-CD2 4.36Å; F615-F633 AromaticContact CE2-CE1 3.84Å; F615-F633 HydrophobicContact CE2-CE1 3.84Å; F615-F633 HydrophobicContact CE2-CE2 4.01Å; F615-F633 HydrophobicContact CE2-CG 4.46Å; F615-F633 AromaticContact CE2-CZ 3.75Å; F615-F633 HydrophobicContact CE2-CZ 3.75Å; F615-F633 HydrophobicContact CZ-CD1 4.22Å; F615-F633 AromaticContact CZ-CE1 3.48Å; F615-F633 HydrophobicContact CZ-CE1 3.48Å; F615-F633 VanDerWaalsContact CZ-CE1 3.48Å; F615-F633 HydrophobicContact CZ-CE2 4.21Å; F615-F633 AromaticContact CZ-CZ 3.49Å; F615-F633 HydrophobicContact CZ-CZ 3.49Å; F615-F633 VanDerWaalsContact CZ-CZ 3.49Å; P631-F633 PolarHBondContact O-N 2.84Å; F633-C637 WeakPolarHBondContact CZ-SG 3.4Å; F633-C637 WeakPolarHBondContact O-CB 3.31Å; F633-C637 PolarHBondContact O-N 3.41Å; F633-C637 PolarHBondContact O-SG 2.9Å; F633-A668 HydrophobicContact CD2-CB 3.76Å; F633-A668 HydrophobicContact CE2-CB 3.83Å; F633-L674 HydrophobicContact CD2-CD2 3.59Å; F633-L674 HydrophobicContact CE2-CD2 3.73Å; F633-A690 HydrophobicContact CZ-CB 3.99Å; F633-F694 HydrophobicContact CD1-CB 4.09Å; F633-F694 HydrophobicContact CD1-CD2 4.02Å; F633-F694 HydrophobicContact CD1-CG 4.06Å; F633-F694 HydrophobicContact CE1-CB 3.92Å; F633-F694 HydrophobicContact CE1-CG 4.4Å
634	V	97.7	Very high	95	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-66.5	-50.3	178.9	169.8	0	0	0	0	109.8	V630 P631 K636 C637 I638 L691 F694 F695	V630-V634 HydrophobicContact CG1-CB 4.4Å; V630-V634 HydrophobicContact CG1-CG1 4.22Å; P631-V634 HydrophobicContact CB-CB 4.36Å; P631-V634 HydrophobicContact CB-CG2 4.04Å; P631-V634 HydrophobicContact CG-CG2 4.17Å; P631-V634 WeakPolarHBondContact O-CB 3.22Å; P631-V634 PolarHBondContact O-N 2.96Å; V634-K636 PolarHBondContact O-N 3.13Å; V634-C637 PolarHBondContact O-N 3.23Å; V634-I638 HydrophobicContact CG1-CD1 3.8Å; V634-I638 WeakPolarHBondContact O-CB 3.38Å; V634-I638 WeakPolarHBondContact O-CG1 3.47Å; V634-I638 PolarHBondContact O-N 2.84Å; V634-L691 HydrophobicContact CB-CD1 4.22Å; V634-L691 HydrophobicContact CG1-CD1 4.16Å; V634-L691 HydrophobicContact CG2-CD1 3.95Å; V634-F694 HydrophobicContact CG2-CD1 3.61Å; V634-F694 HydrophobicContact CG2-CE1 3.47Å; V634-F694 VanDerWaalsContact CG2-CE1 3.47Å; V634-F694 HydrophobicContact CG2-CG 4.47Å; V634-F694 HydrophobicContact CG2-CZ 4.23Å; V634-F695 HydrophobicContact CG1-CZ 4.06Å; V634-F695 HydrophobicContact CG2-CE1 4.45Å; V634-F695 HydrophobicContact CG2-CE2 4.41Å; V634-F695 HydrophobicContact CG2-CZ 3.89Å
635	D	96.1	Very high	94.9	Very high	47 Å²	47	52.3 Å²	52.3	25%	0.251	24%	0.239	S	C	.	.	H	α-helix	trans	-57	-46.7	176.7	176.5	77.6	0	0	0	112.6	P631 I638 K639 L744	P631-D635 PolarHBondContact O-N 3.03Å; D635-I638 PolarHBondContact O-N 3.24Å; D635-K639 WeakPolarHBondContact O-CB 3.38Å; D635-K639 WeakPolarHBondContact O-CG 3.41Å; D635-K639 PolarHBondContact O-N 3.24Å; D635-K639 WeakPolarHBondContact OD1-CE 3.4Å; D635-K639 IonicContact OD1-NZ 3.34Å; D635-K639 PolarHBondContact OD1-NZ 3.16Å; D635-K639 WeakPolarHBondContact OD2-CD 3.46Å; D635-K639 WeakPolarHBondContact OD2-CE 3.3Å; D635-K639 IonicContact OD2-NZ 2.71Å; D635-K639 PolarHBondContact OD2-NZ 3.17Å; D635-L744 HydrophobicContact CB-CD2 4.21Å
636	K	95.7	Very high	95	Very high	72 Å²	72	47 Å²	47	31%	0.313	22%	0.215	S	C	.	.	H	α-helix	trans	-61.9	-45.7	176.6	-76.6	175.5	175.7	-170.5	0	112.4	S632 V634 K639 A640 L674 L676	S632-K636 VanDerWaalsContact O-CB 3.31Å; S632-K636 WeakPolarHBondContact O-CB 3.31Å; S632-K636 WeakPolarHBondContact O-CG 3.38Å; S632-K636 PolarHBondContact O-N 2.92Å; V634-K636 PolarHBondContact O-N 3.13Å; K636-K639 PolarHBondContact O-N 3.12Å; K636-A640 WeakPolarHBondContact O-CB 3.47Å; K636-A640 PolarHBondContact O-N 3.48Å; K636-L674 PolarHBondContact NZ-O 3.18Å; K636-L676 HydrophobicContact CB-CD1 4.04Å; K636-L676 WeakPolarHBondContact O-CD1 3.12Å
637	C	97.1	Very high	95.1	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-62.9	-47.1	178.8	-71.3	0	0	0	0	111.6	F633 V634 A640 V641 I687 L691	F633-C637 WeakPolarHBondContact CZ-SG 3.4Å; F633-C637 WeakPolarHBondContact O-CB 3.31Å; F633-C637 PolarHBondContact O-N 3.41Å; F633-C637 PolarHBondContact O-SG 2.9Å; V634-C637 PolarHBondContact O-N 3.23Å; C637-A640 PolarHBondContact O-N 3.01Å; C637-V641 VanDerWaalsContact O-CG2 3.31Å; C637-V641 WeakPolarHBondContact O-CG2 3.32Å; C637-V641 PolarHBondContact O-N 2.85Å; C637-I687 HydrophobicContact CB-CG2 3.85Å; C637-L691 HydrophobicContact CB-CB 4.06Å; C637-L691 HydrophobicContact CB-CD1 4.11Å; C637-L691 HydrophobicContact CB-CD2 4.03Å; C637-L691 HydrophobicContact CB-CG 4.3Å
638	I	96.4	Very high	95.1	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.01	20%	0.197	C	C	.	.	H	α-helix	trans	-56.4	-52.5	176.4	-77.5	175	0	0	0	110.4	V634 D635 A640 V641 E642 L691 L744 L745 H748	V634-I638 HydrophobicContact CG1-CD1 3.8Å; V634-I638 WeakPolarHBondContact O-CB 3.38Å; V634-I638 WeakPolarHBondContact O-CG1 3.47Å; V634-I638 PolarHBondContact O-N 2.84Å; D635-I638 PolarHBondContact O-N 3.24Å; I638-A640 VanDerWaalsContact C-N 3.29Å; I638-A640 PolarHBondContact O-N 3.38Å; I638-V641 PolarHBondContact O-N 3.33Å; I638-V641 VanDerWaalsContact O-N 3.16Å; I638-E642 WeakPolarHBondContact CG2-OE1 3.3Å; I638-E642 WeakPolarHBondContact O-CG 3.43Å; I638-E642 PolarHBondContact O-N 3.49Å; I638-L691 HydrophobicContact CG1-CD2 3.89Å; I638-L744 HydrophobicContact CD1-CD2 4.1Å; I638-L744 HydrophobicContact CD1-CG 3.89Å; I638-L745 HydrophobicContact CD1-CD1 4.39Å; I638-H748 HydrophobicContact CD1-CB 4.12Å; I638-H748 HydrophobicContact CG1-CB 4.23Å; I638-H748 HydrophobicContact CG2-CB 3.85Å
639	K	94.8	Very high	95	Very high	98 Å²	98	40.3 Å²	40.3	43%	0.426	20%	0.196	S	C	.	.	H	α-helix	trans	-61.9	-32.5	178.5	-74	169.8	179.5	162	0	113.6	D635 K636 R643	D635-K639 WeakPolarHBondContact O-CB 3.38Å; D635-K639 WeakPolarHBondContact O-CG 3.41Å; D635-K639 PolarHBondContact O-N 3.24Å; D635-K639 WeakPolarHBondContact OD1-CE 3.4Å; D635-K639 IonicContact OD1-NZ 3.34Å; D635-K639 PolarHBondContact OD1-NZ 3.16Å; D635-K639 WeakPolarHBondContact OD2-CD 3.46Å; D635-K639 WeakPolarHBondContact OD2-CE 3.3Å; D635-K639 IonicContact OD2-NZ 2.71Å; D635-K639 PolarHBondContact OD2-NZ 3.17Å; K636-K639 PolarHBondContact O-N 3.12Å; K639-R643 WeakPolarHBondContact O-CB 3.46Å; K639-R643 VanDerWaalsContact O-CG 3.3Å; K639-R643 WeakPolarHBondContact O-CG 3.26Å; K639-R643 VanDerWaalsContact O-CZ 3.25Å; K639-R643 PolarHBondContact O-N 3.3Å; K639-R643 PolarHBondContact O-NE 3.1Å; K639-R643 PolarHBondContact O-NH2 2.88Å
640	A	95.1	Very high	94.9	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-72.7	-39.1	175.9	0	0	0	0	0	112.1	K636 C637 I638 R643 R644 L676 I687	K636-A640 WeakPolarHBondContact O-CB 3.47Å; K636-A640 PolarHBondContact O-N 3.48Å; C637-A640 PolarHBondContact O-N 3.01Å; I638-A640 VanDerWaalsContact C-N 3.29Å; I638-A640 PolarHBondContact O-N 3.38Å; A640-R643 PolarHBondContact O-N 3.35Å; A640-R644 WeakPolarHBondContact O-CG 3.39Å; A640-R644 PolarHBondContact O-N 3.01Å; A640-L676 HydrophobicContact CB-CB 4.07Å; A640-L676 HydrophobicContact CB-CD1 3.83Å; A640-I687 HydrophobicContact CB-CD1 3.93Å; A640-I687 HydrophobicContact CB-CG2 4.42Å
641	V	95.4	Very high	94.8	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-65.1	-45.1	174.6	174	0	0	0	0	111.1	C637 I638 R643 R644 G645 L651 Y652 V684 I687 T688	C637-V641 VanDerWaalsContact O-CG2 3.31Å; C637-V641 WeakPolarHBondContact O-CG2 3.32Å; C637-V641 PolarHBondContact O-N 2.85Å; I638-V641 PolarHBondContact O-N 3.33Å; I638-V641 VanDerWaalsContact O-N 3.16Å; V641-R643 VanDerWaalsContact C-N 3.26Å; V641-R643 PolarHBondContact O-N 3.15Å; V641-R644 PolarHBondContact O-N 3.45Å; V641-G645 VanDerWaalsContact O-CA 3.31Å; V641-G645 WeakPolarHBondContact O-CA 3.35Å; V641-G645 PolarHBondContact O-N 2.78Å; V641-L651 HydrophobicContact CG1-CD1 4.05Å; V641-L651 HydrophobicContact CG1-CD2 3.8Å; V641-L651 HydrophobicContact CG1-CG 4.36Å; V641-Y652 HydrophobicContact CG1-CE2 4.26Å; V641-V684 HydrophobicContact CB-CG2 4.42Å; V641-V684 HydrophobicContact CG1-CG2 4.43Å; V641-V684 HydrophobicContact CG2-CG2 3.91Å; V641-I687 HydrophobicContact CG2-CB 4.44Å; V641-I687 HydrophobicContact CG2-CG2 3.92Å; V641-T688 HydrophobicContact CG1-CG2 4.2Å; V641-T688 HydrophobicContact CG2-CG2 3.55Å
642	E	93.6	Very high	94.8	Very high	50 Å²	50	36.3 Å²	36.3	23%	0.234	17%	0.171	C	C	.	.	H	α-helix	trans	-61	-32.4	178.6	-70.8	178.8	-164.9	0	0	113.3	I638 H748 R753	I638-E642 WeakPolarHBondContact CG2-OE1 3.3Å; I638-E642 WeakPolarHBondContact O-CG 3.43Å; I638-E642 PolarHBondContact O-N 3.49Å; E642-H748 VanDerWaalsContact CG-ND1 3.3Å; E642-H748 WeakPolarHBondContact CG-ND1 3.3Å; E642-H748 IonicContact OE1-CE1 3.8Å; E642-H748 IonicContact OE1-CG 2.69Å; E642-H748 IonicContact OE1-ND1 3.67Å; E642-H748 PolarHBondContact OE1-ND1 3.07Å; E642-R753 HydrophobicContact CG-CG 4.47Å; E642-R753 WeakPolarHBondContact OE1-CD 3.19Å; E642-R753 IonicContact OE1-CZ 3.09Å; E642-R753 IonicContact OE1-NE 2.66Å; E642-R753 IonicContact OE1-NH1 2.66Å; E642-R753 PolarHBondContact OE1-NH1 3.48Å; E642-R753 WeakPolarHBondContact OE2-CD 3.19Å; E642-R753 IonicContact OE2-CZ 2.94Å; E642-R753 IonicContact OE2-NH1 2.7Å; E642-R753 PolarHBondContact OE2-NH1 2.91Å
643	R	92.1	Very high	94.9	Very high	142 Å²	142	39 Å²	39	54%	0.536	18%	0.175	S	C	.	.	H	α-helix	trans	-87.7	-14.9	-175.4	-73.8	-178.7	-69.1	92.4	-0.4	115.1	K639 A640 V641 E677	K639-R643 WeakPolarHBondContact O-CB 3.46Å; K639-R643 VanDerWaalsContact O-CG 3.3Å; K639-R643 WeakPolarHBondContact O-CG 3.26Å; K639-R643 VanDerWaalsContact O-CZ 3.25Å; K639-R643 PolarHBondContact O-N 3.3Å; K639-R643 PolarHBondContact O-NE 3.1Å; K639-R643 PolarHBondContact O-NH2 2.88Å; A640-R643 PolarHBondContact O-N 3.35Å; V641-R643 VanDerWaalsContact C-N 3.26Å; V641-R643 PolarHBondContact O-N 3.15Å; R643-E677 IonicContact CZ-OE1 2.91Å; R643-E677 IonicContact CZ-OE2 3.64Å; R643-E677 IonicContact NH1-OE1 2.72Å; R643-E677 PolarHBondContact NH1-OE1 3.26Å; R643-E677 VanDerWaalsContact NH1-OE1 3.08Å; R643-E677 IonicContact NH1-OE2 3.56Å; R643-E677 PolarHBondContact NH1-OE2 3.32Å; R643-E677 IonicContact NH2-OE1 2.84Å; R643-E677 PolarHBondContact NH2-OE1 3.37Å; R643-E677 IonicContact NH2-OE2 2.72Å
644	R	92.1	Very high	95	Very high	74 Å²	74	41.6 Å²	41.6	28%	0.279	19%	0.19	S	C	.	.	H	α-helix	trans	-155	23.7	-178.1	69.1	175.3	-168.7	-108.4	6.7	116.3	A640 V641 L676 E677 W681	A640-R644 WeakPolarHBondContact O-CG 3.39Å; A640-R644 PolarHBondContact O-N 3.01Å; V641-R644 PolarHBondContact O-N 3.45Å; R644-L676 PolarHBondContact NH1-O 2.9Å; R644-L676 PolarHBondContact NH2-O 3.13Å; R644-E677 IonicContact NH1-OE1 3.13Å; R644-E677 PolarHBondContact NH1-OE1 2.82Å; R644-E677 IonicContact NH1-OE2 3.26Å; R644-E677 PolarHBondContact NH1-OE2 3.45Å; R644-W681 PolarHBondContact NH2-O 3.18Å
645	G	91.3	Very high	94.9	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.01	22%	0.223	C	C	.	.			trans	-143.1	-9.7	-171.9	0	0	0	0	0	117.7	V641 D647 I648 L651	V641-G645 VanDerWaalsContact O-CA 3.31Å; V641-G645 WeakPolarHBondContact O-CA 3.35Å; V641-G645 PolarHBondContact O-N 2.78Å; G645-D647 PolarHBondContact O-N 2.9Å; G645-I648 PolarHBondContact O-N 3.28Å; G645-L651 WeakPolarHBondContact O-CD1 3.3Å; G645-L651 WeakPolarHBondContact O-CD2 3.4Å
646	L	93.8	Very high	94.9	Very high	16 Å²	16	44.6 Å²	44.6	8%	0.084	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-23.1	-173	-62.8	178.8	0	0	0	113.5	L651 R753 V754 Y757 N761	L646-L651 HydrophobicContact CD2-CD2 4.48Å; L646-R753 HydrophobicContact CD1-CB 4.35Å; L646-R753 HydrophobicContact CD1-CG 4.12Å; L646-R753 HydrophobicContact CD2-CB 4.09Å; L646-V754 HydrophobicContact CD2-CG2 3.98Å; L646-Y757 HydrophobicContact CB-CD1 3.76Å; L646-Y757 HydrophobicContact CB-CD2 4.27Å; L646-Y757 HydrophobicContact CB-CE1 4.03Å; L646-Y757 HydrophobicContact CB-CG 3.89Å; L646-Y757 HydrophobicContact CD1-CD2 4.37Å; L646-Y757 HydrophobicContact CD1-CE2 4.09Å; L646-Y757 VanDerWaalsContact O-CB 3.27Å; L646-Y757 WeakPolarHBondContact O-CB 3.49Å; L646-N761 WeakPolarHBondContact O-CB 3.41Å; L646-N761 PolarHBondContact O-ND2 2.87Å
647	D	93.4	Very high	95	Very high	94 Å²	94	45.6 Å²	45.6	50%	0.503	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-1.3	179.9	61.3	-42.6	0	0	0	114.4	G645	G645-D647 PolarHBondContact O-N 2.9Å
648	I	94.4	Very high	94.9	Very high	54 Å²	54	51 Å²	51	28%	0.277	25%	0.254	S	S	.	.	S	Bend	trans	-89.1	116.3	-170.8	-56.7	-60.7	0	0	0	112	G645 G650 L651 V684 N761	G645-I648 PolarHBondContact O-N 3.28Å; I648-G650 PolarHBondContact O-N 3.49Å; I648-L651 WeakPolarHBondContact O-CB 3.22Å; I648-L651 PolarHBondContact O-N 2.76Å; I648-V684 HydrophobicContact CB-CG1 4.27Å; I648-V684 HydrophobicContact CG1-CG1 4.06Å; I648-V684 HydrophobicContact CG2-CG1 4.17Å; I648-N761 WeakPolarHBondContact O-CB 3.31Å
649	D	94.1	Very high	94.9	Very high	65 Å²	65	54.3 Å²	54.3	35%	0.348	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49	119.9	178.1	-173.5	-4.5	0	0	0	112.8	R653 N761 R762	D649-R653 IonicContact OD1-NH2 2.74Å; D649-R653 PolarHBondContact OD1-NH2 2.92Å; D649-N761 WeakPolarHBondContact CA-O 3.49Å; D649-R762 IonicContact OD2-CZ 2.87Å; D649-R762 IonicContact OD2-NE 2.88Å; D649-R762 IonicContact OD2-NH1 2.84Å; D649-R762 PolarHBondContact OD2-NH1 3.02Å
650	G	94.4	Very high	95	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.1	32.7	-178.4	0	0	0	0	0	113.9	I648 Y652 R653 V654 N761	I648-G650 PolarHBondContact O-N 3.49Å; G650-Y652 PolarHBondContact O-N 3.39Å; G650-R653 VanDerWaalsContact CA-CZ 3.5Å; G650-R653 WeakPolarHBondContact O-CB 3.32Å; G650-R653 PolarHBondContact O-N 2.68Å; G650-V654 WeakPolarHBondContact O-CB 3.34Å; G650-V654 PolarHBondContact O-N 3.22Å; G650-N761 PolarHBondContact N-O 3.2Å
651	L	95.7	Very high	95.2	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.7	136.6	168.2	-169	67.2	0	0	0	110.8	V641 G645 L646 I648 R653 V684 T688 V754 M763	V641-L651 HydrophobicContact CG1-CD1 4.05Å; V641-L651 HydrophobicContact CG1-CD2 3.8Å; V641-L651 HydrophobicContact CG1-CG 4.36Å; G645-L651 WeakPolarHBondContact O-CD1 3.3Å; G645-L651 WeakPolarHBondContact O-CD2 3.4Å; L646-L651 HydrophobicContact CD2-CD2 4.48Å; I648-L651 WeakPolarHBondContact O-CB 3.22Å; I648-L651 PolarHBondContact O-N 2.76Å; L651-R653 PolarHBondContact O-N 3.36Å; L651-V684 HydrophobicContact CD1-CG1 4.09Å; L651-V684 HydrophobicContact CD1-CG2 4.1Å; L651-T688 HydrophobicContact CD1-CG2 3.77Å; L651-T688 HydrophobicContact CG-CG2 4.35Å; L651-V754 HydrophobicContact CD2-CG1 4.14Å; L651-V754 HydrophobicContact CD2-CG2 3.92Å; L651-M763 WeakPolarHBondContact O-CE 3.47Å; L651-M763 VanDerWaalsContact O-CG 3.31Å; L651-M763 WeakPolarHBondContact O-CG 2.79Å; L651-M763 VanDerWaalsContact O-SD 3.37Å
652	Y	96.9	Very high	95.2	Very high	0 Å²	0	56 Å²	56	0%	0	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.7	-28.3	-168	-64.5	-80.3	0	0	0	117.3	V641 G650 T688 L691 K692 H748 L749 V754 F772	V641-Y652 HydrophobicContact CG1-CE2 4.26Å; G650-Y652 PolarHBondContact O-N 3.39Å; Y652-T688 HydrophobicContact CD1-CG2 3.75Å; Y652-T688 HydrophobicContact CD2-CG2 4.16Å; Y652-T688 HydrophobicContact CE1-CG2 3.48Å; Y652-T688 VanDerWaalsContact CE1-CG2 3.48Å; Y652-T688 HydrophobicContact CE2-CG2 3.92Å; Y652-T688 HydrophobicContact CG-CG2 4.06Å; Y652-L691 HydrophobicContact CE1-CD2 4.16Å; Y652-K692 HydrophobicContact CD1-CD 4.32Å; Y652-K692 HydrophobicContact CD1-CG 4.28Å; Y652-K692 PolarHBondContact O-NZ 2.96Å; Y652-H748 AromaticContact CE2-CD2 4Å; Y652-H748 AromaticContact CE2-NE2 3.41Å; Y652-H748 WeakPolarHBondContact CE2-NE2 3.4Å; Y652-H748 AromaticContact CZ-CD2 3.95Å; Y652-H748 AromaticContact CZ-NE2 3.53Å; Y652-H748 PolarHBondContact OH-CD2 3.31Å; Y652-H748 VanDerWaalsContact OH-CD2 3.24Å; Y652-H748 PolarHBondContact OH-NE2 3.44Å; Y652-L749 HydrophobicContact CD2-CD2 4.04Å; Y652-L749 HydrophobicContact CE2-CD2 3.88Å; Y652-V754 HydrophobicContact CD2-CG1 4.46Å; Y652-V754 HydrophobicContact CE2-CG2 4.13Å; Y652-F772 AromaticContact CD1-CE2 3.68Å; Y652-F772 HydrophobicContact CD1-CE2 3.68Å; Y652-F772 AromaticContact CD1-CZ 3.48Å; Y652-F772 HydrophobicContact CD1-CZ 3.48Å; Y652-F772 VanDerWaalsContact CD1-CZ 3.48Å; Y652-F772 HydrophobicContact CD2-CE2 4.36Å; Y652-F772 HydrophobicContact CE1-CE2 4.24Å; Y652-F772 AromaticContact CE1-CZ 3.68Å; Y652-F772 HydrophobicContact CE1-CZ 3.68Å; Y652-F772 AromaticContact CG-CE2 3.76Å; Y652-F772 HydrophobicContact CG-CE2 3.76Å; Y652-F772 HydrophobicContact CG-CZ 4.05Å
653	R	96.8	Very high	95.3	Very high	101 Å²	101	58.3 Å²	58.3	38%	0.381	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-49.9	174.7	179.9	178.6	71.1	-142.5	-1.8	112	D649 G650 L651 R762 M763	D649-R653 IonicContact OD1-NH2 2.74Å; D649-R653 PolarHBondContact OD1-NH2 2.92Å; G650-R653 VanDerWaalsContact CA-CZ 3.5Å; G650-R653 WeakPolarHBondContact O-CB 3.32Å; G650-R653 PolarHBondContact O-N 2.68Å; L651-R653 PolarHBondContact O-N 3.36Å; R653-R762 PolarHBondContact NH1-O 3.02Å; R653-M763 HydrophobicContact CB-CE 3.91Å; R653-M763 HydrophobicContact CB-SD 3.62Å
