A0A087YM12_POEFO Loading...

Wu:fj64h06

AlphaFold DB , UniProt , Accession A0A087YM12, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 781 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	E	39.2	Very low	34	Very low	194 Å²	194	150.5 Å²	150.5	91%	0.907	73%	0.727	S	S	*	*				0	-56.3	0	-66.1	-167.3	175	0	0	114.4	D4	E1-D4 PolarHBondContact N-OD2 2.82Å
2	L	32.9	Very low	35	Very low	153 Å²	153	150.5 Å²	150.5	80%	0.801	72%	0.721	S	S	*	*			trans	-88.1	-5.2	171.8	-89.9	161	0	0	0	114.9
3	Q	30.2	Very low	36.4	Very low	170 Å²	170	153.3 Å²	153.3	79%	0.794	72%	0.72	S	S	*	*	S	Bend	trans	-98.5	-15.5	175.1	-153.8	156.1	-4.5	0	0	112.3
4	D	31.9	Very low	38.1	Very low	105 Å²	105	152.9 Å²	152.9	56%	0.561	72%	0.718	S	S	*	*	S	Bend	trans	-87.5	-17.8	175.7	-53.9	-59.7	0	0	0	112.2	E1	E1-D4 PolarHBondContact N-OD2 2.82Å
5	Q	29.8	Very low	39.9	Very low	127 Å²	127	145 Å²	145	59%	0.593	69%	0.686	S	S	*	*	S	Bend	trans	-87.2	-5.9	178.4	-71.3	-168	-11.2	0	0	114.3
6	L	31.7	Very low	42.1	Very low	153 Å²	153	144.4 Å²	144.4	80%	0.801	68%	0.681	S	S	*	*	S	Bend	trans	-92.1	-12.7	173.3	-104.6	146.1	0	0	0	112.8
7	E	33.2	Very low	44.4	Very low	162 Å²	162	145.7 Å²	145.7	76%	0.757	68%	0.677	S	S	*	*	S	Bend	trans	-83.9	-14.5	171.5	-71.9	-170.4	159.9	0	0	113	H9	E7-H9 PolarHBondContact O-N 2.98Å
8	E	31.2	Very low	46.5	Very low	150 Å²	150	143.7 Å²	143.7	70%	0.701	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-5.2	-176.8	-81.8	-172	145.8	0	0	115.4
9	H	35.2	Very low	47.8	Very low	147 Å²	147	143.9 Å²	143.9	68%	0.681	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.4	35.3	178.9	-77.7	-66.3	0	0	0	114.1	E7 H11	E7-H9 PolarHBondContact O-N 2.98Å; H9-H11 VanDerWaalsContact C-N 3.25Å; H9-H11 PolarHBondContact O-N 3.43Å
10	M	36.3	Very low	49	Very low	144 Å²	144	139.1 Å²	139.1	71%	0.709	67%	0.67	S	S	*	*			trans	-66.3	95.1	152.7	-103.8	-175	63.6	0	0	107.4	K12	M10-K12 VanDerWaalsContact C-N 3.31Å; M10-K12 PolarHBondContact O-N 3.42Å
11	H	42.3	Very low	50.2	Low	150 Å²	150	134.1 Å²	134.1	69%	0.694	66%	0.655	S	S	*	*			trans	-52.9	100.8	166.9	-74.2	-72.8	0	0	0	107.9	H9 W13	H9-H11 VanDerWaalsContact C-N 3.25Å; H9-H11 PolarHBondContact O-N 3.43Å; H11-W13 PolarHBondContact O-N 2.69Å
12	K	45.5	Very low	52.2	Low	151 Å²	151	126.2 Å²	126.2	66%	0.657	62%	0.619	S	S	*	*			trans	-71.5	103	176.7	-167.5	-178.6	-178.9	-168.4	0	106.6	M10 E14	M10-K12 VanDerWaalsContact C-N 3.31Å; M10-K12 PolarHBondContact O-N 3.42Å; K12-E14 PolarHBondContact O-N 3.45Å; K12-E14 VanDerWaalsContact O-N 3.08Å
13	W	53.8	Low	54.6	Low	187 Å²	187	122.7 Å²	122.7	71%	0.708	60%	0.603	S	S	*	*			trans	-69.9	103.4	175.3	-75.1	82.3	0	0	0	108.2	H11 V416	H11-W13 PolarHBondContact O-N 2.69Å; W13-V416 HydrophobicContact CD2-CG1 4.4Å; W13-V416 HydrophobicContact CG-CG1 4.22Å
14	E	59.5	Low	57.2	Low	147 Å²	147	114.7 Å²	114.7	69%	0.687	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-86.2	123	174.2	-66.5	-168.2	162	0	0	109.9	K12 K16	K12-E14 PolarHBondContact O-N 3.45Å; K12-E14 VanDerWaalsContact O-N 3.08Å; E14-K16 PolarHBondContact O-N 3.48Å
15	S	66.5	Low	59.7	Low	35 Å²	35	117.3 Å²	117.3	25%	0.245	57%	0.568	C	S	.	*	P	Polyproline II helix	trans	-55.6	120.2	174	177.4	0	0	0	0	109.7	R17 L419	S15-R17 PolarHBondContact O-N 2.79Å; S15-L419 WeakPolarHBondContact OG-CD2 3.37Å
16	K	75.1	Confident	62.4	Low	136 Å²	136	114.1 Å²	114.1	59%	0.591	55%	0.553	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-66.9	119.6	174.7	-72.6	-174	178.8	-179.2	0	109.5	E14 A467 C469 S470	E14-K16 PolarHBondContact O-N 3.48Å; K16-A467 HydrophobicContact CD-CB 4.47Å; K16-C469 HydrophobicContact CB-CB 4.04Å; K16-C469 WeakPolarHBondContact O-CA 3.44Å; K16-S470 PolarHBondContact O-N 3.01Å; K16-S470 PolarHBondContact O-OG 2.99Å
17	R	81	Confident	64.9	Low	166 Å²	166	111.5 Å²	111.5	63%	0.626	54%	0.538	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.2	126.7	176.5	-56.2	-168	172.2	176.5	-3.4	109.9	S15 K420 S470	S15-R17 PolarHBondContact O-N 2.79Å; R17-K420 PolarHBondContact NH2-O 3.21Å; R17-S470 WeakPolarHBondContact CA-OG 3.49Å; R17-S470 WeakPolarHBondContact CG-OG 3.16Å
18	Q	81.2	Confident	67.2	Low	110 Å²	110	105.9 Å²	105.9	51%	0.514	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	127.3	171.1	-169.9	165.7	2.8	0	0	109.1	G20 S470 H471 G472	Q18-G20 VanDerWaalsContact C-N 3.29Å; Q18-G20 PolarHBondContact O-N 3.44Å; Q18-S470 PolarHBondContact N-O 3.17Å; Q18-H471 PolarHBondContact OE1-CE1 3.19Å; Q18-G472 PolarHBondContact O-N 2.95Å
19	V	72.5	Confident	69.7	Low	148 Å²	148	100.2 Å²	100.2	90%	0.897	49%	0.487	S	S	*	.	S	Bend	trans	-67.5	-33.3	-177.4	-178.5	0	0	0	0	111.3
20	G	71.1	Confident	72.2	Confident	46 Å²	46	93.3 Å²	93.3	47%	0.474	46%	0.456	S	S	.	.			trans	-75.7	136.5	171.9	0	0	0	0	0	111.5	Q18 G472	Q18-G20 VanDerWaalsContact C-N 3.29Å; Q18-G20 PolarHBondContact O-N 3.44Å; G20-G472 PolarHBondContact O-N 3.24Å
21	G	73.8	Confident	74.7	Confident	35 Å²	35	86.7 Å²	86.7	36%	0.361	42%	0.423	S	S	.	.			trans	-151.8	167.9	173	0	0	0	0	0	110.3	V23	G21-V23 PolarHBondContact O-N 3.11Å
22	E	81.6	Confident	76.9	Confident	29 Å²	29	79.8 Å²	79.8	14%	0.136	39%	0.392	C	S	.	.			trans	-69.3	131.2	177.1	-61.6	-176.2	158.7	0	0	109.6	W24 S440 T442 K444 Q459 R540	E22-W24 WeakPolarHBondContact OE2-CZ2 3.39Å; E22-W24 PolarHBondContact OE2-NE1 3.02Å; E22-S440 VanDerWaalsContact OE1-CB 3.23Å; E22-S440 WeakPolarHBondContact OE1-CB 3.39Å; E22-S440 PolarHBondContact OE1-OG 3.02Å; E22-T442 PolarHBondContact OE1-OG1 3.29Å; E22-T442 VanDerWaalsContact OE1-OG1 3.09Å; E22-T442 PolarHBondContact OE2-OG1 2.99Å; E22-K444 WeakPolarHBondContact OE2-CE 3.21Å; E22-K444 IonicContact OE2-NZ 3.23Å; E22-K444 PolarHBondContact OE2-NZ 2.84Å; E22-Q459 PolarHBondContact O-NE2 3.42Å; E22-Q459 PolarHBondContact O-OE1 2.73Å; E22-R540 HydrophobicContact CB-CG 4.45Å; E22-R540 IonicContact OE1-NH1 3.42Å
23	V	83.1	Confident	78.9	Confident	79 Å²	79	73.1 Å²	73.1	48%	0.479	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	120.3	175.7	-178.5	0	0	0	0	108.9	G21 R25 D541	G21-V23 PolarHBondContact O-N 3.11Å; V23-R25 HydrophobicContact CG1-CG 4.36Å; V23-D541 HydrophobicContact CB-CB 4.33Å; V23-D541 PolarHBondContact O-N 3.36Å
24	W	84.8	Confident	80.3	Confident	2 Å²	2	65.4 Å²	65.4	1%	0.008	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	108.6	179.1	-71.3	82.4	0	0	0	109.7	E22 K444 L457 Q475 A520 M522 L538 E539 R540	E22-W24 WeakPolarHBondContact OE2-CZ2 3.39Å; E22-W24 PolarHBondContact OE2-NE1 3.02Å; W24-K444 HydrophobicContact CZ2-CD 3.99Å; W24-L457 HydrophobicContact CB-CD2 4.23Å; W24-L457 HydrophobicContact CG-CD2 4.02Å; W24-Q475 PolarHBondContact O-NE2 3.44Å; W24-A520 HydrophobicContact CH2-CB 3.78Å; W24-A520 WeakPolarHBondContact CZ3-O 3.39Å; W24-M522 HydrophobicContact CE3-CB 4.11Å; W24-M522 HydrophobicContact CZ3-CB 3.8Å; W24-L538 HydrophobicContact CB-CB 4.3Å; W24-L538 HydrophobicContact CE3-CB 3.86Å; W24-E539 CarbonylContact C-O 3.55Å; W24-E539 WeakPolarHBondContact CA-O 3.48Å; W24-R540 HydrophobicContact CD2-CB 4.41Å; W24-R540 HydrophobicContact CE3-CB 4.25Å; W24-R540 HydrophobicContact CH2-CB 3.77Å; W24-R540 HydrophobicContact CH2-CG 4.37Å; W24-R540 HydrophobicContact CZ2-CB 3.84Å; W24-R540 HydrophobicContact CZ2-CG 3.93Å; W24-R540 HydrophobicContact CZ3-CB 3.97Å
25	R	85.5	Confident	81.3	Confident	159 Å²	159	59.7 Å²	59.7	60%	0.6	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	136.6	-179.7	-66.1	-173.2	-174.1	-149.4	5.6	110.6	V23 L538 E539 D541	V23-R25 HydrophobicContact CG1-CG 4.36Å; R25-L538 CarbonylContact O-C 3.52Å; R25-L538 WeakPolarHBondContact O-CA 3.19Å; R25-E539 PolarHBondContact N-O 3.11Å; R25-E539 PolarHBondContact O-N 3.02Å; R25-D541 HydrophobicContact CG-CB 4.2Å; R25-D541 IonicContact CZ-OD2 3.06Å; R25-D541 IonicContact NE-OD2 2.78Å; R25-D541 PolarHBondContact NE-OD2 3.14Å; R25-D541 IonicContact NH2-OD2 2.68Å; R25-D541 PolarHBondContact NH2-OD2 3.13Å
26	Q	86.1	Confident	81.5	Confident	60 Å²	60	60.5 Å²	60.5	28%	0.28	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	134.1	174.3	-71.1	160.9	-2.1	0	0	110.1	L538	Q26-L538 HydrophobicContact CB-CD2 4.34Å; Q26-L538 HydrophobicContact CG-CD2 3.33Å
27	M	83.3	Confident	81.3	Confident	98 Å²	98	54.2 Å²	54.2	48%	0.483	29%	0.289	S	S	.	.	S	Bend	trans	-73	-33.3	177.3	-74	-65	-80.3	0	0	112.9	I537 E539	M27-I537 HydrophobicContact CB-CB 4.32Å; M27-I537 HydrophobicContact CG-CB 4.32Å; M27-I537 HydrophobicContact CG-CG2 4.03Å; M27-I537 PolarHBondContact N-O 2.9Å; M27-E539 HydrophobicContact CG-CG 3.69Å; M27-E539 HydrophobicContact SD-CB 4.49Å; M27-E539 HydrophobicContact SD-CG 3.71Å; M27-E539 VanDerWaalsContact SD-OE2 3.39Å
28	E	82.4	Confident	80.5	Confident	44 Å²	44	50.2 Å²	50.2	21%	0.206	27%	0.274	C	S	.	.	S	Bend	trans	-122	142.9	-178.8	-68.3	-75.9	169.3	0	0	109.3	V30 V32 S606 T609	E28-V30 PolarHBondContact O-N 3.43Å; E28-V30 VanDerWaalsContact O-N 3.14Å; E28-V32 HydrophobicContact CG-CG2 4.44Å; E28-S606 VanDerWaalsContact CD-OG 3.3Å; E28-S606 WeakPolarHBondContact OE1-CB 3.22Å; E28-S606 PolarHBondContact OE1-OG 2.88Å; E28-S606 PolarHBondContact OE2-N 3Å; E28-S606 PolarHBondContact OE2-OG 3.34Å; E28-T609 PolarHBondContact OE1-OG1 3.24Å; E28-T609 WeakPolarHBondContact OE2-CB 3.46Å; E28-T609 PolarHBondContact OE2-OG1 3.12Å
29	P	83.9	Confident	79	Confident	31 Å²	31	48.4 Å²	48.4	20%	0.201	27%	0.273	C	S	.	.	S	Bend	trans	-73.8	-0.5	179.3	31.9	-36.6	0	0	0	113.2	L478 L486 L605	P29-L478 WeakPolarHBondContact O-CD1 3.42Å; P29-L486 HydrophobicContact CB-CD1 4.39Å; P29-L605 HydrophobicContact CG-CD2 4.47Å; P29-L605 HydrophobicContact CG-CG 4.05Å
30	V	87.6	Confident	77.6	Confident	3 Å²	3	44 Å²	44	2%	0.018	24%	0.242	C	C	.	.	S	Bend	trans	-145.1	140.3	-175.5	-179.3	0	0	0	0	110.6	E28 V32 L486 L605 W613	E28-V30 PolarHBondContact O-N 3.43Å; E28-V30 VanDerWaalsContact O-N 3.14Å; V30-V32 PolarHBondContact O-N 3.19Å; V30-L486 HydrophobicContact CG2-CB 3.88Å; V30-L486 HydrophobicContact CG2-CD1 3.47Å; V30-L486 VanDerWaalsContact CG2-CD1 3.47Å; V30-L486 HydrophobicContact CG2-CG 4.3Å; V30-L605 HydrophobicContact CB-CD2 4.12Å; V30-L605 HydrophobicContact CG2-CD2 3.88Å; V30-W613 HydrophobicContact CG1-CZ2 3.94Å
31	P	88.2	Confident	75.8	Confident	4 Å²	4	46.4 Å²	46.4	3%	0.026	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-59.9	135.4	169.3	-22.7	34.5	0	0	0	111.8	L478 F534 W613	P31-L478 HydrophobicContact CG-CB 3.72Å; P31-F534 HydrophobicContact CB-CB 4.11Å; P31-W613 VanDerWaalsContact O-CZ2 3.27Å; P31-W613 WeakPolarHBondContact O-CZ2 3.34Å; P31-W613 PolarHBondContact O-NE1 2.83Å
32	V	87.9	Confident	74	Confident	6 Å²	6	45.9 Å²	45.9	4%	0.036	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	131.1	-175.3	-171.4	0	0	0	0	109.8	E28 V30 L34 F534 Y535 T609 A612	E28-V32 HydrophobicContact CG-CG2 4.44Å; V30-V32 PolarHBondContact O-N 3.19Å; V32-L34 PolarHBondContact O-N 2.85Å; V32-F534 CarbonylContact O-C 3.38Å; V32-F534 WeakPolarHBondContact O-CA 3.47Å; V32-Y535 HydrophobicContact CB-CD1 4.09Å; V32-Y535 HydrophobicContact CB-CE1 3.57Å; V32-Y535 HydrophobicContact CB-CE2 4.16Å; V32-Y535 HydrophobicContact CG1-CE1 3.66Å; V32-Y535 WeakPolarHBondContact CG1-OH 3.42Å; V32-Y535 PolarHBondContact N-O 2.76Å; V32-Y535 WeakPolarHBondContact O-CD1 3.33Å; V32-Y535 PolarHBondContact O-N 3.02Å; V32-T609 HydrophobicContact CG2-CG2 3.89Å; V32-A612 HydrophobicContact CG1-CB 3.84Å
33	P	88.6	Confident	71.8	Confident	11 Å²	11	47.8 Å²	47.8	7%	0.071	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	121.7	175	26	-32.2	0	0	0	110.1	F534 A612 W613 W616	P33-F534 HydrophobicContact CB-CD1 4.09Å; P33-F534 HydrophobicContact CB-CE1 3.9Å; P33-A612 HydrophobicContact CG-CB 4.25Å; P33-W613 HydrophobicContact CG-CD2 4.15Å; P33-W613 HydrophobicContact CG-CG 4.33Å; P33-W616 HydrophobicContact CB-CB 4.32Å; P33-W616 HydrophobicContact CB-CG 4.1Å; P33-W616 HydrophobicContact CG-CB 4.02Å; P33-W616 HydrophobicContact CG-CG 4.26Å
34	L	83.8	Confident	69.3	Low	24 Å²	24	47.9 Å²	47.9	13%	0.126	26%	0.255	C	S	.	.			trans	-76.6	-47	177.9	-174.3	63.6	0	0	0	111.2	V32 L197 M223 T225 L525 V533 Y535	V32-L34 PolarHBondContact O-N 2.85Å; L34-L197 HydrophobicContact CD2-CD2 3.92Å; L34-M223 HydrophobicContact CD1-CB 3.82Å; L34-M223 HydrophobicContact CD1-SD 4.37Å; L34-M223 HydrophobicContact CD2-SD 4.29Å; L34-T225 HydrophobicContact CD1-CG2 3.9Å; L34-T225 HydrophobicContact CD2-CG2 4.33Å; L34-T225 HydrophobicContact CG-CG2 4.12Å; L34-L525 HydrophobicContact CD2-CD2 3.96Å; L34-V533 HydrophobicContact CB-CB 4.43Å; L34-V533 HydrophobicContact CB-CG1 4.27Å; L34-V533 HydrophobicContact CD2-CG1 4.11Å; L34-V533 PolarHBondContact N-O 3.4Å; L34-Y535 HydrophobicContact CB-CD1 3.83Å; L34-Y535 HydrophobicContact CB-CE1 4.3Å; L34-Y535 HydrophobicContact CD1-CD1 3.99Å; L34-Y535 HydrophobicContact CD1-CE1 4.02Å; L34-Y535 HydrophobicContact CG-CD1 4.48Å
35	L	80.1	Confident	66.8	Low	28 Å²	28	50 Å²	50	15%	0.147	27%	0.273	C	S	.	.	S	Bend	trans	-108.2	155.3	-175.6	-60.8	177	0	0	0	110.7	Y199 V533	L35-Y199 HydrophobicContact CD1-CD2 4.28Å; L35-Y199 HydrophobicContact CD1-CE1 4.27Å; L35-Y199 HydrophobicContact CD1-CE2 3.63Å; L35-V533 HydrophobicContact CD1-CB 4.4Å; L35-V533 HydrophobicContact CD1-CG2 4.13Å
36	S	70.1	Confident	64.3	Low	52 Å²	52	44.5 Å²	44.5	36%	0.364	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-67.6	145.4	170.5	-63.7	0	0	0	0	110.7	R38 K619	S36-R38 PolarHBondContact O-N 3.2Å; S36-K619 WeakPolarHBondContact OG-CD 3.24Å; S36-K619 PolarHBondContact OG-NZ 2.86Å
37	P	70.1	Confident	62	Low	3 Å²	3	45.5 Å²	45.5	2%	0.019	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-61.5	130.8	178.1	21.8	-22	0	0	0	108.6	D532 W616 K619 L620	P37-D532 WeakPolarHBondContact CA-OD1 3.19Å; P37-W616 HydrophobicContact CB-CD2 4.43Å; P37-W616 HydrophobicContact CB-CZ2 4.25Å; P37-W616 HydrophobicContact CG-CD2 4.07Å; P37-W616 HydrophobicContact CG-CG 3.91Å; P37-W616 VanDerWaalsContact CG-O 3.23Å; P37-W616 WeakPolarHBondContact CG-O 3.29Å; P37-K619 HydrophobicContact CG-CB 3.93Å; P37-L620 HydrophobicContact CB-CD1 4.37Å; P37-L620 HydrophobicContact CG-CB 4.15Å
38	R	65	Low	59.8	Low	82 Å²	82	46.3 Å²	46.3	31%	0.309	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-81.4	148.5	-174.5	-69.4	-164.4	170.9	-167.7	-0.8	111.1	S36 F40	S36-R38 PolarHBondContact O-N 3.2Å; R38-F40 PolarHBondContact O-N 2.74Å; R38-F40 VanDerWaalsContact O-N 3.15Å
39	C	49.1	Very low	57.5	Low	72 Å²	72	51.7 Å²	51.7	49%	0.486	29%	0.293	S	S	.	.			trans	-52.6	115.9	-177.2	-73.4	0	0	0	0	112.4	C41 L203 Q623	C39-C41 VanDerWaalsContact C-N 3.32Å; C39-L203 VanDerWaalsContact O-CD2 3.29Å; C39-L203 WeakPolarHBondContact O-CD2 3.49Å; C39-Q623 VanDerWaalsContact CA-OE1 3.26Å; C39-Q623 PolarHBondContact SG-NE2 3.21Å
40	F	44.7	Very low	55.5	Low	57 Å²	57	53.6 Å²	53.6	25%	0.25	30%	0.301	C	S	.	.			trans	-98.6	53.2	160.3	-122.6	-97.4	0	0	0	109.1	R38 G42 F43 F47 L203	R38-F40 PolarHBondContact O-N 2.74Å; R38-F40 VanDerWaalsContact O-N 3.15Å; F40-G42 PolarHBondContact O-N 3.41Å; F40-F43 HydrophobicContact CD1-CB 3.72Å; F40-F43 VanDerWaalsContact CD1-O 3.25Å; F40-F43 WeakPolarHBondContact CD1-O 3.46Å; F40-F43 HydrophobicContact CE1-CB 3.44Å; F40-F43 VanDerWaalsContact CE1-CB 3.44Å; F40-F43 VanDerWaalsContact CE1-O 3.3Å; F40-F43 WeakPolarHBondContact CE1-O 3.02Å; F40-F47 AromaticContact CE1-CD2 3.67Å; F40-F47 HydrophobicContact CE1-CD2 3.67Å; F40-F47 HydrophobicContact CE1-CE2 4.14Å; F40-F47 HydrophobicContact CE2-CD2 4.48Å; F40-F47 HydrophobicContact CE2-CE2 4.34Å; F40-F47 AromaticContact CZ-CD2 3.46Å; F40-F47 HydrophobicContact CZ-CD2 3.46Å; F40-F47 VanDerWaalsContact CZ-CD2 3.46Å; F40-F47 AromaticContact CZ-CE2 3.47Å; F40-F47 HydrophobicContact CZ-CE2 3.47Å; F40-F47 VanDerWaalsContact CZ-CE2 3.47Å; F40-L203 HydrophobicContact CD2-CD2 4.41Å
41	C	31.7	Very low	53.3	Low	95 Å²	95	58.2 Å²	58.2	64%	0.642	33%	0.329	S	S	*	.			trans	-76	92.2	176.2	51.3	0	0	0	0	109.2	C39	C39-C41 VanDerWaalsContact C-N 3.32Å
42	G	35.9	Very low	51.3	Low	25 Å²	25	63.5 Å²	63.5	26%	0.258	36%	0.361	S	S	.	.	S	Bend	trans	133	-16.3	168	0	0	0	0	0	116	F40 P44 P631	F40-G42 PolarHBondContact O-N 3.41Å; G42-P44 WeakPolarHBondContact O-CD 3.33Å; G42-P631 WeakPolarHBondContact O-CD 3.19Å; G42-P631 WeakPolarHBondContact O-CG 3.33Å
43	F	36	Very low	49.6	Very low	68 Å²	68	64.2 Å²	64.2	30%	0.298	37%	0.366	S	S	.	.			trans	-121.3	58.4	-177.4	-78.6	-85	0	0	0	114.2	F40 A45 A46 L633	F40-F43 HydrophobicContact CD1-CB 3.72Å; F40-F43 VanDerWaalsContact CD1-O 3.25Å; F40-F43 WeakPolarHBondContact CD1-O 3.46Å; F40-F43 HydrophobicContact CE1-CB 3.44Å; F40-F43 VanDerWaalsContact CE1-CB 3.44Å; F40-F43 VanDerWaalsContact CE1-O 3.3Å; F40-F43 WeakPolarHBondContact CE1-O 3.02Å; F43-A45 PolarHBondContact O-N 2.95Å; F43-A46 HydrophobicContact CB-CB 4.32Å; F43-A46 HydrophobicContact CD1-CB 3.56Å; F43-A46 HydrophobicContact CE1-CB 4.27Å; F43-A46 HydrophobicContact CG-CB 4.35Å; F43-L633 HydrophobicContact CE1-CD1 3.29Å; F43-L633 HydrophobicContact CZ-CD1 3.34Å
44	P	31.2	Very low	47.9	Very low	82 Å²	82	65.5 Å²	65.5	53%	0.532	38%	0.375	S	S	.	.	S	Bend	trans	-56.2	-41.1	162.9	-16.8	29.3	0	0	0	110.2	G42 Q48	G42-P44 WeakPolarHBondContact O-CD 3.33Å; P44-Q48 VanDerWaalsContact O-CB 3.26Å; P44-Q48 WeakPolarHBondContact O-CB 3.43Å; P44-Q48 PolarHBondContact O-N 3.41Å; P44-Q48 PolarHBondContact O-OE1 3.37Å
45	A	32.2	Very low	46.6	Very low	46 Å²	46	66.3 Å²	66.3	38%	0.38	38%	0.379	S	S	.	.	H	α-helix	trans	-72.4	-36.5	-170.1	0	0	0	0	0	115.8	F43 F47 Q48 E49	F43-A45 PolarHBondContact O-N 2.95Å; A45-F47 PolarHBondContact O-N 3.4Å; A45-Q48 PolarHBondContact O-N 2.82Å; A45-E49 PolarHBondContact O-N 3.35Å; A45-E49 VanDerWaalsContact O-N 3.08Å
46	A	33.3	Very low	45.5	Very low	43 Å²	43	65.1 Å²	65.1	36%	0.355	37%	0.373	S	S	.	.	H	α-helix	trans	-74.1	-10	-175.1	0	0	0	0	0	114	F43 L50	F43-A46 HydrophobicContact CB-CB 4.32Å; F43-A46 HydrophobicContact CD1-CB 3.56Å; F43-A46 HydrophobicContact CE1-CB 4.27Å; F43-A46 HydrophobicContact CG-CB 4.35Å; A46-L50 WeakPolarHBondContact O-CD1 3.37Å
47	F	36.6	Very low	44.8	Very low	81 Å²	81	66.4 Å²	66.4	36%	0.355	38%	0.375	S	S	.	.	H	α-helix	trans	-110.9	-35.2	168.3	-84.5	-87.1	0	0	0	111	F40 A45 E49 L50 H500	F40-F47 AromaticContact CE1-CD2 3.67Å; F40-F47 HydrophobicContact CE1-CD2 3.67Å; F40-F47 HydrophobicContact CE1-CE2 4.14Å; F40-F47 HydrophobicContact CE2-CD2 4.48Å; F40-F47 HydrophobicContact CE2-CE2 4.34Å; F40-F47 AromaticContact CZ-CD2 3.46Å; F40-F47 HydrophobicContact CZ-CD2 3.46Å; F40-F47 VanDerWaalsContact CZ-CD2 3.46Å; F40-F47 AromaticContact CZ-CE2 3.47Å; F40-F47 HydrophobicContact CZ-CE2 3.47Å; F40-F47 VanDerWaalsContact CZ-CE2 3.47Å; A45-F47 PolarHBondContact O-N 3.4Å; F47-E49 VanDerWaalsContact C-N 3.34Å; F47-E49 PolarHBondContact O-N 3.15Å; F47-L50 PolarHBondContact O-N 3.45Å; F47-L50 VanDerWaalsContact O-N 3.15Å; F47-H500 VanDerWaalsContact C-NE2 3.35Å; F47-H500 PolarHBondContact O-CE1 2.95Å; F47-H500 PolarHBondContact O-NE2 3.14Å
48	Q	37	Very low	44	Very low	116 Å²	116	69 Å²	69	54%	0.542	39%	0.389	S	S	.	.	H	α-helix	trans	-64.4	-29	178	-104.3	155.5	-19.8	0	0	115.2	P44 A45 H500	P44-Q48 VanDerWaalsContact O-CB 3.26Å; P44-Q48 WeakPolarHBondContact O-CB 3.43Å; P44-Q48 PolarHBondContact O-N 3.41Å; P44-Q48 PolarHBondContact O-OE1 3.37Å; A45-Q48 PolarHBondContact O-N 2.82Å; Q48-H500 WeakPolarHBondContact CA-NE2 3.45Å
49	E	34.8	Very low	43.3	Very low	157 Å²	157	67.4 Å²	67.4	73%	0.734	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-1.7	176.4	-70.9	-171.7	160.8	0	0	113.6	A45 F47	A45-E49 PolarHBondContact O-N 3.35Å; A45-E49 VanDerWaalsContact O-N 3.08Å; F47-E49 VanDerWaalsContact C-N 3.34Å; F47-E49 PolarHBondContact O-N 3.15Å
50	L	40.9	Very low	43.1	Very low	71 Å²	71	69.8 Å²	69.8	37%	0.372	39%	0.391	S	S	.	.			trans	-104.8	7.6	-176	-97.2	118	0	0	0	114.8	A46 F47 T52 M174	A46-L50 WeakPolarHBondContact O-CD1 3.37Å; F47-L50 PolarHBondContact O-N 3.45Å; F47-L50 VanDerWaalsContact O-N 3.15Å; L50-T52 PolarHBondContact O-N 2.87Å; L50-M174 HydrophobicContact CD2-CE 3.79Å; L50-M174 HydrophobicContact CD2-CG 4.4Å; L50-M174 HydrophobicContact CD2-SD 3.84Å
51	V	42.7	Very low	43	Very low	100 Å²	100	74.1 Å²	74.1	61%	0.606	41%	0.41	S	S	*	.	S	Bend	trans	-68.5	-24.9	174.2	-175	0	0	0	0	111.4	H500	V51-H500 VanDerWaalsContact CG2-CD2 3.41Å; V51-H500 WeakPolarHBondContact CG2-CD2 3.37Å; V51-H500 WeakPolarHBondContact CG2-NE2 3.31Å
52	T	46.4	Very low	43.4	Very low	114 Å²	114	72.2 Å²	72.2	70%	0.699	39%	0.392	S	S	*	.	S	Bend	trans	-155.4	111.4	167.5	9.5	0	0	0	0	108.1	L50	L50-T52 PolarHBondContact O-N 2.87Å
53	P	50.6	Low	43.5	Very low	22 Å²	22	75.5 Å²	75.5	14%	0.143	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-59.8	143.7	167.8	30.2	-34.3	0	0	0	107.4	D55 R171 M174	P53-D55 PolarHBondContact O-N 3.09Å; P53-R171 HydrophobicContact CG-CB 4.18Å; P53-M174 HydrophobicContact CB-CE 3.73Å; P53-M174 HydrophobicContact CG-CE 3.31Å; P53-M174 HydrophobicContact CG-SD 4.27Å
54	P	54.8	Low	43.5	Very low	38 Å²	38	81.4 Å²	81.4	25%	0.247	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-53.7	145	171.6	18.1	-25.2	0	0	0	109.7	P56 L167	P54-P56 WeakPolarHBondContact O-CD 3.29Å; P54-L167 HydrophobicContact CG-CD1 4.34Å; P54-L167 HydrophobicContact CG-CD2 4.27Å
55	D	56.4	Low	43.6	Very low	40 Å²	40	83.3 Å²	83.3	21%	0.214	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-65.1	125	-175.2	-171	1.4	0	0	0	109.6	P53 L57 D58 R171	P53-D55 PolarHBondContact O-N 3.09Å; D55-L57 PolarHBondContact O-N 3.32Å; D55-L57 PolarHBondContact OD1-N 3.36Å; D55-D58 HydrophobicContact CB-CB 4.32Å; D55-D58 VanDerWaalsContact O-CB 3.27Å; D55-D58 WeakPolarHBondContact O-CB 3.39Å; D55-D58 PolarHBondContact O-N 3.1Å; D55-R171 VanDerWaalsContact CA-NH2 3.26Å; D55-R171 IonicContact OD1-CZ 2.88Å; D55-R171 VanDerWaalsContact OD1-CZ 3.23Å; D55-R171 IonicContact OD1-NH1 3.68Å; D55-R171 PolarHBondContact OD1-NH1 2.88Å; D55-R171 IonicContact OD1-NH2 3.49Å; D55-R171 PolarHBondContact OD1-NH2 2.88Å
56	P	56.1	Low	43.5	Very low	3 Å²	3	89.7 Å²	89.7	2%	0.019	47%	0.474	C	S	.	.	G	3₁₀ helix	trans	-53.1	-24.1	168	-23.4	34.3	0	0	0	111.9	P54 F59 F164 L167	P54-P56 WeakPolarHBondContact O-CD 3.29Å; P56-F59 WeakPolarHBondContact O-CB 3.4Å; P56-F59 WeakPolarHBondContact O-CD2 3.22Å; P56-F59 PolarHBondContact O-N 2.81Å; P56-F164 HydrophobicContact CB-CD2 3.54Å; P56-F164 HydrophobicContact CB-CE2 3.28Å; P56-F164 HydrophobicContact CB-CG 4.47Å; P56-F164 HydrophobicContact CB-CZ 4.02Å; P56-F164 WeakPolarHBondContact O-CD2 3.34Å; P56-F164 VanDerWaalsContact O-CE2 3.24Å; P56-F164 WeakPolarHBondContact O-CE2 3.27Å; P56-L167 HydrophobicContact CG-CB 4.24Å
57	L	55	Low	43.4	Very low	79 Å²	79	95 Å²	95	41%	0.414	49%	0.493	S	S	.	.	G	3₁₀ helix	trans	-81.6	-13.8	173.9	-59.3	175.5	0	0	0	114.3	D55 F59 L60 K61	D55-L57 PolarHBondContact O-N 3.32Å; D55-L57 PolarHBondContact OD1-N 3.36Å; L57-F59 PolarHBondContact O-N 2.89Å; L57-L60 HydrophobicContact CD2-CD1 3.92Å; L57-L60 PolarHBondContact O-N 3.44Å; L57-K61 PolarHBondContact O-N 2.83Å
58	D	53.2	Low	43.6	Very low	59 Å²	59	98.9 Å²	98.9	32%	0.316	51%	0.505	S	S	.	.	G	3₁₀ helix	trans	-64.8	-15.3	167.7	-72.5	-25.6	0	0	0	111.1	D55 H62	D55-D58 HydrophobicContact CB-CB 4.32Å; D55-D58 VanDerWaalsContact O-CB 3.27Å; D55-D58 WeakPolarHBondContact O-CB 3.39Å; D55-D58 PolarHBondContact O-N 3.1Å; D58-H62 PolarHBondContact O-CD2 2.86Å
59	F	50.5	Low	43.7	Very low	47 Å²	47	97.6 Å²	97.6	21%	0.206	51%	0.51	C	S	.	.	G	3₁₀ helix	trans	-72.7	-32	170.4	-66.9	-97.5	0	0	0	112.8	P56 L57 L163 F164 L167	P56-F59 WeakPolarHBondContact O-CB 3.4Å; P56-F59 WeakPolarHBondContact O-CD2 3.22Å; P56-F59 PolarHBondContact O-N 2.81Å; L57-F59 PolarHBondContact O-N 2.89Å; F59-L163 HydrophobicContact CE1-CD2 3.8Å; F59-L163 HydrophobicContact CE1-CG 4.23Å; F59-L163 HydrophobicContact CZ-CD2 3.78Å; F59-L163 HydrophobicContact CZ-CG 3.95Å; F59-F164 HydrophobicContact CD2-CD2 4.45Å; F59-L167 HydrophobicContact CE2-CD1 3.42Å; F59-L167 VanDerWaalsContact CE2-CD1 3.42Å; F59-L167 HydrophobicContact CZ-CD1 3.43Å; F59-L167 VanDerWaalsContact CZ-CD1 3.43Å
60	L	44.5	Very low	44	Very low	122 Å²	122	92.8 Å²	92.8	64%	0.639	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-28.4	-172.6	-74.6	160.4	0	0	0	113.3	L57 H62	L57-L60 HydrophobicContact CD2-CD1 3.92Å; L57-L60 PolarHBondContact O-N 3.44Å; L60-H62 PolarHBondContact O-N 2.93Å
61	K	42.5	Very low	44	Very low	149 Å²	149	90.6 Å²	90.6	65%	0.648	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	7.5	-177.6	-69.8	178.3	-178.1	168.3	0	114.9	L57	L57-K61 PolarHBondContact O-N 2.83Å
62	H	41.6	Very low	44.4	Very low	54 Å²	54	91.2 Å²	91.2	25%	0.25	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	16.8	-177.7	-82.3	-42.7	0	0	0	115.1	D58 L60 E64 K66	D58-H62 PolarHBondContact O-CD2 2.86Å; L60-H62 PolarHBondContact O-N 2.93Å; H62-E64 PolarHBondContact O-N 2.86Å; H62-K66 PolarHBondContact CE1-O 3.42Å; H62-K66 PolarHBondContact ND1-O 3.32Å
63	S	36.7	Very low	44.8	Very low	95 Å²	95	88.7 Å²	88.7	66%	0.664	46%	0.462	S	S	*	.	S	Bend	trans	-71.6	109.4	165.1	60.3	0	0	0	0	109.9
64	E	37.5	Very low	45.4	Very low	192 Å²	192	90.5 Å²	90.5	90%	0.897	47%	0.469	S	S	*	.	S	Bend	trans	110.2	-17.6	148.7	-58	-170.1	153.2	0	0	121	H62	H62-E64 PolarHBondContact O-N 2.86Å
65	S	31.4	Very low	46	Very low	121 Å²	121	90.2 Å²	90.2	85%	0.846	47%	0.465	S	S	*	.	S	Bend	trans	-152.6	-17.9	-179	-175.8	0	0	0	0	118.9
66	K	30.8	Very low	46.3	Very low	180 Å²	180	92.2 Å²	92.2	78%	0.783	47%	0.473	S	S	*	.			trans	-131.3	51.5	-176.1	-128.6	174.3	-174.4	178.4	0	112.9	H62 R68	H62-K66 PolarHBondContact CE1-O 3.42Å; H62-K66 PolarHBondContact ND1-O 3.32Å; K66-R68 VanDerWaalsContact C-N 3.26Å; K66-R68 PolarHBondContact O-N 2.81Å
67	M	31.3	Very low	46.7	Very low	155 Å²	155	96 Å²	96	76%	0.764	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	44.8	-172.4	-169.5	-176.5	150	0	0	114.9
68	R	40	Very low	47.6	Very low	162 Å²	162	94.9 Å²	94.9	61%	0.611	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-145.4	-6.3	-174.6	-78.6	-162.7	178.3	159.9	1.8	121.2	K66	K66-R68 VanDerWaalsContact C-N 3.26Å; K66-R68 PolarHBondContact O-N 2.81Å
69	S	40.4	Very low	48.4	Very low	90 Å²	90	93.7 Å²	93.7	63%	0.629	48%	0.477	S	S	*	.	S	Bend	trans	-97.4	-37.7	-160.5	-150.9	0	0	0	0	118	V73	S69-V73 VanDerWaalsContact O-CG2 3.3Å; S69-V73 WeakPolarHBondContact O-CG2 3.41Å
70	C	40.2	Very low	49.2	Very low	55 Å²	55	97.9 Å²	97.9	37%	0.372	50%	0.498	S	S	.	.	S	Bend	trans	-133.8	-48.4	-172.5	-70.3	0	0	0	0	114.7	F72 V73 Q74	C70-F72 PolarHBondContact O-N 3.34Å; C70-V73 WeakPolarHBondContact O-CB 3.3Å; C70-V73 PolarHBondContact O-N 3.36Å; C70-V73 VanDerWaalsContact O-N 3.08Å; C70-Q74 PolarHBondContact O-N 3.2Å
71	S	42.4	Very low	50.4	Low	26 Å²	26	98 Å²	98	18%	0.182	50%	0.5	C	S	.	.	H	α-helix	trans	-63.2	-43	-178.7	63.4	0	0	0	0	112.8	V73 M75	S71-V73 PolarHBondContact O-N 3.34Å; S71-M75 PolarHBondContact O-N 3.4Å
72	F	49.8	Very low	51.8	Low	112 Å²	112	95.1 Å²	95.1	49%	0.491	49%	0.489	S	S	.	.	H	α-helix	trans	-62.8	-32.8	175	-167.6	-100.4	0	0	0	111.4	C70 Q76	C70-F72 PolarHBondContact O-N 3.34Å; F72-Q76 HydrophobicContact CD1-CB 4.41Å; F72-Q76 VanDerWaalsContact CD1-OE1 3.28Å; F72-Q76 HydrophobicContact CE1-CB 4.4Å; F72-Q76 HydrophobicContact CE1-CG 4.44Å; F72-Q76 WeakPolarHBondContact O-CA 3.47Å; F72-Q76 WeakPolarHBondContact O-CB 3.28Å; F72-Q76 PolarHBondContact O-N 2.88Å
73	V	54.1	Low	52.9	Low	62 Å²	62	93.7 Å²	93.7	38%	0.376	49%	0.488	S	S	.	.	H	α-helix	trans	-69.9	-42.9	-176.3	-179.1	0	0	0	0	111.4	S69 C70 S71 Q76 N77	S69-V73 VanDerWaalsContact O-CG2 3.3Å; S69-V73 WeakPolarHBondContact O-CG2 3.41Å; C70-V73 WeakPolarHBondContact O-CB 3.3Å; C70-V73 PolarHBondContact O-N 3.36Å; C70-V73 VanDerWaalsContact O-N 3.08Å; S71-V73 PolarHBondContact O-N 3.34Å; V73-Q76 PolarHBondContact O-N 2.6Å; V73-N77 PolarHBondContact O-N 2.98Å; V73-N77 PolarHBondContact O-ND2 2.99Å; V73-N77 PolarHBondContact O-OD1 2.72Å
74	Q	63.7	Low	54.3	Low	60 Å²	60	93.6 Å²	93.6	28%	0.28	49%	0.485	S	S	.	.	H	α-helix	trans	-71.7	-43.7	-179.6	-70.8	-174.7	-37.7	0	0	113	C70 Q76 N77 F78 L163	C70-Q74 PolarHBondContact O-N 3.2Å; Q74-Q76 VanDerWaalsContact C-N 3.3Å; Q74-Q76 PolarHBondContact O-N 2.91Å; Q74-N77 WeakPolarHBondContact O-CB 3.28Å; Q74-N77 PolarHBondContact O-N 2.9Å; Q74-F78 PolarHBondContact O-N 2.97Å; Q74-F78 VanDerWaalsContact O-N 3.09Å; Q74-L163 HydrophobicContact CB-CD2 4.07Å
75	M	67.1	Low	56.1	Low	32 Å²	32	89 Å²	89	16%	0.158	47%	0.467	C	S	.	.	H	α-helix	trans	-65.6	-36.4	173.8	-66.7	178	73.2	0	0	111.4	S71 N77 F78 F79 P156 L159 L163	S71-M75 PolarHBondContact O-N 3.4Å; M75-N77 VanDerWaalsContact C-N 3.34Å; M75-F78 WeakPolarHBondContact O-CB 3.31Å; M75-F78 PolarHBondContact O-N 3.48Å; M75-F79 HydrophobicContact CB-CE2 4.19Å; M75-F79 HydrophobicContact CE-CZ 4.48Å; M75-F79 WeakPolarHBondContact O-CD2 3.48Å; M75-F79 VanDerWaalsContact O-CG 3.32Å; M75-F79 WeakPolarHBondContact O-CG 3.34Å; M75-F79 PolarHBondContact O-N 3.39Å; M75-P156 HydrophobicContact CE-CB 3.93Å; M75-P156 VanDerWaalsContact CE-O 3.29Å; M75-P156 WeakPolarHBondContact CE-O 3.37Å; M75-L159 HydrophobicContact CE-CB 4.32Å; M75-L159 HydrophobicContact CE-CD2 4.11Å; M75-L159 HydrophobicContact CE-CG 4.33Å; M75-L163 HydrophobicContact CG-CD2 4.07Å
76	Q	62.8	Low	58.1	Low	82 Å²	82	83.3 Å²	83.3	38%	0.383	43%	0.427	S	S	.	.	H	α-helix	trans	-66.1	-35.4	174.4	-175.8	173.3	19.7	0	0	112.2	F72 V73 Q74 F79 M80	F72-Q76 HydrophobicContact CD1-CB 4.41Å; F72-Q76 VanDerWaalsContact CD1-OE1 3.28Å; F72-Q76 HydrophobicContact CE1-CB 4.4Å; F72-Q76 HydrophobicContact CE1-CG 4.44Å; F72-Q76 WeakPolarHBondContact O-CA 3.47Å; F72-Q76 WeakPolarHBondContact O-CB 3.28Å; F72-Q76 PolarHBondContact O-N 2.88Å; V73-Q76 PolarHBondContact O-N 2.6Å; Q74-Q76 VanDerWaalsContact C-N 3.3Å; Q74-Q76 PolarHBondContact O-N 2.91Å; Q76-F79 PolarHBondContact O-N 2.8Å; Q76-M80 HydrophobicContact CG-CG 4.26Å; Q76-M80 VanDerWaalsContact O-CB 3.29Å; Q76-M80 WeakPolarHBondContact O-CB 3.41Å; Q76-M80 WeakPolarHBondContact O-CG 3.32Å; Q76-M80 PolarHBondContact O-N 2.95Å
77	N	66	Low	60.2	Low	82 Å²	82	77.5 Å²	77.5	44%	0.439	40%	0.402	S	S	.	.	H	α-helix	trans	-62.2	-44.8	171.8	-68.5	-14.7	0	0	0	110.5	V73 Q74 M75 F79 M80 D81	V73-N77 PolarHBondContact O-N 2.98Å; V73-N77 PolarHBondContact O-ND2 2.99Å; V73-N77 PolarHBondContact O-OD1 2.72Å; Q74-N77 WeakPolarHBondContact O-CB 3.28Å; Q74-N77 PolarHBondContact O-N 2.9Å; M75-N77 VanDerWaalsContact C-N 3.34Å; N77-F79 PolarHBondContact O-N 2.85Å; N77-M80 PolarHBondContact O-N 2.99Å; N77-M80 VanDerWaalsContact O-N 3.1Å; N77-D81 WeakPolarHBondContact O-CB 3.33Å; N77-D81 PolarHBondContact O-N 2.95Å
78	F	73	Confident	62.1	Low	56 Å²	56	70.8 Å²	70.8	25%	0.246	37%	0.372	C	S	.	.	H	α-helix	trans	-57.7	-48.9	173.1	176.1	-97.4	0	0	0	111.9	Q74 M75 M80 D81 H82 A86 L159	Q74-F78 PolarHBondContact O-N 2.97Å; Q74-F78 VanDerWaalsContact O-N 3.09Å; M75-F78 WeakPolarHBondContact O-CB 3.31Å; M75-F78 PolarHBondContact O-N 3.48Å; F78-M80 PolarHBondContact O-N 3.04Å; F78-D81 PolarHBondContact O-N 2.83Å; F78-H82 HydrophobicContact CD2-CB 3.99Å; F78-H82 AromaticContact CD2-CD2 3.94Å; F78-H82 HydrophobicContact CE2-CB 3.75Å; F78-H82 HydrophobicContact CZ-CB 4.12Å; F78-H82 CarbonylContact O-C 3.56Å; F78-H82 WeakPolarHBondContact O-CA 3.27Å; F78-H82 WeakPolarHBondContact O-CB 3.19Å; F78-H82 PolarHBondContact O-N 3.22Å; F78-A86 HydrophobicContact CD1-CB 4.47Å; F78-A86 HydrophobicContact CE1-CB 3.91Å; F78-L159 HydrophobicContact CB-CD2 4.45Å; F78-L159 HydrophobicContact CD1-CD1 4.21Å; F78-L159 HydrophobicContact CD1-CD2 3.41Å; F78-L159 VanDerWaalsContact CD1-CD2 3.41Å; F78-L159 HydrophobicContact CD1-CG 4.47Å; F78-L159 HydrophobicContact CE1-CD1 4.27Å; F78-L159 HydrophobicContact CE1-CD2 3.86Å; F78-L159 HydrophobicContact CG-CD1 4.39Å; F78-L159 HydrophobicContact CG-CD2 4.07Å
79	F	70.5	Confident	63.6	Low	34 Å²	34	66.2 Å²	66.2	15%	0.149	36%	0.364	C	S	.	.	H	α-helix	trans	-62.7	-26.5	177.4	-64.5	-41	0	0	0	113.6	M75 Q76 N77 G83 A86 F87 H152 L159	M75-F79 HydrophobicContact CB-CE2 4.19Å; M75-F79 HydrophobicContact CE-CZ 4.48Å; M75-F79 WeakPolarHBondContact O-CD2 3.48Å; M75-F79 VanDerWaalsContact O-CG 3.32Å; M75-F79 WeakPolarHBondContact O-CG 3.34Å; M75-F79 PolarHBondContact O-N 3.39Å; Q76-F79 PolarHBondContact O-N 2.8Å; N77-F79 PolarHBondContact O-N 2.85Å; F79-G83 WeakPolarHBondContact O-CA 3.17Å; F79-G83 PolarHBondContact O-N 2.8Å; F79-A86 HydrophobicContact CD1-CB 3.63Å; F79-A86 HydrophobicContact CE1-CB 4.14Å; F79-F87 HydrophobicContact CB-CE2 3.92Å; F79-F87 HydrophobicContact CB-CZ 4.13Å; F79-F87 AromaticContact CD1-CE2 3.99Å; F79-F87 HydrophobicContact CD1-CE2 3.99Å; F79-F87 AromaticContact CD1-CZ 3.75Å; F79-F87 HydrophobicContact CD1-CZ 3.75Å; F79-F87 HydrophobicContact CE1-CZ 4.34Å; F79-F87 HydrophobicContact CG-CE2 4.18Å; F79-F87 AromaticContact CG-CZ 3.95Å; F79-F87 HydrophobicContact CG-CZ 3.95Å; F79-H152 AromaticContact CE1-CD2 3.79Å; F79-H152 AromaticContact CZ-CD2 3.75Å; F79-L159 HydrophobicContact CE1-CD2 3.94Å; F79-L159 HydrophobicContact CZ-CD2 3.94Å
80	M	65.9	Low	64.9	Low	134 Å²	134	63 Å²	63	66%	0.66	34%	0.34	S	S	*	.	H	α-helix	trans	-86.6	-38.6	-180	-71.3	-88.5	47.1	0	0	113.5	Q76 N77 F78	Q76-M80 HydrophobicContact CG-CG 4.26Å; Q76-M80 VanDerWaalsContact O-CB 3.29Å; Q76-M80 WeakPolarHBondContact O-CB 3.41Å; Q76-M80 WeakPolarHBondContact O-CG 3.32Å; Q76-M80 PolarHBondContact O-N 2.95Å; N77-M80 PolarHBondContact O-N 2.99Å; N77-M80 VanDerWaalsContact O-N 3.1Å; F78-M80 PolarHBondContact O-N 3.04Å
81	D	70	Confident	66.1	Low	124 Å²	124	63.4 Å²	63.4	66%	0.663	34%	0.343	S	S	*	.	H	α-helix	trans	-86	-35.4	-177.9	-66.1	-32.1	0	0	0	111.6	N77 F78	N77-D81 WeakPolarHBondContact O-CB 3.33Å; N77-D81 PolarHBondContact O-N 2.95Å; F78-D81 PolarHBondContact O-N 2.83Å
82	H	71.8	Confident	67.3	Low	90 Å²	90	67.5 Å²	67.5	42%	0.417	36%	0.359	S	S	.	.	S	Bend	trans	-116.5	38.7	-178.5	-62.3	-82.7	0	0	0	112.5	F78 D85 A86	F78-H82 HydrophobicContact CD2-CB 3.99Å; F78-H82 AromaticContact CD2-CD2 3.94Å; F78-H82 HydrophobicContact CE2-CB 3.75Å; F78-H82 HydrophobicContact CZ-CB 4.12Å; F78-H82 CarbonylContact O-C 3.56Å; F78-H82 WeakPolarHBondContact O-CA 3.27Å; F78-H82 WeakPolarHBondContact O-CB 3.19Å; F78-H82 PolarHBondContact O-N 3.22Å; H82-D85 HydrophobicContact CB-CB 4.36Å; H82-D85 IonicContact CG-OD2 2.85Å; H82-D85 IonicContact ND1-OD2 2.87Å; H82-D85 PolarHBondContact ND1-OD2 2.9Å; H82-D85 PolarHBondContact O-N 3.31Å; H82-D85 VanDerWaalsContact O-N 3.09Å; H82-A86 WeakPolarHBondContact O-CB 3.44Å; H82-A86 PolarHBondContact O-N 3.5Å
83	G	65	Low	68	Low	23 Å²	23	67.4 Å²	67.4	24%	0.237	36%	0.361	C	S	.	.	H	α-helix	trans	-49.9	-40.6	174.5	0	0	0	0	0	116.3	F79 D85 A86 F87	F79-G83 WeakPolarHBondContact O-CA 3.17Å; F79-G83 PolarHBondContact O-N 2.8Å; G83-D85 VanDerWaalsContact C-N 3.35Å; G83-A86 PolarHBondContact O-N 2.89Å; G83-F87 WeakPolarHBondContact O-CD2 3.3Å; G83-F87 PolarHBondContact O-N 2.87Å
84	P	67.4	Low	68.5	Low	93 Å²	93	67.9 Å²	67.9	60%	0.604	36%	0.362	S	S	*	.	H	α-helix	trans	-69.5	-30	177.6	27	-34.6	0	0	0	113.4	G88	P84-G88 WeakPolarHBondContact O-CA 3.3Å; P84-G88 PolarHBondContact O-N 3.36Å
85	D	74.1	Confident	68.3	Low	97 Å²	97	66.6 Å²	66.6	52%	0.519	37%	0.365	S	S	.	.	H	α-helix	trans	-80.4	-30.9	178.4	-55.4	-41.1	0	0	0	111	H82 G83	H82-D85 HydrophobicContact CB-CB 4.36Å; H82-D85 IonicContact CG-OD2 2.85Å; H82-D85 IonicContact ND1-OD2 2.87Å; H82-D85 PolarHBondContact ND1-OD2 2.9Å; H82-D85 PolarHBondContact O-N 3.31Å; H82-D85 VanDerWaalsContact O-N 3.09Å; G83-D85 VanDerWaalsContact C-N 3.35Å
86	A	73.2	Confident	67.9	Low	0 Å²	0	70.3 Å²	70.3	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-82.1	-30.9	179.8	0	0	0	0	0	114.3	F78 F79 H82 G83 D153	F78-A86 HydrophobicContact CD1-CB 4.47Å; F78-A86 HydrophobicContact CE1-CB 3.91Å; F79-A86 HydrophobicContact CD1-CB 3.63Å; F79-A86 HydrophobicContact CE1-CB 4.14Å; H82-A86 WeakPolarHBondContact O-CB 3.44Å; H82-A86 PolarHBondContact O-N 3.5Å; G83-A86 PolarHBondContact O-N 2.89Å; A86-D153 PolarHBondContact O-N 3.47Å
87	F	75.8	Confident	67.8	Low	58 Å²	58	70.6 Å²	70.6	25%	0.254	39%	0.386	S	S	.	.	H	α-helix	trans	-133.9	16.8	-171.9	-52.6	-72.1	0	0	0	113.3	F79 G83 M90 S91 V151 H152	F79-F87 HydrophobicContact CB-CE2 3.92Å; F79-F87 HydrophobicContact CB-CZ 4.13Å; F79-F87 AromaticContact CD1-CE2 3.99Å; F79-F87 HydrophobicContact CD1-CE2 3.99Å; F79-F87 AromaticContact CD1-CZ 3.75Å; F79-F87 HydrophobicContact CD1-CZ 3.75Å; F79-F87 HydrophobicContact CE1-CZ 4.34Å; F79-F87 HydrophobicContact CG-CE2 4.18Å; F79-F87 AromaticContact CG-CZ 3.95Å; F79-F87 HydrophobicContact CG-CZ 3.95Å; G83-F87 WeakPolarHBondContact O-CD2 3.3Å; G83-F87 PolarHBondContact O-N 2.87Å; F87-M90 PolarHBondContact O-N 2.83Å; F87-S91 WeakPolarHBondContact O-CB 3.47Å; F87-S91 PolarHBondContact O-N 2.81Å; F87-S91 PolarHBondContact O-OG 2.99Å; F87-V151 HydrophobicContact CD1-CG1 3.76Å; F87-V151 WeakPolarHBondContact CD1-O 3.49Å; F87-V151 HydrophobicContact CE1-CG1 3.83Å; F87-H152 AromaticContact CE1-CD2 3.48Å; F87-H152 VanDerWaalsContact CE1-CD2 3.48Å; F87-H152 WeakPolarHBondContact CE1-CD2 3.41Å; F87-H152 AromaticContact CE1-NE2 3.82Å
88	G	71.1	Confident	67.4	Low	14 Å²	14	69.5 Å²	69.5	14%	0.144	38%	0.377	C	S	.	.	H	α-helix	trans	-54.8	-56	-172.6	0	0	0	0	0	113.6	P84 M90 S91 E92 D153	P84-G88 WeakPolarHBondContact O-CA 3.3Å; P84-G88 PolarHBondContact O-N 3.36Å; G88-M90 VanDerWaalsContact C-N 3.32Å; G88-M90 PolarHBondContact O-N 2.7Å; G88-S91 PolarHBondContact O-N 3.4Å; G88-S91 VanDerWaalsContact O-N 3.15Å; G88-S91 PolarHBondContact O-OG 2.98Å; G88-E92 WeakPolarHBondContact O-CG 3.2Å; G88-E92 PolarHBondContact O-N 3.38Å; G88-D153 VanDerWaalsContact CA-OD2 3.32Å; G88-D153 WeakPolarHBondContact CA-OD2 3.46Å; G88-D153 PolarHBondContact N-OD2 2.74Å
89	C	71.9	Confident	66.7	Low	66 Å²	66	69.2 Å²	69.2	45%	0.446	38%	0.377	S	S	.	.	H	α-helix	trans	-61.6	-43.2	-177.4	-56.2	0	0	0	0	110.9	E92 M93 D153	C89-E92 PolarHBondContact O-N 3.47Å; C89-M93 WeakPolarHBondContact O-CG 3.32Å; C89-M93 PolarHBondContact O-N 2.84Å; C89-D153 VanDerWaalsContact CB-OD1 3.24Å; C89-D153 WeakPolarHBondContact CB-OD1 3.38Å; C89-D153 PolarHBondContact N-OD1 2.88Å; C89-D153 PolarHBondContact N-OD2 2.87Å; C89-D153 PolarHBondContact SG-OD2 3.15Å
90	M	67.9	Low	65.9	Low	24 Å²	24	73.8 Å²	73.8	12%	0.118	40%	0.397	C	S	.	.	H	α-helix	trans	-70.9	-33.7	177.5	-75	-65.6	-62.5	0	0	112.9	F87 G88 E92 M93 L94 V150 V151	F87-M90 PolarHBondContact O-N 2.83Å; G88-M90 VanDerWaalsContact C-N 3.32Å; G88-M90 PolarHBondContact O-N 2.7Å; M90-E92 VanDerWaalsContact C-N 3.29Å; M90-E92 PolarHBondContact O-N 3.34Å; M90-M93 PolarHBondContact O-N 2.67Å; M90-M93 HydrophobicContact SD-SD 4.48Å; M90-L94 HydrophobicContact CE-CD1 3.93Å; M90-L94 HydrophobicContact CE-CG 4.14Å; M90-L94 WeakPolarHBondContact O-CB 3.13Å; M90-L94 WeakPolarHBondContact O-CG 3.11Å; M90-L94 PolarHBondContact O-N 2.76Å; M90-V150 WeakPolarHBondContact CG-O 3.49Å; M90-V150 HydrophobicContact SD-CG1 4.15Å; M90-V151 HydrophobicContact CE-CG2 4.31Å; M90-V151 WeakPolarHBondContact CG-O 3.37Å
91	S	65	Low	65.4	Low	62 Å²	62	72.4 Å²	72.4	43%	0.434	39%	0.389	S	S	.	.	H	α-helix	trans	-65.8	-33.9	174	80.1	0	0	0	0	111.9	F87 G88 G95	F87-S91 WeakPolarHBondContact O-CB 3.47Å; F87-S91 PolarHBondContact O-N 2.81Å; F87-S91 PolarHBondContact O-OG 2.99Å; G88-S91 PolarHBondContact O-N 3.4Å; G88-S91 VanDerWaalsContact O-N 3.15Å; G88-S91 PolarHBondContact O-OG 2.98Å; S91-G95 WeakPolarHBondContact O-CA 3.26Å; S91-G95 PolarHBondContact O-N 2.85Å
92	E	66.6	Low	64.4	Low	113 Å²	113	72.3 Å²	72.3	53%	0.528	38%	0.382	S	S	.	.	H	α-helix	trans	-73.6	-45.2	175.1	-71.8	-176.1	174.5	0	0	111.7	G88 C89 M90 G95	G88-E92 WeakPolarHBondContact O-CG 3.2Å; G88-E92 PolarHBondContact O-N 3.38Å; C89-E92 PolarHBondContact O-N 3.47Å; M90-E92 VanDerWaalsContact C-N 3.29Å; M90-E92 PolarHBondContact O-N 3.34Å; E92-G95 PolarHBondContact O-N 3.47Å
93	M	65.8	Low	63.4	Low	109 Å²	109	72 Å²	72	54%	0.537	40%	0.396	S	S	.	.	H	α-helix	trans	-65.1	-42	177.4	-71.5	-171.7	74.4	0	0	112.5	C89 M90 M665	C89-M93 WeakPolarHBondContact O-CG 3.32Å; C89-M93 PolarHBondContact O-N 2.84Å; M90-M93 PolarHBondContact O-N 2.67Å; M90-M93 HydrophobicContact SD-SD 4.48Å; M93-M665 HydrophobicContact CE-CE 3.91Å; M93-M665 HydrophobicContact SD-CE 3.96Å
94	L	64.3	Low	62.6	Low	72 Å²	72	80.1 Å²	80.1	38%	0.377	42%	0.424	S	S	.	.	H	α-helix	trans	-79.7	-22.7	177.3	-64	178.5	0	0	0	111.5	M90 E96 N97 F98	M90-L94 HydrophobicContact CE-CD1 3.93Å; M90-L94 HydrophobicContact CE-CG 4.14Å; M90-L94 WeakPolarHBondContact O-CB 3.13Å; M90-L94 WeakPolarHBondContact O-CG 3.11Å; M90-L94 PolarHBondContact O-N 2.76Å; L94-E96 PolarHBondContact O-N 3.37Å; L94-E96 VanDerWaalsContact O-N 3.1Å; L94-N97 CarbonylContact O-C 3.49Å; L94-N97 WeakPolarHBondContact O-CA 3.45Å; L94-N97 PolarHBondContact O-N 3.24Å; L94-F98 HydrophobicContact CB-CD2 3.75Å; L94-F98 HydrophobicContact CB-CE2 4.05Å; L94-F98 HydrophobicContact CD1-CE2 4.45Å; L94-F98 HydrophobicContact CD2-CE2 4.16Å; L94-F98 HydrophobicContact CG-CE2 4.46Å; L94-F98 VanDerWaalsContact O-CD2 3.3Å; L94-F98 WeakPolarHBondContact O-CD2 3.4Å; L94-F98 PolarHBondContact O-N 3.27Å
95	G	60.2	Low	61.6	Low	34 Å²	34	81.5 Å²	81.5	35%	0.351	43%	0.426	S	S	.	.	H	α-helix	trans	-57.7	-26.6	-179	0	0	0	0	0	114.5	S91 E92 N97 F98	S91-G95 WeakPolarHBondContact O-CA 3.26Å; S91-G95 PolarHBondContact O-N 2.85Å; E92-G95 PolarHBondContact O-N 3.47Å; G95-N97 VanDerWaalsContact C-N 3.27Å; G95-N97 PolarHBondContact O-N 3.27Å; G95-F98 VanDerWaalsContact O-O 3.05Å
96	E	57.9	Low	60.2	Low	110 Å²	110	87.4 Å²	87.4	51%	0.514	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-27	172.7	-65.1	-169.8	175.6	0	0	112.8	L94 R666	L94-E96 PolarHBondContact O-N 3.37Å; L94-E96 VanDerWaalsContact O-N 3.1Å; E96-R666 IonicContact OE1-NH2 3.11Å; E96-R666 PolarHBondContact OE1-NH2 3.41Å
97	N	60.6	Low	59.1	Low	87 Å²	87	94.8 Å²	94.8	47%	0.465	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-15.7	-178.1	-62.5	-41.9	0	0	0	113.3	L94 G95 S113 I114	L94-N97 CarbonylContact O-C 3.49Å; L94-N97 WeakPolarHBondContact O-CA 3.45Å; L94-N97 PolarHBondContact O-N 3.24Å; G95-N97 VanDerWaalsContact C-N 3.27Å; G95-N97 PolarHBondContact O-N 3.27Å; N97-S113 CarbonylContact O-C 3.48Å; N97-S113 WeakPolarHBondContact O-CA 3.15Å; N97-I114 PolarHBondContact O-N 3.25Å