654	V	96.9	Very high	95.5	Very high	57 Å²	57	51.6 Å²	51.6	35%	0.345	28%	0.278	S	S	.	.	S	Bend	trans	-68.9	143.1	178.4	173.8	0	0	0	0	110.2	G650 H685	G650-V654 WeakPolarHBondContact O-CB 3.34Å; G650-V654 PolarHBondContact O-N 3.22Å; V654-H685 HydrophobicContact CG1-CB 4.41Å
655	S	96.2	Very high	95.6	Very high	99 Å²	99	50.2 Å²	50.2	69%	0.692	27%	0.273	S	S	*	.			trans	-102.5	122	-179.9	-67.3	0	0	0	0	111.1
656	G	96.5	Very high	95.7	Very high	11 Å²	11	56.2 Å²	56.2	11%	0.113	30%	0.299	C	S	.	.			trans	-72.8	174.9	174	0	0	0	0	0	112.8	L658 H685	G656-L658 PolarHBondContact O-N 3.12Å; G656-H685 VanDerWaalsContact CA-CB 3.47Å; G656-H685 WeakPolarHBondContact CA-O 3.41Å; G656-H685 PolarHBondContact N-O 3.21Å
657	N	97.1	Very high	95.6	Very high	94 Å²	94	57.6 Å²	57.6	50%	0.503	31%	0.305	S	S	.	.			trans	-64.2	111.2	-176.8	-174.3	-35.7	0	0	0	111.8	A659 V660 I661	N657-A659 VanDerWaalsContact C-N 3.25Å; N657-A659 PolarHBondContact O-N 3.5Å; N657-A659 VanDerWaalsContact O-N 3.16Å; N657-A659 WeakPolarHBondContact OD1-CB 3.08Å; N657-A659 PolarHBondContact OD1-N 3.47Å; N657-V660 HydrophobicContact CB-CB 4.26Å; N657-V660 HydrophobicContact CB-CG2 3.85Å; N657-V660 WeakPolarHBondContact O-CA 3.41Å; N657-V660 PolarHBondContact O-N 3.08Å; N657-I661 PolarHBondContact O-N 3.33Å
658	L	96.2	Very high	95.6	Very high	112 Å²	112	53.6 Å²	53.6	59%	0.586	28%	0.284	S	S	*	.	H	α-helix	trans	-56	-34	-176.4	-177.2	60.6	0	0	0	113.9	G656 V660 I661 Q662	G656-L658 PolarHBondContact O-N 3.12Å; L658-V660 VanDerWaalsContact C-N 3.32Å; L658-I661 PolarHBondContact O-N 2.92Å; L658-Q662 HydrophobicContact CD1-CG 4.33Å; L658-Q662 WeakPolarHBondContact O-CB 3.48Å; L658-Q662 WeakPolarHBondContact O-CG 3.28Å; L658-Q662 PolarHBondContact O-N 3.04Å
659	A	96.7	Very high	95.4	Very high	73 Å²	73	51.7 Å²	51.7	60%	0.603	28%	0.275	S	S	*	.	H	α-helix	trans	-69	-33.1	176.7	0	0	0	0	0	112	N657 K663	N657-A659 VanDerWaalsContact C-N 3.25Å; N657-A659 PolarHBondContact O-N 3.5Å; N657-A659 VanDerWaalsContact O-N 3.16Å; N657-A659 WeakPolarHBondContact OD1-CB 3.08Å; N657-A659 PolarHBondContact OD1-N 3.47Å; A659-K663 WeakPolarHBondContact O-CB 3.48Å; A659-K663 PolarHBondContact O-N 2.91Å
660	V	96.9	Very high	94.9	Very high	43 Å²	43	53.6 Å²	53.6	26%	0.261	28%	0.281	S	S	.	.	H	α-helix	trans	-77.6	-36.6	175.1	-167.8	0	0	0	0	110.6	N657 L658 Q662 K663 L664 W681 V686	N657-V660 HydrophobicContact CB-CB 4.26Å; N657-V660 HydrophobicContact CB-CG2 3.85Å; N657-V660 WeakPolarHBondContact O-CA 3.41Å; N657-V660 PolarHBondContact O-N 3.08Å; L658-V660 VanDerWaalsContact C-N 3.32Å; V660-Q662 VanDerWaalsContact C-N 3.34Å; V660-Q662 PolarHBondContact O-N 3Å; V660-K663 WeakPolarHBondContact O-CB 3.47Å; V660-K663 PolarHBondContact O-N 3.22Å; V660-L664 PolarHBondContact O-N 2.94Å; V660-W681 HydrophobicContact CG1-CE3 3.89Å; V660-W681 HydrophobicContact CG1-CZ3 3.78Å; V660-V686 HydrophobicContact CB-CG1 4.27Å; V660-V686 HydrophobicContact CB-CG2 3.92Å; V660-V686 HydrophobicContact CG1-CG1 3.93Å; V660-V686 HydrophobicContact CG1-CG2 4.02Å
661	I	97.8	Very high	93.9	Very high	11 Å²	11	55.5 Å²	55.5	6%	0.056	30%	0.297	C	S	.	.	H	α-helix	trans	-58.3	-45.7	170.4	-66.6	167.9	0	0	0	110.6	N657 L658 K663 L664 R665 V686 A690 L693	N657-I661 PolarHBondContact O-N 3.33Å; L658-I661 PolarHBondContact O-N 2.92Å; I661-K663 VanDerWaalsContact C-N 3.34Å; I661-K663 PolarHBondContact O-N 2.95Å; I661-L664 WeakPolarHBondContact O-CB 3.29Å; I661-L664 PolarHBondContact O-N 3.24Å; I661-R665 WeakPolarHBondContact O-CB 3.31Å; I661-R665 PolarHBondContact O-N 2.82Å; I661-V686 HydrophobicContact CG1-CB 4.23Å; I661-V686 HydrophobicContact CG1-CG1 3.93Å; I661-V686 HydrophobicContact CG1-CG2 4.36Å; I661-A690 HydrophobicContact CG2-CB 4.11Å; I661-L693 HydrophobicContact CG2-CD2 3.76Å
662	Q	96.6	Very high	92.7	Very high	80 Å²	80	63.8 Å²	63.8	37%	0.374	34%	0.336	S	S	.	.	H	α-helix	trans	-68	-31.7	176.7	-72	-66.3	-23.6	0	0	112.8	L658 V660 F666	L658-Q662 HydrophobicContact CD1-CG 4.33Å; L658-Q662 WeakPolarHBondContact O-CB 3.48Å; L658-Q662 WeakPolarHBondContact O-CG 3.28Å; L658-Q662 PolarHBondContact O-N 3.04Å; V660-Q662 VanDerWaalsContact C-N 3.34Å; V660-Q662 PolarHBondContact O-N 3Å; Q662-F666 WeakPolarHBondContact O-CB 3.26Å; Q662-F666 PolarHBondContact O-N 3.39Å
663	K	95.1	Very high	91.8	Very high	98 Å²	98	71.3 Å²	71.3	43%	0.426	37%	0.371	S	S	.	.	H	α-helix	trans	-66.3	-39.4	169.7	-172.3	-160.1	163.4	-151.9	0	111.8	A659 V660 I661 F666 K667 W681	A659-K663 WeakPolarHBondContact O-CB 3.48Å; A659-K663 PolarHBondContact O-N 2.91Å; V660-K663 WeakPolarHBondContact O-CB 3.47Å; V660-K663 PolarHBondContact O-N 3.22Å; I661-K663 VanDerWaalsContact C-N 3.34Å; I661-K663 PolarHBondContact O-N 2.95Å; K663-F666 PolarHBondContact O-N 3.28Å; K663-K667 PolarHBondContact O-N 2.94Å; K663-W681 HydrophobicContact CB-CH2 4.35Å; K663-W681 HydrophobicContact CB-CZ3 4.34Å; K663-W681 HydrophobicContact CD-CH2 3.81Å; K663-W681 HydrophobicContact CD-CZ3 4.09Å; K663-W681 HydrophobicContact CG-CH2 3.95Å; K663-W681 HydrophobicContact CG-CZ3 4.36Å
664	L	96	Very high	91.4	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-66.4	-47.2	175.5	-179.8	50.1	0	0	0	111	V660 I661 F666 K667 A668 L674 L676 W681 V686 A690	V660-L664 PolarHBondContact O-N 2.94Å; I661-L664 WeakPolarHBondContact O-CB 3.29Å; I661-L664 PolarHBondContact O-N 3.24Å; L664-F666 VanDerWaalsContact C-N 3.3Å; L664-F666 PolarHBondContact O-N 3.29Å; L664-K667 PolarHBondContact O-N 3.36Å; L664-K667 VanDerWaalsContact O-N 3.1Å; L664-A668 PolarHBondContact O-N 3.11Å; L664-L674 HydrophobicContact CD1-CD1 3.77Å; L664-L674 HydrophobicContact CD1-CD2 4.22Å; L664-L676 HydrophobicContact CD1-CD2 3.76Å; L664-L676 HydrophobicContact CD2-CD2 4.24Å; L664-W681 HydrophobicContact CB-CD2 4.47Å; L664-W681 HydrophobicContact CB-CE3 3.8Å; L664-W681 HydrophobicContact CB-CH2 4.01Å; L664-W681 HydrophobicContact CB-CZ3 3.54Å; L664-W681 HydrophobicContact CD1-CD2 3.98Å; L664-W681 HydrophobicContact CD1-CE3 4.18Å; L664-W681 HydrophobicContact CD1-CH2 4.31Å; L664-W681 HydrophobicContact CD1-CZ2 4.16Å; L664-W681 HydrophobicContact CD1-CZ3 4.33Å; L664-W681 HydrophobicContact CD2-CD2 4.42Å; L664-W681 HydrophobicContact CD2-CE3 4.24Å; L664-W681 HydrophobicContact CG-CE3 4.29Å; L664-W681 HydrophobicContact CG-CZ3 4.41Å; L664-V686 HydrophobicContact CB-CG1 4.49Å; L664-V686 HydrophobicContact CD2-CG1 4.08Å; L664-A690 HydrophobicContact CD2-CB 3.71Å; L664-A690 HydrophobicContact CG-CB 4.18Å
665	R	95.2	Very high	91	Very high	45 Å²	45	68 Å²	68	17%	0.17	36%	0.358	C	S	.	.	H	α-helix	trans	-50.4	-49	171.5	-169.9	-159.8	176.7	-64.1	-11.3	111.3	F615 I661 A668 D669 L693 E697	F615-R665 HydrophobicContact CB-CG 4.06Å; F615-R665 VanDerWaalsContact CB-NH2 3.26Å; F615-R665 HydrophobicContact CD1-CG 3.66Å; F615-R665 HydrophobicContact CD2-CG 3.73Å; F615-R665 HydrophobicContact CE1-CB 4.48Å; F615-R665 HydrophobicContact CE1-CG 3.91Å; F615-R665 HydrophobicContact CE2-CB 4.36Å; F615-R665 HydrophobicContact CE2-CG 4.02Å; F615-R665 HydrophobicContact CG-CG 3.55Å; F615-R665 HydrophobicContact CZ-CB 4.33Å; F615-R665 HydrophobicContact CZ-CG 4.09Å; I661-R665 WeakPolarHBondContact O-CB 3.31Å; I661-R665 PolarHBondContact O-N 2.82Å; R665-A668 PolarHBondContact O-N 3.28Å; R665-D669 IonicContact CZ-OD2 3.66Å; R665-D669 IonicContact NH1-OD2 3.64Å; R665-D669 PolarHBondContact NH1-OD2 3.24Å; R665-D669 IonicContact NH2-OD2 3.94Å; R665-D669 PolarHBondContact O-N 3.45Å; R665-L693 HydrophobicContact CG-CD2 4.37Å; R665-E697 IonicContact CZ-OE2 3.52Å; R665-E697 IonicContact NE-OE1 3.37Å; R665-E697 PolarHBondContact NE-OE1 2.97Å; R665-E697 VanDerWaalsContact NE-OE1 3.15Å; R665-E697 IonicContact NE-OE2 3.8Å; R665-E697 PolarHBondContact NE-OE2 2.79Å; R665-E697 IonicContact NH2-OE2 2.66Å; R665-E697 PolarHBondContact NH2-OE2 3.16Å
666	F	92.5	Very high	90.7	Very high	127 Å²	127	63.5 Å²	63.5	56%	0.557	33%	0.327	S	S	*	.	H	α-helix	trans	-64.5	-40.5	177.4	-176.9	-91.7	0	0	0	113	Q662 K663 L664 D669 H670	Q662-F666 WeakPolarHBondContact O-CB 3.26Å; Q662-F666 PolarHBondContact O-N 3.39Å; K663-F666 PolarHBondContact O-N 3.28Å; L664-F666 VanDerWaalsContact C-N 3.3Å; L664-F666 PolarHBondContact O-N 3.29Å; F666-D669 PolarHBondContact O-N 3.16Å; F666-H670 AromaticContact CD2-CE1 3.53Å; F666-H670 AromaticContact CD2-ND1 3.63Å; F666-H670 AromaticContact CE2-CE1 3.32Å; F666-H670 WeakPolarHBondContact CE2-CE1 3.35Å; F666-H670 AromaticContact CE2-ND1 3.56Å; F666-H670 AromaticContact CE2-NE2 3.76Å; F666-H670 AromaticContact CZ-CE1 3.99Å; F666-H670 AromaticContact CZ-ND1 3.88Å; F666-H670 PolarHBondContact O-N 2.96Å; F666-H670 PolarHBondContact O-ND1 3.47Å
667	K	91.9	Very high	90.1	Very high	46 Å²	46	66.9 Å²	66.9	20%	0.2	34%	0.34	C	S	.	.	H	α-helix	trans	-62.5	-44.6	174.4	-171.7	-178.3	172.9	-160.7	0	110.7	K663 L664 D669 H670 A671 L674 D675 D678 W681	K663-K667 PolarHBondContact O-N 2.94Å; L664-K667 PolarHBondContact O-N 3.36Å; L664-K667 VanDerWaalsContact O-N 3.1Å; K667-D669 PolarHBondContact O-N 2.98Å; K667-H670 PolarHBondContact O-N 3.48Å; K667-A671 HydrophobicContact CG-CB 3.99Å; K667-A671 WeakPolarHBondContact O-CB 3.47Å; K667-A671 PolarHBondContact O-N 2.94Å; K667-L674 HydrophobicContact CB-CD1 4.39Å; K667-L674 HydrophobicContact CD-CD1 3.55Å; K667-L674 HydrophobicContact CG-CD1 3.86Å; K667-D675 PolarHBondContact NZ-O 2.87Å; K667-D678 IonicContact NZ-OD2 2.7Å; K667-D678 PolarHBondContact NZ-OD2 3.42Å; K667-W681 HydrophobicContact CD-CZ2 3.68Å
668	A	92.8	Very high	89.4	Confident	9 Å²	9	65.1 Å²	65.1	7%	0.074	33%	0.33	C	S	.	.	H	α-helix	trans	-61.5	-40.9	177.7	0	0	0	0	0	112.9	V614 F615 F633 L664 R665 H670 L674	V614-A668 VanDerWaalsContact CG2-O 3.31Å; V614-A668 WeakPolarHBondContact CG2-O 3.44Å; F615-A668 HydrophobicContact CD2-CB 4.31Å; F615-A668 HydrophobicContact CE2-CB 3.85Å; F633-A668 HydrophobicContact CD2-CB 3.76Å; F633-A668 HydrophobicContact CE2-CB 3.83Å; L664-A668 PolarHBondContact O-N 3.11Å; R665-A668 PolarHBondContact O-N 3.28Å; A668-H670 VanDerWaalsContact C-N 3.31Å; A668-H670 PolarHBondContact O-N 3Å; A668-L674 HydrophobicContact CB-CD2 4.11Å
669	D	90.6	Very high	88.6	Confident	14 Å²	14	61.6 Å²	61.6	8%	0.075	32%	0.321	C	S	.	.	H	α-helix	trans	-70.6	-18.3	179.6	-81	-5.6	0	0	0	114.8	N613 V614 F615 R665 F666 K667	N613-D669 HydrophobicContact CB-CB 4.33Å; N613-D669 PolarHBondContact ND2-OD2 3.05Å; V614-D669 PolarHBondContact N-OD1 2.82Å; F615-D669 PolarHBondContact N-OD1 3.19Å; R665-D669 IonicContact CZ-OD2 3.66Å; R665-D669 IonicContact NH1-OD2 3.64Å; R665-D669 PolarHBondContact NH1-OD2 3.24Å; R665-D669 IonicContact NH2-OD2 3.94Å; R665-D669 PolarHBondContact O-N 3.45Å; F666-D669 PolarHBondContact O-N 3.16Å; K667-D669 PolarHBondContact O-N 2.98Å
670	H	83.4	Confident	88.1	Confident	106 Å²	106	63.2 Å²	63.2	49%	0.491	32%	0.316	S	S	.	.	H	α-helix	trans	-131	-18.9	-168.1	-61.3	82.5	0	0	0	115.5	F666 K667 A668	F666-H670 AromaticContact CD2-CE1 3.53Å; F666-H670 AromaticContact CD2-ND1 3.63Å; F666-H670 AromaticContact CE2-CE1 3.32Å; F666-H670 WeakPolarHBondContact CE2-CE1 3.35Å; F666-H670 AromaticContact CE2-ND1 3.56Å; F666-H670 AromaticContact CE2-NE2 3.76Å; F666-H670 AromaticContact CZ-CE1 3.99Å; F666-H670 AromaticContact CZ-ND1 3.88Å; F666-H670 PolarHBondContact O-N 2.96Å; F666-H670 PolarHBondContact O-ND1 3.47Å; K667-H670 PolarHBondContact O-N 3.48Å; A668-H670 VanDerWaalsContact C-N 3.31Å; A668-H670 PolarHBondContact O-N 3Å
671	A	74.6	Confident	87.9	Confident	40 Å²	40	61.3 Å²	61.3	33%	0.331	30%	0.304	S	S	.	.			trans	-90.5	127.2	-179.9	0	0	0	0	0	110.8	K667 E673	K667-A671 HydrophobicContact CG-CB 3.99Å; K667-A671 WeakPolarHBondContact O-CB 3.47Å; K667-A671 PolarHBondContact O-N 2.94Å; A671-E673 PolarHBondContact O-N 2.99Å
672	E	68.9	Low	87.4	Confident	173 Å²	173	68.4 Å²	68.4	81%	0.808	34%	0.337	S	S	*	.	S	Bend	trans	-66.3	-17.2	173.2	-69.7	166.1	-170.1	0	0	111.7	R611	R611-E672 IonicContact CZ-OE1 3.58Å; R611-E672 IonicContact NH1-OE1 2.64Å; R611-E672 PolarHBondContact NH1-OE1 2.99Å; R611-E672 IonicContact NH2-OE1 3.75Å
673	E	79.6	Confident	87.3	Confident	159 Å²	159	67.8 Å²	67.8	74%	0.743	34%	0.336	S	S	*	.			trans	-135	116.3	167.1	-173.6	166	-140	0	0	111.9	A671	A671-E673 PolarHBondContact O-N 2.99Å
674	L	88.2	Confident	87.4	Confident	15 Å²	15	63.5 Å²	63.5	8%	0.079	32%	0.319	C	S	.	.			trans	-97.4	110.4	165.1	177.5	65.6	0	0	0	110.2	F633 K636 L664 K667 A668 L676	F633-L674 HydrophobicContact CD2-CD2 3.59Å; F633-L674 HydrophobicContact CE2-CD2 3.73Å; K636-L674 PolarHBondContact NZ-O 3.18Å; L664-L674 HydrophobicContact CD1-CD1 3.77Å; L664-L674 HydrophobicContact CD1-CD2 4.22Å; K667-L674 HydrophobicContact CB-CD1 4.39Å; K667-L674 HydrophobicContact CD-CD1 3.55Å; K667-L674 HydrophobicContact CG-CD1 3.86Å; A668-L674 HydrophobicContact CB-CD2 4.11Å; L674-L676 HydrophobicContact CD1-CD2 4.15Å; L674-L676 HydrophobicContact CD2-CD2 4.17Å; L674-L676 HydrophobicContact CG-CD2 4.18Å; L674-L676 HydrophobicContact CG-CG 4.46Å
675	D	88.3	Confident	87.4	Confident	72 Å²	72	65 Å²	65	39%	0.385	33%	0.326	S	S	.	.			trans	-93.9	144	157.7	-176.2	20.9	0	0	0	110.7	K667 E677 D678	K667-D675 PolarHBondContact NZ-O 2.87Å; D675-E677 PolarHBondContact OD1-N 2.94Å; D675-D678 HydrophobicContact CB-CB 4.41Å; D675-D678 PolarHBondContact OD2-N 3.1Å
676	L	90.6	Very high	87.6	Confident	5 Å²	5	63 Å²	63	3%	0.026	32%	0.318	C	S	.	.	S	Bend	trans	-113.2	-5.5	176.5	-64.9	179.8	0	0	0	112.9	K636 A640 R644 L664 L674 W681 I687	K636-L676 HydrophobicContact CB-CD1 4.04Å; K636-L676 WeakPolarHBondContact O-CD1 3.12Å; A640-L676 HydrophobicContact CB-CB 4.07Å; A640-L676 HydrophobicContact CB-CD1 3.83Å; R644-L676 PolarHBondContact NH1-O 2.9Å; R644-L676 PolarHBondContact NH2-O 3.13Å; L664-L676 HydrophobicContact CD1-CD2 3.76Å; L664-L676 HydrophobicContact CD2-CD2 4.24Å; L674-L676 HydrophobicContact CD1-CD2 4.15Å; L674-L676 HydrophobicContact CD2-CD2 4.17Å; L674-L676 HydrophobicContact CG-CD2 4.18Å; L674-L676 HydrophobicContact CG-CG 4.46Å; L676-W681 HydrophobicContact CD2-CG 4.33Å; L676-I687 HydrophobicContact CD1-CG2 4.38Å
677	E	83.8	Confident	87.8	Confident	82 Å²	82	57 Å²	57	38%	0.383	29%	0.292	S	S	.	.			trans	-94.6	-5.4	175.1	-45.8	-48.8	125.8	0	0	112.7	R643 R644 D675 G679	R643-E677 IonicContact CZ-OE1 2.91Å; R643-E677 IonicContact CZ-OE2 3.64Å; R643-E677 IonicContact NH1-OE1 2.72Å; R643-E677 PolarHBondContact NH1-OE1 3.26Å; R643-E677 VanDerWaalsContact NH1-OE1 3.08Å; R643-E677 IonicContact NH1-OE2 3.56Å; R643-E677 PolarHBondContact NH1-OE2 3.32Å; R643-E677 IonicContact NH2-OE1 2.84Å; R643-E677 PolarHBondContact NH2-OE1 3.37Å; R643-E677 IonicContact NH2-OE2 2.72Å; R644-E677 IonicContact NH1-OE1 3.13Å; R644-E677 PolarHBondContact NH1-OE1 2.82Å; R644-E677 IonicContact NH1-OE2 3.26Å; R644-E677 PolarHBondContact NH1-OE2 3.45Å; D675-E677 PolarHBondContact OD1-N 2.94Å; E677-G679 PolarHBondContact O-N 3.25Å
678	D	80.8	Confident	88.1	Confident	57 Å²	57	54.8 Å²	54.8	31%	0.305	28%	0.282	S	S	.	.	S	Bend	trans	-62.3	10.2	-178.2	76.2	-3.6	0	0	0	116.3	K667 D675 Q680 W681	K667-D678 IonicContact NZ-OD2 2.7Å; K667-D678 PolarHBondContact NZ-OD2 3.42Å; D675-D678 HydrophobicContact CB-CB 4.41Å; D675-D678 PolarHBondContact OD2-N 3.1Å; D678-Q680 PolarHBondContact O-N 3.26Å; D678-Q680 VanDerWaalsContact O-N 3.09Å; D678-Q680 WeakPolarHBondContact OD1-CB 3.4Å; D678-Q680 PolarHBondContact OD1-N 3.05Å; D678-W681 PolarHBondContact OD1-NE1 2.93Å; D678-W681 PolarHBondContact OD2-NE1 3.28Å
679	G	80.6	Confident	88.4	Confident	38 Å²	38	54.8 Å²	54.8	39%	0.392	28%	0.283	S	S	.	.	S	Bend	trans	69.4	-7.5	-176.6	0	0	0	0	0	115.2	E677 W681	E677-G679 PolarHBondContact O-N 3.25Å; G679-W681 PolarHBondContact O-N 2.8Å
680	Q	85.7	Confident	88.7	Confident	108 Å²	108	54.1 Å²	54.1	51%	0.505	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-6.6	-178.3	-54.6	-151.3	6.2	0	0	113.5	D678	D678-Q680 PolarHBondContact O-N 3.26Å; D678-Q680 VanDerWaalsContact O-N 3.09Å; D678-Q680 WeakPolarHBondContact OD1-CB 3.4Å; D678-Q680 PolarHBondContact OD1-N 3.05Å
681	W	91.9	Very high	89.4	Confident	3 Å²	3	49 Å²	49	1%	0.011	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131.8	34.6	-174.6	-33.4	97.5	0	0	0	111.5	R644 V660 K663 L664 K667 L676 D678 G679 D683 V686 I687	R644-W681 PolarHBondContact NH2-O 3.18Å; V660-W681 HydrophobicContact CG1-CE3 3.89Å; V660-W681 HydrophobicContact CG1-CZ3 3.78Å; K663-W681 HydrophobicContact CB-CH2 4.35Å; K663-W681 HydrophobicContact CB-CZ3 4.34Å; K663-W681 HydrophobicContact CD-CH2 3.81Å; K663-W681 HydrophobicContact CD-CZ3 4.09Å; K663-W681 HydrophobicContact CG-CH2 3.95Å; K663-W681 HydrophobicContact CG-CZ3 4.36Å; L664-W681 HydrophobicContact CB-CD2 4.47Å; L664-W681 HydrophobicContact CB-CE3 3.8Å; L664-W681 HydrophobicContact CB-CH2 4.01Å; L664-W681 HydrophobicContact CB-CZ3 3.54Å; L664-W681 HydrophobicContact CD1-CD2 3.98Å; L664-W681 HydrophobicContact CD1-CE3 4.18Å; L664-W681 HydrophobicContact CD1-CH2 4.31Å; L664-W681 HydrophobicContact CD1-CZ2 4.16Å; L664-W681 HydrophobicContact CD1-CZ3 4.33Å; L664-W681 HydrophobicContact CD2-CD2 4.42Å; L664-W681 HydrophobicContact CD2-CE3 4.24Å; L664-W681 HydrophobicContact CG-CE3 4.29Å; L664-W681 HydrophobicContact CG-CZ3 4.41Å; K667-W681 HydrophobicContact CD-CZ2 3.68Å; L676-W681 HydrophobicContact CD2-CG 4.33Å; D678-W681 PolarHBondContact OD1-NE1 2.93Å; D678-W681 PolarHBondContact OD2-NE1 3.28Å; G679-W681 PolarHBondContact O-N 2.8Å; W681-D683 PolarHBondContact O-N 3.4Å; W681-V686 HydrophobicContact CE3-CG1 4.18Å; W681-I687 HydrophobicContact CB-CD1 4.23Å; W681-I687 HydrophobicContact CB-CG1 4.2Å
682	E	88.7	Confident	90.6	Very high	160 Å²	160	48.3 Å²	48.3	75%	0.748	25%	0.245	S	C	*	.			trans	-48.6	-42.1	177.1	-77.1	170.9	-176.1	0	0	112.6	V684	E682-V684 PolarHBondContact O-N 2.84Å
683	D	94.6	Very high	91.9	Very high	66 Å²	66	40.5 Å²	40.5	35%	0.353	21%	0.209	S	C	.	.			trans	-68.5	106.1	175.3	177.7	9.3	0	0	0	111.9	W681 H685 V686	W681-D683 PolarHBondContact O-N 3.4Å; D683-H685 PolarHBondContact O-N 3.44Å; D683-H685 WeakPolarHBondContact OD1-CA 3.46Å; D683-H685 WeakPolarHBondContact OD1-CB 3.42Å; D683-H685 IonicContact OD1-CD2 3.7Å; D683-H685 PolarHBondContact OD1-CD2 3.27Å; D683-H685 VanDerWaalsContact OD1-CD2 3.25Å; D683-H685 IonicContact OD1-CG 3.87Å; D683-H685 PolarHBondContact OD1-N 3.34Å; D683-V686 HydrophobicContact CB-CG2 4.04Å; D683-V686 VanDerWaalsContact O-CB 3.31Å; D683-V686 WeakPolarHBondContact O-CB 3.13Å; D683-V686 PolarHBondContact O-N 3.35Å; D683-V686 WeakPolarHBondContact OD2-CG2 3.18Å
684	V	95.9	Very high	92.8	Very high	9 Å²	9	32.9 Å²	32.9	6%	0.055	17%	0.174	C	C	.	.	H	α-helix	trans	-63.7	-21.1	177.6	74.3	0	0	0	0	113.4	V641 I648 L651 E682 V686 I687 T688	V641-V684 HydrophobicContact CB-CG2 4.42Å; V641-V684 HydrophobicContact CG1-CG2 4.43Å; V641-V684 HydrophobicContact CG2-CG2 3.91Å; I648-V684 HydrophobicContact CB-CG1 4.27Å; I648-V684 HydrophobicContact CG1-CG1 4.06Å; I648-V684 HydrophobicContact CG2-CG1 4.17Å; L651-V684 HydrophobicContact CD1-CG1 4.09Å; L651-V684 HydrophobicContact CD1-CG2 4.1Å; E682-V684 PolarHBondContact O-N 2.84Å; V684-V686 PolarHBondContact O-N 3.22Å; V684-I687 PolarHBondContact O-N 3.03Å; V684-I687 VanDerWaalsContact O-N 3.16Å; V684-T688 HydrophobicContact CG2-CG2 4.4Å; V684-T688 PolarHBondContact O-N 2.86Å; V684-T688 PolarHBondContact O-OG1 3.03Å
685	H	97.4	Very high	93.3	Very high	32 Å²	32	32.2 Å²	32.2	15%	0.148	17%	0.17	C	C	.	.	H	α-helix	trans	-71.2	-20.1	173.7	-52.1	-65.8	0	0	0	112.2	V654 G656 D683 T688 G689	V654-H685 HydrophobicContact CG1-CB 4.41Å; G656-H685 VanDerWaalsContact CA-CB 3.47Å; G656-H685 WeakPolarHBondContact CA-O 3.41Å; G656-H685 PolarHBondContact N-O 3.21Å; D683-H685 PolarHBondContact O-N 3.44Å; D683-H685 WeakPolarHBondContact OD1-CA 3.46Å; D683-H685 WeakPolarHBondContact OD1-CB 3.42Å; D683-H685 IonicContact OD1-CD2 3.7Å; D683-H685 PolarHBondContact OD1-CD2 3.27Å; D683-H685 VanDerWaalsContact OD1-CD2 3.25Å; D683-H685 IonicContact OD1-CG 3.87Å; D683-H685 PolarHBondContact OD1-N 3.34Å; H685-T688 WeakPolarHBondContact CA-OG1 3.47Å; H685-G689 WeakPolarHBondContact O-CA 3.45Å; H685-G689 PolarHBondContact O-N 2.96Å
686	V	97.9	Very high	93.8	Very high	2 Å²	2	36 Å²	36	1%	0.012	18%	0.179	C	C	.	.	H	α-helix	trans	-71.7	-42.7	166.8	173.2	0	0	0	0	110.8	V660 I661 L664 W681 D683 V684 G689 A690	V660-V686 HydrophobicContact CB-CG1 4.27Å; V660-V686 HydrophobicContact CB-CG2 3.92Å; V660-V686 HydrophobicContact CG1-CG1 3.93Å; V660-V686 HydrophobicContact CG1-CG2 4.02Å; I661-V686 HydrophobicContact CG1-CB 4.23Å; I661-V686 HydrophobicContact CG1-CG1 3.93Å; I661-V686 HydrophobicContact CG1-CG2 4.36Å; L664-V686 HydrophobicContact CB-CG1 4.49Å; L664-V686 HydrophobicContact CD2-CG1 4.08Å; W681-V686 HydrophobicContact CE3-CG1 4.18Å; D683-V686 HydrophobicContact CB-CG2 4.04Å; D683-V686 VanDerWaalsContact O-CB 3.31Å; D683-V686 WeakPolarHBondContact O-CB 3.13Å; D683-V686 PolarHBondContact O-N 3.35Å; D683-V686 WeakPolarHBondContact OD2-CG2 3.18Å; V684-V686 PolarHBondContact O-N 3.22Å; V686-G689 PolarHBondContact O-N 2.76Å; V686-A690 WeakPolarHBondContact O-CB 3.44Å; V686-A690 PolarHBondContact O-N 3.34Å
687	I	97.7	Very high	94	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-68.6	-52.1	-178.9	-58.6	-179.8	0	0	0	110.8	C637 A640 V641 L676 W681 V684 G689 A690 L691	C637-I687 HydrophobicContact CB-CG2 3.85Å; A640-I687 HydrophobicContact CB-CD1 3.93Å; A640-I687 HydrophobicContact CB-CG2 4.42Å; V641-I687 HydrophobicContact CG2-CB 4.44Å; V641-I687 HydrophobicContact CG2-CG2 3.92Å; L676-I687 HydrophobicContact CD1-CG2 4.38Å; W681-I687 HydrophobicContact CB-CD1 4.23Å; W681-I687 HydrophobicContact CB-CG1 4.2Å; V684-I687 PolarHBondContact O-N 3.03Å; V684-I687 VanDerWaalsContact O-N 3.16Å; I687-G689 VanDerWaalsContact C-N 3.25Å; I687-G689 PolarHBondContact O-N 2.87Å; I687-A690 PolarHBondContact O-N 3.13Å; I687-A690 VanDerWaalsContact O-N 3.16Å; I687-L691 PolarHBondContact O-N 3.21Å
688	T	97.9	Very high	94.6	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-62.8	-32.5	173.9	55.3	0	0	0	0	112.3	V641 L651 Y652 V684 H685 K692	V641-T688 HydrophobicContact CG1-CG2 4.2Å; V641-T688 HydrophobicContact CG2-CG2 3.55Å; L651-T688 HydrophobicContact CD1-CG2 3.77Å; L651-T688 HydrophobicContact CG-CG2 4.35Å; Y652-T688 HydrophobicContact CD1-CG2 3.75Å; Y652-T688 HydrophobicContact CD2-CG2 4.16Å; Y652-T688 HydrophobicContact CE1-CG2 3.48Å; Y652-T688 VanDerWaalsContact CE1-CG2 3.48Å; Y652-T688 HydrophobicContact CE2-CG2 3.92Å; Y652-T688 HydrophobicContact CG-CG2 4.06Å; V684-T688 HydrophobicContact CG2-CG2 4.4Å; V684-T688 PolarHBondContact O-N 2.86Å; V684-T688 PolarHBondContact O-OG1 3.03Å; H685-T688 WeakPolarHBondContact CA-OG1 3.47Å; T688-K692 VanDerWaalsContact O-CE 3.22Å; T688-K692 WeakPolarHBondContact O-CE 3.5Å; T688-K692 VanDerWaalsContact O-CG 3.31Å; T688-K692 WeakPolarHBondContact O-CG 3.3Å; T688-K692 PolarHBondContact O-N 3.4Å; T688-K692 VanDerWaalsContact O-N 3.1Å
689	G	98.3	Very high	95.3	Very high	9 Å²	9	34.3 Å²	34.3	9%	0.093	17%	0.173	C	C	.	.	H	α-helix	trans	-63.5	-44.2	171.6	0	0	0	0	0	113	H685 V686 I687 L693	H685-G689 WeakPolarHBondContact O-CA 3.45Å; H685-G689 PolarHBondContact O-N 2.96Å; V686-G689 PolarHBondContact O-N 2.76Å; I687-G689 VanDerWaalsContact C-N 3.25Å; I687-G689 PolarHBondContact O-N 2.87Å; G689-L693 WeakPolarHBondContact O-CB 3.14Å; G689-L693 PolarHBondContact O-N 2.86Å
690	A	98.3	Very high	95.9	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-72.8	-34.8	178.4	0	0	0	0	0	112.8	F633 I661 L664 V686 I687 L693 F694	F633-A690 HydrophobicContact CZ-CB 3.99Å; I661-A690 HydrophobicContact CG2-CB 4.11Å; L664-A690 HydrophobicContact CD2-CB 3.71Å; L664-A690 HydrophobicContact CG-CB 4.18Å; V686-A690 WeakPolarHBondContact O-CB 3.44Å; V686-A690 PolarHBondContact O-N 3.34Å; I687-A690 PolarHBondContact O-N 3.13Å; I687-A690 VanDerWaalsContact O-N 3.16Å; A690-L693 WeakPolarHBondContact O-CB 3.44Å; A690-L693 PolarHBondContact O-N 3.13Å; A690-F694 PolarHBondContact O-N 3.18Å
691	L	98.4	Very high	96.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-64.6	-44.9	173.8	-176.8	56.4	0	0	0	111.8	V634 C637 I638 Y652 I687 L693 F694 F695	V634-L691 HydrophobicContact CB-CD1 4.22Å; V634-L691 HydrophobicContact CG1-CD1 4.16Å; V634-L691 HydrophobicContact CG2-CD1 3.95Å; C637-L691 HydrophobicContact CB-CB 4.06Å; C637-L691 HydrophobicContact CB-CD1 4.11Å; C637-L691 HydrophobicContact CB-CD2 4.03Å; C637-L691 HydrophobicContact CB-CG 4.3Å; I638-L691 HydrophobicContact CG1-CD2 3.89Å; Y652-L691 HydrophobicContact CE1-CD2 4.16Å; I687-L691 PolarHBondContact O-N 3.21Å; L691-L693 VanDerWaalsContact C-N 3.31Å; L691-L693 PolarHBondContact O-N 3.14Å; L691-F694 WeakPolarHBondContact O-CB 3.5Å; L691-F694 PolarHBondContact O-N 2.81Å; L691-F695 HydrophobicContact CD1-CD2 4.31Å; L691-F695 HydrophobicContact CD1-CE2 3.65Å; L691-F695 HydrophobicContact CD1-CZ 4.43Å; L691-F695 HydrophobicContact CG-CE2 4.07Å; L691-F695 VanDerWaalsContact O-CD2 3.26Å; L691-F695 WeakPolarHBondContact O-CD2 3.25Å; L691-F695 PolarHBondContact O-N 3.16Å
692	K	98.1	Very high	96.8	Very high	25 Å²	25	30.8 Å²	30.8	11%	0.109	15%	0.147	C	C	.	.	H	α-helix	trans	-61.8	-38.7	171.3	-69.8	178.3	-64	174.9	0	112.1	Y652 T688 F694 R696 V771 F772 T775	Y652-K692 HydrophobicContact CD1-CD 4.32Å; Y652-K692 HydrophobicContact CD1-CG 4.28Å; Y652-K692 PolarHBondContact O-NZ 2.96Å; T688-K692 VanDerWaalsContact O-CE 3.22Å; T688-K692 WeakPolarHBondContact O-CE 3.5Å; T688-K692 VanDerWaalsContact O-CG 3.31Å; T688-K692 WeakPolarHBondContact O-CG 3.3Å; T688-K692 PolarHBondContact O-N 3.4Å; T688-K692 VanDerWaalsContact O-N 3.1Å; K692-F694 VanDerWaalsContact C-N 3.33Å; K692-F694 PolarHBondContact O-N 2.81Å; K692-R696 WeakPolarHBondContact O-CB 3.38Å; K692-R696 PolarHBondContact O-N 3.09Å; K692-R696 VanDerWaalsContact O-N 3.13Å; K692-V771 HydrophobicContact CD-CG1 3.57Å; K692-F772 HydrophobicContact CG-CE1 4.38Å; K692-F772 HydrophobicContact CG-CZ 4.32Å; K692-T775 HydrophobicContact CB-CG2 4.23Å; K692-T775 HydrophobicContact CG-CG2 4.49Å
693	L	98.2	Very high	97.2	Very high	8 Å²	8	23.2 Å²	23.2	4%	0.042	11%	0.111	C	C	.	.	H	α-helix	trans	-64	-38.1	177.4	-174.7	67.7	0	0	0	112	F615 I661 R665 G689 A690 L691 R696 E697	F615-L693 HydrophobicContact CD1-CG 4.32Å; F615-L693 HydrophobicContact CE1-CB 4.09Å; F615-L693 HydrophobicContact CE1-CD2 4.14Å; F615-L693 HydrophobicContact CE1-CG 4.02Å; I661-L693 HydrophobicContact CG2-CD2 3.76Å; R665-L693 HydrophobicContact CG-CD2 4.37Å; G689-L693 WeakPolarHBondContact O-CB 3.14Å; G689-L693 PolarHBondContact O-N 2.86Å; A690-L693 WeakPolarHBondContact O-CB 3.44Å; A690-L693 PolarHBondContact O-N 3.13Å; L691-L693 VanDerWaalsContact C-N 3.31Å; L691-L693 PolarHBondContact O-N 3.14Å; L693-R696 VanDerWaalsContact CD1-NH2 3.26Å; L693-R696 PolarHBondContact O-N 3.42Å; L693-E697 HydrophobicContact CD1-CG 4.06Å; L693-E697 VanDerWaalsContact CD1-OE1 3.29Å; L693-E697 WeakPolarHBondContact CD1-OE1 3.19Å; L693-E697 HydrophobicContact CG-CG 4.27Å; L693-E697 WeakPolarHBondContact CG-OE1 3.47Å; L693-E697 WeakPolarHBondContact O-CB 3.42Å; L693-E697 WeakPolarHBondContact O-CG 3.34Å; L693-E697 PolarHBondContact O-N 3.41Å
694	F	98.4	Very high	97.3	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-58	-56.3	177.6	172.5	-95.1	0	0	0	110.9	V614 F615 L619 L622 P631 F633 V634 A690 L691 K692 R696 E697 L698	V614-F694 HydrophobicContact CG1-CD2 4.21Å; V614-F694 HydrophobicContact CG1-CE2 3.94Å; V614-F694 WeakPolarHBondContact O-CE2 3.28Å; F615-F694 HydrophobicContact CD1-CB 4.2Å; F615-F694 HydrophobicContact CD1-CD2 4.5Å; F615-F694 VanDerWaalsContact CE1-CA 3.47Å; F615-F694 HydrophobicContact CE1-CB 3.71Å; F615-F694 HydrophobicContact CG-CD2 4.48Å; F615-F694 HydrophobicContact CZ-CB 4.02Å; L619-F694 HydrophobicContact CD1-CE1 3.99Å; L619-F694 HydrophobicContact CD1-CZ 3.98Å; L622-F694 HydrophobicContact CD2-CE2 3.74Å; L622-F694 HydrophobicContact CD2-CZ 3.82Å; P631-F694 HydrophobicContact CB-CE1 4.46Å; P631-F694 HydrophobicContact CB-CZ 3.94Å; P631-F694 HydrophobicContact CG-CE1 4.07Å; P631-F694 HydrophobicContact CG-CZ 3.72Å; F633-F694 HydrophobicContact CD1-CB 4.09Å; F633-F694 HydrophobicContact CD1-CD2 4.02Å; F633-F694 HydrophobicContact CD1-CG 4.06Å; F633-F694 HydrophobicContact CE1-CB 3.92Å; F633-F694 HydrophobicContact CE1-CG 4.4Å; V634-F694 HydrophobicContact CG2-CD1 3.61Å; V634-F694 HydrophobicContact CG2-CE1 3.47Å; V634-F694 VanDerWaalsContact CG2-CE1 3.47Å; V634-F694 HydrophobicContact CG2-CG 4.47Å; V634-F694 HydrophobicContact CG2-CZ 4.23Å; A690-F694 PolarHBondContact O-N 3.18Å; L691-F694 WeakPolarHBondContact O-CB 3.5Å; L691-F694 PolarHBondContact O-N 2.81Å; K692-F694 VanDerWaalsContact C-N 3.33Å; K692-F694 PolarHBondContact O-N 2.81Å; F694-R696 VanDerWaalsContact C-N 3.32Å; F694-R696 PolarHBondContact O-N 3.24Å; F694-E697 PolarHBondContact O-N 3.43Å; F694-L698 HydrophobicContact CE1-CD1 4.46Å; F694-L698 HydrophobicContact CE1-CD2 4.05Å; F694-L698 HydrophobicContact CE2-CD2 4.34Å; F694-L698 HydrophobicContact CZ-CD2 3.87Å; F694-L698 PolarHBondContact O-N 3.28Å
695	F	98.4	Very high	97.2	Very high	0 Å²	0	22 Å²	22	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-59.8	-40.1	178.8	-69.4	-66.2	0	0	0	112.9	V634 L691 E697 L698 L702 T741 L745 T775 L776	V634-F695 HydrophobicContact CG1-CZ 4.06Å; V634-F695 HydrophobicContact CG2-CE1 4.45Å; V634-F695 HydrophobicContact CG2-CE2 4.41Å; V634-F695 HydrophobicContact CG2-CZ 3.89Å; L691-F695 HydrophobicContact CD1-CD2 4.31Å; L691-F695 HydrophobicContact CD1-CE2 3.65Å; L691-F695 HydrophobicContact CD1-CZ 4.43Å; L691-F695 HydrophobicContact CG-CE2 4.07Å; L691-F695 VanDerWaalsContact O-CD2 3.26Å; L691-F695 WeakPolarHBondContact O-CD2 3.25Å; L691-F695 PolarHBondContact O-N 3.16Å; F695-E697 PolarHBondContact O-N 3.49Å; F695-L698 HydrophobicContact CD1-CD1 3.97Å; F695-L698 WeakPolarHBondContact O-CB 3.46Å; F695-L698 PolarHBondContact O-N 3.39Å; F695-L702 HydrophobicContact CD1-CB 4.32Å; F695-L702 HydrophobicContact CD1-CD2 4.31Å; F695-L702 HydrophobicContact CE1-CD1 4.4Å; F695-L702 HydrophobicContact CE1-CD2 3.96Å; F695-T741 HydrophobicContact CE1-CG2 3.73Å; F695-T741 HydrophobicContact CZ-CG2 4.03Å; F695-L745 HydrophobicContact CD2-CD2 4.35Å; F695-L745 HydrophobicContact CE1-CD2 4.44Å; F695-L745 HydrophobicContact CE2-CD1 4.09Å; F695-L745 HydrophobicContact CE2-CD2 3.77Å; F695-L745 HydrophobicContact CE2-CG 4.49Å; F695-L745 HydrophobicContact CZ-CD1 4.49Å; F695-L745 HydrophobicContact CZ-CD2 3.83Å; F695-T775 HydrophobicContact CB-CG2 4Å; F695-L776 HydrophobicContact CB-CD2 3.88Å; F695-L776 HydrophobicContact CD1-CD2 3.97Å; F695-L776 HydrophobicContact CD2-CD2 4.03Å; F695-L776 HydrophobicContact CG-CD2 3.69Å
696	R	97.1	Very high	97	Very high	151 Å²	151	24.4 Å²	24.4	57%	0.57	12%	0.123	S	C	*	.	H	α-helix	trans	-69.5	-30.2	179	-169	176.1	65.5	-159.6	0.6	113.6	K692 L693 F694	K692-R696 WeakPolarHBondContact O-CB 3.38Å; K692-R696 PolarHBondContact O-N 3.09Å; K692-R696 VanDerWaalsContact O-N 3.13Å; L693-R696 VanDerWaalsContact CD1-NH2 3.26Å; L693-R696 PolarHBondContact O-N 3.42Å; F694-R696 VanDerWaalsContact C-N 3.32Å; F694-R696 PolarHBondContact O-N 3.24Å
697	E	96.1	Very high	96.9	Very high	57 Å²	57	25.6 Å²	25.6	27%	0.266	13%	0.129	S	C	.	.	H	α-helix	trans	-85.2	-6.3	176.5	-73.5	-171.6	-158	0	0	113.8	G616 R665 L693 F694 F695	G616-E697 WeakPolarHBondContact CA-O 3.2Å; R665-E697 IonicContact CZ-OE2 3.52Å; R665-E697 IonicContact NE-OE1 3.37Å; R665-E697 PolarHBondContact NE-OE1 2.97Å; R665-E697 VanDerWaalsContact NE-OE1 3.15Å; R665-E697 IonicContact NE-OE2 3.8Å; R665-E697 PolarHBondContact NE-OE2 2.79Å; R665-E697 IonicContact NH2-OE2 2.66Å; R665-E697 PolarHBondContact NH2-OE2 3.16Å; L693-E697 HydrophobicContact CD1-CG 4.06Å; L693-E697 VanDerWaalsContact CD1-OE1 3.29Å; L693-E697 WeakPolarHBondContact CD1-OE1 3.19Å; L693-E697 HydrophobicContact CG-CG 4.27Å; L693-E697 WeakPolarHBondContact CG-OE1 3.47Å; L693-E697 WeakPolarHBondContact O-CB 3.42Å; L693-E697 WeakPolarHBondContact O-CG 3.34Å; L693-E697 PolarHBondContact O-N 3.41Å; F694-E697 PolarHBondContact O-N 3.43Å; F695-E697 PolarHBondContact O-N 3.49Å
698	L	96.1	Very high	96.6	Very high	3 Å²	3	25.9 Å²	25.9	2%	0.016	13%	0.13	C	C	.	.	S	Bend	trans	-59.5	134.4	174.7	-66	175.6	0	0	0	110.9	L619 F694 F695 E700 R778	L619-L698 HydrophobicContact CB-CD2 4.42Å; L619-L698 HydrophobicContact CD1-CD1 4.12Å; L619-L698 HydrophobicContact CD1-CD2 4.11Å; F694-L698 HydrophobicContact CE1-CD1 4.46Å; F694-L698 HydrophobicContact CE1-CD2 4.05Å; F694-L698 HydrophobicContact CE2-CD2 4.34Å; F694-L698 HydrophobicContact CZ-CD2 3.87Å; F694-L698 PolarHBondContact O-N 3.28Å; F695-L698 HydrophobicContact CD1-CD1 3.97Å; F695-L698 WeakPolarHBondContact O-CB 3.46Å; F695-L698 PolarHBondContact O-N 3.39Å; L698-E700 WeakPolarHBondContact CB-O 3.44Å; L698-E700 PolarHBondContact O-N 3.21Å; L698-R778 PolarHBondContact O-NH1 3.24Å; L698-R778 VanDerWaalsContact O-NH1 3.13Å; L698-R778 PolarHBondContact O-NH2 2.84Å
699	P	94.6	Very high	96.4	Very high	50 Å²	50	30.6 Å²	30.6	33%	0.325	16%	0.155	S	C	.	.	S	Bend	trans	-57.9	-30.5	177.7	-27	35.9	0	0	0	114.2	G616 C617 R778	G616-P699 WeakPolarHBondContact O-CG 3.45Å; C617-P699 WeakPolarHBondContact O-CD 3.31Å; P699-R778 PolarHBondContact O-NH2 3.41Å
700	E	95.1	Very high	96.2	Very high	72 Å²	72	34.6 Å²	34.6	34%	0.336	17%	0.171	S	C	.	.	S	Bend	trans	-122.8	140.2	169.8	-175.4	173.6	-161.8	0	0	108.9	L698 P704 F705	L698-E700 WeakPolarHBondContact CB-O 3.44Å; L698-E700 PolarHBondContact O-N 3.21Å; E700-P704 WeakPolarHBondContact OE1-CA 3.36Å; E700-P704 WeakPolarHBondContact OE1-CB 3.38Å; E700-F705 HydrophobicContact CB-CD2 4.46Å; E700-F705 HydrophobicContact CB-CE2 4.31Å; E700-F705 HydrophobicContact CG-CD2 3.75Å; E700-F705 HydrophobicContact CG-CE2 4.04Å; E700-F705 HydrophobicContact CG-CG 4.43Å; E700-F705 PolarHBondContact OE1-N 3.36Å; E700-F705 VanDerWaalsContact OE1-N 3.08Å