98	F	58.3	Low	57.8	Low	59 Å²	59	102.2 Å²	102.2	26%	0.259	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	119.8	179.5	-70.3	-88.5	0	0	0	111.5	L94 G95 F100 I114 M116	L94-F98 HydrophobicContact CB-CD2 3.75Å; L94-F98 HydrophobicContact CB-CE2 4.05Å; L94-F98 HydrophobicContact CD1-CE2 4.45Å; L94-F98 HydrophobicContact CD2-CE2 4.16Å; L94-F98 HydrophobicContact CG-CE2 4.46Å; L94-F98 VanDerWaalsContact O-CD2 3.3Å; L94-F98 WeakPolarHBondContact O-CD2 3.4Å; L94-F98 PolarHBondContact O-N 3.27Å; G95-F98 VanDerWaalsContact O-O 3.05Å; F98-F100 HydrophobicContact CB-CE2 4.04Å; F98-F100 HydrophobicContact CB-CZ 4.21Å; F98-F100 WeakPolarHBondContact O-CD2 3.44Å; F98-I114 WeakPolarHBondContact CA-O 3.28Å; F98-I114 HydrophobicContact CD1-CB 3.71Å; F98-I114 HydrophobicContact CD1-CD1 4.4Å; F98-I114 HydrophobicContact CD1-CG2 3.98Å; F98-I114 HydrophobicContact CE1-CB 3.81Å; F98-I114 HydrophobicContact CE1-CD1 3.63Å; F98-I114 HydrophobicContact CE1-CG1 4.26Å; F98-I114 HydrophobicContact CE1-CG2 3.97Å; F98-I114 HydrophobicContact CZ-CD1 3.97Å; F98-M116 HydrophobicContact CB-CG 4Å; F98-M116 HydrophobicContact CD1-CG 3.93Å; F98-M116 HydrophobicContact CD1-SD 3.63Å; F98-M116 HydrophobicContact CE1-SD 4.27Å; F98-M116 HydrophobicContact CG-CG 4.42Å; F98-M116 HydrophobicContact CG-SD 4.39Å
99	H	56.6	Low	56.7	Low	50 Å²	50	104.8 Å²	104.8	23%	0.231	53%	0.526	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	116.1	-176.8	-178.4	-84.6	0	0	0	111.6	Q101 I114 M116	H99-Q101 WeakPolarHBondContact CE1-CB 3.28Å; H99-Q101 PolarHBondContact CE1-O 2.86Å; H99-Q101 PolarHBondContact ND1-N 3.04Å; H99-I114 PolarHBondContact N-O 3Å; H99-M116 PolarHBondContact O-N 3.17Å
100	F	55.4	Low	55.9	Low	130 Å²	130	110.4 Å²	110.4	57%	0.57	54%	0.538	S	S	*	.			trans	-95.2	-5.5	-176.4	-64.1	-84.2	0	0	0	115.4	F98 M116	F98-F100 HydrophobicContact CB-CE2 4.04Å; F98-F100 HydrophobicContact CB-CZ 4.21Å; F98-F100 WeakPolarHBondContact O-CD2 3.44Å; F100-M116 HydrophobicContact CD1-CB 3.68Å; F100-M116 HydrophobicContact CD1-CG 3.88Å; F100-M116 HydrophobicContact CE1-CB 3.84Å; F100-M116 HydrophobicContact CE1-CG 3.59Å; F100-M116 HydrophobicContact CE1-SD 4.09Å; F100-M116 HydrophobicContact CG-CB 4.41Å; F100-M116 HydrophobicContact CZ-CG 4.01Å; F100-M116 HydrophobicContact CZ-SD 4.43Å
101	Q	53.8	Low	55	Low	105 Å²	105	121.2 Å²	121.2	49%	0.491	58%	0.577	S	S	.	*	S	Bend	trans	-75.4	139.2	-178.1	-46.4	-179.3	-9.2	0	0	111.9	H99 A103	H99-Q101 WeakPolarHBondContact CE1-CB 3.28Å; H99-Q101 PolarHBondContact CE1-O 2.86Å; H99-Q101 PolarHBondContact ND1-N 3.04Å; Q101-A103 PolarHBondContact O-N 3.36Å
102	K	49.4	Very low	54.5	Low	123 Å²	123	125.2 Å²	125.2	54%	0.535	59%	0.594	S	S	.	*			trans	-55.9	135.3	168	-87.5	-177.9	175.6	172.9	0	108.8	K104 W117	K102-K104 PolarHBondContact O-N 2.78Å; K102-W117 HydrophobicContact CD-CH2 4.47Å; K102-W117 HydrophobicContact CD-CZ2 3.98Å; K102-W117 HydrophobicContact CG-CD2 3.71Å; K102-W117 HydrophobicContact CG-CE3 4.41Å; K102-W117 HydrophobicContact CG-CG 4.03Å; K102-W117 HydrophobicContact CG-CH2 4.48Å; K102-W117 HydrophobicContact CG-CZ2 3.82Å; K102-W117 VanDerWaalsContact CG-NE1 3.31Å
103	A	51.2	Low	54	Low	84 Å²	84	121 Å²	121	69%	0.694	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.3	21.1	-176.6	0	0	0	0	0	116.2	Q101	Q101-A103 PolarHBondContact O-N 3.36Å
104	K	47.3	Very low	53.7	Low	192 Å²	192	120 Å²	120	84%	0.835	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-19.1	179.3	-71.2	-167.3	174.3	-171.8	0	113.6	K102	K102-K104 PolarHBondContact O-N 2.78Å
105	L	46.4	Very low	53.5	Low	122 Å²	122	117.9 Å²	117.9	64%	0.639	56%	0.562	S	S	*	*	S	Bend	trans	-106.8	116.4	170	-87.6	102.9	0	0	0	110.6	K107	L105-K107 PolarHBondContact O-N 3.07Å
106	K	46	Very low	53.6	Low	222 Å²	222	118.6 Å²	118.6	97%	0.965	56%	0.557	S	S	*	*			trans	-68.1	69.6	169.9	-72.8	-179.6	175.8	177.2	0	110.4
107	K	50.6	Low	53.6	Low	155 Å²	155	118 Å²	118	67%	0.674	55%	0.55	S	S	*	*			trans	-89.5	138.1	156.4	-79.8	-175.6	175.2	-179.5	0	107.8	L105 C109	L105-K107 PolarHBondContact O-N 3.07Å; K107-C109 PolarHBondContact O-N 3.47Å
108	K	47.6	Very low	53.5	Low	213 Å²	213	123.1 Å²	123.1	93%	0.926	56%	0.563	S	S	*	*			trans	-54.4	109.1	174.3	-106.7	178.2	173.9	176.1	0	108	R110	K108-R110 PolarHBondContact O-N 2.74Å
109	C	47.8	Very low	53.4	Low	68 Å²	68	123 Å²	123	46%	0.459	57%	0.567	S	S	.	*			trans	-55.9	134.4	163.4	-86	0	0	0	0	107.9	K107	K107-C109 PolarHBondContact O-N 3.47Å
110	R	55.8	Low	53.2	Low	185 Å²	185	126.1 Å²	126.1	70%	0.698	58%	0.58	S	S	*	*			trans	-59.9	140.9	167.6	-76.6	-176.3	173.5	-178.4	-1.3	107.8	K108 D112 S113	K108-R110 PolarHBondContact O-N 2.74Å; R110-D112 PolarHBondContact O-N 3.2Å; R110-S113 PolarHBondContact N-OG 3.47Å; R110-S113 PolarHBondContact O-N 2.73Å; R110-S113 PolarHBondContact O-OG 2.93Å
111	R	48.4	Very low	53.3	Low	250 Å²	250	122.1 Å²	122.1	94%	0.943	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.7	-24.3	-168.6	-128.9	175.3	-170.2	168.1	0.2	113.6
112	D	54.2	Low	53.4	Low	146 Å²	146	123.1 Å²	123.1	78%	0.781	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.8	13	-176.7	-53.1	-39.5	0	0	0	114.1	R110	R110-D112 PolarHBondContact O-N 3.2Å
113	S	57.5	Low	53.7	Low	26 Å²	26	121 Å²	121	18%	0.182	57%	0.568	C	S	.	*			trans	-92.3	132.2	-178.3	61.6	0	0	0	0	113.6	N97 R110	N97-S113 CarbonylContact O-C 3.48Å; N97-S113 WeakPolarHBondContact O-CA 3.15Å; R110-S113 PolarHBondContact N-OG 3.47Å; R110-S113 PolarHBondContact O-N 2.73Å; R110-S113 PolarHBondContact O-OG 2.93Å
114	I	58.4	Low	53.8	Low	87 Å²	87	119.7 Å²	119.7	45%	0.446	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	123.8	179.1	-63	170.8	0	0	0	109.5	N97 F98 H99 M116	N97-I114 PolarHBondContact O-N 3.25Å; F98-I114 WeakPolarHBondContact CA-O 3.28Å; F98-I114 HydrophobicContact CD1-CB 3.71Å; F98-I114 HydrophobicContact CD1-CD1 4.4Å; F98-I114 HydrophobicContact CD1-CG2 3.98Å; F98-I114 HydrophobicContact CE1-CB 3.81Å; F98-I114 HydrophobicContact CE1-CD1 3.63Å; F98-I114 HydrophobicContact CE1-CG1 4.26Å; F98-I114 HydrophobicContact CE1-CG2 3.97Å; F98-I114 HydrophobicContact CZ-CD1 3.97Å; H99-I114 PolarHBondContact N-O 3Å; I114-M116 PolarHBondContact O-N 2.75Å
115	N	60.9	Low	54.3	Low	27 Å²	27	117 Å²	117	14%	0.144	54%	0.54	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	107.8	178.2	-174.7	-39.1	0	0	0	111	W117 R118 T119	N115-W117 VanDerWaalsContact C-N 3.27Å; N115-W117 PolarHBondContact O-N 3.4Å; N115-W117 WeakPolarHBondContact OD1-CA 3.45Å; N115-W117 VanDerWaalsContact OD1-CB 3.29Å; N115-W117 WeakPolarHBondContact OD1-CB 3.41Å; N115-W117 PolarHBondContact OD1-N 2.75Å; N115-R118 HydrophobicContact CB-CB 4.45Å; N115-R118 HydrophobicContact CB-CG 4.39Å; N115-R118 PolarHBondContact O-N 3.28Å; N115-R118 PolarHBondContact OD1-N 3.02Å; N115-T119 PolarHBondContact O-N 3.09Å; N115-T119 PolarHBondContact O-OG1 2.87Å
116	M	61.4	Low	54.5	Low	49 Å²	49	116.2 Å²	116.2	24%	0.241	54%	0.536	C	S	.	.	H	α-helix	trans	-71.3	-21.5	-175.5	-69.4	-88.6	46.4	0	0	113.7	F98 H99 F100 I114 T119 K120	F98-M116 HydrophobicContact CB-CG 4Å; F98-M116 HydrophobicContact CD1-CG 3.93Å; F98-M116 HydrophobicContact CD1-SD 3.63Å; F98-M116 HydrophobicContact CE1-SD 4.27Å; F98-M116 HydrophobicContact CG-CG 4.42Å; F98-M116 HydrophobicContact CG-SD 4.39Å; H99-M116 PolarHBondContact O-N 3.17Å; F100-M116 HydrophobicContact CD1-CB 3.68Å; F100-M116 HydrophobicContact CD1-CG 3.88Å; F100-M116 HydrophobicContact CE1-CB 3.84Å; F100-M116 HydrophobicContact CE1-CG 3.59Å; F100-M116 HydrophobicContact CE1-SD 4.09Å; F100-M116 HydrophobicContact CG-CB 4.41Å; F100-M116 HydrophobicContact CZ-CG 4.01Å; F100-M116 HydrophobicContact CZ-SD 4.43Å; I114-M116 PolarHBondContact O-N 2.75Å; M116-T119 HydrophobicContact CE-CG2 3.65Å; M116-T119 WeakPolarHBondContact CE-OG1 3.24Å; M116-T119 PolarHBondContact O-N 3.41Å; M116-K120 VanDerWaalsContact O-CB 3.28Å; M116-K120 WeakPolarHBondContact O-CB 3.41Å; M116-K120 PolarHBondContact O-N 2.99Å
117	W	57.6	Low	54.5	Low	98 Å²	98	112.6 Å²	112.6	37%	0.371	52%	0.52	S	S	.	.	H	α-helix	trans	-69.9	-34.8	173.5	-119.3	90.4	0	0	0	112.3	K102 N115 S121	K102-W117 HydrophobicContact CD-CH2 4.47Å; K102-W117 HydrophobicContact CD-CZ2 3.98Å; K102-W117 HydrophobicContact CG-CD2 3.71Å; K102-W117 HydrophobicContact CG-CE3 4.41Å; K102-W117 HydrophobicContact CG-CG 4.03Å; K102-W117 HydrophobicContact CG-CH2 4.48Å; K102-W117 HydrophobicContact CG-CZ2 3.82Å; K102-W117 VanDerWaalsContact CG-NE1 3.31Å; N115-W117 VanDerWaalsContact C-N 3.27Å; N115-W117 PolarHBondContact O-N 3.4Å; N115-W117 WeakPolarHBondContact OD1-CA 3.45Å; N115-W117 VanDerWaalsContact OD1-CB 3.29Å; N115-W117 WeakPolarHBondContact OD1-CB 3.41Å; N115-W117 PolarHBondContact OD1-N 2.75Å; W117-S121 VanDerWaalsContact O-CB 3.28Å; W117-S121 WeakPolarHBondContact O-CB 3.12Å; W117-S121 PolarHBondContact O-N 3.13Å
118	R	58.4	Low	54.2	Low	195 Å²	195	114 Å²	114	74%	0.736	53%	0.526	S	S	*	.	H	α-helix	trans	-67.1	-43.6	171.7	-76.7	-175.8	176.1	172.6	-2.1	111.1	N115 S121 F122	N115-R118 HydrophobicContact CB-CB 4.45Å; N115-R118 HydrophobicContact CB-CG 4.39Å; N115-R118 PolarHBondContact O-N 3.28Å; N115-R118 PolarHBondContact OD1-N 3.02Å; R118-S121 PolarHBondContact O-N 3.48Å; R118-F122 VanDerWaalsContact O-CB 3.31Å; R118-F122 WeakPolarHBondContact O-CB 3.32Å; R118-F122 PolarHBondContact O-N 3.1Å
119	T	56.2	Low	53.8	Low	55 Å²	55	110.7 Å²	110.7	34%	0.337	52%	0.519	S	S	.	.	H	α-helix	trans	-64.4	-43	176.6	-45.9	0	0	0	0	111.6	N115 M116 F122 V123	N115-T119 PolarHBondContact O-N 3.09Å; N115-T119 PolarHBondContact O-OG1 2.87Å; M116-T119 HydrophobicContact CE-CG2 3.65Å; M116-T119 WeakPolarHBondContact CE-OG1 3.24Å; M116-T119 PolarHBondContact O-N 3.41Å; T119-F122 WeakPolarHBondContact O-CB 3.06Å; T119-F122 PolarHBondContact O-N 3.37Å; T119-V123 VanDerWaalsContact O-CG2 3.28Å; T119-V123 WeakPolarHBondContact O-CG2 3.19Å; T119-V123 PolarHBondContact O-N 2.93Å
120	K	53.3	Low	53.3	Low	117 Å²	117	116.4 Å²	116.4	51%	0.509	54%	0.541	S	S	.	.	H	α-helix	trans	-63.2	-44.9	175	-179.5	166.2	-177.3	148	0	111.9	M116 F122 V123 D124	M116-K120 VanDerWaalsContact O-CB 3.28Å; M116-K120 WeakPolarHBondContact O-CB 3.41Å; M116-K120 PolarHBondContact O-N 2.99Å; K120-F122 VanDerWaalsContact C-N 3.26Å; K120-F122 PolarHBondContact O-N 3.21Å; K120-V123 PolarHBondContact O-N 3.06Å; K120-D124 WeakPolarHBondContact CG-OD2 3.42Å; K120-D124 VanDerWaalsContact O-CB 3.26Å; K120-D124 WeakPolarHBondContact O-CB 3.02Å; K120-D124 VanDerWaalsContact O-CG 3.23Å; K120-D124 PolarHBondContact O-N 2.63Å
121	S	57.6	Low	52.2	Low	46 Å²	46	112.6 Å²	112.6	32%	0.322	54%	0.542	S	S	.	.	H	α-helix	trans	-61.5	-35.7	174.6	-175.1	0	0	0	0	112.3	W117 R118 Q125	W117-S121 VanDerWaalsContact O-CB 3.28Å; W117-S121 WeakPolarHBondContact O-CB 3.12Å; W117-S121 PolarHBondContact O-N 3.13Å; R118-S121 PolarHBondContact O-N 3.48Å; S121-Q125 WeakPolarHBondContact O-CB 3.46Å; S121-Q125 WeakPolarHBondContact O-CG 3.47Å; S121-Q125 PolarHBondContact O-N 2.98Å
122	F	56.1	Low	52	Low	126 Å²	126	105.7 Å²	105.7	55%	0.553	53%	0.529	S	S	*	.	H	α-helix	trans	-69.3	-44.2	175.4	-179.5	-98.7	0	0	0	111.6	R118 T119 K120 Q125 L126	R118-F122 VanDerWaalsContact O-CB 3.31Å; R118-F122 WeakPolarHBondContact O-CB 3.32Å; R118-F122 PolarHBondContact O-N 3.1Å; T119-F122 WeakPolarHBondContact O-CB 3.06Å; T119-F122 PolarHBondContact O-N 3.37Å; K120-F122 VanDerWaalsContact C-N 3.26Å; K120-F122 PolarHBondContact O-N 3.21Å; F122-Q125 WeakPolarHBondContact O-CB 2.86Å; F122-Q125 PolarHBondContact O-N 2.83Å; F122-L126 HydrophobicContact CD1-CD1 4.11Å; F122-L126 HydrophobicContact CE1-CD1 3.82Å; F122-L126 HydrophobicContact CZ-CD1 4.46Å; F122-L126 WeakPolarHBondContact O-CG 3.5Å; F122-L126 PolarHBondContact O-N 3.43Å; F122-L126 VanDerWaalsContact O-N 3.17Å
123	V	54.6	Low	51.4	Low	79 Å²	79	104 Å²	104	48%	0.479	52%	0.518	S	S	.	.	H	α-helix	trans	-65.2	-38.8	174.4	173	0	0	0	0	111.7	T119 K120 Q125 L126	T119-V123 VanDerWaalsContact O-CG2 3.28Å; T119-V123 WeakPolarHBondContact O-CG2 3.19Å; T119-V123 PolarHBondContact O-N 2.93Å; K120-V123 PolarHBondContact O-N 3.06Å; V123-Q125 VanDerWaalsContact C-N 3.3Å; V123-Q125 PolarHBondContact O-N 2.85Å; V123-L126 WeakPolarHBondContact O-CB 3.39Å; V123-L126 PolarHBondContact O-N 3.41Å; V123-L126 VanDerWaalsContact O-N 3.13Å
124	D	54.3	Low	50.6	Low	55 Å²	55	106.7 Å²	106.7	29%	0.294	54%	0.542	S	S	.	.	H	α-helix	trans	-68.1	-30.9	175.9	-74.7	-30.9	0	0	0	111.6	K120 L126 K127	K120-D124 WeakPolarHBondContact CG-OD2 3.42Å; K120-D124 VanDerWaalsContact O-CB 3.26Å; K120-D124 WeakPolarHBondContact O-CB 3.02Å; K120-D124 VanDerWaalsContact O-CG 3.23Å; K120-D124 PolarHBondContact O-N 2.63Å; D124-L126 VanDerWaalsContact C-N 3.29Å; D124-K127 HydrophobicContact CB-CD 4.45Å; D124-K127 VanDerWaalsContact O-CB 3.28Å; D124-K127 WeakPolarHBondContact O-CB 3.49Å; D124-K127 WeakPolarHBondContact O-CG 3.34Å; D124-K127 PolarHBondContact O-N 3.02Å; D124-K127 WeakPolarHBondContact OD1-CE 3.39Å; D124-K127 IonicContact OD1-NZ 2.72Å; D124-K127 PolarHBondContact OD1-NZ 2.7Å
125	Q	57.9	Low	49.8	Very low	137 Å²	137	113.7 Å²	113.7	64%	0.64	56%	0.564	S	S	*	*	H	α-helix	trans	-69.9	-25.1	171.1	-77.6	166.8	10	0	0	112.8	S121 F122 V123 K127	S121-Q125 WeakPolarHBondContact O-CB 3.46Å; S121-Q125 WeakPolarHBondContact O-CG 3.47Å; S121-Q125 PolarHBondContact O-N 2.98Å; F122-Q125 WeakPolarHBondContact O-CB 2.86Å; F122-Q125 PolarHBondContact O-N 2.83Å; V123-Q125 VanDerWaalsContact C-N 3.3Å; V123-Q125 PolarHBondContact O-N 2.85Å; Q125-K127 PolarHBondContact O-N 3.5Å
126	L	49.1	Very low	49	Very low	105 Å²	105	119.8 Å²	119.8	55%	0.55	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.6	-2.2	173.4	-66.3	168	0	0	0	113.3	F122 V123 D124 F128	F122-L126 HydrophobicContact CD1-CD1 4.11Å; F122-L126 HydrophobicContact CE1-CD1 3.82Å; F122-L126 HydrophobicContact CZ-CD1 4.46Å; F122-L126 WeakPolarHBondContact O-CG 3.5Å; F122-L126 PolarHBondContact O-N 3.43Å; F122-L126 VanDerWaalsContact O-N 3.17Å; V123-L126 WeakPolarHBondContact O-CB 3.39Å; V123-L126 PolarHBondContact O-N 3.41Å; V123-L126 VanDerWaalsContact O-N 3.13Å; D124-L126 VanDerWaalsContact C-N 3.29Å; L126-F128 PolarHBondContact O-N 2.8Å
127	K	46.7	Very low	48.4	Very low	145 Å²	145	119.3 Å²	119.3	63%	0.63	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-7.7	178.1	-72.4	178.4	168.1	169.3	0	114.4	D124 Q125	D124-K127 HydrophobicContact CB-CD 4.45Å; D124-K127 VanDerWaalsContact O-CB 3.28Å; D124-K127 WeakPolarHBondContact O-CB 3.49Å; D124-K127 WeakPolarHBondContact O-CG 3.34Å; D124-K127 PolarHBondContact O-N 3.02Å; D124-K127 WeakPolarHBondContact OD1-CE 3.39Å; D124-K127 IonicContact OD1-NZ 2.72Å; D124-K127 PolarHBondContact OD1-NZ 2.7Å; Q125-K127 PolarHBondContact O-N 3.5Å
128	F	45.1	Very low	48.1	Very low	185 Å²	185	124.1 Å²	124.1	81%	0.811	61%	0.605	S	S	*	*	S	Bend	trans	-96.7	108.1	166.6	-74.3	-81.6	0	0	0	109.1	L126	L126-F128 PolarHBondContact O-N 2.8Å
129	N	38.9	Very low	47.6	Very low	143 Å²	143	118.1 Å²	118.1	77%	0.765	59%	0.592	S	S	*	*	S	Bend	trans	85.9	89	-172.1	-54.2	-21.5	0	0	0	114.3	C131	N129-C131 VanDerWaalsContact C-N 3.3Å; N129-C131 PolarHBondContact O-N 2.8Å
130	M	36.2	Very low	47.2	Very low	189 Å²	189	121 Å²	121	93%	0.931	61%	0.606	S	S	*	*			trans	-58.1	94.8	156.6	-67.3	-149.1	-49.9	0	0	109.6
131	C	32.9	Very low	47.1	Very low	105 Å²	105	118.4 Å²	118.4	71%	0.709	60%	0.597	S	S	*	*			trans	-92.2	117.9	155.8	-84.9	0	0	0	0	108.2	N129 M133	N129-C131 VanDerWaalsContact C-N 3.3Å; N129-C131 PolarHBondContact O-N 2.8Å; C131-M133 PolarHBondContact O-N 3.44Å; C131-M133 VanDerWaalsContact O-N 3.1Å
132	P	44.6	Very low	46.9	Very low	104 Å²	104	124.4 Å²	124.4	68%	0.675	61%	0.613	S	S	*	*	S	Bend	trans	-70	108	169.5	28.6	-28.7	0	0	0	108.1
133	M	41.4	Very low	46.8	Very low	110 Å²	110	125.5 Å²	125.5	54%	0.542	61%	0.614	S	S	.	*			trans	81.2	118	-178.4	-61.1	-177	-82.3	0	0	116.4	C131 R136	C131-M133 PolarHBondContact O-N 3.44Å; C131-M133 VanDerWaalsContact O-N 3.1Å; M133-R136 PolarHBondContact SD-NH2 3.21Å; M133-R136 VanDerWaalsContact SD-NH2 3.41Å
134	A	40	Very low	46.8	Very low	83 Å²	83	124.5 Å²	124.5	69%	0.686	61%	0.611	S	S	*	*				159.7	80.2	103.6	0	0	0	0	0	112.2
135	Y	41.6	Very low	47	Very low	235 Å²	235	126 Å²	126	92%	0.922	63%	0.626	S	S	*	*			trans	-118.3	64.3	134.8	-115.6	-87.6	0	0	0	107.5	S137	Y135-S137 PolarHBondContact O-N 3.45Å
136	R	44.3	Very low	47.2	Very low	155 Å²	155	125.6 Å²	125.6	59%	0.585	63%	0.627	S	S	*	*			trans	-72	82.2	163.1	-80	-172.1	-179.7	176.7	-1.1	106.9	M133 R138 D141	M133-R136 PolarHBondContact SD-NH2 3.21Å; M133-R136 VanDerWaalsContact SD-NH2 3.41Å; R136-R138 PolarHBondContact O-N 2.95Å; R136-D141 VanDerWaalsContact CB-OD2 3.24Å; R136-D141 WeakPolarHBondContact CB-OD2 3.14Å; R136-D141 VanDerWaalsContact CD-OD2 3.32Å; R136-D141 WeakPolarHBondContact CD-OD2 3.34Å; R136-D141 VanDerWaalsContact CG-OD2 3.23Å; R136-D141 WeakPolarHBondContact CG-OD2 3.32Å
137	S	48.9	Very low	47.9	Very low	39 Å²	39	124.2 Å²	124.2	27%	0.273	62%	0.62	S	S	.	*			trans	-61.4	114.5	162.2	155	0	0	0	0	105.2	Y135 S139 L140 D141	Y135-S137 PolarHBondContact O-N 3.45Å; S137-S139 CarbonylContact O-C 3.54Å; S137-S139 PolarHBondContact O-N 2.89Å; S137-S139 WeakPolarHBondContact OG-CB 3.48Å; S137-S139 PolarHBondContact OG-N 3.1Å; S137-L140 CarbonylContact O-C 3.56Å; S137-L140 WeakPolarHBondContact O-CA 3.4Å; S137-L140 PolarHBondContact O-N 3.33Å; S137-L140 PolarHBondContact OG-N 2.84Å; S137-L140 VanDerWaalsContact OG-N 3.1Å; S137-D141 PolarHBondContact O-N 3.02Å
138	R	52.4	Low	48.7	Very low	198 Å²	198	123.1 Å²	123.1	75%	0.747	61%	0.612	S	S	*	*	H	α-helix	trans	-50.1	-29.9	175.7	-77.6	-176.4	175.7	-177.2	-1.3	111.2	R136 R142	R136-R138 PolarHBondContact O-N 2.95Å; R138-R142 VanDerWaalsContact O-CB 3.31Å; R138-R142 WeakPolarHBondContact O-CB 3.44Å; R138-R142 WeakPolarHBondContact O-CD 3.09Å; R138-R142 WeakPolarHBondContact O-CG 3.29Å; R138-R142 PolarHBondContact O-N 2.78Å
139	S	47.6	Very low	49.5	Very low	69 Å²	69	120.7 Å²	120.7	48%	0.483	61%	0.608	S	S	.	*	H	α-helix	trans	-70.1	-48.9	174.3	-43.6	0	0	0	0	111.7	S137 R142 Y143	S137-S139 CarbonylContact O-C 3.54Å; S137-S139 PolarHBondContact O-N 2.89Å; S137-S139 WeakPolarHBondContact OG-CB 3.48Å; S137-S139 PolarHBondContact OG-N 3.1Å; S139-R142 PolarHBondContact O-N 3.45Å; S139-Y143 WeakPolarHBondContact O-CB 3.26Å; S139-Y143 WeakPolarHBondContact O-CD2 3.17Å; S139-Y143 PolarHBondContact O-N 2.88Å
140	L	48.3	Very low	50.8	Low	117 Å²	117	118 Å²	118	61%	0.613	60%	0.596	S	S	*	*	H	α-helix	trans	-63.9	-39	175.8	-96.5	159.5	0	0	0	112.3	S137 Y143 S144	S137-L140 CarbonylContact O-C 3.56Å; S137-L140 WeakPolarHBondContact O-CA 3.4Å; S137-L140 PolarHBondContact O-N 3.33Å; S137-L140 PolarHBondContact OG-N 2.84Å; S137-L140 VanDerWaalsContact OG-N 3.1Å; L140-Y143 PolarHBondContact O-N 3.17Å; L140-S144 WeakPolarHBondContact O-CA 3.5Å; L140-S144 WeakPolarHBondContact O-CB 3.47Å; L140-S144 PolarHBondContact O-N 3.27Å; L140-S144 PolarHBondContact O-OG 2.71Å
141	D	50.1	Low	52.5	Low	62 Å²	62	111.1 Å²	111.1	33%	0.332	57%	0.565	S	S	.	*	H	α-helix	trans	-63.2	-47.4	174.7	-75.2	-10.1	0	0	0	109.7	R136 S137 Y143 S144 S145	R136-D141 VanDerWaalsContact CB-OD2 3.24Å; R136-D141 WeakPolarHBondContact CB-OD2 3.14Å; R136-D141 VanDerWaalsContact CD-OD2 3.32Å; R136-D141 WeakPolarHBondContact CD-OD2 3.34Å; R136-D141 VanDerWaalsContact CG-OD2 3.23Å; R136-D141 WeakPolarHBondContact CG-OD2 3.32Å; S137-D141 PolarHBondContact O-N 3.02Å; D141-Y143 PolarHBondContact O-N 2.81Å; D141-S144 WeakPolarHBondContact CA-OG 3.18Å; D141-S144 PolarHBondContact O-N 2.7Å; D141-S144 PolarHBondContact O-OG 3.21Å; D141-S145 PolarHBondContact O-N 3.03Å; D141-S145 PolarHBondContact O-OG 2.84Å
142	R	54.2	Low	54.4	Low	171 Å²	171	106.9 Å²	106.9	65%	0.645	53%	0.534	S	S	*	.	H	α-helix	trans	-59.8	-44.2	174.6	-76.7	173	-174.7	-171.7	0.4	112.7	R138 S139 S145 L146	R138-R142 VanDerWaalsContact O-CB 3.31Å; R138-R142 WeakPolarHBondContact O-CB 3.44Å; R138-R142 WeakPolarHBondContact O-CD 3.09Å; R138-R142 WeakPolarHBondContact O-CG 3.29Å; R138-R142 PolarHBondContact O-N 2.78Å; S139-R142 PolarHBondContact O-N 3.45Å; R142-S145 PolarHBondContact O-N 3.31Å; R142-L146 WeakPolarHBondContact O-CB 3.36Å; R142-L146 WeakPolarHBondContact O-CD1 3.19Å; R142-L146 WeakPolarHBondContact O-CG 3.39Å; R142-L146 PolarHBondContact O-N 3.39Å
143	Y	54.5	Low	55.9	Low	149 Å²	149	104.5 Å²	104.5	58%	0.584	52%	0.516	S	S	*	.	H	α-helix	trans	-66.2	-39.2	176.4	-81.1	-64.3	0	0	0	111.5	S139 L140 D141 S145 L146 L147	S139-Y143 WeakPolarHBondContact O-CB 3.26Å; S139-Y143 WeakPolarHBondContact O-CD2 3.17Å; S139-Y143 PolarHBondContact O-N 2.88Å; L140-Y143 PolarHBondContact O-N 3.17Å; D141-Y143 PolarHBondContact O-N 2.81Å; Y143-S145 VanDerWaalsContact C-N 3.33Å; Y143-L146 PolarHBondContact O-N 3.31Å; Y143-L147 HydrophobicContact CD1-CD1 4.48Å; Y143-L147 WeakPolarHBondContact O-CB 3.42Å; Y143-L147 VanDerWaalsContact O-CG 3.26Å; Y143-L147 WeakPolarHBondContact O-CG 3.47Å; Y143-L147 PolarHBondContact O-N 2.79Å
144	S	54.1	Low	57.7	Low	58 Å²	58	101.2 Å²	101.2	41%	0.406	50%	0.502	S	S	.	.	H	α-helix	trans	-64.5	-39.5	175.4	74.8	0	0	0	0	111	L140 D141 W148	L140-S144 WeakPolarHBondContact O-CA 3.5Å; L140-S144 WeakPolarHBondContact O-CB 3.47Å; L140-S144 PolarHBondContact O-N 3.27Å; L140-S144 PolarHBondContact O-OG 2.71Å; D141-S144 WeakPolarHBondContact CA-OG 3.18Å; D141-S144 PolarHBondContact O-N 2.7Å; D141-S144 PolarHBondContact O-OG 3.21Å; S144-W148 WeakPolarHBondContact O-CA 3.31Å; S144-W148 WeakPolarHBondContact O-CB 3.47Å; S144-W148 PolarHBondContact O-N 2.97Å
145	S	57.5	Low	59.5	Low	87 Å²	87	100.4 Å²	100.4	61%	0.608	49%	0.489	S	S	*	.	H	α-helix	trans	-69.1	-35.5	175.4	-50.7	0	0	0	0	112.6	D141 R142 Y143	D141-S145 PolarHBondContact O-N 3.03Å; D141-S145 PolarHBondContact O-OG 2.84Å; R142-S145 PolarHBondContact O-N 3.31Å; Y143-S145 VanDerWaalsContact C-N 3.33Å
146	L	63.5	Low	61.1	Low	129 Å²	129	90.2 Å²	90.2	68%	0.675	45%	0.452	S	S	*	.	H	α-helix	trans	-79.1	-30	179.4	-72.1	168	0	0	0	113.1	R142 Y143	R142-L146 WeakPolarHBondContact O-CB 3.36Å; R142-L146 WeakPolarHBondContact O-CD1 3.19Å; R142-L146 WeakPolarHBondContact O-CG 3.39Å; R142-L146 PolarHBondContact O-N 3.39Å; Y143-L146 PolarHBondContact O-N 3.31Å
147	L	62.5	Low	62.5	Low	76 Å²	76	89.4 Å²	89.4	40%	0.398	46%	0.46	S	S	.	.	H	α-helix	trans	-100.8	-4.4	-177.9	-62.9	171.8	0	0	0	112.4	Y143 D149 V150 V151	Y143-L147 HydrophobicContact CD1-CD1 4.48Å; Y143-L147 WeakPolarHBondContact O-CB 3.42Å; Y143-L147 VanDerWaalsContact O-CG 3.26Å; Y143-L147 WeakPolarHBondContact O-CG 3.47Å; Y143-L147 PolarHBondContact O-N 2.79Å; L147-D149 PolarHBondContact O-N 3.44Å; L147-V150 PolarHBondContact O-N 2.86Å; L147-V151 HydrophobicContact CB-CG2 3.87Å; L147-V151 WeakPolarHBondContact O-CB 3.38Å; L147-V151 WeakPolarHBondContact O-CG2 3.33Å; L147-V151 PolarHBondContact O-N 2.98Å
148	W	63.5	Low	64	Low	121 Å²	121	91.8 Å²	91.8	46%	0.458	47%	0.469	S	S	.	.	H	α-helix	trans	-51	-43	-179.2	-171.5	-107.1	0	0	0	111.7	S144 V150 H152 P156	S144-W148 WeakPolarHBondContact O-CA 3.31Å; S144-W148 WeakPolarHBondContact O-CB 3.47Å; S144-W148 PolarHBondContact O-N 2.97Å; W148-V150 VanDerWaalsContact C-N 3.25Å; W148-V150 PolarHBondContact O-N 3.07Å; W148-H152 AromaticContact CD2-CE1 3.61Å; W148-H152 AromaticContact CE2-CE1 3.63Å; W148-H152 AromaticContact CE3-CE1 3.55Å; W148-H152 AromaticContact CH2-CE1 3.52Å; W148-H152 AromaticContact CH2-NE2 3.57Å; W148-H152 AromaticContact CZ2-CE1 3.6Å; W148-H152 AromaticContact CZ2-NE2 3.86Å; W148-H152 AromaticContact CZ3-CE1 3.51Å; W148-H152 AromaticContact CZ3-NE2 3.84Å; W148-H152 PolarHBondContact O-CE1 2.89Å; W148-H152 PolarHBondContact O-ND1 2.86Å; W148-P156 HydrophobicContact CZ2-CG 4.4Å
149	D	62.3	Low	65.4	Low	135 Å²	135	83.4 Å²	83.4	72%	0.722	44%	0.439	S	S	*	.	H	α-helix	trans	-71.6	-19.1	-177.5	-55.5	-11.7	0	0	0	113.3	L147	L147-D149 PolarHBondContact O-N 3.44Å
150	V	67.2	Low	66.8	Low	87 Å²	87	80.9 Å²	80.9	53%	0.527	42%	0.424	S	S	.	.	H	α-helix	trans	-111.7	-20.8	-172.3	-171.1	0	0	0	0	111.9	M90 L147 W148	M90-V150 WeakPolarHBondContact CG-O 3.49Å; M90-V150 HydrophobicContact SD-CG1 4.15Å; L147-V150 PolarHBondContact O-N 2.86Å; W148-V150 VanDerWaalsContact C-N 3.25Å; W148-V150 PolarHBondContact O-N 3.07Å
151	V	71.9	Confident	68.2	Low	44 Å²	44	78.2 Å²	78.2	27%	0.267	42%	0.415	S	S	.	.	H	α-helix	trans	-69.8	-36.6	-177.5	166.6	0	0	0	0	111.7	F87 M90 L147	F87-V151 HydrophobicContact CD1-CG1 3.76Å; F87-V151 WeakPolarHBondContact CD1-O 3.49Å; F87-V151 HydrophobicContact CE1-CG1 3.83Å; M90-V151 HydrophobicContact CE-CG2 4.31Å; M90-V151 WeakPolarHBondContact CG-O 3.37Å; L147-V151 HydrophobicContact CB-CG2 3.87Å; L147-V151 WeakPolarHBondContact O-CB 3.38Å; L147-V151 WeakPolarHBondContact O-CG2 3.33Å; L147-V151 PolarHBondContact O-N 2.98Å
152	H	72.8	Confident	69.8	Low	15 Å²	15	79.5 Å²	79.5	7%	0.069	42%	0.421	C	S	.	.			trans	-90.6	126.4	-176.4	-50.4	81.4	0	0	0	110.2	F79 F87 W148 V154	F79-H152 AromaticContact CE1-CD2 3.79Å; F79-H152 AromaticContact CZ-CD2 3.75Å; F87-H152 AromaticContact CE1-CD2 3.48Å; F87-H152 VanDerWaalsContact CE1-CD2 3.48Å; F87-H152 WeakPolarHBondContact CE1-CD2 3.41Å; F87-H152 AromaticContact CE1-NE2 3.82Å; W148-H152 AromaticContact CD2-CE1 3.61Å; W148-H152 AromaticContact CE2-CE1 3.63Å; W148-H152 AromaticContact CE3-CE1 3.55Å; W148-H152 AromaticContact CH2-CE1 3.52Å; W148-H152 AromaticContact CH2-NE2 3.57Å; W148-H152 AromaticContact CZ2-CE1 3.6Å; W148-H152 AromaticContact CZ2-NE2 3.86Å; W148-H152 AromaticContact CZ3-CE1 3.51Å; W148-H152 AromaticContact CZ3-NE2 3.84Å; W148-H152 PolarHBondContact O-CE1 2.89Å; W148-H152 PolarHBondContact O-ND1 2.86Å; H152-V154 VanDerWaalsContact C-N 3.34Å; H152-V154 VanDerWaalsContact CB-O 3.31Å; H152-V154 WeakPolarHBondContact CB-O 3.27Å
153	D	76.3	Confident	71	Confident	54 Å²	54	73.2 Å²	73.2	29%	0.289	40%	0.4	S	S	.	.	S	Bend	trans	-70.7	-36.5	171.8	-69.6	0.2	0	0	0	110.6	A86 G88 C89	A86-D153 PolarHBondContact O-N 3.47Å; G88-D153 VanDerWaalsContact CA-OD2 3.32Å; G88-D153 WeakPolarHBondContact CA-OD2 3.46Å; G88-D153 PolarHBondContact N-OD2 2.74Å; C89-D153 VanDerWaalsContact CB-OD1 3.24Å; C89-D153 WeakPolarHBondContact CB-OD1 3.38Å; C89-D153 PolarHBondContact N-OD1 2.88Å; C89-D153 PolarHBondContact N-OD2 2.87Å; C89-D153 PolarHBondContact SG-OD2 3.15Å
154	V	78.4	Confident	72.1	Confident	41 Å²	41	69.7 Å²	69.7	25%	0.248	39%	0.388	C	S	.	.	S	Bend	trans	-100.2	113.1	170.1	-177.1	0	0	0	0	108.2	H152 L159	H152-V154 VanDerWaalsContact C-N 3.34Å; H152-V154 VanDerWaalsContact CB-O 3.31Å; H152-V154 WeakPolarHBondContact CB-O 3.27Å; V154-L159 HydrophobicContact CG1-CB 4.14Å
155	P	78.7	Confident	73.6	Confident	66 Å²	66	73 Å²	73	43%	0.429	40%	0.397	S	S	.	.			trans	-55.1	133.1	179.5	-26.6	34.5	0	0	0	111.2	D157 L158 L159	P155-D157 PolarHBondContact O-N 2.69Å; P155-L158 HydrophobicContact CB-CB 4.24Å; P155-L158 PolarHBondContact O-N 3.05Å; P155-L158 VanDerWaalsContact O-N 3.07Å; P155-L159 PolarHBondContact O-N 2.71Å
156	P	73.9	Confident	74.7	Confident	21 Å²	21	72.6 Å²	72.6	14%	0.136	39%	0.386	C	S	.	.	H	α-helix	trans	-61.7	-30.1	-177.8	23.5	-32.9	0	0	0	112.4	M75 W148 L159 G160	M75-P156 HydrophobicContact CE-CB 3.93Å; M75-P156 VanDerWaalsContact CE-O 3.29Å; M75-P156 WeakPolarHBondContact CE-O 3.37Å; W148-P156 HydrophobicContact CZ2-CG 4.4Å; P156-L159 PolarHBondContact O-N 3.47Å; P156-G160 PolarHBondContact O-N 2.97Å
157	D	74.4	Confident	75.4	Confident	139 Å²	139	66.9 Å²	66.9	74%	0.743	36%	0.355	S	S	*	.	H	α-helix	trans	-66.1	-40	175.9	-62.2	-27.7	0	0	0	111.9	P155 S161	P155-D157 PolarHBondContact O-N 2.69Å; D157-S161 PolarHBondContact O-N 3.43Å; D157-S161 PolarHBondContact O-OG 3.22Å
158	L	80.8	Confident	76.2	Confident	88 Å²	88	65 Å²	65	46%	0.461	35%	0.348	S	S	.	.	H	α-helix	trans	-71.1	-42.8	176.1	179.3	64.3	0	0	0	111.2	P155 G160 S161 L162	P155-L158 HydrophobicContact CB-CB 4.24Å; P155-L158 PolarHBondContact O-N 3.05Å; P155-L158 VanDerWaalsContact O-N 3.07Å; L158-G160 VanDerWaalsContact C-N 3.28Å; L158-G160 PolarHBondContact O-N 2.99Å; L158-S161 PolarHBondContact O-N 2.94Å; L158-S161 PolarHBondContact O-OG 3.06Å; L158-L162 HydrophobicContact CD1-CD1 4.25Å; L158-L162 HydrophobicContact CD1-CG 4.3Å; L158-L162 HydrophobicContact CG-CD1 4.09Å; L158-L162 WeakPolarHBondContact O-CB 3.39Å; L158-L162 VanDerWaalsContact O-CG 3.26Å; L158-L162 WeakPolarHBondContact O-CG 2.93Å; L158-L162 PolarHBondContact O-N 3.25Å
159	L	80.1	Confident	76.9	Confident	23 Å²	23	63.3 Å²	63.3	12%	0.12	34%	0.344	C	S	.	.	H	α-helix	trans	-62.2	-40.1	175	-179	63.8	0	0	0	111.1	M75 F78 F79 V154 P155 P156 L163	M75-L159 HydrophobicContact CE-CB 4.32Å; M75-L159 HydrophobicContact CE-CD2 4.11Å; M75-L159 HydrophobicContact CE-CG 4.33Å; F78-L159 HydrophobicContact CB-CD2 4.45Å; F78-L159 HydrophobicContact CD1-CD1 4.21Å; F78-L159 HydrophobicContact CD1-CD2 3.41Å; F78-L159 VanDerWaalsContact CD1-CD2 3.41Å; F78-L159 HydrophobicContact CD1-CG 4.47Å; F78-L159 HydrophobicContact CE1-CD1 4.27Å; F78-L159 HydrophobicContact CE1-CD2 3.86Å; F78-L159 HydrophobicContact CG-CD1 4.39Å; F78-L159 HydrophobicContact CG-CD2 4.07Å; F79-L159 HydrophobicContact CE1-CD2 3.94Å; F79-L159 HydrophobicContact CZ-CD2 3.94Å; V154-L159 HydrophobicContact CG1-CB 4.14Å; P155-L159 PolarHBondContact O-N 2.71Å; P156-L159 PolarHBondContact O-N 3.47Å; L159-L163 WeakPolarHBondContact O-CB 3.31Å; L159-L163 PolarHBondContact O-N 2.99Å
160	G	77	Confident	77.5	Confident	16 Å²	16	59.8 Å²	59.8	17%	0.165	32%	0.324	C	S	.	.	H	α-helix	trans	-64.1	-43.3	176	0	0	0	0	0	112.6	P156 L158 L163 F164	P156-G160 PolarHBondContact O-N 2.97Å; L158-G160 VanDerWaalsContact C-N 3.28Å; L158-G160 PolarHBondContact O-N 2.99Å; G160-L163 PolarHBondContact O-N 3.43Å; G160-F164 WeakPolarHBondContact O-CB 3.4Å; G160-F164 PolarHBondContact O-N 2.96Å
161	S	79.1	Confident	78	Confident	61 Å²	61	58.7 Å²	58.7	43%	0.427	31%	0.31	S	S	.	.	H	α-helix	trans	-67.1	-42.2	177.6	65.5	0	0	0	0	112.5	D157 L158 F164 E165	D157-S161 PolarHBondContact O-N 3.43Å; D157-S161 PolarHBondContact O-OG 3.22Å; L158-S161 PolarHBondContact O-N 2.94Å; L158-S161 PolarHBondContact O-OG 3.06Å; S161-F164 WeakPolarHBondContact O-CB 3.29Å; S161-F164 PolarHBondContact O-N 3.07Å; S161-E165 WeakPolarHBondContact O-CB 3.39Å; S161-E165 PolarHBondContact O-N 3.5Å
162	L	82.3	Confident	78.3	Confident	89 Å²	89	60.7 Å²	60.7	47%	0.466	32%	0.319	S	S	.	.	H	α-helix	trans	-65.6	-40.8	176.2	-68.5	172.9	0	0	0	112	L158 F164 E165 E166	L158-L162 HydrophobicContact CD1-CD1 4.25Å; L158-L162 HydrophobicContact CD1-CG 4.3Å; L158-L162 HydrophobicContact CG-CD1 4.09Å; L158-L162 WeakPolarHBondContact O-CB 3.39Å; L158-L162 VanDerWaalsContact O-CG 3.26Å; L158-L162 WeakPolarHBondContact O-CG 2.93Å; L158-L162 PolarHBondContact O-N 3.25Å; L162-F164 VanDerWaalsContact C-N 3.34Å; L162-E165 PolarHBondContact O-N 3.19Å; L162-E166 PolarHBondContact O-N 3.4Å
163	L	79.8	Confident	78.4	Confident	38 Å²	38	66.1 Å²	66.1	20%	0.199	34%	0.339	C	S	.	.	H	α-helix	trans	-64.3	-40.9	174.9	179.6	62.4	0	0	0	111.2	F59 Q74 M75 L159 G160 L167	F59-L163 HydrophobicContact CE1-CD2 3.8Å; F59-L163 HydrophobicContact CE1-CG 4.23Å; F59-L163 HydrophobicContact CZ-CD2 3.78Å; F59-L163 HydrophobicContact CZ-CG 3.95Å; Q74-L163 HydrophobicContact CB-CD2 4.07Å; M75-L163 HydrophobicContact CG-CD2 4.07Å; L159-L163 WeakPolarHBondContact O-CB 3.31Å; L159-L163 PolarHBondContact O-N 2.99Å; G160-L163 PolarHBondContact O-N 3.43Å; L163-L167 HydrophobicContact CD1-CD1 4.03Å; L163-L167 HydrophobicContact CD1-CG 4.09Å; L163-L167 HydrophobicContact CG-CD1 3.93Å; L163-L167 HydrophobicContact CG-CG 4.4Å; L163-L167 WeakPolarHBondContact O-CB 3.46Å; L163-L167 VanDerWaalsContact O-CG 3.23Å; L163-L167 WeakPolarHBondContact O-CG 3.32Å; L163-L167 PolarHBondContact O-N 3.25Å
164	F	78.8	Confident	78.2	Confident	76 Å²	76	66.8 Å²	66.8	33%	0.333	34%	0.341	S	S	.	.	H	α-helix	trans	-62	-44.2	174.7	175.3	-87.1	0	0	0	111.5	P56 F59 G160 S161 L162 L167 T168	P56-F164 HydrophobicContact CB-CD2 3.54Å; P56-F164 HydrophobicContact CB-CE2 3.28Å; P56-F164 HydrophobicContact CB-CG 4.47Å; P56-F164 HydrophobicContact CB-CZ 4.02Å; P56-F164 WeakPolarHBondContact O-CD2 3.34Å; P56-F164 VanDerWaalsContact O-CE2 3.24Å; P56-F164 WeakPolarHBondContact O-CE2 3.27Å; F59-F164 HydrophobicContact CD2-CD2 4.45Å; G160-F164 WeakPolarHBondContact O-CB 3.4Å; G160-F164 PolarHBondContact O-N 2.96Å; S161-F164 WeakPolarHBondContact O-CB 3.29Å; S161-F164 PolarHBondContact O-N 3.07Å; L162-F164 VanDerWaalsContact C-N 3.34Å; F164-L167 PolarHBondContact O-N 3.48Å; F164-T168 VanDerWaalsContact O-CB 3.27Å; F164-T168 WeakPolarHBondContact O-CB 3.44Å; F164-T168 PolarHBondContact O-N 2.93Å; F164-T168 PolarHBondContact O-OG1 2.83Å
165	E	83.8	Confident	78	Confident	128 Å²	128	71 Å²	71	60%	0.598	36%	0.358	S	S	*	.	H	α-helix	trans	-60.5	-49.8	177.2	-173.3	174	-175.3	0	0	111.2	S161 L162 L167 T168 E169	S161-E165 WeakPolarHBondContact O-CB 3.39Å; S161-E165 PolarHBondContact O-N 3.5Å; L162-E165 PolarHBondContact O-N 3.19Å; E165-L167 PolarHBondContact O-N 3.47Å; E165-T168 PolarHBondContact O-N 3.31Å; E165-E169 WeakPolarHBondContact O-CB 3.39Å; E165-E169 PolarHBondContact O-N 3.45Å
166	E	82.6	Confident	78.2	Confident	78 Å²	78	70.3 Å²	70.3	36%	0.364	35%	0.349	S	S	.	.	H	α-helix	trans	-62.5	-44.1	177.8	179.1	64.5	-149.9	0	0	112.1	L162 T168 E169 Q170	L162-E166 PolarHBondContact O-N 3.4Å; E166-T168 VanDerWaalsContact C-N 3.32Å; E166-T168 PolarHBondContact O-N 3.09Å; E166-E169 PolarHBondContact O-N 3.25Å; E166-Q170 HydrophobicContact CG-CG 4.48Å; E166-Q170 WeakPolarHBondContact O-CB 2.9Å; E166-Q170 VanDerWaalsContact O-CG 3.3Å; E166-Q170 WeakPolarHBondContact O-CG 3.15Å; E166-Q170 PolarHBondContact O-N 3.45Å; E166-Q170 WeakPolarHBondContact OE1-CG 3.32Å; E166-Q170 PolarHBondContact OE1-NE2 3.21Å
167	L	78	Confident	78.7	Confident	8 Å²	8	70.3 Å²	70.3	4%	0.042	35%	0.349	C	S	.	.	H	α-helix	trans	-66.9	-35.4	178.4	-72.7	173.5	0	0	0	112.3	P54 P56 F59 L163 F164 E165 R171	P54-L167 HydrophobicContact CG-CD1 4.34Å; P54-L167 HydrophobicContact CG-CD2 4.27Å; P56-L167 HydrophobicContact CG-CB 4.24Å; F59-L167 HydrophobicContact CE2-CD1 3.42Å; F59-L167 VanDerWaalsContact CE2-CD1 3.42Å; F59-L167 HydrophobicContact CZ-CD1 3.43Å; F59-L167 VanDerWaalsContact CZ-CD1 3.43Å; L163-L167 HydrophobicContact CD1-CD1 4.03Å; L163-L167 HydrophobicContact CD1-CG 4.09Å; L163-L167 HydrophobicContact CG-CD1 3.93Å; L163-L167 HydrophobicContact CG-CG 4.4Å; L163-L167 WeakPolarHBondContact O-CB 3.46Å; L163-L167 VanDerWaalsContact O-CG 3.23Å; L163-L167 WeakPolarHBondContact O-CG 3.32Å; L163-L167 PolarHBondContact O-N 3.25Å; F164-L167 PolarHBondContact O-N 3.48Å; E165-L167 PolarHBondContact O-N 3.47Å; L167-R171 VanDerWaalsContact O-CB 3.27Å; L167-R171 WeakPolarHBondContact O-CB 3.23Å; L167-R171 PolarHBondContact O-N 3.4Å
168	T	78.8	Confident	79.2	Confident	38 Å²	38	66.2 Å²	66.2	23%	0.233	33%	0.326	C	S	.	.	H	α-helix	trans	-65.4	-46.2	173.8	-57.9	0	0	0	0	109.8	F164 E165 E166 Q170 R171 D172	F164-T168 VanDerWaalsContact O-CB 3.27Å; F164-T168 WeakPolarHBondContact O-CB 3.44Å; F164-T168 PolarHBondContact O-N 2.93Å; F164-T168 PolarHBondContact O-OG1 2.83Å; E165-T168 PolarHBondContact O-N 3.31Å; E166-T168 VanDerWaalsContact C-N 3.32Å; E166-T168 PolarHBondContact O-N 3.09Å; T168-Q170 PolarHBondContact O-N 2.91Å; T168-R171 WeakPolarHBondContact O-CB 3.1Å; T168-R171 PolarHBondContact O-N 3.35Å; T168-D172 WeakPolarHBondContact O-CB 3.35Å; T168-D172 VanDerWaalsContact O-CG 3.27Å; T168-D172 PolarHBondContact O-N 3.48Å
169	E	78.8	Confident	79.5	Confident	84 Å²	84	63.2 Å²	63.2	39%	0.393	31%	0.313	S	S	.	.	H	α-helix	trans	-63.2	-42.8	176.9	-168.7	-178.4	-171.2	0	0	112	E165 E166 R171 D172 R173	E165-E169 WeakPolarHBondContact O-CB 3.39Å; E165-E169 PolarHBondContact O-N 3.45Å; E166-E169 PolarHBondContact O-N 3.25Å; E169-R171 PolarHBondContact O-N 3.34Å; E169-D172 PolarHBondContact O-N 3.01Å; E169-R173 VanDerWaalsContact CD-CZ 3.45Å; E169-R173 HydrophobicContact CG-CG 4.44Å; E169-R173 WeakPolarHBondContact O-CB 3.24Å; E169-R173 VanDerWaalsContact O-CG 3.24Å; E169-R173 WeakPolarHBondContact O-CG 3.24Å; E169-R173 PolarHBondContact O-N 3.46Å; E169-R173 IonicContact OE1-CZ 2.99Å; E169-R173 IonicContact OE1-NE 3.98Å; E169-R173 PolarHBondContact OE1-NE 2.91Å; E169-R173 IonicContact OE1-NH2 2.67Å; E169-R173 PolarHBondContact OE1-NH2 3.28Å; E169-R173 IonicContact OE2-CZ 3.04Å; E169-R173 IonicContact OE2-NH2 3.41Å; E169-R173 PolarHBondContact OE2-NH2 3.35Å
170	Q	74.5	Confident	79.8	Confident	61 Å²	61	62.6 Å²	62.6	29%	0.285	31%	0.312	S	S	.	.	H	α-helix	trans	-63.1	-42.1	176.3	-75.3	-170.9	6.3	0	0	112.1	E166 T168 R173 M174	E166-Q170 HydrophobicContact CG-CG 4.48Å; E166-Q170 WeakPolarHBondContact O-CB 2.9Å; E166-Q170 VanDerWaalsContact O-CG 3.3Å; E166-Q170 WeakPolarHBondContact O-CG 3.15Å; E166-Q170 PolarHBondContact O-N 3.45Å; E166-Q170 WeakPolarHBondContact OE1-CG 3.32Å; E166-Q170 PolarHBondContact OE1-NE2 3.21Å; T168-Q170 PolarHBondContact O-N 2.91Å; Q170-R173 PolarHBondContact O-N 2.83Å; Q170-M174 HydrophobicContact CB-CE 4.1Å; Q170-M174 WeakPolarHBondContact O-CB 3.48Å; Q170-M174 WeakPolarHBondContact O-CE 3.19Å; Q170-M174 WeakPolarHBondContact O-CG 3.22Å; Q170-M174 PolarHBondContact O-N 2.87Å
171	R	76.9	Confident	80.5	Confident	65 Å²	65	61.9 Å²	61.9	25%	0.245	30%	0.304	C	S	.	.	H	α-helix	trans	-57.7	-50.2	172.5	165.7	-176.5	-72.8	-166.8	-11.6	110.9	P53 D55 L167 T168 E169 R173 M174 Q175	P53-R171 HydrophobicContact CG-CB 4.18Å; D55-R171 VanDerWaalsContact CA-NH2 3.26Å; D55-R171 IonicContact OD1-CZ 2.88Å; D55-R171 VanDerWaalsContact OD1-CZ 3.23Å; D55-R171 IonicContact OD1-NH1 3.68Å; D55-R171 PolarHBondContact OD1-NH1 2.88Å; D55-R171 IonicContact OD1-NH2 3.49Å; D55-R171 PolarHBondContact OD1-NH2 2.88Å; L167-R171 VanDerWaalsContact O-CB 3.27Å; L167-R171 WeakPolarHBondContact O-CB 3.23Å; L167-R171 PolarHBondContact O-N 3.4Å; T168-R171 WeakPolarHBondContact O-CB 3.1Å; T168-R171 PolarHBondContact O-N 3.35Å; E169-R171 PolarHBondContact O-N 3.34Å; R171-R173 VanDerWaalsContact C-N 3.32Å; R171-R173 PolarHBondContact O-N 3.36Å; R171-M174 WeakPolarHBondContact O-CB 3.42Å; R171-M174 PolarHBondContact O-N 3.1Å; R171-M174 VanDerWaalsContact O-N 3.14Å; R171-Q175 WeakPolarHBondContact O-CG 3.42Å; R171-Q175 PolarHBondContact O-N 3.4Å
172	D	77.9	Confident	80.9	Confident	85 Å²	85	60 Å²	60	46%	0.455	30%	0.295	S	S	.	.	H	α-helix	trans	-62.5	-43.5	-177.6	-70.8	-9.5	0	0	0	110.2	T168 E169 M174 Q175 F176	T168-D172 WeakPolarHBondContact O-CB 3.35Å; T168-D172 VanDerWaalsContact O-CG 3.27Å; T168-D172 PolarHBondContact O-N 3.48Å; E169-D172 PolarHBondContact O-N 3.01Å; D172-M174 VanDerWaalsContact C-N 3.29Å; D172-M174 PolarHBondContact O-N 3.18Å; D172-Q175 PolarHBondContact O-N 3.29Å; D172-F176 PolarHBondContact O-N 3.34Å; D172-F176 VanDerWaalsContact O-O 3.06Å
173	R	75.7	Confident	81.4	Confident	130 Å²	130	55.9 Å²	55.9	49%	0.491	27%	0.273	S	S	.	.	H	α-helix	trans	-61	-33.7	174.3	-73	171.3	178.2	178	0.3	113.2	E169 Q170 R171 F176	E169-R173 VanDerWaalsContact CD-CZ 3.45Å; E169-R173 HydrophobicContact CG-CG 4.44Å; E169-R173 WeakPolarHBondContact O-CB 3.24Å; E169-R173 VanDerWaalsContact O-CG 3.24Å; E169-R173 WeakPolarHBondContact O-CG 3.24Å; E169-R173 PolarHBondContact O-N 3.46Å; E169-R173 IonicContact OE1-CZ 2.99Å; E169-R173 IonicContact OE1-NE 3.98Å; E169-R173 PolarHBondContact OE1-NE 2.91Å; E169-R173 IonicContact OE1-NH2 2.67Å; E169-R173 PolarHBondContact OE1-NH2 3.28Å; E169-R173 IonicContact OE2-CZ 3.04Å; E169-R173 IonicContact OE2-NH2 3.41Å; E169-R173 PolarHBondContact OE2-NH2 3.35Å; Q170-R173 PolarHBondContact O-N 2.83Å; R171-R173 VanDerWaalsContact C-N 3.32Å; R171-R173 PolarHBondContact O-N 3.36Å; R173-F176 CarbonylContact O-C 3.57Å
174	M	71.5	Confident	82	Confident	68 Å²	68	54.1 Å²	54.1	34%	0.335	26%	0.264	S	S	.	.	H	α-helix	trans	-73.1	-35.9	175.5	-85.2	-178.1	-90.9	0	0	112.8	L50 P53 Q170 R171 D172	L50-M174 HydrophobicContact CD2-CE 3.79Å; L50-M174 HydrophobicContact CD2-CG 4.4Å; L50-M174 HydrophobicContact CD2-SD 3.84Å; P53-M174 HydrophobicContact CB-CE 3.73Å; P53-M174 HydrophobicContact CG-CE 3.31Å; P53-M174 HydrophobicContact CG-SD 4.27Å; Q170-M174 HydrophobicContact CB-CE 4.1Å; Q170-M174 WeakPolarHBondContact O-CB 3.48Å; Q170-M174 WeakPolarHBondContact O-CE 3.19Å; Q170-M174 WeakPolarHBondContact O-CG 3.22Å; Q170-M174 PolarHBondContact O-N 2.87Å; R171-M174 WeakPolarHBondContact O-CB 3.42Å; R171-M174 PolarHBondContact O-N 3.1Å; R171-M174 VanDerWaalsContact O-N 3.14Å; D172-M174 VanDerWaalsContact C-N 3.29Å; D172-M174 PolarHBondContact O-N 3.18Å
175	Q	74.4	Confident	82.8	Confident	128 Å²	128	50.9 Å²	50.9	60%	0.598	25%	0.25	S	S	*	.	H	α-helix	trans	-70	-44.6	174.9	-68.6	-178.9	11.5	0	0	110.8	R171 D172	R171-Q175 WeakPolarHBondContact O-CG 3.42Å; R171-Q175 PolarHBondContact O-N 3.4Å; D172-Q175 PolarHBondContact O-N 3.29Å
176	F	82.4	Confident	83.2	Confident	53 Å²	53	45.2 Å²	45.2	23%	0.232	23%	0.226	C	C	.	.			trans	-158.8	122.1	-177	179.7	-105.8	0	0	0	111.6	D172 R173 E178 L385 P428 L430	D172-F176 PolarHBondContact O-N 3.34Å; D172-F176 VanDerWaalsContact O-O 3.06Å; R173-F176 CarbonylContact O-C 3.57Å; F176-E178 HydrophobicContact CD1-CG 4.17Å; F176-E178 HydrophobicContact CE1-CG 3.79Å; F176-L385 HydrophobicContact CE2-CD2 4.19Å; F176-L385 HydrophobicContact CZ-CD2 3.77Å; F176-P428 HydrophobicContact CD2-CG 3.85Å; F176-P428 HydrophobicContact CE2-CB 4.4Å; F176-P428 HydrophobicContact CE2-CG 3.86Å; F176-L430 HydrophobicContact CD2-CD1 4.15Å; F176-L430 HydrophobicContact CE2-CD1 3.65Å; F176-L430 HydrophobicContact CE2-CD2 3.65Å; F176-L430 HydrophobicContact CE2-CG 3.82Å; F176-L430 HydrophobicContact CZ-CD1 4.3Å; F176-L430 HydrophobicContact CZ-CD2 3.78Å; F176-L430 HydrophobicContact CZ-CG 4.43Å
177	S	84.1	Confident	83.6	Confident	21 Å²	21	43 Å²	43	15%	0.147	22%	0.215	C	C	.	.			trans	-112.5	110.1	178	-173.7	0	0	0	0	111.5	A179 A180 Q450	S177-A179 PolarHBondContact O-N 3.46Å; S177-A180 PolarHBondContact O-N 2.88Å; S177-Q450 VanDerWaalsContact N-OE1 3.17Å; S177-Q450 PolarHBondContact O-OE1 3.2Å
178	E	86.3	Confident	84.2	Confident	53 Å²	53	42.8 Å²	42.8	25%	0.248	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-62.7	-28.6	178	-40.3	-158.7	130	0	0	111.9	F176 A180 T181 S330 R349	F176-E178 HydrophobicContact CD1-CG 4.17Å; F176-E178 HydrophobicContact CE1-CG 3.79Å; E178-A180 PolarHBondContact O-N 2.89Å; E178-A180 VanDerWaalsContact O-N 3.15Å; E178-T181 WeakPolarHBondContact O-CB 3.49Å; E178-T181 PolarHBondContact O-N 2.96Å; E178-T181 VanDerWaalsContact O-N 3.1Å; E178-T181 PolarHBondContact O-OG1 3.45Å; E178-S330 WeakPolarHBondContact OE1-CB 3.49Å; E178-S330 PolarHBondContact OE1-OG 3.32Å; E178-S330 PolarHBondContact OE2-OG 2.92Å; E178-R349 IonicContact OE1-CZ 2.65Å; E178-R349 IonicContact OE1-NE 2.7Å; E178-R349 PolarHBondContact OE1-NE 2.83Å; E178-R349 IonicContact OE1-NH2 3.33Å; E178-R349 PolarHBondContact OE1-NH2 2.88Å; E178-R349 IonicContact OE2-NH2 3.56Å