701	P	97.1	Very high	96.1	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.006	17%	0.171	C	C	.	.			trans	-57.7	162.5	174.8	16.7	-26.6	0	0	0	114.1	F703 F705 L776 R778	P701-F703 VanDerWaalsContact C-N 3.25Å; P701-F703 WeakPolarHBondContact CB-O 3.46Å; P701-F703 VanDerWaalsContact CG-O 3.23Å; P701-F703 WeakPolarHBondContact CG-O 3.49Å; P701-F703 PolarHBondContact O-N 3.47Å; P701-F705 VanDerWaalsContact CD-CZ 3.41Å; P701-F705 HydrophobicContact CG-CD1 3.88Å; P701-F705 HydrophobicContact CG-CE1 3.75Å; P701-F705 HydrophobicContact CG-CG 4.39Å; P701-F705 HydrophobicContact CG-CZ 4.15Å; P701-L776 VanDerWaalsContact CB-O 3.28Å; P701-L776 WeakPolarHBondContact CB-O 3.23Å; P701-R778 HydrophobicContact CB-CG 4.1Å; P701-R778 HydrophobicContact CG-CG 3.81Å
702	L	97.9	Very high	95.9	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	18%	0.175	C	C	.	.	S	Bend	trans	-62.9	-35.9	177	179.2	62.1	0	0	0	111.4	L619 F695 P704 N738 T741 M742 L745 L776	L619-L702 HydrophobicContact CD2-CD1 3.83Å; F695-L702 HydrophobicContact CD1-CB 4.32Å; F695-L702 HydrophobicContact CD1-CD2 4.31Å; F695-L702 HydrophobicContact CE1-CD1 4.4Å; F695-L702 HydrophobicContact CE1-CD2 3.96Å; L702-P704 WeakPolarHBondContact O-CD 3.04Å; L702-N738 PolarHBondContact O-ND2 3.21Å; L702-T741 HydrophobicContact CD1-CG2 3.81Å; L702-M742 HydrophobicContact CD2-CB 4.24Å; L702-M742 HydrophobicContact CG-CE 4.32Å; L702-L745 HydrophobicContact CD2-CD2 4.06Å; L702-L776 HydrophobicContact CB-CB 4.5Å; L702-L776 HydrophobicContact CB-CD2 4.28Å; L702-L776 HydrophobicContact CD2-CD1 4.43Å; L702-L776 HydrophobicContact CD2-CD2 3.94Å; L702-L776 PolarHBondContact N-O 3.44Å
703	F	97	Very high	95.7	Very high	1 Å²	1	38 Å²	38	0%	0.004	19%	0.194	C	C	.	.	S	Bend	trans	-85.2	110.3	163.5	-68.7	-103.6	0	0	0	107.8	P701 F711 M742 F746 L776 L777 I796 I800	P701-F703 VanDerWaalsContact C-N 3.25Å; P701-F703 WeakPolarHBondContact CB-O 3.46Å; P701-F703 VanDerWaalsContact CG-O 3.23Å; P701-F703 WeakPolarHBondContact CG-O 3.49Å; P701-F703 PolarHBondContact O-N 3.47Å; F703-F711 AromaticContact CD1-CD2 3.87Å; F703-F711 HydrophobicContact CD1-CD2 3.87Å; F703-F711 HydrophobicContact CD1-CE1 4.41Å; F703-F711 AromaticContact CD1-CE2 3.7Å; F703-F711 HydrophobicContact CD1-CE2 3.7Å; F703-F711 HydrophobicContact CD1-CG 4.32Å; F703-F711 AromaticContact CD1-CZ 3.99Å; F703-F711 HydrophobicContact CD1-CZ 3.99Å; F703-F711 HydrophobicContact CE1-CD1 4.43Å; F703-F711 HydrophobicContact CE1-CD2 4.5Å; F703-F711 HydrophobicContact CE1-CE1 4.16Å; F703-F711 HydrophobicContact CE1-CE2 4.24Å; F703-F711 HydrophobicContact CE1-CZ 4.06Å; F703-M742 HydrophobicContact CD1-CE 3.72Å; F703-M742 HydrophobicContact CD2-CE 3.8Å; F703-M742 HydrophobicContact CE1-CE 3.53Å; F703-M742 HydrophobicContact CE1-SD 3.97Å; F703-M742 HydrophobicContact CE2-CE 3.62Å; F703-M742 HydrophobicContact CE2-SD 4.33Å; F703-M742 HydrophobicContact CG-CE 3.85Å; F703-M742 HydrophobicContact CZ-CE 3.47Å; F703-M742 VanDerWaalsContact CZ-CE 3.47Å; F703-M742 HydrophobicContact CZ-SD 3.75Å; F703-F746 HydrophobicContact CE2-CE2 4.15Å; F703-F746 HydrophobicContact CE2-CZ 4.16Å; F703-F746 HydrophobicContact CZ-CE2 4.16Å; F703-F746 AromaticContact CZ-CZ 3.97Å; F703-F746 HydrophobicContact CZ-CZ 3.97Å; F703-L776 HydrophobicContact CD2-CB 3.93Å; F703-L776 HydrophobicContact CE2-CB 3.95Å; F703-L776 HydrophobicContact CE2-CD1 4.33Å; F703-L776 PolarHBondContact N-O 3.14Å; F703-L777 HydrophobicContact CB-CD2 4.14Å; F703-L777 HydrophobicContact CB-CG 3.98Å; F703-L777 HydrophobicContact CD1-CD2 4.02Å; F703-L777 HydrophobicContact CD1-CG 4.33Å; F703-L777 HydrophobicContact CD2-CD1 3.79Å; F703-L777 HydrophobicContact CD2-CD2 4.19Å; F703-L777 HydrophobicContact CD2-CG 3.59Å; F703-L777 HydrophobicContact CE1-CD2 4.49Å; F703-L777 HydrophobicContact CE2-CD1 3.81Å; F703-L777 HydrophobicContact CE2-CG 4.12Å; F703-L777 HydrophobicContact CG-CD1 4.32Å; F703-L777 HydrophobicContact CG-CD2 3.86Å; F703-L777 HydrophobicContact CG-CG 3.71Å; F703-L777 HydrophobicContact CZ-CD1 4.35Å; F703-I796 HydrophobicContact CE1-CG2 4.02Å; F703-I796 HydrophobicContact CZ-CG2 4.38Å; F703-I800 HydrophobicContact CE1-CD1 3.55Å; F703-I800 HydrophobicContact CZ-CD1 3.67Å
704	P	96.3	Very high	95.7	Very high	5 Å²	5	37.6 Å²	37.6	3%	0.032	19%	0.192	C	C	.	.			trans	-56.3	149.9	-174.9	-26.5	35.9	0	0	0	113.1	E700 L702 S706 H707 F708 L734	E700-P704 WeakPolarHBondContact OE1-CA 3.36Å; E700-P704 WeakPolarHBondContact OE1-CB 3.38Å; L702-P704 WeakPolarHBondContact O-CD 3.04Å; P704-S706 PolarHBondContact O-N 2.99Å; P704-H707 PolarHBondContact O-N 3.29Å; P704-F708 PolarHBondContact O-N 3.34Å; P704-L734 VanDerWaalsContact CD-CD2 3.42Å; P704-L734 HydrophobicContact CG-CD2 3.94Å
705	F	94.8	Very high	95.5	Very high	46 Å²	46	38.1 Å²	38.1	20%	0.202	20%	0.195	C	C	.	.	H	α-helix	trans	-57.8	-37.6	-178.4	-72.1	-58.9	0	0	0	112.1	E700 P701 H707 F708 R778 E780	E700-F705 HydrophobicContact CB-CD2 4.46Å; E700-F705 HydrophobicContact CB-CE2 4.31Å; E700-F705 HydrophobicContact CG-CD2 3.75Å; E700-F705 HydrophobicContact CG-CE2 4.04Å; E700-F705 HydrophobicContact CG-CG 4.43Å; E700-F705 PolarHBondContact OE1-N 3.36Å; E700-F705 VanDerWaalsContact OE1-N 3.08Å; P701-F705 VanDerWaalsContact CD-CZ 3.41Å; P701-F705 HydrophobicContact CG-CD1 3.88Å; P701-F705 HydrophobicContact CG-CE1 3.75Å; P701-F705 HydrophobicContact CG-CG 4.39Å; P701-F705 HydrophobicContact CG-CZ 4.15Å; F705-H707 VanDerWaalsContact C-N 3.31Å; F705-H707 PolarHBondContact O-N 3.19Å; F705-F708 WeakPolarHBondContact O-CB 3.36Å; F705-F708 PolarHBondContact O-N 3.34Å; F705-R778 HydrophobicContact CE1-CG 4.05Å; F705-E780 HydrophobicContact CB-CB 4.25Å; F705-E780 HydrophobicContact CD1-CB 3.69Å; F705-E780 HydrophobicContact CD1-CG 4.31Å; F705-E780 HydrophobicContact CD2-CG 4.45Å; F705-E780 HydrophobicContact CE1-CB 4.1Å; F705-E780 HydrophobicContact CG-CB 4Å; F705-E780 HydrophobicContact CG-CG 4.25Å
706	S	94.1	Very high	95.3	Very high	82 Å²	82	46 Å²	46	57%	0.573	23%	0.225	S	C	*	.	H	α-helix	trans	-58.8	-36.9	176.3	51.4	0	0	0	0	113.8	P704	P704-S706 PolarHBondContact O-N 2.99Å
707	H	94.4	Very high	95.2	Very high	26 Å²	26	41.1 Å²	41.1	12%	0.12	21%	0.21	C	C	.	.	H	α-helix	trans	-88.7	-14.1	-176.3	-64.6	55.2	0	0	0	112.5	P704 F705 N709 E710 F711 S733	P704-H707 PolarHBondContact O-N 3.29Å; F705-H707 VanDerWaalsContact C-N 3.31Å; F705-H707 PolarHBondContact O-N 3.19Å; H707-N709 PolarHBondContact O-N 2.6Å; H707-E710 PolarHBondContact O-N 3.32Å; H707-F711 HydrophobicContact CB-CD2 3.9Å; H707-F711 HydrophobicContact CB-CE2 3.82Å; H707-F711 WeakPolarHBondContact O-CD2 3.46Å; H707-F711 PolarHBondContact O-N 2.88Å; H707-S733 PolarHBondContact CD2-OG 3.23Å; H707-S733 PolarHBondContact NE2-OG 3.25Å; H707-S733 VanDerWaalsContact NE2-OG 3.12Å
708	F	93.1	Very high	95	Very high	6 Å²	6	44.5 Å²	44.5	3%	0.026	24%	0.237	C	C	.	.	H	α-helix	trans	-55.7	-47	-172.5	176.9	-99.3	0	0	0	113.1	P704 F705 E710 V712 L777 P779 H789 Q793	P704-F708 PolarHBondContact O-N 3.34Å; F705-F708 WeakPolarHBondContact O-CB 3.36Å; F705-F708 PolarHBondContact O-N 3.34Å; F708-E710 VanDerWaalsContact C-N 3.29Å; F708-E710 PolarHBondContact O-N 2.97Å; F708-V712 HydrophobicContact CE1-CG2 4.2Å; F708-V712 HydrophobicContact CE2-CG2 4.44Å; F708-V712 HydrophobicContact CZ-CG2 4.14Å; F708-V712 VanDerWaalsContact O-CG2 3.32Å; F708-V712 WeakPolarHBondContact O-CG2 3.4Å; F708-V712 PolarHBondContact O-N 3.04Å; F708-L777 HydrophobicContact CD2-CB 4.36Å; F708-L777 HydrophobicContact CD2-CD2 4.26Å; F708-L777 HydrophobicContact CE2-CB 4.19Å; F708-L777 HydrophobicContact CE2-CD2 4.42Å; F708-P779 HydrophobicContact CD1-CB 4.33Å; F708-P779 HydrophobicContact CE1-CB 3.82Å; F708-P779 HydrophobicContact CZ-CB 4.19Å; F708-H789 AromaticContact CE1-ND1 3.63Å; F708-H789 HydrophobicContact CZ-CB 4.36Å; F708-H789 AromaticContact CZ-ND1 3.77Å; F708-Q793 HydrophobicContact CE2-CG 4.05Å
709	N	92.2	Very high	95.1	Very high	100 Å²	100	47.4 Å²	47.4	54%	0.535	25%	0.252	S	S	.	.	H	α-helix	trans	-69.5	-27.9	179.7	-68.3	-40	0	0	0	112.7	H707 T713	H707-N709 PolarHBondContact O-N 2.6Å; N709-T713 WeakPolarHBondContact O-CB 3.44Å; N709-T713 PolarHBondContact O-N 3.23Å; N709-T713 PolarHBondContact O-OG1 2.81Å
710	E	95.2	Very high	95.1	Very high	92 Å²	92	49.7 Å²	49.7	43%	0.43	26%	0.255	S	S	.	.	H	α-helix	trans	-74.9	-44.1	178.6	-57.6	-178.4	164.9	0	0	110.5	H707 F708 V712 T713 A714 L730	H707-E710 PolarHBondContact O-N 3.32Å; F708-E710 VanDerWaalsContact C-N 3.29Å; F708-E710 PolarHBondContact O-N 2.97Å; E710-V712 VanDerWaalsContact C-N 3.34Å; E710-V712 PolarHBondContact O-N 3.14Å; E710-T713 CarbonylContact O-C 3.59Å; E710-T713 WeakPolarHBondContact O-CB 3.19Å; E710-T713 PolarHBondContact O-N 2.9Å; E710-T713 VanDerWaalsContact O-N 3.08Å; E710-A714 WeakPolarHBondContact O-CB 3.41Å; E710-A714 PolarHBondContact O-N 3.48Å; E710-L730 HydrophobicContact CB-CD1 3.98Å; E710-L730 HydrophobicContact CB-CD2 3.65Å; E710-L730 HydrophobicContact CB-CG 4.49Å; E710-L730 VanDerWaalsContact OE2-CD2 3.22Å; E710-L730 WeakPolarHBondContact OE2-CD2 3.23Å
711	F	96.3	Very high	95.1	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-60.1	-40.5	170.2	-79.7	-73.9	0	0	0	112.4	F703 H707 T713 A714 I715 I727 L730 V731 L734 I796 I800	F703-F711 AromaticContact CD1-CD2 3.87Å; F703-F711 HydrophobicContact CD1-CD2 3.87Å; F703-F711 HydrophobicContact CD1-CE1 4.41Å; F703-F711 AromaticContact CD1-CE2 3.7Å; F703-F711 HydrophobicContact CD1-CE2 3.7Å; F703-F711 HydrophobicContact CD1-CG 4.32Å; F703-F711 AromaticContact CD1-CZ 3.99Å; F703-F711 HydrophobicContact CD1-CZ 3.99Å; F703-F711 HydrophobicContact CE1-CD1 4.43Å; F703-F711 HydrophobicContact CE1-CD2 4.5Å; F703-F711 HydrophobicContact CE1-CE1 4.16Å; F703-F711 HydrophobicContact CE1-CE2 4.24Å; F703-F711 HydrophobicContact CE1-CZ 4.06Å; H707-F711 HydrophobicContact CB-CD2 3.9Å; H707-F711 HydrophobicContact CB-CE2 3.82Å; H707-F711 WeakPolarHBondContact O-CD2 3.46Å; H707-F711 PolarHBondContact O-N 2.88Å; F711-T713 VanDerWaalsContact C-N 3.3Å; F711-T713 PolarHBondContact O-N 2.7Å; F711-A714 PolarHBondContact O-N 2.74Å; F711-I715 PolarHBondContact O-N 2.87Å; F711-I727 HydrophobicContact CE1-CG2 4.25Å; F711-L730 HydrophobicContact CD1-CB 4.35Å; F711-L730 HydrophobicContact CD1-CD1 4.15Å; F711-L730 HydrophobicContact CE1-CB 3.8Å; F711-L730 HydrophobicContact CE1-CD1 4.42Å; F711-L730 HydrophobicContact CE2-CB 4.17Å; F711-L730 HydrophobicContact CG-CD1 4.25Å; F711-L730 HydrophobicContact CZ-CB 3.69Å; F711-V731 HydrophobicContact CE1-CG2 4.06Å; F711-V731 HydrophobicContact CZ-CG2 4.12Å; F711-L734 HydrophobicContact CE2-CD2 4.45Å; F711-I796 HydrophobicContact CB-CD1 3.88Å; F711-I796 HydrophobicContact CB-CG1 4.38Å; F711-I796 HydrophobicContact CB-CG2 4.48Å; F711-I796 HydrophobicContact CD1-CG2 4.28Å; F711-I800 HydrophobicContact CE1-CD1 4.23Å
712	V	93.9	Very high	95	Very high	13 Å²	13	53.7 Å²	53.7	8%	0.079	28%	0.283	C	S	.	.	H	α-helix	trans	-65.2	-33.1	173.6	171.2	0	0	0	0	111.8	F708 E710 I715 R716 F792 I796	F708-V712 HydrophobicContact CE1-CG2 4.2Å; F708-V712 HydrophobicContact CE2-CG2 4.44Å; F708-V712 HydrophobicContact CZ-CG2 4.14Å; F708-V712 VanDerWaalsContact O-CG2 3.32Å; F708-V712 WeakPolarHBondContact O-CG2 3.4Å; F708-V712 PolarHBondContact O-N 3.04Å; E710-V712 VanDerWaalsContact C-N 3.34Å; E710-V712 PolarHBondContact O-N 3.14Å; V712-I715 WeakPolarHBondContact O-CG2 3.46Å; V712-R716 WeakPolarHBondContact O-CB 3.26Å; V712-R716 WeakPolarHBondContact O-CD 3.49Å; V712-R716 WeakPolarHBondContact O-CG 3.48Å; V712-R716 PolarHBondContact O-N 3.06Å; V712-F792 HydrophobicContact CG1-CB 4.43Å; V712-F792 HydrophobicContact CG1-CD2 3.81Å; V712-F792 HydrophobicContact CG1-CE2 4.3Å; V712-F792 HydrophobicContact CG1-CG 4.14Å; V712-F792 HydrophobicContact CG2-CB 4.12Å; V712-I796 HydrophobicContact CG2-CD1 4.05Å
713	T	94.6	Very high	95	Very high	83 Å²	83	55.5 Å²	55.5	51%	0.509	29%	0.291	S	S	.	.	H	α-helix	trans	-72.3	-40.7	175	-59.7	0	0	0	0	111.3	N709 E710 F711 R716	N709-T713 WeakPolarHBondContact O-CB 3.44Å; N709-T713 PolarHBondContact O-N 3.23Å; N709-T713 PolarHBondContact O-OG1 2.81Å; E710-T713 CarbonylContact O-C 3.59Å; E710-T713 WeakPolarHBondContact O-CB 3.19Å; E710-T713 PolarHBondContact O-N 2.9Å; E710-T713 VanDerWaalsContact O-N 3.08Å; F711-T713 VanDerWaalsContact C-N 3.3Å; F711-T713 PolarHBondContact O-N 2.7Å; T713-R716 PolarHBondContact O-N 3.48Å
714	A	96.5	Very high	95	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-66.4	-45.2	178.4	0	0	0	0	0	112.6	E710 F711 R716 N717 H726 I727 L730	E710-A714 WeakPolarHBondContact O-CB 3.41Å; E710-A714 PolarHBondContact O-N 3.48Å; F711-A714 PolarHBondContact O-N 2.74Å; A714-R716 VanDerWaalsContact C-N 3.26Å; A714-R716 PolarHBondContact O-N 2.8Å; A714-N717 WeakPolarHBondContact O-CB 3.42Å; A714-N717 PolarHBondContact O-N 2.72Å; A714-H726 HydrophobicContact CB-CB 4.05Å; A714-H726 WeakPolarHBondContact CB-ND1 3.23Å; A714-I727 HydrophobicContact CB-CD1 4.35Å; A714-I727 HydrophobicContact CB-CG1 3.65Å; A714-L730 HydrophobicContact CB-CD1 4.01Å
715	I	95.8	Very high	95	Very high	11 Å²	11	59.9 Å²	59.9	6%	0.056	32%	0.32	C	S	.	.	H	α-helix	trans	-66.3	-27.7	179.8	-158.7	68.8	0	0	0	112.6	F711 V712 N717 K723 I727 F792 Q795 I796 F799	F711-I715 PolarHBondContact O-N 2.87Å; V712-I715 WeakPolarHBondContact O-CG2 3.46Å; I715-N717 VanDerWaalsContact C-N 3.33Å; I715-N717 PolarHBondContact O-N 3.24Å; I715-K723 HydrophobicContact CD1-CD 4.29Å; I715-K723 VanDerWaalsContact O-CE 3.24Å; I715-K723 WeakPolarHBondContact O-CE 3.44Å; I715-K723 PolarHBondContact O-NZ 2.93Å; I715-I727 HydrophobicContact CD1-CD1 4.15Å; I715-F792 HydrophobicContact CG2-CB 4.31Å; I715-F792 HydrophobicContact CG2-CD1 3.93Å; I715-F792 HydrophobicContact CG2-CG 4.42Å; I715-Q795 HydrophobicContact CD1-CB 4.26Å; I715-Q795 WeakPolarHBondContact CD1-O 3.41Å; I715-Q795 HydrophobicContact CG1-CB 3.74Å; I715-I796 HydrophobicContact CB-CG1 3.89Å; I715-I796 HydrophobicContact CG1-CG1 4.11Å; I715-I796 HydrophobicContact CG2-CD1 4.32Å; I715-I796 HydrophobicContact CG2-CG1 3.94Å; I715-F799 HydrophobicContact CD1-CB 3.71Å; I715-F799 HydrophobicContact CD1-CD2 4.39Å; I715-F799 HydrophobicContact CD1-CG 4.09Å
716	R	94.1	Very high	95.1	Very high	167 Å²	167	61.3 Å²	61.3	63%	0.63	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-13.2	176	-77.5	177.8	70.1	-152.2	1.1	114.6	V712 T713 A714 F792	V712-R716 WeakPolarHBondContact O-CB 3.26Å; V712-R716 WeakPolarHBondContact O-CD 3.49Å; V712-R716 WeakPolarHBondContact O-CG 3.48Å; V712-R716 PolarHBondContact O-N 3.06Å; T713-R716 PolarHBondContact O-N 3.48Å; A714-R716 VanDerWaalsContact C-N 3.26Å; A714-R716 PolarHBondContact O-N 2.8Å; R716-F792 HydrophobicContact CG-CD1 4.17Å; R716-F792 HydrophobicContact CG-CE1 3.52Å; R716-F792 HydrophobicContact CG-CZ 3.74Å
717	N	94.3	Very high	95.3	Very high	47 Å²	47	57.4 Å²	57.4	25%	0.251	30%	0.3	S	S	.	.			trans	-63.8	131.4	177.2	-169.8	-24.8	0	0	0	110.3	A714 I715 D719 S722 K723	A714-N717 WeakPolarHBondContact O-CB 3.42Å; A714-N717 PolarHBondContact O-N 2.72Å; I715-N717 VanDerWaalsContact C-N 3.33Å; I715-N717 PolarHBondContact O-N 3.24Å; N717-D719 PolarHBondContact OD1-N 3.21Å; N717-S722 VanDerWaalsContact ND2-CB 3.26Å; N717-S722 WeakPolarHBondContact ND2-CB 3.35Å; N717-K723 HydrophobicContact CB-CB 4.42Å; N717-K723 WeakPolarHBondContact O-CE 3.34Å; N717-K723 PolarHBondContact O-NZ 3.4Å
718	P	92.8	Very high	95.4	Very high	129 Å²	129	59 Å²	59	84%	0.838	31%	0.305	S	S	*	.	S	Bend	trans	-71.9	-30.5	175.4	27.7	-35	0	0	0	113.6
719	D	96.4	Very high	95.6	Very high	64 Å²	64	63.1 Å²	63.1	34%	0.342	32%	0.324	S	S	.	.			trans	-77.8	126.6	177.2	172.6	44.1	0	0	0	111.6	N717 N721 S722 K723	N717-D719 PolarHBondContact OD1-N 3.21Å; D719-N721 PolarHBondContact OD1-N 2.77Å; D719-N721 PolarHBondContact OD1-ND2 3.15Å; D719-N721 PolarHBondContact OD2-N 2.56Å; D719-S722 WeakPolarHBondContact OD2-CB 3.42Å; D719-S722 PolarHBondContact OD2-N 2.85Å; D719-S722 PolarHBondContact OD2-OG 3.48Å; D719-K723 WeakPolarHBondContact O-CB 3.22Å; D719-K723 PolarHBondContact O-N 2.98Å
720	Y	95.1	Very high	95.8	Very high	97 Å²	97	58.8 Å²	58.8	38%	0.38	30%	0.301	S	S	.	.	H	α-helix	trans	-67.4	-37.2	-179.3	175	-89.7	0	0	0	112.7	K723 L724 F799 E803 R806	Y720-K723 PolarHBondContact O-N 3.25Å; Y720-L724 HydrophobicContact CE1-CD2 4.49Å; Y720-L724 WeakPolarHBondContact O-CB 3.48Å; Y720-L724 PolarHBondContact O-N 3.5Å; Y720-F799 HydrophobicContact CD2-CE2 4.22Å; Y720-F799 HydrophobicContact CE2-CE2 4.09Å; Y720-E803 PolarHBondContact OH-OE1 3.04Å; Y720-E803 PolarHBondContact OH-OE2 3.2Å; Y720-R806 PolarHBondContact OH-NH1 3.49Å
721	N	95.1	Very high	95.9	Very high	103 Å²	103	54.4 Å²	54.4	55%	0.551	28%	0.281	S	S	*	.	H	α-helix	trans	-74.2	-42.4	-176.6	-61	-73.7	0	0	0	111.6	D719 L724 S725	D719-N721 PolarHBondContact OD1-N 2.77Å; D719-N721 PolarHBondContact OD1-ND2 3.15Å; D719-N721 PolarHBondContact OD2-N 2.56Å; N721-L724 PolarHBondContact O-N 3.4Å; N721-S725 WeakPolarHBondContact O-CB 3.37Å; N721-S725 PolarHBondContact O-N 3.45Å; N721-S725 PolarHBondContact O-OG 3.28Å