179	A	85.9	Confident	84.5	Confident	25 Å²	25	44.6 Å²	44.6	21%	0.207	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-60.4	-26.9	-179	0	0	0	0	0	112.9	S177 T181 R255	S177-A179 PolarHBondContact O-N 3.46Å; A179-T181 VanDerWaalsContact C-N 3.29Å; A179-T181 PolarHBondContact O-N 2.94Å; A179-R255 PolarHBondContact O-NH2 3.47Å
180	A	86.9	Confident	84.6	Confident	10 Å²	10	42.6 Å²	42.6	8%	0.083	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-79	-6.9	-179.8	0	0	0	0	0	114.1	S177 E178 G182 G183 F431	S177-A180 PolarHBondContact O-N 2.88Å; E178-A180 PolarHBondContact O-N 2.89Å; E178-A180 VanDerWaalsContact O-N 3.15Å; A180-G182 PolarHBondContact O-N 2.9Å; A180-G183 PolarHBondContact O-N 2.81Å; A180-F431 HydrophobicContact CB-CE1 4.39Å; A180-F431 HydrophobicContact CB-CZ 4.4Å; A180-F431 WeakPolarHBondContact O-CE1 3.43Å
181	T	91.3	Very high	84.6	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	132.4	-176	-50.1	0	0	0	0	112.3	E178 A179 G183 R255 W332 W334 L386 L430	E178-T181 WeakPolarHBondContact O-CB 3.49Å; E178-T181 PolarHBondContact O-N 2.96Å; E178-T181 VanDerWaalsContact O-N 3.1Å; E178-T181 PolarHBondContact O-OG1 3.45Å; A179-T181 VanDerWaalsContact C-N 3.29Å; A179-T181 PolarHBondContact O-N 2.94Å; T181-G183 VanDerWaalsContact C-N 3.27Å; T181-G183 PolarHBondContact O-N 2.89Å; T181-R255 PolarHBondContact O-NH2 3Å; T181-W332 HydrophobicContact CG2-CZ2 3.96Å; T181-W334 HydrophobicContact CG2-CE3 4.08Å; T181-W334 HydrophobicContact CG2-CH2 4.34Å; T181-W334 HydrophobicContact CG2-CZ3 3.7Å; T181-L386 HydrophobicContact CG2-CD1 3.79Å; T181-L430 HydrophobicContact CG2-CD2 4.47Å
182	G	87.4	Confident	84.1	Confident	23 Å²	23	47.6 Å²	47.6	24%	0.237	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.5	-27	-178.1	0	0	0	0	0	114.5	A180 L430	A180-G182 PolarHBondContact O-N 2.9Å; G182-L430 PolarHBondContact N-O 2.8Å; G182-L430 VanDerWaalsContact N-O 3.09Å
183	G	92.9	Very high	83.6	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.01	23%	0.234	C	C	.	.			trans	79.9	150.5	172.4	0	0	0	0	0	115.9	A180 T181 Q240 I241 F431 A507	A180-G183 PolarHBondContact O-N 2.81Å; T181-G183 VanDerWaalsContact C-N 3.27Å; T181-G183 PolarHBondContact O-N 2.89Å; G183-Q240 CarbonylContact O-C 3.48Å; G183-Q240 VanDerWaalsContact O-CA 3.26Å; G183-Q240 WeakPolarHBondContact O-CA 3.46Å; G183-I241 PolarHBondContact O-N 3.38Å; G183-F431 VanDerWaalsContact CA-CD1 3.47Å; G183-A507 WeakPolarHBondContact CA-O 3.26Å
184	A	93.7	Very high	83.8	Confident	2 Å²	2	40.2 Å²	40.2	2%	0.017	22%	0.22	C	C	.	.	S	Bend	trans	-98.5	21.5	-175.6	0	0	0	0	0	113.7	P200 V238 I241 A507 L527	A184-P200 HydrophobicContact CB-CG 4.02Å; A184-P200 WeakPolarHBondContact O-CD 3.47Å; A184-V238 HydrophobicContact CB-CG1 3.93Å; A184-I241 WeakPolarHBondContact O-CD1 3.19Å; A184-A507 PolarHBondContact N-O 3.06Å; A184-L527 HydrophobicContact CB-CD2 4.24Å
185	L	94.8	Very high	84.5	Confident	7 Å²	7	37 Å²	37	4%	0.037	20%	0.204	C	C	.	.			trans	-128	127.1	-179.2	-176	69.7	0	0	0	109.2	L197 T510 L525 L527	L185-L197 HydrophobicContact CD1-CD1 4.03Å; L185-T510 HydrophobicContact CD2-CG2 3.77Å; L185-T510 HydrophobicContact CG-CG2 3.75Å; L185-L525 HydrophobicContact CD2-CB 4Å; L185-L525 WeakPolarHBondContact CD2-O 3.29Å; L185-L527 HydrophobicContact CB-CB 4.05Å; L185-L527 HydrophobicContact CB-CD2 4.27Å; L185-L527 HydrophobicContact CD1-CB 4.33Å; L185-L527 HydrophobicContact CD2-CB 3.97Å; L185-L527 HydrophobicContact CG-CB 4.35Å
186	A	93	Very high	85.2	Confident	10 Å²	10	31 Å²	31	8%	0.083	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	153.7	177.3	0	0	0	0	0	111.3	L198 I241	A186-L198 HydrophobicContact CB-CB 4.39Å; A186-L198 HydrophobicContact CB-CD1 4.29Å; A186-L198 PolarHBondContact N-O 2.95Å; A186-L198 VanDerWaalsContact N-O 3.16Å; A186-L198 WeakPolarHBondContact O-CB 3.34Å; A186-L198 PolarHBondContact O-N 2.99Å; A186-I241 HydrophobicContact CB-CB 4.15Å; A186-I241 HydrophobicContact CB-CG2 3.7Å
187	F	90.8	Very high	85.7	Confident	32 Å²	32	28.6 Å²	28.6	14%	0.14	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	133.7	170.7	179.6	-91.3	0	0	0	110.1	P189 G195 C196 L197 T510 L512	F187-P189 HydrophobicContact CD1-CB 4.47Å; F187-P189 HydrophobicContact CE1-CB 3.9Å; F187-G195 VanDerWaalsContact CZ-CA 3.46Å; F187-C196 WeakPolarHBondContact CA-O 3.39Å; F187-L197 HydrophobicContact CD2-CB 4.41Å; F187-L197 HydrophobicContact CD2-CD1 4.45Å; F187-T510 HydrophobicContact CB-CG2 4.22Å; F187-T510 PolarHBondContact N-OG1 3.21Å; F187-L512 HydrophobicContact CB-CD2 4.16Å; F187-L512 HydrophobicContact CD1-CD2 3.04Å; F187-L512 HydrophobicContact CD1-CG 4.29Å; F187-L512 HydrophobicContact CD2-CD1 4.46Å; F187-L512 HydrophobicContact CD2-CD2 3.68Å; F187-L512 HydrophobicContact CE1-CD2 3.02Å; F187-L512 HydrophobicContact CE1-CG 4.47Å; F187-L512 HydrophobicContact CE2-CD2 3.67Å; F187-L512 HydrophobicContact CG-CD2 3.34Å; F187-L512 HydrophobicContact CG-CG 4.27Å; F187-L512 HydrophobicContact CZ-CD2 3.33Å
188	V	89.1	Confident	86.1	Confident	3 Å²	3	27.6 Å²	27.6	2%	0.018	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	111.7	176.6	-179.3	0	0	0	0	108.5	F190 G195 C196 L198 C243 S250 V252 M265	V188-F190 HydrophobicContact CG1-CD1 4.45Å; V188-F190 HydrophobicContact CG1-CE1 4.11Å; V188-G195 CarbonylContact O-C 3.58Å; V188-G195 WeakPolarHBondContact O-CA 3.39Å; V188-C196 PolarHBondContact N-O 3.47Å; V188-C196 PolarHBondContact O-N 3.43Å; V188-L198 HydrophobicContact CG2-CD1 3.85Å; V188-C243 HydrophobicContact CG2-CB 3.98Å; V188-S250 WeakPolarHBondContact CG1-OG 3.39Å; V188-V252 HydrophobicContact CG2-CG2 4.31Å; V188-M265 HydrophobicContact CB-CE 4.11Å; V188-M265 HydrophobicContact CG1-CE 4.17Å; V188-M265 HydrophobicContact CG2-CE 4.27Å
189	P	85.4	Confident	86.4	Confident	75 Å²	75	25.2 Å²	25.2	49%	0.487	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	132.7	176.1	28.7	-31.9	0	0	0	110.8	F187	F187-P189 HydrophobicContact CD1-CB 4.47Å; F187-P189 HydrophobicContact CE1-CB 3.9Å
190	F	81.3	Confident	86.7	Confident	42 Å²	42	24 Å²	24	18%	0.184	14%	0.138	C	C	.	.	S	Bend	trans	-101	-40.7	168.3	-60.3	-38.2	0	0	0	111.1	V188 D194 C196 M265 D267	V188-F190 HydrophobicContact CG1-CD1 4.45Å; V188-F190 HydrophobicContact CG1-CE1 4.11Å; F190-D194 PolarHBondContact N-O 3.16Å; F190-C196 HydrophobicContact CE2-CB 3.81Å; F190-C196 HydrophobicContact CZ-CB 3.66Å; F190-M265 HydrophobicContact CE1-CE 3.84Å; F190-M265 HydrophobicContact CE1-CG 4.33Å; F190-M265 HydrophobicContact CE1-SD 4.42Å; F190-M265 HydrophobicContact CZ-CE 3.62Å; F190-M265 HydrophobicContact CZ-CG 4Å; F190-M265 HydrophobicContact CZ-SD 3.76Å; F190-D267 HydrophobicContact CB-CB 4.09Å; F190-D267 HydrophobicContact CD1-CB 4.41Å; F190-D267 HydrophobicContact CG-CB 4.19Å
191	S	74.1	Confident	86.6	Confident	55 Å²	55	23.6 Å²	23.6	39%	0.385	14%	0.135	S	C	.	.	S	Bend	trans	-139.8	-176.6	176	79.5	0	0	0	0	110.4	S193 D194	S191-S193 PolarHBondContact O-N 2.72Å; S191-S193 PolarHBondContact OG-N 2.82Å; S191-D194 PolarHBondContact N-O 2.89Å; S191-D194 WeakPolarHBondContact OG-CB 3.48Å; S191-D194 PolarHBondContact OG-N 3.11Å
192	Q	67.1	Low	86	Confident	176 Å²	176	25.4 Å²	25.4	82%	0.822	15%	0.154	S	C	*	.	S	Bend	trans	-65.9	-21.4	176.8	-69.2	-175.9	-7.8	0	0	113.6
193	S	67.1	Low	85.4	Confident	22 Å²	22	29.3 Å²	29.3	15%	0.154	17%	0.169	C	C	.	.	S	Bend	trans	-118.2	-15.2	-179.1	59.7	0	0	0	0	114	S191 L215	S191-S193 PolarHBondContact O-N 2.72Å; S191-S193 PolarHBondContact OG-N 2.82Å; S193-L215 WeakPolarHBondContact O-CB 3.21Å; S193-L215 PolarHBondContact O-N 3.15Å
194	D	80.6	Confident	84.7	Confident	38 Å²	38	31.2 Å²	31.2	20%	0.203	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	143	-170.6	-56.7	7.8	0	0	0	110.3	F190 S191	F190-D194 PolarHBondContact N-O 3.16Å; S191-D194 PolarHBondContact N-O 2.89Å; S191-D194 WeakPolarHBondContact OG-CB 3.48Å; S191-D194 PolarHBondContact OG-N 3.11Å
195	G	85.6	Confident	84.3	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.1	-168.2	171	0	0	0	0	0	112.6	F187 V188 R212 V213	F187-G195 VanDerWaalsContact CZ-CA 3.46Å; V188-G195 CarbonylContact O-C 3.58Å; V188-G195 WeakPolarHBondContact O-CA 3.39Å; G195-R212 WeakPolarHBondContact O-CA 3.25Å; G195-V213 PolarHBondContact N-O 2.85Å; G195-V213 VanDerWaalsContact N-O 3.09Å; G195-V213 PolarHBondContact O-N 3.42Å
196	C	89.4	Confident	84	Confident	4 Å²	4	34 Å²	34	3%	0.027	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	120.8	-179	-174.5	0	0	0	0	110.7	F187 V188 F190 H211 M265	F187-C196 WeakPolarHBondContact CA-O 3.39Å; V188-C196 PolarHBondContact N-O 3.47Å; V188-C196 PolarHBondContact O-N 3.43Å; F190-C196 HydrophobicContact CE2-CB 3.81Å; F190-C196 HydrophobicContact CZ-CB 3.66Å; C196-H211 CarbonylContact C-O 3.6Å; C196-H211 WeakPolarHBondContact CA-O 3.49Å; C196-M265 HydrophobicContact CB-CE 3.62Å; C196-M265 HydrophobicContact CB-SD 4.03Å
197	L	91.8	Very high	83.9	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	127.3	170.9	-173.8	68.7	0	0	0	109.7	L34 L185 F187 Y199 H211 V213 T510 L525	L34-L197 HydrophobicContact CD2-CD2 3.92Å; L185-L197 HydrophobicContact CD1-CD1 4.03Å; F187-L197 HydrophobicContact CD2-CB 4.41Å; F187-L197 HydrophobicContact CD2-CD1 4.45Å; L197-Y199 HydrophobicContact CD2-CD1 4.03Å; L197-Y199 HydrophobicContact CD2-CE1 4.32Å; L197-Y199 HydrophobicContact CG-CD1 4Å; L197-H211 PolarHBondContact N-O 3.28Å; L197-H211 PolarHBondContact O-N 2.83Å; L197-V213 HydrophobicContact CB-CG2 3.91Å; L197-T510 HydrophobicContact CD1-CG2 4.19Å; L197-L525 HydrophobicContact CD1-CD2 4.16Å; L197-L525 HydrophobicContact CD2-CD2 4.09Å
198	L	93.5	Very high	84	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	119.4	-179.5	-55.6	175.5	0	0	0	109.4	A186 V188 N209 F210 I241 C243 V252	A186-L198 HydrophobicContact CB-CB 4.39Å; A186-L198 HydrophobicContact CB-CD1 4.29Å; A186-L198 PolarHBondContact N-O 2.95Å; A186-L198 VanDerWaalsContact N-O 3.16Å; A186-L198 WeakPolarHBondContact O-CB 3.34Å; A186-L198 PolarHBondContact O-N 2.99Å; V188-L198 HydrophobicContact CG2-CD1 3.85Å; L198-N209 WeakPolarHBondContact CA-O 3.28Å; L198-F210 HydrophobicContact CD2-CB 4.25Å; L198-F210 HydrophobicContact CD2-CD1 3.08Å; L198-F210 HydrophobicContact CD2-CD2 4.47Å; L198-F210 HydrophobicContact CD2-CE1 3.37Å; L198-F210 HydrophobicContact CD2-CG 3.69Å; L198-F210 HydrophobicContact CD2-CZ 4.18Å; L198-I241 HydrophobicContact CB-CD1 4.09Å; L198-I241 HydrophobicContact CB-CG2 4.42Å; L198-I241 HydrophobicContact CD1-CG2 4Å; L198-C243 VanDerWaalsContact CD1-SG 3.52Å; L198-V252 HydrophobicContact CD1-CB 4.36Å; L198-V252 HydrophobicContact CD1-CG1 3.63Å; L198-V252 HydrophobicContact CD1-CG2 3.75Å
199	Y	92.8	Very high	84.1	Confident	3 Å²	3	37.1 Å²	37.1	1%	0.012	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	144.7	179.6	62.3	-86.6	0	0	0	111.8	L35 L197 N209 H211	L35-Y199 HydrophobicContact CD1-CD2 4.28Å; L35-Y199 HydrophobicContact CD1-CE1 4.27Å; L35-Y199 HydrophobicContact CD1-CE2 3.63Å; L197-Y199 HydrophobicContact CD2-CD1 4.03Å; L197-Y199 HydrophobicContact CD2-CE1 4.32Å; L197-Y199 HydrophobicContact CG-CD1 4Å; Y199-N209 HydrophobicContact CD1-CB 4.41Å; Y199-N209 HydrophobicContact CD2-CB 4.21Å; Y199-N209 HydrophobicContact CE1-CB 4.09Å; Y199-N209 HydrophobicContact CE2-CB 3.83Å; Y199-N209 WeakPolarHBondContact CE2-ND2 3.42Å; Y199-N209 HydrophobicContact CG-CB 4.48Å; Y199-N209 PolarHBondContact N-O 3.21Å; Y199-N209 WeakPolarHBondContact O-CB 3.34Å; Y199-N209 PolarHBondContact O-N 3.15Å; Y199-N209 PolarHBondContact O-ND2 3.4Å; Y199-N209 VanDerWaalsContact O-ND2 3.16Å; Y199-H211 HydrophobicContact CE1-CB 3.66Å; Y199-H211 AromaticContact CE1-ND1 3.9Å; Y199-H211 PolarHBondContact OH-ND1 3.49Å
200	P	92.6	Very high	84.5	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	160.3	171.9	31	-38	0	0	0	112.2	A184 M205 R207 V238 L527	A184-P200 HydrophobicContact CB-CG 4.02Å; A184-P200 WeakPolarHBondContact O-CD 3.47Å; P200-M205 HydrophobicContact CB-CB 4.11Å; P200-M205 HydrophobicContact CB-CE 4.1Å; P200-M205 HydrophobicContact CB-SD 4.11Å; P200-M205 HydrophobicContact CG-CE 3.35Å; P200-M205 HydrophobicContact CG-SD 4Å; P200-R207 CarbonylContact C-O 3.59Å; P200-R207 WeakPolarHBondContact CA-O 3.26Å; P200-V238 HydrophobicContact CB-CB 3.86Å; P200-V238 HydrophobicContact CB-CG2 3.99Å; P200-V238 HydrophobicContact CG-CB 4.37Å; P200-L527 HydrophobicContact CG-CD2 3.73Å
201	G	84.5	Confident	84.8	Confident	1 Å²	1	32.1 Å²	32.1	1%	0.01	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	-171.7	171.9	0	0	0	0	0	110.2	M205 D206 R207	G201-M205 CarbonylContact O-C 3.59Å; G201-M205 WeakPolarHBondContact O-CA 3.48Å; G201-D206 PolarHBondContact O-N 3.21Å; G201-D206 VanDerWaalsContact O-N 3.11Å; G201-R207 PolarHBondContact N-O 2.76Å; G201-R207 WeakPolarHBondContact O-CA 3.42Å; G201-R207 WeakPolarHBondContact O-CB 3.46Å; G201-R207 PolarHBondContact O-N 3.09Å
202	G	78.7	Confident	85.4	Confident	39 Å²	39	33.5 Å²	33.5	40%	0.402	18%	0.179	S	C	.	.	S	Bend	trans	86.9	165.9	-167.1	0	0	0	0	0	110.6	G204 M205	G202-G204 VanDerWaalsContact C-N 3.25Å; G202-G204 PolarHBondContact O-N 3.35Å; G202-M205 PolarHBondContact O-N 3.44Å
203	L	74	Confident	86.2	Confident	104 Å²	104	25.2 Å²	25.2	55%	0.545	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-30.5	-177.5	-70.5	169.7	0	0	0	111.9	C39 F40	C39-L203 VanDerWaalsContact O-CD2 3.29Å; C39-L203 WeakPolarHBondContact O-CD2 3.49Å; F40-L203 HydrophobicContact CD2-CD2 4.41Å
204	G	78.4	Confident	86.7	Confident	42 Å²	42	26.6 Å²	26.6	43%	0.433	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	16.7	179.5	0	0	0	0	0	114	G202 D206 P237	G202-G204 VanDerWaalsContact C-N 3.25Å; G202-G204 PolarHBondContact O-N 3.35Å; G204-D206 PolarHBondContact O-N 2.61Å; G204-D206 VanDerWaalsContact O-N 3.15Å; G204-P237 WeakPolarHBondContact O-CA 3.44Å; G204-P237 WeakPolarHBondContact O-CB 3.27Å
205	M	84.9	Confident	86.1	Confident	23 Å²	23	25.4 Å²	25.4	11%	0.113	14%	0.141	C	C	.	.	S	Bend	trans	54.3	31	-172.7	-61.7	-69.9	-96.2	0	0	112.8	P200 G201 G202 P237 V238 A507 L527	P200-M205 HydrophobicContact CB-CB 4.11Å; P200-M205 HydrophobicContact CB-CE 4.1Å; P200-M205 HydrophobicContact CB-SD 4.11Å; P200-M205 HydrophobicContact CG-CE 3.35Å; P200-M205 HydrophobicContact CG-SD 4Å; G201-M205 CarbonylContact O-C 3.59Å; G201-M205 WeakPolarHBondContact O-CA 3.48Å; G202-M205 PolarHBondContact O-N 3.44Å; M205-P237 HydrophobicContact CB-CB 4.42Å; M205-P237 WeakPolarHBondContact O-CA 3.44Å; M205-V238 PolarHBondContact O-N 3.41Å; M205-A507 HydrophobicContact CE-CB 4.42Å; M205-L527 HydrophobicContact CE-CD1 4.4Å; M205-L527 HydrophobicContact CE-CD2 4.01Å; M205-L527 HydrophobicContact CE-CG 4.35Å
206	D	89.3	Confident	85	Confident	43 Å²	43	29.8 Å²	29.8	23%	0.23	16%	0.161	C	C	.	.			trans	-99.5	0.2	-169.1	60.3	-34.4	0	0	0	113.3	G201 G204 Q233 L234 G236	G201-D206 PolarHBondContact O-N 3.21Å; G201-D206 VanDerWaalsContact O-N 3.11Å; G204-D206 PolarHBondContact O-N 2.61Å; G204-D206 VanDerWaalsContact O-N 3.15Å; D206-Q233 VanDerWaalsContact CG-NE2 3.32Å; D206-Q233 PolarHBondContact O-NE2 3.4Å; D206-Q233 PolarHBondContact OD2-NE2 3.15Å; D206-L234 WeakPolarHBondContact O-CA 3.31Å; D206-L234 WeakPolarHBondContact O-CB 3.32Å; D206-L234 PolarHBondContact O-N 3.03Å; D206-G236 WeakPolarHBondContact CA-O 3.44Å
207	R	90.4	Very high	83.3	Confident	110 Å²	110	38.6 Å²	38.6	42%	0.415	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	108.4	178.5	-179.8	178.7	167	158.4	6.2	111.4	P200 G201 N209 S231 F232	P200-R207 CarbonylContact C-O 3.59Å; P200-R207 WeakPolarHBondContact CA-O 3.26Å; G201-R207 PolarHBondContact N-O 2.76Å; G201-R207 WeakPolarHBondContact O-CA 3.42Å; G201-R207 WeakPolarHBondContact O-CB 3.46Å; G201-R207 PolarHBondContact O-N 3.09Å; R207-N209 PolarHBondContact O-ND2 2.92Å; R207-S231 PolarHBondContact NE-OG 2.98Å; R207-S231 PolarHBondContact NH2-OG 3.45Å; R207-F232 CarbonylContact C-O 3.56Å; R207-F232 WeakPolarHBondContact CA-O 3.41Å
208	L	93.3	Very high	80.9	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	128.7	177.2	-178.7	65.2	0	0	0	110.8	F210 S231 F232 L234 I241 V254 W263	L208-F210 HydrophobicContact CD2-CE2 3.5Å; L208-F210 VanDerWaalsContact CD2-CE2 3.5Å; L208-F210 HydrophobicContact CD2-CZ 3.77Å; L208-F210 HydrophobicContact CG-CD2 4.35Å; L208-F210 HydrophobicContact CG-CE2 3.75Å; L208-F210 HydrophobicContact CG-CZ 4.33Å; L208-S231 CarbonylContact O-C 3.59Å; L208-S231 VanDerWaalsContact O-CA 3.27Å; L208-S231 WeakPolarHBondContact O-CA 3.29Å; L208-F232 PolarHBondContact N-O 2.93Å; L208-F232 PolarHBondContact O-N 3.33Å; L208-L234 HydrophobicContact CB-CD1 4.21Å; L208-I241 HydrophobicContact CD1-CD1 3.81Å; L208-V254 HydrophobicContact CD1-CG2 4.37Å; L208-V254 HydrophobicContact CD2-CG2 3.75Å; L208-W263 HydrophobicContact CD2-CD2 4.21Å; L208-W263 HydrophobicContact CD2-CE3 4.28Å; L208-W263 HydrophobicContact CD2-CH2 4.1Å; L208-W263 HydrophobicContact CD2-CZ2 3.98Å; L208-W263 HydrophobicContact CD2-CZ3 4.25Å
209	N	92.1	Very high	78.5	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	130.1	179.5	-53.3	-67.8	0	0	0	110.8	L198 Y199 R207 P229 V230 S231	L198-N209 WeakPolarHBondContact CA-O 3.28Å; Y199-N209 HydrophobicContact CD1-CB 4.41Å; Y199-N209 HydrophobicContact CD2-CB 4.21Å; Y199-N209 HydrophobicContact CE1-CB 4.09Å; Y199-N209 HydrophobicContact CE2-CB 3.83Å; Y199-N209 WeakPolarHBondContact CE2-ND2 3.42Å; Y199-N209 HydrophobicContact CG-CB 4.48Å; Y199-N209 PolarHBondContact N-O 3.21Å; Y199-N209 WeakPolarHBondContact O-CB 3.34Å; Y199-N209 PolarHBondContact O-N 3.15Å; Y199-N209 PolarHBondContact O-ND2 3.4Å; Y199-N209 VanDerWaalsContact O-ND2 3.16Å; R207-N209 PolarHBondContact O-ND2 2.92Å; N209-P229 HydrophobicContact CB-CB 4.22Å; N209-V230 WeakPolarHBondContact CA-O 3.21Å; N209-S231 WeakPolarHBondContact OD1-CB 3.39Å; N209-S231 PolarHBondContact OD1-OG 3.03Å
210	F	91.9	Very high	76.2	Confident	5 Å²	5	52.7 Å²	52.7	2%	0.022	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	105.7	170.2	-66.5	-103.5	0	0	0	107.6	L198 L208 P229 V230 F232 V252 W263 M265 P271	L198-F210 HydrophobicContact CD2-CB 4.25Å; L198-F210 HydrophobicContact CD2-CD1 3.08Å; L198-F210 HydrophobicContact CD2-CD2 4.47Å; L198-F210 HydrophobicContact CD2-CE1 3.37Å; L198-F210 HydrophobicContact CD2-CG 3.69Å; L198-F210 HydrophobicContact CD2-CZ 4.18Å; L208-F210 HydrophobicContact CD2-CE2 3.5Å; L208-F210 VanDerWaalsContact CD2-CE2 3.5Å; L208-F210 HydrophobicContact CD2-CZ 3.77Å; L208-F210 HydrophobicContact CG-CD2 4.35Å; L208-F210 HydrophobicContact CG-CE2 3.75Å; L208-F210 HydrophobicContact CG-CZ 4.33Å; F210-P229 CarbonylContact O-C 3.55Å; F210-P229 VanDerWaalsContact O-CA 3.26Å; F210-P229 WeakPolarHBondContact O-CA 3.38Å; F210-P229 WeakPolarHBondContact O-CB 3.3Å; F210-V230 HydrophobicContact CB-CB 4.36Å; F210-V230 PolarHBondContact N-O 3.5Å; F210-V230 PolarHBondContact O-N 2.91Å; F210-F232 AromaticContact CD2-CD2 3.78Å; F210-F232 HydrophobicContact CD2-CD2 3.78Å; F210-F232 AromaticContact CD2-CE2 3.78Å; F210-F232 HydrophobicContact CD2-CE2 3.78Å; F210-F232 AromaticContact CE2-CD2 3.59Å; F210-F232 HydrophobicContact CE2-CD2 3.59Å; F210-F232 AromaticContact CE2-CE2 3.74Å; F210-F232 HydrophobicContact CE2-CE2 3.74Å; F210-V252 HydrophobicContact CE1-CG2 4.46Å; F210-W263 HydrophobicContact CE1-CB 4.46Å; F210-W263 HydrophobicContact CE2-CG 4.4Å; F210-W263 HydrophobicContact CZ-CB 3.95Å; F210-W263 AromaticContact CZ-CD1 3.88Å; F210-W263 HydrophobicContact CZ-CD2 4.33Å; F210-W263 AromaticContact CZ-CG 3.8Å; F210-W263 HydrophobicContact CZ-CG 3.8Å; F210-M265 HydrophobicContact CD1-CE 4.3Å; F210-M265 HydrophobicContact CD1-SD 3.74Å; F210-M265 HydrophobicContact CE1-SD 4.32Å; F210-P271 HydrophobicContact CB-CB 4.47Å; F210-P271 HydrophobicContact CB-CG 3.83Å; F210-P271 HydrophobicContact CD1-CB 3.56Å; F210-P271 HydrophobicContact CD1-CG 3.88Å; F210-P271 HydrophobicContact CD2-CB 4.13Å; F210-P271 HydrophobicContact CD2-CG 4.01Å; F210-P271 HydrophobicContact CE1-CB 3.72Å; F210-P271 HydrophobicContact CE1-CG 4.48Å; F210-P271 HydrophobicContact CE2-CB 4.25Å; F210-P271 HydrophobicContact CG-CB 3.81Å; F210-P271 HydrophobicContact CG-CG 3.65Å; F210-P271 HydrophobicContact CZ-CB 4.08Å
211	H	89.4	Confident	74.2	Confident	7 Å²	7	53.6 Å²	53.6	3%	0.032	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	111	-176.9	-160.7	152.6	0	0	0	109.1	C196 L197 Y199 V213 T225 Q227 P229	C196-H211 CarbonylContact C-O 3.6Å; C196-H211 WeakPolarHBondContact CA-O 3.49Å; L197-H211 PolarHBondContact N-O 3.28Å; L197-H211 PolarHBondContact O-N 2.83Å; Y199-H211 HydrophobicContact CE1-CB 3.66Å; Y199-H211 AromaticContact CE1-ND1 3.9Å; Y199-H211 PolarHBondContact OH-ND1 3.49Å; H211-V213 PolarHBondContact O-N 3.32Å; H211-T225 PolarHBondContact NE2-O 2.96Å; H211-T225 VanDerWaalsContact NE2-O 3.09Å; H211-Q227 PolarHBondContact NE2-O 3.06Å; H211-P229 HydrophobicContact CB-CB 3.96Å
212	R	86.6	Confident	72.7	Confident	85 Å²	85	55.9 Å²	55.9	32%	0.321	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	122.3	172.2	-166.4	175.2	-174.6	149.8	11	109.1	G195 D267	G195-R212 WeakPolarHBondContact O-CA 3.25Å; R212-D267 IonicContact CZ-OD1 3.36Å; R212-D267 PolarHBondContact NH1-O 2.75Å; R212-D267 VanDerWaalsContact NH1-O 3.16Å; R212-D267 PolarHBondContact NH2-O 3.48Å; R212-D267 IonicContact NH2-OD1 3.46Å; R212-D267 PolarHBondContact NH2-OD1 3Å
213	V	82.5	Confident	71.9	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.012	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	133.5	-179.4	-177.8	0	0	0	0	108.3	G195 L197 H211 M223 T225	G195-V213 PolarHBondContact N-O 2.85Å; G195-V213 VanDerWaalsContact N-O 3.09Å; G195-V213 PolarHBondContact O-N 3.42Å; L197-V213 HydrophobicContact CB-CG2 3.91Å; H211-V213 PolarHBondContact O-N 3.32Å; V213-M223 HydrophobicContact CG1-CB 3.82Å; V213-M223 HydrophobicContact CG1-CE 3.72Å; V213-M223 HydrophobicContact CG1-CG 3.9Å; V213-M223 HydrophobicContact CG1-SD 3.78Å; V213-T225 HydrophobicContact CG2-CG2 4.45Å
214	V	77.8	Confident	71.3	Confident	50 Å²	50	53.2 Å²	53.2	30%	0.303	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	129.2	173.5	179.3	0	0	0	0	107.6	D224	V214-D224 PolarHBondContact O-N 2.68Å; V214-D224 VanDerWaalsContact O-N 3.08Å
215	L	69.6	Low	70.6	Confident	14 Å²	14	53.2 Å²	53.2	7%	0.073	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	115.5	169.4	-117.8	75.9	0	0	0	108.4	S193 M223 R514 I523	S193-L215 WeakPolarHBondContact O-CB 3.21Å; S193-L215 PolarHBondContact O-N 3.15Å; L215-M223 HydrophobicContact CD1-CE 3.6Å; L215-M223 HydrophobicContact CD1-CG 4.01Å; L215-R514 HydrophobicContact CD2-CB 4.37Å; L215-I523 HydrophobicContact CD1-CD1 3.8Å; L215-I523 HydrophobicContact CD2-CD1 3.73Å; L215-I523 HydrophobicContact CG-CD1 3.99Å
216	E	61.6	Low	69.4	Low	91 Å²	91	55.2 Å²	55.2	43%	0.425	31%	0.313	S	S	.	.			trans	-62.1	146.8	178.4	-72.8	-170.1	154.4	0	0	111.9	C222 D224 R514	E216-C222 PolarHBondContact N-O 3.33Å; E216-D224 HydrophobicContact CG-CB 4.37Å; E216-R514 PolarHBondContact O-NH1 2.79Å
217	R	52.8	Low	68.6	Low	190 Å²	190	58.6 Å²	58.6	72%	0.717	33%	0.328	S	S	*	.	S	Bend	trans	-83.7	-17.4	-172	-76.2	-177.2	-178.2	171.4	2.1	114
218	D	42.4	Very low	68.2	Low	141 Å²	141	62.8 Å²	62.8	75%	0.754	35%	0.349	S	S	*	.	S	Bend	trans	-105.4	88.9	-162.6	-63.3	-19.7	0	0	0	112.9	S220	D218-S220 PolarHBondContact O-N 2.91Å
219	G	43.2	Very low	67.9	Low	87 Å²	87	64.8 Å²	64.8	90%	0.897	36%	0.362	S	S	*	.	S	Bend	trans	63.8	-15.6	157.6	0	0	0	0	0	118.9
220	S	44.9	Very low	67.8	Low	72 Å²	72	67.2 Å²	67.2	50%	0.503	38%	0.377	S	S	.	.	S	Bend	trans	-126.8	120.3	170.1	69.1	0	0	0	0	106.9	D218 C222	D218-S220 PolarHBondContact O-N 2.91Å; S220-C222 PolarHBondContact O-N 3.47Å
221	A	49.5	Very low	67.7	Low	18 Å²	18	68.6 Å²	68.6	15%	0.149	39%	0.387	C	S	.	.			trans	-72	70.9	177	0	0	0	0	0	109.6	I523 I537	A221-I523 HydrophobicContact CB-CD1 4.17Å; A221-I537 HydrophobicContact CB-CD1 4Å; A221-I537 HydrophobicContact CB-CG1 4.36Å; A221-I537 HydrophobicContact CB-CG2 4.17Å; A221-I537 VanDerWaalsContact O-CD1 3.24Å; A221-I537 WeakPolarHBondContact O-CD1 3.01Å
222	C	53.2	Low	67.8	Low	50 Å²	50	71 Å²	71	34%	0.338	40%	0.397	S	S	.	.			trans	-84.8	133.8	173.1	-160.4	0	0	0	0	109	E216 S220	E216-C222 PolarHBondContact N-O 3.33Å; S220-C222 PolarHBondContact O-N 3.47Å
223	M	61.8	Low	68.1	Low	7 Å²	7	73 Å²	73	3%	0.034	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	109.3	167.6	-77.8	-157.8	139.9	0	0	108.8	L34 V213 L215 T225 L512 L525	L34-M223 HydrophobicContact CD1-CB 3.82Å; L34-M223 HydrophobicContact CD1-SD 4.37Å; L34-M223 HydrophobicContact CD2-SD 4.29Å; V213-M223 HydrophobicContact CG1-CB 3.82Å; V213-M223 HydrophobicContact CG1-CE 3.72Å; V213-M223 HydrophobicContact CG1-CG 3.9Å; V213-M223 HydrophobicContact CG1-SD 3.78Å; L215-M223 HydrophobicContact CD1-CE 3.6Å; L215-M223 HydrophobicContact CD1-CG 4.01Å; M223-T225 PolarHBondContact O-N 3.5Å; M223-L512 HydrophobicContact CE-CD1 3.03Å; M223-L512 HydrophobicContact CE-CG 4.5Å; M223-L525 HydrophobicContact CE-CD1 4.35Å; M223-L525 HydrophobicContact SD-CD2 4.01Å
224	D	61.5	Low	68.4	Low	80 Å²	80	74.3 Å²	74.3	43%	0.428	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	118.9	171.1	-171.2	10.2	0	0	0	109.4	V214 E216 G226	V214-D224 PolarHBondContact O-N 2.68Å; V214-D224 VanDerWaalsContact O-N 3.08Å; E216-D224 HydrophobicContact CG-CB 4.37Å; D224-G226 PolarHBondContact OD1-N 3.39Å
225	T	63.3	Low	68.9	Low	41 Å²	41	83.9 Å²	83.9	25%	0.252	45%	0.448	S	S	.	.			trans	-108.2	15.7	177.7	50.8	0	0	0	0	111.9	L34 H211 V213 M223 Q227	L34-T225 HydrophobicContact CD1-CG2 3.9Å; L34-T225 HydrophobicContact CD2-CG2 4.33Å; L34-T225 HydrophobicContact CG-CG2 4.12Å; H211-T225 PolarHBondContact NE2-O 2.96Å; H211-T225 VanDerWaalsContact NE2-O 3.09Å; V213-T225 HydrophobicContact CG2-CG2 4.45Å; M223-T225 PolarHBondContact O-N 3.5Å; T225-Q227 PolarHBondContact O-N 3.07Å; T225-Q227 VanDerWaalsContact O-O 3.13Å
226	G	60.2	Low	69.7	Low	65 Å²	65	84.1 Å²	84.1	67%	0.67	45%	0.454	S	S	*	.			trans	-57.4	-22.8	-174.5	0	0	0	0	0	115.6	D224	D224-G226 PolarHBondContact OD1-N 3.39Å
227	Q	72.2	Confident	71.1	Confident	115 Å²	115	81.5 Å²	81.5	54%	0.537	45%	0.445	S	S	.	.	S	Bend	trans	-79.1	141.1	175	-65.6	-169	-9.1	0	0	112.3	H211 T225	H211-Q227 PolarHBondContact NE2-O 3.06Å; T225-Q227 PolarHBondContact O-N 3.07Å; T225-Q227 VanDerWaalsContact O-O 3.13Å
228	K	82.1	Confident	73	Confident	198 Å²	198	72.8 Å²	72.8	86%	0.861	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-72.1	134.5	176.4	-71.4	-179.3	-178.7	174.3	0	110.2
229	P	86.8	Confident	75.4	Confident	41 Å²	41	69.8 Å²	69.8	27%	0.266	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-71.9	145.2	177.3	28.8	-34.4	0	0	0	111.7	N209 F210 H211	N209-P229 HydrophobicContact CB-CB 4.22Å; F210-P229 CarbonylContact O-C 3.55Å; F210-P229 VanDerWaalsContact O-CA 3.26Å; F210-P229 WeakPolarHBondContact O-CA 3.38Å; F210-P229 WeakPolarHBondContact O-CB 3.3Å; H211-P229 HydrophobicContact CB-CB 3.96Å
230	V	89.6	Confident	77.9	Confident	52 Å²	52	66 Å²	66	32%	0.315	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	128.6	167.1	-177.8	0	0	0	0	107.8	N209 F210 F232 P271	N209-V230 WeakPolarHBondContact CA-O 3.21Å; F210-V230 HydrophobicContact CB-CB 4.36Å; F210-V230 PolarHBondContact N-O 3.5Å; F210-V230 PolarHBondContact O-N 2.91Å; V230-F232 HydrophobicContact CG1-CE2 3.78Å; V230-F232 HydrophobicContact CG1-CZ 4.03Å; V230-P271 HydrophobicContact CB-CG 4.06Å; V230-P271 HydrophobicContact CG1-CG 3.96Å; V230-P271 HydrophobicContact CG2-CG 4.48Å
231	S	91.3	Very high	80.3	Confident	35 Å²	35	63.1 Å²	63.1	25%	0.245	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	142.6	-174.6	-56.9	0	0	0	0	113	R207 L208 N209	R207-S231 PolarHBondContact NE-OG 2.98Å; R207-S231 PolarHBondContact NH2-OG 3.45Å; L208-S231 CarbonylContact O-C 3.59Å; L208-S231 VanDerWaalsContact O-CA 3.27Å; L208-S231 WeakPolarHBondContact O-CA 3.29Å; N209-S231 WeakPolarHBondContact OD1-CB 3.39Å; N209-S231 PolarHBondContact OD1-OG 3.03Å
232	F	90.9	Very high	82.4	Confident	56 Å²	56	62.6 Å²	62.6	25%	0.246	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	133.4	173.4	-62.4	-88.6	0	0	0	110.3	R207 L208 F210 V230 W263 P271	R207-F232 CarbonylContact C-O 3.56Å; R207-F232 WeakPolarHBondContact CA-O 3.41Å; L208-F232 PolarHBondContact N-O 2.93Å; L208-F232 PolarHBondContact O-N 3.33Å; F210-F232 AromaticContact CD2-CD2 3.78Å; F210-F232 HydrophobicContact CD2-CD2 3.78Å; F210-F232 AromaticContact CD2-CE2 3.78Å; F210-F232 HydrophobicContact CD2-CE2 3.78Å; F210-F232 AromaticContact CE2-CD2 3.59Å; F210-F232 HydrophobicContact CE2-CD2 3.59Å; F210-F232 AromaticContact CE2-CE2 3.74Å; F210-F232 HydrophobicContact CE2-CE2 3.74Å; V230-F232 HydrophobicContact CG1-CE2 3.78Å; V230-F232 HydrophobicContact CG1-CZ 4.03Å; F232-W263 AromaticContact CD2-NE1 3.88Å; F232-W263 AromaticContact CG-NE1 3.85Å; F232-P271 HydrophobicContact CE2-CB 4.29Å; F232-P271 HydrophobicContact CE2-CG 4.04Å; F232-P271 HydrophobicContact CZ-CG 4.48Å; F232-P271 WeakPolarHBondContact CZ-O 3.35Å
233	Q	92.3	Very high	84.3	Confident	127 Å²	127	61.8 Å²	61.8	59%	0.593	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.3	126.2	175.4	-176.1	63.7	48	0	0	109.7	D206	D206-Q233 VanDerWaalsContact CG-NE2 3.32Å; D206-Q233 PolarHBondContact O-NE2 3.4Å; D206-Q233 PolarHBondContact OD2-NE2 3.15Å
234	L	89.9	Confident	85.6	Confident	30 Å²	30	62.1 Å²	62.1	16%	0.157	32%	0.321	C	S	.	.			trans	-104.1	166.1	177.4	-51	179.3	0	0	0	110.2	D206 L208 V238 V254 W263	D206-L234 WeakPolarHBondContact O-CA 3.31Å; D206-L234 WeakPolarHBondContact O-CB 3.32Å; D206-L234 PolarHBondContact O-N 3.03Å; L208-L234 HydrophobicContact CB-CD1 4.21Å; L234-V238 HydrophobicContact CD1-CG2 3.42Å; L234-V238 VanDerWaalsContact CD1-CG2 3.42Å; L234-V254 HydrophobicContact CD1-CG1 4.48Å; L234-W263 HydrophobicContact CD2-CH2 3.83Å; L234-W263 HydrophobicContact CD2-CZ2 3.79Å
235	R	87.6	Confident	86.7	Confident	252 Å²	252	61.3 Å²	61.3	95%	0.951	32%	0.322	S	S	*	.	S	Bend	trans	-84.7	-11.3	177.5	-68.4	-174	178.6	-177.5	-0.3	113.7
236	G	86.9	Confident	87.4	Confident	18 Å²	18	64.1 Å²	64.1	19%	0.186	33%	0.328	C	S	.	.	S	Bend	trans	-152.9	173.3	-177.5	0	0	0	0	0	111.7	D206	D206-G236 WeakPolarHBondContact CA-O 3.44Å
237	P	90.8	Very high	88.1	Confident	37 Å²	37	70.2 Å²	70.2	24%	0.24	34%	0.336	C	S	.	.			trans	-63.2	145.2	179.5	26.2	-34.2	0	0	0	111.2	G204 M205 R239 S256	G204-P237 WeakPolarHBondContact O-CA 3.44Å; G204-P237 WeakPolarHBondContact O-CB 3.27Å; M205-P237 HydrophobicContact CB-CB 4.42Å; M205-P237 WeakPolarHBondContact O-CA 3.44Å; P237-R239 PolarHBondContact O-N 3.03Å; P237-S256 WeakPolarHBondContact O-CA 3.47Å; P237-S256 VanDerWaalsContact O-CB 3.25Å; P237-S256 WeakPolarHBondContact O-CB 3.45Å; P237-S256 PolarHBondContact O-OG 2.91Å
238	V	93.4	Very high	88.2	Confident	7 Å²	7	66.9 Å²	66.9	4%	0.042	33%	0.332	C	S	.	.			trans	-77.2	116.5	167.3	179.6	0	0	0	0	108.9	A184 P200 M205 L234 I241 V254	A184-V238 HydrophobicContact CB-CG1 3.93Å; P200-V238 HydrophobicContact CB-CB 3.86Å; P200-V238 HydrophobicContact CB-CG2 3.99Å; P200-V238 HydrophobicContact CG-CB 4.37Å; M205-V238 PolarHBondContact O-N 3.41Å; L234-V238 HydrophobicContact CD1-CG2 3.42Å; L234-V238 VanDerWaalsContact CD1-CG2 3.42Å; V238-I241 HydrophobicContact CG1-CD1 4.1Å; V238-I241 HydrophobicContact CG1-CG1 3.7Å; V238-V254 HydrophobicContact CB-CG1 4.26Å; V238-V254 HydrophobicContact CG1-CG1 3.49Å; V238-V254 VanDerWaalsContact CG1-CG1 3.49Å; V238-V254 HydrophobicContact CG2-CG1 3.96Å
239	R	92.4	Very high	88.4	Confident	77 Å²	77	61.7 Å²	61.7	29%	0.291	31%	0.314	S	S	.	.			trans	-95	-39	177.4	-62.9	-58.6	-171.7	170.5	-1.2	112.9	P237 R255 D257	P237-R239 PolarHBondContact O-N 3.03Å; R239-R255 PolarHBondContact N-O 3.13Å; R239-D257 WeakPolarHBondContact CG-OD1 3.26Å; R239-D257 IonicContact CZ-OD1 3.16Å; R239-D257 IonicContact CZ-OD2 3.62Å; R239-D257 IonicContact NE-OD1 3.28Å; R239-D257 PolarHBondContact NE-OD1 3.13Å; R239-D257 IonicContact NE-OD2 2.81Å; R239-D257 PolarHBondContact NE-OD2 3.01Å; R239-D257 IonicContact NH2-OD1 2.74Å; R239-D257 IonicContact NH2-OD2 3.83Å; R239-D257 PolarHBondContact NH2-OD2 2.83Å
240	Q	95.3	Very high	88.5	Confident	8 Å²	8	60 Å²	60	4%	0.037	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	141.6	-177.2	-173.5	-171.6	-1	0	0	111.2	G183 V254 R255 V286	G183-Q240 CarbonylContact O-C 3.48Å; G183-Q240 VanDerWaalsContact O-CA 3.26Å; G183-Q240 WeakPolarHBondContact O-CA 3.46Å; Q240-V254 WeakPolarHBondContact O-CA 3.42Å; Q240-R255 HydrophobicContact CB-CB 4.04Å; Q240-R255 PolarHBondContact N-O 3.38Å; Q240-R255 PolarHBondContact O-N 3.11Å; Q240-V286 HydrophobicContact CB-CG1 4.37Å; Q240-V286 HydrophobicContact CG-CG1 4.24Å; Q240-V286 PolarHBondContact NE2-O 2.86Å; Q240-V286 VanDerWaalsContact OE1-N 3.08Å
241	I	95.9	Very high	88.6	Confident	11 Å²	11	57.8 Å²	57.8	6%	0.056	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	124.3	170.7	-56.9	178.9	0	0	0	108.3	G183 A184 A186 L198 L208 V238 V252 V254	G183-I241 PolarHBondContact O-N 3.38Å; A184-I241 WeakPolarHBondContact O-CD1 3.19Å; A186-I241 HydrophobicContact CB-CB 4.15Å; A186-I241 HydrophobicContact CB-CG2 3.7Å; L198-I241 HydrophobicContact CB-CD1 4.09Å; L198-I241 HydrophobicContact CB-CG2 4.42Å; L198-I241 HydrophobicContact CD1-CG2 4Å; L208-I241 HydrophobicContact CD1-CD1 3.81Å; V238-I241 HydrophobicContact CG1-CD1 4.1Å; V238-I241 HydrophobicContact CG1-CG1 3.7Å; I241-V252 HydrophobicContact CG2-CG1 3.88Å; I241-V254 HydrophobicContact CG1-CG1 4.3Å; I241-V254 HydrophobicContact CG1-CG2 4.3Å; I241-V254 HydrophobicContact CG2-CG2 4.43Å
242	S	93.9	Very high	88.8	Confident	8 Å²	8	56.1 Å²	56.1	6%	0.056	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	135.3	174.6	-170.7	0	0	0	0	109.4	A253 V286 T288	S242-A253 PolarHBondContact N-O 3.45Å; S242-A253 PolarHBondContact O-N 3.08Å; S242-V286 WeakPolarHBondContact CB-O 3.45Å; S242-T288 WeakPolarHBondContact O-CG2 3.19Å; S242-T288 PolarHBondContact OG-N 3.34Å; S242-T288 PolarHBondContact OG-OG1 2.61Å
243	C	92	Very high	89	Confident	33 Å²	33	53.4 Å²	53.4	22%	0.223	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	143	-175	-59	0	0	0	0	110.5	V188 L198 T288	V188-C243 HydrophobicContact CG2-CB 3.98Å; L198-C243 VanDerWaalsContact CD1-SG 3.52Å; C243-T288 PolarHBondContact O-OG1 3.43Å
244	S	88.3	Confident	89.2	Confident	13 Å²	13	47.5 Å²	47.5	9%	0.091	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	139.5	167.8	54.3	0	0	0	0	108.3	S250 C251 T288 S289	S244-S250 CarbonylContact O-C 3.57Å; S244-S250 VanDerWaalsContact O-CA 3.32Å; S244-S250 WeakPolarHBondContact O-CA 3.3Å; S244-C251 PolarHBondContact N-O 3.08Å; S244-C251 PolarHBondContact O-N 3.34Å; S244-C251 PolarHBondContact OG-O 3.44Å; S244-T288 WeakPolarHBondContact CB-OG1 3.32Å; S244-T288 PolarHBondContact N-OG1 3.14Å; S244-T288 WeakPolarHBondContact OG-CB 2.99Å; S244-T288 PolarHBondContact OG-OG1 3.42Å; S244-S289 WeakPolarHBondContact CB-O 3.45Å; S244-S289 PolarHBondContact OG-O 2.85Å
245	S	85	Confident	89.4	Confident	64 Å²	64	46.3 Å²	46.3	45%	0.448	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	133.1	176.1	178.8	0	0	0	0	108.9	S250	S245-S250 WeakPolarHBondContact CB-OG 3.45Å; S245-S250 PolarHBondContact OG-OG 3.3Å
246	R	79.4	Confident	89.7	Confident	100 Å²	100	34.8 Å²	34.8	38%	0.377	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	125.5	179	-157	177.6	176.1	122.9	-4.8	109.9	G248 D249 P290 H291 L293	R246-G248 PolarHBondContact O-N 3.37Å; R246-D249 PolarHBondContact N-O 3.44Å; R246-D249 PolarHBondContact O-N 3.13Å; R246-D249 VanDerWaalsContact O-N 3.14Å; R246-D249 VanDerWaalsContact O-O 3.07Å; R246-P290 PolarHBondContact NH1-O 3.39Å; R246-H291 VanDerWaalsContact NH1-CA 3.33Å; R246-H291 PolarHBondContact NH1-O 2.83Å; R246-H291 VanDerWaalsContact NH1-O 3.07Å; R246-L293 HydrophobicContact CB-CD1 4.18Å; R246-L293 HydrophobicContact CB-CD2 3.93Å; R246-L293 HydrophobicContact CB-CG 4.1Å
247	F	73.8	Confident	89.9	Confident	193 Å²	193	36 Å²	36	85%	0.846	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.9	33.1	178.9	-57	-65.4	0	0	0	115.4	D249	F247-D249 VanDerWaalsContact C-N 3.31Å; F247-D249 PolarHBondContact O-N 3.01Å
248	G	75.7	Confident	90	Very high	44 Å²	44	39.2 Å²	39.2	45%	0.454	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.1	-10.2	178.3	0	0	0	0	0	115	R246	R246-G248 PolarHBondContact O-N 3.37Å
249	D	85.1	Confident	89.9	Confident	90 Å²	90	41.3 Å²	41.3	48%	0.481	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	136.9	169.1	-73.6	-33.5	0	0	0	110.3	R246 F247 L293	R246-D249 PolarHBondContact N-O 3.44Å; R246-D249 PolarHBondContact O-N 3.13Å; R246-D249 VanDerWaalsContact O-N 3.14Å; R246-D249 VanDerWaalsContact O-O 3.07Å; F247-D249 VanDerWaalsContact C-N 3.31Å; F247-D249 PolarHBondContact O-N 3.01Å; D249-L293 HydrophobicContact CB-CD1 3.93Å
250	S	88.9	Confident	90	Very high	5 Å²	5	37.7 Å²	37.7	4%	0.035	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	133.5	-177.6	-61.6	0	0	0	0	110.9	V188 S244 S245 M265	V188-S250 WeakPolarHBondContact CG1-OG 3.39Å; S244-S250 CarbonylContact O-C 3.57Å; S244-S250 VanDerWaalsContact O-CA 3.32Å; S244-S250 WeakPolarHBondContact O-CA 3.3Å; S245-S250 WeakPolarHBondContact CB-OG 3.45Å; S245-S250 PolarHBondContact OG-OG 3.3Å; S250-M265 WeakPolarHBondContact CA-O 3.47Å; S250-M265 PolarHBondContact N-O 2.93Å; S250-M265 PolarHBondContact O-N 2.85Å
251	C	92.3	Very high	90	Very high	5 Å²	5	37.5 Å²	37.5	3%	0.034	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	123.2	174.9	-173.5	0	0	0	0	108.7	S244 V262 L293	S244-C251 PolarHBondContact N-O 3.08Å; S244-C251 PolarHBondContact O-N 3.34Å; S244-C251 PolarHBondContact OG-O 3.44Å; C251-V262 WeakPolarHBondContact SG-CG1 3.33Å; C251-L293 HydrophobicContact CB-CD2 4.13Å
252	V	94.6	Very high	90	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	118.9	-178.9	178.9	0	0	0	0	108.1	V188 L198 F210 I241 V254 V262 W263	V188-V252 HydrophobicContact CG2-CG2 4.31Å; L198-V252 HydrophobicContact CD1-CB 4.36Å; L198-V252 HydrophobicContact CD1-CG1 3.63Å; L198-V252 HydrophobicContact CD1-CG2 3.75Å; F210-V252 HydrophobicContact CE1-CG2 4.46Å; I241-V252 HydrophobicContact CG2-CG1 3.88Å; V252-V254 HydrophobicContact CG1-CG2 4.04Å; V252-V262 CarbonylContact O-C 3.55Å; V252-V262 WeakPolarHBondContact O-CA 3.37Å; V252-W263 HydrophobicContact CB-CB 4.4Å; V252-W263 PolarHBondContact N-O 2.88Å; V252-W263 PolarHBondContact O-N 3.16Å
253	A	95.5	Very high	90	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	135.4	171.4	0	0	0	0	0	110.3	S242 G261 V262 V286 T288 V296	S242-A253 PolarHBondContact N-O 3.45Å; S242-A253 PolarHBondContact O-N 3.08Å; A253-G261 CarbonylContact C-O 3.58Å; A253-G261 WeakPolarHBondContact CA-O 3.27Å; A253-V262 HydrophobicContact CB-CG2 4.02Å; A253-V286 HydrophobicContact CB-CG2 3.56Å; A253-T288 HydrophobicContact CB-CG2 3.43Å; A253-T288 VanDerWaalsContact CB-CG2 3.43Å; A253-V296 HydrophobicContact CB-CG1 3.87Å; A253-V296 HydrophobicContact CB-CG2 4.15Å
254	V	95.9	Very high	90	Very high	3 Å²	3	36.2 Å²	36.2	2%	0.018	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	130.9	-179.8	-173.2	0	0	0	0	109.6	L208 L234 V238 Q240 I241 V252 C260 G261 W263	L208-V254 HydrophobicContact CD1-CG2 4.37Å; L208-V254 HydrophobicContact CD2-CG2 3.75Å; L234-V254 HydrophobicContact CD1-CG1 4.48Å; V238-V254 HydrophobicContact CB-CG1 4.26Å; V238-V254 HydrophobicContact CG1-CG1 3.49Å; V238-V254 VanDerWaalsContact CG1-CG1 3.49Å; V238-V254 HydrophobicContact CG2-CG1 3.96Å; Q240-V254 WeakPolarHBondContact O-CA 3.42Å; I241-V254 HydrophobicContact CG1-CG1 4.3Å; I241-V254 HydrophobicContact CG1-CG2 4.3Å; I241-V254 HydrophobicContact CG2-CG2 4.43Å; V252-V254 HydrophobicContact CG1-CG2 4.04Å; V254-C260 WeakPolarHBondContact O-CA 3.34Å; V254-G261 PolarHBondContact N-O 2.86Å; V254-G261 PolarHBondContact O-N 2.87Å; V254-W263 HydrophobicContact CB-CE3 4.36Å; V254-W263 HydrophobicContact CB-CH2 4.2Å; V254-W263 HydrophobicContact CB-CZ3 3.56Å; V254-W263 HydrophobicContact CG2-CE3 3.87Å; V254-W263 HydrophobicContact CG2-CH2 4.34Å; V254-W263 HydrophobicContact CG2-CZ3 3.54Å
255	R	95.1	Very high	90.1	Very high	4 Å²	4	36.1 Å²	36.1	2%	0.015	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	126.3	177.3	-179.8	174.7	69.8	100.1	0.9	110.2	A179 T181 R239 Q240 A283 S284 V286	A179-R255 PolarHBondContact O-NH2 3.47Å; T181-R255 PolarHBondContact O-NH2 3Å; R239-R255 PolarHBondContact N-O 3.13Å; Q240-R255 HydrophobicContact CB-CB 4.04Å; Q240-R255 PolarHBondContact N-O 3.38Å; Q240-R255 PolarHBondContact O-N 3.11Å; R255-A283 WeakPolarHBondContact CD-O 3.45Å; R255-A283 HydrophobicContact CG-CB 4.08Å; R255-A283 PolarHBondContact NH1-O 2.95Å; R255-S284 PolarHBondContact NE-O 3.01Å; R255-S284 PolarHBondContact NH1-O 3.41Å; R255-S284 VanDerWaalsContact NH1-O 3.11Å; R255-V286 HydrophobicContact CB-CB 4Å; R255-V286 HydrophobicContact CB-CG1 3.59Å
256	S	93.4	Very high	89.9	Confident	10 Å²	10	33.3 Å²	33.3	7%	0.07	18%	0.177	C	C	.	.			trans	-107.8	-179.5	154.9	-63.8	0	0	0	0	109	P237 H258 V259	P237-S256 WeakPolarHBondContact O-CA 3.47Å; P237-S256 VanDerWaalsContact O-CB 3.25Å; P237-S256 WeakPolarHBondContact O-CB 3.45Å; P237-S256 PolarHBondContact O-OG 2.91Å; S256-H258 PolarHBondContact O-N 3.24Å; S256-V259 WeakPolarHBondContact CA-O 3.44Å; S256-V259 VanDerWaalsContact CB-O 3.31Å; S256-V259 WeakPolarHBondContact CB-O 3.44Å; S256-V259 PolarHBondContact N-O 2.93Å
257	D	91.1	Very high	89.9	Confident	45 Å²	45	31.5 Å²	31.5	24%	0.241	18%	0.175	C	C	.	.	S	Bend	trans	-62.3	-45.1	-172.9	-60.2	-25.2	0	0	0	112.6	R239 A282 A283	R239-D257 WeakPolarHBondContact CG-OD1 3.26Å; R239-D257 IonicContact CZ-OD1 3.16Å; R239-D257 IonicContact CZ-OD2 3.62Å; R239-D257 IonicContact NE-OD1 3.28Å; R239-D257 PolarHBondContact NE-OD1 3.13Å; R239-D257 IonicContact NE-OD2 2.81Å; R239-D257 PolarHBondContact NE-OD2 3.01Å; R239-D257 IonicContact NH2-OD1 2.74Å; R239-D257 IonicContact NH2-OD2 3.83Å; R239-D257 PolarHBondContact NH2-OD2 2.83Å; D257-A282 CarbonylContact O-C 3.5Å; D257-A282 WeakPolarHBondContact O-CA 3.33Å; D257-A283 PolarHBondContact O-N 3.49Å
258	H	92.3	Very high	89.9	Confident	104 Å²	104	30.7 Å²	30.7	48%	0.481	17%	0.174	S	C	.	.	S	Bend	trans	-121.7	6.1	179.8	-64.8	-78.1	0	0	0	114.4	S256 G278 T279	S256-H258 PolarHBondContact O-N 3.24Å; H258-G278 WeakPolarHBondContact O-CA 3.15Å; H258-T279 PolarHBondContact O-N 2.91Å; H258-T279 PolarHBondContact O-OG1 2.75Å
259	V	92.6	Very high	90.1	Very high	50 Å²	50	33.4 Å²	33.4	30%	0.303	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	130.7	-173.6	-177.5	0	0	0	0	109.2	S256 V276 V277	S256-V259 WeakPolarHBondContact CA-O 3.44Å; S256-V259 VanDerWaalsContact CB-O 3.31Å; S256-V259 WeakPolarHBondContact CB-O 3.44Å; S256-V259 PolarHBondContact N-O 2.93Å; V259-V276 HydrophobicContact CG1-CG1 3.35Å; V259-V277 WeakPolarHBondContact CA-O 3.35Å
260	C	94.3	Very high	90.1	Very high	1 Å²	1	36 Å²	36	1%	0.007	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	138	172.6	-65.2	0	0	0	0	109.6	V254 V276 V277 W308	V254-C260 WeakPolarHBondContact O-CA 3.34Å; C260-V276 WeakPolarHBondContact O-CA 3.25Å; C260-V277 PolarHBondContact N-O 3.23Å; C260-V277 PolarHBondContact O-N 3.09Å; C260-W308 HydrophobicContact CB-CZ3 3.88Å; C260-W308 WeakPolarHBondContact O-CH2 3.41Å
261	G	94.8	Very high	90.2	Very high	4 Å²	4	36.4 Å²	36.4	4%	0.041	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	151.3	177.7	0	0	0	0	0	111.5	A253 V254 W263	A253-G261 CarbonylContact C-O 3.58Å; A253-G261 WeakPolarHBondContact CA-O 3.27Å; V254-G261 PolarHBondContact N-O 2.86Å; V254-G261 PolarHBondContact O-N 2.87Å; G261-W263 VanDerWaalsContact CA-CZ3 3.44Å; G261-W263 VanDerWaalsContact O-CZ3 3.27Å; G261-W263 WeakPolarHBondContact O-CZ3 3.23Å
262	V	95.4	Very high	90.1	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	130.8	173.3	171.2	0	0	0	0	110.1	C251 V252 A253 L274 Q275 V296 W308 V310	C251-V262 WeakPolarHBondContact SG-CG1 3.33Å; V252-V262 CarbonylContact O-C 3.55Å; V252-V262 WeakPolarHBondContact O-CA 3.37Å; A253-V262 HydrophobicContact CB-CG2 4.02Å; V262-L274 HydrophobicContact CG1-CB 4.46Å; V262-L274 HydrophobicContact CG1-CD1 4.16Å; V262-L274 PolarHBondContact O-N 2.75Å; V262-Q275 PolarHBondContact N-O 3.33Å; V262-Q275 PolarHBondContact O-N 3.31Å; V262-V296 HydrophobicContact CG2-CG2 3.71Å; V262-W308 HydrophobicContact CB-CH2 3.9Å; V262-W308 HydrophobicContact CB-CZ2 4.26Å; V262-W308 HydrophobicContact CB-CZ3 4.33Å; V262-W308 HydrophobicContact CG2-CD2 4.45Å; V262-W308 HydrophobicContact CG2-CE3 3.89Å; V262-W308 HydrophobicContact CG2-CH2 3.41Å; V262-W308 VanDerWaalsContact CG2-CH2 3.41Å; V262-W308 HydrophobicContact CG2-CZ2 3.99Å; V262-W308 HydrophobicContact CG2-CZ3 3.35Å; V262-V310 HydrophobicContact CB-CG2 4.44Å; V262-V310 HydrophobicContact CG1-CG2 4.03Å
263	W	94.7	Very high	90.1	Very high	7 Å²	7	48.3 Å²	48.3	3%	0.027	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	141.2	176.3	-68.4	-106.3	0	0	0	110.2	L208 F210 F232 L234 V252 V254 G261 R272 L273	L208-W263 HydrophobicContact CD2-CD2 4.21Å; L208-W263 HydrophobicContact CD2-CE3 4.28Å; L208-W263 HydrophobicContact CD2-CH2 4.1Å; L208-W263 HydrophobicContact CD2-CZ2 3.98Å; L208-W263 HydrophobicContact CD2-CZ3 4.25Å; F210-W263 HydrophobicContact CE1-CB 4.46Å; F210-W263 HydrophobicContact CE2-CG 4.4Å; F210-W263 HydrophobicContact CZ-CB 3.95Å; F210-W263 AromaticContact CZ-CD1 3.88Å; F210-W263 HydrophobicContact CZ-CD2 4.33Å; F210-W263 AromaticContact CZ-CG 3.8Å; F210-W263 HydrophobicContact CZ-CG 3.8Å; F232-W263 AromaticContact CD2-NE1 3.88Å; F232-W263 AromaticContact CG-NE1 3.85Å; L234-W263 HydrophobicContact CD2-CH2 3.83Å; L234-W263 HydrophobicContact CD2-CZ2 3.79Å; V252-W263 HydrophobicContact CB-CB 4.4Å; V252-W263 PolarHBondContact N-O 2.88Å; V252-W263 PolarHBondContact O-N 3.16Å; V254-W263 HydrophobicContact CB-CE3 4.36Å; V254-W263 HydrophobicContact CB-CH2 4.2Å; V254-W263 HydrophobicContact CB-CZ3 3.56Å; V254-W263 HydrophobicContact CG2-CE3 3.87Å; V254-W263 HydrophobicContact CG2-CH2 4.34Å; V254-W263 HydrophobicContact CG2-CZ3 3.54Å; G261-W263 VanDerWaalsContact CA-CZ3 3.44Å; G261-W263 VanDerWaalsContact O-CZ3 3.27Å; G261-W263 WeakPolarHBondContact O-CZ3 3.23Å; W263-R272 CarbonylContact C-O 3.54Å; W263-R272 VanDerWaalsContact CA-O 3.24Å; W263-R272 WeakPolarHBondContact CA-O 3.31Å; W263-L273 HydrophobicContact CD2-CD1 3.92Å; W263-L273 VanDerWaalsContact CE2-CD1 3.5Å; W263-L273 HydrophobicContact CE3-CD1 4.41Å; W263-L273 HydrophobicContact CG-CD1 4.41Å; W263-L273 HydrophobicContact CH2-CD1 4.15Å; W263-L273 HydrophobicContact CZ2-CD1 3.64Å; W263-L273 HydrophobicContact CZ3-CD1 4.49Å
264	G	92.1	Very high	89.8	Confident	18 Å²	18	52.6 Å²	52.6	19%	0.186	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	138.5	168.6	0	0	0	0	0	109.7	P271 R272	G264-P271 WeakPolarHBondContact O-CA 3.41Å; G264-R272 PolarHBondContact N-O 2.92Å; G264-R272 PolarHBondContact O-N 2.81Å
265	M	89.3	Confident	89.7	Confident	12 Å²	12	54.9 Å²	54.9	6%	0.059	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	146.9	178.3	-177.6	174.6	62.3	0	0	109.5	V188 F190 C196 F210 S250 P271	V188-M265 HydrophobicContact CB-CE 4.11Å; V188-M265 HydrophobicContact CG1-CE 4.17Å; V188-M265 HydrophobicContact CG2-CE 4.27Å; F190-M265 HydrophobicContact CE1-CE 3.84Å; F190-M265 HydrophobicContact CE1-CG 4.33Å; F190-M265 HydrophobicContact CE1-SD 4.42Å; F190-M265 HydrophobicContact CZ-CE 3.62Å; F190-M265 HydrophobicContact CZ-CG 4Å; F190-M265 HydrophobicContact CZ-SD 3.76Å; C196-M265 HydrophobicContact CB-CE 3.62Å; C196-M265 HydrophobicContact CB-SD 4.03Å; F210-M265 HydrophobicContact CD1-CE 4.3Å; F210-M265 HydrophobicContact CD1-SD 3.74Å; F210-M265 HydrophobicContact CE1-SD 4.32Å; S250-M265 WeakPolarHBondContact CA-O 3.47Å; S250-M265 PolarHBondContact N-O 2.93Å; S250-M265 PolarHBondContact O-N 2.85Å; M265-P271 HydrophobicContact CB-CB 4.32Å; M265-P271 HydrophobicContact CG-CB 4.31Å; M265-P271 HydrophobicContact SD-CB 4.15Å
266	G	82.6	Confident	89.6	Confident	4 Å²	4	58.3 Å²	58.3	4%	0.041	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	174.3	171.3	0	0	0	0	0	110.2	Q268 N269	G266-Q268 VanDerWaalsContact C-N 3.27Å; G266-Q268 PolarHBondContact O-N 2.87Å; G266-N269 PolarHBondContact O-N 3.4Å; G266-N269 VanDerWaalsContact O-O 3.09Å
267	D	77.9	Confident	89.5	Confident	62 Å²	62	58.8 Å²	58.8	33%	0.332	30%	0.296	S	S	.	.	S	Bend	trans	-57.5	-36.9	-176.6	-179.1	20.9	0	0	0	113.6	F190 R212	F190-D267 HydrophobicContact CB-CB 4.09Å; F190-D267 HydrophobicContact CD1-CB 4.41Å; F190-D267 HydrophobicContact CG-CB 4.19Å; R212-D267 IonicContact CZ-OD1 3.36Å; R212-D267 PolarHBondContact NH1-O 2.75Å; R212-D267 VanDerWaalsContact NH1-O 3.16Å; R212-D267 PolarHBondContact NH2-O 3.48Å; R212-D267 IonicContact NH2-OD1 3.46Å; R212-D267 PolarHBondContact NH2-OD1 3Å
268	Q	74.3	Confident	89.5	Confident	177 Å²	177	59.4 Å²	59.4	83%	0.827	31%	0.313	S	S	*	.	S	Bend	trans	-106.2	-8.4	178.9	-59.3	-152.8	3.2	0	0	114.4	G266	G266-Q268 VanDerWaalsContact C-N 3.27Å; G266-Q268 PolarHBondContact O-N 2.87Å
269	N	80.5	Confident	89.3	Confident	101 Å²	101	55.5 Å²	55.5	54%	0.54	30%	0.297	S	S	.	.	S	Bend	trans	-100.5	132.4	-175.9	-78	-22.7	0	0	0	110.7	G266	G266-N269 PolarHBondContact O-N 3.4Å; G266-N269 VanDerWaalsContact O-O 3.09Å
270	E	84.5	Confident	89.1	Confident	143 Å²	143	61.7 Å²	61.7	67%	0.668	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-59	146.3	169.7	-69	-172.9	166.6	0	0	111.1	R272	E270-R272 PolarHBondContact O-N 2.83Å
271	P	90.6	Very high	88.9	Confident	14 Å²	14	63 Å²	63	9%	0.091	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-62.1	131.8	178.3	26.6	-35.2	0	0	0	110.5	F210 V230 F232 G264 M265	F210-P271 HydrophobicContact CB-CB 4.47Å; F210-P271 HydrophobicContact CB-CG 3.83Å; F210-P271 HydrophobicContact CD1-CB 3.56Å; F210-P271 HydrophobicContact CD1-CG 3.88Å; F210-P271 HydrophobicContact CD2-CB 4.13Å; F210-P271 HydrophobicContact CD2-CG 4.01Å; F210-P271 HydrophobicContact CE1-CB 3.72Å; F210-P271 HydrophobicContact CE1-CG 4.48Å; F210-P271 HydrophobicContact CE2-CB 4.25Å; F210-P271 HydrophobicContact CG-CB 3.81Å; F210-P271 HydrophobicContact CG-CG 3.65Å; F210-P271 HydrophobicContact CZ-CB 4.08Å; V230-P271 HydrophobicContact CB-CG 4.06Å; V230-P271 HydrophobicContact CG1-CG 3.96Å; V230-P271 HydrophobicContact CG2-CG 4.48Å; F232-P271 HydrophobicContact CE2-CB 4.29Å; F232-P271 HydrophobicContact CE2-CG 4.04Å; F232-P271 HydrophobicContact CZ-CG 4.48Å; F232-P271 WeakPolarHBondContact CZ-O 3.35Å; G264-P271 WeakPolarHBondContact O-CA 3.41Å; M265-P271 HydrophobicContact CB-CB 4.32Å; M265-P271 HydrophobicContact CG-CB 4.31Å; M265-P271 HydrophobicContact SD-CB 4.15Å
272	R	91.8	Very high	88.8	Confident	171 Å²	171	63.7 Å²	63.7	65%	0.645	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.9	132.9	179.6	-65.3	179.8	-175.6	-171.2	1.3	110.4	W263 G264 E270 L274	W263-R272 CarbonylContact C-O 3.54Å; W263-R272 VanDerWaalsContact CA-O 3.24Å; W263-R272 WeakPolarHBondContact CA-O 3.31Å; G264-R272 PolarHBondContact N-O 2.92Å; G264-R272 PolarHBondContact O-N 2.81Å; E270-R272 PolarHBondContact O-N 2.83Å; R272-L274 PolarHBondContact O-N 3.45Å
273	L	92.5	Very high	88.7	Confident	84 Å²	84	63.7 Å²	63.7	44%	0.44	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	121.4	171.5	178.6	67.3	0	0	0	109	W263 V276	W263-L273 HydrophobicContact CD2-CD1 3.92Å; W263-L273 VanDerWaalsContact CE2-CD1 3.5Å; W263-L273 HydrophobicContact CE3-CD1 4.41Å; W263-L273 HydrophobicContact CG-CD1 4.41Å; W263-L273 HydrophobicContact CH2-CD1 4.15Å; W263-L273 HydrophobicContact CZ2-CD1 3.64Å; W263-L273 HydrophobicContact CZ3-CD1 4.49Å; L273-V276 HydrophobicContact CD1-CG2 3.74Å; L273-V276 HydrophobicContact CD2-CG2 3.87Å; L273-V276 HydrophobicContact CG-CG2 4.23Å
274	L	90.6	Very high	88.7	Confident	90 Å²	90	63.6 Å²	63.6	47%	0.471	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-53.5	179.4	-60.6	-178.1	0	0	0	111.1	V262 R272 V310	V262-L274 HydrophobicContact CG1-CB 4.46Å; V262-L274 HydrophobicContact CG1-CD1 4.16Å; V262-L274 PolarHBondContact O-N 2.75Å; R272-L274 PolarHBondContact O-N 3.45Å; L274-V310 HydrophobicContact CB-CG1 4.1Å
275	Q	92.9	Very high	88.8	Confident	52 Å²	52	62.7 Å²	62.7	24%	0.243	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	154.8	-178.9	-171.7	176.8	10.5	0	0	111	V262 W308 V310	V262-Q275 PolarHBondContact N-O 3.33Å; V262-Q275 PolarHBondContact O-N 3.31Å; Q275-W308 HydrophobicContact CB-CZ2 3.78Å; Q275-W308 HydrophobicContact CG-CZ2 3.87Å; Q275-W308 WeakPolarHBondContact O-CH2 3.43Å; Q275-W308 VanDerWaalsContact OE1-NE1 3.13Å; Q275-V310 HydrophobicContact CB-CG1 4.46Å
276	V	93.2	Very high	89.1	Confident	75 Å²	75	62.1 Å²	62.1	46%	0.455	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	140.4	172.7	-179.4	0	0	0	0	108.7	V259 C260 L273	V259-V276 HydrophobicContact CG1-CG1 3.35Å; C260-V276 WeakPolarHBondContact O-CA 3.25Å; L273-V276 HydrophobicContact CD1-CG2 3.74Å; L273-V276 HydrophobicContact CD2-CG2 3.87Å; L273-V276 HydrophobicContact CG-CG2 4.23Å
277	V	92	Very high	89.7	Confident	21 Å²	21	62.1 Å²	62.1	13%	0.127	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	135.8	176.8	171.8	0	0	0	0	109.1	V259 C260 W308 L314	V259-V277 WeakPolarHBondContact CA-O 3.35Å; C260-V277 PolarHBondContact N-O 3.23Å; C260-V277 PolarHBondContact O-N 3.09Å; V277-W308 HydrophobicContact CB-CH2 4.38Å; V277-W308 HydrophobicContact CB-CZ2 4.25Å; V277-W308 HydrophobicContact CG2-CD2 3.93Å; V277-W308 VanDerWaalsContact CG2-CE2 3.41Å; V277-W308 HydrophobicContact CG2-CG 4.34Å; V277-W308 HydrophobicContact CG2-CH2 4.18Å; V277-W308 HydrophobicContact CG2-CZ2 3.57Å; V277-L314 HydrophobicContact CG1-CB 4.12Å; V277-L314 HydrophobicContact CG1-CD2 4.02Å; V277-L314 HydrophobicContact CG1-CG 4.49Å
278	G	90.8	Very high	90.5	Very high	58 Å²	58	59.5 Å²	59.5	60%	0.598	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.7	142.7	169.1	0	0	0	0	0	110.7	H258	H258-G278 WeakPolarHBondContact O-CA 3.15Å
279	T	88.8	Confident	91.4	Very high	22 Å²	22	51.1 Å²	51.1	14%	0.135	27%	0.274	C	S	.	.			trans	-109	143	174.4	56.8	0	0	0	0	110.1	H258 A281 V298	H258-T279 PolarHBondContact O-N 2.91Å; H258-T279 PolarHBondContact O-OG1 2.75Å; T279-A281 VanDerWaalsContact CB-O 3.23Å; T279-A281 WeakPolarHBondContact CB-O 3.4Å; T279-A281 PolarHBondContact OG1-O 3.18Å; T279-V298 HydrophobicContact CG2-CG1 4.25Å
280	E	88	Confident	91.8	Very high	180 Å²	180	48.6 Å²	48.6	84%	0.841	26%	0.263	S	S	*	.	S	Bend	trans	-67.5	-49.1	178	-66	174.6	160.7	0	0	111.1
281	A	90.4	Very high	92.1	Very high	28 Å²	28	44 Å²	44	23%	0.231	24%	0.241	C	C	.	.	S	Bend	trans	-93	161.1	171	0	0	0	0	0	111	T279 A283	T279-A281 VanDerWaalsContact CB-O 3.23Å; T279-A281 WeakPolarHBondContact CB-O 3.4Å; T279-A281 PolarHBondContact OG1-O 3.18Å; A281-A283 PolarHBondContact O-N 3.43Å
282	A	91.9	Very high	92.1	Very high	18 Å²	18	46.4 Å²	46.4	15%	0.149	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-61	136.4	176.9	0	0	0	0	0	111	D257 S300 E301	D257-A282 CarbonylContact O-C 3.5Å; D257-A282 WeakPolarHBondContact O-CA 3.33Å; A282-S300 CarbonylContact O-C 3.55Å; A282-S300 VanDerWaalsContact O-CA 3.29Å; A282-S300 WeakPolarHBondContact O-CA 3.34Å; A282-E301 HydrophobicContact CB-CG 4.23Å; A282-E301 PolarHBondContact O-N 3.4Å
283	A	93.7	Very high	92	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.008	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	124.1	178.9	0	0	0	0	0	110	R255 D257 A281 V298 A299	R255-A283 WeakPolarHBondContact CD-O 3.45Å; R255-A283 HydrophobicContact CG-CB 4.08Å; R255-A283 PolarHBondContact NH1-O 2.95Å; D257-A283 PolarHBondContact O-N 3.49Å; A281-A283 PolarHBondContact O-N 3.43Å; A283-V298 HydrophobicContact CB-CG1 4.18Å; A283-A299 CarbonylContact C-O 3.55Å; A283-A299 WeakPolarHBondContact CA-O 3.23Å
284	S	93.5	Very high	91.9	Very high	4 Å²	4	38 Å²	38	3%	0.028	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	-25.9	-179.7	55.6	0	0	0	0	113.1	R255 A299 R333	R255-S284 PolarHBondContact NE-O 3.01Å; R255-S284 PolarHBondContact NH1-O 3.41Å; R255-S284 VanDerWaalsContact NH1-O 3.11Å; S284-A299 PolarHBondContact N-O 2.78Å; S284-A299 PolarHBondContact OG-O 2.97Å; S284-R333 WeakPolarHBondContact CB-O 3.35Å; S284-R333 PolarHBondContact OG-O 3.06Å
285	C	94.9	Very high	92.1	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	146.1	-178.2	-177.3	0	0	0	0	112	V298 A299 W334 C335	C285-V298 WeakPolarHBondContact O-CA 3.44Å; C285-A299 HydrophobicContact CB-CB 3.95Å; C285-A299 PolarHBondContact N-O 3.48Å; C285-A299 PolarHBondContact O-N 2.78Å; C285-A299 VanDerWaalsContact O-N 3.1Å; C285-W334 HydrophobicContact CB-CD2 3.96Å; C285-W334 HydrophobicContact CB-CE3 3.52Å; C285-W334 HydrophobicContact CB-CG 4.45Å; C285-W334 HydrophobicContact CB-CZ3 3.97Å; C285-W334 VanDerWaalsContact SG-CE2 3.56Å; C285-W334 VanDerWaalsContact SG-CZ3 3.56Å; C285-C335 PolarHBondContact SG-O 3.19Å
286	V	95.7	Very high	92.2	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	134.2	163.8	70.8	0	0	0	0	110.5	Q240 S242 A253 R255 V296 L297 V298	Q240-V286 HydrophobicContact CB-CG1 4.37Å; Q240-V286 HydrophobicContact CG-CG1 4.24Å; Q240-V286 PolarHBondContact NE2-O 2.86Å; Q240-V286 VanDerWaalsContact OE1-N 3.08Å; S242-V286 WeakPolarHBondContact CB-O 3.45Å; A253-V286 HydrophobicContact CB-CG2 3.56Å; R255-V286 HydrophobicContact CB-CB 4Å; R255-V286 HydrophobicContact CB-CG1 3.59Å; V286-V296 HydrophobicContact CG2-CG1 3.43Å; V286-V296 VanDerWaalsContact CG2-CG1 3.43Å; V286-L297 WeakPolarHBondContact CA-O 3.46Å; V286-V298 HydrophobicContact CG2-CG2 4.37Å
287	S	94.8	Very high	92.4	Very high	4 Å²	4	28.3 Å²	28.3	3%	0.028	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	123.9	177.6	-175.1	0	0	0	0	112	V296 L297 C335	S287-V296 CarbonylContact O-C 3.48Å; S287-V296 VanDerWaalsContact O-CA 3.3Å; S287-V296 WeakPolarHBondContact O-CA 3.47Å; S287-V296 WeakPolarHBondContact O-CG1 3.5Å; S287-L297 PolarHBondContact N-O 2.91Å; S287-L297 PolarHBondContact O-N 3.47Å; S287-C335 WeakPolarHBondContact CB-O 3.46Å
288	T	94.3	Very high	92.6	Very high	7 Å²	7	27.5 Å²	27.5	4%	0.043	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	140.8	175	52.5	0	0	0	0	111.4	S242 C243 S244 A253 V296	S242-T288 WeakPolarHBondContact O-CG2 3.19Å; S242-T288 PolarHBondContact OG-N 3.34Å; S242-T288 PolarHBondContact OG-OG1 2.61Å; C243-T288 PolarHBondContact O-OG1 3.43Å; S244-T288 WeakPolarHBondContact CB-OG1 3.32Å; S244-T288 PolarHBondContact N-OG1 3.14Å; S244-T288 WeakPolarHBondContact OG-CB 2.99Å; S244-T288 PolarHBondContact OG-OG1 3.42Å; A253-T288 HydrophobicContact CB-CG2 3.43Å; A253-T288 VanDerWaalsContact CB-CG2 3.43Å; T288-V296 HydrophobicContact CG2-CG2 4.24Å
289	S	93.3	Very high	92.8	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.007	14%	0.137	C	C	.	.			trans	-68.6	125.9	177.8	-175.1	0	0	0	0	111.8	S244 H291 I292 E295 F337	S244-S289 WeakPolarHBondContact CB-O 3.45Å; S244-S289 PolarHBondContact OG-O 2.85Å; S289-H291 PolarHBondContact O-N 2.7Å; S289-H291 PolarHBondContact OG-N 3.14Å; S289-I292 WeakPolarHBondContact CB-O 3.3Å; S289-I292 PolarHBondContact OG-N 2.8Å; S289-I292 VanDerWaalsContact OG-N 3.16Å; S289-E295 VanDerWaalsContact CB-O 3.26Å; S289-E295 WeakPolarHBondContact CB-O 3.48Å; S289-E295 PolarHBondContact N-O 2.91Å; S289-F337 VanDerWaalsContact CA-CD2 3.4Å; S289-F337 VanDerWaalsContact CB-CE2 3.48Å
290	P	89.9	Confident	93	Very high	47 Å²	47	24.3 Å²	24.3	31%	0.305	14%	0.135	S	C	.	.	S	Bend	trans	-72.2	-16.2	169.4	30	-32.2	0	0	0	111.6	R246 F337 F389	R246-P290 PolarHBondContact NH1-O 3.39Å; P290-F337 HydrophobicContact CG-CB 4.37Å; P290-F389 HydrophobicContact CG-CD1 4.34Å; P290-F389 HydrophobicContact CG-CE1 4.09Å
291	H	91.1	Very high	93.2	Very high	48 Å²	48	19.8 Å²	19.8	22%	0.222	11%	0.114	C	C	.	.	S	Bend	trans	-92.9	-42.5	-172.3	-58.7	-65.5	0	0	0	113.6	R246 S289 S338 A339 P341	R246-H291 VanDerWaalsContact NH1-CA 3.33Å; R246-H291 PolarHBondContact NH1-O 2.83Å; R246-H291 VanDerWaalsContact NH1-O 3.07Å; S289-H291 PolarHBondContact O-N 2.7Å; S289-H291 PolarHBondContact OG-N 3.14Å; H291-S338 PolarHBondContact NE2-O 2.73Å; H291-A339 PolarHBondContact CE1-O 3.29Å; H291-A339 PolarHBondContact NE2-O 3.46Å; H291-P341 HydrophobicContact CB-CB 3.66Å; H291-P341 VanDerWaalsContact CD2-CA 3.46Å; H291-P341 WeakPolarHBondContact CD2-CA 3.42Å
292	I	91.1	Very high	93.2	Very high	63 Å²	63	21.8 Å²	21.8	32%	0.323	13%	0.126	S	C	.	.	S	Bend	trans	-133.9	114.7	-172.3	-56.5	174.5	0	0	0	109	S289 G294 E295 P341	S289-I292 WeakPolarHBondContact CB-O 3.3Å; S289-I292 PolarHBondContact OG-N 2.8Å; S289-I292 VanDerWaalsContact OG-N 3.16Å; I292-G294 PolarHBondContact O-N 3.34Å; I292-E295 HydrophobicContact CB-CB 4.4Å; I292-E295 HydrophobicContact CB-CG 4.1Å; I292-E295 HydrophobicContact CG2-CG 3.85Å; I292-E295 PolarHBondContact O-N 2.95Å; I292-P341 HydrophobicContact CD1-CB 4.32Å
293	L	89.6	Confident	93.2	Very high	69 Å²	69	20.9 Å²	20.9	36%	0.361	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	135.4	177.1	-66.5	177.8	0	0	0	110.8	R246 D249 C251 E295	R246-L293 HydrophobicContact CB-CD1 4.18Å; R246-L293 HydrophobicContact CB-CD2 3.93Å; R246-L293 HydrophobicContact CB-CG 4.1Å; D249-L293 HydrophobicContact CB-CD1 3.93Å; C251-L293 HydrophobicContact CB-CD2 4.13Å; L293-E295 VanDerWaalsContact C-N 3.35Å
294	G	89.8	Confident	93.1	Very high	11 Å²	11	21 Å²	21	11%	0.113	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.7	2.4	-177.7	0	0	0	0	0	114.9	I292 V310	I292-G294 PolarHBondContact O-N 3.34Å; G294-V310 WeakPolarHBondContact O-CG2 3.3Å; G294-V310 PolarHBondContact O-N 3.15Å
295	E	94.5	Very high	93.1	Very high	13 Å²	13	20.9 Å²	20.9	6%	0.061	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	133.2	165.7	-68.1	-170.4	173.7	0	0	110.9	S289 I292 L293 L307 W308 T309 F337 R342	S289-E295 VanDerWaalsContact CB-O 3.26Å; S289-E295 WeakPolarHBondContact CB-O 3.48Å; S289-E295 PolarHBondContact N-O 2.91Å; I292-E295 HydrophobicContact CB-CB 4.4Å; I292-E295 HydrophobicContact CB-CG 4.1Å; I292-E295 HydrophobicContact CG2-CG 3.85Å; I292-E295 PolarHBondContact O-N 2.95Å; L293-E295 VanDerWaalsContact C-N 3.35Å; E295-L307 HydrophobicContact CB-CD1 4.37Å; E295-W308 CarbonylContact C-O 3.58Å; E295-W308 WeakPolarHBondContact CA-O 3.41Å; E295-T309 HydrophobicContact CG-CG2 4.32Å; E295-F337 HydrophobicContact CB-CZ 4.36Å; E295-R342 IonicContact OE1-CZ 2.92Å; E295-R342 VanDerWaalsContact OE1-CZ 3.32Å; E295-R342 IonicContact OE1-NH1 3.2Å; E295-R342 PolarHBondContact OE1-NH1 3.32Å; E295-R342 IonicContact OE1-NH2 3.94Å; E295-R342 PolarHBondContact OE1-NH2 3.42Å; E295-R342 IonicContact OE2-CZ 3.07Å; E295-R342 IonicContact OE2-NH1 2.84Å; E295-R342 PolarHBondContact OE2-NH1 3.08Å; E295-R342 IonicContact OE2-NH2 3.93Å
296	V	96	Very high	93.1	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	137.7	-176.2	-178.6	0	0	0	0	109.2	A253 V262 V286 S287 T288 V298 W308	A253-V296 HydrophobicContact CB-CG1 3.87Å; A253-V296 HydrophobicContact CB-CG2 4.15Å; V262-V296 HydrophobicContact CG2-CG2 3.71Å; V286-V296 HydrophobicContact CG2-CG1 3.43Å; V286-V296 VanDerWaalsContact CG2-CG1 3.43Å; S287-V296 CarbonylContact O-C 3.48Å; S287-V296 VanDerWaalsContact O-CA 3.3Å; S287-V296 WeakPolarHBondContact O-CA 3.47Å; S287-V296 WeakPolarHBondContact O-CG1 3.5Å; T288-V296 HydrophobicContact CG2-CG2 4.24Å; V296-V298 HydrophobicContact CG1-CG2 4.36Å; V296-W308 HydrophobicContact CB-CB 4.32Å; V296-W308 HydrophobicContact CB-CE3 4.17Å; V296-W308 HydrophobicContact CG1-CE3 4.26Å; V296-W308 PolarHBondContact N-O 3.26Å; V296-W308 WeakPolarHBondContact O-CA 3.42Å; V296-W308 WeakPolarHBondContact O-CB 3.29Å; V296-W308 PolarHBondContact O-N 3.04Å
297	L	96.1	Very high	93	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	138.4	169.4	-70.1	166.5	0	0	0	109.8	V286 S287 S306 L307 C335 F337 M344	V286-L297 WeakPolarHBondContact CA-O 3.46Å; S287-L297 PolarHBondContact N-O 2.91Å; S287-L297 PolarHBondContact O-N 3.47Å; L297-S306 WeakPolarHBondContact CA-O 3.23Å; L297-L307 HydrophobicContact CD2-CB 4.23Å; L297-L307 HydrophobicContact CD2-CD1 4.01Å; L297-C335 HydrophobicContact CB-CB 4.35Å; L297-F337 HydrophobicContact CB-CE2 4.13Å; L297-F337 HydrophobicContact CB-CZ 4.48Å; L297-F337 HydrophobicContact CD1-CD1 3.85Å; L297-F337 HydrophobicContact CD1-CD2 3.61Å; L297-F337 HydrophobicContact CD1-CE1 3.85Å; L297-F337 HydrophobicContact CD1-CE2 3.61Å; L297-F337 HydrophobicContact CD1-CG 3.75Å; L297-F337 HydrophobicContact CD1-CZ 3.75Å; L297-F337 HydrophobicContact CD2-CZ 4.26Å; L297-F337 HydrophobicContact CG-CD1 4.46Å; L297-F337 HydrophobicContact CG-CD2 4.04Å; L297-F337 HydrophobicContact CG-CE1 3.97Å; L297-F337 HydrophobicContact CG-CE2 3.49Å; L297-F337 VanDerWaalsContact CG-CE2 3.49Å; L297-F337 HydrophobicContact CG-CZ 3.47Å; L297-F337 VanDerWaalsContact CG-CZ 3.47Å; L297-M344 HydrophobicContact CD1-CB 3.73Å; L297-M344 HydrophobicContact CD2-SD 4.14Å
298	V	96.1	Very high	93.1	Very high	4 Å²	4	21.6 Å²	21.6	2%	0.024	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	126.5	175.7	-177	0	0	0	0	108.8	T279 A283 C285 V286 V296 S306 W308 C335	T279-V298 HydrophobicContact CG2-CG1 4.25Å; A283-V298 HydrophobicContact CB-CG1 4.18Å; C285-V298 WeakPolarHBondContact O-CA 3.44Å; V286-V298 HydrophobicContact CG2-CG2 4.37Å; V296-V298 HydrophobicContact CG1-CG2 4.36Å; V298-S306 PolarHBondContact N-O 3.24Å; V298-S306 PolarHBondContact O-N 2.89Å; V298-W308 HydrophobicContact CG2-CE3 4.37Å; V298-C335 VanDerWaalsContact C-SG 3.56Å
299	A	95.3	Very high	93.1	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	142.4	170.2	0	0	0	0	0	110	A283 S284 C285 A304 R333 C335	A283-A299 CarbonylContact C-O 3.55Å; A283-A299 WeakPolarHBondContact CA-O 3.23Å; S284-A299 PolarHBondContact N-O 2.78Å; S284-A299 PolarHBondContact OG-O 2.97Å; C285-A299 HydrophobicContact CB-CB 3.95Å; C285-A299 PolarHBondContact N-O 3.48Å; C285-A299 PolarHBondContact O-N 2.78Å; C285-A299 VanDerWaalsContact O-N 3.1Å; A299-A304 WeakPolarHBondContact CA-O 3.22Å; A299-R333 HydrophobicContact CB-CB 4.15Å; A299-C335 HydrophobicContact CB-CB 4.18Å; A299-C335 PolarHBondContact N-SG 3.12Å
300	S	93.9	Very high	93	Very high	12 Å²	12	25 Å²	25	8%	0.084	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	156	172.5	63.7	0	0	0	0	112	A282 S302 G303 A304 R333	A282-S300 CarbonylContact O-C 3.55Å; A282-S300 VanDerWaalsContact O-CA 3.29Å; A282-S300 WeakPolarHBondContact O-CA 3.34Å; S300-S302 PolarHBondContact O-N 2.91Å; S300-S302 VanDerWaalsContact O-N 3.15Å; S300-S302 PolarHBondContact OG-OG 3.5Å; S300-G303 PolarHBondContact O-N 2.91Å; S300-A304 PolarHBondContact N-O 2.87Å; S300-A304 WeakPolarHBondContact OG-CB 3.22Å; S300-A304 PolarHBondContact OG-N 3.42Å; S300-A304 PolarHBondContact OG-O 2.99Å; S300-R333 WeakPolarHBondContact O-CG 3.33Å
301	E	92.1	Very high	93	Very high	85 Å²	85	26 Å²	26	40%	0.397	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-18.8	173.7	-71.4	-176.4	-167.3	0	0	113.1	A282 G303 S331	A282-E301 HydrophobicContact CB-CG 4.23Å; A282-E301 PolarHBondContact O-N 3.4Å; E301-G303 PolarHBondContact O-N 2.91Å; E301-S331 WeakPolarHBondContact CA-O 3.34Å; E301-S331 PolarHBondContact OE2-OG 2.94Å
302	S	90.7	Very high	92.9	Very high	70 Å²	70	34.6 Å²	34.6	49%	0.49	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	0.4	172.3	73.1	0	0	0	0	114.1	S300	S300-S302 PolarHBondContact O-N 2.91Å; S300-S302 VanDerWaalsContact O-N 3.15Å; S300-S302 PolarHBondContact OG-OG 3.5Å
303	G	90.1	Very high	92.8	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.187	C	C	.	.	S	Bend	trans	85	8.1	-177.4	0	0	0	0	0	115.6	S300 E301 E320 Y346	S300-G303 PolarHBondContact O-N 2.91Å; E301-G303 PolarHBondContact O-N 2.91Å; G303-E320 WeakPolarHBondContact CA-O 3.45Å; G303-E320 PolarHBondContact O-N 3.4Å; G303-Y346 PolarHBondContact O-OH 3.25Å
304	A	92.1	Very high	92.9	Very high	4 Å²	4	32.4 Å²	32.4	3%	0.033	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	131.8	177.2	0	0	0	0	0	111.1	A299 S300 R318	A299-A304 WeakPolarHBondContact CA-O 3.22Å; S300-A304 PolarHBondContact N-O 2.87Å; S300-A304 WeakPolarHBondContact OG-CB 3.22Å; S300-A304 PolarHBondContact OG-N 3.42Å; S300-A304 PolarHBondContact OG-O 2.99Å; A304-R318 WeakPolarHBondContact CA-O 3.48Å
305	A	94	Very high	93	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	127.7	167.8	0	0	0	0	0	109.4	V317 R318 C335 M344 Y346	A305-V317 PolarHBondContact O-N 2.98Å; A305-R318 HydrophobicContact CB-CB 4.28Å; A305-R318 PolarHBondContact N-O 3Å; A305-R318 PolarHBondContact O-N 3.47Å; A305-C335 HydrophobicContact CB-CB 4.49Å; A305-M344 HydrophobicContact CB-CE 3.9Å; A305-M344 HydrophobicContact CB-SD 4.21Å; A305-Y346 HydrophobicContact CB-CD2 3.92Å; A305-Y346 HydrophobicContact CB-CE2 4.07Å
306	S	94.3	Very high	92.8	Very high	9 Å²	9	43.7 Å²	43.7	6%	0.063	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	137	-172.9	-57.2	0	0	0	0	111.5	L297 V298 L314 Q315	L297-S306 WeakPolarHBondContact CA-O 3.23Å; V298-S306 PolarHBondContact N-O 3.24Å; V298-S306 PolarHBondContact O-N 2.89Å; S306-L314 VanDerWaalsContact CB-CD1 3.44Å; S306-Q315 CarbonylContact C-O 3.55Å; S306-Q315 WeakPolarHBondContact CA-O 3.47Å; S306-Q315 WeakPolarHBondContact CB-O 3.31Å
307	L	95.2	Very high	92.5	Very high	10 Å²	10	45.1 Å²	45.1	5%	0.052	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	119	170.4	178.9	67.2	0	0	0	109.2	E295 L297 Q315 V317 F337 F357	E295-L307 HydrophobicContact CB-CD1 4.37Å; L297-L307 HydrophobicContact CD2-CB 4.23Å; L297-L307 HydrophobicContact CD2-CD1 4.01Å; L307-Q315 PolarHBondContact N-O 3.43Å; L307-Q315 PolarHBondContact O-N 3.45Å; L307-V317 HydrophobicContact CB-CG2 3.71Å; L307-F337 HydrophobicContact CD1-CE1 4.28Å; L307-F337 HydrophobicContact CD1-CZ 3.93Å; L307-F357 HydrophobicContact CD2-CE2 3.81Å; L307-F357 HydrophobicContact CD2-CZ 4.24Å
308	W	95.1	Very high	92.2	Very high	1 Å²	1	45.5 Å²	45.5	0%	0.004	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	119	172.1	179.1	14.3	0	0	0	109.4	C260 V262 Q275 V277 E295 V296 V298 L314	C260-W308 HydrophobicContact CB-CZ3 3.88Å; C260-W308 WeakPolarHBondContact O-CH2 3.41Å; V262-W308 HydrophobicContact CB-CH2 3.9Å; V262-W308 HydrophobicContact CB-CZ2 4.26Å; V262-W308 HydrophobicContact CB-CZ3 4.33Å; V262-W308 HydrophobicContact CG2-CD2 4.45Å; V262-W308 HydrophobicContact CG2-CE3 3.89Å; V262-W308 HydrophobicContact CG2-CH2 3.41Å; V262-W308 VanDerWaalsContact CG2-CH2 3.41Å; V262-W308 HydrophobicContact CG2-CZ2 3.99Å; V262-W308 HydrophobicContact CG2-CZ3 3.35Å; Q275-W308 HydrophobicContact CB-CZ2 3.78Å; Q275-W308 HydrophobicContact CG-CZ2 3.87Å; Q275-W308 WeakPolarHBondContact O-CH2 3.43Å; Q275-W308 VanDerWaalsContact OE1-NE1 3.13Å; V277-W308 HydrophobicContact CB-CH2 4.38Å; V277-W308 HydrophobicContact CB-CZ2 4.25Å; V277-W308 HydrophobicContact CG2-CD2 3.93Å; V277-W308 VanDerWaalsContact CG2-CE2 3.41Å; V277-W308 HydrophobicContact CG2-CG 4.34Å; V277-W308 HydrophobicContact CG2-CH2 4.18Å; V277-W308 HydrophobicContact CG2-CZ2 3.57Å; E295-W308 CarbonylContact C-O 3.58Å; E295-W308 WeakPolarHBondContact CA-O 3.41Å; V296-W308 HydrophobicContact CB-CB 4.32Å; V296-W308 HydrophobicContact CB-CE3 4.17Å; V296-W308 HydrophobicContact CG1-CE3 4.26Å; V296-W308 PolarHBondContact N-O 3.26Å; V296-W308 WeakPolarHBondContact O-CA 3.42Å; V296-W308 WeakPolarHBondContact O-CB 3.29Å; V296-W308 PolarHBondContact O-N 3.04Å; V298-W308 HydrophobicContact CG2-CE3 4.37Å; W308-L314 HydrophobicContact CB-CD1 3.73Å; W308-L314 HydrophobicContact CG-CD1 4.46Å
309	T	94.2	Very high	91.8	Very high	32 Å²	32	48.9 Å²	48.9	20%	0.196	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	125.5	168.5	-54.8	0	0	0	0	109.2	E295 G311 R312 G313	E295-T309 HydrophobicContact CG-CG2 4.32Å; T309-G311 PolarHBondContact O-N 3.05Å; T309-R312 HydrophobicContact CG2-CB 4.44Å; T309-R312 HydrophobicContact CG2-CG 4.32Å; T309-R312 PolarHBondContact O-N 3.25Å; T309-G313 PolarHBondContact N-O 3.45Å; T309-G313 VanDerWaalsContact N-O 3.13Å; T309-G313 PolarHBondContact O-N 2.92Å
310	V	92.1	Very high	91.4	Very high	46 Å²	46	51 Å²	51	28%	0.279	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	123.1	177.5	174.8	0	0	0	0	109.6	V262 L274 Q275 G294 R312	V262-V310 HydrophobicContact CB-CG2 4.44Å; V262-V310 HydrophobicContact CG1-CG2 4.03Å; L274-V310 HydrophobicContact CB-CG1 4.1Å; Q275-V310 HydrophobicContact CB-CG1 4.46Å; G294-V310 WeakPolarHBondContact O-CG2 3.3Å; G294-V310 PolarHBondContact O-N 3.15Å; V310-R312 PolarHBondContact O-N 3.36Å
311	G	89.3	Confident	91	Very high	69 Å²	69	59.9 Å²	59.9	71%	0.711	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.8	-22.5	-178	0	0	0	0	0	115.9	T309	T309-G311 PolarHBondContact O-N 3.05Å
312	R	88.6	Confident	90.7	Very high	229 Å²	229	59.5 Å²	59.5	86%	0.864	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	-22.7	173.3	-61.6	-173.9	-179.1	-153.1	0.1	113.3	T309 V310	T309-R312 HydrophobicContact CG2-CB 4.44Å; T309-R312 HydrophobicContact CG2-CG 4.32Å; T309-R312 PolarHBondContact O-N 3.25Å; V310-R312 PolarHBondContact O-N 3.36Å
313	G	89.4	Confident	90.6	Very high	18 Å²	18	57.1 Å²	57.1	19%	0.186	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	93.7	-163.6	-179.7	0	0	0	0	0	113.3	T309	T309-G313 PolarHBondContact N-O 3.45Å; T309-G313 VanDerWaalsContact N-O 3.13Å; T309-G313 PolarHBondContact O-N 2.92Å
314	L	92	Very high	90.5	Very high	68 Å²	68	58.5 Å²	58.5	36%	0.356	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	126.4	-173.9	-168.2	70.5	0	0	0	110.7	V277 S306 W308	V277-L314 HydrophobicContact CG1-CB 4.12Å; V277-L314 HydrophobicContact CG1-CD2 4.02Å; V277-L314 HydrophobicContact CG1-CG 4.49Å; S306-L314 VanDerWaalsContact CB-CD1 3.44Å; W308-L314 HydrophobicContact CB-CD1 3.73Å; W308-L314 HydrophobicContact CG-CD1 4.46Å
315	Q	91.6	Very high	90.3	Very high	131 Å²	131	60.3 Å²	60.3	61%	0.612	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.1	121.7	176.4	-178.6	177.9	-9.7	0	0	109.8	S306 L307 V317	S306-Q315 CarbonylContact C-O 3.55Å; S306-Q315 WeakPolarHBondContact CA-O 3.47Å; S306-Q315 WeakPolarHBondContact CB-O 3.31Å; L307-Q315 PolarHBondContact N-O 3.43Å; L307-Q315 PolarHBondContact O-N 3.45Å; Q315-V317 PolarHBondContact O-N 3.11Å
316	K	90.9	Very high	90	Very high	130 Å²	130	63.2 Å²	63.2	57%	0.565	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.6	129	173.2	-68.4	-177.8	-176.5	177.7	0	109.4
317	V	90.1	Very high	89.6	Confident	29 Å²	29	69.7 Å²	69.7	18%	0.176	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	-40	-173.6	159.9	0	0	0	0	111.5	A305 L307 Q315 M344 F357	A305-V317 PolarHBondContact O-N 2.98Å; L307-V317 HydrophobicContact CB-CG2 3.71Å; Q315-V317 PolarHBondContact O-N 3.11Å; V317-M344 HydrophobicContact CG1-CE 3.68Å; V317-M344 HydrophobicContact CG1-SD 3.83Å; V317-F357 HydrophobicContact CB-CB 4.32Å; V317-F357 HydrophobicContact CG1-CB 3.08Å; V317-F357 HydrophobicContact CG1-CD1 4.11Å; V317-F357 HydrophobicContact CG1-CD2 4.5Å; V317-F357 HydrophobicContact CG1-CG 3.72Å; V317-F357 HydrophobicContact CG2-CB 4.37Å
318	R	88.8	Confident	89.1	Confident	9 Å²	9	69.7 Å²	69.7	3%	0.034	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	147.9	174.8	-175.1	174.2	-179.4	163.9	-3.7	109.3	A304 A305 E320 M344 E353 T355 L361	A304-R318 WeakPolarHBondContact CA-O 3.48Å; A305-R318 HydrophobicContact CB-CB 4.28Å; A305-R318 PolarHBondContact N-O 3Å; A305-R318 PolarHBondContact O-N 3.47Å; R318-E320 HydrophobicContact CG-CG 4.4Å; R318-E320 IonicContact CZ-OE1 2.61Å; R318-E320 IonicContact NE-OE1 2.78Å; R318-E320 PolarHBondContact NE-OE1 3.26Å; R318-E320 IonicContact NH2-OE1 3.36Å; R318-E320 PolarHBondContact NH2-OE1 3.42Å; R318-M344 HydrophobicContact CB-CE 3.37Å; R318-M344 HydrophobicContact CG-CE 4.25Å; R318-E353 IonicContact CZ-OE2 3.81Å; R318-E353 VanDerWaalsContact CZ-OE2 3.25Å; R318-E353 IonicContact NH1-OE2 3.12Å; R318-E353 PolarHBondContact NH1-OE2 2.92Å; R318-E353 IonicContact NH2-OE2 3.43Å; R318-E353 PolarHBondContact NH2-OE2 3.46Å; R318-T355 PolarHBondContact NH1-OG1 2.78Å; R318-L361 HydrophobicContact CG-CD1 4.22Å; R318-L361 HydrophobicContact CG-CD2 4Å
319	T	88.8	Confident	88.6	Confident	75 Å²	75	80.2 Å²	80.2	46%	0.46	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	124.4	174.4	-58.5	0	0	0	0	108
320	E	86.8	Confident	88.2	Confident	44 Å²	44	79.7 Å²	79.7	21%	0.206	41%	0.409	C	S	.	.			trans	-121.4	125	177.4	-65.7	-62.8	165.4	0	0	109	G303 R318 L324 Y346	G303-E320 WeakPolarHBondContact CA-O 3.45Å; G303-E320 PolarHBondContact O-N 3.4Å; R318-E320 HydrophobicContact CG-CG 4.4Å; R318-E320 IonicContact CZ-OE1 2.61Å; R318-E320 IonicContact NE-OE1 2.78Å; R318-E320 PolarHBondContact NE-OE1 3.26Å; R318-E320 IonicContact NH2-OE1 3.36Å; R318-E320 PolarHBondContact NH2-OE1 3.42Å; E320-L324 HydrophobicContact CG-CD2 4.44Å; E320-Y346 HydrophobicContact CB-CE1 4.41Å; E320-Y346 HydrophobicContact CG-CE1 3.83Å
321	E	84.6	Confident	88.1	Confident	198 Å²	198	79.7 Å²	79.7	93%	0.925	41%	0.411	S	S	*	.	S	Bend	trans	-82.2	-25.6	177.4	-63.1	-176.7	174.6	0	0	111.9
322	S	86.4	Confident	88.3	Confident	77 Å²	77	76.7 Å²	76.7	54%	0.538	38%	0.378	S	S	.	.	S	Bend	trans	-121.8	173.1	-178.8	64	0	0	0	0	112.4	R333	S322-R333 PolarHBondContact O-NH2 2.75Å
323	N	87.8	Confident	88.5	Confident	20 Å²	20	66.4 Å²	66.4	11%	0.107	34%	0.339	C	S	.	.			trans	-64.9	153.9	167.2	-65	-61.3	0	0	0	111.1	F326 A328 R333 D348 T350	N323-F326 WeakPolarHBondContact CB-O 3.07Å; N323-A328 PolarHBondContact ND2-N 3.44Å; N323-A328 PolarHBondContact ND2-O 2.97Å; N323-R333 PolarHBondContact OD1-NH1 3.08Å; N323-R333 PolarHBondContact OD1-NH2 2.97Å; N323-D348 WeakPolarHBondContact CA-OD2 3.38Å; N323-D348 WeakPolarHBondContact CB-OD2 3.43Å; N323-T350 HydrophobicContact CB-CG2 4.22Å
324	L	87.8	Confident	88.8	Confident	30 Å²	30	65.9 Å²	65.9	16%	0.157	33%	0.331	C	S	.	.	S	Bend	trans	-63.4	-51.6	-173.6	-67.4	174.4	0	0	0	112.2	E320 Y346 D348 E353	E320-L324 HydrophobicContact CG-CD2 4.44Å; L324-Y346 HydrophobicContact CD1-CD1 4.11Å; L324-Y346 HydrophobicContact CD1-CE1 4.39Å; L324-Y346 HydrophobicContact CD2-CD1 3.98Å; L324-Y346 HydrophobicContact CD2-CE1 3.94Å; L324-Y346 HydrophobicContact CG-CD1 4.4Å; L324-Y346 HydrophobicContact CG-CE1 4.29Å; L324-D348 PolarHBondContact N-OD2 2.96Å; L324-E353 HydrophobicContact CD1-CG 4.31Å
325	Y	87.9	Confident	89	Confident	42 Å²	42	62.6 Å²	62.6	17%	0.165	31%	0.314	C	S	.	.	S	Bend	trans	-115.3	-41.2	-171.3	-57.9	-67.3	0	0	0	114.7	T350 E353 T368 R371	Y325-T350 WeakPolarHBondContact CD2-OG1 3.41Å; Y325-T350 PolarHBondContact N-OG1 2.85Å; Y325-E353 WeakPolarHBondContact OH-CG 3.39Å; Y325-E353 PolarHBondContact OH-OE1 2.75Å; Y325-T368 HydrophobicContact CE1-CG2 4.38Å; Y325-T368 WeakPolarHBondContact OH-CB 3.37Å; Y325-T368 WeakPolarHBondContact OH-CG2 3.31Å; Y325-T368 PolarHBondContact OH-OG1 3.15Å; Y325-R371 HydrophobicContact CD1-CG 4.05Å; Y325-R371 HydrophobicContact CD2-CB 4.44Å; Y325-R371 HydrophobicContact CD2-CG 4Å; Y325-R371 HydrophobicContact CE1-CG 4.21Å; Y325-R371 HydrophobicContact CE2-CB 4.16Å; Y325-R371 HydrophobicContact CE2-CG 4.19Å; Y325-R371 HydrophobicContact CG-CG 3.94Å
326	F	87.9	Confident	89.1	Confident	60 Å²	60	56.7 Å²	56.7	26%	0.263	29%	0.287	S	S	.	.	S	Bend	trans	-149.9	165.2	-178.5	59.7	-97.9	0	0	0	111.4	N323 A328 T350 I372	N323-F326 WeakPolarHBondContact CB-O 3.07Å; F326-A328 PolarHBondContact O-N 2.98Å; F326-T350 HydrophobicContact CD1-CG2 4.03Å; F326-T350 HydrophobicContact CD2-CG2 3.73Å; F326-T350 HydrophobicContact CE1-CG2 3.87Å; F326-T350 HydrophobicContact CE2-CG2 3.53Å; F326-T350 HydrophobicContact CG-CG2 3.97Å; F326-T350 HydrophobicContact CZ-CG2 3.61Å; F326-T350 WeakPolarHBondContact O-CG2 3.18Å; F326-I372 HydrophobicContact CE1-CB 4.38Å
327	N	85.5	Confident	89.3	Confident	145 Å²	145	50.5 Å²	50.5	78%	0.775	26%	0.26	S	S	*	.			trans	-72.3	119.8	-175.1	-164.1	8.2	0	0	0	112
328	A	85.1	Confident	89.4	Confident	10 Å²	10	49.2 Å²	49.2	8%	0.083	25%	0.252	C	S	.	.			trans	-122.5	140.1	171.6	0	0	0	0	0	109.5	N323 F326 S330 R349 T350	N323-A328 PolarHBondContact ND2-N 3.44Å; N323-A328 PolarHBondContact ND2-O 2.97Å; F326-A328 PolarHBondContact O-N 2.98Å; A328-S330 VanDerWaalsContact C-N 3.25Å; A328-S330 PolarHBondContact O-N 3.01Å; A328-R349 HydrophobicContact CB-CB 4.16Å; A328-T350 HydrophobicContact CB-CG2 4.07Å
329	K	84.4	Confident	89.5	Confident	222 Å²	222	49.9 Å²	49.9	97%	0.965	26%	0.259	S	S	*	.	S	Bend	trans	-72.3	-14.8	-177.9	-68.1	-173.9	176.4	-175.1	0	114.4
330	S	86.6	Confident	89.7	Confident	22 Å²	22	49.5 Å²	49.5	15%	0.154	25%	0.252	C	S	.	.			trans	-81.6	136.8	-175.1	166.5	0	0	0	0	110.9	E178 A328 W332 R349	E178-S330 WeakPolarHBondContact OE1-CB 3.49Å; E178-S330 PolarHBondContact OE1-OG 3.32Å; E178-S330 PolarHBondContact OE2-OG 2.92Å; A328-S330 VanDerWaalsContact C-N 3.25Å; A328-S330 PolarHBondContact O-N 3.01Å; S330-W332 VanDerWaalsContact C-N 3.26Å; S330-W332 WeakPolarHBondContact OG-CB 3.34Å; S330-W332 PolarHBondContact OG-N 3.15Å; S330-W332 VanDerWaalsContact OG-N 3.1Å; S330-R349 PolarHBondContact OG-NE 3.45Å; S330-R349 VanDerWaalsContact OG-NE 3.16Å
331	S	89.6	Confident	89.8	Confident	46 Å²	46	49.2 Å²	49.2	32%	0.322	25%	0.254	S	S	.	.			trans	-84.8	2.5	172.1	58.4	0	0	0	0	112.8	E301 R333	E301-S331 WeakPolarHBondContact CA-O 3.34Å; E301-S331 PolarHBondContact OE2-OG 2.94Å; S331-R333 PolarHBondContact O-N 2.92Å
332	W	92.9	Very high	90.2	Very high	5 Å²	5	42.8 Å²	42.8	2%	0.019	22%	0.221	C	C	.	.			trans	-64.6	121.8	-178.4	180	81.8	0	0	0	112.1	T181 S330 W334 R349 L384 L385	T181-W332 HydrophobicContact CG2-CZ2 3.96Å; S330-W332 VanDerWaalsContact C-N 3.26Å; S330-W332 WeakPolarHBondContact OG-CB 3.34Å; S330-W332 PolarHBondContact OG-N 3.15Å; S330-W332 VanDerWaalsContact OG-N 3.1Å; W332-W334 HydrophobicContact CH2-CB 3.68Å; W332-W334 HydrophobicContact CH2-CG 4.23Å; W332-W334 HydrophobicContact CZ2-CB 3.55Å; W332-W334 AromaticContact CZ2-CD2 3.97Å; W332-W334 HydrophobicContact CZ2-CD2 3.97Å; W332-W334 AromaticContact CZ2-CE3 3.8Å; W332-W334 HydrophobicContact CZ2-CE3 3.8Å; W332-W334 AromaticContact CZ2-CG 3.91Å; W332-W334 HydrophobicContact CZ2-CG 3.91Å; W332-W334 HydrophobicContact CZ3-CB 4.34Å; W332-R349 HydrophobicContact CE3-CG 4.32Å; W332-L384 HydrophobicContact CZ3-CD2 4.4Å; W332-L385 WeakPolarHBondContact CH2-O 3.33Å; W332-L385 WeakPolarHBondContact CZ2-O 3.19Å
333	R	94.3	Very high	90.4	Very high	13 Å²	13	40.2 Å²	40.2	5%	0.049	20%	0.203	C	C	.	.			trans	-124.6	144.6	173.6	-54.6	-60.4	-172.4	-161.2	-5.5	110.3	S284 A299 S300 S322 N323 S331 Y346 D348	S284-R333 WeakPolarHBondContact CB-O 3.35Å; S284-R333 PolarHBondContact OG-O 3.06Å; A299-R333 HydrophobicContact CB-CB 4.15Å; S300-R333 WeakPolarHBondContact O-CG 3.33Å; S322-R333 PolarHBondContact O-NH2 2.75Å; N323-R333 PolarHBondContact OD1-NH1 3.08Å; N323-R333 PolarHBondContact OD1-NH2 2.97Å; S331-R333 PolarHBondContact O-N 2.92Å; R333-Y346 HydrophobicContact CB-CE2 4.46Å; R333-Y346 VanDerWaalsContact CD-OH 3.29Å; R333-Y346 WeakPolarHBondContact CD-OH 3.46Å; R333-D348 IonicContact NH1-OD2 3.18Å; R333-D348 PolarHBondContact NH1-OD2 2.98Å; R333-D348 VanDerWaalsContact NH1-OD2 3.16Å
334	W	95.4	Very high	90.7	Very high	7 Å²	7	39.3 Å²	39.3	3%	0.027	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	141.4	-177.6	-171.1	-93.3	0	0	0	111.6	T181 C285 W332 Y346 A347 L386 V387	T181-W334 HydrophobicContact CG2-CE3 4.08Å; T181-W334 HydrophobicContact CG2-CH2 4.34Å; T181-W334 HydrophobicContact CG2-CZ3 3.7Å; C285-W334 HydrophobicContact CB-CD2 3.96Å; C285-W334 HydrophobicContact CB-CE3 3.52Å; C285-W334 HydrophobicContact CB-CG 4.45Å; C285-W334 HydrophobicContact CB-CZ3 3.97Å; C285-W334 VanDerWaalsContact SG-CE2 3.56Å; C285-W334 VanDerWaalsContact SG-CZ3 3.56Å; W332-W334 HydrophobicContact CH2-CB 3.68Å; W332-W334 HydrophobicContact CH2-CG 4.23Å; W332-W334 HydrophobicContact CZ2-CB 3.55Å; W332-W334 AromaticContact CZ2-CD2 3.97Å; W332-W334 HydrophobicContact CZ2-CD2 3.97Å; W332-W334 AromaticContact CZ2-CE3 3.8Å; W332-W334 HydrophobicContact CZ2-CE3 3.8Å; W332-W334 AromaticContact CZ2-CG 3.91Å; W332-W334 HydrophobicContact CZ2-CG 3.91Å; W332-W334 HydrophobicContact CZ3-CB 4.34Å; W334-Y346 WeakPolarHBondContact O-CA 3.41Å; W334-A347 HydrophobicContact CB-CB 4.17Å; W334-A347 PolarHBondContact N-O 3.48Å; W334-A347 PolarHBondContact O-N 2.84Å; W334-L386 HydrophobicContact CH2-CD1 3.87Å; W334-L386 HydrophobicContact CZ2-CD1 3.89Å; W334-L386 HydrophobicContact CZ3-CD1 4.44Å; W334-V387 PolarHBondContact NE1-O 3.14Å
335	C	94.8	Very high	91	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	136.4	177.1	63.6	0	0	0	0	112.2	C285 S287 L297 V298 A299 A305 L345	C285-C335 PolarHBondContact SG-O 3.19Å; S287-C335 WeakPolarHBondContact CB-O 3.46Å; L297-C335 HydrophobicContact CB-CB 4.35Å; V298-C335 VanDerWaalsContact C-SG 3.56Å; A299-C335 HydrophobicContact CB-CB 4.18Å; A299-C335 PolarHBondContact N-SG 3.12Å; A305-C335 HydrophobicContact CB-CB 4.49Å; C335-L345 WeakPolarHBondContact CA-O 3.43Å