722	S	95.8	Very high	95.9	Very high	55 Å²	55	59.9 Å²	59.9	39%	0.385	30%	0.304	S	S	.	.	H	α-helix	trans	-64	-40.2	172.8	-58.5	0	0	0	0	111.4	N717 D719 H726	N717-S722 VanDerWaalsContact ND2-CB 3.26Å; N717-S722 WeakPolarHBondContact ND2-CB 3.35Å; D719-S722 WeakPolarHBondContact OD2-CB 3.42Å; D719-S722 PolarHBondContact OD2-N 2.85Å; D719-S722 PolarHBondContact OD2-OG 3.48Å; S722-H726 WeakPolarHBondContact O-CB 3.45Å; S722-H726 PolarHBondContact O-N 3.01Å
723	K	96.8	Very high	96.1	Very high	38 Å²	38	62.3 Å²	62.3	17%	0.165	32%	0.322	C	S	.	.	H	α-helix	trans	-59.9	-50.4	172	176.6	176.3	-55.4	-167.2	0	112.4	I715 N717 D719 Y720 H726 I727 F799	I715-K723 HydrophobicContact CD1-CD 4.29Å; I715-K723 VanDerWaalsContact O-CE 3.24Å; I715-K723 WeakPolarHBondContact O-CE 3.44Å; I715-K723 PolarHBondContact O-NZ 2.93Å; N717-K723 HydrophobicContact CB-CB 4.42Å; N717-K723 WeakPolarHBondContact O-CE 3.34Å; N717-K723 PolarHBondContact O-NZ 3.4Å; D719-K723 WeakPolarHBondContact O-CB 3.22Å; D719-K723 PolarHBondContact O-N 2.98Å; Y720-K723 PolarHBondContact O-N 3.25Å; K723-H726 PolarHBondContact O-N 3.49Å; K723-I727 HydrophobicContact CG-CD1 3.89Å; K723-I727 WeakPolarHBondContact O-CB 3.47Å; K723-I727 WeakPolarHBondContact O-CG1 3.28Å; K723-I727 PolarHBondContact O-N 3.47Å; K723-F799 HydrophobicContact CD-CD2 3.89Å; K723-F799 HydrophobicContact CD-CE2 3.59Å; K723-F799 HydrophobicContact CD-CZ 4.14Å; K723-F799 HydrophobicContact CG-CD2 4.39Å; K723-F799 HydrophobicContact CG-CE1 4.4Å; K723-F799 HydrophobicContact CG-CE2 3.84Å; K723-F799 HydrophobicContact CG-CZ 3.84Å
724	L	96.9	Very high	96.2	Very high	27 Å²	27	58.9 Å²	58.9	14%	0.141	30%	0.301	C	S	.	.	H	α-helix	trans	-60.3	-47.2	178.4	179.6	58.5	0	0	0	111.3	Y720 N721 H726 I727 Y728 F799 E803 L807	Y720-L724 HydrophobicContact CE1-CD2 4.49Å; Y720-L724 WeakPolarHBondContact O-CB 3.48Å; Y720-L724 PolarHBondContact O-N 3.5Å; N721-L724 PolarHBondContact O-N 3.4Å; L724-H726 PolarHBondContact O-N 3.13Å; L724-I727 PolarHBondContact O-N 3.02Å; L724-Y728 VanDerWaalsContact O-CB 3.27Å; L724-Y728 WeakPolarHBondContact O-CB 3.29Å; L724-Y728 PolarHBondContact O-N 2.86Å; L724-F799 HydrophobicContact CB-CZ 4.03Å; L724-F799 HydrophobicContact CD1-CE1 4.03Å; L724-F799 HydrophobicContact CD1-CZ 4.08Å; L724-E803 HydrophobicContact CD1-CB 3.95Å; L724-E803 HydrophobicContact CD1-CG 4.01Å; L724-L807 HydrophobicContact CD1-CD2 3.96Å; L724-L807 HydrophobicContact CD1-CG 4.44Å
725	S	96.8	Very high	96.2	Very high	72 Å²	72	61.4 Å²	61.4	50%	0.503	32%	0.317	S	S	.	.	H	α-helix	trans	-63.7	-41.1	179.8	-54.1	0	0	0	0	112.3	N721 Y728 E729	N721-S725 WeakPolarHBondContact O-CB 3.37Å; N721-S725 PolarHBondContact O-N 3.45Å; N721-S725 PolarHBondContact O-OG 3.28Å; S725-Y728 PolarHBondContact O-N 3.22Å; S725-E729 PolarHBondContact O-N 3.26Å; S725-E729 VanDerWaalsContact O-N 3.1Å
726	H	97.1	Very high	96.3	Very high	75 Å²	75	65.3 Å²	65.3	35%	0.347	34%	0.343	S	S	.	.	H	α-helix	trans	-69.7	-44.7	178.5	-167.8	-178	0	0	0	111.3	A714 S722 K723 L724 Y728 E729 L730	A714-H726 HydrophobicContact CB-CB 4.05Å; A714-H726 WeakPolarHBondContact CB-ND1 3.23Å; S722-H726 WeakPolarHBondContact O-CB 3.45Å; S722-H726 PolarHBondContact O-N 3.01Å; K723-H726 PolarHBondContact O-N 3.49Å; L724-H726 PolarHBondContact O-N 3.13Å; H726-Y728 VanDerWaalsContact C-N 3.3Å; H726-Y728 PolarHBondContact O-N 3.25Å; H726-E729 PolarHBondContact O-N 3.32Å; H726-L730 WeakPolarHBondContact O-CB 3.2Å; H726-L730 VanDerWaalsContact O-CG 3.26Å; H726-L730 WeakPolarHBondContact O-CG 3.47Å; H726-L730 PolarHBondContact O-N 2.92Å
727	I	97.4	Very high	96.5	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-64.5	-35.4	175.8	-68.9	176	0	0	0	111.2	F711 A714 I715 K723 L724 L730 V731 F799 I800 L807	F711-I727 HydrophobicContact CE1-CG2 4.25Å; A714-I727 HydrophobicContact CB-CD1 4.35Å; A714-I727 HydrophobicContact CB-CG1 3.65Å; I715-I727 HydrophobicContact CD1-CD1 4.15Å; K723-I727 HydrophobicContact CG-CD1 3.89Å; K723-I727 WeakPolarHBondContact O-CB 3.47Å; K723-I727 WeakPolarHBondContact O-CG1 3.28Å; K723-I727 PolarHBondContact O-N 3.47Å; L724-I727 PolarHBondContact O-N 3.02Å; I727-L730 PolarHBondContact O-N 3.49Å; I727-V731 HydrophobicContact CG2-CG2 4.4Å; I727-V731 WeakPolarHBondContact O-CB 3.37Å; I727-V731 VanDerWaalsContact O-CG2 3.31Å; I727-V731 WeakPolarHBondContact O-CG2 3.32Å; I727-V731 PolarHBondContact O-N 3.23Å; I727-F799 HydrophobicContact CB-CE1 4.21Å; I727-F799 HydrophobicContact CD1-CD1 3.45Å; I727-F799 VanDerWaalsContact CD1-CD1 3.45Å; I727-F799 HydrophobicContact CD1-CE1 3.66Å; I727-F799 HydrophobicContact CD1-CG 4.08Å; I727-F799 HydrophobicContact CD1-CZ 4.43Å; I727-F799 HydrophobicContact CG1-CE1 4.47Å; I727-F799 HydrophobicContact CG2-CD1 4.18Å; I727-F799 HydrophobicContact CG2-CE1 4.23Å; I727-I800 HydrophobicContact CG2-CD1 4.36Å; I727-I800 HydrophobicContact CG2-CG1 3.96Å; I727-L807 HydrophobicContact CB-CD2 4.48Å; I727-L807 HydrophobicContact CG2-CD1 4.05Å; I727-L807 HydrophobicContact CG2-CD2 3.91Å
728	Y	97.3	Very high	96.7	Very high	59 Å²	59	56.3 Å²	56.3	23%	0.231	31%	0.308	C	S	.	.	H	α-helix	trans	-61.3	-52.5	174	172.4	-113	0	0	0	112.4	L724 S725 H726 L730 V731 K732	L724-Y728 VanDerWaalsContact O-CB 3.27Å; L724-Y728 WeakPolarHBondContact O-CB 3.29Å; L724-Y728 PolarHBondContact O-N 2.86Å; S725-Y728 PolarHBondContact O-N 3.22Å; H726-Y728 VanDerWaalsContact C-N 3.3Å; H726-Y728 PolarHBondContact O-N 3.25Å; Y728-L730 VanDerWaalsContact C-N 3.3Å; Y728-L730 PolarHBondContact O-N 3.4Å; Y728-V731 PolarHBondContact O-N 3.13Å; Y728-K732 HydrophobicContact CE1-CD 3.99Å; Y728-K732 HydrophobicContact CE2-CD 4.42Å; Y728-K732 VanDerWaalsContact O-CB 3.22Å; Y728-K732 WeakPolarHBondContact O-CB 3.47Å; Y728-K732 PolarHBondContact O-N 3.39Å
729	E	97.1	Very high	96.9	Very high	93 Å²	93	52.4 Å²	52.4	44%	0.435	28%	0.278	S	S	.	.	H	α-helix	trans	-64.6	-33.5	178.5	-68.5	-61.8	144.5	0	0	112.2	S725 H726 K732 S733	S725-E729 PolarHBondContact O-N 3.26Å; S725-E729 VanDerWaalsContact O-N 3.1Å; H726-E729 PolarHBondContact O-N 3.32Å; E729-K732 CarbonylContact O-C 3.56Å; E729-K732 PolarHBondContact O-N 2.91Å; E729-K732 IonicContact OE1-NZ 3.79Å; E729-K732 PolarHBondContact OE1-NZ 2.88Å; E729-K732 IonicContact OE2-NZ 2.78Å; E729-K732 PolarHBondContact OE2-NZ 3.26Å; E729-S733 WeakPolarHBondContact O-CB 3.33Å; E729-S733 PolarHBondContact O-N 2.91Å; E729-S733 PolarHBondContact O-OG 3.39Å
730	L	97.4	Very high	97	Very high	9 Å²	9	51.8 Å²	51.8	5%	0.047	28%	0.275	C	S	.	.	H	α-helix	trans	-68.6	-36.6	173.2	-70.9	172.6	0	0	0	113.9	E710 F711 A714 H726 I727 Y728 K732 S733 L734	E710-L730 HydrophobicContact CB-CD1 3.98Å; E710-L730 HydrophobicContact CB-CD2 3.65Å; E710-L730 HydrophobicContact CB-CG 4.49Å; E710-L730 VanDerWaalsContact OE2-CD2 3.22Å; E710-L730 WeakPolarHBondContact OE2-CD2 3.23Å; F711-L730 HydrophobicContact CD1-CB 4.35Å; F711-L730 HydrophobicContact CD1-CD1 4.15Å; F711-L730 HydrophobicContact CE1-CB 3.8Å; F711-L730 HydrophobicContact CE1-CD1 4.42Å; F711-L730 HydrophobicContact CE2-CB 4.17Å; F711-L730 HydrophobicContact CG-CD1 4.25Å; F711-L730 HydrophobicContact CZ-CB 3.69Å; A714-L730 HydrophobicContact CB-CD1 4.01Å; H726-L730 WeakPolarHBondContact O-CB 3.2Å; H726-L730 VanDerWaalsContact O-CG 3.26Å; H726-L730 WeakPolarHBondContact O-CG 3.47Å; H726-L730 PolarHBondContact O-N 2.92Å; I727-L730 PolarHBondContact O-N 3.49Å; Y728-L730 VanDerWaalsContact C-N 3.3Å; Y728-L730 PolarHBondContact O-N 3.4Å; L730-K732 VanDerWaalsContact C-N 3.3Å; L730-S733 PolarHBondContact O-OG 3Å; L730-L734 WeakPolarHBondContact O-CG 3.32Å
731	V	97.1	Very high	97.1	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.006	26%	0.257	C	S	.	.	H	α-helix	trans	-67.9	-36.2	172.8	166.1	0	0	0	0	110.4	F711 I727 Y728 L734 F808	F711-V731 HydrophobicContact CE1-CG2 4.06Å; F711-V731 HydrophobicContact CZ-CG2 4.12Å; I727-V731 HydrophobicContact CG2-CG2 4.4Å; I727-V731 WeakPolarHBondContact O-CB 3.37Å; I727-V731 VanDerWaalsContact O-CG2 3.31Å; I727-V731 WeakPolarHBondContact O-CG2 3.32Å; I727-V731 PolarHBondContact O-N 3.23Å; Y728-V731 PolarHBondContact O-N 3.13Å; V731-L734 WeakPolarHBondContact O-CB 3.41Å; V731-L734 WeakPolarHBondContact O-CG 3.43Å; V731-L734 PolarHBondContact O-N 3.31Å; V731-F808 HydrophobicContact CG1-CD1 4.09Å; V731-F808 HydrophobicContact CG1-CE1 3.45Å; V731-F808 VanDerWaalsContact CG1-CE1 3.45Å; V731-F808 HydrophobicContact CG1-CE2 4.42Å; V731-F808 HydrophobicContact CG1-CZ 3.64Å
732	K	95.9	Very high	97.3	Very high	114 Å²	114	42.3 Å²	42.3	50%	0.496	23%	0.231	S	C	.	.	H	α-helix	trans	-76.7	-21.5	179.8	176.1	168.3	158.9	-110.3	0	113.9	Y728 E729 L730	Y728-K732 HydrophobicContact CE1-CD 3.99Å; Y728-K732 HydrophobicContact CE2-CD 4.42Å; Y728-K732 VanDerWaalsContact O-CB 3.22Å; Y728-K732 WeakPolarHBondContact O-CB 3.47Å; Y728-K732 PolarHBondContact O-N 3.39Å; E729-K732 CarbonylContact O-C 3.56Å; E729-K732 PolarHBondContact O-N 2.91Å; E729-K732 IonicContact OE1-NZ 3.79Å; E729-K732 PolarHBondContact OE1-NZ 2.88Å; E729-K732 IonicContact OE2-NZ 2.78Å; E729-K732 PolarHBondContact OE2-NZ 3.26Å; L730-K732 VanDerWaalsContact C-N 3.3Å
733	S	97.2	Very high	97.3	Very high	65 Å²	65	42.1 Å²	42.1	46%	0.455	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-10.8	172.4	68.8	0	0	0	0	114.2	H707 E729 L730	H707-S733 PolarHBondContact CD2-OG 3.23Å; H707-S733 PolarHBondContact NE2-OG 3.25Å; H707-S733 VanDerWaalsContact NE2-OG 3.12Å; E729-S733 WeakPolarHBondContact O-CB 3.33Å; E729-S733 PolarHBondContact O-N 2.91Å; E729-S733 PolarHBondContact O-OG 3.39Å; L730-S733 PolarHBondContact O-OG 3Å
734	L	97.1	Very high	97.3	Very high	10 Å²	10	42.9 Å²	42.9	5%	0.052	23%	0.229	C	C	.	.	S	Bend	trans	-59.7	148.6	-179.9	-69.2	175.8	0	0	0	112.2	P704 F711 L730 V731 N738 H739 M742	P704-L734 VanDerWaalsContact CD-CD2 3.42Å; P704-L734 HydrophobicContact CG-CD2 3.94Å; F711-L734 HydrophobicContact CE2-CD2 4.45Å; L730-L734 WeakPolarHBondContact O-CG 3.32Å; V731-L734 WeakPolarHBondContact O-CB 3.41Å; V731-L734 WeakPolarHBondContact O-CG 3.43Å; V731-L734 PolarHBondContact O-N 3.31Å; L734-N738 HydrophobicContact CB-CB 4.46Å; L734-H739 HydrophobicContact CB-CB 4.17Å; L734-M742 HydrophobicContact CD1-CE 3.5Å; L734-M742 VanDerWaalsContact CD1-CE 3.5Å; L734-M742 HydrophobicContact CD1-SD 3.93Å
735	P	97.5	Very high	97.4	Very high	54 Å²	54	41.6 Å²	41.6	35%	0.351	22%	0.222	S	C	.	.			trans	-53.2	138.3	167.3	-24.1	33.3	0	0	0	110.7	V737 N738 H739	P735-V737 PolarHBondContact O-N 3.21Å; P735-N738 HydrophobicContact CB-CB 4.49Å; P735-N738 WeakPolarHBondContact O-CA 3.31Å; P735-N738 WeakPolarHBondContact O-CB 3.44Å; P735-N738 PolarHBondContact O-N 2.72Å; P735-H739 PolarHBondContact O-N 3.32Å
736	P	97.3	Very high	97.4	Very high	92 Å²	92	38.1 Å²	38.1	60%	0.597	20%	0.198	S	C	*	.	H	α-helix	trans	-54.2	-34.1	-172.7	-30.7	35.6	0	0	0	114.8	H739 D740	P736-H739 PolarHBondContact O-N 3.44Å; P736-D740 WeakPolarHBondContact O-CB 3.45Å; P736-D740 PolarHBondContact O-N 2.88Å
737	V	97.9	Very high	97.3	Very high	12 Å²	12	34.6 Å²	34.6	7%	0.073	18%	0.182	C	C	.	.	H	α-helix	trans	-65.9	-39.7	176	168.2	0	0	0	0	112.3	L619 C623 T629 P735 T741	L619-V737 HydrophobicContact CB-CG1 4.27Å; L619-V737 HydrophobicContact CD2-CG1 3.85Å; L619-V737 HydrophobicContact CG-CG1 3.63Å; C623-V737 HydrophobicContact CB-CG1 3.93Å; C623-V737 HydrophobicContact CB-CG2 3.93Å; T629-V737 WeakPolarHBondContact O-CA 3.38Å; P735-V737 PolarHBondContact O-N 3.21Å; V737-T741 WeakPolarHBondContact O-CB 3.33Å; V737-T741 PolarHBondContact O-N 2.85Å; V737-T741 PolarHBondContact O-OG1 3.2Å
738	N	98.3	Very high	97.2	Very high	13 Å²	13	34.7 Å²	34.7	7%	0.07	18%	0.182	C	C	.	.	H	α-helix	trans	-71.5	-45.9	175.3	-67.2	64.2	0	0	0	110.4	L702 L734 P735 T741 M742	L702-N738 PolarHBondContact O-ND2 3.21Å; L734-N738 HydrophobicContact CB-CB 4.46Å; P735-N738 HydrophobicContact CB-CB 4.49Å; P735-N738 WeakPolarHBondContact O-CA 3.31Å; P735-N738 WeakPolarHBondContact O-CB 3.44Å; P735-N738 PolarHBondContact O-N 2.72Å; N738-T741 PolarHBondContact O-N 2.96Å; N738-M742 WeakPolarHBondContact O-CB 3.38Å; N738-M742 PolarHBondContact O-N 2.93Å
739	H	98.1	Very high	97.1	Very high	47 Å²	47	31.9 Å²	31.9	22%	0.218	17%	0.171	C	C	.	.	H	α-helix	trans	-55.7	-54	176.2	170	-89.7	0	0	0	112	L734 P735 P736 T741 M742 K743 F808	L734-H739 HydrophobicContact CB-CB 4.17Å; P735-H739 PolarHBondContact O-N 3.32Å; P736-H739 PolarHBondContact O-N 3.44Å; H739-T741 PolarHBondContact O-N 2.9Å; H739-M742 WeakPolarHBondContact O-CB 3.39Å; H739-M742 PolarHBondContact O-N 3.08Å; H739-K743 WeakPolarHBondContact O-CB 3.38Å; H739-K743 PolarHBondContact O-N 3.3Å; H739-F808 AromaticContact NE2-CD1 3.67Å; H739-F808 AromaticContact NE2-CE1 3.97Å
740	D	98	Very high	96.5	Very high	52 Å²	52	29.4 Å²	29.4	28%	0.278	16%	0.16	S	C	.	.	H	α-helix	trans	-68.9	-36.6	-175.5	-71.9	2	0	0	0	111.8	T629 V630 P736 K743 L744	T629-D740 WeakPolarHBondContact CB-OD2 3.48Å; T629-D740 PolarHBondContact OG1-OD2 2.85Å; V630-D740 HydrophobicContact CG2-CB 3.69Å; P736-D740 WeakPolarHBondContact O-CB 3.45Å; P736-D740 PolarHBondContact O-N 2.88Å; D740-K743 PolarHBondContact O-N 2.79Å; D740-L744 PolarHBondContact O-N 3.12Å
741	T	98.4	Very high	94.7	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-66.8	-38.7	174.8	-60	0	0	0	0	111.1	L619 V630 P631 F695 L702 V737 N738 H739 L745	L619-T741 HydrophobicContact CD2-CG2 4.42Å; V630-T741 HydrophobicContact CG1-CG2 4.32Å; P631-T741 WeakPolarHBondContact CD-OG1 3.33Å; F695-T741 HydrophobicContact CE1-CG2 3.73Å; F695-T741 HydrophobicContact CZ-CG2 4.03Å; L702-T741 HydrophobicContact CD1-CG2 3.81Å; V737-T741 WeakPolarHBondContact O-CB 3.33Å; V737-T741 PolarHBondContact O-N 2.85Å; V737-T741 PolarHBondContact O-OG1 3.2Å; N738-T741 PolarHBondContact O-N 2.96Å; H739-T741 PolarHBondContact O-N 2.9Å; T741-L745 WeakPolarHBondContact O-CB 3.27Å; T741-L745 PolarHBondContact O-N 3.45Å
742	M	97.7	Very high	92.8	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-65.7	-44.6	173.4	-168.4	-179.3	-64.4	0	0	111	L702 F703 L734 N738 H739 L744 L745 F746 F808	L702-M742 HydrophobicContact CD2-CB 4.24Å; L702-M742 HydrophobicContact CG-CE 4.32Å; F703-M742 HydrophobicContact CD1-CE 3.72Å; F703-M742 HydrophobicContact CD2-CE 3.8Å; F703-M742 HydrophobicContact CE1-CE 3.53Å; F703-M742 HydrophobicContact CE1-SD 3.97Å; F703-M742 HydrophobicContact CE2-CE 3.62Å; F703-M742 HydrophobicContact CE2-SD 4.33Å; F703-M742 HydrophobicContact CG-CE 3.85Å; F703-M742 HydrophobicContact CZ-CE 3.47Å; F703-M742 VanDerWaalsContact CZ-CE 3.47Å; F703-M742 HydrophobicContact CZ-SD 3.75Å; L734-M742 HydrophobicContact CD1-CE 3.5Å; L734-M742 VanDerWaalsContact CD1-CE 3.5Å; L734-M742 HydrophobicContact CD1-SD 3.93Å; N738-M742 WeakPolarHBondContact O-CB 3.38Å; N738-M742 PolarHBondContact O-N 2.93Å; H739-M742 WeakPolarHBondContact O-CB 3.39Å; H739-M742 PolarHBondContact O-N 3.08Å; M742-L744 PolarHBondContact O-N 2.94Å; M742-L745 PolarHBondContact O-N 2.95Å; M742-F746 HydrophobicContact CG-CD2 3.49Å; M742-F746 VanDerWaalsContact CG-CD2 3.49Å; M742-F746 HydrophobicContact CG-CE2 3.61Å; M742-F746 WeakPolarHBondContact O-CB 3.18Å; M742-F746 WeakPolarHBondContact O-CD2 3.38Å; M742-F746 PolarHBondContact O-N 2.74Å; M742-F746 HydrophobicContact SD-CE2 4.41Å; M742-F808 HydrophobicContact CB-CZ 4.35Å; M742-F808 HydrophobicContact CG-CZ 3.86Å; M742-F808 HydrophobicContact SD-CZ 3.97Å
743	K	96.6	Very high	91.9	Very high	52 Å²	52	33.5 Å²	33.5	23%	0.226	19%	0.185	C	C	.	.	H	α-helix	trans	-58.1	-47.1	176.5	-173.3	167.4	-179.3	162.7	0	111.7	H739 D740 G747 Y804 F808 Y809	H739-K743 WeakPolarHBondContact O-CB 3.38Å; H739-K743 PolarHBondContact O-N 3.3Å; D740-K743 PolarHBondContact O-N 2.79Å; K743-G747 WeakPolarHBondContact O-CA 3.45Å; K743-G747 PolarHBondContact O-N 3.06Å; K743-Y804 HydrophobicContact CG-CE2 4.39Å; K743-Y804 WeakPolarHBondContact O-CE2 3.22Å; K743-Y804 PolarHBondContact O-OH 2.79Å; K743-Y804 VanDerWaalsContact O-OH 3.12Å; K743-F808 HydrophobicContact CB-CD1 3.64Å; K743-F808 HydrophobicContact CB-CE1 3.87Å; K743-F808 HydrophobicContact CB-CG 4.3Å; K743-F808 HydrophobicContact CD-CB 3.98Å; K743-F808 HydrophobicContact CD-CD1 3.96Å; K743-F808 HydrophobicContact CD-CG 4.31Å; K743-F808 HydrophobicContact CG-CB 4.06Å; K743-F808 HydrophobicContact CG-CD1 3.79Å; K743-F808 HydrophobicContact CG-CE1 4.49Å; K743-F808 HydrophobicContact CG-CG 4.03Å; K743-F808 PolarHBondContact NZ-O 3.31Å; K743-Y809 VanDerWaalsContact CE-CZ 3.42Å
744	L	97	Very high	91.4	Very high	53 Å²	53	30.4 Å²	30.4	28%	0.277	16%	0.163	S	C	.	.	H	α-helix	trans	-64.5	-43	177	-172	66.8	0	0	0	112.2	V630 D635 I638 D740 M742 H748	V630-L744 HydrophobicContact CG1-CB 4.46Å; V630-L744 HydrophobicContact CG1-CD2 3.75Å; D635-L744 HydrophobicContact CB-CD2 4.21Å; I638-L744 HydrophobicContact CD1-CD2 4.1Å; I638-L744 HydrophobicContact CD1-CG 3.89Å; D740-L744 PolarHBondContact O-N 3.12Å; M742-L744 PolarHBondContact O-N 2.94Å; L744-H748 WeakPolarHBondContact O-CB 3.25Å; L744-H748 PolarHBondContact O-N 3.41Å