336	E	94.3	Very high	91.3	Very high	6 Å²	6	35.9 Å²	35.9	3%	0.028	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	152.9	178	-167.4	162	-155.1	0	0	111	M344 L345 R388 F389	E336-M344 CarbonylContact O-C 3.51Å; E336-M344 WeakPolarHBondContact O-CA 3.35Å; E336-L345 PolarHBondContact N-O 3.46Å; E336-L345 PolarHBondContact O-N 2.91Å; E336-R388 WeakPolarHBondContact OE1-CD 3.43Å; E336-R388 IonicContact OE1-CZ 3.89Å; E336-R388 IonicContact OE1-NE 3.9Å; E336-R388 IonicContact OE1-NH1 2.97Å; E336-R388 PolarHBondContact OE1-NH1 3.49Å; E336-R388 WeakPolarHBondContact OE2-CA 3.35Å; E336-F389 HydrophobicContact CG-CB 3.84Å; E336-F389 PolarHBondContact OE1-N 3.24Å; E336-F389 PolarHBondContact OE2-N 2.83Å
337	F	94.4	Very high	91.6	Very high	1 Å²	1	33 Å²	33	0%	0.004	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	143.2	173.7	-69.6	-86.8	0	0	0	110.5	S289 P290 E295 L297 L307 F357 F389	S289-F337 VanDerWaalsContact CA-CD2 3.4Å; S289-F337 VanDerWaalsContact CB-CE2 3.48Å; P290-F337 HydrophobicContact CG-CB 4.37Å; E295-F337 HydrophobicContact CB-CZ 4.36Å; L297-F337 HydrophobicContact CB-CE2 4.13Å; L297-F337 HydrophobicContact CB-CZ 4.48Å; L297-F337 HydrophobicContact CD1-CD1 3.85Å; L297-F337 HydrophobicContact CD1-CD2 3.61Å; L297-F337 HydrophobicContact CD1-CE1 3.85Å; L297-F337 HydrophobicContact CD1-CE2 3.61Å; L297-F337 HydrophobicContact CD1-CG 3.75Å; L297-F337 HydrophobicContact CD1-CZ 3.75Å; L297-F337 HydrophobicContact CD2-CZ 4.26Å; L297-F337 HydrophobicContact CG-CD1 4.46Å; L297-F337 HydrophobicContact CG-CD2 4.04Å; L297-F337 HydrophobicContact CG-CE1 3.97Å; L297-F337 HydrophobicContact CG-CE2 3.49Å; L297-F337 VanDerWaalsContact CG-CE2 3.49Å; L297-F337 HydrophobicContact CG-CZ 3.47Å; L297-F337 VanDerWaalsContact CG-CZ 3.47Å; L307-F337 HydrophobicContact CD1-CE1 4.28Å; L307-F337 HydrophobicContact CD1-CZ 3.93Å; F337-F357 HydrophobicContact CE1-CZ 4.48Å; F337-F389 WeakPolarHBondContact O-CB 3.39Å; F337-F389 WeakPolarHBondContact O-CD1 3.24Å; F337-F389 VanDerWaalsContact O-CG 3.32Å; F337-F389 WeakPolarHBondContact O-CG 3.47Å
338	S	93.4	Very high	92	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.007	13%	0.133	C	C	.	.			trans	-95.6	-164.5	172.4	93.1	0	0	0	0	111.4	H291 H340 V343 E411	H291-S338 PolarHBondContact NE2-O 2.73Å; S338-H340 PolarHBondContact O-N 2.79Å; S338-H340 VanDerWaalsContact O-N 3.15Å; S338-H340 PolarHBondContact OG-N 3.43Å; S338-V343 PolarHBondContact N-O 2.87Å; S338-V343 VanDerWaalsContact N-O 3.15Å; S338-V343 WeakPolarHBondContact OG-CB 3.3Å; S338-V343 WeakPolarHBondContact OG-CG1 3.48Å; S338-E411 VanDerWaalsContact CB-OE2 3.29Å; S338-E411 WeakPolarHBondContact CB-OE2 3.33Å; S338-E411 PolarHBondContact OG-OE2 3.22Å; S338-E411 VanDerWaalsContact OG-OE2 3.07Å
339	A	91.6	Very high	92.4	Very high	23 Å²	23	26 Å²	26	19%	0.19	13%	0.13	C	C	.	.	S	Bend	trans	-57.5	-26	176.3	0	0	0	0	0	113.6	H291 F389 P395 F396 E411	H291-A339 PolarHBondContact CE1-O 3.29Å; H291-A339 PolarHBondContact NE2-O 3.46Å; A339-F389 HydrophobicContact CB-CZ 4.48Å; A339-P395 WeakPolarHBondContact CB-O 3.44Å; A339-F396 HydrophobicContact CB-CD1 3.58Å; A339-F396 HydrophobicContact CB-CE1 3.76Å; A339-E411 VanDerWaalsContact CB-CD 3.49Å; A339-E411 WeakPolarHBondContact CB-OE1 3.19Å; A339-E411 WeakPolarHBondContact CB-OE2 3.34Å; A339-E411 PolarHBondContact N-OE2 3.42Å
340	H	91.3	Very high	92.7	Very high	68 Å²	68	15.4 Å²	15.4	32%	0.315	8%	0.084	S	C	.	.	S	Bend	trans	-103.1	135.9	179.2	-171.5	-82.9	0	0	0	111.3	S338 R342 V343 R358	S338-H340 PolarHBondContact O-N 2.79Å; S338-H340 VanDerWaalsContact O-N 3.15Å; S338-H340 PolarHBondContact OG-N 3.43Å; H340-R342 PolarHBondContact ND1-N 3.23Å; H340-R342 VanDerWaalsContact ND1-N 3.13Å; H340-R342 PolarHBondContact O-N 2.85Å; H340-V343 HydrophobicContact CB-CB 4.09Å; H340-V343 HydrophobicContact CB-CG2 3.83Å; H340-V343 PolarHBondContact O-N 2.88Å; H340-V343 VanDerWaalsContact O-N 3.08Å; H340-R358 VanDerWaalsContact CE1-CZ 3.43Å; H340-R358 PolarHBondContact CE1-NH1 2.86Å; H340-R358 VanDerWaalsContact CE1-NH1 3.26Å
341	P	89.7	Confident	93	Very high	37 Å²	37	14.4 Å²	14.4	24%	0.24	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-19.2	-176.3	21	-34.2	0	0	0	115.5	H291 I292	H291-P341 HydrophobicContact CB-CB 3.66Å; H291-P341 VanDerWaalsContact CD2-CA 3.46Å; H291-P341 WeakPolarHBondContact CD2-CA 3.42Å; I292-P341 HydrophobicContact CD1-CB 4.32Å
342	R	92.1	Very high	93.3	Very high	63 Å²	63	12.2 Å²	12.2	24%	0.238	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.4	9.4	-176.9	-54.2	-64.5	179.9	-154.4	-0.5	114.4	E295 H340 F357 R358	E295-R342 IonicContact OE1-CZ 2.92Å; E295-R342 VanDerWaalsContact OE1-CZ 3.32Å; E295-R342 IonicContact OE1-NH1 3.2Å; E295-R342 PolarHBondContact OE1-NH1 3.32Å; E295-R342 IonicContact OE1-NH2 3.94Å; E295-R342 PolarHBondContact OE1-NH2 3.42Å; E295-R342 IonicContact OE2-CZ 3.07Å; E295-R342 IonicContact OE2-NH1 2.84Å; E295-R342 PolarHBondContact OE2-NH1 3.08Å; E295-R342 IonicContact OE2-NH2 3.93Å; H340-R342 PolarHBondContact ND1-N 3.23Å; H340-R342 VanDerWaalsContact ND1-N 3.13Å; H340-R342 PolarHBondContact O-N 2.85Å; R342-F357 VanDerWaalsContact CA-CZ 3.42Å; R342-F357 HydrophobicContact CB-CD2 4.49Å; R342-F357 HydrophobicContact CB-CE2 4.06Å; R342-F357 HydrophobicContact CB-CZ 4.16Å; R342-F357 HydrophobicContact CG-CE2 4.35Å; R342-F357 WeakPolarHBondContact O-CD1 3.19Å; R342-F357 VanDerWaalsContact O-CE1 3.32Å; R342-F357 WeakPolarHBondContact O-CE1 3.32Å; R342-F357 WeakPolarHBondContact O-CG 3.49Å; R342-F357 PolarHBondContact O-N 2.85Å; R342-F357 VanDerWaalsContact O-N 3.14Å; R342-R358 HydrophobicContact CB-CG 3.67Å; R342-R358 HydrophobicContact CG-CG 4.08Å
343	V	91.9	Very high	93.3	Very high	24 Å²	24	13 Å²	13	15%	0.145	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	128.3	171.2	179.7	0	0	0	0	107	S338 H340 L354 T355 D356	S338-V343 PolarHBondContact N-O 2.87Å; S338-V343 VanDerWaalsContact N-O 3.15Å; S338-V343 WeakPolarHBondContact OG-CB 3.3Å; S338-V343 WeakPolarHBondContact OG-CG1 3.48Å; H340-V343 HydrophobicContact CB-CB 4.09Å; H340-V343 HydrophobicContact CB-CG2 3.83Å; H340-V343 PolarHBondContact O-N 2.88Å; H340-V343 VanDerWaalsContact O-N 3.08Å; V343-L354 HydrophobicContact CG1-CB 4.15Å; V343-L354 HydrophobicContact CG1-CD2 4.37Å; V343-T355 WeakPolarHBondContact CA-O 3.39Å; V343-D356 HydrophobicContact CG2-CB 4.15Å
344	M	92.9	Very high	93.2	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	142.7	175	70.7	179.4	-170.1	0	0	110.1	L297 A305 V317 R318 E336 L354 T355 F357	L297-M344 HydrophobicContact CD1-CB 3.73Å; L297-M344 HydrophobicContact CD2-SD 4.14Å; A305-M344 HydrophobicContact CB-CE 3.9Å; A305-M344 HydrophobicContact CB-SD 4.21Å; V317-M344 HydrophobicContact CG1-CE 3.68Å; V317-M344 HydrophobicContact CG1-SD 3.83Å; R318-M344 HydrophobicContact CB-CE 3.37Å; R318-M344 HydrophobicContact CG-CE 4.25Å; E336-M344 CarbonylContact O-C 3.51Å; E336-M344 WeakPolarHBondContact O-CA 3.35Å; M344-L354 CarbonylContact O-C 3.34Å; M344-L354 WeakPolarHBondContact O-CA 3.41Å; M344-T355 HydrophobicContact CE-CG2 4.34Å; M344-T355 PolarHBondContact N-O 2.91Å; M344-T355 PolarHBondContact O-N 3.09Å; M344-F357 HydrophobicContact CB-CD1 4.13Å; M344-F357 HydrophobicContact CB-CE1 4.09Å; M344-F357 HydrophobicContact CG-CD1 4.01Å; M344-F357 HydrophobicContact CG-CE1 4.47Å; M344-F357 HydrophobicContact SD-CD1 4.25Å
345	L	94.5	Very high	93	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	127.5	164.3	-173	153	0	0	0	108	C335 E336 A347 V352 E353 L354 L369 V387 H398	C335-L345 WeakPolarHBondContact CA-O 3.43Å; E336-L345 PolarHBondContact N-O 3.46Å; E336-L345 PolarHBondContact O-N 2.91Å; L345-A347 HydrophobicContact CD2-CB 3.85Å; L345-V352 HydrophobicContact CD1-CG1 3.65Å; L345-V352 HydrophobicContact CD2-CG1 3.49Å; L345-V352 VanDerWaalsContact CD2-CG1 3.49Å; L345-V352 HydrophobicContact CG-CG1 3.35Å; L345-E353 CarbonylContact C-O 3.53Å; L345-E353 WeakPolarHBondContact CA-O 3.46Å; L345-L354 HydrophobicContact CB-CD2 4.09Å; L345-L354 HydrophobicContact CD1-CD2 4.49Å; L345-L354 HydrophobicContact CG-CD2 4.44Å; L345-L369 HydrophobicContact CD1-CD2 3.99Å; L345-V387 HydrophobicContact CD1-CG1 3.57Å; L345-V387 HydrophobicContact CD2-CB 4.12Å; L345-V387 HydrophobicContact CD2-CG1 3.55Å; L345-V387 HydrophobicContact CD2-CG2 4.33Å; L345-V387 HydrophobicContact CG-CG1 4.22Å; L345-H398 HydrophobicContact CD1-CB 4.45Å; L345-H398 WeakPolarHBondContact CD1-ND1 3.33Å
346	Y	94.6	Very high	92.8	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	129.7	171	-176.8	-98.2	0	0	0	108.7	G303 A305 E320 L324 R333 W334 E353	G303-Y346 PolarHBondContact O-OH 3.25Å; A305-Y346 HydrophobicContact CB-CD2 3.92Å; A305-Y346 HydrophobicContact CB-CE2 4.07Å; E320-Y346 HydrophobicContact CB-CE1 4.41Å; E320-Y346 HydrophobicContact CG-CE1 3.83Å; L324-Y346 HydrophobicContact CD1-CD1 4.11Å; L324-Y346 HydrophobicContact CD1-CE1 4.39Å; L324-Y346 HydrophobicContact CD2-CD1 3.98Å; L324-Y346 HydrophobicContact CD2-CE1 3.94Å; L324-Y346 HydrophobicContact CG-CD1 4.4Å; L324-Y346 HydrophobicContact CG-CE1 4.29Å; R333-Y346 HydrophobicContact CB-CE2 4.46Å; R333-Y346 VanDerWaalsContact CD-OH 3.29Å; R333-Y346 WeakPolarHBondContact CD-OH 3.46Å; W334-Y346 WeakPolarHBondContact O-CA 3.41Å; Y346-E353 PolarHBondContact N-O 2.8Å; Y346-E353 PolarHBondContact O-N 2.84Å
347	A	94.6	Very high	92.5	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	149.1	-174.5	0	0	0	0	0	112.3	W334 L345 G351 V352 L384 V387	W334-A347 HydrophobicContact CB-CB 4.17Å; W334-A347 PolarHBondContact N-O 3.48Å; W334-A347 PolarHBondContact O-N 2.84Å; L345-A347 HydrophobicContact CD2-CB 3.85Å; A347-G351 WeakPolarHBondContact CA-O 3.43Å; A347-V352 HydrophobicContact CB-CB 4.41Å; A347-V352 HydrophobicContact CB-CG1 4.31Å; A347-V352 HydrophobicContact CB-CG2 3.85Å; A347-L384 HydrophobicContact CB-CD2 3.9Å; A347-V387 HydrophobicContact CB-CG2 3.8Å
348	D	93.9	Very high	92.1	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.109	C	C	.	.			trans	-134.7	-173.7	169.6	72.6	2.1	0	0	0	110.3	N323 L324 R333 T350 G351 L384	N323-D348 WeakPolarHBondContact CA-OD2 3.38Å; N323-D348 WeakPolarHBondContact CB-OD2 3.43Å; L324-D348 PolarHBondContact N-OD2 2.96Å; R333-D348 IonicContact NH1-OD2 3.18Å; R333-D348 PolarHBondContact NH1-OD2 2.98Å; R333-D348 VanDerWaalsContact NH1-OD2 3.16Å; D348-T350 VanDerWaalsContact CG-OG1 3.27Å; D348-T350 PolarHBondContact O-N 3.23Å; D348-T350 VanDerWaalsContact OD1-CA 3.31Å; D348-T350 WeakPolarHBondContact OD1-CA 3.49Å; D348-T350 WeakPolarHBondContact OD1-CB 3.42Å; D348-T350 PolarHBondContact OD1-N 3.42Å; D348-T350 PolarHBondContact OD1-OG1 2.9Å; D348-T350 PolarHBondContact OD2-OG1 2.82Å; D348-G351 PolarHBondContact N-O 3.28Å; D348-G351 VanDerWaalsContact N-O 3.08Å; D348-G351 PolarHBondContact OD1-N 2.84Å; D348-L384 WeakPolarHBondContact O-CB 3.27Å; D348-L384 VanDerWaalsContact O-CD2 3.27Å; D348-L384 WeakPolarHBondContact O-CD2 3.36Å
349	R	92.3	Very high	91.4	Very high	8 Å²	8	27.1 Å²	27.1	3%	0.03	13%	0.13	C	C	.	.	S	Bend	trans	-62.4	-12.7	178.9	-61.9	-56.7	-168.9	-175.6	-1	114.5	E178 A328 S330 W332 I372 R383 L384	E178-R349 IonicContact OE1-CZ 2.65Å; E178-R349 IonicContact OE1-NE 2.7Å; E178-R349 PolarHBondContact OE1-NE 2.83Å; E178-R349 IonicContact OE1-NH2 3.33Å; E178-R349 PolarHBondContact OE1-NH2 2.88Å; E178-R349 IonicContact OE2-NH2 3.56Å; A328-R349 HydrophobicContact CB-CB 4.16Å; S330-R349 PolarHBondContact OG-NE 3.45Å; S330-R349 VanDerWaalsContact OG-NE 3.16Å; W332-R349 HydrophobicContact CE3-CG 4.32Å; R349-I372 WeakPolarHBondContact O-CD1 3.29Å; R349-R383 HydrophobicContact CB-CB 4.33Å; R349-R383 WeakPolarHBondContact O-CA 3.43Å; R349-L384 WeakPolarHBondContact CD-O 3.21Å; R349-L384 PolarHBondContact NH1-O 3.1Å; R349-L384 PolarHBondContact O-N 2.87Å
350	T	92.6	Very high	90.2	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.155	C	C	.	.	S	Bend	trans	-103.7	-28.2	-171.1	74.2	0	0	0	0	113.2	N323 Y325 F326 A328 D348 I372	N323-T350 HydrophobicContact CB-CG2 4.22Å; Y325-T350 WeakPolarHBondContact CD2-OG1 3.41Å; Y325-T350 PolarHBondContact N-OG1 2.85Å; F326-T350 HydrophobicContact CD1-CG2 4.03Å; F326-T350 HydrophobicContact CD2-CG2 3.73Å; F326-T350 HydrophobicContact CE1-CG2 3.87Å; F326-T350 HydrophobicContact CE2-CG2 3.53Å; F326-T350 HydrophobicContact CG-CG2 3.97Å; F326-T350 HydrophobicContact CZ-CG2 3.61Å; F326-T350 WeakPolarHBondContact O-CG2 3.18Å; A328-T350 HydrophobicContact CB-CG2 4.07Å; D348-T350 VanDerWaalsContact CG-OG1 3.27Å; D348-T350 PolarHBondContact O-N 3.23Å; D348-T350 VanDerWaalsContact OD1-CA 3.31Å; D348-T350 WeakPolarHBondContact OD1-CA 3.49Å; D348-T350 WeakPolarHBondContact OD1-CB 3.42Å; D348-T350 PolarHBondContact OD1-N 3.42Å; D348-T350 PolarHBondContact OD1-OG1 2.9Å; D348-T350 PolarHBondContact OD2-OG1 2.82Å; T350-I372 VanDerWaalsContact O-CG1 3.3Å; T350-I372 WeakPolarHBondContact O-CG1 3.49Å; T350-I372 PolarHBondContact O-N 3.4Å
351	G	92.6	Very high	88.8	Confident	0 Å²	0	34 Å²	34	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.2	-160.5	173.4	0	0	0	0	0	113.3	A347 D348 F370	A347-G351 WeakPolarHBondContact CA-O 3.43Å; D348-G351 PolarHBondContact N-O 3.28Å; D348-G351 VanDerWaalsContact N-O 3.08Å; D348-G351 PolarHBondContact OD1-N 2.84Å; G351-F370 CarbonylContact C-O 3.56Å; G351-F370 WeakPolarHBondContact CA-O 3.48Å
352	V	94.6	Very high	87.3	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	135.5	-167.3	-174.9	0	0	0	0	110.7	L345 A347 L369 F370 L384 V387 L400	L345-V352 HydrophobicContact CD1-CG1 3.65Å; L345-V352 HydrophobicContact CD2-CG1 3.49Å; L345-V352 VanDerWaalsContact CD2-CG1 3.49Å; L345-V352 HydrophobicContact CG-CG1 3.35Å; A347-V352 HydrophobicContact CB-CB 4.41Å; A347-V352 HydrophobicContact CB-CG1 4.31Å; A347-V352 HydrophobicContact CB-CG2 3.85Å; V352-L369 HydrophobicContact CB-CB 4.38Å; V352-L369 HydrophobicContact CG1-CB 4.15Å; V352-L369 HydrophobicContact CG1-CD2 4.13Å; V352-L369 PolarHBondContact O-N 3.26Å; V352-F370 HydrophobicContact CB-CB 4.13Å; V352-F370 HydrophobicContact CG2-CB 4.26Å; V352-F370 PolarHBondContact N-O 3.34Å; V352-F370 PolarHBondContact O-N 3.23Å; V352-L384 HydrophobicContact CG2-CD2 3.42Å; V352-L384 VanDerWaalsContact CG2-CD2 3.42Å; V352-V387 HydrophobicContact CG2-CG2 4.11Å; V352-L400 HydrophobicContact CG2-CD1 4.09Å; V352-L400 HydrophobicContact CG2-CD2 3.84Å
353	E	93.7	Very high	85.6	Confident	22 Å²	22	41.9 Å²	41.9	10%	0.103	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	146	175.2	-68.4	-177.2	178.9	0	0	111.8	R318 L324 Y325 L345 Y346 L367	R318-E353 IonicContact CZ-OE2 3.81Å; R318-E353 VanDerWaalsContact CZ-OE2 3.25Å; R318-E353 IonicContact NH1-OE2 3.12Å; R318-E353 PolarHBondContact NH1-OE2 2.92Å; R318-E353 IonicContact NH2-OE2 3.43Å; R318-E353 PolarHBondContact NH2-OE2 3.46Å; L324-E353 HydrophobicContact CD1-CG 4.31Å; Y325-E353 WeakPolarHBondContact OH-CG 3.39Å; Y325-E353 PolarHBondContact OH-OE1 2.75Å; L345-E353 CarbonylContact C-O 3.53Å; L345-E353 WeakPolarHBondContact CA-O 3.46Å; Y346-E353 PolarHBondContact N-O 2.8Å; Y346-E353 PolarHBondContact O-N 2.84Å; E353-L367 CarbonylContact C-O 3.59Å; E353-L367 WeakPolarHBondContact CA-O 3.26Å
354	L	92.9	Very high	83.9	Confident	13 Å²	13	45.8 Å²	45.8	7%	0.068	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	126.7	170.5	-64.8	168.9	0	0	0	109	V343 M344 L345 G366 L367 L369 E411	V343-L354 HydrophobicContact CG1-CB 4.15Å; V343-L354 HydrophobicContact CG1-CD2 4.37Å; M344-L354 CarbonylContact O-C 3.34Å; M344-L354 WeakPolarHBondContact O-CA 3.41Å; L345-L354 HydrophobicContact CB-CD2 4.09Å; L345-L354 HydrophobicContact CD1-CD2 4.49Å; L345-L354 HydrophobicContact CG-CD2 4.44Å; L354-G366 CarbonylContact O-C 3.57Å; L354-G366 VanDerWaalsContact O-CA 3.28Å; L354-G366 WeakPolarHBondContact O-CA 3.42Å; L354-L367 HydrophobicContact CB-CB 4.35Å; L354-L367 HydrophobicContact CD1-CD2 4.42Å; L354-L367 PolarHBondContact N-O 3Å; L354-L367 PolarHBondContact O-N 3.15Å; L354-L369 HydrophobicContact CD1-CB 4.39Å; L354-L369 HydrophobicContact CD1-CD1 4.31Å; L354-L369 HydrophobicContact CG-CB 4.27Å; L354-L369 HydrophobicContact CG-CD2 4.49Å; L354-E411 HydrophobicContact CD1-CB 3.75Å
355	T	91.2	Very high	82.7	Confident	6 Å²	6	51.8 Å²	51.8	4%	0.037	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	120.5	-177.6	-46.3	0	0	0	0	109.5	R318 V343 M344 F357 L361	R318-T355 PolarHBondContact NH1-OG1 2.78Å; V343-T355 WeakPolarHBondContact CA-O 3.39Å; M344-T355 HydrophobicContact CE-CG2 4.34Å; M344-T355 PolarHBondContact N-O 2.91Å; M344-T355 PolarHBondContact O-N 3.09Å; T355-F357 PolarHBondContact O-N 2.86Å; T355-L361 HydrophobicContact CG2-CD1 3.93Å
356	D	90.4	Very high	81.9	Confident	40 Å²	40	52.5 Å²	52.5	21%	0.214	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	110.3	167.7	-172.1	-21.4	0	0	0	109.4	V343 R358 L359	V343-D356 HydrophobicContact CG2-CB 4.15Å; D356-R358 VanDerWaalsContact C-N 3.27Å; D356-R358 PolarHBondContact O-N 2.86Å; D356-R358 VanDerWaalsContact OD1-CB 3.28Å; D356-R358 WeakPolarHBondContact OD1-CB 3.48Å; D356-R358 WeakPolarHBondContact OD1-CG 3.24Å; D356-R358 IonicContact OD1-CZ 2.78Å; D356-R358 PolarHBondContact OD1-N 2.9Å; D356-R358 IonicContact OD1-NE 3.14Å; D356-R358 PolarHBondContact OD1-NE 2.98Å; D356-R358 IonicContact OD1-NH2 3.9Å; D356-R358 IonicContact OD2-CZ 3.55Å; D356-R358 VanDerWaalsContact OD2-CZ 3.32Å; D356-R358 IonicContact OD2-NE 3.52Å; D356-R358 PolarHBondContact OD2-NE 3.19Å; D356-R358 IonicContact OD2-NH2 3.22Å; D356-R358 PolarHBondContact OD2-NH2 3.46Å; D356-L359 HydrophobicContact CB-CD1 4.29Å; D356-L359 HydrophobicContact CB-CG 4.45Å; D356-L359 PolarHBondContact O-N 2.8Å
357	F	87.5	Confident	81.7	Confident	36 Å²	36	57.1 Å²	57.1	16%	0.158	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	6.8	-175.5	55.2	-103.6	0	0	0	115	L307 V317 F337 R342 M344 T355	L307-F357 HydrophobicContact CD2-CE2 3.81Å; L307-F357 HydrophobicContact CD2-CZ 4.24Å; V317-F357 HydrophobicContact CB-CB 4.32Å; V317-F357 HydrophobicContact CG1-CB 3.08Å; V317-F357 HydrophobicContact CG1-CD1 4.11Å; V317-F357 HydrophobicContact CG1-CD2 4.5Å; V317-F357 HydrophobicContact CG1-CG 3.72Å; V317-F357 HydrophobicContact CG2-CB 4.37Å; F337-F357 HydrophobicContact CE1-CZ 4.48Å; R342-F357 VanDerWaalsContact CA-CZ 3.42Å; R342-F357 HydrophobicContact CB-CD2 4.49Å; R342-F357 HydrophobicContact CB-CE2 4.06Å; R342-F357 HydrophobicContact CB-CZ 4.16Å; R342-F357 HydrophobicContact CG-CE2 4.35Å; R342-F357 WeakPolarHBondContact O-CD1 3.19Å; R342-F357 VanDerWaalsContact O-CE1 3.32Å; R342-F357 WeakPolarHBondContact O-CE1 3.32Å; R342-F357 WeakPolarHBondContact O-CG 3.49Å; R342-F357 PolarHBondContact O-N 2.85Å; R342-F357 VanDerWaalsContact O-N 3.14Å; M344-F357 HydrophobicContact CB-CD1 4.13Å; M344-F357 HydrophobicContact CB-CE1 4.09Å; M344-F357 HydrophobicContact CG-CD1 4.01Å; M344-F357 HydrophobicContact CG-CE1 4.47Å; M344-F357 HydrophobicContact SD-CD1 4.25Å; T355-F357 PolarHBondContact O-N 2.86Å
358	R	85.8	Confident	81.5	Confident	146 Å²	146	58.8 Å²	58.8	55%	0.551	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-28	165.1	-58.3	172.2	-69.9	-175.5	0	111.3	H340 R342 D356	H340-R358 VanDerWaalsContact CE1-CZ 3.43Å; H340-R358 PolarHBondContact CE1-NH1 2.86Å; H340-R358 VanDerWaalsContact CE1-NH1 3.26Å; R342-R358 HydrophobicContact CB-CG 3.67Å; R342-R358 HydrophobicContact CG-CG 4.08Å; D356-R358 VanDerWaalsContact C-N 3.27Å; D356-R358 PolarHBondContact O-N 2.86Å; D356-R358 VanDerWaalsContact OD1-CB 3.28Å; D356-R358 WeakPolarHBondContact OD1-CB 3.48Å; D356-R358 WeakPolarHBondContact OD1-CG 3.24Å; D356-R358 IonicContact OD1-CZ 2.78Å; D356-R358 PolarHBondContact OD1-N 2.9Å; D356-R358 IonicContact OD1-NE 3.14Å; D356-R358 PolarHBondContact OD1-NE 2.98Å; D356-R358 IonicContact OD1-NH2 3.9Å; D356-R358 IonicContact OD2-CZ 3.55Å; D356-R358 VanDerWaalsContact OD2-CZ 3.32Å; D356-R358 IonicContact OD2-NE 3.52Å; D356-R358 PolarHBondContact OD2-NE 3.19Å; D356-R358 IonicContact OD2-NH2 3.22Å; D356-R358 PolarHBondContact OD2-NH2 3.46Å
359	L	78.2	Confident	81.4	Confident	84 Å²	84	58.8 Å²	58.8	44%	0.44	30%	0.3	S	S	.	.	S	Bend	trans	-84	144.2	177.7	-58.5	177.9	0	0	0	108.7	D356 L361 H364	D356-L359 HydrophobicContact CB-CD1 4.29Å; D356-L359 HydrophobicContact CB-CG 4.45Å; D356-L359 PolarHBondContact O-N 2.8Å; L359-L361 PolarHBondContact O-N 3.08Å; L359-H364 HydrophobicContact CD1-CB 4.47Å
360	K	66.4	Low	81.4	Confident	167 Å²	167	58.4 Å²	58.4	73%	0.726	30%	0.298	S	S	*	.			trans	-67.9	126.7	171.7	-68.7	-174.5	178.5	-176.6	0	108.4	E362 S363	K360-E362 PolarHBondContact O-N 3.11Å; K360-E362 VanDerWaalsContact O-N 3.14Å; K360-S363 PolarHBondContact O-N 3.46Å
361	L	61.4	Low	81.3	Confident	68 Å²	68	63 Å²	63	36%	0.356	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-54.9	-32.9	-175.1	-168.1	69.4	0	0	0	112.8	R318 T355 L359 S363 H364	R318-L361 HydrophobicContact CG-CD1 4.22Å; R318-L361 HydrophobicContact CG-CD2 4Å; T355-L361 HydrophobicContact CG2-CD1 3.93Å; L359-L361 PolarHBondContact O-N 3.08Å; L361-S363 PolarHBondContact O-N 3.16Å; L361-H364 PolarHBondContact O-N 2.81Å
362	E	59.7	Low	81.1	Confident	189 Å²	189	63.7 Å²	63.7	88%	0.883	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-62.5	-21.3	177.4	-63.4	176.4	178.3	0	0	113.8	K360	K360-E362 PolarHBondContact O-N 3.11Å; K360-E362 VanDerWaalsContact O-N 3.14Å
363	S	55.4	Low	80.3	Confident	76 Å²	76	67.2 Å²	67.2	53%	0.531	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-100.7	-17.4	-173.6	-52.1	0	0	0	0	113.9	K360 L361	K360-S363 PolarHBondContact O-N 3.46Å; L361-S363 PolarHBondContact O-N 3.16Å
364	H	57.6	Low	79.5	Confident	107 Å²	107	69.4 Å²	69.4	50%	0.495	36%	0.362	S	S	.	.			trans	-146.4	110.3	-176.9	-65.2	83.5	0	0	0	111	L359 L361	L359-H364 HydrophobicContact CD1-CB 4.47Å; L361-H364 PolarHBondContact O-N 2.81Å
365	P	67.3	Low	78.7	Confident	125 Å²	125	69.3 Å²	69.3	81%	0.812	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-62	143.3	168.9	27	-31.8	0	0	0	109.3
366	G	77.8	Confident	77.1	Confident	16 Å²	16	73.1 Å²	73.1	17%	0.165	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-55.3	150.7	178.3	0	0	0	0	0	112	L354 T368	L354-G366 CarbonylContact O-C 3.57Å; L354-G366 VanDerWaalsContact O-CA 3.28Å; L354-G366 WeakPolarHBondContact O-CA 3.42Å; G366-T368 PolarHBondContact O-N 2.85Å
367	L	88.9	Confident	76.2	Confident	96 Å²	96	73.8 Å²	73.8	50%	0.503	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	117	174.8	178.7	70.9	0	0	0	109	E353 L354 L369 P414	E353-L367 CarbonylContact C-O 3.59Å; E353-L367 WeakPolarHBondContact CA-O 3.26Å; L354-L367 HydrophobicContact CB-CB 4.35Å; L354-L367 HydrophobicContact CD1-CD2 4.42Å; L354-L367 PolarHBondContact N-O 3Å; L354-L367 PolarHBondContact O-N 3.15Å; L367-L369 PolarHBondContact O-N 3.43Å; L367-L369 VanDerWaalsContact O-N 3.15Å; L367-P414 HydrophobicContact CD1-CG 4.4Å; L367-P414 HydrophobicContact CD2-CB 4.41Å; L367-P414 HydrophobicContact CD2-CG 4.33Å; L367-P414 HydrophobicContact CG-CB 4.39Å
368	T	91.7	Very high	75.9	Confident	36 Å²	36	73.1 Å²	73.1	22%	0.221	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	116.3	174.2	-59	0	0	0	0	110.7	Y325 G366 R371 P414	Y325-T368 HydrophobicContact CE1-CG2 4.38Å; Y325-T368 WeakPolarHBondContact OH-CB 3.37Å; Y325-T368 WeakPolarHBondContact OH-CG2 3.31Å; Y325-T368 PolarHBondContact OH-OG1 3.15Å; G366-T368 PolarHBondContact O-N 2.85Å; T368-R371 HydrophobicContact CG2-CB 3.97Å; T368-P414 WeakPolarHBondContact O-CB 3.42Å
369	L	91.8	Very high	75.7	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	-42.3	172.8	-179.1	62.4	0	0	0	110.6	L345 V352 L354 L367 H398 M409 C415	L345-L369 HydrophobicContact CD1-CD2 3.99Å; V352-L369 HydrophobicContact CB-CB 4.38Å; V352-L369 HydrophobicContact CG1-CB 4.15Å; V352-L369 HydrophobicContact CG1-CD2 4.13Å; V352-L369 PolarHBondContact O-N 3.26Å; L354-L369 HydrophobicContact CD1-CB 4.39Å; L354-L369 HydrophobicContact CD1-CD1 4.31Å; L354-L369 HydrophobicContact CG-CB 4.27Å; L354-L369 HydrophobicContact CG-CD2 4.49Å; L367-L369 PolarHBondContact O-N 3.43Å; L367-L369 VanDerWaalsContact O-N 3.15Å; L369-H398 HydrophobicContact CD2-CB 4.24Å; L369-M409 HydrophobicContact CD1-CB 4.15Å; L369-M409 HydrophobicContact CD2-CB 4.33Å; L369-M409 HydrophobicContact CG-CB 4.17Å; L369-M409 VanDerWaalsContact O-CE 3.23Å; L369-M409 WeakPolarHBondContact O-CE 3.48Å; L369-C415 WeakPolarHBondContact O-CA 3.38Å; L369-C415 PolarHBondContact O-N 3.33Å
370	F	91.4	Very high	75.8	Confident	0 Å²	0	79.1 Å²	79.1	0%	0	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	138.8	-176.8	178.5	-98.7	0	0	0	110.9	G351 V352 I372 T375 L384 L400 Y407 M409	G351-F370 CarbonylContact C-O 3.56Å; G351-F370 WeakPolarHBondContact CA-O 3.48Å; V352-F370 HydrophobicContact CB-CB 4.13Å; V352-F370 HydrophobicContact CG2-CB 4.26Å; V352-F370 PolarHBondContact N-O 3.34Å; V352-F370 PolarHBondContact O-N 3.23Å; F370-I372 HydrophobicContact CE1-CG1 3.71Å; F370-I372 HydrophobicContact CZ-CG1 4.37Å; F370-T375 HydrophobicContact CE2-CG2 4.09Å; F370-L384 HydrophobicContact CE1-CD1 4.46Å; F370-L400 HydrophobicContact CB-CD1 3.33Å; F370-L400 HydrophobicContact CD1-CD1 3.7Å; F370-L400 HydrophobicContact CD2-CD1 3.8Å; F370-L400 HydrophobicContact CE1-CD1 4.41Å; F370-L400 HydrophobicContact CE2-CD1 4.49Å; F370-L400 HydrophobicContact CG-CD1 3.33Å; F370-Y407 HydrophobicContact CE2-CD1 4.34Å; F370-Y407 HydrophobicContact CE2-CD2 4.39Å; F370-Y407 HydrophobicContact CE2-CG 4.26Å; F370-Y407 HydrophobicContact CZ-CD2 4.27Å; F370-Y407 HydrophobicContact CZ-CE2 4.25Å; F370-M409 HydrophobicContact CB-CE 4.28Å; F370-M409 HydrophobicContact CD2-CE 4.02Å; F370-M409 HydrophobicContact CD2-SD 3.87Å
371	R	90.9	Very high	76.5	Confident	95 Å²	95	73.5 Å²	73.5	36%	0.358	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	118.5	-179.9	176.1	178.4	177	170.7	-0.1	110	Y325 T368 S373 S374 T375	Y325-R371 HydrophobicContact CD1-CG 4.05Å; Y325-R371 HydrophobicContact CD2-CB 4.44Å; Y325-R371 HydrophobicContact CD2-CG 4Å; Y325-R371 HydrophobicContact CE1-CG 4.21Å; Y325-R371 HydrophobicContact CE2-CB 4.16Å; Y325-R371 HydrophobicContact CE2-CG 4.19Å; Y325-R371 HydrophobicContact CG-CG 3.94Å; T368-R371 HydrophobicContact CG2-CB 3.97Å; R371-S373 PolarHBondContact NE-OG 2.94Å; R371-S373 PolarHBondContact NH2-OG 2.76Å; R371-S373 PolarHBondContact O-N 3.22Å; R371-S373 VanDerWaalsContact O-N 3.14Å; R371-S374 PolarHBondContact O-N 3.31Å; R371-S374 PolarHBondContact O-OG 2.87Å; R371-T375 PolarHBondContact O-N 2.9Å; R371-T375 PolarHBondContact O-OG1 2.76Å
372	I	88.1	Confident	77.8	Confident	15 Å²	15	70.3 Å²	70.3	8%	0.077	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-34.4	-175.8	-65.1	173.7	0	0	0	112.2	F326 R349 T350 F370 C378 E382	F326-I372 HydrophobicContact CE1-CB 4.38Å; R349-I372 WeakPolarHBondContact O-CD1 3.29Å; T350-I372 VanDerWaalsContact O-CG1 3.3Å; T350-I372 WeakPolarHBondContact O-CG1 3.49Å; T350-I372 PolarHBondContact O-N 3.4Å; F370-I372 HydrophobicContact CE1-CG1 3.71Å; F370-I372 HydrophobicContact CZ-CG1 4.37Å; I372-C378 HydrophobicContact CG2-CB 4.1Å; I372-C378 WeakPolarHBondContact O-CB 3.18Å; I372-E382 HydrophobicContact CG2-CB 4.21Å
373	S	78.8	Confident	79.3	Confident	74 Å²	74	65 Å²	65	52%	0.517	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-13.1	-178.7	76.2	0	0	0	0	114.7	R371	R371-S373 PolarHBondContact NE-OG 2.94Å; R371-S373 PolarHBondContact NH2-OG 2.76Å; R371-S373 PolarHBondContact O-N 3.22Å; R371-S373 VanDerWaalsContact O-N 3.14Å
374	S	76.3	Confident	81.1	Confident	69 Å²	69	61.4 Å²	61.4	48%	0.483	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	-23.1	-179.2	77.1	0	0	0	0	113.2	R371 S376	R371-S374 PolarHBondContact O-N 3.31Å; R371-S374 PolarHBondContact O-OG 2.87Å; S374-S376 PolarHBondContact O-N 3.34Å
375	T	75.3	Confident	82.8	Confident	10 Å²	10	56.6 Å²	56.6	6%	0.061	31%	0.31	C	S	.	.			trans	-74	115.8	175.4	-56	0	0	0	0	109.4	F370 R371 D377 C378 P417	F370-T375 HydrophobicContact CE2-CG2 4.09Å; R371-T375 PolarHBondContact O-N 2.9Å; R371-T375 PolarHBondContact O-OG1 2.76Å; T375-D377 PolarHBondContact O-N 3.37Å; T375-C378 PolarHBondContact O-N 2.9Å; T375-P417 HydrophobicContact CG2-CG 4.18Å
376	S	58.7	Low	84.1	Confident	86 Å²	86	51 Å²	51	60%	0.601	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-23.8	-173.5	55.2	0	0	0	0	114.6	S374	S374-S376 PolarHBondContact O-N 3.34Å
377	D	71	Confident	84.9	Confident	54 Å²	54	50.2 Å²	50.2	29%	0.289	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-4	-173.7	-63.9	-8.7	0	0	0	113.3	T375 K420	T375-D377 PolarHBondContact O-N 3.37Å; D377-K420 HydrophobicContact CB-CD 3.79Å; D377-K420 PolarHBondContact O-NZ 3.04Å
378	C	81.8	Confident	85.1	Confident	23 Å²	23	48.9 Å²	48.9	16%	0.155	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-75.8	129.8	178	-71.3	0	0	0	0	111.2	I372 T375	I372-C378 HydrophobicContact CG2-CB 4.1Å; I372-C378 WeakPolarHBondContact O-CB 3.18Å; T375-C378 PolarHBondContact O-N 2.9Å
379	Q	80.5	Confident	85.2	Confident	99 Å²	99	47.9 Å²	47.9	46%	0.463	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-71.2	155.1	173.6	-56.2	176	22.7	0	0	111.2	G381 E382 H404	Q379-G381 PolarHBondContact O-N 2.95Å; Q379-E382 WeakPolarHBondContact CA-OE1 3.49Å; Q379-E382 HydrophobicContact CB-CG 3.97Å; Q379-E382 WeakPolarHBondContact CB-OE1 3.48Å; Q379-E382 WeakPolarHBondContact CG-OE1 3.49Å; Q379-E382 VanDerWaalsContact N-CD 3.33Å; Q379-E382 PolarHBondContact N-OE1 3.14Å; Q379-E382 PolarHBondContact O-N 3.45Å; Q379-H404 PolarHBondContact OE1-CD2 3.27Å
380	R	80.1	Confident	85.1	Confident	256 Å²	256	48 Å²	48	97%	0.966	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	123.7	176.6	-69.5	-176.4	178.8	-177.9	0.1	109.9
381	G	82.7	Confident	84.7	Confident	50 Å²	50	49.5 Å²	49.5	52%	0.515	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.8	1.1	178.6	0	0	0	0	0	114.9	Q379 R383	Q379-G381 PolarHBondContact O-N 2.95Å; G381-R383 PolarHBondContact O-NH1 3.47Å
382	E	88.8	Confident	84.3	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.276	C	S	.	.			trans	-57.9	147.6	172.1	-79	-173.4	-147.5	0	0	111.9	I372 Q379 T402 Y407	I372-E382 HydrophobicContact CG2-CB 4.21Å; Q379-E382 WeakPolarHBondContact CA-OE1 3.49Å; Q379-E382 HydrophobicContact CB-CG 3.97Å; Q379-E382 WeakPolarHBondContact CB-OE1 3.48Å; Q379-E382 WeakPolarHBondContact CG-OE1 3.49Å; Q379-E382 VanDerWaalsContact N-CD 3.33Å; Q379-E382 PolarHBondContact N-OE1 3.14Å; Q379-E382 PolarHBondContact O-N 3.45Å; E382-T402 WeakPolarHBondContact OE2-CB 3.38Å; E382-T402 PolarHBondContact OE2-OG1 2.99Å; E382-Y407 PolarHBondContact OE2-OH 2.86Å
383	R	91.1	Very high	84.1	Confident	79 Å²	79	52 Å²	52	30%	0.298	29%	0.285	S	S	.	.			trans	-138	140.2	177.3	-61.5	-64.7	-178.3	-96.6	4	108.5	R349 G381 T402 Q403	R349-R383 HydrophobicContact CB-CB 4.33Å; R349-R383 WeakPolarHBondContact O-CA 3.43Å; G381-R383 PolarHBondContact O-NH1 3.47Å; R383-T402 WeakPolarHBondContact O-CA 3.46Å; R383-T402 WeakPolarHBondContact O-CB 3.44Å; R383-Q403 PolarHBondContact O-OE1 3.46Å
384	L	93.2	Very high	84.5	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	139.6	175.5	-168.7	72.6	0	0	0	110.5	W332 A347 D348 R349 V352 F370 V387 L400	W332-L384 HydrophobicContact CZ3-CD2 4.4Å; A347-L384 HydrophobicContact CB-CD2 3.9Å; D348-L384 WeakPolarHBondContact O-CB 3.27Å; D348-L384 VanDerWaalsContact O-CD2 3.27Å; D348-L384 WeakPolarHBondContact O-CD2 3.36Å; R349-L384 WeakPolarHBondContact CD-O 3.21Å; R349-L384 PolarHBondContact NH1-O 3.1Å; R349-L384 PolarHBondContact O-N 2.87Å; V352-L384 HydrophobicContact CG2-CD2 3.42Å; V352-L384 VanDerWaalsContact CG2-CD2 3.42Å; F370-L384 HydrophobicContact CE1-CD1 4.46Å; L384-V387 HydrophobicContact CD1-CG2 4.41Å; L384-V387 HydrophobicContact CD2-CG2 3.61Å; L384-V387 HydrophobicContact CG-CG2 4.22Å; L384-L400 HydrophobicContact CD1-CB 3.92Å; L384-L400 HydrophobicContact CD1-CD2 4.41Å
385	L	93.4	Very high	85	Confident	5 Å²	5	49.3 Å²	49.3	3%	0.026	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	-45.8	-174.7	-63.3	176.5	0	0	0	114.1	F176 W332 T401 T402 Q403 P428 L430	F176-L385 HydrophobicContact CE2-CD2 4.19Å; F176-L385 HydrophobicContact CZ-CD2 3.77Å; W332-L385 WeakPolarHBondContact CH2-O 3.33Å; W332-L385 WeakPolarHBondContact CZ2-O 3.19Å; L385-T401 PolarHBondContact N-O 3Å; L385-T402 VanDerWaalsContact CD1-O 3.3Å; L385-T402 WeakPolarHBondContact CD1-O 3.37Å; L385-Q403 HydrophobicContact CD1-CG 4.25Å; L385-Q403 HydrophobicContact CD2-CG 4.31Å; L385-Q403 HydrophobicContact CG-CG 4.47Å; L385-P428 HydrophobicContact CD1-CB 3.18Å; L385-P428 HydrophobicContact CD1-CG 4.48Å; L385-P428 HydrophobicContact CD2-CB 4.32Å; L385-P428 HydrophobicContact CG-CB 4.37Å; L385-L430 HydrophobicContact CB-CD2 4.47Å
386	L	93.8	Very high	85.8	Confident	7 Å²	7	52 Å²	52	4%	0.037	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	145.2	-178.2	-179.3	69.2	0	0	0	109	T181 W334 T401 C432	T181-L386 HydrophobicContact CG2-CD1 3.79Å; W334-L386 HydrophobicContact CH2-CD1 3.87Å; W334-L386 HydrophobicContact CZ2-CD1 3.89Å; W334-L386 HydrophobicContact CZ3-CD1 4.44Å; L386-T401 WeakPolarHBondContact CB-OG1 3.47Å; L386-T401 PolarHBondContact N-OG1 3.28Å; L386-T401 PolarHBondContact O-N 2.71Å; L386-C432 HydrophobicContact CD2-CB 3.43Å; L386-C432 VanDerWaalsContact CD2-CB 3.43Å
387	V	94.7	Very high	87.4	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	136.6	168.2	-177.3	0	0	0	0	108.4	W334 L345 A347 V352 L384 L399 L400	W334-V387 PolarHBondContact NE1-O 3.14Å; L345-V387 HydrophobicContact CD1-CG1 3.57Å; L345-V387 HydrophobicContact CD2-CB 4.12Å; L345-V387 HydrophobicContact CD2-CG1 3.55Å; L345-V387 HydrophobicContact CD2-CG2 4.33Å; L345-V387 HydrophobicContact CG-CG1 4.22Å; A347-V387 HydrophobicContact CB-CG2 3.8Å; V352-V387 HydrophobicContact CG2-CG2 4.11Å; L384-V387 HydrophobicContact CD1-CG2 4.41Å; L384-V387 HydrophobicContact CD2-CG2 3.61Å; L384-V387 HydrophobicContact CG-CG2 4.22Å; V387-L399 CarbonylContact C-O 3.58Å; V387-L399 WeakPolarHBondContact CA-O 3.19Å; V387-L400 HydrophobicContact CB-CD2 3.9Å; V387-L400 HydrophobicContact CG1-CD2 3.43Å; V387-L400 VanDerWaalsContact CG1-CD2 3.43Å; V387-L400 HydrophobicContact CG2-CD2 3.5Å; V387-L400 VanDerWaalsContact CG2-CD2 3.5Å
388	R	93.6	Very high	88.5	Confident	68 Å²	68	45.4 Å²	45.4	26%	0.257	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	124.3	175.6	-175.6	62.4	-179.6	162.5	-3.1	111	E336 L390 H398 L399	E336-R388 WeakPolarHBondContact OE1-CD 3.43Å; E336-R388 IonicContact OE1-CZ 3.89Å; E336-R388 IonicContact OE1-NE 3.9Å; E336-R388 IonicContact OE1-NH1 2.97Å; E336-R388 PolarHBondContact OE1-NH1 3.49Å; E336-R388 WeakPolarHBondContact OE2-CA 3.35Å; R388-L390 HydrophobicContact CG-CD2 4.24Å; R388-H398 WeakPolarHBondContact O-CA 3.27Å; R388-L399 HydrophobicContact CB-CB 4.36Å; R388-L399 PolarHBondContact N-O 2.7Å; R388-L399 PolarHBondContact O-N 2.9Å
389	F	93.5	Very high	89.1	Confident	15 Å²	15	44.4 Å²	44.4	7%	0.066	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	128.5	169	177.6	-127.8	0	0	0	109.8	P290 E336 F337 A339 G391 P395 H397 H398	P290-F389 HydrophobicContact CG-CD1 4.34Å; P290-F389 HydrophobicContact CG-CE1 4.09Å; E336-F389 HydrophobicContact CG-CB 3.84Å; E336-F389 PolarHBondContact OE1-N 3.24Å; E336-F389 PolarHBondContact OE2-N 2.83Å; F337-F389 WeakPolarHBondContact O-CB 3.39Å; F337-F389 WeakPolarHBondContact O-CD1 3.24Å; F337-F389 VanDerWaalsContact O-CG 3.32Å; F337-F389 WeakPolarHBondContact O-CG 3.47Å; A339-F389 HydrophobicContact CB-CZ 4.48Å; F389-G391 VanDerWaalsContact C-N 3.32Å; F389-G391 VanDerWaalsContact CE1-CA 3.5Å; F389-G391 PolarHBondContact O-N 2.9Å; F389-P395 WeakPolarHBondContact CE2-O 3.48Å; F389-P395 VanDerWaalsContact CZ-O 3.24Å; F389-P395 WeakPolarHBondContact CZ-O 3.29Å; F389-H397 WeakPolarHBondContact CD2-O 3.34Å; F389-H398 AromaticContact CD2-CE1 3.33Å; F389-H398 WeakPolarHBondContact CD2-CE1 3.38Å; F389-H398 AromaticContact CD2-ND1 3.63Å; F389-H398 AromaticContact CD2-NE2 3.96Å
390	L	90.3	Very high	89.8	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.01	20%	0.202	C	C	.	.			trans	-96.8	29.3	-174.6	-55.6	-175.9	0	0	0	112.5	R388 D392 V393 H394 H397 L399 I408 V434 Y460	R388-L390 HydrophobicContact CG-CD2 4.24Å; L390-D392 PolarHBondContact O-N 3.28Å; L390-V393 PolarHBondContact O-N 3.49Å; L390-H394 CarbonylContact C-O 3.56Å; L390-H394 CarbonylContact O-C 3.56Å; L390-H394 PolarHBondContact O-N 2.87Å; L390-H397 HydrophobicContact CB-CB 4.14Å; L390-H397 WeakPolarHBondContact CB-O 3.08Å; L390-H397 HydrophobicContact CD1-CB 4.04Å; L390-H397 HydrophobicContact CG-CB 4.45Å; L390-H397 PolarHBondContact N-O 3.34Å; L390-L399 HydrophobicContact CD1-CB 4.15Å; L390-L399 HydrophobicContact CD2-CB 4.02Å; L390-L399 HydrophobicContact CG-CB 4.24Å; L390-I408 HydrophobicContact CD1-CD1 3.82Å; L390-V434 HydrophobicContact CD2-CB 4.27Å; L390-V434 HydrophobicContact CD2-CG1 4.29Å; L390-V434 HydrophobicContact CD2-CG2 3.32Å; L390-Y460 HydrophobicContact CD1-CE1 4.38Å; L390-Y460 WeakPolarHBondContact CD1-OH 3.45Å
391	G	83.1	Confident	90.4	Very high	33 Å²	33	27.5 Å²	27.5	34%	0.34	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-24.5	-175.9	0	0	0	0	0	115.1	F389 V393	F389-G391 VanDerWaalsContact C-N 3.32Å; F389-G391 VanDerWaalsContact CE1-CA 3.5Å; F389-G391 PolarHBondContact O-N 2.9Å; G391-V393 PolarHBondContact O-N 3.3Å
392	D	81.8	Confident	90.9	Very high	119 Å²	119	25.1 Å²	25.1	64%	0.636	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-21.7	175.2	-59.9	-36.1	0	0	0	112.9	L390	L390-D392 PolarHBondContact O-N 3.28Å
393	V	84	Confident	91	Very high	42 Å²	42	27.5 Å²	27.5	26%	0.255	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.5	-44	-176.5	-173.9	0	0	0	0	112.3	L390 G391 V434 P436 T443	L390-V393 PolarHBondContact O-N 3.49Å; G391-V393 PolarHBondContact O-N 3.3Å; V393-V434 HydrophobicContact CG2-CG1 3.52Å; V393-P436 HydrophobicContact CG2-CB 4.08Å; V393-T443 HydrophobicContact CB-CG2 4.09Å; V393-T443 HydrophobicContact CG1-CG2 3.5Å; V393-T443 VanDerWaalsContact CG1-CG2 3.5Å; V393-T443 WeakPolarHBondContact CG1-OG1 3.4Å; V393-T443 HydrophobicContact CG2-CG2 3.93Å
394	H	87.1	Confident	90.9	Very high	16 Å²	16	27.7 Å²	27.7	7%	0.074	15%	0.147	C	C	.	.			trans	-138.8	128.3	178.8	-167.4	-89.7	0	0	0	111.5	L390 F396 H397 G463 A464	L390-H394 CarbonylContact C-O 3.56Å; L390-H394 CarbonylContact O-C 3.56Å; L390-H394 PolarHBondContact O-N 2.87Å; H394-F396 VanDerWaalsContact C-N 3.26Å; H394-F396 PolarHBondContact ND1-N 2.77Å; H394-F396 PolarHBondContact O-N 2.71Å; H394-F396 VanDerWaalsContact O-N 3.12Å; H394-H397 HydrophobicContact CB-CB 4Å; H394-H397 AromaticContact CD2-CE1 3.96Å; H394-H397 AromaticContact CE1-CD2 3.47Å; H394-H397 PolarHBondContact CE1-CD2 3.42Å; H394-H397 VanDerWaalsContact CE1-CD2 3.47Å; H394-H397 AromaticContact CE1-CE1 3.85Å; H394-H397 AromaticContact CE1-CG 4Å; H394-H397 AromaticContact CE1-NE2 3.35Å; H394-H397 PolarHBondContact CE1-NE2 3.11Å; H394-H397 AromaticContact CG-CD2 3.86Å; H394-H397 AromaticContact CG-CE1 3.68Å; H394-H397 AromaticContact CG-CG 3.59Å; H394-H397 AromaticContact CG-ND1 3.49Å; H394-H397 AromaticContact CG-NE2 3.89Å; H394-H397 AromaticContact ND1-CD2 3.09Å; H394-H397 PolarHBondContact ND1-CD2 2.9Å; H394-H397 AromaticContact ND1-CE1 3.63Å; H394-H397 AromaticContact ND1-CG 3.2Å; H394-H397 AromaticContact ND1-ND1 3.56Å; H394-H397 AromaticContact ND1-NE2 3.37Å; H394-H397 PolarHBondContact ND1-NE2 3.27Å; H394-H397 AromaticContact NE2-NE2 3.92Å; H394-G463 PolarHBondContact NE2-O 2.91Å; H394-G463 VanDerWaalsContact NE2-O 3.16Å; H394-A464 PolarHBondContact NE2-N 2.82Å
395	P	87.6	Confident	90.9	Very high	72 Å²	72	27.7 Å²	27.7	47%	0.468	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-27.3	-171.7	-25.2	33.8	0	0	0	115.6	A339 F389	A339-P395 WeakPolarHBondContact CB-O 3.44Å; F389-P395 WeakPolarHBondContact CE2-O 3.48Å; F389-P395 VanDerWaalsContact CZ-O 3.24Å; F389-P395 WeakPolarHBondContact CZ-O 3.29Å
396	F	90.6	Very high	90.9	Very high	67 Å²	67	27.5 Å²	27.5	29%	0.294	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.4	1.7	-170.1	-55.9	-64.2	0	0	0	114.2	A339 H394 D410 E411 R412	A339-F396 HydrophobicContact CB-CD1 3.58Å; A339-F396 HydrophobicContact CB-CE1 3.76Å; H394-F396 VanDerWaalsContact C-N 3.26Å; H394-F396 PolarHBondContact ND1-N 2.77Å; H394-F396 PolarHBondContact O-N 2.71Å; H394-F396 VanDerWaalsContact O-N 3.12Å; F396-D410 WeakPolarHBondContact O-CA 3.37Å; F396-E411 HydrophobicContact CB-CG 3.83Å; F396-E411 HydrophobicContact CD1-CG 3.85Å; F396-E411 VanDerWaalsContact CD1-OE1 3.27Å; F396-E411 WeakPolarHBondContact CD1-OE1 3.41Å; F396-E411 HydrophobicContact CG-CG 4.32Å; F396-E411 PolarHBondContact O-N 3.37Å; F396-R412 HydrophobicContact CD1-CG 4.46Å; F396-R412 HydrophobicContact CG-CG 4.31Å
397	H	92.3	Very high	90.8	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	143.5	-174.9	-70.3	177.8	0	0	0	112.8	F389 L390 H394 I408 M409 D410 G463 C468	F389-H397 WeakPolarHBondContact CD2-O 3.34Å; L390-H397 HydrophobicContact CB-CB 4.14Å; L390-H397 WeakPolarHBondContact CB-O 3.08Å; L390-H397 HydrophobicContact CD1-CB 4.04Å; L390-H397 HydrophobicContact CG-CB 4.45Å; L390-H397 PolarHBondContact N-O 3.34Å; H394-H397 HydrophobicContact CB-CB 4Å; H394-H397 AromaticContact CD2-CE1 3.96Å; H394-H397 AromaticContact CE1-CD2 3.47Å; H394-H397 PolarHBondContact CE1-CD2 3.42Å; H394-H397 VanDerWaalsContact CE1-CD2 3.47Å; H394-H397 AromaticContact CE1-CE1 3.85Å; H394-H397 AromaticContact CE1-CG 4Å; H394-H397 AromaticContact CE1-NE2 3.35Å; H394-H397 PolarHBondContact CE1-NE2 3.11Å; H394-H397 AromaticContact CG-CD2 3.86Å; H394-H397 AromaticContact CG-CE1 3.68Å; H394-H397 AromaticContact CG-CG 3.59Å; H394-H397 AromaticContact CG-ND1 3.49Å; H394-H397 AromaticContact CG-NE2 3.89Å; H394-H397 AromaticContact ND1-CD2 3.09Å; H394-H397 PolarHBondContact ND1-CD2 2.9Å; H394-H397 AromaticContact ND1-CE1 3.63Å; H394-H397 AromaticContact ND1-CG 3.2Å; H394-H397 AromaticContact ND1-ND1 3.56Å; H394-H397 AromaticContact ND1-NE2 3.37Å; H394-H397 PolarHBondContact ND1-NE2 3.27Å; H394-H397 AromaticContact NE2-NE2 3.92Å; H397-I408 HydrophobicContact CB-CG2 4.2Å; H397-M409 CarbonylContact C-O 3.5Å; H397-M409 VanDerWaalsContact CA-O 3.29Å; H397-M409 WeakPolarHBondContact CA-O 3.5Å; H397-D410 IonicContact CD2-OD2 3.6Å; H397-D410 IonicContact NE2-OD2 3.86Å; H397-G463 VanDerWaalsContact CE1-CA 3.44Å; H397-G463 WeakPolarHBondContact CE1-CA 3.45Å; H397-C468 PolarHBondContact CE1-SG 3.01Å
398	H	93.9	Very high	90.7	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	131.5	173	-59.9	-89.2	0	0	0	109.4	L345 L369 R388 F389 I408 M409 E411	L345-H398 HydrophobicContact CD1-CB 4.45Å; L345-H398 WeakPolarHBondContact CD1-ND1 3.33Å; L369-H398 HydrophobicContact CD2-CB 4.24Å; R388-H398 WeakPolarHBondContact O-CA 3.27Å; F389-H398 AromaticContact CD2-CE1 3.33Å; F389-H398 WeakPolarHBondContact CD2-CE1 3.38Å; F389-H398 AromaticContact CD2-ND1 3.63Å; F389-H398 AromaticContact CD2-NE2 3.96Å; H398-I408 WeakPolarHBondContact O-CA 3.16Å; H398-M409 HydrophobicContact CB-CB 4.46Å; H398-M409 PolarHBondContact N-O 3.49Å; H398-M409 PolarHBondContact O-N 2.92Å; H398-E411 IonicContact NE2-OE2 3.95Å
399	L	94.8	Very high	90.7	Very high	2 Å²	2	23.9 Å²	23.9	1%	0.01	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	128.7	168.8	177.1	73.5	0	0	0	109.2	V387 R388 L390 T401 A406 Y407 I408 C432 V445 L447	V387-L399 CarbonylContact C-O 3.58Å; V387-L399 WeakPolarHBondContact CA-O 3.19Å; R388-L399 HydrophobicContact CB-CB 4.36Å; R388-L399 PolarHBondContact N-O 2.7Å; R388-L399 PolarHBondContact O-N 2.9Å; L390-L399 HydrophobicContact CD1-CB 4.15Å; L390-L399 HydrophobicContact CD2-CB 4.02Å; L390-L399 HydrophobicContact CG-CB 4.24Å; L399-T401 HydrophobicContact CD2-CG2 4.44Å; L399-T401 HydrophobicContact CG-CG2 4.35Å; L399-A406 HydrophobicContact CD1-CB 4.32Å; L399-Y407 WeakPolarHBondContact CA-O 3.27Å; L399-I408 HydrophobicContact CB-CD1 4.26Å; L399-I408 HydrophobicContact CD1-CD1 3.68Å; L399-C432 HydrophobicContact CD2-CB 4.17Å; L399-C432 WeakPolarHBondContact CD2-SG 3.48Å; L399-V445 HydrophobicContact CD1-CG1 4.33Å; L399-V445 HydrophobicContact CD2-CG1 3.57Å; L399-L447 HydrophobicContact CD2-CD2 4.08Å
400	L	94.8	Very high	90.6	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	133.1	172.6	-55	-175.4	0	0	0	108.9	V352 F370 L384 V387 A406 Y407 M409	V352-L400 HydrophobicContact CG2-CD1 4.09Å; V352-L400 HydrophobicContact CG2-CD2 3.84Å; F370-L400 HydrophobicContact CB-CD1 3.33Å; F370-L400 HydrophobicContact CD1-CD1 3.7Å; F370-L400 HydrophobicContact CD2-CD1 3.8Å; F370-L400 HydrophobicContact CE1-CD1 4.41Å; F370-L400 HydrophobicContact CE2-CD1 4.49Å; F370-L400 HydrophobicContact CG-CD1 3.33Å; L384-L400 HydrophobicContact CD1-CB 3.92Å; L384-L400 HydrophobicContact CD1-CD2 4.41Å; V387-L400 HydrophobicContact CB-CD2 3.9Å; V387-L400 HydrophobicContact CG1-CD2 3.43Å; V387-L400 VanDerWaalsContact CG1-CD2 3.43Å; V387-L400 HydrophobicContact CG2-CD2 3.5Å; V387-L400 VanDerWaalsContact CG2-CD2 3.5Å; L400-A406 CarbonylContact O-C 3.53Å; L400-A406 WeakPolarHBondContact O-CA 3.39Å; L400-Y407 PolarHBondContact N-O 3.45Å; L400-Y407 PolarHBondContact O-N 3.35Å; L400-M409 HydrophobicContact CD1-CG 3.39Å; L400-M409 HydrophobicContact CD1-SD 4.32Å; L400-M409 HydrophobicContact CG-CG 3.87Å
401	T	94.3	Very high	90.6	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	138.1	172.8	68.5	0	0	0	0	111	L385 L386 L399 A406 P429 L447	L385-T401 PolarHBondContact N-O 3Å; L386-T401 WeakPolarHBondContact CB-OG1 3.47Å; L386-T401 PolarHBondContact N-OG1 3.28Å; L386-T401 PolarHBondContact O-N 2.71Å; L399-T401 HydrophobicContact CD2-CG2 4.44Å; L399-T401 HydrophobicContact CG-CG2 4.35Å; T401-A406 HydrophobicContact CG2-CB 4.23Å; T401-P429 HydrophobicContact CG2-CG 4.27Å; T401-L447 HydrophobicContact CG2-CD1 4.44Å; T401-L447 HydrophobicContact CG2-CD2 3.86Å
402	T	93.1	Very high	90.9	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	-177.1	168.8	70.3	0	0	0	0	109	E382 R383 L385 H404 S405 Y407 H423	E382-T402 WeakPolarHBondContact OE2-CB 3.38Å; E382-T402 PolarHBondContact OE2-OG1 2.99Å; R383-T402 WeakPolarHBondContact O-CA 3.46Å; R383-T402 WeakPolarHBondContact O-CB 3.44Å; L385-T402 VanDerWaalsContact CD1-O 3.3Å; L385-T402 WeakPolarHBondContact CD1-O 3.37Å; T402-H404 PolarHBondContact O-N 2.94Å; T402-S405 PolarHBondContact N-O 3.38Å; T402-S405 PolarHBondContact OG1-N 2.95Å; T402-S405 PolarHBondContact OG1-O 3.38Å; T402-Y407 HydrophobicContact CG2-CD2 4.37Å; T402-Y407 HydrophobicContact CG2-CE2 3.83Å; T402-H423 PolarHBondContact O-NE2 3.44Å
403	Q	90.6	Very high	91.1	Very high	50 Å²	50	28.4 Å²	28.4	23%	0.234	13%	0.134	C	C	.	.	S	Bend	trans	-64.2	-20.6	179.4	-53.7	100.3	-43.6	0	0	113.9	R383 L385 H423 P428	R383-Q403 PolarHBondContact O-OE1 3.46Å; L385-Q403 HydrophobicContact CD1-CG 4.25Å; L385-Q403 HydrophobicContact CD2-CG 4.31Å; L385-Q403 HydrophobicContact CG-CG 4.47Å; Q403-H423 PolarHBondContact O-CE1 3.19Å; Q403-H423 VanDerWaalsContact O-CE1 3.26Å; Q403-H423 PolarHBondContact O-NE2 2.82Å; Q403-P428 HydrophobicContact CB-CB 4.46Å; Q403-P428 HydrophobicContact CG-CB 4.44Å
404	H	89.3	Confident	91.3	Very high	84 Å²	84	28.5 Å²	28.5	39%	0.389	14%	0.136	S	C	.	.	S	Bend	trans	-122.9	-31.5	-171.8	-55.2	-43.6	0	0	0	113.1	Q379 T402 H423	Q379-H404 PolarHBondContact OE1-CD2 3.27Å; T402-H404 PolarHBondContact O-N 2.94Å; H404-H423 VanDerWaalsContact C-CD2 3.46Å; H404-H423 PolarHBondContact N-NE2 3.06Å; H404-H423 PolarHBondContact O-CD2 3.07Å; H404-H423 PolarHBondContact O-N 2.74Å; H404-H423 PolarHBondContact O-NE2 3.48Å
405	S	91.7	Very high	91.3	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	154.7	-170.5	-53.3	0	0	0	0	112.5	T402 K420 W421 D422 H423	T402-S405 PolarHBondContact N-O 3.38Å; T402-S405 PolarHBondContact OG1-N 2.95Å; T402-S405 PolarHBondContact OG1-O 3.38Å; S405-K420 WeakPolarHBondContact OG-CE 3.21Å; S405-W421 CarbonylContact C-O 3.59Å; S405-W421 WeakPolarHBondContact CA-O 3.45Å; S405-W421 VanDerWaalsContact CB-O 3.23Å; S405-W421 WeakPolarHBondContact CB-O 3.27Å; S405-D422 PolarHBondContact OG-OD1 3.19Å; S405-H423 PolarHBondContact N-NE2 3.39Å
406	A	93.5	Very high	91.2	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	134.9	171.4	0	0	0	0	0	109.4	L399 L400 T401 K420 W421 L447 L458	L399-A406 HydrophobicContact CD1-CB 4.32Å; L400-A406 CarbonylContact O-C 3.53Å; L400-A406 WeakPolarHBondContact O-CA 3.39Å; T401-A406 HydrophobicContact CG2-CB 4.23Å; A406-K420 CarbonylContact O-C 3.56Å; A406-K420 WeakPolarHBondContact O-CA 3.39Å; A406-W421 HydrophobicContact CB-CB 4.48Å; A406-W421 HydrophobicContact CB-CE3 4.18Å; A406-W421 PolarHBondContact N-O 2.86Å; A406-W421 PolarHBondContact O-N 3.27Å; A406-L447 HydrophobicContact CB-CD1 4.03Å; A406-L458 HydrophobicContact CB-CD1 4.25Å
407	Y	92.8	Very high	91.1	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	138.3	-175.1	-55.6	-97.7	0	0	0	110.1	F370 E382 L399 L400 T402 P417 L419 K420	F370-Y407 HydrophobicContact CE2-CD1 4.34Å; F370-Y407 HydrophobicContact CE2-CD2 4.39Å; F370-Y407 HydrophobicContact CE2-CG 4.26Å; F370-Y407 HydrophobicContact CZ-CD2 4.27Å; F370-Y407 HydrophobicContact CZ-CE2 4.25Å; E382-Y407 PolarHBondContact OE2-OH 2.86Å; L399-Y407 WeakPolarHBondContact CA-O 3.27Å; L400-Y407 PolarHBondContact N-O 3.45Å; L400-Y407 PolarHBondContact O-N 3.35Å; T402-Y407 HydrophobicContact CG2-CD2 4.37Å; T402-Y407 HydrophobicContact CG2-CE2 3.83Å; Y407-P417 HydrophobicContact CD1-CB 4.11Å; Y407-L419 VanDerWaalsContact CA-O 3.31Å; Y407-L419 WeakPolarHBondContact CA-O 3.26Å; Y407-K420 HydrophobicContact CD1-CB 4.09Å; Y407-K420 HydrophobicContact CD1-CD 4.33Å; Y407-K420 HydrophobicContact CD1-CG 3.9Å; Y407-K420 HydrophobicContact CE1-CB 4.22Å; Y407-K420 HydrophobicContact CE1-CD 3.6Å; Y407-K420 HydrophobicContact CE1-CG 3.62Å; Y407-K420 WeakPolarHBondContact OH-CE 3.33Å
408	I	93.2	Very high	90.9	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	122.2	164.3	-58.8	-62.2	0	0	0	107.9	L390 H397 H398 L399 M418 L419 W421 Y460	L390-I408 HydrophobicContact CD1-CD1 3.82Å; H397-I408 HydrophobicContact CB-CG2 4.2Å; H398-I408 WeakPolarHBondContact O-CA 3.16Å; L399-I408 HydrophobicContact CB-CD1 4.26Å; L399-I408 HydrophobicContact CD1-CD1 3.68Å; I408-M418 HydrophobicContact CB-CB 4.49Å; I408-M418 HydrophobicContact CG2-CB 4.3Å; I408-M418 WeakPolarHBondContact O-CB 3.2Å; I408-M418 PolarHBondContact O-N 3.36Å; I408-L419 HydrophobicContact CB-CB 4.11Å; I408-L419 HydrophobicContact CG1-CB 4.12Å; I408-L419 HydrophobicContact CG1-CD1 4.43Å; I408-L419 PolarHBondContact N-O 2.87Å; I408-L419 PolarHBondContact O-N 3.36Å; I408-W421 HydrophobicContact CD1-CH2 4.09Å; I408-W421 HydrophobicContact CD1-CZ3 3.74Å; I408-W421 HydrophobicContact CG1-CH2 3.52Å; I408-W421 HydrophobicContact CG1-CZ3 3.38Å; I408-Y460 HydrophobicContact CD1-CE1 4.32Å
409	M	92.6	Very high	90.8	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	149	174.2	-54.5	-56.8	-65.7	0	0	109.6	L369 F370 H397 H398 L400 P417	L369-M409 HydrophobicContact CD1-CB 4.15Å; L369-M409 HydrophobicContact CD2-CB 4.33Å; L369-M409 HydrophobicContact CG-CB 4.17Å; L369-M409 VanDerWaalsContact O-CE 3.23Å; L369-M409 WeakPolarHBondContact O-CE 3.48Å; F370-M409 HydrophobicContact CB-CE 4.28Å; F370-M409 HydrophobicContact CD2-CE 4.02Å; F370-M409 HydrophobicContact CD2-SD 3.87Å; H397-M409 CarbonylContact C-O 3.5Å; H397-M409 VanDerWaalsContact CA-O 3.29Å; H397-M409 WeakPolarHBondContact CA-O 3.5Å; H398-M409 HydrophobicContact CB-CB 4.46Å; H398-M409 PolarHBondContact N-O 3.49Å; H398-M409 PolarHBondContact O-N 2.92Å; L400-M409 HydrophobicContact CD1-CG 3.39Å; L400-M409 HydrophobicContact CD1-SD 4.32Å; L400-M409 HydrophobicContact CG-CG 3.87Å; M409-P417 VanDerWaalsContact SD-CA 3.55Å; M409-P417 HydrophobicContact SD-CB 3.81Å
410	D	90.9	Very high	90.6	Very high	2 Å²	2	30 Å²	30	1%	0.011	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	127.4	169.7	-169.4	-45.4	0	0	0	108.8	F396 H397 R412 F413 M418	F396-D410 WeakPolarHBondContact O-CA 3.37Å; H397-D410 IonicContact CD2-OD2 3.6Å; H397-D410 IonicContact NE2-OD2 3.86Å; D410-R412 PolarHBondContact O-N 2.84Å; D410-R412 VanDerWaalsContact O-N 3.13Å; D410-R412 VanDerWaalsContact OD1-CB 3.23Å; D410-R412 WeakPolarHBondContact OD1-CB 3.29Å; D410-R412 VanDerWaalsContact OD1-CG 3.3Å; D410-R412 WeakPolarHBondContact OD1-CG 3.48Å; D410-R412 IonicContact OD1-CZ 2.69Å; D410-R412 PolarHBondContact OD1-N 3.18Å; D410-R412 IonicContact OD1-NE 3.32Å; D410-R412 PolarHBondContact OD1-NE 3.04Å; D410-R412 IonicContact OD1-NH2 3.18Å; D410-R412 IonicContact OD2-CZ 2.94Å; D410-R412 IonicContact OD2-NE 2.72Å; D410-R412 PolarHBondContact OD2-NE 3.06Å; D410-R412 IonicContact OD2-NH2 3.82Å; D410-R412 PolarHBondContact OD2-NH2 3.03Å; D410-F413 HydrophobicContact CB-CD2 4.22Å; D410-F413 CarbonylContact O-C 3.59Å; D410-F413 VanDerWaalsContact O-C 3.32Å; D410-F413 PolarHBondContact O-N 3.16Å; D410-M418 HydrophobicContact CB-CG 3.83Å; D410-M418 HydrophobicContact CB-SD 4.23Å
411	E	91.4	Very high	90.4	Very high	38 Å²	38	30.5 Å²	30.5	18%	0.178	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-20.6	179.9	58.8	164.9	-130.6	0	0	113.6	S338 A339 L354 F396 H398	S338-E411 VanDerWaalsContact CB-OE2 3.29Å; S338-E411 WeakPolarHBondContact CB-OE2 3.33Å; S338-E411 PolarHBondContact OG-OE2 3.22Å; S338-E411 VanDerWaalsContact OG-OE2 3.07Å; A339-E411 VanDerWaalsContact CB-CD 3.49Å; A339-E411 WeakPolarHBondContact CB-OE1 3.19Å; A339-E411 WeakPolarHBondContact CB-OE2 3.34Å; A339-E411 PolarHBondContact N-OE2 3.42Å; L354-E411 HydrophobicContact CD1-CB 3.75Å; F396-E411 HydrophobicContact CB-CG 3.83Å; F396-E411 HydrophobicContact CD1-CG 3.85Å; F396-E411 VanDerWaalsContact CD1-OE1 3.27Å; F396-E411 WeakPolarHBondContact CD1-OE1 3.41Å; F396-E411 HydrophobicContact CG-CG 4.32Å; F396-E411 PolarHBondContact O-N 3.37Å; H398-E411 IonicContact NE2-OE2 3.95Å
412	R	88.2	Confident	90.2	Very high	112 Å²	112	33.3 Å²	33.3	42%	0.423	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-21.6	175.8	-55.6	172.2	-66	174.7	-0.3	112.8	F396 D410 P414 G463	F396-R412 HydrophobicContact CD1-CG 4.46Å; F396-R412 HydrophobicContact CG-CG 4.31Å; D410-R412 PolarHBondContact O-N 2.84Å; D410-R412 VanDerWaalsContact O-N 3.13Å; D410-R412 VanDerWaalsContact OD1-CB 3.23Å; D410-R412 WeakPolarHBondContact OD1-CB 3.29Å; D410-R412 VanDerWaalsContact OD1-CG 3.3Å; D410-R412 WeakPolarHBondContact OD1-CG 3.48Å; D410-R412 IonicContact OD1-CZ 2.69Å; D410-R412 PolarHBondContact OD1-N 3.18Å; D410-R412 IonicContact OD1-NE 3.32Å; D410-R412 PolarHBondContact OD1-NE 3.04Å; D410-R412 IonicContact OD1-NH2 3.18Å; D410-R412 IonicContact OD2-CZ 2.94Å; D410-R412 IonicContact OD2-NE 2.72Å; D410-R412 PolarHBondContact OD2-NE 3.06Å; D410-R412 IonicContact OD2-NH2 3.82Å; D410-R412 PolarHBondContact OD2-NH2 3.03Å; R412-P414 VanDerWaalsContact C-CD 3.45Å; R412-P414 WeakPolarHBondContact O-CD 3.36Å; R412-G463 PolarHBondContact NH2-O 3.21Å
413	F	87.6	Confident	90	Very high	111 Å²	111	33.4 Å²	33.4	49%	0.487	17%	0.165	S	C	.	.	S	Bend	trans	-124.6	68.5	-178.8	-60.7	-77.2	0	0	0	110	D410 V416 M418	D410-F413 HydrophobicContact CB-CD2 4.22Å; D410-F413 CarbonylContact O-C 3.59Å; D410-F413 VanDerWaalsContact O-C 3.32Å; D410-F413 PolarHBondContact O-N 3.16Å; F413-V416 PolarHBondContact O-N 3.19Å; F413-M418 HydrophobicContact CB-CE 3.91Å; F413-M418 HydrophobicContact CG-CE 4.45Å
414	P	86.7	Confident	89.9	Confident	44 Å²	44	38.8 Å²	38.8	29%	0.286	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	148.7	-178.5	24.7	-34.2	0	0	0	111.9	L367 T368 R412 V416	L367-P414 HydrophobicContact CD1-CG 4.4Å; L367-P414 HydrophobicContact CD2-CB 4.41Å; L367-P414 HydrophobicContact CD2-CG 4.33Å; L367-P414 HydrophobicContact CG-CB 4.39Å; T368-P414 WeakPolarHBondContact O-CB 3.42Å; R412-P414 VanDerWaalsContact C-CD 3.45Å; R412-P414 WeakPolarHBondContact O-CD 3.36Å; P414-V416 PolarHBondContact O-N 2.82Å
415	C	86.8	Confident	90	Very high	50 Å²	50	35.7 Å²	35.7	34%	0.338	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.8	-1.1	-178.9	-57.3	0	0	0	0	115.8	L369	L369-C415 WeakPolarHBondContact O-CA 3.38Å; L369-C415 PolarHBondContact O-N 3.33Å
416	V	86.5	Confident	89.9	Confident	44 Å²	44	42.4 Å²	42.4	27%	0.267	21%	0.209	S	C	.	.			trans	-110.6	109.8	179.2	-174.3	0	0	0	0	109.4	W13 F413 P414 M418	W13-V416 HydrophobicContact CD2-CG1 4.4Å; W13-V416 HydrophobicContact CG-CG1 4.22Å; F413-V416 PolarHBondContact O-N 3.19Å; P414-V416 PolarHBondContact O-N 2.82Å; V416-M418 HydrophobicContact CB-CE 4.05Å; V416-M418 HydrophobicContact CG1-CE 3.74Å; V416-M418 WeakPolarHBondContact O-CE 3.21Å; V416-M418 PolarHBondContact O-N 2.92Å
417	P	89	Confident	89.8	Confident	26 Å²	26	42.9 Å²	42.9	17%	0.169	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	129.7	174.7	28.6	-32.5	0	0	0	110.4	T375 Y407 M409	T375-P417 HydrophobicContact CG2-CG 4.18Å; Y407-P417 HydrophobicContact CD1-CB 4.11Å; M409-P417 VanDerWaalsContact SD-CA 3.55Å; M409-P417 HydrophobicContact SD-CB 3.81Å
418	M	88.5	Confident	89.7	Confident	39 Å²	39	44.4 Å²	44.4	19%	0.192	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	-37.1	175.9	-62.3	-61.8	98.8	0	0	111.5	I408 D410 F413 V416 C468	I408-M418 HydrophobicContact CB-CB 4.49Å; I408-M418 HydrophobicContact CG2-CB 4.3Å; I408-M418 WeakPolarHBondContact O-CB 3.2Å; I408-M418 PolarHBondContact O-N 3.36Å; D410-M418 HydrophobicContact CB-CG 3.83Å; D410-M418 HydrophobicContact CB-SD 4.23Å; F413-M418 HydrophobicContact CB-CE 3.91Å; F413-M418 HydrophobicContact CG-CE 4.45Å; V416-M418 HydrophobicContact CB-CE 4.05Å; V416-M418 HydrophobicContact CG1-CE 3.74Å; V416-M418 WeakPolarHBondContact O-CE 3.21Å; V416-M418 PolarHBondContact O-N 2.92Å; M418-C468 HydrophobicContact CB-CB 4.11Å
419	L	89.8	Confident	89.8	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	149.2	176.5	-70	173.6	0	0	0	110.3	S15 Y407 I408 W421 Y460 C468	S15-L419 WeakPolarHBondContact OG-CD2 3.37Å; Y407-L419 VanDerWaalsContact CA-O 3.31Å; Y407-L419 WeakPolarHBondContact CA-O 3.26Å; I408-L419 HydrophobicContact CB-CB 4.11Å; I408-L419 HydrophobicContact CG1-CB 4.12Å; I408-L419 HydrophobicContact CG1-CD1 4.43Å; I408-L419 PolarHBondContact N-O 2.87Å; I408-L419 PolarHBondContact O-N 3.36Å; L419-W421 HydrophobicContact CB-CH2 4.11Å; L419-W421 HydrophobicContact CB-CZ2 4.25Å; L419-W421 HydrophobicContact CB-CZ3 4.48Å; L419-W421 HydrophobicContact CD1-CH2 3.74Å; L419-W421 HydrophobicContact CD1-CZ2 3.7Å; L419-Y460 HydrophobicContact CD1-CD2 4.12Å; L419-Y460 HydrophobicContact CD1-CG 4.17Å; L419-C468 HydrophobicContact CD1-CB 3.68Å; L419-C468 HydrophobicContact CD2-CB 4.13Å; L419-C468 HydrophobicContact CG-CB 3.59Å
420	K	91	Very high	89.8	Confident	28 Å²	28	44.4 Å²	44.4	12%	0.122	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	127.5	171.1	-177.9	-172.8	177.3	-174	0	110.6	R17 D377 S405 A406 Y407 D422	R17-K420 PolarHBondContact NH2-O 3.21Å; D377-K420 HydrophobicContact CB-CD 3.79Å; D377-K420 PolarHBondContact O-NZ 3.04Å; S405-K420 WeakPolarHBondContact OG-CE 3.21Å; A406-K420 CarbonylContact O-C 3.56Å; A406-K420 WeakPolarHBondContact O-CA 3.39Å; Y407-K420 HydrophobicContact CD1-CB 4.09Å; Y407-K420 HydrophobicContact CD1-CD 4.33Å; Y407-K420 HydrophobicContact CD1-CG 3.9Å; Y407-K420 HydrophobicContact CE1-CB 4.22Å; Y407-K420 HydrophobicContact CE1-CD 3.6Å; Y407-K420 HydrophobicContact CE1-CG 3.62Å; Y407-K420 WeakPolarHBondContact OH-CE 3.33Å; K420-D422 WeakPolarHBondContact CE-OD1 3.24Å; K420-D422 IonicContact NZ-OD1 2.95Å
421	W	90.6	Very high	90	Very high	11 Å²	11	44.4 Å²	44.4	4%	0.042	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	141	167.9	-63.5	-76.8	0	0	0	110.9	S405 A406 I408 L419 L458 Y460	S405-W421 CarbonylContact C-O 3.59Å; S405-W421 WeakPolarHBondContact CA-O 3.45Å; S405-W421 VanDerWaalsContact CB-O 3.23Å; S405-W421 WeakPolarHBondContact CB-O 3.27Å; A406-W421 HydrophobicContact CB-CB 4.48Å; A406-W421 HydrophobicContact CB-CE3 4.18Å; A406-W421 PolarHBondContact N-O 2.86Å; A406-W421 PolarHBondContact O-N 3.27Å; I408-W421 HydrophobicContact CD1-CH2 4.09Å; I408-W421 HydrophobicContact CD1-CZ3 3.74Å; I408-W421 HydrophobicContact CG1-CH2 3.52Å; I408-W421 HydrophobicContact CG1-CZ3 3.38Å; L419-W421 HydrophobicContact CB-CH2 4.11Å; L419-W421 HydrophobicContact CB-CZ2 4.25Å; L419-W421 HydrophobicContact CB-CZ3 4.48Å; L419-W421 HydrophobicContact CD1-CH2 3.74Å; L419-W421 HydrophobicContact CD1-CZ2 3.7Å; W421-L458 HydrophobicContact CB-CD1 4.14Å; W421-L458 HydrophobicContact CB-CD2 4.46Å; W421-L458 HydrophobicContact CD2-CD1 3.97Å; W421-L458 HydrophobicContact CE3-CD1 3.93Å; W421-L458 HydrophobicContact CG-CD1 4.05Å; W421-L458 HydrophobicContact CG-CD2 4.28Å; W421-Y460 AromaticContact CH2-CD1 3.87Å; W421-Y460 HydrophobicContact CH2-CD1 3.87Å; W421-Y460 AromaticContact CH2-CG 3.89Å; W421-Y460 HydrophobicContact CH2-CG 3.89Å; W421-Y460 HydrophobicContact CZ2-CG 4.28Å
422	D	90.3	Very high	90.1	Very high	58 Å²	58	43.4 Å²	43.4	31%	0.31	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	111.3	158.8	-56.8	-46.1	0	0	0	106.3	S405 K420 M424	S405-D422 PolarHBondContact OG-OD1 3.19Å; K420-D422 WeakPolarHBondContact CE-OD1 3.24Å; K420-D422 IonicContact NZ-OD1 2.95Å; D422-M424 VanDerWaalsContact C-N 3.28Å; D422-M424 HydrophobicContact CB-SD 4.23Å; D422-M424 PolarHBondContact O-N 3.32Å
423	H	88.8	Confident	90.3	Very high	3 Å²	3	40.5 Å²	40.5	1%	0.014	21%	0.211	C	C	.	.			trans	-80.4	-10.4	-169.3	58.5	69.3	0	0	0	113.1	T402 Q403 H404 S405 M425 L447	T402-H423 PolarHBondContact O-NE2 3.44Å; Q403-H423 PolarHBondContact O-CE1 3.19Å; Q403-H423 VanDerWaalsContact O-CE1 3.26Å; Q403-H423 PolarHBondContact O-NE2 2.82Å; H404-H423 VanDerWaalsContact C-CD2 3.46Å; H404-H423 PolarHBondContact N-NE2 3.06Å; H404-H423 PolarHBondContact O-CD2 3.07Å; H404-H423 PolarHBondContact O-N 2.74Å; H404-H423 PolarHBondContact O-NE2 3.48Å; S405-H423 PolarHBondContact N-NE2 3.39Å; H423-M425 HydrophobicContact CB-CG 4.31Å; H423-M425 HydrophobicContact CB-SD 4.47Å; H423-M425 WeakPolarHBondContact ND1-CB 3.27Å; H423-M425 WeakPolarHBondContact ND1-CG 3.46Å; H423-M425 PolarHBondContact ND1-N 3.4Å; H423-M425 PolarHBondContact O-N 3.16Å; H423-M425 VanDerWaalsContact O-N 3.08Å; H423-L447 HydrophobicContact CB-CD1 4.04Å
424	M	88.8	Confident	90.4	Very high	163 Å²	163	36 Å²	36	80%	0.803	19%	0.193	S	C	*	.			trans	53.9	28.6	173.5	-54.2	-59.1	-70.7	0	0	114.8	D422	D422-M424 VanDerWaalsContact C-N 3.28Å; D422-M424 HydrophobicContact CB-SD 4.23Å; D422-M424 PolarHBondContact O-N 3.32Å
425	M	91.1	Very high	90.4	Very high	19 Å²	19	34 Å²	34	9%	0.094	18%	0.18	C	C	.	.			trans	-82.4	145.7	179.6	-61.7	175.7	77.2	0	0	110	H423 A427 P429 L447 E454 T456	H423-M425 HydrophobicContact CB-CG 4.31Å; H423-M425 HydrophobicContact CB-SD 4.47Å; H423-M425 WeakPolarHBondContact ND1-CB 3.27Å; H423-M425 WeakPolarHBondContact ND1-CG 3.46Å; H423-M425 PolarHBondContact ND1-N 3.4Å; H423-M425 PolarHBondContact O-N 3.16Å; H423-M425 VanDerWaalsContact O-N 3.08Å; M425-A427 VanDerWaalsContact C-N 3.26Å; M425-A427 WeakPolarHBondContact CB-O 3.37Å; M425-A427 PolarHBondContact O-N 3.27Å; M425-P429 HydrophobicContact SD-CB 3.91Å; M425-P429 HydrophobicContact SD-CG 4.3Å; M425-L447 HydrophobicContact SD-CB 4.05Å; M425-E454 HydrophobicContact CE-CB 3.89Å; M425-E454 VanDerWaalsContact CE-O 3.27Å; M425-E454 WeakPolarHBondContact CE-O 3.4Å; M425-T456 WeakPolarHBondContact CG-OG1 3.35Å
426	E	90.1	Very high	90	Very high	140 Å²	140	34.8 Å²	34.8	65%	0.654	19%	0.185	S	C	*	.	S	Bend	trans	-61.7	-39.4	177	-178.9	-177	-165.6	0	0	110.9	E454 R481	E426-E454 WeakPolarHBondContact CB-OE2 3.39Å; E426-E454 PolarHBondContact N-OE2 3.09Å; E426-R481 IonicContact OE2-NH2 2.75Å; E426-R481 PolarHBondContact OE2-NH2 2.78Å
427	A	90.9	Very high	89.2	Confident	10 Å²	10	34.1 Å²	34.1	8%	0.083	19%	0.187	C	C	.	.	S	Bend	trans	-126	152.4	179	0	0	0	0	0	111.6	M425 S449 S451	M425-A427 VanDerWaalsContact C-N 3.26Å; M425-A427 WeakPolarHBondContact CB-O 3.37Å; M425-A427 PolarHBondContact O-N 3.27Å; A427-S449 VanDerWaalsContact CB-OG 3.23Å; A427-S449 WeakPolarHBondContact CB-OG 3.29Å; A427-S451 WeakPolarHBondContact CB-OG 3.38Å
428	P	91.7	Very high	88	Confident	32 Å²	32	34.4 Å²	34.4	21%	0.208	19%	0.19	C	C	.	.			trans	-58	137.6	-175.9	19.2	-32.9	0	0	0	113.8	F176 L385 Q403 L430	F176-P428 HydrophobicContact CD2-CG 3.85Å; F176-P428 HydrophobicContact CE2-CB 4.4Å; F176-P428 HydrophobicContact CE2-CG 3.86Å; L385-P428 HydrophobicContact CD1-CB 3.18Å; L385-P428 HydrophobicContact CD1-CG 4.48Å; L385-P428 HydrophobicContact CD2-CB 4.32Å; L385-P428 HydrophobicContact CG-CB 4.37Å; Q403-P428 HydrophobicContact CB-CB 4.46Å; Q403-P428 HydrophobicContact CG-CB 4.44Å; P428-L430 PolarHBondContact O-N 3.39Å
429	P	93.8	Very high	86.1	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	125.4	177.1	29.1	-34.1	0	0	0	112	T401 M425 L447 G448	T401-P429 HydrophobicContact CG2-CG 4.27Å; M425-P429 HydrophobicContact SD-CB 3.91Å; M425-P429 HydrophobicContact SD-CG 4.3Å; P429-L447 HydrophobicContact CB-CB 3.99Å; P429-L447 HydrophobicContact CG-CD1 4.44Å; P429-G448 CarbonylContact C-O 3.41Å; P429-G448 WeakPolarHBondContact CA-O 3.27Å
430	L	93.7	Very high	84.5	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	-13.5	178	-74.4	-178.1	0	0	0	113.6	F176 T181 G182 L385 P428 G448 Q450	F176-L430 HydrophobicContact CD2-CD1 4.15Å; F176-L430 HydrophobicContact CE2-CD1 3.65Å; F176-L430 HydrophobicContact CE2-CD2 3.65Å; F176-L430 HydrophobicContact CE2-CG 3.82Å; F176-L430 HydrophobicContact CZ-CD1 4.3Å; F176-L430 HydrophobicContact CZ-CD2 3.78Å; F176-L430 HydrophobicContact CZ-CG 4.43Å; T181-L430 HydrophobicContact CG2-CD2 4.47Å; G182-L430 PolarHBondContact N-O 2.8Å; G182-L430 VanDerWaalsContact N-O 3.09Å; L385-L430 HydrophobicContact CB-CD2 4.47Å; P428-L430 PolarHBondContact O-N 3.39Å; L430-G448 PolarHBondContact N-O 3.1Å; L430-Q450 HydrophobicContact CD1-CB 3.92Å
431	F	94.1	Very high	83.5	Confident	3 Å²	3	41.2 Å²	41.2	1%	0.013	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	143.3	178	-44.2	-60.1	0	0	0	109.6	A180 G183 G448 Q450 A506 L509	A180-F431 HydrophobicContact CB-CE1 4.39Å; A180-F431 HydrophobicContact CB-CZ 4.4Å; A180-F431 WeakPolarHBondContact O-CE1 3.43Å; G183-F431 VanDerWaalsContact CA-CD1 3.47Å; F431-G448 WeakPolarHBondContact CD2-O 3.4Å; F431-G448 PolarHBondContact N-O 3.48Å; F431-G448 PolarHBondContact O-N 3.45Å; F431-Q450 HydrophobicContact CE2-CB 4.17Å; F431-Q450 HydrophobicContact CZ-CB 4.2Å; F431-A506 HydrophobicContact CE2-CB 3.88Å; F431-A506 WeakPolarHBondContact CZ-O 3.26Å; F431-L509 HydrophobicContact CB-CB 3.82Å; F431-L509 HydrophobicContact CG-CB 4.41Å
432	C	93.7	Very high	83.2	Confident	17 Å²	17	41.2 Å²	41.2	12%	0.115	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	138.4	171.5	175.6	0	0	0	0	110	L386 L399 L446 L447	L386-C432 HydrophobicContact CD2-CB 3.43Å; L386-C432 VanDerWaalsContact CD2-CB 3.43Å; L399-C432 HydrophobicContact CD2-CB 4.17Å; L399-C432 WeakPolarHBondContact CD2-SG 3.48Å; C432-L446 VanDerWaalsContact CA-O 3.26Å; C432-L446 WeakPolarHBondContact CA-O 3.45Å; C432-L447 HydrophobicContact CB-CD2 4.31Å
433	H	92.8	Very high	83.1	Confident	50 Å²	50	38.8 Å²	38.8	23%	0.231	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	142.5	163.8	-166.8	86.2	0	0	0	109.7	L446 C511	H433-L446 PolarHBondContact N-O 3.31Å; H433-L446 PolarHBondContact O-N 3.26Å; H433-C511 HydrophobicContact CB-CB 4.46Å; H433-C511 VanDerWaalsContact CD2-CB 3.45Å; H433-C511 WeakPolarHBondContact CD2-CB 3.15Å; H433-C511 PolarHBondContact NE2-O 2.85Å; H433-C511 VanDerWaalsContact NE2-O 3.11Å
434	V	90.3	Very high	83.2	Confident	16 Å²	16	38.7 Å²	38.7	10%	0.097	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	125.9	-176.6	-179.7	0	0	0	0	107.3	L390 V393 T443 K444 V445	L390-V434 HydrophobicContact CD2-CB 4.27Å; L390-V434 HydrophobicContact CD2-CG1 4.29Å; L390-V434 HydrophobicContact CD2-CG2 3.32Å; V393-V434 HydrophobicContact CG2-CG1 3.52Å; V434-T443 HydrophobicContact CG1-CG2 3.77Å; V434-K444 WeakPolarHBondContact CA-O 3.36Å; V434-V445 HydrophobicContact CG2-CG2 4.43Å
435	A	86.2	Confident	83.5	Confident	3 Å²	3	31 Å²	31	3%	0.025	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	125.3	175.7	0	0	0	0	0	109.2	K444 Q513 M522	A435-K444 HydrophobicContact CB-CB 4.25Å; A435-K444 PolarHBondContact N-O 3.28Å; A435-K444 PolarHBondContact O-N 3.33Å; A435-Q513 HydrophobicContact CB-CB 4.33Å; A435-Q513 VanDerWaalsContact CB-OE1 3.23Å; A435-M522 HydrophobicContact CB-CE 3.56Å
436	P	79.3	Confident	83.6	Confident	67 Å²	67	30.1 Å²	30.1	44%	0.435	20%	0.204	S	C	.	.			trans	-63.7	146.8	-177.7	24.8	-32.6	0	0	0	111.1	V393 Q513	V393-P436 HydrophobicContact CG2-CB 4.08Å; P436-Q513 PolarHBondContact O-NE2 2.87Å; P436-Q513 PolarHBondContact O-OE1 2.85Å; P436-Q513 VanDerWaalsContact O-OE1 3.11Å
437	G	69.6	Low	83.9	Confident	30 Å²	30	23.4 Å²	23.4	31%	0.309	17%	0.173	S	C	.	.			trans	-62	142.4	176.9	0	0	0	0	0	112.8	T442	G437-T442 WeakPolarHBondContact CA-O 3.11Å
438	S	62.4	Low	84.1	Confident	32 Å²	32	23 Å²	23	22%	0.224	17%	0.17	C	C	.	.			trans	-78.2	-163.1	168.1	-170.6	0	0	0	0	109.7	S440 G441 T515	S438-S440 PolarHBondContact O-N 3.2Å; S438-G441 PolarHBondContact O-N 2.93Å; S438-T515 WeakPolarHBondContact OG-CG2 3.17Å
439	A	50.3	Low	84.2	Confident	108 Å²	108	21.5 Å²	21.5	89%	0.893	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.1	-14.6	179.4	0	0	0	0	0	116.2
440	S	56	Low	84.1	Confident	57 Å²	57	22.7 Å²	22.7	40%	0.399	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-13.3	174.7	56.6	0	0	0	0	114.8	E22 S438 T442	E22-S440 VanDerWaalsContact OE1-CB 3.23Å; E22-S440 WeakPolarHBondContact OE1-CB 3.39Å; E22-S440 PolarHBondContact OE1-OG 3.02Å; S438-S440 PolarHBondContact O-N 3.2Å; S440-T442 VanDerWaalsContact C-N 3.29Å; S440-T442 PolarHBondContact O-N 3.31Å; S440-T442 PolarHBondContact OG-OG1 3.34Å
441	G	69.9	Low	83.8	Confident	47 Å²	47	24.9 Å²	24.9	49%	0.485	18%	0.181	S	C	.	.			trans	75.8	6.3	-178.3	0	0	0	0	0	115.6	S438	S438-G441 PolarHBondContact O-N 2.93Å
442	T	83.4	Confident	83.6	Confident	10 Å²	10	24.9 Å²	24.9	6%	0.061	18%	0.181	C	C	.	.			trans	-92.3	119.2	-179	60.8	0	0	0	0	112.7	E22 G437 S440 K444 Y460	E22-T442 PolarHBondContact OE1-OG1 3.29Å; E22-T442 VanDerWaalsContact OE1-OG1 3.09Å; E22-T442 PolarHBondContact OE2-OG1 2.99Å; G437-T442 WeakPolarHBondContact CA-O 3.11Å; S440-T442 VanDerWaalsContact C-N 3.29Å; S440-T442 PolarHBondContact O-N 3.31Å; S440-T442 PolarHBondContact OG-OG1 3.34Å; T442-K444 PolarHBondContact O-NZ 2.95Å; T442-K444 PolarHBondContact OG1-NZ 3.37Å; T442-Y460 CarbonylContact C-O 3.32Å
443	T	89.2	Confident	83.5	Confident	8 Å²	8	24 Å²	24	5%	0.049	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	140.8	175.2	-52.7	0	0	0	0	110.8	V393 V434 Q459 Y460	V393-T443 HydrophobicContact CB-CG2 4.09Å; V393-T443 HydrophobicContact CG1-CG2 3.5Å; V393-T443 VanDerWaalsContact CG1-CG2 3.5Å; V393-T443 WeakPolarHBondContact CG1-OG1 3.4Å; V393-T443 HydrophobicContact CG2-CG2 3.93Å; V434-T443 HydrophobicContact CG1-CG2 3.77Å; T443-Q459 WeakPolarHBondContact O-CA 2.98Å; T443-Y460 WeakPolarHBondContact CA-O 3.46Å; T443-Y460 WeakPolarHBondContact CB-O 3.44Å; T443-Y460 HydrophobicContact CG2-CD1 4.14Å; T443-Y460 HydrophobicContact CG2-CE1 3.43Å; T443-Y460 VanDerWaalsContact CG2-CE1 3.43Å; T443-Y460 PolarHBondContact N-O 3.05Å; T443-Y460 PolarHBondContact O-N 2.86Å
444	K	91	Very high	83.5	Confident	1 Å²	1	22.7 Å²	22.7	0%	0.004	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	127.3	-178.4	-70.1	159.4	-168.1	55.1	0	109.7	E22 W24 V434 A435 T442 L457 L458 Q459 M522	E22-K444 WeakPolarHBondContact OE2-CE 3.21Å; E22-K444 IonicContact OE2-NZ 3.23Å; E22-K444 PolarHBondContact OE2-NZ 2.84Å; W24-K444 HydrophobicContact CZ2-CD 3.99Å; V434-K444 WeakPolarHBondContact CA-O 3.36Å; A435-K444 HydrophobicContact CB-CB 4.25Å; A435-K444 PolarHBondContact N-O 3.28Å; A435-K444 PolarHBondContact O-N 3.33Å; T442-K444 PolarHBondContact O-NZ 2.95Å; T442-K444 PolarHBondContact OG1-NZ 3.37Å; K444-L457 HydrophobicContact CB-CD1 3.81Å; K444-L457 HydrophobicContact CG-CD1 4.18Å; K444-L458 WeakPolarHBondContact CA-O 3.27Å; K444-Q459 HydrophobicContact CG-CG 4.42Å; K444-M522 HydrophobicContact CB-CE 4Å; K444-M522 HydrophobicContact CD-CE 3.33Å; K444-M522 HydrophobicContact CG-CE 4.26Å
445	V	93.4	Very high	83.7	Confident	0 Å²	0	22 Å²	22	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	117.4	179.3	-179.5	0	0	0	0	107.9	L399 V434 L447 L458 Y460	L399-V445 HydrophobicContact CD1-CG1 4.33Å; L399-V445 HydrophobicContact CD2-CG1 3.57Å; V434-V445 HydrophobicContact CG2-CG2 4.43Å; V445-L447 HydrophobicContact CG1-CD2 3.99Å; V445-L447 HydrophobicContact CG1-CG 4.45Å; V445-L458 HydrophobicContact CB-CB 4.29Å; V445-L458 PolarHBondContact N-O 3.16Å; V445-L458 PolarHBondContact O-N 2.59Å; V445-Y460 HydrophobicContact CG2-CD1 3.88Å; V445-Y460 HydrophobicContact CG2-CE1 3.66Å
446	L	94.8	Very high	84.1	Confident	1 Å²	1	22 Å²	22	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	120.7	175.6	-70.4	165	0	0	0	109	C432 H433 V455 T456 L457 L477 L509 C511 M522 V524	C432-L446 VanDerWaalsContact CA-O 3.26Å; C432-L446 WeakPolarHBondContact CA-O 3.45Å; H433-L446 PolarHBondContact N-O 3.31Å; H433-L446 PolarHBondContact O-N 3.26Å; L446-V455 HydrophobicContact CD2-CG1 4.08Å; L446-T456 WeakPolarHBondContact CA-O 3.49Å; L446-L457 HydrophobicContact CD2-CB 3.82Å; L446-L457 HydrophobicContact CD2-CD1 3.69Å; L446-L457 HydrophobicContact CD2-CG 4.31Å; L446-L457 HydrophobicContact CG-CD1 4.06Å; L446-L477 HydrophobicContact CD2-CD1 3.77Å; L446-L509 HydrophobicContact CB-CD2 4.05Å; L446-C511 HydrophobicContact CD1-CB 3.31Å; L446-C511 VanDerWaalsContact CD1-SG 3.59Å; L446-M522 HydrophobicContact CD1-SD 4.14Å; L446-V524 HydrophobicContact CD1-CG1 4.3Å; L446-V524 HydrophobicContact CD1-CG2 3.75Å; L446-V524 HydrophobicContact CD2-CG2 4.36Å
447	L	95.9	Very high	84.8	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	133.5	174.2	-59.9	-175.8	0	0	0	109.5	L399 T401 A406 H423 M425 P429 C432 V445 V455 T456 L458	L399-L447 HydrophobicContact CD2-CD2 4.08Å; T401-L447 HydrophobicContact CG2-CD1 4.44Å; T401-L447 HydrophobicContact CG2-CD2 3.86Å; A406-L447 HydrophobicContact CB-CD1 4.03Å; H423-L447 HydrophobicContact CB-CD1 4.04Å; M425-L447 HydrophobicContact SD-CB 4.05Å; P429-L447 HydrophobicContact CB-CB 3.99Å; P429-L447 HydrophobicContact CG-CD1 4.44Å; C432-L447 HydrophobicContact CB-CD2 4.31Å; V445-L447 HydrophobicContact CG1-CD2 3.99Å; V445-L447 HydrophobicContact CG1-CG 4.45Å; L447-V455 CarbonylContact O-C 3.43Å; L447-V455 VanDerWaalsContact O-CA 3.24Å; L447-V455 WeakPolarHBondContact O-CA 3.43Å; L447-T456 PolarHBondContact N-O 2.66Å; L447-T456 PolarHBondContact O-N 3.1Å; L447-L458 HydrophobicContact CD1-CD1 3.61Å; L447-L458 HydrophobicContact CD1-CG 4.47Å; L447-L458 HydrophobicContact CG-CD1 4.18Å
448	G	94.9	Very high	86	Confident	1 Å²	1	17.5 Å²	17.5	1%	0.01	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	135.4	179.6	0	0	0	0	0	112.4	P429 L430 F431 E454	P429-G448 CarbonylContact C-O 3.41Å; P429-G448 WeakPolarHBondContact CA-O 3.27Å; L430-G448 PolarHBondContact N-O 3.1Å; F431-G448 WeakPolarHBondContact CD2-O 3.4Å; F431-G448 PolarHBondContact N-O 3.48Å; F431-G448 PolarHBondContact O-N 3.45Å; G448-E454 WeakPolarHBondContact CA-O 3.2Å
449	S	93.3	Very high	87.3	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	145.3	173.6	165.3	0	0	0	0	111.3	A427 S452 Q453 E454	A427-S449 VanDerWaalsContact CB-OG 3.23Å; A427-S449 WeakPolarHBondContact CB-OG 3.29Å; S449-S452 VanDerWaalsContact CB-OG 3.26Å; S449-S452 WeakPolarHBondContact CB-OG 3.28Å; S449-S452 PolarHBondContact OG-N 2.84Å; S449-S452 PolarHBondContact OG-OG 2.97Å; S449-Q453 WeakPolarHBondContact O-CA 3.13Å; S449-E454 PolarHBondContact N-O 2.89Å
450	Q	91.3	Very high	89.3	Confident	25 Å²	25	11.5 Å²	11.5	12%	0.117	8%	0.08	C	C	.	.	S	Bend	trans	-75.3	-57.4	176.3	173.5	175.6	39.9	0	0	112.1	S177 L430 F431 P505 A506	S177-Q450 VanDerWaalsContact N-OE1 3.17Å; S177-Q450 PolarHBondContact O-OE1 3.2Å; L430-Q450 HydrophobicContact CD1-CB 3.92Å; F431-Q450 HydrophobicContact CE2-CB 4.17Å; F431-Q450 HydrophobicContact CZ-CB 4.2Å; Q450-P505 HydrophobicContact CG-CB 3.84Å; Q450-P505 CarbonylContact O-C 3.6Å; Q450-P505 WeakPolarHBondContact O-CA 3.4Å; Q450-P505 WeakPolarHBondContact O-CB 3.49Å; Q450-A506 WeakPolarHBondContact CG-O 3.44Å; Q450-A506 PolarHBondContact O-N 2.75Å
451	S	87.8	Confident	90.8	Very high	47 Å²	47	9.5 Å²	9.5	33%	0.329	7%	0.066	S	C	.	.	S	Bend	trans	-78.7	-42	-169.7	51.2	0	0	0	0	112.7	A427	A427-S451 WeakPolarHBondContact CB-OG 3.38Å
452	S	89.7	Confident	91.4	Very high	2 Å²	2	8.6 Å²	8.6	1%	0.014	6%	0.056	C	C	.	.	S	Bend	trans	-81.6	-13.4	178.2	67.3	0	0	0	0	113.8	S449 E454 R481	S449-S452 VanDerWaalsContact CB-OG 3.26Å; S449-S452 WeakPolarHBondContact CB-OG 3.28Å; S449-S452 PolarHBondContact OG-N 2.84Å; S449-S452 PolarHBondContact OG-OG 2.97Å; S452-E454 PolarHBondContact O-N 3.05Å; S452-E454 VanDerWaalsContact O-N 3.11Å; S452-E454 WeakPolarHBondContact OG-CB 3.46Å; S452-E454 WeakPolarHBondContact OG-CG 3.32Å; S452-E454 PolarHBondContact OG-N 3.34Å; S452-E454 PolarHBondContact OG-OE2 3.38Å; S452-R481 PolarHBondContact O-NH1 3.47Å; S452-R481 PolarHBondContact O-NH2 2.94Å
453	Q	91.8	Very high	91.2	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	6%	0.058	C	C	.	.			trans	56.8	15.7	-171.6	-56.1	172.4	31.9	0	0	114	S449 L502 S504 A506 Q526	S449-Q453 WeakPolarHBondContact O-CA 3.13Å; Q453-L502 PolarHBondContact NE2-O 2.99Å; Q453-L502 PolarHBondContact OE1-O 3.08Å; Q453-S504 PolarHBondContact NE2-O 3.15Å; Q453-A506 HydrophobicContact CG-CB 4.21Å; Q453-Q526 PolarHBondContact O-NE2 3.32Å
454	E	93.2	Very high	90.5	Very high	22 Å²	22	11.9 Å²	11.9	10%	0.103	9%	0.086	C	C	.	.			trans	-72.2	142	-179.8	-74.9	171.1	170.2	0	0	111.3	M425 E426 G448 S449 S452 R479	M425-E454 HydrophobicContact CE-CB 3.89Å; M425-E454 VanDerWaalsContact CE-O 3.27Å; M425-E454 WeakPolarHBondContact CE-O 3.4Å; E426-E454 WeakPolarHBondContact CB-OE2 3.39Å; E426-E454 PolarHBondContact N-OE2 3.09Å; G448-E454 WeakPolarHBondContact CA-O 3.2Å; S449-E454 PolarHBondContact N-O 2.89Å; S452-E454 PolarHBondContact O-N 3.05Å; S452-E454 VanDerWaalsContact O-N 3.11Å; S452-E454 WeakPolarHBondContact OG-CB 3.46Å; S452-E454 WeakPolarHBondContact OG-CG 3.32Å; S452-E454 PolarHBondContact OG-N 3.34Å; S452-E454 PolarHBondContact OG-OE2 3.38Å; E454-R479 HydrophobicContact CG-CG 4.29Å; E454-R479 IonicContact OE1-NH1 2.74Å; E454-R479 PolarHBondContact OE1-NH1 3.5Å
455	V	94.8	Very high	89.7	Confident	1 Å²	1	19 Å²	19	1%	0.006	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	124.5	172.7	-174.5	0	0	0	0	108.5	L446 L447 L477 L509 V524	L446-V455 HydrophobicContact CD2-CG1 4.08Å; L447-V455 CarbonylContact O-C 3.43Å; L447-V455 VanDerWaalsContact O-CA 3.24Å; L447-V455 WeakPolarHBondContact O-CA 3.43Å; V455-L477 HydrophobicContact CB-CB 4.25Å; V455-L477 HydrophobicContact CB-CD1 4.31Å; V455-L477 HydrophobicContact CG1-CD1 3.8Å; V455-L477 HydrophobicContact CG1-CG 4.44Å; V455-L477 PolarHBondContact O-N 3.29Å; V455-L509 HydrophobicContact CG1-CD1 4.03Å; V455-L509 HydrophobicContact CG1-CD2 4Å; V455-L509 HydrophobicContact CG2-CD1 3.79Å; V455-V524 HydrophobicContact CG1-CG1 4.48Å
456	T	94.9	Very high	89.1	Confident	2 Å²	2	25.6 Å²	25.6	1%	0.012	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	129	179.5	-60.5	0	0	0	0	109.8	M425 L446 L447 L458 P474 Q475	M425-T456 WeakPolarHBondContact CG-OG1 3.35Å; L446-T456 WeakPolarHBondContact CA-O 3.49Å; L447-T456 PolarHBondContact N-O 2.66Å; L447-T456 PolarHBondContact O-N 3.1Å; T456-L458 HydrophobicContact CG2-CD2 4.1Å; T456-P474 HydrophobicContact CG2-CB 3.71Å; T456-Q475 CarbonylContact C-O 3.41Å; T456-Q475 WeakPolarHBondContact CA-O 3.4Å
457	L	94.1	Very high	88.5	Confident	1 Å²	1	28.4 Å²	28.4	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	122.9	174.6	175.4	64.5	0	0	0	110	W24 K444 L446 Q475	W24-L457 HydrophobicContact CB-CD2 4.23Å; W24-L457 HydrophobicContact CG-CD2 4.02Å; K444-L457 HydrophobicContact CB-CD1 3.81Å; K444-L457 HydrophobicContact CG-CD1 4.18Å; L446-L457 HydrophobicContact CD2-CB 3.82Å; L446-L457 HydrophobicContact CD2-CD1 3.69Å; L446-L457 HydrophobicContact CD2-CG 4.31Å; L446-L457 HydrophobicContact CG-CD1 4.06Å; L457-Q475 HydrophobicContact CB-CB 4.33Å; L457-Q475 PolarHBondContact N-O 2.71Å; L457-Q475 PolarHBondContact O-N 2.8Å
458	L	92.9	Very high	88.2	Confident	3 Å²	3	28.9 Å²	28.9	2%	0.016	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	147.5	173.3	-55	177.2	0	0	0	109.6	A406 W421 K444 V445 L447 T456 P474	A406-L458 HydrophobicContact CB-CD1 4.25Å; W421-L458 HydrophobicContact CB-CD1 4.14Å; W421-L458 HydrophobicContact CB-CD2 4.46Å; W421-L458 HydrophobicContact CD2-CD1 3.97Å; W421-L458 HydrophobicContact CE3-CD1 3.93Å; W421-L458 HydrophobicContact CG-CD1 4.05Å; W421-L458 HydrophobicContact CG-CD2 4.28Å; K444-L458 WeakPolarHBondContact CA-O 3.27Å; V445-L458 HydrophobicContact CB-CB 4.29Å; V445-L458 PolarHBondContact N-O 3.16Å; V445-L458 PolarHBondContact O-N 2.59Å; L447-L458 HydrophobicContact CD1-CD1 3.61Å; L447-L458 HydrophobicContact CD1-CG 4.47Å; L447-L458 HydrophobicContact CG-CD1 4.18Å; T456-L458 HydrophobicContact CG2-CD2 4.1Å; L458-P474 HydrophobicContact CD2-CB 3.56Å; L458-P474 HydrophobicContact CD2-CG 3.64Å
459	Q	91.6	Very high	87.8	Confident	12 Å²	12	29.7 Å²	29.7	6%	0.056	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	136.7	-179.3	-58.2	177.1	17.7	0	0	111.1	E22 T443 K444 H471	E22-Q459 PolarHBondContact O-NE2 3.42Å; E22-Q459 PolarHBondContact O-OE1 2.73Å; T443-Q459 WeakPolarHBondContact O-CA 2.98Å; K444-Q459 HydrophobicContact CG-CG 4.42Å; Q459-H471 HydrophobicContact CB-CB 4Å; Q459-H471 PolarHBondContact O-N 2.84Å
460	Y	91.3	Very high	87.7	Confident	1 Å²	1	29.9 Å²	29.9	0%	0.004	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	154.4	177.9	85.7	-91.2	0	0	0	112.7	L390 I408 L419 W421 T442 T443 V445 C469	L390-Y460 HydrophobicContact CD1-CE1 4.38Å; L390-Y460 WeakPolarHBondContact CD1-OH 3.45Å; I408-Y460 HydrophobicContact CD1-CE1 4.32Å; L419-Y460 HydrophobicContact CD1-CD2 4.12Å; L419-Y460 HydrophobicContact CD1-CG 4.17Å; W421-Y460 AromaticContact CH2-CD1 3.87Å; W421-Y460 HydrophobicContact CH2-CD1 3.87Å; W421-Y460 AromaticContact CH2-CG 3.89Å; W421-Y460 HydrophobicContact CH2-CG 3.89Å; W421-Y460 HydrophobicContact CZ2-CG 4.28Å; T442-Y460 CarbonylContact C-O 3.32Å; T443-Y460 WeakPolarHBondContact CA-O 3.46Å; T443-Y460 WeakPolarHBondContact CB-O 3.44Å; T443-Y460 HydrophobicContact CG2-CD1 4.14Å; T443-Y460 HydrophobicContact CG2-CE1 3.43Å; T443-Y460 VanDerWaalsContact CG2-CE1 3.43Å; T443-Y460 PolarHBondContact N-O 3.05Å; T443-Y460 PolarHBondContact O-N 2.86Å; V445-Y460 HydrophobicContact CG2-CD1 3.88Å; V445-Y460 HydrophobicContact CG2-CE1 3.66Å; Y460-C469 CarbonylContact C-O 3.6Å; Y460-C469 VanDerWaalsContact CA-O 3.27Å; Y460-C469 WeakPolarHBondContact CA-O 3.32Å
461	S	88.7	Confident	87.5	Confident	16 Å²	16	29.8 Å²	29.8	11%	0.112	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	172.8	170.6	68.9	0	0	0	0	110.7	C468 C469 H471	S461-C468 CarbonylContact O-C 3.57Å; S461-C468 VanDerWaalsContact O-CA 3.28Å; S461-C468 WeakPolarHBondContact O-CA 3.22Å; S461-C469 PolarHBondContact N-O 2.69Å; S461-C469 PolarHBondContact O-N 2.75Å; S461-C469 PolarHBondContact OG-SG 2.89Å; S461-H471 PolarHBondContact OG-NE2 3.19Å
462	G	82.3	Confident	87.4	Confident	27 Å²	27	28.8 Å²	28.8	28%	0.278	19%	0.19	S	C	.	.			trans	90.9	-175.8	-179.8	0	0	0	0	0	114.2
463	G	77.7	Confident	87.2	Confident	10 Å²	10	33.7 Å²	33.7	10%	0.103	22%	0.224	C	C	.	.	S	Bend	trans	115.2	-28.6	-178.5	0	0	0	0	0	114.8	H394 H397 R412 E466 C468	H394-G463 PolarHBondContact NE2-O 2.91Å; H394-G463 VanDerWaalsContact NE2-O 3.16Å; H397-G463 VanDerWaalsContact CE1-CA 3.44Å; H397-G463 WeakPolarHBondContact CE1-CA 3.45Å; R412-G463 PolarHBondContact NH2-O 3.21Å; G463-E466 PolarHBondContact N-O 2.87Å; G463-C468 VanDerWaalsContact CA-SG 3.59Å
464	A	74.6	Confident	87.1	Confident	77 Å²	77	36 Å²	36	64%	0.636	24%	0.239	S	C	*	.	S	Bend	trans	-88.8	-77.9	-179.8	0	0	0	0	0	111.7	H394	H394-A464 PolarHBondContact NE2-N 2.82Å
465	V	74.9	Confident	87	Confident	150 Å²	150	37.2 Å²	37.2	91%	0.909	25%	0.245	S	C	*	.	S	Bend	trans	-102.1	-36	179.7	-177	0	0	0	0	111.1
466	E	80.3	Confident	86.8	Confident	139 Å²	139	41.4 Å²	41.4	65%	0.65	27%	0.271	S	S	*	.	S	Bend	trans	-99.6	149.4	180	-62.8	-176.7	169	0	0	111.3	G463	G463-E466 PolarHBondContact N-O 2.87Å
467	A	83.7	Confident	86.7	Confident	60 Å²	60	41.6 Å²	41.6	50%	0.496	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-61.1	145.6	173.7	0	0	0	0	0	110.7	K16 C469	K16-A467 HydrophobicContact CD-CB 4.47Å; A467-C469 PolarHBondContact O-N 2.88Å
468	C	87.8	Confident	86.6	Confident	10 Å²	10	43.8 Å²	43.8	7%	0.068	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-61	134.1	177.3	-63	0	0	0	0	110.9	H397 M418 L419 S461 G463	H397-C468 PolarHBondContact CE1-SG 3.01Å; M418-C468 HydrophobicContact CB-CB 4.11Å; L419-C468 HydrophobicContact CD1-CB 3.68Å; L419-C468 HydrophobicContact CD2-CB 4.13Å; L419-C468 HydrophobicContact CG-CB 3.59Å; S461-C468 CarbonylContact O-C 3.57Å; S461-C468 VanDerWaalsContact O-CA 3.28Å; S461-C468 WeakPolarHBondContact O-CA 3.22Å; G463-C468 VanDerWaalsContact CA-SG 3.59Å