745	L	97.8	Very high	90.9	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-68.3	-50.7	-178.1	-179.4	64.5	0	0	0	112.6	I638 F695 L702 T741 M742 G747 H748 L749 F772 L776	I638-L745 HydrophobicContact CD1-CD1 4.39Å; F695-L745 HydrophobicContact CD2-CD2 4.35Å; F695-L745 HydrophobicContact CE1-CD2 4.44Å; F695-L745 HydrophobicContact CE2-CD1 4.09Å; F695-L745 HydrophobicContact CE2-CD2 3.77Å; F695-L745 HydrophobicContact CE2-CG 4.49Å; F695-L745 HydrophobicContact CZ-CD1 4.49Å; F695-L745 HydrophobicContact CZ-CD2 3.83Å; L702-L745 HydrophobicContact CD2-CD2 4.06Å; T741-L745 WeakPolarHBondContact O-CB 3.27Å; T741-L745 PolarHBondContact O-N 3.45Å; M742-L745 PolarHBondContact O-N 2.95Å; L745-G747 VanDerWaalsContact C-N 3.3Å; L745-G747 PolarHBondContact O-N 3.38Å; L745-H748 WeakPolarHBondContact O-CB 3.34Å; L745-H748 PolarHBondContact O-N 2.91Å; L745-L749 HydrophobicContact CD1-CD1 4.21Å; L745-L749 HydrophobicContact CD1-CG 4.5Å; L745-L749 HydrophobicContact CG-CD1 4.12Å; L745-L749 WeakPolarHBondContact O-CG 3.47Å; L745-L749 PolarHBondContact O-N 2.8Å; L745-F772 HydrophobicContact CD1-CE1 4.09Å; L745-F772 HydrophobicContact CD1-CZ 4.4Å; L745-F772 HydrophobicContact CD2-CD1 4.33Å; L745-F772 HydrophobicContact CD2-CE1 4.21Å; L745-L776 HydrophobicContact CD2-CD1 3.64Å; L745-L776 HydrophobicContact CD2-CD2 3.65Å; L745-L776 HydrophobicContact CD2-CG 4.27Å
746	F	96.9	Very high	90.3	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-68.8	-32.2	178.8	-78.7	-101.8	0	0	0	111.3	F703 M742 H748 L749 Q750 L776 V797 I800 L801 Y804	F703-F746 HydrophobicContact CE2-CE2 4.15Å; F703-F746 HydrophobicContact CE2-CZ 4.16Å; F703-F746 HydrophobicContact CZ-CE2 4.16Å; F703-F746 AromaticContact CZ-CZ 3.97Å; F703-F746 HydrophobicContact CZ-CZ 3.97Å; M742-F746 HydrophobicContact CG-CD2 3.49Å; M742-F746 VanDerWaalsContact CG-CD2 3.49Å; M742-F746 HydrophobicContact CG-CE2 3.61Å; M742-F746 WeakPolarHBondContact O-CB 3.18Å; M742-F746 WeakPolarHBondContact O-CD2 3.38Å; M742-F746 PolarHBondContact O-N 2.74Å; M742-F746 HydrophobicContact SD-CE2 4.41Å; F746-H748 VanDerWaalsContact C-N 3.34Å; F746-H748 PolarHBondContact O-N 2.92Å; F746-L749 PolarHBondContact O-N 3.24Å; F746-Q750 PolarHBondContact O-N 2.87Å; F746-L776 HydrophobicContact CE2-CD1 3.77Å; F746-L776 HydrophobicContact CZ-CD1 4.01Å; F746-V797 HydrophobicContact CE1-CB 4.46Å; F746-V797 HydrophobicContact CE1-CG1 3.89Å; F746-V797 HydrophobicContact CZ-CG1 4.12Å; F746-V797 HydrophobicContact CZ-CG2 4.24Å; F746-I800 HydrophobicContact CD1-CB 4.09Å; F746-I800 HydrophobicContact CD1-CG2 3.51Å; F746-I800 HydrophobicContact CD2-CG2 4.49Å; F746-I800 HydrophobicContact CE1-CB 3.72Å; F746-I800 HydrophobicContact CE1-CG2 3.54Å; F746-I800 HydrophobicContact CG-CG2 4.01Å; F746-I800 HydrophobicContact CZ-CB 4.36Å; F746-I800 HydrophobicContact CZ-CG2 4.07Å; F746-L801 HydrophobicContact CD1-CD2 3.65Å; F746-L801 HydrophobicContact CD1-CG 3.8Å; F746-L801 HydrophobicContact CE1-CD2 4.24Å; F746-L801 HydrophobicContact CE1-CG 3.98Å; F746-L801 HydrophobicContact CG-CD2 4.48Å; F746-Y804 HydrophobicContact CB-CD2 3.64Å; F746-Y804 HydrophobicContact CB-CE2 3.94Å
747	G	95.4	Very high	89.8	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.01	17%	0.173	C	C	.	.	H	α-helix	trans	-64.8	-33.1	170.9	0	0	0	0	0	113.9	K743 L745 S751 R753 Y804	K743-G747 WeakPolarHBondContact O-CA 3.45Å; K743-G747 PolarHBondContact O-N 3.06Å; L745-G747 VanDerWaalsContact C-N 3.3Å; L745-G747 PolarHBondContact O-N 3.38Å; G747-S751 WeakPolarHBondContact O-CB 3.48Å; G747-S751 PolarHBondContact O-N 3.46Å; G747-R753 PolarHBondContact O-NE 3.19Å; G747-R753 PolarHBondContact O-NH2 2.84Å; G747-Y804 WeakPolarHBondContact CA-OH 3.16Å; G747-Y804 VanDerWaalsContact N-CE2 3.29Å
748	H	95.3	Very high	89.4	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-69.7	-40.5	170.6	170.9	68.5	0	0	0	112.5	I638 E642 Y652 L744 L745 F746 R753	I638-H748 HydrophobicContact CD1-CB 4.12Å; I638-H748 HydrophobicContact CG1-CB 4.23Å; I638-H748 HydrophobicContact CG2-CB 3.85Å; E642-H748 VanDerWaalsContact CG-ND1 3.3Å; E642-H748 WeakPolarHBondContact CG-ND1 3.3Å; E642-H748 IonicContact OE1-CE1 3.8Å; E642-H748 IonicContact OE1-CG 2.69Å; E642-H748 IonicContact OE1-ND1 3.67Å; E642-H748 PolarHBondContact OE1-ND1 3.07Å; Y652-H748 AromaticContact CE2-CD2 4Å; Y652-H748 AromaticContact CE2-NE2 3.41Å; Y652-H748 WeakPolarHBondContact CE2-NE2 3.4Å; Y652-H748 AromaticContact CZ-CD2 3.95Å; Y652-H748 AromaticContact CZ-NE2 3.53Å; Y652-H748 PolarHBondContact OH-CD2 3.31Å; Y652-H748 VanDerWaalsContact OH-CD2 3.24Å; Y652-H748 PolarHBondContact OH-NE2 3.44Å; L744-H748 WeakPolarHBondContact O-CB 3.25Å; L744-H748 PolarHBondContact O-N 3.41Å; L745-H748 WeakPolarHBondContact O-CB 3.34Å; L745-H748 PolarHBondContact O-N 2.91Å; F746-H748 VanDerWaalsContact C-N 3.34Å; F746-H748 PolarHBondContact O-N 2.92Å; H748-R753 WeakPolarHBondContact O-CB 3.41Å
749	L	94.8	Very high	89	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-76.6	-43.8	-174.6	-67.3	172.7	0	0	0	112.8	Y652 L745 F746 V754 I755 V768 F772 L801	Y652-L749 HydrophobicContact CD2-CD2 4.04Å; Y652-L749 HydrophobicContact CE2-CD2 3.88Å; L745-L749 HydrophobicContact CD1-CD1 4.21Å; L745-L749 HydrophobicContact CD1-CG 4.5Å; L745-L749 HydrophobicContact CG-CD1 4.12Å; L745-L749 WeakPolarHBondContact O-CG 3.47Å; L745-L749 PolarHBondContact O-N 2.8Å; F746-L749 PolarHBondContact O-N 3.24Å; L749-V754 HydrophobicContact CD2-CG2 4.42Å; L749-V754 WeakPolarHBondContact O-CB 3.36Å; L749-I755 WeakPolarHBondContact O-CD1 3.3Å; L749-I755 WeakPolarHBondContact O-CG1 3.42Å; L749-I755 PolarHBondContact O-N 3.04Å; L749-I755 VanDerWaalsContact O-N 3.11Å; L749-V768 HydrophobicContact CB-CG1 4.26Å; L749-V768 HydrophobicContact CD1-CG1 3.93Å; L749-V768 HydrophobicContact CD2-CG1 3.95Å; L749-V768 HydrophobicContact CG-CG1 4.26Å; L749-F772 HydrophobicContact CD1-CD1 4.36Å; L749-F772 HydrophobicContact CD1-CD2 3.8Å; L749-F772 HydrophobicContact CD1-CE1 4.33Å; L749-F772 HydrophobicContact CD1-CE2 3.77Å; L749-F772 HydrophobicContact CD1-CG 4.09Å; L749-F772 HydrophobicContact CD1-CZ 4.03Å; L749-F772 HydrophobicContact CD2-CD2 4.33Å; L749-F772 HydrophobicContact CD2-CE2 3.64Å; L749-F772 HydrophobicContact CD2-CZ 4.07Å; L749-F772 HydrophobicContact CG-CE2 4.36Å; L749-L801 HydrophobicContact CB-CD2 3.59Å; L749-L801 HydrophobicContact CD1-CD2 4.44Å
750	Q	85.1	Confident	88.7	Confident	41 Å²	41	47.1 Å²	47.1	19%	0.192	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-57	-178.9	-177.6	-112.6	37.7	0	0	113.3	F746 D752 I755 L801 Y804	F746-Q750 PolarHBondContact O-N 2.87Å; Q750-D752 PolarHBondContact O-N 2.73Å; Q750-D752 VanDerWaalsContact O-N 3.14Å; Q750-I755 HydrophobicContact CB-CD1 4.35Å; Q750-L801 HydrophobicContact CB-CB 4.49Å; Q750-L801 HydrophobicContact CB-CD2 3.93Å; Q750-L801 WeakPolarHBondContact CG-O 3.26Å; Q750-L801 PolarHBondContact NE2-O 3.1Å; Q750-L801 VanDerWaalsContact NE2-O 3.08Å; Q750-Y804 VanDerWaalsContact OE1-CD1 3.28Å
751	S	59.3	Low	88.4	Confident	30 Å²	30	44.7 Å²	44.7	21%	0.21	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	112.3	-166.8	172.8	0	0	0	0	112	G747 R753	G747-S751 WeakPolarHBondContact O-CB 3.48Å; G747-S751 PolarHBondContact O-N 3.46Å; S751-R753 WeakPolarHBondContact O-CB 3.47Å; S751-R753 WeakPolarHBondContact O-CG 3.48Å; S751-R753 PolarHBondContact O-N 3.49Å; S751-R753 PolarHBondContact O-NE 3.47Å
752	D	56.8	Low	88.2	Confident	118 Å²	118	51.9 Å²	51.9	63%	0.631	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.9	24.7	163.2	-45	0.4	0	0	0	114.4	Q750 E756	Q750-D752 PolarHBondContact O-N 2.73Å; Q750-D752 VanDerWaalsContact O-N 3.14Å; D752-E756 VanDerWaalsContact CA-OE2 3.25Å; D752-E756 WeakPolarHBondContact CA-OE2 3.25Å
753	R	77.4	Confident	88	Confident	63 Å²	63	51.9 Å²	51.9	24%	0.238	25%	0.248	C	C	.	.	S	Bend	trans	-142.5	-108.3	-167.5	-74.5	173.2	-81.5	-159.1	1.9	112.3	E642 L646 G747 H748 S751 I755 E756 Y757	E642-R753 HydrophobicContact CG-CG 4.47Å; E642-R753 WeakPolarHBondContact OE1-CD 3.19Å; E642-R753 IonicContact OE1-CZ 3.09Å; E642-R753 IonicContact OE1-NE 2.66Å; E642-R753 IonicContact OE1-NH1 2.66Å; E642-R753 PolarHBondContact OE1-NH1 3.48Å; E642-R753 WeakPolarHBondContact OE2-CD 3.19Å; E642-R753 IonicContact OE2-CZ 2.94Å; E642-R753 IonicContact OE2-NH1 2.7Å; E642-R753 PolarHBondContact OE2-NH1 2.91Å; L646-R753 HydrophobicContact CD1-CB 4.35Å; L646-R753 HydrophobicContact CD1-CG 4.12Å; L646-R753 HydrophobicContact CD2-CB 4.09Å; G747-R753 PolarHBondContact O-NE 3.19Å; G747-R753 PolarHBondContact O-NH2 2.84Å; H748-R753 WeakPolarHBondContact O-CB 3.41Å; S751-R753 WeakPolarHBondContact O-CB 3.47Å; S751-R753 WeakPolarHBondContact O-CG 3.48Å; S751-R753 PolarHBondContact O-N 3.49Å; S751-R753 PolarHBondContact O-NE 3.47Å; R753-I755 PolarHBondContact O-N 3.43Å; R753-E756 PolarHBondContact O-N 2.93Å; R753-Y757 VanDerWaalsContact O-CD2 3.26Å; R753-Y757 WeakPolarHBondContact O-CD2 3.44Å; R753-Y757 PolarHBondContact O-N 3.06Å
754	V	85.9	Confident	87.9	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-43.8	-164.8	179	0	0	0	0	112.5	L646 L651 Y652 L749 N761 M763 V768	L646-V754 HydrophobicContact CD2-CG2 3.98Å; L651-V754 HydrophobicContact CD2-CG1 4.14Å; L651-V754 HydrophobicContact CD2-CG2 3.92Å; Y652-V754 HydrophobicContact CD2-CG1 4.46Å; Y652-V754 HydrophobicContact CE2-CG2 4.13Å; L749-V754 HydrophobicContact CD2-CG2 4.42Å; L749-V754 WeakPolarHBondContact O-CB 3.36Å; V754-N761 PolarHBondContact O-ND2 3.36Å; V754-M763 HydrophobicContact CG1-CB 4.39Å; V754-V768 HydrophobicContact CG1-CG2 4.4Å
755	I	88.4	Confident	87.8	Confident	38 Å²	38	51.7 Å²	51.7	20%	0.195	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-31.1	179.4	-74.4	162.2	0	0	0	112.6	L749 Q750 R753 G758 V765 V768 L801	L749-I755 WeakPolarHBondContact O-CD1 3.3Å; L749-I755 WeakPolarHBondContact O-CG1 3.42Å; L749-I755 PolarHBondContact O-N 3.04Å; L749-I755 VanDerWaalsContact O-N 3.11Å; Q750-I755 HydrophobicContact CB-CD1 4.35Å; R753-I755 PolarHBondContact O-N 3.43Å; I755-G758 PolarHBondContact O-N 2.85Å; I755-V765 HydrophobicContact CD1-CB 4.32Å; I755-V765 HydrophobicContact CD1-CG1 4.27Å; I755-V765 HydrophobicContact CD1-CG2 4.09Å; I755-V765 HydrophobicContact CG2-CG2 4.09Å; I755-V768 HydrophobicContact CD1-CG2 4.5Å; I755-V768 HydrophobicContact CG1-CG2 4.23Å; I755-L801 HydrophobicContact CD1-CB 4.48Å; I755-L801 HydrophobicContact CD1-CD1 4.2Å; I755-L801 HydrophobicContact CD1-CD2 4.14Å
756	E	84.4	Confident	87.6	Confident	130 Å²	130	57 Å²	57	61%	0.607	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-40.4	176.7	-170.4	-179.7	-155.5	0	0	111.7	D752 R753 G758	D752-E756 VanDerWaalsContact CA-OE2 3.25Å; D752-E756 WeakPolarHBondContact CA-OE2 3.25Å; R753-E756 PolarHBondContact O-N 2.93Å; E756-G758 PolarHBondContact O-N 3.46Å
757	Y	87.1	Confident	87.5	Confident	102 Å²	102	59.5 Å²	59.5	40%	0.4	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	16.4	172.7	-77.4	-115.1	0	0	0	113.1	L646 R753 E759 D760 N761	L646-Y757 HydrophobicContact CB-CD1 3.76Å; L646-Y757 HydrophobicContact CB-CD2 4.27Å; L646-Y757 HydrophobicContact CB-CE1 4.03Å; L646-Y757 HydrophobicContact CB-CG 3.89Å; L646-Y757 HydrophobicContact CD1-CD2 4.37Å; L646-Y757 HydrophobicContact CD1-CE2 4.09Å; L646-Y757 VanDerWaalsContact O-CB 3.27Å; L646-Y757 WeakPolarHBondContact O-CB 3.49Å; R753-Y757 VanDerWaalsContact O-CD2 3.26Å; R753-Y757 WeakPolarHBondContact O-CD2 3.44Å; R753-Y757 PolarHBondContact O-N 3.06Å; Y757-E759 PolarHBondContact O-N 2.76Å; Y757-E759 VanDerWaalsContact O-N 3.13Å; Y757-D760 PolarHBondContact O-N 2.83Å; Y757-D760 VanDerWaalsContact O-N 3.12Å; Y757-N761 WeakPolarHBondContact CB-ND2 3.44Å; Y757-N761 PolarHBondContact O-N 3.5Å; Y757-N761 PolarHBondContact O-ND2 2.99Å; Y757-N761 PolarHBondContact O-OD1 2.87Å
758	G	87.9	Confident	87.6	Confident	23 Å²	23	59.4 Å²	59.4	24%	0.237	29%	0.291	C	S	.	.	H	α-helix	trans	-59.6	-20.9	-176.9	0	0	0	0	0	115.2	I755 E756 R762	I755-G758 PolarHBondContact O-N 2.85Å; E756-G758 PolarHBondContact O-N 3.46Å; G758-R762 WeakPolarHBondContact O-CA 3.24Å; G758-R762 PolarHBondContact O-N 3.27Å
759	E	90.5	Very high	87.6	Confident	183 Å²	183	59.4 Å²	59.4	86%	0.855	29%	0.291	S	S	*	.	H	α-helix	trans	-70	-44.3	173.2	-62	-161.7	154.8	0	0	112.2	Y757	Y757-E759 PolarHBondContact O-N 2.76Å; Y757-E759 VanDerWaalsContact O-N 3.13Å
760	D	91.4	Very high	87.7	Confident	103 Å²	103	64.2 Å²	64.2	55%	0.551	32%	0.316	S	S	*	.	H	α-helix	trans	-79.6	-51.6	178.3	-74.1	-47	0	0	0	111.6	Y757	Y757-D760 PolarHBondContact O-N 2.83Å; Y757-D760 VanDerWaalsContact O-N 3.12Å
761	N	92.6	Very high	88.2	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-86.5	-10.2	-172.7	74.6	36.7	0	0	0	114.4	L646 I648 D649 G650 V754 Y757 M763	L646-N761 WeakPolarHBondContact O-CB 3.41Å; L646-N761 PolarHBondContact O-ND2 2.87Å; I648-N761 WeakPolarHBondContact O-CB 3.31Å; D649-N761 WeakPolarHBondContact CA-O 3.49Å; G650-N761 PolarHBondContact N-O 3.2Å; V754-N761 PolarHBondContact O-ND2 3.36Å; Y757-N761 WeakPolarHBondContact CB-ND2 3.44Å; Y757-N761 PolarHBondContact O-N 3.5Å; Y757-N761 PolarHBondContact O-ND2 2.99Å; Y757-N761 PolarHBondContact O-OD1 2.87Å; N761-M763 VanDerWaalsContact C-N 3.25Å; N761-M763 PolarHBondContact O-N 2.96Å; N761-M763 VanDerWaalsContact OD1-CB 3.25Å; N761-M763 WeakPolarHBondContact OD1-CB 3.45Å; N761-M763 PolarHBondContact OD1-N 3.47Å
762	R	93.4	Very high	90	Very high	151 Å²	151	62.1 Å²	62.1	57%	0.57	30%	0.304	S	S	*	.			trans	57.5	31.8	176.5	-50.2	-175.5	-172.9	143	11.9	114.6	D649 R653 G758 N767	D649-R762 IonicContact OD2-CZ 2.87Å; D649-R762 IonicContact OD2-NE 2.88Å; D649-R762 IonicContact OD2-NH1 2.84Å; D649-R762 PolarHBondContact OD2-NH1 3.02Å; R653-R762 PolarHBondContact NH1-O 3.02Å; G758-R762 WeakPolarHBondContact O-CA 3.24Å; G758-R762 PolarHBondContact O-N 3.27Å; R762-N767 PolarHBondContact O-ND2 3.06Å; R762-N767 VanDerWaalsContact O-ND2 3.12Å
763	M	94	Very high	91.9	Very high	1 Å²	1	56.5 Å²	56.5	1%	0.005	27%	0.274	C	S	.	.			trans	-106.3	101.5	175.4	-65.6	-60.8	-64.7	0	0	111.3	L651 R653 V754 N761 N767 V768	L651-M763 WeakPolarHBondContact O-CE 3.47Å; L651-M763 VanDerWaalsContact O-CG 3.31Å; L651-M763 WeakPolarHBondContact O-CG 2.79Å; L651-M763 VanDerWaalsContact O-SD 3.37Å; R653-M763 HydrophobicContact CB-CE 3.91Å; R653-M763 HydrophobicContact CB-SD 3.62Å; V754-M763 HydrophobicContact CG1-CB 4.39Å; N761-M763 VanDerWaalsContact C-N 3.25Å; N761-M763 PolarHBondContact O-N 2.96Å; N761-M763 VanDerWaalsContact OD1-CB 3.25Å; N761-M763 WeakPolarHBondContact OD1-CB 3.45Å; N761-M763 PolarHBondContact OD1-N 3.47Å; M763-N767 HydrophobicContact CE-CB 3.62Å; M763-N767 HydrophobicContact SD-CB 3.95Å; M763-V768 HydrophobicContact CB-CG2 4.15Å; M763-V768 HydrophobicContact CE-CG2 3.87Å
764	T	94.2	Very high	92.8	Very high	73 Å²	73	56.9 Å²	56.9	45%	0.448	29%	0.285	S	S	.	.			trans	-75.7	164.7	167.8	61.6	0	0	0	0	111.2	Q766 N767 V768	T764-Q766 PolarHBondContact O-N 3.2Å; T764-N767 PolarHBondContact O-N 3.08Å; T764-N767 VanDerWaalsContact OG1-CG 3.31Å; T764-N767 PolarHBondContact OG1-N 3.43Å; T764-N767 VanDerWaalsContact OG1-N 3.15Å; T764-V768 WeakPolarHBondContact O-CG2 3.33Å; T764-V768 PolarHBondContact O-N 3.47Å
765	V	95.1	Very high	93.3	Very high	28 Å²	28	57.7 Å²	57.7	17%	0.17	29%	0.29	C	S	.	.	H	α-helix	trans	-49.3	-43.3	172.2	-164.7	0	0	0	0	111.4	I755 V768 A769 E798 L801	I755-V765 HydrophobicContact CD1-CB 4.32Å; I755-V765 HydrophobicContact CD1-CG1 4.27Å; I755-V765 HydrophobicContact CD1-CG2 4.09Å; I755-V765 HydrophobicContact CG2-CG2 4.09Å; V765-V768 PolarHBondContact O-N 3.41Å; V765-A769 VanDerWaalsContact O-CB 3.31Å; V765-A769 WeakPolarHBondContact O-CB 3.37Å; V765-A769 PolarHBondContact O-N 3.08Å; V765-E798 HydrophobicContact CG1-CG 4.02Å; V765-L801 HydrophobicContact CG1-CB 3.7Å; V765-L801 HydrophobicContact CG1-CD1 3.78Å; V765-L801 HydrophobicContact CG1-CG 4.4Å
766	Q	94.6	Very high	93.7	Very high	110 Å²	110	56 Å²	56	51%	0.514	28%	0.281	S	S	.	.	H	α-helix	trans	-66.6	-42.9	178.3	-70.3	171.5	-7	0	0	112.8	T764 V768 A769 I770 E798	T764-Q766 PolarHBondContact O-N 3.2Å; Q766-V768 VanDerWaalsContact C-N 3.27Å; Q766-V768 PolarHBondContact O-N 2.92Å; Q766-A769 PolarHBondContact O-N 3.42Å; Q766-I770 WeakPolarHBondContact O-CD1 3.45Å; Q766-I770 VanDerWaalsContact O-CG1 3.28Å; Q766-I770 WeakPolarHBondContact O-CG1 3.35Å; Q766-I770 PolarHBondContact O-N 3.05Å; Q766-E798 WeakPolarHBondContact CG-OE1 3.2Å; Q766-E798 PolarHBondContact NE2-OE1 2.98Å
767	N	95	Very high	94.2	Very high	53 Å²	53	49.9 Å²	49.9	28%	0.283	25%	0.253	S	S	.	.	H	α-helix	trans	-61.6	-36.7	174.9	-72.9	-12	0	0	0	111.7	R762 M763 T764 V771	R762-N767 PolarHBondContact O-ND2 3.06Å; R762-N767 VanDerWaalsContact O-ND2 3.12Å; M763-N767 HydrophobicContact CE-CB 3.62Å; M763-N767 HydrophobicContact SD-CB 3.95Å; T764-N767 PolarHBondContact O-N 3.08Å; T764-N767 VanDerWaalsContact OG1-CG 3.31Å; T764-N767 PolarHBondContact OG1-N 3.43Å; T764-N767 VanDerWaalsContact OG1-N 3.15Å; N767-V771 WeakPolarHBondContact O-CG2 3.46Å
768	V	96	Very high	94.3	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-71.1	-44.7	174.7	177	0	0	0	0	110.7	L749 V754 I755 M763 T764 V765 Q766 I770 V771 F772 L801	L749-V768 HydrophobicContact CB-CG1 4.26Å; L749-V768 HydrophobicContact CD1-CG1 3.93Å; L749-V768 HydrophobicContact CD2-CG1 3.95Å; L749-V768 HydrophobicContact CG-CG1 4.26Å; V754-V768 HydrophobicContact CG1-CG2 4.4Å; I755-V768 HydrophobicContact CD1-CG2 4.5Å; I755-V768 HydrophobicContact CG1-CG2 4.23Å; M763-V768 HydrophobicContact CB-CG2 4.15Å; M763-V768 HydrophobicContact CE-CG2 3.87Å; T764-V768 WeakPolarHBondContact O-CG2 3.33Å; T764-V768 PolarHBondContact O-N 3.47Å; V765-V768 PolarHBondContact O-N 3.41Å; Q766-V768 VanDerWaalsContact C-N 3.27Å; Q766-V768 PolarHBondContact O-N 2.92Å; V768-I770 PolarHBondContact O-N 2.75Å; V768-V771 PolarHBondContact O-N 3.31Å; V768-V771 VanDerWaalsContact O-N 3.1Å; V768-F772 HydrophobicContact CG1-CD2 3.79Å; V768-F772 HydrophobicContact CG1-CE2 4.3Å; V768-F772 PolarHBondContact O-N 3.32Å; V768-L801 HydrophobicContact CB-CD1 4.24Å; V768-L801 HydrophobicContact CG1-CD1 3.88Å
769	A	96.4	Very high	94.1	Very high	1 Å²	1	49 Å²	49	1%	0.008	25%	0.246	C	C	.	.	H	α-helix	trans	-60.6	-43.1	-179.9	0	0	0	0	0	112.7	V765 Q766 V771 F772 G773 N794 V797 E798	V765-A769 VanDerWaalsContact O-CB 3.31Å; V765-A769 WeakPolarHBondContact O-CB 3.37Å; V765-A769 PolarHBondContact O-N 3.08Å; Q766-A769 PolarHBondContact O-N 3.42Å; A769-V771 PolarHBondContact O-N 3.49Å; A769-F772 PolarHBondContact O-N 3.36Å; A769-G773 PolarHBondContact O-N 3.11Å; A769-N794 PolarHBondContact O-OD1 2.99Å; A769-V797 HydrophobicContact CB-CB 4.24Å; A769-V797 HydrophobicContact CB-CG1 4.11Å; A769-E798 HydrophobicContact CB-CB 3.98Å
770	I	95.7	Very high	93.8	Very high	101 Å²	101	47.5 Å²	47.5	52%	0.518	24%	0.239	S	C	.	.	H	α-helix	trans	-60.8	-31.5	175.5	-69.1	163.5	0	0	0	112.1	Q766 V768	Q766-I770 WeakPolarHBondContact O-CD1 3.45Å; Q766-I770 VanDerWaalsContact O-CG1 3.28Å; Q766-I770 WeakPolarHBondContact O-CG1 3.35Å; Q766-I770 PolarHBondContact O-N 3.05Å; V768-I770 PolarHBondContact O-N 2.75Å
771	V	96.6	Very high	93.3	Very high	26 Å²	26	47.2 Å²	47.2	16%	0.158	24%	0.241	C	C	.	.	H	α-helix	trans	-80	-41	177.1	172.7	0	0	0	0	111.7	K692 N767 V768 A769 T775	K692-V771 HydrophobicContact CD-CG1 3.57Å; N767-V771 WeakPolarHBondContact O-CG2 3.46Å; V768-V771 PolarHBondContact O-N 3.31Å; V768-V771 VanDerWaalsContact O-N 3.1Å; A769-V771 PolarHBondContact O-N 3.49Å; V771-T775 PolarHBondContact O-OG1 3.5Å
772	F	97.8	Very high	92.2	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-92.8	-25.5	-171.4	-82.4	-81.8	0	0	0	115	Y652 K692 L745 L749 V768 A769 T775 L776 V797	Y652-F772 AromaticContact CD1-CE2 3.68Å; Y652-F772 HydrophobicContact CD1-CE2 3.68Å; Y652-F772 AromaticContact CD1-CZ 3.48Å; Y652-F772 HydrophobicContact CD1-CZ 3.48Å; Y652-F772 VanDerWaalsContact CD1-CZ 3.48Å; Y652-F772 HydrophobicContact CD2-CE2 4.36Å; Y652-F772 HydrophobicContact CE1-CE2 4.24Å; Y652-F772 AromaticContact CE1-CZ 3.68Å; Y652-F772 HydrophobicContact CE1-CZ 3.68Å; Y652-F772 AromaticContact CG-CE2 3.76Å; Y652-F772 HydrophobicContact CG-CE2 3.76Å; Y652-F772 HydrophobicContact CG-CZ 4.05Å; K692-F772 HydrophobicContact CG-CE1 4.38Å; K692-F772 HydrophobicContact CG-CZ 4.32Å; L745-F772 HydrophobicContact CD1-CE1 4.09Å; L745-F772 HydrophobicContact CD1-CZ 4.4Å; L745-F772 HydrophobicContact CD2-CD1 4.33Å; L745-F772 HydrophobicContact CD2-CE1 4.21Å; L749-F772 HydrophobicContact CD1-CD1 4.36Å; L749-F772 HydrophobicContact CD1-CD2 3.8Å; L749-F772 HydrophobicContact CD1-CE1 4.33Å; L749-F772 HydrophobicContact CD1-CE2 3.77Å; L749-F772 HydrophobicContact CD1-CG 4.09Å; L749-F772 HydrophobicContact CD1-CZ 4.03Å; L749-F772 HydrophobicContact CD2-CD2 4.33Å; L749-F772 HydrophobicContact CD2-CE2 3.64Å; L749-F772 HydrophobicContact CD2-CZ 4.07Å; L749-F772 HydrophobicContact CG-CE2 4.36Å; V768-F772 HydrophobicContact CG1-CD2 3.79Å; V768-F772 HydrophobicContact CG1-CE2 4.3Å; V768-F772 PolarHBondContact O-N 3.32Å; A769-F772 PolarHBondContact O-N 3.36Å; F772-T775 HydrophobicContact CD1-CG2 4.45Å; F772-T775 CarbonylContact O-C 3.56Å; F772-T775 PolarHBondContact O-N 3.41Å; F772-L776 HydrophobicContact CB-CD1 4.04Å; F772-L776 HydrophobicContact CB-CG 4.29Å; F772-L776 HydrophobicContact CD1-CD1 3.89Å; F772-L776 HydrophobicContact CD1-CD2 4.15Å; F772-L776 HydrophobicContact CD1-CG 3.92Å; F772-L776 HydrophobicContact CG-CD1 4.38Å; F772-L776 WeakPolarHBondContact O-CB 3.39Å; F772-L776 WeakPolarHBondContact O-CG 3.25Å; F772-L776 PolarHBondContact O-N 3.31Å; F772-V797 HydrophobicContact CB-CG1 4.1Å
773	G	96.7	Very high	91.1	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-48	-66.1	174.9	0	0	0	0	0	112.9	A769 T775 L776 L777	A769-G773 PolarHBondContact O-N 3.11Å; G773-T775 PolarHBondContact O-N 2.81Å; G773-L776 PolarHBondContact O-N 2.84Å; G773-L777 WeakPolarHBondContact O-CB 3.4Å; G773-L777 PolarHBondContact O-N 3.06Å
774	P	94.8	Very high	89.4	Confident	71 Å²	71	56.1 Å²	56.1	46%	0.461	31%	0.311	S	S	.	.	H	α-helix	trans	-73.6	-1.2	177.4	31.1	-37.3	0	0	0	114.5
775	T	96.5	Very high	88.2	Confident	18 Å²	18	57.8 Å²	57.8	11%	0.11	32%	0.317	C	S	.	.	H	α-helix	trans	-94.5	-33.4	175.3	-61.9	0	0	0	0	111.8	K692 F695 V771 F772 G773	K692-T775 HydrophobicContact CB-CG2 4.23Å; K692-T775 HydrophobicContact CG-CG2 4.49Å; F695-T775 HydrophobicContact CB-CG2 4Å; V771-T775 PolarHBondContact O-OG1 3.5Å; F772-T775 HydrophobicContact CD1-CG2 4.45Å; F772-T775 CarbonylContact O-C 3.56Å; F772-T775 PolarHBondContact O-N 3.41Å; G773-T775 PolarHBondContact O-N 2.81Å
776	L	97.6	Very high	87.1	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.005	33%	0.327	C	S	.	.	H	α-helix	trans	-105.6	-25	-175	-56.6	-179.3	0	0	0	113.3	F695 P701 L702 F703 L745 F746 F772 G773	F695-L776 HydrophobicContact CB-CD2 3.88Å; F695-L776 HydrophobicContact CD1-CD2 3.97Å; F695-L776 HydrophobicContact CD2-CD2 4.03Å; F695-L776 HydrophobicContact CG-CD2 3.69Å; P701-L776 VanDerWaalsContact CB-O 3.28Å; P701-L776 WeakPolarHBondContact CB-O 3.23Å; L702-L776 HydrophobicContact CB-CB 4.5Å; L702-L776 HydrophobicContact CB-CD2 4.28Å; L702-L776 HydrophobicContact CD2-CD1 4.43Å; L702-L776 HydrophobicContact CD2-CD2 3.94Å; L702-L776 PolarHBondContact N-O 3.44Å; F703-L776 HydrophobicContact CD2-CB 3.93Å; F703-L776 HydrophobicContact CE2-CB 3.95Å; F703-L776 HydrophobicContact CE2-CD1 4.33Å; F703-L776 PolarHBondContact N-O 3.14Å; L745-L776 HydrophobicContact CD2-CD1 3.64Å; L745-L776 HydrophobicContact CD2-CD2 3.65Å; L745-L776 HydrophobicContact CD2-CG 4.27Å; F746-L776 HydrophobicContact CE2-CD1 3.77Å; F746-L776 HydrophobicContact CZ-CD1 4.01Å; F772-L776 HydrophobicContact CB-CD1 4.04Å; F772-L776 HydrophobicContact CB-CG 4.29Å; F772-L776 HydrophobicContact CD1-CD1 3.89Å; F772-L776 HydrophobicContact CD1-CD2 4.15Å; F772-L776 HydrophobicContact CD1-CG 3.92Å; F772-L776 HydrophobicContact CG-CD1 4.38Å; F772-L776 WeakPolarHBondContact O-CB 3.39Å; F772-L776 WeakPolarHBondContact O-CG 3.25Å; F772-L776 PolarHBondContact O-N 3.31Å; G773-L776 PolarHBondContact O-N 2.84Å
777	L	94	Very high	85.9	Confident	2 Å²	2	60 Å²	60	1%	0.01	34%	0.335	C	S	.	.			trans	-121	139.2	179	-59.8	99.4	0	0	0	110.4	F703 F708 G773 Q793 I796 V797	F703-L777 HydrophobicContact CB-CD2 4.14Å; F703-L777 HydrophobicContact CB-CG 3.98Å; F703-L777 HydrophobicContact CD1-CD2 4.02Å; F703-L777 HydrophobicContact CD1-CG 4.33Å; F703-L777 HydrophobicContact CD2-CD1 3.79Å; F703-L777 HydrophobicContact CD2-CD2 4.19Å; F703-L777 HydrophobicContact CD2-CG 3.59Å; F703-L777 HydrophobicContact CE1-CD2 4.49Å; F703-L777 HydrophobicContact CE2-CD1 3.81Å; F703-L777 HydrophobicContact CE2-CG 4.12Å; F703-L777 HydrophobicContact CG-CD1 4.32Å; F703-L777 HydrophobicContact CG-CD2 3.86Å; F703-L777 HydrophobicContact CG-CG 3.71Å; F703-L777 HydrophobicContact CZ-CD1 4.35Å; F708-L777 HydrophobicContact CD2-CB 4.36Å; F708-L777 HydrophobicContact CD2-CD2 4.26Å; F708-L777 HydrophobicContact CE2-CB 4.19Å; F708-L777 HydrophobicContact CE2-CD2 4.42Å; G773-L777 WeakPolarHBondContact O-CB 3.4Å; G773-L777 PolarHBondContact O-N 3.06Å; L777-Q793 HydrophobicContact CB-CB 4.35Å; L777-Q793 HydrophobicContact CB-CG 3.78Å; L777-I796 HydrophobicContact CD2-CB 4.42Å; L777-I796 HydrophobicContact CD2-CD1 3.96Å; L777-I796 HydrophobicContact CD2-CG2 4.06Å; L777-V797 HydrophobicContact CD1-CG2 3.61Å
778	R	89.2	Confident	84.7	Confident	73 Å²	73	62.7 Å²	62.7	28%	0.275	35%	0.347	S	S	.	.			trans	-154.3	143.1	167.6	58.3	-177.6	-166.4	-111.7	3.8	108.7	L698 P699 P701 F705	L698-R778 PolarHBondContact O-NH1 3.24Å; L698-R778 VanDerWaalsContact O-NH1 3.13Å; L698-R778 PolarHBondContact O-NH2 2.84Å; P699-R778 PolarHBondContact O-NH2 3.41Å; P701-R778 HydrophobicContact CB-CG 4.1Å; P701-R778 HydrophobicContact CG-CG 3.81Å; F705-R778 HydrophobicContact CE1-CG 4.05Å
779	P	85	Confident	83.9	Confident	35 Å²	35	64.2 Å²	64.2	23%	0.227	35%	0.354	C	S	.	.			trans	-66.5	158.3	172.3	31.7	-36.1	0	0	0	110.4	F708 T781	F708-P779 HydrophobicContact CD1-CB 4.33Å; F708-P779 HydrophobicContact CE1-CB 3.82Å; F708-P779 HydrophobicContact CZ-CB 4.19Å; P779-T781 VanDerWaalsContact C-N 3.35Å; P779-T781 WeakPolarHBondContact CB-O 3.49Å
780	E	84.3	Confident	83.3	Confident	151 Å²	151	69 Å²	69	71%	0.706	38%	0.378	S	S	*	.	S	Bend	trans	-71.8	-32.2	174.6	-170.5	174.7	-168.6	0	0	112	F705	F705-E780 HydrophobicContact CB-CB 4.25Å; F705-E780 HydrophobicContact CD1-CB 3.69Å; F705-E780 HydrophobicContact CD1-CG 4.31Å; F705-E780 HydrophobicContact CD2-CG 4.45Å; F705-E780 HydrophobicContact CE1-CB 4.1Å; F705-E780 HydrophobicContact CG-CB 4Å; F705-E780 HydrophobicContact CG-CG 4.25Å
781	T	80.3	Confident	83	Confident	96 Å²	96	67.7 Å²	67.7	59%	0.589	37%	0.374	S	S	*	.	S	Bend	trans	-124.3	143.4	179.2	51.3	0	0	0	0	111.3	P779 T783	P779-T781 VanDerWaalsContact C-N 3.35Å; P779-T781 WeakPolarHBondContact CB-O 3.49Å; T781-T783 PolarHBondContact O-N 3.34Å
782	E	70	Confident	82.8	Confident	182 Å²	182	68 Å²	68	85%	0.85	37%	0.373	S	S	*	.			trans	-75.6	105.8	171.7	-68.9	-177.1	157.4	0	0	109.2	I786	E782-I786 HydrophobicContact CB-CD1 4.48Å
783	T	70.1	Confident	82.6	Confident	52 Å²	52	68.5 Å²	68.5	32%	0.319	38%	0.375	S	S	.	.			trans	-91.1	161.4	175.2	65.8	0	0	0	0	110.6	T781 N785 I786 H789	T781-T783 PolarHBondContact O-N 3.34Å; T783-N785 PolarHBondContact O-N 2.86Å; T783-I786 WeakPolarHBondContact O-CD1 3.47Å; T783-I786 VanDerWaalsContact O-CG1 3.3Å; T783-I786 WeakPolarHBondContact O-CG1 3.46Å; T783-I786 PolarHBondContact O-N 3.22Å; T783-H789 PolarHBondContact OG1-CD2 2.66Å; T783-H789 PolarHBondContact OG1-NE2 3.34Å
784	A	57.7	Low	82.5	Confident	106 Å²	106	70.3 Å²	70.3	88%	0.876	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-18.7	176.2	0	0	0	0	0	113.8	I786	A784-I786 PolarHBondContact O-N 2.96Å
785	N	68.9	Low	82.6	Confident	107 Å²	107	70.7 Å²	70.7	57%	0.572	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	31.3	-174.9	-71.9	-35.5	0	0	0	113.9	T783 T787 M788 H789	T783-N785 PolarHBondContact O-N 2.86Å; N785-T787 PolarHBondContact O-N 2.65Å; N785-T787 VanDerWaalsContact O-N 3.12Å; N785-M788 HydrophobicContact CB-CB 4.4Å; N785-M788 WeakPolarHBondContact O-CB 3.43Å; N785-M788 PolarHBondContact O-N 2.86Å; N785-H789 PolarHBondContact O-CD2 3.07Å; N785-H789 VanDerWaalsContact O-CD2 3.29Å; N785-H789 PolarHBondContact O-N 3.31Å
786	I	71.1	Confident	82.6	Confident	73 Å²	73	69.8 Å²	69.8	37%	0.374	38%	0.376	S	S	.	.	H	α-helix	trans	-44.9	-45	178	-76.9	149	0	0	0	112.6	E782 T783 A784 M788 H789 M790	E782-I786 HydrophobicContact CB-CD1 4.48Å; T783-I786 WeakPolarHBondContact O-CD1 3.47Å; T783-I786 VanDerWaalsContact O-CG1 3.3Å; T783-I786 WeakPolarHBondContact O-CG1 3.46Å; T783-I786 PolarHBondContact O-N 3.22Å; A784-I786 PolarHBondContact O-N 2.96Å; I786-M788 VanDerWaalsContact C-N 3.34Å; I786-M788 PolarHBondContact O-N 2.67Å; I786-H789 PolarHBondContact O-N 2.59Å; I786-H789 VanDerWaalsContact O-N 3.16Å; I786-M790 HydrophobicContact CG2-CE 3.66Å; I786-M790 HydrophobicContact CG2-CG 4.46Å; I786-M790 HydrophobicContact CG2-SD 4.16Å; I786-M790 WeakPolarHBondContact O-CG 3.35Å; I786-M790 PolarHBondContact O-N 2.98Å
787	T	69.6	Low	82.6	Confident	111 Å²	111	69.8 Å²	69.8	68%	0.681	38%	0.375	S	S	*	.	H	α-helix	trans	-59.5	-40	-179.5	-43.1	0	0	0	0	112.9	N785 M790 V791	N785-T787 PolarHBondContact O-N 2.65Å; N785-T787 VanDerWaalsContact O-N 3.12Å; T787-M790 PolarHBondContact O-N 2.89Å; T787-V791 PolarHBondContact O-N 2.94Å
788	M	71.4	Confident	82.7	Confident	110 Å²	110	72.1 Å²	72.1	54%	0.542	39%	0.386	S	S	.	.	H	α-helix	trans	-68.1	-42.6	176.3	-70.2	-73.6	-78.6	0	0	111	N785 I786 M790 V791 F792	N785-M788 HydrophobicContact CB-CB 4.4Å; N785-M788 WeakPolarHBondContact O-CB 3.43Å; N785-M788 PolarHBondContact O-N 2.86Å; I786-M788 VanDerWaalsContact C-N 3.34Å; I786-M788 PolarHBondContact O-N 2.67Å; M788-M790 VanDerWaalsContact C-N 3.33Å; M788-M790 PolarHBondContact O-N 3.49Å; M788-V791 PolarHBondContact O-N 3.03Å; M788-F792 HydrophobicContact CB-CE2 4.25Å; M788-F792 HydrophobicContact CE-CE2 4.2Å; M788-F792 HydrophobicContact CE-CZ 4.12Å; M788-F792 WeakPolarHBondContact O-CD2 3.12Å; M788-F792 PolarHBondContact O-N 2.88Å; M788-F792 VanDerWaalsContact O-N 3.16Å
789	H	78.2	Confident	83.1	Confident	32 Å²	32	69.7 Å²	69.7	15%	0.148	38%	0.378	C	S	.	.	H	α-helix	trans	-62.1	-39.2	177.2	-70	-68.8	0	0	0	112.1	F708 T783 N785 I786 V791 F792 Q793	F708-H789 AromaticContact CE1-ND1 3.63Å; F708-H789 HydrophobicContact CZ-CB 4.36Å; F708-H789 AromaticContact CZ-ND1 3.77Å; T783-H789 PolarHBondContact OG1-CD2 2.66Å; T783-H789 PolarHBondContact OG1-NE2 3.34Å; N785-H789 PolarHBondContact O-CD2 3.07Å; N785-H789 VanDerWaalsContact O-CD2 3.29Å; N785-H789 PolarHBondContact O-N 3.31Å; I786-H789 PolarHBondContact O-N 2.59Å; I786-H789 VanDerWaalsContact O-N 3.16Å; H789-V791 VanDerWaalsContact C-N 3.32Å; H789-V791 PolarHBondContact O-N 2.88Å; H789-F792 PolarHBondContact O-N 3.42Å; H789-Q793 WeakPolarHBondContact O-CG 3.34Å; H789-Q793 PolarHBondContact O-N 2.91Å
790	M	83.4	Confident	83.6	Confident	103 Å²	103	68 Å²	68	51%	0.507	37%	0.367	S	S	.	.	H	α-helix	trans	-59.4	-39.2	175.3	-72.2	177	171.4	0	0	112.9	I786 T787 M788 N794	I786-M790 HydrophobicContact CG2-CE 3.66Å; I786-M790 HydrophobicContact CG2-CG 4.46Å; I786-M790 HydrophobicContact CG2-SD 4.16Å; I786-M790 WeakPolarHBondContact O-CG 3.35Å; I786-M790 PolarHBondContact O-N 2.98Å; T787-M790 PolarHBondContact O-N 2.89Å; M788-M790 VanDerWaalsContact C-N 3.33Å; M788-M790 PolarHBondContact O-N 3.49Å; M790-N794 PolarHBondContact O-N 3.24Å
791	V	89.8	Confident	84.1	Confident	73 Å²	73	60.8 Å²	60.8	44%	0.442	33%	0.333	S	S	.	.	H	α-helix	trans	-66	-47.6	176	176.8	0	0	0	0	110.8	T787 M788 H789 Q793 N794 Q795	T787-V791 PolarHBondContact O-N 2.94Å; M788-V791 PolarHBondContact O-N 3.03Å; H789-V791 VanDerWaalsContact C-N 3.32Å; H789-V791 PolarHBondContact O-N 2.88Å; V791-Q793 PolarHBondContact O-N 3.42Å; V791-N794 PolarHBondContact O-N 3.49Å; V791-Q795 HydrophobicContact CG1-CG 4.43Å; V791-Q795 WeakPolarHBondContact O-CG 3.34Å; V791-Q795 PolarHBondContact O-N 3.49Å
792	F	91.9	Very high	84.8	Confident	31 Å²	31	60.2 Å²	60.2	14%	0.136	33%	0.327	C	S	.	.	H	α-helix	trans	-63.9	-38.1	179.2	-63.2	-51	0	0	0	112.8	V712 I715 R716 M788 H789 N794 Q795 I796	V712-F792 HydrophobicContact CG1-CB 4.43Å; V712-F792 HydrophobicContact CG1-CD2 3.81Å; V712-F792 HydrophobicContact CG1-CE2 4.3Å; V712-F792 HydrophobicContact CG1-CG 4.14Å; V712-F792 HydrophobicContact CG2-CB 4.12Å; I715-F792 HydrophobicContact CG2-CB 4.31Å; I715-F792 HydrophobicContact CG2-CD1 3.93Å; I715-F792 HydrophobicContact CG2-CG 4.42Å; R716-F792 HydrophobicContact CG-CD1 4.17Å; R716-F792 HydrophobicContact CG-CE1 3.52Å; R716-F792 HydrophobicContact CG-CZ 3.74Å; M788-F792 HydrophobicContact CB-CE2 4.25Å; M788-F792 HydrophobicContact CE-CE2 4.2Å; M788-F792 HydrophobicContact CE-CZ 4.12Å; M788-F792 WeakPolarHBondContact O-CD2 3.12Å; M788-F792 PolarHBondContact O-N 2.88Å; M788-F792 VanDerWaalsContact O-N 3.16Å; H789-F792 PolarHBondContact O-N 3.42Å; F792-N794 VanDerWaalsContact C-N 3.32Å; F792-N794 PolarHBondContact O-N 3.46Å; F792-Q795 PolarHBondContact O-N 2.95Å; F792-I796 WeakPolarHBondContact O-CB 3.48Å; F792-I796 WeakPolarHBondContact O-CD1 3.47Å; F792-I796 WeakPolarHBondContact O-CG1 3.42Å; F792-I796 PolarHBondContact O-N 3.32Å
793	Q	93.9	Very high	86	Confident	11 Å²	11	52.7 Å²	52.7	5%	0.051	29%	0.291	C	S	.	.	H	α-helix	trans	-56.4	-45.2	175.1	-72.7	168.6	-0.5	0	0	111.9	F708 L777 H789 V791 V797	F708-Q793 HydrophobicContact CE2-CG 4.05Å; L777-Q793 HydrophobicContact CB-CB 4.35Å; L777-Q793 HydrophobicContact CB-CG 3.78Å; H789-Q793 WeakPolarHBondContact O-CG 3.34Å; H789-Q793 PolarHBondContact O-N 2.91Å; V791-Q793 PolarHBondContact O-N 3.42Å; Q793-V797 WeakPolarHBondContact O-CG2 3.39Å; Q793-V797 PolarHBondContact O-N 2.92Å