469	C	88.1	Confident	86.5	Confident	19 Å²	19	46.5 Å²	46.5	13%	0.128	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	136.3	176.4	41.9	0	0	0	0	110.7	K16 Y460 S461 A467 H471	K16-C469 HydrophobicContact CB-CB 4.04Å; K16-C469 WeakPolarHBondContact O-CA 3.44Å; Y460-C469 CarbonylContact C-O 3.6Å; Y460-C469 VanDerWaalsContact CA-O 3.27Å; Y460-C469 WeakPolarHBondContact CA-O 3.32Å; S461-C469 PolarHBondContact N-O 2.69Å; S461-C469 PolarHBondContact O-N 2.75Å; S461-C469 PolarHBondContact OG-SG 2.89Å; A467-C469 PolarHBondContact O-N 2.88Å; C469-H471 PolarHBondContact O-CD2 2.83Å
470	S	90.1	Very high	86.4	Confident	4 Å²	4	45.9 Å²	45.9	3%	0.028	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	138.2	172	64.3	0	0	0	0	110.3	K16 R17 Q18	K16-S470 PolarHBondContact O-N 3.01Å; K16-S470 PolarHBondContact O-OG 2.99Å; R17-S470 WeakPolarHBondContact CA-OG 3.49Å; R17-S470 WeakPolarHBondContact CG-OG 3.16Å; Q18-S470 PolarHBondContact N-O 3.17Å
471	H	87.2	Confident	86.2	Confident	22 Å²	22	49.4 Å²	49.4	10%	0.102	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	128.7	-179.5	-71.1	-92.3	0	0	0	111.2	Q18 Q459 S461 C469	Q18-H471 PolarHBondContact OE1-CE1 3.19Å; Q459-H471 HydrophobicContact CB-CB 4Å; Q459-H471 PolarHBondContact O-N 2.84Å; S461-H471 PolarHBondContact OG-NE2 3.19Å; C469-H471 PolarHBondContact O-CD2 2.83Å
472	G	85.2	Confident	86.2	Confident	26 Å²	26	52 Å²	52	27%	0.268	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	62.6	-177.1	177.3	0	0	0	0	0	114.5	Q18 G20	Q18-G472 PolarHBondContact O-N 2.95Å; G20-G472 PolarHBondContact O-N 3.24Å
473	S	86.2	Confident	86.5	Confident	105 Å²	105	50.8 Å²	50.8	73%	0.734	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	151.5	172.3	54	0	0	0	0	111.2	Q475	S473-Q475 PolarHBondContact O-N 3.48Å
474	P	89.6	Confident	86.8	Confident	48 Å²	48	51.6 Å²	51.6	31%	0.312	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-50.3	128.3	168.7	-26	34.6	0	0	0	111.6	T456 L458	T456-P474 HydrophobicContact CG2-CB 3.71Å; L458-P474 HydrophobicContact CD2-CB 3.56Å; L458-P474 HydrophobicContact CD2-CG 3.64Å
475	Q	90.6	Very high	87.2	Confident	49 Å²	49	52.4 Å²	52.4	23%	0.229	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	119.1	-179.2	-176.8	-178.5	3	0	0	110.4	W24 T456 L457 S473 L477	W24-Q475 PolarHBondContact O-NE2 3.44Å; T456-Q475 CarbonylContact C-O 3.41Å; T456-Q475 WeakPolarHBondContact CA-O 3.4Å; L457-Q475 HydrophobicContact CB-CB 4.33Å; L457-Q475 PolarHBondContact N-O 2.71Å; L457-Q475 PolarHBondContact O-N 2.8Å; S473-Q475 PolarHBondContact O-N 3.48Å; Q475-L477 HydrophobicContact CG-CD2 4.5Å
476	V	91.8	Very high	87.6	Confident	89 Å²	89	49.1 Å²	49.1	54%	0.539	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	134.5	176.3	-177.1	0	0	0	0	110
477	L	92.5	Very high	87.6	Confident	6 Å²	6	43.2 Å²	43.2	3%	0.031	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-100.1	170.8	177.6	-50.8	-179.2	0	0	0	111.8	L446 V455 Q475 V524 Q536 L538	L446-L477 HydrophobicContact CD2-CD1 3.77Å; V455-L477 HydrophobicContact CB-CB 4.25Å; V455-L477 HydrophobicContact CB-CD1 4.31Å; V455-L477 HydrophobicContact CG1-CD1 3.8Å; V455-L477 HydrophobicContact CG1-CG 4.44Å; V455-L477 PolarHBondContact O-N 3.29Å; Q475-L477 HydrophobicContact CG-CD2 4.5Å; L477-V524 HydrophobicContact CD1-CG2 4.16Å; L477-Q536 VanDerWaalsContact CB-NE2 3.33Å; L477-L538 HydrophobicContact CD1-CD1 4.09Å; L477-L538 HydrophobicContact CD2-CD1 4.06Å; L477-L538 HydrophobicContact CD2-CD2 4Å
478	L	91.5	Very high	87.2	Confident	47 Å²	47	44.7 Å²	44.7	25%	0.246	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-72.2	144.4	-174.6	-59.6	168.6	0	0	0	112.1	P29 P31	P29-L478 WeakPolarHBondContact O-CD1 3.42Å; P31-L478 HydrophobicContact CG-CB 3.72Å
479	R	91.5	Very high	86.2	Confident	59 Å²	59	51 Å²	51	22%	0.223	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-97.3	136.6	175.5	-60	178	-69	-157.2	1.3	110.5	E454 R481 D482	E454-R479 HydrophobicContact CG-CG 4.29Å; E454-R479 IonicContact OE1-NH1 2.74Å; E454-R479 PolarHBondContact OE1-NH1 3.5Å; R479-R481 HydrophobicContact CB-CG 4.04Å; R479-R481 PolarHBondContact O-N 3.3Å; R479-D482 IonicContact CZ-OD1 3.54Å; R479-D482 IonicContact CZ-OD2 3.66Å; R479-D482 IonicContact NE-OD1 2.97Å; R479-D482 IonicContact NE-OD2 3.32Å; R479-D482 PolarHBondContact NE-OD2 3.02Å; R479-D482 IonicContact NH2-OD1 2.66Å; R479-D482 PolarHBondContact NH2-OD1 3.1Å; R479-D482 IonicContact NH2-OD2 2.98Å; R479-D482 PolarHBondContact NH2-OD2 3.4Å; R479-D482 PolarHBondContact O-N 2.57Å; R479-D482 VanDerWaalsContact O-N 3.13Å
480	P	88.6	Confident	85.5	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-55.9	-34.8	174.6	-27.7	35.6	0	0	0	113.3	D482 S483 L502 F534	P480-D482 VanDerWaalsContact C-N 3.3Å; P480-D482 PolarHBondContact O-N 3.21Å; P480-S483 WeakPolarHBondContact O-CB 3.42Å; P480-S483 PolarHBondContact O-N 3.35Å; P480-S483 PolarHBondContact O-OG 2.57Å; P480-L502 HydrophobicContact CB-CD2 4.36Å; P480-F534 HydrophobicContact CB-CD1 4.39Å; P480-F534 HydrophobicContact CB-CD2 3.85Å; P480-F534 HydrophobicContact CB-CE2 3.99Å; P480-F534 HydrophobicContact CB-CG 4.07Å; P480-F534 HydrophobicContact CB-CZ 4.33Å; P480-F534 HydrophobicContact CG-CB 4.23Å; P480-F534 HydrophobicContact CG-CD2 3.84Å; P480-F534 HydrophobicContact CG-CE2 4.44Å; P480-F534 HydrophobicContact CG-CG 4.01Å
481	R	88.1	Confident	84.9	Confident	74 Å²	74	56.6 Å²	56.6	28%	0.279	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-63.5	-29.4	178.7	71.1	-173.5	-177.6	-176.3	0.2	114.6	E426 S452 R479 S483	E426-R481 IonicContact OE2-NH2 2.75Å; E426-R481 PolarHBondContact OE2-NH2 2.78Å; S452-R481 PolarHBondContact O-NH1 3.47Å; S452-R481 PolarHBondContact O-NH2 2.94Å; R479-R481 HydrophobicContact CB-CG 4.04Å; R479-R481 PolarHBondContact O-N 3.3Å; R481-S483 VanDerWaalsContact C-N 3.28Å; R481-S483 PolarHBondContact O-N 2.9Å
482	D	88.8	Confident	84.5	Confident	71 Å²	71	59.9 Å²	59.9	38%	0.38	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-80.2	-14	-177.2	-61.7	-16	0	0	0	112.1	R479 P480 L484 A485	R479-D482 IonicContact CZ-OD1 3.54Å; R479-D482 IonicContact CZ-OD2 3.66Å; R479-D482 IonicContact NE-OD1 2.97Å; R479-D482 IonicContact NE-OD2 3.32Å; R479-D482 PolarHBondContact NE-OD2 3.02Å; R479-D482 IonicContact NH2-OD1 2.66Å; R479-D482 PolarHBondContact NH2-OD1 3.1Å; R479-D482 IonicContact NH2-OD2 2.98Å; R479-D482 PolarHBondContact NH2-OD2 3.4Å; R479-D482 PolarHBondContact O-N 2.57Å; R479-D482 VanDerWaalsContact O-N 3.13Å; P480-D482 VanDerWaalsContact C-N 3.3Å; P480-D482 PolarHBondContact O-N 3.21Å; D482-L484 PolarHBondContact O-N 3.41Å; D482-A485 PolarHBondContact O-N 3.44Å
483	S	87.3	Confident	84	Confident	2 Å²	2	63.2 Å²	63.2	1%	0.014	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-56	-33.3	-180	63.9	0	0	0	0	114.3	P480 R481 A485 L486 L487 W613	P480-S483 WeakPolarHBondContact O-CB 3.42Å; P480-S483 PolarHBondContact O-N 3.35Å; P480-S483 PolarHBondContact O-OG 2.57Å; R481-S483 VanDerWaalsContact C-N 3.28Å; R481-S483 PolarHBondContact O-N 2.9Å; S483-A485 PolarHBondContact O-N 2.86Å; S483-L486 PolarHBondContact O-N 3.19Å; S483-L486 VanDerWaalsContact O-N 3.16Å; S483-L487 WeakPolarHBondContact O-CG 3.33Å; S483-L487 PolarHBondContact O-N 3.16Å; S483-W613 VanDerWaalsContact CB-CZ2 3.43Å; S483-W613 WeakPolarHBondContact OG-CH2 3.35Å; S483-W613 WeakPolarHBondContact OG-CZ2 3.34Å
484	L	84.6	Confident	83.7	Confident	27 Å²	27	63.1 Å²	63.1	14%	0.141	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-64.1	-29.1	-173.3	-70.3	179.4	0	0	0	113.1	D482 L486 L487 A498 A499 L502	D482-L484 PolarHBondContact O-N 3.41Å; L484-L486 PolarHBondContact O-N 3.25Å; L484-L487 HydrophobicContact CD2-CD1 4.29Å; L484-L487 PolarHBondContact O-N 3.44Å; L484-A498 HydrophobicContact CD1-CB 4.37Å; L484-A498 HydrophobicContact CD2-CB 4Å; L484-A499 VanDerWaalsContact CD1-CA 3.42Å; L484-A499 HydrophobicContact CD1-CB 3.73Å; L484-L502 HydrophobicContact CD1-CD1 3.82Å; L484-L502 HydrophobicContact CD2-CD1 3.7Å; L484-L502 HydrophobicContact CG-CD1 3.5Å
485	A	83.9	Confident	83.3	Confident	93 Å²	93	65.2 Å²	65.2	77%	0.769	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-68.1	-27.3	179.7	0	0	0	0	0	112.5	D482 S483	D482-A485 PolarHBondContact O-N 3.44Å; S483-A485 PolarHBondContact O-N 2.86Å
486	L	82.8	Confident	82.9	Confident	81 Å²	81	69.6 Å²	69.6	42%	0.424	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-10.2	-177.2	-64.5	172.2	0	0	0	112.8	P29 V30 S483 L484 L605	P29-L486 HydrophobicContact CB-CD1 4.39Å; V30-L486 HydrophobicContact CG2-CB 3.88Å; V30-L486 HydrophobicContact CG2-CD1 3.47Å; V30-L486 VanDerWaalsContact CG2-CD1 3.47Å; V30-L486 HydrophobicContact CG2-CG 4.3Å; S483-L486 PolarHBondContact O-N 3.19Å; S483-L486 VanDerWaalsContact O-N 3.16Å; L484-L486 PolarHBondContact O-N 3.25Å; L486-L605 HydrophobicContact CB-CD1 4.27Å; L486-L605 WeakPolarHBondContact O-CD1 3.41Å
487	L	80.5	Confident	82.4	Confident	16 Å²	16	67 Å²	67	8%	0.084	36%	0.356	C	S	.	.	S	Bend	trans	-85.7	154.1	178.3	-70.2	171.4	0	0	0	111.4	S483 L484 V489 W613 L617	S483-L487 WeakPolarHBondContact O-CG 3.33Å; S483-L487 PolarHBondContact O-N 3.16Å; L484-L487 HydrophobicContact CD2-CD1 4.29Å; L484-L487 PolarHBondContact O-N 3.44Å; L487-V489 PolarHBondContact O-N 2.69Å; L487-W613 HydrophobicContact CD1-CB 4.23Å; L487-W613 HydrophobicContact CD1-CD2 3.58Å; L487-W613 HydrophobicContact CD1-CE3 3.49Å; L487-W613 VanDerWaalsContact CD1-CE3 3.49Å; L487-W613 HydrophobicContact CD1-CG 3.93Å; L487-W613 HydrophobicContact CD1-CZ3 4.04Å; L487-W613 HydrophobicContact CD2-CB 3.66Å; L487-W613 HydrophobicContact CD2-CD2 4.26Å; L487-W613 HydrophobicContact CD2-CG 3.72Å; L487-W613 HydrophobicContact CG-CG 4.45Å; L487-L617 HydrophobicContact CD1-CD1 4.23Å
488	P	73.7	Confident	82	Confident	91 Å²	91	66.8 Å²	66.8	59%	0.591	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-58.8	138.8	179.2	23.3	-33.6	0	0	0	111.7	Q490	P488-Q490 PolarHBondContact O-N 2.72Å
489	V	68.6	Low	81.8	Confident	143 Å²	143	66.5 Å²	66.5	87%	0.867	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-51	125.9	-177	-178.3	0	0	0	0	111	L487	L487-V489 PolarHBondContact O-N 2.69Å
490	Q	72.4	Confident	81.3	Confident	48 Å²	48	66 Å²	66	22%	0.224	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-103.3	169.3	175.6	-60.5	-156.4	-1.7	0	0	111.8	P488 R494 Q495	P488-Q490 PolarHBondContact O-N 2.72Å; Q490-R494 HydrophobicContact CB-CB 4.31Å; Q490-Q495 HydrophobicContact CB-CB 4.49Å
491	L	77.6	Confident	81.1	Confident	92 Å²	92	67.3 Å²	67.3	48%	0.482	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-59.7	139.9	168.2	-65.1	168	0	0	0	109.6	H493 R494 Q495	L491-H493 VanDerWaalsContact C-N 3.32Å; L491-H493 PolarHBondContact O-N 3.44Å; L491-H493 VanDerWaalsContact O-N 3.15Å; L491-R494 HydrophobicContact CB-CG 4.12Å; L491-R494 WeakPolarHBondContact O-CB 3.17Å; L491-R494 PolarHBondContact O-N 3.45Å; L491-Q495 PolarHBondContact O-N 3.02Å
492	P	79.1	Confident	81.1	Confident	91 Å²	91	63.8 Å²	63.8	59%	0.591	35%	0.351	S	S	*	.	H	α-helix	trans	-52.5	-42.1	-172.1	-30.5	34.9	0	0	0	115	R494 Q495 Q496	P492-R494 PolarHBondContact O-N 3.41Å; P492-Q495 PolarHBondContact O-N 3.2Å; P492-Q496 WeakPolarHBondContact O-CG 3.48Å; P492-Q496 PolarHBondContact O-N 3.23Å
493	H	74.8	Confident	81	Confident	96 Å²	96	63.5 Å²	63.5	44%	0.444	36%	0.359	S	S	.	.	H	α-helix	trans	-64.2	-38.4	177.6	60.9	-88.7	0	0	0	112.4	L491 Q496 T497	L491-H493 VanDerWaalsContact C-N 3.32Å; L491-H493 PolarHBondContact O-N 3.44Å; L491-H493 VanDerWaalsContact O-N 3.15Å; H493-Q496 PolarHBondContact O-N 3.35Å; H493-T497 PolarHBondContact O-N 2.89Å; H493-T497 PolarHBondContact O-OG1 2.95Å; H493-T497 VanDerWaalsContact O-OG1 3.11Å
494	R	78.9	Confident	81	Confident	103 Å²	103	63.8 Å²	63.8	39%	0.389	36%	0.361	S	S	.	.	H	α-helix	trans	-69.4	-38.4	177.5	-55.8	-166.9	171.4	178.8	-2.2	111.4	Q490 L491 P492 Q496 T497 A498 M621	Q490-R494 HydrophobicContact CB-CB 4.31Å; L491-R494 HydrophobicContact CB-CG 4.12Å; L491-R494 WeakPolarHBondContact O-CB 3.17Å; L491-R494 PolarHBondContact O-N 3.45Å; P492-R494 PolarHBondContact O-N 3.41Å; R494-Q496 VanDerWaalsContact C-N 3.34Å; R494-T497 PolarHBondContact O-N 3.27Å; R494-A498 WeakPolarHBondContact O-CB 3.47Å; R494-A498 PolarHBondContact O-N 3.37Å; R494-M621 HydrophobicContact CB-CE 4.18Å; R494-M621 HydrophobicContact CB-SD 3.77Å; R494-M621 HydrophobicContact CG-CE 3.55Å; R494-M621 HydrophobicContact CG-CG 4.43Å; R494-M621 HydrophobicContact CG-SD 3.75Å
495	Q	82.1	Confident	81.3	Confident	91 Å²	91	64.7 Å²	64.7	43%	0.425	37%	0.368	S	S	.	.	H	α-helix	trans	-64	-41.5	174.8	-171.6	174.7	1.8	0	0	111	Q490 L491 P492 A498 A499	Q490-Q495 HydrophobicContact CB-CB 4.49Å; L491-Q495 PolarHBondContact O-N 3.02Å; P492-Q495 PolarHBondContact O-N 3.2Å; Q495-A498 PolarHBondContact O-N 3.14Å; Q495-A499 WeakPolarHBondContact O-CB 3.07Å; Q495-A499 PolarHBondContact O-N 3.39Å
496	Q	80.7	Confident	81.6	Confident	141 Å²	141	60.3 Å²	60.3	66%	0.659	33%	0.332	S	S	*	.	H	α-helix	trans	-63.1	-46.5	174.2	-74.4	175	-9.7	0	0	112.1	P492 H493 R494 A498 A499 H500	P492-Q496 WeakPolarHBondContact O-CG 3.48Å; P492-Q496 PolarHBondContact O-N 3.23Å; H493-Q496 PolarHBondContact O-N 3.35Å; R494-Q496 VanDerWaalsContact C-N 3.34Å; Q496-A498 PolarHBondContact O-N 3.13Å; Q496-A499 PolarHBondContact O-N 3.48Å; Q496-H500 VanDerWaalsContact O-CB 3.31Å; Q496-H500 WeakPolarHBondContact O-CB 3.26Å; Q496-H500 PolarHBondContact O-N 3.35Å
497	T	82.3	Confident	82.1	Confident	35 Å²	35	57.1 Å²	57.1	22%	0.215	32%	0.317	C	S	.	.	H	α-helix	trans	-59.9	-45.1	176.1	-57.2	0	0	0	0	111.6	H493 R494 H500 R501 L620 E624	H493-T497 PolarHBondContact O-N 2.89Å; H493-T497 PolarHBondContact O-OG1 2.95Å; H493-T497 VanDerWaalsContact O-OG1 3.11Å; R494-T497 PolarHBondContact O-N 3.27Å; T497-H500 PolarHBondContact O-N 3.26Å; T497-R501 WeakPolarHBondContact O-CB 3.26Å; T497-R501 PolarHBondContact O-N 3.18Å; T497-L620 HydrophobicContact CG2-CD2 4.39Å; T497-E624 PolarHBondContact OG1-OE1 2.87Å
498	A	84.1	Confident	82.6	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.008	31%	0.313	C	S	.	.	H	α-helix	trans	-66	-42.3	178.1	0	0	0	0	0	112.1	L484 R494 Q495 Q496 H500 R501 L502 L617 L620	L484-A498 HydrophobicContact CD1-CB 4.37Å; L484-A498 HydrophobicContact CD2-CB 4Å; R494-A498 WeakPolarHBondContact O-CB 3.47Å; R494-A498 PolarHBondContact O-N 3.37Å; Q495-A498 PolarHBondContact O-N 3.14Å; Q496-A498 PolarHBondContact O-N 3.13Å; A498-H500 VanDerWaalsContact C-N 3.35Å; A498-R501 PolarHBondContact O-N 2.97Å; A498-L502 WeakPolarHBondContact O-CB 3.33Å; A498-L502 WeakPolarHBondContact O-CG 3Å; A498-L502 PolarHBondContact O-N 2.94Å; A498-L617 HydrophobicContact CB-CD2 3.93Å; A498-L620 HydrophobicContact CB-CD2 4.24Å
499	A	86.3	Confident	83.6	Confident	41 Å²	41	52.4 Å²	52.4	34%	0.339	29%	0.287	S	S	.	.	H	α-helix	trans	-61.6	-44.6	176.6	0	0	0	0	0	111.1	L484 Q495 Q496 R501 L502 A503	L484-A499 VanDerWaalsContact CD1-CA 3.42Å; L484-A499 HydrophobicContact CD1-CB 3.73Å; Q495-A499 WeakPolarHBondContact O-CB 3.07Å; Q495-A499 PolarHBondContact O-N 3.39Å; Q496-A499 PolarHBondContact O-N 3.48Å; A499-R501 VanDerWaalsContact C-N 3.35Å; A499-R501 PolarHBondContact O-N 3.18Å; A499-L502 PolarHBondContact O-N 3.49Å; A499-A503 VanDerWaalsContact O-CB 3.29Å; A499-A503 WeakPolarHBondContact O-CB 3.35Å; A499-A503 PolarHBondContact O-N 2.82Å
500	H	81.9	Confident	84.8	Confident	50 Å²	50	45.7 Å²	45.7	23%	0.231	25%	0.246	C	C	.	.	H	α-helix	trans	-60.7	-43.8	175.5	-172.2	-51.7	0	0	0	112.1	F47 Q48 V51 Q496 T497 A498 A503	F47-H500 VanDerWaalsContact C-NE2 3.35Å; F47-H500 PolarHBondContact O-CE1 2.95Å; F47-H500 PolarHBondContact O-NE2 3.14Å; Q48-H500 WeakPolarHBondContact CA-NE2 3.45Å; V51-H500 VanDerWaalsContact CG2-CD2 3.41Å; V51-H500 WeakPolarHBondContact CG2-CD2 3.37Å; V51-H500 WeakPolarHBondContact CG2-NE2 3.31Å; Q496-H500 VanDerWaalsContact O-CB 3.31Å; Q496-H500 WeakPolarHBondContact O-CB 3.26Å; Q496-H500 PolarHBondContact O-N 3.35Å; T497-H500 PolarHBondContact O-N 3.26Å; A498-H500 VanDerWaalsContact C-N 3.35Å; H500-A503 PolarHBondContact O-N 3.15Å
501	R	85.3	Confident	85.6	Confident	26 Å²	26	43.6 Å²	43.6	10%	0.098	24%	0.237	C	C	.	.	H	α-helix	trans	-64	-43.4	179	-178	63.4	177	-175.2	0.7	111.4	T497 A498 A499 A503 S504 A530 D532 W616 L620	T497-R501 WeakPolarHBondContact O-CB 3.26Å; T497-R501 PolarHBondContact O-N 3.18Å; A498-R501 PolarHBondContact O-N 2.97Å; A499-R501 VanDerWaalsContact C-N 3.35Å; A499-R501 PolarHBondContact O-N 3.18Å; R501-A503 VanDerWaalsContact C-N 3.34Å; R501-S504 WeakPolarHBondContact O-CB 3.38Å; R501-S504 PolarHBondContact O-N 3.3Å; R501-S504 PolarHBondContact O-OG 2.79Å; R501-A530 PolarHBondContact NH1-O 3.01Å; R501-A530 PolarHBondContact NH2-O 3.25Å; R501-D532 IonicContact CZ-OD1 2.67Å; R501-D532 IonicContact CZ-OD2 3.69Å; R501-D532 IonicContact NE-OD1 3.22Å; R501-D532 IonicContact NE-OD2 3.46Å; R501-D532 PolarHBondContact NE-OD2 3.33Å; R501-D532 VanDerWaalsContact NH2-CG 3.32Å; R501-D532 IonicContact NH2-OD1 3.77Å; R501-D532 PolarHBondContact NH2-OD1 3.01Å; R501-D532 IonicContact NH2-OD2 2.79Å; R501-D532 PolarHBondContact NH2-OD2 2.89Å; R501-D532 VanDerWaalsContact NH2-OD2 3.12Å; R501-W616 HydrophobicContact CB-CH2 4.33Å; R501-W616 HydrophobicContact CG-CH2 3.9Å; R501-W616 HydrophobicContact CG-CZ2 3.96Å; R501-L620 HydrophobicContact CG-CD1 4.23Å
502	L	87.3	Confident	86.1	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-74.7	-21	178.9	-68.8	171.2	0	0	0	113.4	Q453 P480 L484 A498 A499 S504 F534 W613 W616	Q453-L502 PolarHBondContact NE2-O 2.99Å; Q453-L502 PolarHBondContact OE1-O 3.08Å; P480-L502 HydrophobicContact CB-CD2 4.36Å; L484-L502 HydrophobicContact CD1-CD1 3.82Å; L484-L502 HydrophobicContact CD2-CD1 3.7Å; L484-L502 HydrophobicContact CG-CD1 3.5Å; A498-L502 WeakPolarHBondContact O-CB 3.33Å; A498-L502 WeakPolarHBondContact O-CG 3Å; A498-L502 PolarHBondContact O-N 2.94Å; A499-L502 PolarHBondContact O-N 3.49Å; L502-S504 PolarHBondContact O-N 2.89Å; L502-F534 HydrophobicContact CD2-CE1 4.14Å; L502-F534 HydrophobicContact CD2-CE2 4.09Å; L502-F534 HydrophobicContact CD2-CZ 3.44Å; L502-F534 VanDerWaalsContact CD2-CZ 3.44Å; L502-W613 HydrophobicContact CD1-CH2 4.1Å; L502-W613 HydrophobicContact CD1-CZ3 4.18Å; L502-W613 HydrophobicContact CD2-CH2 4.05Å; L502-W613 HydrophobicContact CD2-CZ3 4.44Å; L502-W616 HydrophobicContact CD2-CH2 4.16Å; L502-W616 HydrophobicContact CD2-CZ2 4.42Å; L502-W616 HydrophobicContact CG-CH2 4.17Å
503	A	87.1	Confident	86.1	Confident	65 Å²	65	38.1 Å²	38.1	54%	0.537	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-8.3	173.4	0	0	0	0	0	113.4	A499 H500 R501	A499-A503 VanDerWaalsContact O-CB 3.29Å; A499-A503 WeakPolarHBondContact O-CB 3.35Å; A499-A503 PolarHBondContact O-N 2.82Å; H500-A503 PolarHBondContact O-N 3.15Å; R501-A503 VanDerWaalsContact C-N 3.34Å
504	S	87.8	Confident	86.1	Confident	7 Å²	7	36.6 Å²	36.6	5%	0.049	19%	0.192	C	C	.	.	S	Bend	trans	-57.4	137.7	175.6	57.4	0	0	0	0	111.7	Q453 R501 L502 A530	Q453-S504 PolarHBondContact NE2-O 3.15Å; R501-S504 WeakPolarHBondContact O-CB 3.38Å; R501-S504 PolarHBondContact O-N 3.3Å; R501-S504 PolarHBondContact O-OG 2.79Å; L502-S504 PolarHBondContact O-N 2.89Å; S504-A530 WeakPolarHBondContact OG-CB 3.28Å
505	P	89.8	Confident	85.5	Confident	47 Å²	47	34.8 Å²	34.8	31%	0.305	19%	0.192	S	C	.	.	P	Polyproline II helix	trans	-62.5	154.2	-176.1	24.2	-32.7	0	0	0	111.5	Q450 A529	Q450-P505 HydrophobicContact CG-CB 3.84Å; Q450-P505 CarbonylContact O-C 3.6Å; Q450-P505 WeakPolarHBondContact O-CA 3.4Å; Q450-P505 WeakPolarHBondContact O-CB 3.49Å; P505-A529 HydrophobicContact CG-CB 3.88Å; P505-A529 VanDerWaalsContact O-CB 3.31Å; P505-A529 WeakPolarHBondContact O-CB 3.45Å; P505-A529 PolarHBondContact O-N 2.88Å
506	A	91.5	Very high	84.6	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	143.3	173.1	0	0	0	0	0	110.7	F431 Q450 Q453 Q526 L527	F431-A506 HydrophobicContact CE2-CB 3.88Å; F431-A506 WeakPolarHBondContact CZ-O 3.26Å; Q450-A506 WeakPolarHBondContact CG-O 3.44Å; Q450-A506 PolarHBondContact O-N 2.75Å; Q453-A506 HydrophobicContact CG-CB 4.21Å; A506-Q526 HydrophobicContact CB-CG 4.4Å; A506-L527 CarbonylContact C-O 3.55Å; A506-L527 WeakPolarHBondContact CA-O 3.42Å
507	A	91.5	Very high	83.5	Confident	14 Å²	14	34.1 Å²	34.1	12%	0.116	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	-9.8	-179.7	0	0	0	0	0	113.1	G183 A184 M205 L527 A529	G183-A507 WeakPolarHBondContact CA-O 3.26Å; A184-A507 PolarHBondContact N-O 3.06Å; M205-A507 HydrophobicContact CE-CB 4.42Å; A507-L527 HydrophobicContact CB-CD2 4.12Å; A507-L527 HydrophobicContact CB-CG 4.2Å; A507-L527 PolarHBondContact N-O 2.89Å; A507-A529 HydrophobicContact CB-CB 4.43Å
508	G	92.8	Very high	82.3	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.6	160.6	175.5	0	0	0	0	0	113.4	L527	G508-L527 PolarHBondContact N-O 3.11Å; G508-L527 PolarHBondContact O-N 3.3Å
509	L	94.6	Very high	81.5	Confident	9 Å²	9	39.6 Å²	39.6	5%	0.047	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	133.9	-179.1	-177.2	73.8	0	0	0	108.8	F431 L446 V455 V524 L525	F431-L509 HydrophobicContact CB-CB 3.82Å; F431-L509 HydrophobicContact CG-CB 4.41Å; L446-L509 HydrophobicContact CB-CD2 4.05Å; V455-L509 HydrophobicContact CG1-CD1 4.03Å; V455-L509 HydrophobicContact CG1-CD2 4Å; V455-L509 HydrophobicContact CG2-CD1 3.79Å; L509-V524 HydrophobicContact CD1-CG1 3.68Å; L509-L525 WeakPolarHBondContact CA-O 3.17Å
510	T	93	Very high	81	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.006	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	161.3	170.4	-162.1	0	0	0	0	110.1	L185 F187 L197 L525	L185-T510 HydrophobicContact CD2-CG2 3.77Å; L185-T510 HydrophobicContact CG-CG2 3.75Å; F187-T510 HydrophobicContact CB-CG2 4.22Å; F187-T510 PolarHBondContact N-OG1 3.21Å; L197-T510 HydrophobicContact CD1-CG2 4.19Å; T510-L525 HydrophobicContact CG2-CB 3.96Å; T510-L525 HydrophobicContact CG2-CD1 4.17Å; T510-L525 PolarHBondContact N-O 3.03Å; T510-L525 PolarHBondContact O-N 2.8Å
511	C	90.1	Very high	81.1	Confident	5 Å²	5	36 Å²	36	3%	0.034	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	154	-177.7	158	0	0	0	0	111.3	H433 L446 M522 I523 V524	H433-C511 HydrophobicContact CB-CB 4.46Å; H433-C511 VanDerWaalsContact CD2-CB 3.45Å; H433-C511 WeakPolarHBondContact CD2-CB 3.15Å; H433-C511 PolarHBondContact NE2-O 2.85Å; H433-C511 VanDerWaalsContact NE2-O 3.11Å; L446-C511 HydrophobicContact CD1-CB 3.31Å; L446-C511 VanDerWaalsContact CD1-SG 3.59Å; C511-M522 WeakPolarHBondContact SG-CG 3.23Å; C511-I523 CarbonylContact C-O 3.53Å; C511-I523 VanDerWaalsContact CA-O 3.31Å; C511-I523 WeakPolarHBondContact CA-O 3.44Å; C511-V524 HydrophobicContact CB-CG2 4.41Å
512	L	86.7	Confident	81.2	Confident	18 Å²	18	34.8 Å²	34.8	9%	0.094	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	131.8	-179.3	-64.8	158.8	0	0	0	107.6	F187 M223 M522 I523 L525	F187-L512 HydrophobicContact CB-CD2 4.16Å; F187-L512 HydrophobicContact CD1-CD2 3.04Å; F187-L512 HydrophobicContact CD1-CG 4.29Å; F187-L512 HydrophobicContact CD2-CD1 4.46Å; F187-L512 HydrophobicContact CD2-CD2 3.68Å; F187-L512 HydrophobicContact CE1-CD2 3.02Å; F187-L512 HydrophobicContact CE1-CG 4.47Å; F187-L512 HydrophobicContact CE2-CD2 3.67Å; F187-L512 HydrophobicContact CG-CD2 3.34Å; F187-L512 HydrophobicContact CG-CG 4.27Å; F187-L512 HydrophobicContact CZ-CD2 3.33Å; M223-L512 HydrophobicContact CE-CD1 3.03Å; M223-L512 HydrophobicContact CE-CG 4.5Å; L512-M522 CarbonylContact O-C 3.55Å; L512-M522 VanDerWaalsContact O-CA 3.26Å; L512-M522 WeakPolarHBondContact O-CA 3.34Å; L512-I523 HydrophobicContact CB-CB 4.16Å; L512-I523 HydrophobicContact CD1-CB 4.26Å; L512-I523 HydrophobicContact CD1-CG2 4.49Å; L512-I523 PolarHBondContact N-O 2.69Å; L512-I523 PolarHBondContact O-N 2.72Å; L512-L525 HydrophobicContact CD1-CD1 3.56Å; L512-L525 HydrophobicContact CG-CD1 4.27Å
513	Q	79.3	Confident	81.3	Confident	49 Å²	49	34.8 Å²	34.8	23%	0.229	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	127.7	173	-168.9	173.3	-44.8	0	0	109.1	A435 P436 T515	A435-Q513 HydrophobicContact CB-CB 4.33Å; A435-Q513 VanDerWaalsContact CB-OE1 3.23Å; P436-Q513 PolarHBondContact O-NE2 2.87Å; P436-Q513 PolarHBondContact O-OE1 2.85Å; P436-Q513 VanDerWaalsContact O-OE1 3.11Å; Q513-T515 HydrophobicContact CG-CG2 4.49Å
514	R	75.1	Confident	81.6	Confident	65 Å²	65	31.8 Å²	31.8	25%	0.245	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	127	172.5	172.8	176.8	176.4	177.5	-6.4	108.5	L215 E216 T521	L215-R514 HydrophobicContact CD2-CB 4.37Å; E216-R514 PolarHBondContact O-NH1 2.79Å; R514-T521 PolarHBondContact N-O 2.81Å; R514-T521 PolarHBondContact O-N 3.08Å; R514-T521 VanDerWaalsContact O-O 3.11Å
515	T	66.2	Low	81.8	Confident	65 Å²	65	31.5 Å²	31.5	40%	0.399	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	110.1	176.3	44.7	0	0	0	0	108.4	S438 Q513 A520	S438-T515 WeakPolarHBondContact OG-CG2 3.17Å; Q513-T515 HydrophobicContact CG-CG2 4.49Å; T515-A520 HydrophobicContact CG2-CB 4.48Å
516	S	62.5	Low	82	Confident	61 Å²	61	29.8 Å²	29.8	43%	0.427	18%	0.177	S	C	.	.			trans	-90.8	166.8	166.9	-178.1	0	0	0	0	109.6	S518 T519	S516-S518 PolarHBondContact O-N 3.23Å; S516-S518 VanDerWaalsContact O-N 3.12Å; S516-T519 WeakPolarHBondContact CB-O 3.31Å; S516-T519 PolarHBondContact N-O 2.96Å
517	V	58.2	Low	82.1	Confident	156 Å²	156	29.8 Å²	29.8	95%	0.945	18%	0.177	S	C	*	.	S	Bend	trans	-56.5	-26.9	177.2	-178	0	0	0	0	112.1
518	S	56.8	Low	82.1	Confident	86 Å²	86	29.1 Å²	29.1	60%	0.601	17%	0.172	S	C	*	.	S	Bend	trans	-125.3	-12.1	-174.6	61.7	0	0	0	0	115.9	S516	S516-S518 PolarHBondContact O-N 3.23Å; S516-S518 VanDerWaalsContact O-N 3.12Å
519	T	67.8	Low	81.8	Confident	66 Å²	66	30.8 Å²	30.8	41%	0.405	19%	0.185	S	C	.	.			trans	-146.1	136.4	-176.8	52	0	0	0	0	111	S516	S516-T519 WeakPolarHBondContact CB-O 3.31Å; S516-T519 PolarHBondContact N-O 2.96Å
520	A	76.9	Confident	81.3	Confident	2 Å²	2	31 Å²	31	2%	0.017	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	122.2	171.7	0	0	0	0	0	109	W24 T515 R540	W24-A520 HydrophobicContact CH2-CB 3.78Å; W24-A520 WeakPolarHBondContact CZ3-O 3.39Å; T515-A520 HydrophobicContact CG2-CB 4.48Å; A520-R540 HydrophobicContact CB-CB 4.1Å; A520-R540 PolarHBondContact O-N 2.88Å
521	T	83.6	Confident	81	Confident	13 Å²	13	31.1 Å²	31.1	8%	0.08	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	135	-178.5	62.3	0	0	0	0	109.9	R514 L538 E539	R514-T521 PolarHBondContact N-O 2.81Å; R514-T521 PolarHBondContact O-N 3.08Å; R514-T521 VanDerWaalsContact O-O 3.11Å; T521-L538 CarbonylContact C-O 3.59Å; T521-L538 VanDerWaalsContact CA-O 3.32Å; T521-L538 WeakPolarHBondContact CA-O 3.41Å; T521-E539 HydrophobicContact CG2-CG 4.01Å
522	M	87.1	Confident	80.9	Confident	0 Å²	0	31 Å²	31	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	131.1	178.1	174.2	178.2	-72	0	0	109.8	W24 A435 K444 L446 C511 L512 V524 L538	W24-M522 HydrophobicContact CE3-CB 4.11Å; W24-M522 HydrophobicContact CZ3-CB 3.8Å; A435-M522 HydrophobicContact CB-CE 3.56Å; K444-M522 HydrophobicContact CB-CE 4Å; K444-M522 HydrophobicContact CD-CE 3.33Å; K444-M522 HydrophobicContact CG-CE 4.26Å; L446-M522 HydrophobicContact CD1-SD 4.14Å; C511-M522 WeakPolarHBondContact SG-CG 3.23Å; L512-M522 CarbonylContact O-C 3.55Å; L512-M522 VanDerWaalsContact O-CA 3.26Å; L512-M522 WeakPolarHBondContact O-CA 3.34Å; M522-V524 HydrophobicContact CG-CG2 4.1Å; M522-V524 HydrophobicContact SD-CG2 4.22Å; M522-L538 HydrophobicContact CB-CB 4.2Å; M522-L538 HydrophobicContact CG-CD1 4.32Å; M522-L538 PolarHBondContact N-O 3.48Å; M522-L538 PolarHBondContact O-N 3.16Å; M522-L538 HydrophobicContact SD-CD1 4.11Å
523	I	89.3	Confident	81.1	Confident	2 Å²	2	30.2 Å²	30.2	1%	0.01	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	118.7	175.8	-52.2	175.9	0	0	0	108	L215 A221 C511 L512 L525 Y535 Q536 I537	L215-I523 HydrophobicContact CD1-CD1 3.8Å; L215-I523 HydrophobicContact CD2-CD1 3.73Å; L215-I523 HydrophobicContact CG-CD1 3.99Å; A221-I523 HydrophobicContact CB-CD1 4.17Å; C511-I523 CarbonylContact C-O 3.53Å; C511-I523 VanDerWaalsContact CA-O 3.31Å; C511-I523 WeakPolarHBondContact CA-O 3.44Å; L512-I523 HydrophobicContact CB-CB 4.16Å; L512-I523 HydrophobicContact CD1-CB 4.26Å; L512-I523 HydrophobicContact CD1-CG2 4.49Å; L512-I523 PolarHBondContact N-O 2.69Å; L512-I523 PolarHBondContact O-N 2.72Å; I523-L525 HydrophobicContact CG2-CD1 4.06Å; I523-Y535 HydrophobicContact CG2-CD2 4.32Å; I523-Q536 CarbonylContact C-O 3.59Å; I523-Q536 WeakPolarHBondContact CA-O 3.33Å; I523-I537 HydrophobicContact CG1-CG1 4.21Å
524	V	92.6	Very high	81.7	Confident	2 Å²	2	28 Å²	28	1%	0.012	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	127.6	177.7	-177.6	0	0	0	0	108.2	L446 V455 L477 L509 C511 M522 Y535 Q536 L538	L446-V524 HydrophobicContact CD1-CG1 4.3Å; L446-V524 HydrophobicContact CD1-CG2 3.75Å; L446-V524 HydrophobicContact CD2-CG2 4.36Å; V455-V524 HydrophobicContact CG1-CG1 4.48Å; L477-V524 HydrophobicContact CD1-CG2 4.16Å; L509-V524 HydrophobicContact CD1-CG1 3.68Å; C511-V524 HydrophobicContact CB-CG2 4.41Å; M522-V524 HydrophobicContact CG-CG2 4.1Å; M522-V524 HydrophobicContact SD-CG2 4.22Å; V524-Y535 CarbonylContact O-C 3.39Å; V524-Y535 VanDerWaalsContact O-CA 3.27Å; V524-Y535 WeakPolarHBondContact O-CA 3.43Å; V524-Q536 HydrophobicContact CB-CG 3.79Å; V524-Q536 PolarHBondContact N-O 2.9Å; V524-Q536 PolarHBondContact O-N 2.77Å; V524-L538 HydrophobicContact CG2-CD1 3.94Å
525	L	93.5	Very high	82.5	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	136.8	176.4	-63.7	97	0	0	0	110.7	L34 L185 L197 M223 L509 T510 L512 I523 V533 F534	L34-L525 HydrophobicContact CD2-CD2 3.96Å; L185-L525 HydrophobicContact CD2-CB 4Å; L185-L525 WeakPolarHBondContact CD2-O 3.29Å; L197-L525 HydrophobicContact CD1-CD2 4.16Å; L197-L525 HydrophobicContact CD2-CD2 4.09Å; M223-L525 HydrophobicContact CE-CD1 4.35Å; M223-L525 HydrophobicContact SD-CD2 4.01Å; L509-L525 WeakPolarHBondContact CA-O 3.17Å; T510-L525 HydrophobicContact CG2-CB 3.96Å; T510-L525 HydrophobicContact CG2-CD1 4.17Å; T510-L525 PolarHBondContact N-O 3.03Å; T510-L525 PolarHBondContact O-N 2.8Å; L512-L525 HydrophobicContact CD1-CD1 3.56Å; L512-L525 HydrophobicContact CG-CD1 4.27Å; I523-L525 HydrophobicContact CG2-CD1 4.06Å; L525-V533 HydrophobicContact CD2-CG1 4.06Å; L525-F534 CarbonylContact C-O 3.52Å; L525-F534 VanDerWaalsContact CA-O 3.27Å; L525-F534 WeakPolarHBondContact CA-O 3.4Å
526	Q	93.9	Very high	83.7	Confident	11 Å²	11	24.1 Å²	24.1	5%	0.051	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	132.6	178.3	-171	176.3	17.3	0	0	109.9	Q453 A506 V533 F534	Q453-Q526 PolarHBondContact O-NE2 3.32Å; A506-Q526 HydrophobicContact CB-CG 4.4Å; Q526-V533 WeakPolarHBondContact O-CA 3.22Å; Q526-F534 PolarHBondContact N-O 3.16Å; Q526-F534 PolarHBondContact O-N 2.91Å
527	L	93.4	Very high	85	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	133.5	175.5	173.8	71.4	0	0	0	109.1	A184 L185 P200 M205 A506 A507 G508 D532 V533	A184-L527 HydrophobicContact CB-CD2 4.24Å; L185-L527 HydrophobicContact CB-CB 4.05Å; L185-L527 HydrophobicContact CB-CD2 4.27Å; L185-L527 HydrophobicContact CD1-CB 4.33Å; L185-L527 HydrophobicContact CD2-CB 3.97Å; L185-L527 HydrophobicContact CG-CB 4.35Å; P200-L527 HydrophobicContact CG-CD2 3.73Å; M205-L527 HydrophobicContact CE-CD1 4.4Å; M205-L527 HydrophobicContact CE-CD2 4.01Å; M205-L527 HydrophobicContact CE-CG 4.35Å; A506-L527 CarbonylContact C-O 3.55Å; A506-L527 WeakPolarHBondContact CA-O 3.42Å; A507-L527 HydrophobicContact CB-CD2 4.12Å; A507-L527 HydrophobicContact CB-CG 4.2Å; A507-L527 PolarHBondContact N-O 2.89Å; G508-L527 PolarHBondContact N-O 3.11Å; G508-L527 PolarHBondContact O-N 3.3Å; L527-D532 WeakPolarHBondContact CA-O 3.12Å; L527-V533 HydrophobicContact CD1-CG2 3.68Å
528	T	91	Very high	86.5	Confident	0 Å²	0	15.1 Å²	15.1	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	155.4	169.9	67.8	0	0	0	0	111.2	A530 G531 D532 F534	T528-A530 PolarHBondContact O-N 3.35Å; T528-A530 VanDerWaalsContact O-N 3.14Å; T528-G531 WeakPolarHBondContact O-CA 3.24Å; T528-G531 PolarHBondContact O-N 2.82Å; T528-D532 PolarHBondContact N-O 2.98Å; T528-D532 PolarHBondContact OG1-N 2.84Å; T528-D532 VanDerWaalsContact OG1-N 3.14Å; T528-D532 PolarHBondContact OG1-O 2.87Å; T528-F534 HydrophobicContact CG2-CD2 4.14Å; T528-F534 HydrophobicContact CG2-CE2 3.82Å
529	A	87.3	Confident	87.9	Confident	35 Å²	35	14.2 Å²	14.2	29%	0.289	8%	0.082	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-21	173.8	0	0	0	0	0	112.5	P505 A507 G531	P505-A529 HydrophobicContact CG-CB 3.88Å; P505-A529 VanDerWaalsContact O-CB 3.31Å; P505-A529 WeakPolarHBondContact O-CB 3.45Å; P505-A529 PolarHBondContact O-N 2.88Å; A507-A529 HydrophobicContact CB-CB 4.43Å; A529-G531 PolarHBondContact O-N 2.79Å
530	A	83.9	Confident	88.7	Confident	13 Å²	13	13.8 Å²	13.8	11%	0.107	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-16	172.2	0	0	0	0	0	113.1	R501 S504 T528	R501-A530 PolarHBondContact NH1-O 3.01Å; R501-A530 PolarHBondContact NH2-O 3.25Å; S504-A530 WeakPolarHBondContact OG-CB 3.28Å; T528-A530 PolarHBondContact O-N 3.35Å; T528-A530 VanDerWaalsContact O-N 3.14Å
531	G	85.8	Confident	88.8	Confident	5 Å²	5	16.6 Å²	16.6	5%	0.052	9%	0.087	C	C	.	.	S	Bend	trans	90.4	17.2	-178.2	0	0	0	0	0	114.4	T528 A529	T528-G531 WeakPolarHBondContact O-CA 3.24Å; T528-G531 PolarHBondContact O-N 2.82Å; A529-G531 PolarHBondContact O-N 2.79Å
532	D	88.8	Confident	87.8	Confident	3 Å²	3	19.7 Å²	19.7	2%	0.016	10%	0.103	C	C	.	.			trans	-92.2	138.6	174.9	-55.8	-40.8	0	0	0	109.7	P37 R501 L527 T528 F534	P37-D532 WeakPolarHBondContact CA-OD1 3.19Å; R501-D532 IonicContact CZ-OD1 2.67Å; R501-D532 IonicContact CZ-OD2 3.69Å; R501-D532 IonicContact NE-OD1 3.22Å; R501-D532 IonicContact NE-OD2 3.46Å; R501-D532 PolarHBondContact NE-OD2 3.33Å; R501-D532 VanDerWaalsContact NH2-CG 3.32Å; R501-D532 IonicContact NH2-OD1 3.77Å; R501-D532 PolarHBondContact NH2-OD1 3.01Å; R501-D532 IonicContact NH2-OD2 2.79Å; R501-D532 PolarHBondContact NH2-OD2 2.89Å; R501-D532 VanDerWaalsContact NH2-OD2 3.12Å; L527-D532 WeakPolarHBondContact CA-O 3.12Å; T528-D532 PolarHBondContact N-O 2.98Å; T528-D532 PolarHBondContact OG1-N 2.84Å; T528-D532 VanDerWaalsContact OG1-N 3.14Å; T528-D532 PolarHBondContact OG1-O 2.87Å; D532-F534 HydrophobicContact CB-CE2 3.79Å; D532-F534 HydrophobicContact CB-CZ 4.14Å
533	V	91.1	Very high	86	Confident	1 Å²	1	22.2 Å²	22.2	1%	0.006	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	122.7	179.3	-178.9	0	0	0	0	109.2	L34 L35 L525 Q526 L527	L34-V533 HydrophobicContact CB-CB 4.43Å; L34-V533 HydrophobicContact CB-CG1 4.27Å; L34-V533 HydrophobicContact CD2-CG1 4.11Å; L34-V533 PolarHBondContact N-O 3.4Å; L35-V533 HydrophobicContact CD1-CB 4.4Å; L35-V533 HydrophobicContact CD1-CG2 4.13Å; L525-V533 HydrophobicContact CD2-CG1 4.06Å; Q526-V533 WeakPolarHBondContact O-CA 3.22Å; L527-V533 HydrophobicContact CD1-CG2 3.68Å
534	F	91.9	Very high	83.5	Confident	3 Å²	3	31.1 Å²	31.1	1%	0.013	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	147.3	175.3	-61.3	-85.4	0	0	0	109.8	P31 V32 P33 P480 L502 L525 Q526 T528 D532 W613	P31-F534 HydrophobicContact CB-CB 4.11Å; V32-F534 CarbonylContact O-C 3.38Å; V32-F534 WeakPolarHBondContact O-CA 3.47Å; P33-F534 HydrophobicContact CB-CD1 4.09Å; P33-F534 HydrophobicContact CB-CE1 3.9Å; P480-F534 HydrophobicContact CB-CD1 4.39Å; P480-F534 HydrophobicContact CB-CD2 3.85Å; P480-F534 HydrophobicContact CB-CE2 3.99Å; P480-F534 HydrophobicContact CB-CG 4.07Å; P480-F534 HydrophobicContact CB-CZ 4.33Å; P480-F534 HydrophobicContact CG-CB 4.23Å; P480-F534 HydrophobicContact CG-CD2 3.84Å; P480-F534 HydrophobicContact CG-CE2 4.44Å; P480-F534 HydrophobicContact CG-CG 4.01Å; L502-F534 HydrophobicContact CD2-CE1 4.14Å; L502-F534 HydrophobicContact CD2-CE2 4.09Å; L502-F534 HydrophobicContact CD2-CZ 3.44Å; L502-F534 VanDerWaalsContact CD2-CZ 3.44Å; L525-F534 CarbonylContact C-O 3.52Å; L525-F534 VanDerWaalsContact CA-O 3.27Å; L525-F534 WeakPolarHBondContact CA-O 3.4Å; Q526-F534 PolarHBondContact N-O 3.16Å; Q526-F534 PolarHBondContact O-N 2.91Å; T528-F534 HydrophobicContact CG2-CD2 4.14Å; T528-F534 HydrophobicContact CG2-CE2 3.82Å; D532-F534 HydrophobicContact CB-CE2 3.79Å; D532-F534 HydrophobicContact CB-CZ 4.14Å; F534-W613 HydrophobicContact CD1-CH2 4.4Å; F534-W613 HydrophobicContact CD1-CZ2 4.28Å; F534-W613 AromaticContact CE1-CH2 3.61Å; F534-W613 HydrophobicContact CE1-CH2 3.61Å; F534-W613 AromaticContact CE1-CZ2 3.91Å; F534-W613 HydrophobicContact CE1-CZ2 3.91Å; F534-W613 HydrophobicContact CE1-CZ3 4.36Å; F534-W613 HydrophobicContact CZ-CH2 4.35Å
535	Y	91.4	Very high	80.7	Confident	32 Å²	32	36.7 Å²	36.7	13%	0.125	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	151.4	173.3	73.3	-82.3	0	0	0	111.1	V32 L34 I523 V524 I537	V32-Y535 HydrophobicContact CB-CD1 4.09Å; V32-Y535 HydrophobicContact CB-CE1 3.57Å; V32-Y535 HydrophobicContact CB-CE2 4.16Å; V32-Y535 HydrophobicContact CG1-CE1 3.66Å; V32-Y535 WeakPolarHBondContact CG1-OH 3.42Å; V32-Y535 PolarHBondContact N-O 2.76Å; V32-Y535 WeakPolarHBondContact O-CD1 3.33Å; V32-Y535 PolarHBondContact O-N 3.02Å; L34-Y535 HydrophobicContact CB-CD1 3.83Å; L34-Y535 HydrophobicContact CB-CE1 4.3Å; L34-Y535 HydrophobicContact CD1-CD1 3.99Å; L34-Y535 HydrophobicContact CD1-CE1 4.02Å; L34-Y535 HydrophobicContact CG-CD1 4.48Å; I523-Y535 HydrophobicContact CG2-CD2 4.32Å; V524-Y535 CarbonylContact O-C 3.39Å; V524-Y535 VanDerWaalsContact O-CA 3.27Å; V524-Y535 WeakPolarHBondContact O-CA 3.43Å; Y535-I537 HydrophobicContact CD2-CD1 4.49Å; Y535-I537 HydrophobicContact CD2-CG1 4.24Å; Y535-I537 HydrophobicContact CE2-CD1 4.05Å; Y535-I537 HydrophobicContact CE2-CG1 4.3Å
536	Q	91.5	Very high	77.6	Confident	16 Å²	16	39.8 Å²	39.8	8%	0.075	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	142.3	173.8	61.8	-172.8	-0.4	0	0	109.4	L477 I523 V524	L477-Q536 VanDerWaalsContact CB-NE2 3.33Å; I523-Q536 CarbonylContact C-O 3.59Å; I523-Q536 WeakPolarHBondContact CA-O 3.33Å; V524-Q536 HydrophobicContact CB-CG 3.79Å; V524-Q536 PolarHBondContact N-O 2.9Å; V524-Q536 PolarHBondContact O-N 2.77Å
537	I	89.5	Confident	74.4	Confident	27 Å²	27	45.5 Å²	45.5	14%	0.138	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	127.7	-177.2	-55.6	156.5	0	0	0	108.1	M27 A221 I523 Y535	M27-I537 HydrophobicContact CB-CB 4.32Å; M27-I537 HydrophobicContact CG-CB 4.32Å; M27-I537 HydrophobicContact CG-CG2 4.03Å; M27-I537 PolarHBondContact N-O 2.9Å; A221-I537 HydrophobicContact CB-CD1 4Å; A221-I537 HydrophobicContact CB-CG1 4.36Å; A221-I537 HydrophobicContact CB-CG2 4.17Å; A221-I537 VanDerWaalsContact O-CD1 3.24Å; A221-I537 WeakPolarHBondContact O-CD1 3.01Å; I523-I537 HydrophobicContact CG1-CG1 4.21Å; Y535-I537 HydrophobicContact CD2-CD1 4.49Å; Y535-I537 HydrophobicContact CD2-CG1 4.24Å; Y535-I537 HydrophobicContact CE2-CD1 4.05Å; Y535-I537 HydrophobicContact CE2-CG1 4.3Å
538	L	89.1	Confident	71.5	Confident	0 Å²	0	51 Å²	51	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	127.3	177.8	-57.9	170.2	0	0	0	108.7	W24 R25 Q26 L477 T521 M522 V524	W24-L538 HydrophobicContact CB-CB 4.3Å; W24-L538 HydrophobicContact CE3-CB 3.86Å; R25-L538 CarbonylContact O-C 3.52Å; R25-L538 WeakPolarHBondContact O-CA 3.19Å; Q26-L538 HydrophobicContact CB-CD2 4.34Å; Q26-L538 HydrophobicContact CG-CD2 3.33Å; L477-L538 HydrophobicContact CD1-CD1 4.09Å; L477-L538 HydrophobicContact CD2-CD1 4.06Å; L477-L538 HydrophobicContact CD2-CD2 4Å; T521-L538 CarbonylContact C-O 3.59Å; T521-L538 VanDerWaalsContact CA-O 3.32Å; T521-L538 WeakPolarHBondContact CA-O 3.41Å; M522-L538 HydrophobicContact CB-CB 4.2Å; M522-L538 HydrophobicContact CG-CD1 4.32Å; M522-L538 PolarHBondContact N-O 3.48Å; M522-L538 PolarHBondContact O-N 3.16Å; M522-L538 HydrophobicContact SD-CD1 4.11Å; V524-L538 HydrophobicContact CG2-CD1 3.94Å
539	E	87.4	Confident	68.6	Low	68 Å²	68	59.6 Å²	59.6	32%	0.318	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	138.3	171.9	-63.7	-164.8	162.6	0	0	110.1	W24 R25 M27 T521 D541	W24-E539 CarbonylContact C-O 3.55Å; W24-E539 WeakPolarHBondContact CA-O 3.48Å; R25-E539 PolarHBondContact N-O 3.11Å; R25-E539 PolarHBondContact O-N 3.02Å; M27-E539 HydrophobicContact CG-CG 3.69Å; M27-E539 HydrophobicContact SD-CB 4.49Å; M27-E539 HydrophobicContact SD-CG 3.71Å; M27-E539 VanDerWaalsContact SD-OE2 3.39Å; T521-E539 HydrophobicContact CG2-CG 4.01Å; E539-D541 PolarHBondContact O-N 3.41Å
540	R	83.4	Confident	65.8	Low	57 Å²	57	67.2 Å²	67.2	22%	0.215	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	123.8	174.3	-166	177.7	66.9	171.6	4.9	109.3	E22 W24 A520 D542	E22-R540 HydrophobicContact CB-CG 4.45Å; E22-R540 IonicContact OE1-NH1 3.42Å; W24-R540 HydrophobicContact CD2-CB 4.41Å; W24-R540 HydrophobicContact CE3-CB 4.25Å; W24-R540 HydrophobicContact CH2-CB 3.77Å; W24-R540 HydrophobicContact CH2-CG 4.37Å; W24-R540 HydrophobicContact CZ2-CB 3.84Å; W24-R540 HydrophobicContact CZ2-CG 3.93Å; W24-R540 HydrophobicContact CZ3-CB 3.97Å; A520-R540 HydrophobicContact CB-CB 4.1Å; A520-R540 PolarHBondContact O-N 2.88Å; R540-D542 IonicContact CZ-OD1 3.85Å; R540-D542 IonicContact NE-OD1 2.73Å; R540-D542 PolarHBondContact NE-OD1 2.87Å; R540-D542 IonicContact NH2-OD1 3.46Å; R540-D542 PolarHBondContact NH2-OD1 3.23Å; R540-D542 IonicContact NH2-OD2 3.61Å; R540-D542 PolarHBondContact NH2-OD2 3.34Å; R540-D542 PolarHBondContact O-N 3.48Å
541	D	79.2	Confident	63.2	Low	60 Å²	60	72.8 Å²	72.8	32%	0.321	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	102.8	171.5	-174.2	8.4	0	0	0	108.9	V23 R25 E539 G543	V23-D541 HydrophobicContact CB-CB 4.33Å; V23-D541 PolarHBondContact O-N 3.36Å; R25-D541 HydrophobicContact CG-CB 4.2Å; R25-D541 IonicContact CZ-OD2 3.06Å; R25-D541 IonicContact NE-OD2 2.78Å; R25-D541 PolarHBondContact NE-OD2 3.14Å; R25-D541 IonicContact NH2-OD2 2.68Å; R25-D541 PolarHBondContact NH2-OD2 3.13Å; E539-D541 PolarHBondContact O-N 3.41Å; D541-G543 PolarHBondContact O-N 3.28Å; D541-G543 PolarHBondContact OD1-N 3.41Å
542	D	62.7	Low	60.5	Low	78 Å²	78	77.5 Å²	77.5	42%	0.417	44%	0.442	S	S	.	.			trans	-77.5	9.4	-178.6	-77.6	-15.8	0	0	0	113.3	R540 K544	R540-D542 IonicContact CZ-OD1 3.85Å; R540-D542 IonicContact NE-OD1 2.73Å; R540-D542 PolarHBondContact NE-OD1 2.87Å; R540-D542 IonicContact NH2-OD1 3.46Å; R540-D542 PolarHBondContact NH2-OD1 3.23Å; R540-D542 IonicContact NH2-OD2 3.61Å; R540-D542 PolarHBondContact NH2-OD2 3.34Å; R540-D542 PolarHBondContact O-N 3.48Å; D542-K544 PolarHBondContact O-N 2.74Å; D542-K544 VanDerWaalsContact O-N 3.16Å