794	N	95.3	Very high	87.2	Confident	39 Å²	39	50.5 Å²	50.5	21%	0.209	28%	0.277	C	S	.	.	H	α-helix	trans	-67.6	-44.7	177.7	-64.9	-13.8	0	0	0	111.1	A769 M790 V791 F792 I796 V797 E798	A769-N794 PolarHBondContact O-OD1 2.99Å; M790-N794 PolarHBondContact O-N 3.24Å; V791-N794 PolarHBondContact O-N 3.49Å; F792-N794 VanDerWaalsContact C-N 3.32Å; F792-N794 PolarHBondContact O-N 3.46Å; N794-I796 VanDerWaalsContact C-N 3.34Å; N794-I796 PolarHBondContact O-N 3.47Å; N794-V797 PolarHBondContact O-N 3.41Å; N794-E798 WeakPolarHBondContact O-CB 3.15Å; N794-E798 PolarHBondContact O-N 2.82Å
795	Q	95.8	Very high	88.8	Confident	78 Å²	78	48.9 Å²	48.9	36%	0.364	26%	0.259	S	S	.	.	H	α-helix	trans	-62	-37.4	178.1	-71.1	176.9	-13.2	0	0	113.1	I715 V791 F792 E798 F799	I715-Q795 HydrophobicContact CD1-CB 4.26Å; I715-Q795 WeakPolarHBondContact CD1-O 3.41Å; I715-Q795 HydrophobicContact CG1-CB 3.74Å; V791-Q795 HydrophobicContact CG1-CG 4.43Å; V791-Q795 WeakPolarHBondContact O-CG 3.34Å; V791-Q795 PolarHBondContact O-N 3.49Å; F792-Q795 PolarHBondContact O-N 2.95Å; Q795-E798 PolarHBondContact O-N 3.19Å; Q795-F799 WeakPolarHBondContact O-CB 3.31Å; Q795-F799 PolarHBondContact O-N 3.45Å
796	I	97.1	Very high	90	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62.7	-46.4	174.9	-69.5	157.6	0	0	0	110.2	F703 F711 V712 I715 L777 F792 N794 F799 I800	F703-I796 HydrophobicContact CE1-CG2 4.02Å; F703-I796 HydrophobicContact CZ-CG2 4.38Å; F711-I796 HydrophobicContact CB-CD1 3.88Å; F711-I796 HydrophobicContact CB-CG1 4.38Å; F711-I796 HydrophobicContact CB-CG2 4.48Å; F711-I796 HydrophobicContact CD1-CG2 4.28Å; V712-I796 HydrophobicContact CG2-CD1 4.05Å; I715-I796 HydrophobicContact CB-CG1 3.89Å; I715-I796 HydrophobicContact CG1-CG1 4.11Å; I715-I796 HydrophobicContact CG2-CD1 4.32Å; I715-I796 HydrophobicContact CG2-CG1 3.94Å; L777-I796 HydrophobicContact CD2-CB 4.42Å; L777-I796 HydrophobicContact CD2-CD1 3.96Å; L777-I796 HydrophobicContact CD2-CG2 4.06Å; F792-I796 WeakPolarHBondContact O-CB 3.48Å; F792-I796 WeakPolarHBondContact O-CD1 3.47Å; F792-I796 WeakPolarHBondContact O-CG1 3.42Å; F792-I796 PolarHBondContact O-N 3.32Å; N794-I796 VanDerWaalsContact C-N 3.34Å; N794-I796 PolarHBondContact O-N 3.47Å; I796-F799 PolarHBondContact O-N 3.22Å; I796-I800 HydrophobicContact CG2-CD1 3.69Å; I796-I800 WeakPolarHBondContact O-CB 3.48Å; I796-I800 VanDerWaalsContact O-CG1 3.25Å; I796-I800 WeakPolarHBondContact O-CG1 3.47Å; I796-I800 PolarHBondContact O-N 2.76Å
797	V	97.4	Very high	91.1	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-66.9	-42.1	178	176	0	0	0	0	111.6	F746 A769 F772 L777 Q793 N794 F799 I800 L801	F746-V797 HydrophobicContact CE1-CB 4.46Å; F746-V797 HydrophobicContact CE1-CG1 3.89Å; F746-V797 HydrophobicContact CZ-CG1 4.12Å; F746-V797 HydrophobicContact CZ-CG2 4.24Å; A769-V797 HydrophobicContact CB-CB 4.24Å; A769-V797 HydrophobicContact CB-CG1 4.11Å; F772-V797 HydrophobicContact CB-CG1 4.1Å; L777-V797 HydrophobicContact CD1-CG2 3.61Å; Q793-V797 WeakPolarHBondContact O-CG2 3.39Å; Q793-V797 PolarHBondContact O-N 2.92Å; N794-V797 PolarHBondContact O-N 3.41Å; V797-F799 PolarHBondContact O-N 3.04Å; V797-I800 PolarHBondContact O-N 3.12Å; V797-L801 HydrophobicContact CG1-CD1 3.85Å; V797-L801 HydrophobicContact CG1-CG 4.34Å; V797-L801 WeakPolarHBondContact O-CB 3.22Å; V797-L801 WeakPolarHBondContact O-CD1 3.46Å; V797-L801 WeakPolarHBondContact O-CG 3.46Å; V797-L801 PolarHBondContact O-N 3.44Å
798	E	96.1	Very high	92.2	Very high	51 Å²	51	42.3 Å²	42.3	24%	0.238	21%	0.21	C	C	.	.	H	α-helix	trans	-60.2	-44.6	175.8	-177.8	171.5	-166.7	0	0	111.9	V765 Q766 A769 N794 Q795 L801 N802	V765-E798 HydrophobicContact CG1-CG 4.02Å; Q766-E798 WeakPolarHBondContact CG-OE1 3.2Å; Q766-E798 PolarHBondContact NE2-OE1 2.98Å; A769-E798 HydrophobicContact CB-CB 3.98Å; N794-E798 WeakPolarHBondContact O-CB 3.15Å; N794-E798 PolarHBondContact O-N 2.82Å; Q795-E798 PolarHBondContact O-N 3.19Å; E798-L801 PolarHBondContact O-N 2.83Å; E798-N802 WeakPolarHBondContact O-CB 3.34Å; E798-N802 VanDerWaalsContact O-CG 3.29Å; E798-N802 PolarHBondContact O-N 3.5Å; E798-N802 PolarHBondContact O-ND2 3.38Å; E798-N802 VanDerWaalsContact O-ND2 3.15Å
799	F	96.9	Very high	92.9	Very high	22 Å²	22	44.3 Å²	44.3	10%	0.096	21%	0.213	C	C	.	.	H	α-helix	trans	-65	-45.5	177.1	-171.1	-86.9	0	0	0	112.2	I715 Y720 K723 L724 I727 Q795 I796 V797 L801 N802 E803	I715-F799 HydrophobicContact CD1-CB 3.71Å; I715-F799 HydrophobicContact CD1-CD2 4.39Å; I715-F799 HydrophobicContact CD1-CG 4.09Å; Y720-F799 HydrophobicContact CD2-CE2 4.22Å; Y720-F799 HydrophobicContact CE2-CE2 4.09Å; K723-F799 HydrophobicContact CD-CD2 3.89Å; K723-F799 HydrophobicContact CD-CE2 3.59Å; K723-F799 HydrophobicContact CD-CZ 4.14Å; K723-F799 HydrophobicContact CG-CD2 4.39Å; K723-F799 HydrophobicContact CG-CE1 4.4Å; K723-F799 HydrophobicContact CG-CE2 3.84Å; K723-F799 HydrophobicContact CG-CZ 3.84Å; L724-F799 HydrophobicContact CB-CZ 4.03Å; L724-F799 HydrophobicContact CD1-CE1 4.03Å; L724-F799 HydrophobicContact CD1-CZ 4.08Å; I727-F799 HydrophobicContact CB-CE1 4.21Å; I727-F799 HydrophobicContact CD1-CD1 3.45Å; I727-F799 VanDerWaalsContact CD1-CD1 3.45Å; I727-F799 HydrophobicContact CD1-CE1 3.66Å; I727-F799 HydrophobicContact CD1-CG 4.08Å; I727-F799 HydrophobicContact CD1-CZ 4.43Å; I727-F799 HydrophobicContact CG1-CE1 4.47Å; I727-F799 HydrophobicContact CG2-CD1 4.18Å; I727-F799 HydrophobicContact CG2-CE1 4.23Å; Q795-F799 WeakPolarHBondContact O-CB 3.31Å; Q795-F799 PolarHBondContact O-N 3.45Å; I796-F799 PolarHBondContact O-N 3.22Å; V797-F799 PolarHBondContact O-N 3.04Å; F799-L801 VanDerWaalsContact C-N 3.32Å; F799-L801 PolarHBondContact O-N 2.92Å; F799-N802 PolarHBondContact O-N 3.4Å; F799-E803 HydrophobicContact CD1-CB 4.49Å; F799-E803 HydrophobicContact CD1-CG 4.21Å; F799-E803 HydrophobicContact CE1-CB 4.2Å; F799-E803 HydrophobicContact CE1-CG 3.81Å; F799-E803 HydrophobicContact CE2-CG 4.15Å; F799-E803 HydrophobicContact CZ-CG 3.78Å; F799-E803 WeakPolarHBondContact O-CB 3.35Å; F799-E803 PolarHBondContact O-N 2.96Å
800	I	96.6	Very high	91.9	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-69.1	-30.3	-179.2	-64.6	169.8	0	0	0	111.7	F703 F711 I727 F746 I796 V797 Y804 L807 F808	F703-I800 HydrophobicContact CE1-CD1 3.55Å; F703-I800 HydrophobicContact CZ-CD1 3.67Å; F711-I800 HydrophobicContact CE1-CD1 4.23Å; I727-I800 HydrophobicContact CG2-CD1 4.36Å; I727-I800 HydrophobicContact CG2-CG1 3.96Å; F746-I800 HydrophobicContact CD1-CB 4.09Å; F746-I800 HydrophobicContact CD1-CG2 3.51Å; F746-I800 HydrophobicContact CD2-CG2 4.49Å; F746-I800 HydrophobicContact CE1-CB 3.72Å; F746-I800 HydrophobicContact CE1-CG2 3.54Å; F746-I800 HydrophobicContact CG-CG2 4.01Å; F746-I800 HydrophobicContact CZ-CB 4.36Å; F746-I800 HydrophobicContact CZ-CG2 4.07Å; I796-I800 HydrophobicContact CG2-CD1 3.69Å; I796-I800 WeakPolarHBondContact O-CB 3.48Å; I796-I800 VanDerWaalsContact O-CG1 3.25Å; I796-I800 WeakPolarHBondContact O-CG1 3.47Å; I796-I800 PolarHBondContact O-N 2.76Å; V797-I800 PolarHBondContact O-N 3.12Å; I800-Y804 VanDerWaalsContact O-CA 3.27Å; I800-Y804 WeakPolarHBondContact O-CA 3.48Å; I800-Y804 WeakPolarHBondContact O-CB 3.21Å; I800-Y804 PolarHBondContact O-N 2.88Å; I800-L807 HydrophobicContact CB-CD1 4.04Å; I800-L807 HydrophobicContact CG1-CD1 3.88Å; I800-L807 HydrophobicContact CG2-CD1 3.93Å; I800-F808 HydrophobicContact CG2-CE2 3.97Å
801	L	95.6	Very high	92.3	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-65.3	-55.3	168.9	-71.9	165.3	0	0	0	110.7	F746 L749 Q750 I755 V765 V768 V797 E798 F799 E803 Y804	F746-L801 HydrophobicContact CD1-CD2 3.65Å; F746-L801 HydrophobicContact CD1-CG 3.8Å; F746-L801 HydrophobicContact CE1-CD2 4.24Å; F746-L801 HydrophobicContact CE1-CG 3.98Å; F746-L801 HydrophobicContact CG-CD2 4.48Å; L749-L801 HydrophobicContact CB-CD2 3.59Å; L749-L801 HydrophobicContact CD1-CD2 4.44Å; Q750-L801 HydrophobicContact CB-CB 4.49Å; Q750-L801 HydrophobicContact CB-CD2 3.93Å; Q750-L801 WeakPolarHBondContact CG-O 3.26Å; Q750-L801 PolarHBondContact NE2-O 3.1Å; Q750-L801 VanDerWaalsContact NE2-O 3.08Å; I755-L801 HydrophobicContact CD1-CB 4.48Å; I755-L801 HydrophobicContact CD1-CD1 4.2Å; I755-L801 HydrophobicContact CD1-CD2 4.14Å; V765-L801 HydrophobicContact CG1-CB 3.7Å; V765-L801 HydrophobicContact CG1-CD1 3.78Å; V765-L801 HydrophobicContact CG1-CG 4.4Å; V768-L801 HydrophobicContact CB-CD1 4.24Å; V768-L801 HydrophobicContact CG1-CD1 3.88Å; V797-L801 HydrophobicContact CG1-CD1 3.85Å; V797-L801 HydrophobicContact CG1-CG 4.34Å; V797-L801 WeakPolarHBondContact O-CB 3.22Å; V797-L801 WeakPolarHBondContact O-CD1 3.46Å; V797-L801 WeakPolarHBondContact O-CG 3.46Å; V797-L801 PolarHBondContact O-N 3.44Å; E798-L801 PolarHBondContact O-N 2.83Å; F799-L801 VanDerWaalsContact C-N 3.32Å; F799-L801 PolarHBondContact O-N 2.92Å; L801-E803 VanDerWaalsContact C-N 3.31Å; L801-E803 PolarHBondContact O-N 3.49Å; L801-Y804 WeakPolarHBondContact O-CB 3.36Å; L801-Y804 PolarHBondContact O-N 3.46Å
802	N	94.3	Very high	92.5	Very high	84 Å²	84	44.8 Å²	44.8	45%	0.449	22%	0.224	S	C	.	.	H	α-helix	trans	-57.1	-43.1	-178	-72.5	-31	0	0	0	112.4	E798 F799	E798-N802 WeakPolarHBondContact O-CB 3.34Å; E798-N802 VanDerWaalsContact O-CG 3.29Å; E798-N802 PolarHBondContact O-N 3.5Å; E798-N802 PolarHBondContact O-ND2 3.38Å; E798-N802 VanDerWaalsContact O-ND2 3.15Å; F799-N802 PolarHBondContact O-N 3.4Å
803	E	94.6	Very high	92.5	Very high	23 Å²	23	45.6 Å²	45.6	11%	0.107	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	7.4	-175	-60.9	-61.8	137.1	0	0	114.3	Y720 L724 F799 L801 S805 R806 L807	Y720-E803 PolarHBondContact OH-OE1 3.04Å; Y720-E803 PolarHBondContact OH-OE2 3.2Å; L724-E803 HydrophobicContact CD1-CB 3.95Å; L724-E803 HydrophobicContact CD1-CG 4.01Å; F799-E803 HydrophobicContact CD1-CB 4.49Å; F799-E803 HydrophobicContact CD1-CG 4.21Å; F799-E803 HydrophobicContact CE1-CB 4.2Å; F799-E803 HydrophobicContact CE1-CG 3.81Å; F799-E803 HydrophobicContact CE2-CG 4.15Å; F799-E803 HydrophobicContact CZ-CG 3.78Å; F799-E803 WeakPolarHBondContact O-CB 3.35Å; F799-E803 PolarHBondContact O-N 2.96Å; L801-E803 VanDerWaalsContact C-N 3.31Å; L801-E803 PolarHBondContact O-N 3.49Å; E803-S805 VanDerWaalsContact C-N 3.28Å; E803-S805 PolarHBondContact O-N 2.93Å; E803-R806 WeakPolarHBondContact O-CA 3.26Å; E803-R806 PolarHBondContact O-N 3.49Å; E803-R806 IonicContact OE1-NH1 3.15Å; E803-R806 WeakPolarHBondContact OE2-CD 3.47Å; E803-R806 IonicContact OE2-CZ 2.84Å; E803-R806 IonicContact OE2-NE 2.83Å; E803-R806 IonicContact OE2-NH1 2.67Å; E803-R806 PolarHBondContact OE2-NH1 2.7Å; E803-L807 HydrophobicContact CB-CD1 4Å; E803-L807 HydrophobicContact CB-CG 4.07Å; E803-L807 PolarHBondContact O-N 2.94Å
804	Y	94.6	Very high	92.4	Very high	7 Å²	7	47.6 Å²	47.6	3%	0.027	24%	0.24	C	C	.	.	H	α-helix	trans	-44.7	-47.3	-172.4	171.6	-101.4	0	0	0	113.9	K743 F746 G747 Q750 I800 L801 R806 L807 F808 Y809	K743-Y804 HydrophobicContact CG-CE2 4.39Å; K743-Y804 WeakPolarHBondContact O-CE2 3.22Å; K743-Y804 PolarHBondContact O-OH 2.79Å; K743-Y804 VanDerWaalsContact O-OH 3.12Å; F746-Y804 HydrophobicContact CB-CD2 3.64Å; F746-Y804 HydrophobicContact CB-CE2 3.94Å; G747-Y804 WeakPolarHBondContact CA-OH 3.16Å; G747-Y804 VanDerWaalsContact N-CE2 3.29Å; Q750-Y804 VanDerWaalsContact OE1-CD1 3.28Å; I800-Y804 VanDerWaalsContact O-CA 3.27Å; I800-Y804 WeakPolarHBondContact O-CA 3.48Å; I800-Y804 WeakPolarHBondContact O-CB 3.21Å; I800-Y804 PolarHBondContact O-N 2.88Å; L801-Y804 WeakPolarHBondContact O-CB 3.36Å; L801-Y804 PolarHBondContact O-N 3.46Å; Y804-R806 VanDerWaalsContact C-N 3.3Å; Y804-R806 PolarHBondContact O-N 2.64Å; Y804-L807 PolarHBondContact O-N 3.34Å; Y804-F808 AromaticContact CD2-CD2 3.26Å; Y804-F808 HydrophobicContact CD2-CD2 3.26Å; Y804-F808 AromaticContact CD2-CE2 3.69Å; Y804-F808 HydrophobicContact CD2-CE2 3.69Å; Y804-F808 HydrophobicContact CD2-CG 4.17Å; Y804-F808 HydrophobicContact CE2-CB 4.15Å; Y804-F808 AromaticContact CE2-CD2 3.43Å; Y804-F808 HydrophobicContact CE2-CD2 3.43Å; Y804-F808 VanDerWaalsContact CE2-CD2 3.43Å; Y804-F808 AromaticContact CE2-CE2 3.98Å; Y804-F808 HydrophobicContact CE2-CE2 3.98Å; Y804-F808 AromaticContact CE2-CG 3.9Å; Y804-F808 HydrophobicContact CE2-CG 3.9Å; Y804-F808 HydrophobicContact CG-CD2 4.18Å; Y804-F808 WeakPolarHBondContact O-CD2 3.27Å; Y804-F808 PolarHBondContact O-N 2.61Å; Y804-Y809 HydrophobicContact CE1-CD2 4.48Å; Y804-Y809 AromaticContact CE1-CE2 3.71Å; Y804-Y809 HydrophobicContact CE1-CE2 3.71Å; Y804-Y809 AromaticContact CZ-CE2 3.79Å; Y804-Y809 PolarHBondContact OH-OH 2.79Å
805	S	92.8	Very high	92.2	Very high	71 Å²	71	48.1 Å²	48.1	50%	0.497	24%	0.242	S	C	.	.	H	α-helix	trans	-63.8	-33	-178.9	-47.9	0	0	0	0	113.2	E803 Y809	E803-S805 VanDerWaalsContact C-N 3.28Å; E803-S805 PolarHBondContact O-N 2.93Å; S805-Y809 WeakPolarHBondContact O-CB 3.2Å; S805-Y809 PolarHBondContact O-N 3Å
806	R	93.2	Very high	92	Very high	137 Å²	137	46.1 Å²	46.1	52%	0.517	23%	0.233	S	C	.	.	H	α-helix	trans	-79.7	-35.9	174.8	-61.1	-169.6	-174.5	140.8	-7.4	111.8	Y720 E803 Y804 S810	Y720-R806 PolarHBondContact OH-NH1 3.49Å; E803-R806 WeakPolarHBondContact O-CA 3.26Å; E803-R806 PolarHBondContact O-N 3.49Å; E803-R806 IonicContact OE1-NH1 3.15Å; E803-R806 WeakPolarHBondContact OE2-CD 3.47Å; E803-R806 IonicContact OE2-CZ 2.84Å; E803-R806 IonicContact OE2-NE 2.83Å; E803-R806 IonicContact OE2-NH1 2.67Å; E803-R806 PolarHBondContact OE2-NH1 2.7Å; Y804-R806 VanDerWaalsContact C-N 3.3Å; Y804-R806 PolarHBondContact O-N 2.64Å; R806-S810 WeakPolarHBondContact O-CB 3.49Å
807	L	94.8	Very high	91.6	Very high	5 Å²	5	49.4 Å²	49.4	3%	0.026	25%	0.25	C	S	.	.	H	α-helix	trans	-73	-33.7	-177.9	-67.1	174.3	0	0	0	113.3	L724 I727 I800 E803 Y804	L724-L807 HydrophobicContact CD1-CD2 3.96Å; L724-L807 HydrophobicContact CD1-CG 4.44Å; I727-L807 HydrophobicContact CB-CD2 4.48Å; I727-L807 HydrophobicContact CG2-CD1 4.05Å; I727-L807 HydrophobicContact CG2-CD2 3.91Å; I800-L807 HydrophobicContact CB-CD1 4.04Å; I800-L807 HydrophobicContact CG1-CD1 3.88Å; I800-L807 HydrophobicContact CG2-CD1 3.93Å; E803-L807 HydrophobicContact CB-CD1 4Å; E803-L807 HydrophobicContact CB-CG 4.07Å; E803-L807 PolarHBondContact O-N 2.94Å; Y804-L807 PolarHBondContact O-N 3.34Å
808	F	93.1	Very high	91.2	Very high	11 Å²	11	53.2 Å²	53.2	5%	0.048	27%	0.269	C	S	.	.	H	α-helix	trans	-114.4	-4.2	-172.1	-67.4	-80.3	0	0	0	115.5	V731 H739 M742 K743 I800 Y804	V731-F808 HydrophobicContact CG1-CD1 4.09Å; V731-F808 HydrophobicContact CG1-CE1 3.45Å; V731-F808 VanDerWaalsContact CG1-CE1 3.45Å; V731-F808 HydrophobicContact CG1-CE2 4.42Å; V731-F808 HydrophobicContact CG1-CZ 3.64Å; H739-F808 AromaticContact NE2-CD1 3.67Å; H739-F808 AromaticContact NE2-CE1 3.97Å; M742-F808 HydrophobicContact CB-CZ 4.35Å; M742-F808 HydrophobicContact CG-CZ 3.86Å; M742-F808 HydrophobicContact SD-CZ 3.97Å; K743-F808 HydrophobicContact CB-CD1 3.64Å; K743-F808 HydrophobicContact CB-CE1 3.87Å; K743-F808 HydrophobicContact CB-CG 4.3Å; K743-F808 HydrophobicContact CD-CB 3.98Å; K743-F808 HydrophobicContact CD-CD1 3.96Å; K743-F808 HydrophobicContact CD-CG 4.31Å; K743-F808 HydrophobicContact CG-CB 4.06Å; K743-F808 HydrophobicContact CG-CD1 3.79Å; K743-F808 HydrophobicContact CG-CE1 4.49Å; K743-F808 HydrophobicContact CG-CG 4.03Å; K743-F808 PolarHBondContact NZ-O 3.31Å; I800-F808 HydrophobicContact CG2-CE2 3.97Å; Y804-F808 AromaticContact CD2-CD2 3.26Å; Y804-F808 HydrophobicContact CD2-CD2 3.26Å; Y804-F808 AromaticContact CD2-CE2 3.69Å; Y804-F808 HydrophobicContact CD2-CE2 3.69Å; Y804-F808 HydrophobicContact CD2-CG 4.17Å; Y804-F808 HydrophobicContact CE2-CB 4.15Å; Y804-F808 AromaticContact CE2-CD2 3.43Å; Y804-F808 HydrophobicContact CE2-CD2 3.43Å; Y804-F808 VanDerWaalsContact CE2-CD2 3.43Å; Y804-F808 AromaticContact CE2-CE2 3.98Å; Y804-F808 HydrophobicContact CE2-CE2 3.98Å; Y804-F808 AromaticContact CE2-CG 3.9Å; Y804-F808 HydrophobicContact CE2-CG 3.9Å; Y804-F808 HydrophobicContact CG-CD2 4.18Å; Y804-F808 WeakPolarHBondContact O-CD2 3.27Å; Y804-F808 PolarHBondContact O-N 2.61Å
809	Y	84.8	Confident	90.8	Very high	153 Å²	153	53.4 Å²	53.4	60%	0.6	27%	0.272	S	S	*	.	H	α-helix	trans	-137.1	19.5	-179.8	-59.6	-100.3	0	0	0	114	K743 Y804 S805	K743-Y809 VanDerWaalsContact CE-CZ 3.42Å; Y804-Y809 HydrophobicContact CE1-CD2 4.48Å; Y804-Y809 AromaticContact CE1-CE2 3.71Å; Y804-Y809 HydrophobicContact CE1-CE2 3.71Å; Y804-Y809 AromaticContact CZ-CE2 3.79Å; Y804-Y809 PolarHBondContact OH-OH 2.79Å; S805-Y809 WeakPolarHBondContact O-CB 3.2Å; S805-Y809 PolarHBondContact O-N 3Å
810	S	58.5	Low	90.2	Very high	128 Å²	128	56.3 Å²	56.3	90%	0.895	29%	0.288	S	S	*	.			trans	-79.4	0	167.3	-174.4	0	0	0	0	112.9	R806	R806-S810 WeakPolarHBondContact O-CB 3.49Å

Retrieved 810 of 810 residues in 2296 ms (Link to these results)

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