543	G	50	Low	57.6	Low	54 Å²	54	82 Å²	82	56%	0.557	47%	0.474	S	S	*	.			trans	56.7	37.8	172.3	0	0	0	0	0	112.5	D541 P545	D541-G543 PolarHBondContact O-N 3.28Å; D541-G543 PolarHBondContact OD1-N 3.41Å; G543-P545 VanDerWaalsContact O-CD 3.23Å; G543-P545 WeakPolarHBondContact O-CD 3.32Å; G543-P545 VanDerWaalsContact O-N 3.14Å
544	K	36.9	Very low	54.6	Low	188 Å²	188	89.9 Å²	89.9	82%	0.817	52%	0.517	S	S	*	.			trans	-61.6	118.2	163.2	-80.3	-173.5	179.2	178.3	0	106	D542 G546	D542-K544 PolarHBondContact O-N 2.74Å; D542-K544 VanDerWaalsContact O-N 3.16Å; K544-G546 PolarHBondContact O-N 3.18Å
545	P	32	Very low	51.8	Low	120 Å²	120	98 Å²	98	78%	0.779	55%	0.554	S	S	*	*			trans	-57.4	115.5	170.9	23.9	-30.4	0	0	0	105.8	G543 T547	G543-P545 VanDerWaalsContact O-CD 3.23Å; G543-P545 WeakPolarHBondContact O-CD 3.32Å; G543-P545 VanDerWaalsContact O-N 3.14Å; P545-T547 PolarHBondContact O-N 3.44Å; P545-T547 VanDerWaalsContact O-N 3.09Å
546	G	28.4	Very low	48.8	Very low	64 Å²	64	102.9 Å²	102.9	66%	0.66	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-52.5	122.4	175.2	0	0	0	0	0	107.5	K544 P548	K544-G546 PolarHBondContact O-N 3.18Å; G546-P548 WeakPolarHBondContact O-CD 3.17Å; G546-P548 VanDerWaalsContact O-N 3.12Å
547	T	27.6	Very low	45.8	Very low	132 Å²	132	108.2 Å²	108.2	81%	0.81	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-46.8	117.8	157.3	26	0	0	0	0	106.7	P545 E549	P545-T547 PolarHBondContact O-N 3.44Å; P545-T547 VanDerWaalsContact O-N 3.09Å; T547-E549 PolarHBondContact O-N 2.79Å; T547-E549 VanDerWaalsContact O-N 3.16Å
548	P	32.7	Very low	42.8	Very low	116 Å²	116	113.2 Å²	113.2	75%	0.753	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-57.4	126.1	173.2	22.5	-29.6	0	0	0	107.1	G546 E550	G546-P548 WeakPolarHBondContact O-CD 3.17Å; G546-P548 VanDerWaalsContact O-N 3.12Å; P548-E550 PolarHBondContact O-N 3.37Å; P548-E550 VanDerWaalsContact O-N 3.12Å
549	E	30.7	Very low	39.6	Very low	180 Å²	180	121 Å²	121	84%	0.841	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-50.6	121.4	167.8	-71.1	-177.1	152.3	0	0	107.5	T547 T551	T547-E549 PolarHBondContact O-N 2.79Å; T547-E549 VanDerWaalsContact O-N 3.16Å; E549-T551 VanDerWaalsContact C-N 3.27Å; E549-T551 PolarHBondContact O-N 3.46Å
550	E	27.6	Very low	37.3	Very low	195 Å²	195	122.6 Å²	122.6	91%	0.911	70%	0.703	S	S	*	*			trans	-62.2	90.6	172.2	-69.4	-179.9	163.2	0	0	108.4	P548 S552	P548-E550 PolarHBondContact O-N 3.37Å; P548-E550 VanDerWaalsContact O-N 3.12Å; E550-S552 PolarHBondContact O-N 2.87Å
551	T	29.6	Very low	34.4	Very low	129 Å²	129	125.2 Å²	125.2	79%	0.791	73%	0.725	S	S	*	*			trans	-79.7	107.1	155.9	51.5	0	0	0	0	107.4	E549	E549-T551 VanDerWaalsContact C-N 3.27Å; E549-T551 PolarHBondContact O-N 3.46Å
552	S	28.1	Very low	31.8	Very low	104 Å²	104	131 Å²	131	73%	0.727	75%	0.75	S	S	*	*			trans	-43.8	127.2	173.3	54.8	0	0	0	0	113.9	E550	E550-S552 PolarHBondContact O-N 2.87Å
553	S	28.5	Very low	29.9	Very low	98 Å²	98	131.6 Å²	131.6	69%	0.685	77%	0.765	S	S	*	*			trans	27.5	120.8	139.2	61.3	0	0	0	0	119.5
554	D	28.4	Very low	29.5	Very low	167 Å²	167	134 Å²	134	89%	0.893	77%	0.771	S	S	*	*				-150.9	131.2	109.2	-105.9	-15.2	0	0	0	110.1
555	E	32.5	Very low	29	Very low	172 Å²	172	132.5 Å²	132.5	80%	0.804	77%	0.772	S	S	*	*			trans	-66.6	158.9	168.8	-52	-159.2	145	0	0	108.5
556	D	28.1	Very low	28.6	Very low	135 Å²	135	131.1 Å²	131.1	72%	0.722	77%	0.771	S	S	*	*			cis	178.8	179	44.9	-141.6	-20	0	0	0	108.7
557	V	28.9	Very low	28.5	Very low	129 Å²	129	136 Å²	136	78%	0.782	78%	0.781	S	S	*	*			trans	106.8	77.5	167.5	-166.4	0	0	0	0	116.9
558	V	27.1	Very low	28.2	Very low	132 Å²	132	134.6 Å²	134.6	80%	0.8	77%	0.772	S	S	*	*				42.7	114.4	119.2	-170.3	0	0	0	0	119.8
559	M	22.3	Very low	27.7	Very low	162 Å²	162	138.1 Å²	138.1	80%	0.798	78%	0.776	S	S	*	*			trans	-54.6	-175	164.5	-69.9	-75.6	-72.3	0	0	114.9
560	P	37.6	Very low	27.4	Very low	103 Å²	103	134.9 Å²	134.9	67%	0.669	77%	0.768	S	S	*	*			cis	-147.6	178.6	11.1	33.4	-8	0	0	0	118.7
561	T	23.6	Very low	27.7	Very low	111 Å²	111	130.8 Å²	130.8	68%	0.681	76%	0.759	S	S	*	*			trans	90.2	113.7	140.7	-6.8	0	0	0	0	120.7
562	Q	25.4	Very low	27.3	Very low	183 Å²	183	133.9 Å²	133.9	86%	0.855	76%	0.764	S	S	*	*				151.7	118.3	113	-81.4	-179.2	21.6	0	0	111.4
563	A	22.4	Very low	27.2	Very low	89 Å²	89	135.3 Å²	135.3	74%	0.736	77%	0.769	S	S	*	*			trans	-92.4	179.6	148.8	0	0	0	0	0	107.6
564	P	41.1	Very low	28.2	Very low	105 Å²	105	135.9 Å²	135.9	68%	0.682	77%	0.77	S	S	*	*			cis	-134.1	178.9	-3.8	34.1	-13.1	0	0	0	112.8
565	N	25.6	Very low	27.9	Very low	157 Å²	157	135.1 Å²	135.1	84%	0.84	77%	0.766	S	S	*	*				176.5	136.9	123.5	-90.8	-18.6	0	0	0	113.5
566	A	23.7	Very low	27.5	Very low	90 Å²	90	137 Å²	137	74%	0.744	77%	0.766	S	S	*	*			trans	-68.1	160.7	168.1	0	0	0	0	0	112
567	L	26.5	Very low	27.3	Very low	166 Å²	166	136.4 Å²	136.4	87%	0.869	76%	0.762	S	S	*	*			trans	-173.5	108	132.7	-93.9	168.7	0	0	0	110.8
568	T	21.5	Very low	27.2	Very low	103 Å²	103	138.7 Å²	138.7	63%	0.632	77%	0.765	S	S	*	*			trans	3.8	143.8	138.1	30.6	0	0	0	0	123.4
569	F	22.6	Very low	27.1	Very low	190 Å²	190	137.1 Å²	137.1	83%	0.833	76%	0.76	S	S	*	*			trans	76.6	143.5	139.8	-82	-125.3	0	0	0	117.2
570	V	24.3	Very low	27.2	Very low	112 Å²	112	135.1 Å²	135.1	68%	0.679	76%	0.761	S	S	*	*			cis	-167.8	166.9	4.4	118	0	0	0	0	107.6
571	P	34.5	Very low	26.6	Very low	110 Å²	110	137.4 Å²	137.4	71%	0.714	77%	0.768	S	S	*	*			trans	-95.1	148.9	-165.2	36.5	-32.9	0	0	0	114.1
572	E	21.6	Very low	26.6	Very low	194 Å²	194	143.2 Å²	143.2	91%	0.907	78%	0.777	S	S	*	*			trans	-143.7	135	164.1	-71.7	-170	163.3	0	0	112.2
573	T	25.8	Very low	26.7	Very low	134 Å²	134	140 Å²	140	82%	0.822	77%	0.773	S	S	*	*			trans	-130.3	170.4	163	49.7	0	0	0	0	106.2
574	P	47.7	Very low	26.9	Very low	109 Å²	109	142.1 Å²	142.1	71%	0.708	78%	0.778	S	S	*	*			cis	-134.8	178.1	-8.2	26.2	-2.3	0	0	0	113.2
575	D	22.2	Very low	26.2	Very low	152 Å²	152	144.2 Å²	144.2	81%	0.813	78%	0.784	S	S	*	*			trans	-178.3	113.4	131	-99.9	-26.1	0	0	0	115
576	R	25	Very low	26.4	Very low	212 Å²	212	147.9 Å²	147.9	80%	0.8	79%	0.786	S	S	*	*				49.8	116.4	121.1	-156.2	164.4	-178.2	-167.8	-0	123.6
577	N	24.4	Very low	26.6	Very low	121 Å²	121	151.5 Å²	151.5	65%	0.647	79%	0.791	S	S	*	*				113.7	137.6	124.6	-93.5	3.5	0	0	0	123
578	Q	27.2	Very low	26.6	Very low	178 Å²	178	148.9 Å²	148.9	83%	0.832	78%	0.784	S	S	*	*			trans	85	141.6	159.7	-43.3	-166.3	24	0	0	117.9
579	S	24.4	Very low	26.7	Very low	99 Å²	99	148.6 Å²	148.6	69%	0.692	79%	0.792	S	S	*	*			cis	178.5	136.4	-29.1	48.6	0	0	0	0	106.8
580	S	24.8	Very low	26.8	Very low	119 Å²	119	149.4 Å²	149.4	83%	0.832	80%	0.796	S	S	*	*			trans	157.2	123.4	136.4	53.1	0	0	0	0	116
581	D	24.5	Very low	26.8	Very low	151 Å²	151	150.2 Å²	150.2	81%	0.807	80%	0.801	S	S	*	*			trans	60	118.5	136.2	-77.4	-0.5	0	0	0	127.2
582	R	23.6	Very low	26.4	Very low	234 Å²	234	149.5 Å²	149.5	88%	0.883	80%	0.804	S	S	*	*			trans	86.9	158	149.5	-64.3	-178.1	-176.1	-169.4	1.2	120.3
583	P	27.3	Very low	26.6	Very low	116 Å²	116	146.9 Å²	146.9	75%	0.753	80%	0.801	S	S	*	*				-109.5	174.4	-69.1	35.7	-19.6	0	0	0	111.6	D585	P583-D585 PolarHBondContact O-N 3.34Å
584	P	27.4	Very low	26.7	Very low	132 Å²	132	143.4 Å²	143.4	86%	0.857	79%	0.792	S	S	*	*			trans	-88.1	113	-174.5	33.6	-28.7	0	0	0	111.6
585	D	26	Very low	25.7	Very low	150 Å²	150	146 Å²	146	80%	0.802	80%	0.8	S	S	*	*			trans	-123.5	134.4	160.3	-119.7	-11.4	0	0	0	107.9	P583	P583-D585 PolarHBondContact O-N 3.34Å
586	R	29	Very low	26	Very low	234 Å²	234	142.7 Å²	142.7	88%	0.883	80%	0.802	S	S	*	*			trans	84.3	113	167.3	-56	-178.7	179.3	-166.6	-1.7	118.5
587	I	28.7	Very low	26.1	Very low	166 Å²	166	137 Å²	137	85%	0.851	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-54.6	139.3	162.5	-62.9	164	0	0	0	109.9
588	P	26	Very low	26.2	Very low	111 Å²	111	138.6 Å²	138.6	72%	0.721	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-74.3	138.8	-172.1	28.1	-33.1	0	0	0	113.1
589	A	23.3	Very low	26.2	Very low	97 Å²	97	136.8 Å²	136.8	80%	0.802	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-61.1	129.7	170.7	0	0	0	0	0	110.9
590	F	26.1	Very low	26.4	Very low	207 Å²	207	137.2 Å²	137.2	91%	0.908	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-64	131.7	168.8	-98.1	-101.4	0	0	0	110.2	A592	F590-A592 PolarHBondContact O-N 3.4Å; F590-A592 VanDerWaalsContact O-N 3.14Å
591	V	24.2	Very low	26.5	Very low	129 Å²	129	135.6 Å²	135.6	78%	0.782	81%	0.81	S	S	*	*			trans	-68.4	102.9	171.3	176.5	0	0	0	0	108.2	V593	V591-V593 HydrophobicContact CG1-CG2 4.35Å; V591-V593 PolarHBondContact O-N 2.92Å
592	A	25.1	Very low	27.2	Very low	94 Å²	94	133.7 Å²	133.7	78%	0.777	81%	0.806	S	S	*	*			trans	-76.9	110.8	163.3	0	0	0	0	0	108.1	F590 G594	F590-A592 PolarHBondContact O-N 3.4Å; F590-A592 VanDerWaalsContact O-N 3.14Å; A592-G594 PolarHBondContact O-N 2.94Å
593	V	26.9	Very low	28.8	Very low	140 Å²	140	126.5 Å²	126.5	85%	0.848	79%	0.792	S	S	*	*			trans	-76.7	80.2	161	-178.8	0	0	0	0	106.4	V591	V591-V593 HydrophobicContact CG1-CG2 4.35Å; V591-V593 PolarHBondContact O-N 2.92Å
594	G	26.6	Very low	30.8	Very low	61 Å²	61	125.4 Å²	125.4	63%	0.629	79%	0.793	S	S	*	*			trans	-97.9	122	168.6	0	0	0	0	0	108.8	A592 G596	A592-G594 PolarHBondContact O-N 2.94Å; G594-G596 PolarHBondContact O-N 2.91Å
595	N	27.8	Very low	33.3	Very low	163 Å²	163	120 Å²	120	87%	0.872	76%	0.757	S	S	*	*			trans	-54	128.5	162.4	-83.5	-21	0	0	0	108.6	A597	N595-A597 PolarHBondContact O-N 3.37Å; N595-A597 VanDerWaalsContact O-N 3.13Å
596	G	27.5	Very low	36	Very low	83 Å²	83	114.6 Å²	114.6	86%	0.856	73%	0.73	S	S	*	*			trans	-58.9	114.4	175.8	0	0	0	0	0	110.4	G594	G594-G596 PolarHBondContact O-N 2.91Å
597	A	28	Very low	38.5	Very low	91 Å²	91	107.1 Å²	107.1	75%	0.752	71%	0.714	S	S	*	*			trans	-117.2	120.9	156.6	0	0	0	0	0	105.9	N595 C599	N595-A597 PolarHBondContact O-N 3.37Å; N595-A597 VanDerWaalsContact O-N 3.13Å; A597-C599 PolarHBondContact O-N 2.67Å
598	D	25.5	Very low	41	Very low	155 Å²	155	102.4 Å²	102.4	83%	0.829	70%	0.7	S	S	*	*			trans	-51.3	132.6	-177.9	-62.9	-53.8	0	0	0	111.9	S600	D598-S600 PolarHBondContact O-N 3.18Å
599	C	28.1	Very low	43.8	Very low	141 Å²	141	97.4 Å²	97.4	95%	0.953	67%	0.667	S	S	*	*			trans	-62.9	85.8	167.9	-69.3	0	0	0	0	109.6	A597	A597-C599 PolarHBondContact O-N 2.67Å
600	S	28.1	Very low	46.7	Very low	108 Å²	108	98.4 Å²	98.4	76%	0.755	65%	0.65	S	S	*	*			trans	-80.9	145.1	162	51	0	0	0	0	109.4	D598	D598-S600 PolarHBondContact O-N 3.18Å
601	A	27.8	Very low	49.5	Very low	84 Å²	84	93 Å²	93	69%	0.694	63%	0.627	S	S	*	*			trans	-46.6	150.3	-179.8	0	0	0	0	0	112.3	S603	A601-S603 PolarHBondContact O-N 3.07Å
602	P	39	Very low	52.5	Low	112 Å²	112	88.1 Å²	88.1	73%	0.727	60%	0.601	S	S	*	*			trans	-54.1	114.5	179.8	22	-32.2	0	0	0	109.1	A604	P602-A604 PolarHBondContact O-N 3.49Å; P602-A604 VanDerWaalsContact O-N 3.07Å
603	S	56.8	Low	55.4	Low	83 Å²	83	83.7 Å²	83.7	58%	0.58	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-53.3	118.8	176.5	38	0	0	0	0	108	A601 L605	A601-S603 PolarHBondContact O-N 3.07Å; S603-L605 PolarHBondContact O-N 2.78Å
604	A	69	Low	58.2	Low	93 Å²	93	83.4 Å²	83.4	77%	0.769	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-63.3	122	-172.8	0	0	0	0	0	109.7	P602 S606	P602-A604 PolarHBondContact O-N 3.49Å; P602-A604 VanDerWaalsContact O-N 3.07Å; A604-S606 PolarHBondContact O-N 3.45Å
605	L	79.1	Confident	61.1	Low	19 Å²	19	88.4 Å²	88.4	10%	0.099	55%	0.548	C	S	.	.	P	Polyproline II helix	trans	-53.2	138.2	176.5	-75.2	118.2	0	0	0	111.1	P29 V30 L486 S603 T609 R610	P29-L605 HydrophobicContact CG-CD2 4.47Å; P29-L605 HydrophobicContact CG-CG 4.05Å; V30-L605 HydrophobicContact CB-CD2 4.12Å; V30-L605 HydrophobicContact CG2-CD2 3.88Å; L486-L605 HydrophobicContact CB-CD1 4.27Å; L486-L605 WeakPolarHBondContact O-CD1 3.41Å; S603-L605 PolarHBondContact O-N 2.78Å; L605-T609 HydrophobicContact CD2-CG2 3.67Å; L605-R610 HydrophobicContact CB-CG 3.73Å; L605-R610 VanDerWaalsContact O-CZ 3.31Å; L605-R610 PolarHBondContact O-NE 2.82Å; L605-R610 PolarHBondContact O-NH2 3.35Å
606	S	83.6	Confident	63.9	Low	36 Å²	36	80.9 Å²	80.9	25%	0.252	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-60.4	155.9	174.7	77.1	0	0	0	0	111.5	E28 A604 A608 T609 R610	E28-S606 VanDerWaalsContact CD-OG 3.3Å; E28-S606 WeakPolarHBondContact OE1-CB 3.22Å; E28-S606 PolarHBondContact OE1-OG 2.88Å; E28-S606 PolarHBondContact OE2-N 3Å; E28-S606 PolarHBondContact OE2-OG 3.34Å; A604-S606 PolarHBondContact O-N 3.45Å; S606-A608 VanDerWaalsContact C-N 3.27Å; S606-A608 PolarHBondContact O-N 3.04Å; S606-T609 PolarHBondContact O-N 2.92Å; S606-T609 WeakPolarHBondContact OG-CB 3.36Å; S606-T609 PolarHBondContact OG-N 2.82Å; S606-T609 PolarHBondContact OG-OG1 3.11Å; S606-R610 PolarHBondContact O-N 2.9Å; S606-R610 VanDerWaalsContact O-N 3.1Å; S606-R610 PolarHBondContact O-NE 2.77Å
607	S	81.6	Confident	66.7	Low	77 Å²	77	77.4 Å²	77.4	54%	0.538	47%	0.469	S	S	.	.	H	α-helix	trans	-61.4	-39.8	177.4	61.3	0	0	0	0	110.7	R610 H611	S607-R610 PolarHBondContact O-N 2.89Å; S607-H611 PolarHBondContact O-N 3.06Å; S607-H611 PolarHBondContact O-ND1 2.77Å
608	A	81.9	Confident	69.4	Low	67 Å²	67	77.4 Å²	77.4	55%	0.554	45%	0.453	S	S	*	.	H	α-helix	trans	-61.8	-49.4	178.6	0	0	0	0	0	112	S606 R610 H611 A612	S606-A608 VanDerWaalsContact C-N 3.27Å; S606-A608 PolarHBondContact O-N 3.04Å; A608-R610 PolarHBondContact O-N 2.79Å; A608-H611 PolarHBondContact O-N 2.82Å; A608-H611 VanDerWaalsContact O-N 3.11Å; A608-A612 PolarHBondContact O-N 3.04Å
609	T	84.1	Confident	72.1	Confident	5 Å²	5	74.6 Å²	74.6	3%	0.031	43%	0.434	C	S	.	.	H	α-helix	trans	-59.9	-44.6	177.8	-60	0	0	0	0	111.7	E28 V32 L605 S606 H611 A612 W613	E28-T609 PolarHBondContact OE1-OG1 3.24Å; E28-T609 WeakPolarHBondContact OE2-CB 3.46Å; E28-T609 PolarHBondContact OE2-OG1 3.12Å; V32-T609 HydrophobicContact CG2-CG2 3.89Å; L605-T609 HydrophobicContact CD2-CG2 3.67Å; S606-T609 PolarHBondContact O-N 2.92Å; S606-T609 WeakPolarHBondContact OG-CB 3.36Å; S606-T609 PolarHBondContact OG-N 2.82Å; S606-T609 PolarHBondContact OG-OG1 3.11Å; T609-H611 VanDerWaalsContact C-N 3.31Å; T609-H611 PolarHBondContact O-N 2.94Å; T609-A612 PolarHBondContact O-N 2.97Å; T609-W613 PolarHBondContact O-N 2.83Å
610	R	84.6	Confident	74.6	Confident	118 Å²	118	68.9 Å²	68.9	45%	0.445	39%	0.393	S	S	.	.	H	α-helix	trans	-60.7	-38.9	175.3	-78.6	-176.7	-83.8	154.1	-9.9	112.5	L605 S606 S607 A608 R614	L605-R610 HydrophobicContact CB-CG 3.73Å; L605-R610 VanDerWaalsContact O-CZ 3.31Å; L605-R610 PolarHBondContact O-NE 2.82Å; L605-R610 PolarHBondContact O-NH2 3.35Å; S606-R610 PolarHBondContact O-N 2.9Å; S606-R610 VanDerWaalsContact O-N 3.1Å; S606-R610 PolarHBondContact O-NE 2.77Å; S607-R610 PolarHBondContact O-N 2.89Å; A608-R610 PolarHBondContact O-N 2.79Å; R610-R614 WeakPolarHBondContact O-CB 3.34Å; R610-R614 PolarHBondContact O-N 2.87Å
611	H	84.8	Confident	77	Confident	93 Å²	93	65 Å²	65	43%	0.431	36%	0.364	S	S	.	.	H	α-helix	trans	-69.5	-40.9	177	-78.5	85.2	0	0	0	112.2	S607 A608 T609 R614 R615	S607-H611 PolarHBondContact O-N 3.06Å; S607-H611 PolarHBondContact O-ND1 2.77Å; A608-H611 PolarHBondContact O-N 2.82Å; A608-H611 VanDerWaalsContact O-N 3.11Å; T609-H611 VanDerWaalsContact C-N 3.31Å; T609-H611 PolarHBondContact O-N 2.94Å; H611-R614 PolarHBondContact O-N 2.86Å; H611-R615 WeakPolarHBondContact O-CB 3.27Å; H611-R615 WeakPolarHBondContact O-CG 3.33Å; H611-R615 PolarHBondContact O-N 2.96Å
612	A	85.8	Confident	78.8	Confident	27 Å²	27	70.4 Å²	70.4	22%	0.223	37%	0.366	C	S	.	.	H	α-helix	trans	-60.1	-50.8	176	0	0	0	0	0	111.2	V32 P33 A608 T609 R614 R615 W616	V32-A612 HydrophobicContact CG1-CB 3.84Å; P33-A612 HydrophobicContact CG-CB 4.25Å; A608-A612 PolarHBondContact O-N 3.04Å; T609-A612 PolarHBondContact O-N 2.97Å; A612-R614 PolarHBondContact O-N 2.63Å; A612-R615 PolarHBondContact O-N 2.89Å; A612-W616 PolarHBondContact O-N 2.88Å
613	W	86.9	Confident	79.6	Confident	1 Å²	1	68.4 Å²	68.4	0%	0.004	35%	0.347	C	S	.	.	H	α-helix	trans	-61.6	-42.7	175.7	-86.2	105.4	0	0	0	113.1	V30 P31 P33 S483 L487 L502 F534 T609 R615 W616 L617	V30-W613 HydrophobicContact CG1-CZ2 3.94Å; P31-W613 VanDerWaalsContact O-CZ2 3.27Å; P31-W613 WeakPolarHBondContact O-CZ2 3.34Å; P31-W613 PolarHBondContact O-NE1 2.83Å; P33-W613 HydrophobicContact CG-CD2 4.15Å; P33-W613 HydrophobicContact CG-CG 4.33Å; S483-W613 VanDerWaalsContact CB-CZ2 3.43Å; S483-W613 WeakPolarHBondContact OG-CH2 3.35Å; S483-W613 WeakPolarHBondContact OG-CZ2 3.34Å; L487-W613 HydrophobicContact CD1-CB 4.23Å; L487-W613 HydrophobicContact CD1-CD2 3.58Å; L487-W613 HydrophobicContact CD1-CE3 3.49Å; L487-W613 VanDerWaalsContact CD1-CE3 3.49Å; L487-W613 HydrophobicContact CD1-CG 3.93Å; L487-W613 HydrophobicContact CD1-CZ3 4.04Å; L487-W613 HydrophobicContact CD2-CB 3.66Å; L487-W613 HydrophobicContact CD2-CD2 4.26Å; L487-W613 HydrophobicContact CD2-CG 3.72Å; L487-W613 HydrophobicContact CG-CG 4.45Å; L502-W613 HydrophobicContact CD1-CH2 4.1Å; L502-W613 HydrophobicContact CD1-CZ3 4.18Å; L502-W613 HydrophobicContact CD2-CH2 4.05Å; L502-W613 HydrophobicContact CD2-CZ3 4.44Å; F534-W613 HydrophobicContact CD1-CH2 4.4Å; F534-W613 HydrophobicContact CD1-CZ2 4.28Å; F534-W613 AromaticContact CE1-CH2 3.61Å; F534-W613 HydrophobicContact CE1-CH2 3.61Å; F534-W613 AromaticContact CE1-CZ2 3.91Å; F534-W613 HydrophobicContact CE1-CZ2 3.91Å; F534-W613 HydrophobicContact CE1-CZ3 4.36Å; F534-W613 HydrophobicContact CZ-CH2 4.35Å; T609-W613 PolarHBondContact O-N 2.83Å; W613-R615 VanDerWaalsContact C-N 3.33Å; W613-R615 PolarHBondContact O-N 2.79Å; W613-W616 HydrophobicContact CE3-CE3 4.12Å; W613-W616 HydrophobicContact CZ3-CD2 4.4Å; W613-W616 AromaticContact CZ3-CE3 3.93Å; W613-W616 HydrophobicContact CZ3-CE3 3.93Å; W613-W616 HydrophobicContact CZ3-CZ3 4.11Å; W613-W616 PolarHBondContact O-N 3Å; W613-L617 WeakPolarHBondContact O-CB 3.38Å; W613-L617 WeakPolarHBondContact O-CD1 3.2Å; W613-L617 VanDerWaalsContact O-CG 3.29Å; W613-L617 WeakPolarHBondContact O-CG 3.31Å; W613-L617 PolarHBondContact O-N 2.8Å
614	R	86.6	Confident	79.4	Confident	134 Å²	134	69.2 Å²	69.2	51%	0.506	34%	0.341	S	S	.	.	H	α-helix	trans	-59.9	-43.5	175.7	-175	-174.7	-66	175.7	-1.9	111.4	R610 H611 A612 Q618	R610-R614 WeakPolarHBondContact O-CB 3.34Å; R610-R614 PolarHBondContact O-N 2.87Å; H611-R614 PolarHBondContact O-N 2.86Å; A612-R614 PolarHBondContact O-N 2.63Å; R614-Q618 HydrophobicContact CG-CG 4.46Å; R614-Q618 WeakPolarHBondContact O-CB 3.32Å; R614-Q618 VanDerWaalsContact O-CG 3.22Å; R614-Q618 WeakPolarHBondContact O-CG 3.46Å; R614-Q618 PolarHBondContact O-N 3.45Å
615	R	86.1	Confident	78	Confident	167 Å²	167	67.9 Å²	67.9	63%	0.63	34%	0.337	S	S	*	.	H	α-helix	trans	-64.4	-42.3	176.6	-75.7	176.9	-178.2	165.9	1.9	111.5	H611 A612 W613 K619	H611-R615 WeakPolarHBondContact O-CB 3.27Å; H611-R615 WeakPolarHBondContact O-CG 3.33Å; H611-R615 PolarHBondContact O-N 2.96Å; A612-R615 PolarHBondContact O-N 2.89Å; W613-R615 VanDerWaalsContact C-N 3.33Å; W613-R615 PolarHBondContact O-N 2.79Å; R615-K619 WeakPolarHBondContact O-CB 3.33Å; R615-K619 WeakPolarHBondContact O-CG 3.43Å; R615-K619 PolarHBondContact O-N 2.78Å
616	W	87.8	Confident	75.8	Confident	5 Å²	5	76 Å²	76	2%	0.019	37%	0.371	C	S	.	.	H	α-helix	trans	-60.1	-53.5	176.7	-173.3	97.3	0	0	0	110.6	P33 P37 R501 L502 A612 W613 Q618 K619 L620	P33-W616 HydrophobicContact CB-CB 4.32Å; P33-W616 HydrophobicContact CB-CG 4.1Å; P33-W616 HydrophobicContact CG-CB 4.02Å; P33-W616 HydrophobicContact CG-CG 4.26Å; P37-W616 HydrophobicContact CB-CD2 4.43Å; P37-W616 HydrophobicContact CB-CZ2 4.25Å; P37-W616 HydrophobicContact CG-CD2 4.07Å; P37-W616 HydrophobicContact CG-CG 3.91Å; P37-W616 VanDerWaalsContact CG-O 3.23Å; P37-W616 WeakPolarHBondContact CG-O 3.29Å; R501-W616 HydrophobicContact CB-CH2 4.33Å; R501-W616 HydrophobicContact CG-CH2 3.9Å; R501-W616 HydrophobicContact CG-CZ2 3.96Å; L502-W616 HydrophobicContact CD2-CH2 4.16Å; L502-W616 HydrophobicContact CD2-CZ2 4.42Å; L502-W616 HydrophobicContact CG-CH2 4.17Å; A612-W616 PolarHBondContact O-N 2.88Å; W613-W616 HydrophobicContact CE3-CE3 4.12Å; W613-W616 HydrophobicContact CZ3-CD2 4.4Å; W613-W616 AromaticContact CZ3-CE3 3.93Å; W613-W616 HydrophobicContact CZ3-CE3 3.93Å; W613-W616 HydrophobicContact CZ3-CZ3 4.11Å; W613-W616 PolarHBondContact O-N 3Å; W616-Q618 PolarHBondContact O-N 2.82Å; W616-K619 PolarHBondContact O-N 2.98Å; W616-K619 VanDerWaalsContact O-N 3.15Å; W616-L620 HydrophobicContact CH2-CD2 3.9Å; W616-L620 HydrophobicContact CZ3-CD2 3.82Å; W616-L620 PolarHBondContact O-N 2.88Å
617	L	86.5	Confident	73.6	Confident	10 Å²	10	80.5 Å²	80.5	5%	0.052	40%	0.4	C	S	.	.	H	α-helix	trans	-60.3	-44.1	178.7	-69.8	159.5	0	0	0	112.3	L487 A498 W613 K619 L620 M621	L487-L617 HydrophobicContact CD1-CD1 4.23Å; A498-L617 HydrophobicContact CB-CD2 3.93Å; W613-L617 WeakPolarHBondContact O-CB 3.38Å; W613-L617 WeakPolarHBondContact O-CD1 3.2Å; W613-L617 VanDerWaalsContact O-CG 3.29Å; W613-L617 WeakPolarHBondContact O-CG 3.31Å; W613-L617 PolarHBondContact O-N 2.8Å; L617-K619 VanDerWaalsContact C-N 3.32Å; L617-K619 PolarHBondContact O-N 2.8Å; L617-L620 PolarHBondContact O-N 3.2Å; L617-M621 VanDerWaalsContact O-CG 3.3Å; L617-M621 WeakPolarHBondContact O-CG 3.44Å; L617-M621 PolarHBondContact O-N 3.3Å
618	Q	84.4	Confident	71.4	Confident	91 Å²	91	79.5 Å²	79.5	43%	0.425	40%	0.402	S	S	.	.	H	α-helix	trans	-62.2	-38.6	177	-77.4	177.9	-2.8	0	0	112.6	R614 W616 R622	R614-Q618 HydrophobicContact CG-CG 4.46Å; R614-Q618 WeakPolarHBondContact O-CB 3.32Å; R614-Q618 VanDerWaalsContact O-CG 3.22Å; R614-Q618 WeakPolarHBondContact O-CG 3.46Å; R614-Q618 PolarHBondContact O-N 3.45Å; W616-Q618 PolarHBondContact O-N 2.82Å; Q618-R622 WeakPolarHBondContact O-CB 3.27Å; Q618-R622 VanDerWaalsContact O-CG 3.27Å; Q618-R622 WeakPolarHBondContact O-CG 3.35Å; Q618-R622 PolarHBondContact O-N 2.86Å
619	K	82.1	Confident	68.8	Low	96 Å²	96	80.5 Å²	80.5	42%	0.417	41%	0.41	S	S	.	.	H	α-helix	trans	-70.8	-39.2	177.4	-76.7	-174.9	179.8	-172.7	0	111.9	S36 P37 R615 W616 L617 M621 R622 Q623	S36-K619 WeakPolarHBondContact OG-CD 3.24Å; S36-K619 PolarHBondContact OG-NZ 2.86Å; P37-K619 HydrophobicContact CG-CB 3.93Å; R615-K619 WeakPolarHBondContact O-CB 3.33Å; R615-K619 WeakPolarHBondContact O-CG 3.43Å; R615-K619 PolarHBondContact O-N 2.78Å; W616-K619 PolarHBondContact O-N 2.98Å; W616-K619 VanDerWaalsContact O-N 3.15Å; L617-K619 VanDerWaalsContact C-N 3.32Å; L617-K619 PolarHBondContact O-N 2.8Å; K619-M621 VanDerWaalsContact C-N 3.31Å; K619-M621 PolarHBondContact O-N 2.83Å; K619-R622 PolarHBondContact O-N 3.42Å; K619-Q623 VanDerWaalsContact O-CG 3.27Å; K619-Q623 WeakPolarHBondContact O-CG 3.3Å; K619-Q623 PolarHBondContact O-N 2.92Å
620	L	80.8	Confident	66.3	Low	21 Å²	21	85 Å²	85	11%	0.11	44%	0.439	C	S	.	.	H	α-helix	trans	-56.5	-47.8	173	-172.5	69.9	0	0	0	110.5	P37 T497 A498 R501 W616 L617 Q623	P37-L620 HydrophobicContact CB-CD1 4.37Å; P37-L620 HydrophobicContact CG-CB 4.15Å; T497-L620 HydrophobicContact CG2-CD2 4.39Å; A498-L620 HydrophobicContact CB-CD2 4.24Å; R501-L620 HydrophobicContact CG-CD1 4.23Å; W616-L620 HydrophobicContact CH2-CD2 3.9Å; W616-L620 HydrophobicContact CZ3-CD2 3.82Å; W616-L620 PolarHBondContact O-N 2.88Å; L617-L620 PolarHBondContact O-N 3.2Å; L620-Q623 PolarHBondContact O-N 3.07Å
621	M	77	Confident	63.8	Low	26 Å²	26	82.6 Å²	82.6	13%	0.128	44%	0.439	C	S	.	.	H	α-helix	trans	-74.3	-34.7	-177.4	-61.4	-50.1	-46.3	0	0	114.6	R494 L617 K619 Q623 E624	R494-M621 HydrophobicContact CB-CE 4.18Å; R494-M621 HydrophobicContact CB-SD 3.77Å; R494-M621 HydrophobicContact CG-CE 3.55Å; R494-M621 HydrophobicContact CG-CG 4.43Å; R494-M621 HydrophobicContact CG-SD 3.75Å; L617-M621 VanDerWaalsContact O-CG 3.3Å; L617-M621 WeakPolarHBondContact O-CG 3.44Å; L617-M621 PolarHBondContact O-N 3.3Å; K619-M621 VanDerWaalsContact C-N 3.31Å; K619-M621 PolarHBondContact O-N 2.83Å; M621-Q623 PolarHBondContact O-N 2.92Å; M621-E624 WeakPolarHBondContact CE-OE2 3.49Å; M621-E624 PolarHBondContact O-N 3.49Å
622	R	65.7	Low	61.1	Low	197 Å²	197	88.9 Å²	88.9	74%	0.743	46%	0.459	S	S	*	.	H	α-helix	trans	-65.2	-17.5	178	-79.7	177.2	-179.8	-175	1.5	112.8	Q618 K619	Q618-R622 WeakPolarHBondContact O-CB 3.27Å; Q618-R622 VanDerWaalsContact O-CG 3.27Å; Q618-R622 WeakPolarHBondContact O-CG 3.35Å; Q618-R622 PolarHBondContact O-N 2.86Å; K619-R622 PolarHBondContact O-N 3.42Å
623	Q	57.3	Low	58.4	Low	70 Å²	70	93.6 Å²	93.6	33%	0.327	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-2.9	-177.8	-70	178.3	5.4	0	0	113.7	C39 K619 L620 M621 G625	C39-Q623 VanDerWaalsContact CA-OE1 3.26Å; C39-Q623 PolarHBondContact SG-NE2 3.21Å; K619-Q623 VanDerWaalsContact O-CG 3.27Å; K619-Q623 WeakPolarHBondContact O-CG 3.3Å; K619-Q623 PolarHBondContact O-N 2.92Å; L620-Q623 PolarHBondContact O-N 3.07Å; M621-Q623 PolarHBondContact O-N 2.92Å; Q623-G625 PolarHBondContact O-N 2.91Å
624	E	51.5	Low	55.6	Low	100 Å²	100	97.1 Å²	97.1	47%	0.467	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	5.6	169.9	-63.8	-172.7	161.4	0	0	113.2	T497 M621 K626	T497-E624 PolarHBondContact OG1-OE1 2.87Å; M621-E624 WeakPolarHBondContact CE-OE2 3.49Å; M621-E624 PolarHBondContact O-N 3.49Å; E624-K626 PolarHBondContact O-N 3.38Å
625	G	39.7	Very low	52.8	Low	65 Å²	65	93.9 Å²	93.9	67%	0.67	50%	0.504	S	S	*	.			trans	-68	100.3	-176.9	0	0	0	0	0	113.9	Q623	Q623-G625 PolarHBondContact O-N 2.91Å
626	K	34	Very low	50.1	Low	189 Å²	189	94.6 Å²	94.6	82%	0.822	51%	0.507	S	S	*	.			trans	89	108.3	-176.7	-63.9	-176.2	-179.9	178.8	0	113.1	E624 G628	E624-K626 PolarHBondContact O-N 3.38Å; K626-G628 PolarHBondContact O-N 3.3Å
627	P	37	Very low	47.4	Very low	131 Å²	131	99 Å²	99	85%	0.851	53%	0.534	S	S	*	.			trans	-67.2	83.6	154.5	29.7	-29.8	0	0	0	106.4	A629	P627-A629 PolarHBondContact O-N 2.89Å
628	G	34.7	Very low	44.8	Very low	56 Å²	56	104.2 Å²	104.2	58%	0.577	56%	0.562	S	S	*	*			trans	-52.3	137.8	149.8	0	0	0	0	0	105.9	K626	K626-G628 PolarHBondContact O-N 3.3Å
629	A	27.9	Very low	42.4	Very low	88 Å²	88	101.7 Å²	101.7	73%	0.727	56%	0.561	S	S	*	*			trans	-38.9	136.1	167.1	0	0	0	0	0	108	P627	P627-A629 PolarHBondContact O-N 2.89Å
630	P	30.7	Very low	40	Very low	100 Å²	100	103.4 Å²	103.4	65%	0.649	57%	0.574	S	S	*	*			trans	-42.6	124.5	-178.9	19.3	-32.2	0	0	0	106.2	R632	P630-R632 PolarHBondContact O-N 2.87Å
631	P	32.2	Very low	37.5	Very low	67 Å²	67	109.6 Å²	109.6	44%	0.435	61%	0.606	S	S	.	*			trans	-56.4	109.9	174.8	23.8	-28.3	0	0	0	102.6	G42 L633	G42-P631 WeakPolarHBondContact O-CD 3.19Å; G42-P631 WeakPolarHBondContact O-CG 3.33Å; P631-L633 PolarHBondContact O-N 2.89Å
632	R	28.8	Very low	35.1	Very low	225 Å²	225	112.5 Å²	112.5	85%	0.849	63%	0.629	S	S	*	*			trans	-41.4	125.4	161.6	-62.8	176.3	-179.3	-124.2	-3.6	102.2	P630 A634	P630-R632 PolarHBondContact O-N 2.87Å; R632-A634 PolarHBondContact O-N 3.2Å
633	L	29.3	Very low	33.4	Very low	126 Å²	126	108.1 Å²	108.1	66%	0.66	62%	0.624	S	S	*	*			trans	-64.6	71.2	156.5	-130.8	105.6	0	0	0	104.5	F43 P631 V635	F43-L633 HydrophobicContact CE1-CD1 3.29Å; F43-L633 HydrophobicContact CZ-CD1 3.34Å; P631-L633 PolarHBondContact O-N 2.89Å; L633-V635 HydrophobicContact CD2-CG2 3.69Å; L633-V635 HydrophobicContact CG-CG2 4.45Å; L633-V635 PolarHBondContact O-N 3.39Å
634	A	27.8	Very low	32.1	Very low	75 Å²	75	110.3 Å²	110.3	62%	0.62	64%	0.644	S	S	*	*			trans	-67.8	79.2	149.5	0	0	0	0	0	101.9	R632 R636	R632-A634 PolarHBondContact O-N 3.2Å; A634-R636 PolarHBondContact O-N 3.01Å
635	V	27.1	Very low	31	Very low	66 Å²	66	113 Å²	113	40%	0.4	66%	0.657	S	S	.	*			trans	-44.2	111.7	141.5	-177.3	0	0	0	0	102.7	L633 T637 L640	L633-V635 HydrophobicContact CD2-CG2 3.69Å; L633-V635 HydrophobicContact CG-CG2 4.45Å; L633-V635 PolarHBondContact O-N 3.39Å; V635-T637 HydrophobicContact CB-CG2 4.24Å; V635-T637 HydrophobicContact CG1-CG2 3.97Å; V635-T637 PolarHBondContact O-N 3.31Å; V635-L640 HydrophobicContact CG1-CD1 3.42Å; V635-L640 VanDerWaalsContact CG1-CD1 3.42Å
636	R	29.9	Very low	30.6	Very low	183 Å²	183	116.8 Å²	116.8	69%	0.691	66%	0.661	S	S	*	*			trans	-62.8	92.3	162.4	-75.3	-172.8	80.3	-178.7	4.4	103.7	A634 D638	A634-R636 PolarHBondContact O-N 3.01Å; R636-D638 HydrophobicContact CB-CB 4.26Å; R636-D638 IonicContact CZ-OD2 3.25Å; R636-D638 IonicContact NE-OD2 2.69Å; R636-D638 PolarHBondContact NE-OD2 3.32Å; R636-D638 IonicContact NH2-OD2 3.2Å; R636-D638 PolarHBondContact NH2-OD2 3.12Å; R636-D638 PolarHBondContact O-N 3.41Å
637	T	31.5	Very low	30.7	Very low	97 Å²	97	111.2 Å²	111.2	60%	0.595	65%	0.65	S	S	*	*			trans	-67.5	0.1	167	45.4	0	0	0	0	110.4	V635 G639	V635-T637 HydrophobicContact CB-CG2 4.24Å; V635-T637 HydrophobicContact CG1-CG2 3.97Å; V635-T637 PolarHBondContact O-N 3.31Å; T637-G639 PolarHBondContact O-N 3.37Å
638	D	32.1	Very low	30.7	Very low	119 Å²	119	108.8 Å²	108.8	64%	0.636	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.9	75.1	155.1	-49.8	-13.9	0	0	0	110	R636	R636-D638 HydrophobicContact CB-CB 4.26Å; R636-D638 IonicContact CZ-OD2 3.25Å; R636-D638 IonicContact NE-OD2 2.69Å; R636-D638 PolarHBondContact NE-OD2 3.32Å; R636-D638 IonicContact NH2-OD2 3.2Å; R636-D638 PolarHBondContact NH2-OD2 3.12Å; R636-D638 PolarHBondContact O-N 3.41Å
639	G	32.8	Very low	30.9	Very low	39 Å²	39	109.6 Å²	109.6	40%	0.402	64%	0.642	S	S	.	*	T	Hydrogen-bonded Turn	trans	115.1	-12.2	170.9	0	0	0	0	0	116.9	T637 L641 S642	T637-G639 PolarHBondContact O-N 3.37Å; G639-L641 VanDerWaalsContact C-N 3.29Å; G639-L641 PolarHBondContact O-N 3.09Å; G639-S642 PolarHBondContact O-N 3.03Å; G639-S642 PolarHBondContact O-OG 3.15Å
640	L	31.7	Very low	31.4	Very low	132 Å²	132	106.6 Å²	106.6	69%	0.691	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-11.9	177	-82.1	161.4	0	0	0	113.9	V635	V635-L640 HydrophobicContact CG1-CD1 3.42Å; V635-L640 VanDerWaalsContact CG1-CD1 3.42Å
641	L	29.4	Very low	31.8	Very low	151 Å²	151	110.3 Å²	110.3	79%	0.791	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.3	31.2	157.7	-65.9	174.4	0	0	0	111.1	G639 V643	G639-L641 VanDerWaalsContact C-N 3.29Å; G639-L641 PolarHBondContact O-N 3.09Å; L641-V643 PolarHBondContact O-N 2.9Å
642	S	27.2	Very low	32.3	Very low	86 Å²	86	114.5 Å²	114.5	60%	0.601	63%	0.634	S	S	*	*			trans	-79.2	84.9	159.3	64.4	0	0	0	0	107.9	G639	G639-S642 PolarHBondContact O-N 3.03Å; G639-S642 PolarHBondContact O-OG 3.15Å
643	V	29.8	Very low	33	Very low	106 Å²	106	109.6 Å²	109.6	64%	0.642	63%	0.625	S	S	*	*			trans	-47	129.7	148.6	-179.3	0	0	0	0	105.8	L641 E645	L641-V643 PolarHBondContact O-N 2.9Å; V643-E645 PolarHBondContact O-N 2.94Å
644	P	29.2	Very low	33.8	Very low	115 Å²	115	110.6 Å²	110.6	75%	0.747	63%	0.626	S	S	*	*			trans	-49.5	121.9	174.1	-5.4	8.8	0	0	0	106.3	L646	P644-L646 PolarHBondContact O-N 2.84Å
645	E	27.6	Very low	34.9	Very low	158 Å²	158	108.2 Å²	108.2	74%	0.738	61%	0.609	S	S	*	*			trans	-42.9	101.6	-168.9	-75	-174.1	136.1	0	0	110.1	V643 A647 R651	V643-E645 PolarHBondContact O-N 2.94Å; E645-A647 VanDerWaalsContact C-N 3.33Å; E645-A647 PolarHBondContact O-N 3.2Å; E645-R651 IonicContact OE1-NH2 3.82Å; E645-R651 PolarHBondContact OE1-NH2 2.85Å; E645-R651 VanDerWaalsContact OE1-NH2 3.11Å
646	L	32.8	Very low	36.1	Very low	143 Å²	143	106.9 Å²	106.9	75%	0.749	61%	0.605	S	S	*	*			trans	-61	113.1	157.3	-140.7	87.3	0	0	0	102.3	P644	P644-L646 PolarHBondContact O-N 2.84Å
647	A	34.8	Very low	37	Very low	72 Å²	72	102.4 Å²	102.4	60%	0.595	59%	0.594	S	S	*	*			trans	-33.2	143.4	-171.7	0	0	0	0	0	112	E645 A649 G650	E645-A647 VanDerWaalsContact C-N 3.33Å; E645-A647 PolarHBondContact O-N 3.2Å; A647-A649 CarbonylContact O-C 3.54Å; A647-A649 WeakPolarHBondContact O-CA 3.32Å; A647-A649 PolarHBondContact O-N 3.35Å; A647-G650 PolarHBondContact O-N 2.78Å
648	A	38.2	Very low	37.8	Very low	80 Å²	80	101.8 Å²	101.8	66%	0.661	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-35.8	-18.3	-175.1	0	0	0	0	0	117.9	G650	A648-G650 VanDerWaalsContact C-N 3.31Å; A648-G650 PolarHBondContact O-N 2.91Å
649	A	38.3	Very low	38.8	Very low	73 Å²	73	102.2 Å²	102.2	60%	0.603	58%	0.583	S	S	*	*	H	α-helix	trans	-51.1	-37	162.2	0	0	0	0	0	115.1	A647 H652 L653	A647-A649 CarbonylContact O-C 3.54Å; A647-A649 WeakPolarHBondContact O-CA 3.32Å; A647-A649 PolarHBondContact O-N 3.35Å; A649-H652 PolarHBondContact O-N 2.83Å; A649-L653 PolarHBondContact O-N 2.96Å
650	G	38.1	Very low	39.7	Very low	26 Å²	26	103.9 Å²	103.9	27%	0.268	58%	0.582	S	S	.	*	H	α-helix	trans	-70	-37.8	-174.4	0	0	0	0	0	115.2	A647 A648 L653 Q654	A647-G650 PolarHBondContact O-N 2.78Å; A648-G650 VanDerWaalsContact C-N 3.31Å; A648-G650 PolarHBondContact O-N 2.91Å; G650-L653 WeakPolarHBondContact O-CB 3.28Å; G650-L653 PolarHBondContact O-N 2.94Å; G650-Q654 PolarHBondContact O-N 2.72Å
651	R	38.5	Very low	40.5	Very low	178 Å²	178	101.7 Å²	101.7	67%	0.672	57%	0.571	S	S	*	*	H	α-helix	trans	-70.6	-33.9	175.7	-64	-173	-154.7	163.9	13.8	111.9	E645 L653 G655	E645-R651 IonicContact OE1-NH2 3.82Å; E645-R651 PolarHBondContact OE1-NH2 2.85Å; E645-R651 VanDerWaalsContact OE1-NH2 3.11Å; R651-L653 VanDerWaalsContact C-N 3.31Å; R651-G655 PolarHBondContact O-N 3.01Å
652	H	43	Very low	41.5	Very low	154 Å²	154	98.3 Å²	98.3	71%	0.713	55%	0.551	S	S	*	*	H	α-helix	trans	-65.2	-37.1	169.7	-89.1	-76.8	0	0	0	111.6	A649 A656	A649-H652 PolarHBondContact O-N 2.83Å; H652-A656 WeakPolarHBondContact O-CB 3.25Å; H652-A656 PolarHBondContact O-N 3.29Å
653	L	43.7	Very low	42.7	Very low	123 Å²	123	102.6 Å²	102.6	64%	0.644	55%	0.554	S	S	*	*	H	α-helix	trans	-67.7	-43.6	177.4	-144	91.5	0	0	0	112.4	A649 G650 R651 A656 L657	A649-L653 PolarHBondContact O-N 2.96Å; G650-L653 WeakPolarHBondContact O-CB 3.28Å; G650-L653 PolarHBondContact O-N 2.94Å; R651-L653 VanDerWaalsContact C-N 3.31Å; L653-A656 PolarHBondContact O-N 3.2Å; L653-L657 WeakPolarHBondContact O-CB 3.37Å; L653-L657 PolarHBondContact O-N 3.31Å
654	Q	46.6	Very low	43.8	Very low	146 Å²	146	98.5 Å²	98.5	68%	0.682	53%	0.53	S	S	*	.	H	α-helix	trans	-71.8	-41	-179.5	-159.9	175.3	13.2	0	0	111.9	G650 L657 Q658	G650-Q654 PolarHBondContact O-N 2.72Å; Q654-L657 PolarHBondContact O-N 3.32Å; Q654-Q658 WeakPolarHBondContact O-CB 3.44Å; Q654-Q658 PolarHBondContact O-N 2.86Å
655	G	51.6	Low	44.5	Very low	25 Å²	25	98.1 Å²	98.1	26%	0.258	52%	0.519	S	S	.	.	H	α-helix	trans	-64.8	-37.6	171	0	0	0	0	0	112.6	R651 Q659	R651-G655 PolarHBondContact O-N 3.01Å; G655-Q659 WeakPolarHBondContact O-CB 3.48Å; G655-Q659 WeakPolarHBondContact O-CG 3.2Å; G655-Q659 PolarHBondContact O-N 2.77Å
656	A	51.7	Low	45.3	Very low	39 Å²	39	99 Å²	99	32%	0.322	52%	0.516	S	S	.	.	H	α-helix	trans	-67.3	-42.5	173.6	0	0	0	0	0	111.7	H652 L653 Q658 Q659 D660	H652-A656 WeakPolarHBondContact O-CB 3.25Å; H652-A656 PolarHBondContact O-N 3.29Å; L653-A656 PolarHBondContact O-N 3.2Å; A656-Q658 VanDerWaalsContact C-N 3.31Å; A656-Q658 PolarHBondContact O-N 2.84Å; A656-Q659 CarbonylContact O-C 3.55Å; A656-Q659 PolarHBondContact O-N 2.65Å; A656-D660 WeakPolarHBondContact O-CB 3.48Å; A656-D660 VanDerWaalsContact O-CG 3.29Å; A656-D660 PolarHBondContact O-N 2.7Å
657	L	48.9	Very low	46.2	Very low	89 Å²	89	96.4 Å²	96.4	47%	0.466	51%	0.506	S	S	.	.	H	α-helix	trans	-63	-39.8	177	-149.5	100.2	0	0	0	111.3	L653 Q654 D660 L661	L653-L657 WeakPolarHBondContact O-CB 3.37Å; L653-L657 PolarHBondContact O-N 3.31Å; Q654-L657 PolarHBondContact O-N 3.32Å; L657-D660 PolarHBondContact O-N 2.8Å; L657-L661 VanDerWaalsContact O-CB 3.27Å; L657-L661 WeakPolarHBondContact O-CB 3.01Å; L657-L661 PolarHBondContact O-N 3.19Å
658	Q	48.1	Very low	46.5	Very low	84 Å²	84	104.4 Å²	104.4	39%	0.393	52%	0.521	S	S	.	.	H	α-helix	trans	-68.3	-38.3	176.3	-161.1	177.2	9.5	0	0	111.3	Q654 A656 Q662	Q654-Q658 WeakPolarHBondContact O-CB 3.44Å; Q654-Q658 PolarHBondContact O-N 2.86Å; A656-Q658 VanDerWaalsContact C-N 3.31Å; A656-Q658 PolarHBondContact O-N 2.84Å; Q658-Q662 WeakPolarHBondContact O-CB 3.48Å; Q658-Q662 WeakPolarHBondContact O-CG 3.47Å; Q658-Q662 PolarHBondContact O-N 2.88Å
659	Q	53.8	Low	46.9	Very low	128 Å²	128	103.5 Å²	103.5	60%	0.598	51%	0.51	S	S	*	.	H	α-helix	trans	-69.9	-35.8	173	-74.4	173	15.6	0	0	112.8	G655 A656 Q662 R663	G655-Q659 WeakPolarHBondContact O-CB 3.48Å; G655-Q659 WeakPolarHBondContact O-CG 3.2Å; G655-Q659 PolarHBondContact O-N 2.77Å; A656-Q659 CarbonylContact O-C 3.55Å; A656-Q659 PolarHBondContact O-N 2.65Å; Q659-Q662 WeakPolarHBondContact O-CB 3.27Å; Q659-Q662 PolarHBondContact O-N 3.28Å; Q659-R663 WeakPolarHBondContact O-CB 3.44Å; Q659-R663 PolarHBondContact O-N 2.83Å
660	D	51.3	Low	47.1	Very low	73 Å²	73	107.6 Å²	107.6	39%	0.39	52%	0.521	S	S	.	.	H	α-helix	trans	-73.9	-33.8	176.9	-74.4	-27	0	0	0	111.2	A656 L657 R663 C664 L671	A656-D660 WeakPolarHBondContact O-CB 3.48Å; A656-D660 VanDerWaalsContact O-CG 3.29Å; A656-D660 PolarHBondContact O-N 2.7Å; L657-D660 PolarHBondContact O-N 2.8Å; D660-R663 PolarHBondContact O-N 3.27Å; D660-C664 WeakPolarHBondContact O-CB 3.29Å; D660-C664 PolarHBondContact O-N 2.77Å; D660-C664 PolarHBondContact O-SG 3.45Å; D660-L671 HydrophobicContact CB-CD2 3.79Å
661	L	48.1	Very low	47.5	Very low	86 Å²	86	109.5 Å²	109.5	45%	0.45	52%	0.524	S	S	.	.	H	α-helix	trans	-64	-45.7	168.9	-169.8	86.7	0	0	0	109.9	L657 R663 C664 M665 L671	L657-L661 VanDerWaalsContact O-CB 3.27Å; L657-L661 WeakPolarHBondContact O-CB 3.01Å; L657-L661 PolarHBondContact O-N 3.19Å; L661-R663 VanDerWaalsContact C-N 3.31Å; L661-R663 PolarHBondContact O-N 3.4Å; L661-C664 PolarHBondContact O-N 2.95Å; L661-M665 WeakPolarHBondContact O-CB 3.38Å; L661-M665 VanDerWaalsContact O-CG 3.3Å; L661-M665 WeakPolarHBondContact O-CG 3.38Å; L661-M665 PolarHBondContact O-N 3.48Å; L661-L671 HydrophobicContact CB-CD1 3.54Å; L661-L671 HydrophobicContact CD1-CD1 3.5Å; L661-L671 HydrophobicContact CG-CD1 4.1Å
662	Q	50.3	Low	48.3	Very low	80 Å²	80	108.2 Å²	108.2	37%	0.374	53%	0.53	S	S	.	.	H	α-helix	trans	-60.2	-39.8	174.3	-76.2	171.6	8.3	0	0	112.2	Q658 Q659 R666	Q658-Q662 WeakPolarHBondContact O-CB 3.48Å; Q658-Q662 WeakPolarHBondContact O-CG 3.47Å; Q658-Q662 PolarHBondContact O-N 2.88Å; Q659-Q662 WeakPolarHBondContact O-CB 3.27Å; Q659-Q662 PolarHBondContact O-N 3.28Å; Q662-R666 WeakPolarHBondContact O-CB 3.23Å; Q662-R666 VanDerWaalsContact O-CG 3.29Å; Q662-R666 WeakPolarHBondContact O-CG 3.43Å; Q662-R666 PolarHBondContact O-N 3.19Å; Q662-R666 VanDerWaalsContact O-N 3.09Å
663	R	52.5	Low	48.3	Very low	176 Å²	176	107.2 Å²	107.2	66%	0.664	53%	0.53	S	S	*	.	H	α-helix	trans	-66.7	-48.8	176.3	-169.5	176.6	-172.3	160.1	1.3	110.6	Q659 D660 L661 M665 R666 T667	Q659-R663 WeakPolarHBondContact O-CB 3.44Å; Q659-R663 PolarHBondContact O-N 2.83Å; D660-R663 PolarHBondContact O-N 3.27Å; L661-R663 VanDerWaalsContact C-N 3.31Å; L661-R663 PolarHBondContact O-N 3.4Å; R663-M665 PolarHBondContact O-N 2.9Å; R663-R666 PolarHBondContact O-N 3.26Å; R663-R666 VanDerWaalsContact O-N 3.15Å; R663-T667 PolarHBondContact O-N 2.81Å; R663-T667 PolarHBondContact O-OG1 3.3Å
664	C	52.1	Low	48.3	Very low	20 Å²	20	106.5 Å²	106.5	14%	0.135	54%	0.535	C	S	.	.	H	α-helix	trans	-62.2	-39.5	179.8	-78.7	0	0	0	0	112.7	D660 L661 T667 R668 S669 L671	D660-C664 WeakPolarHBondContact O-CB 3.29Å; D660-C664 PolarHBondContact O-N 2.77Å; D660-C664 PolarHBondContact O-SG 3.45Å; L661-C664 PolarHBondContact O-N 2.95Å; C664-T667 WeakPolarHBondContact CA-OG1 3.03Å; C664-T667 CarbonylContact O-C 3.58Å; C664-T667 PolarHBondContact O-N 3.26Å; C664-T667 PolarHBondContact O-OG1 3.32Å; C664-R668 CarbonylContact O-C 3.59Å; C664-R668 VanDerWaalsContact O-CA 3.32Å; C664-R668 WeakPolarHBondContact O-CA 2.96Å; C664-R668 PolarHBondContact O-N 3.28Å; C664-S669 WeakPolarHBondContact CA-OG 3.37Å; C664-S669 VanDerWaalsContact CB-O 3.3Å; C664-S669 WeakPolarHBondContact CB-O 3.47Å; C664-S669 PolarHBondContact O-N 3.47Å; C664-S669 PolarHBondContact SG-OG 3.36Å; C664-L671 HydrophobicContact CB-CG 4.35Å
665	M	44.5	Very low	48	Very low	107 Å²	107	107 Å²	107	53%	0.527	54%	0.542	S	S	.	.	H	α-helix	trans	-69.6	-35.4	174.2	-69.8	-146.6	-61.1	0	0	112.5	M93 L661 R663	M93-M665 HydrophobicContact CE-CE 3.91Å; M93-M665 HydrophobicContact SD-CE 3.96Å; L661-M665 WeakPolarHBondContact O-CB 3.38Å; L661-M665 VanDerWaalsContact O-CG 3.3Å; L661-M665 WeakPolarHBondContact O-CG 3.38Å; L661-M665 PolarHBondContact O-N 3.48Å; R663-M665 PolarHBondContact O-N 2.9Å
666	R	45.1	Very low	47.3	Very low	176 Å²	176	113.3 Å²	113.3	66%	0.664	57%	0.569	S	S	*	*	H	α-helix	trans	-68.6	-34.1	172.9	-77.6	176	176.5	164.8	0	112.3	E96 Q662 R663	E96-R666 IonicContact OE1-NH2 3.11Å; E96-R666 PolarHBondContact OE1-NH2 3.41Å; Q662-R666 WeakPolarHBondContact O-CB 3.23Å; Q662-R666 VanDerWaalsContact O-CG 3.29Å; Q662-R666 WeakPolarHBondContact O-CG 3.43Å; Q662-R666 PolarHBondContact O-N 3.19Å; Q662-R666 VanDerWaalsContact O-N 3.09Å; R663-R666 PolarHBondContact O-N 3.26Å; R663-R666 VanDerWaalsContact O-N 3.15Å
667	T	50.2	Low	46.4	Very low	89 Å²	89	118.5 Å²	118.5	55%	0.546	59%	0.592	S	S	.	*	H	α-helix	trans	-95.7	-1.9	-179.1	54.2	0	0	0	0	114.4	R663 C664 S669	R663-T667 PolarHBondContact O-N 2.81Å; R663-T667 PolarHBondContact O-OG1 3.3Å; C664-T667 WeakPolarHBondContact CA-OG1 3.03Å; C664-T667 CarbonylContact O-C 3.58Å; C664-T667 PolarHBondContact O-N 3.26Å; C664-T667 PolarHBondContact O-OG1 3.32Å; T667-S669 PolarHBondContact OG1-OG 2.73Å
668	R	41.2	Very low	45.8	Very low	240 Å²	240	119.8 Å²	119.8	91%	0.906	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	54.3	44.6	-173.5	-57.8	-180	177.2	177.1	-1.6	113.3	C664	C664-R668 CarbonylContact O-C 3.59Å; C664-R668 VanDerWaalsContact O-CA 3.32Å; C664-R668 WeakPolarHBondContact O-CA 2.96Å; C664-R668 PolarHBondContact O-N 3.28Å
669	S	47.4	Very low	45.1	Very low	61 Å²	61	122 Å²	122	43%	0.427	62%	0.624	S	S	.	*			trans	-116.9	160.3	177.3	55	0	0	0	0	111.7	C664 T667	C664-S669 WeakPolarHBondContact CA-OG 3.37Å; C664-S669 VanDerWaalsContact CB-O 3.3Å; C664-S669 WeakPolarHBondContact CB-O 3.47Å; C664-S669 PolarHBondContact O-N 3.47Å; C664-S669 PolarHBondContact SG-OG 3.36Å; T667-S669 PolarHBondContact OG1-OG 2.73Å
670	L	42.3	Very low	44.3	Very low	160 Å²	160	121 Å²	121	84%	0.838	63%	0.63	S	S	*	*			trans	-88.5	142.2	176.7	-70	169.5	0	0	0	111	L672	L670-L672 PolarHBondContact O-N 3.08Å
671	L	46.8	Very low	43.7	Very low	65 Å²	65	123.9 Å²	123.9	34%	0.34	65%	0.649	S	S	.	*			trans	-80.2	112.9	175.9	-114.8	171.9	0	0	0	109.5	D660 L661 C664	D660-L671 HydrophobicContact CB-CD2 3.79Å; L661-L671 HydrophobicContact CB-CD1 3.54Å; L661-L671 HydrophobicContact CD1-CD1 3.5Å; L661-L671 HydrophobicContact CG-CD1 4.1Å; C664-L671 HydrophobicContact CB-CG 4.35Å
672	L	54.4	Low	43	Very low	151 Å²	151	124.5 Å²	124.5	79%	0.791	66%	0.658	S	S	*	*			trans	-108	131.4	171.9	-68.8	169.2	0	0	0	109	L670 S674	L670-L672 PolarHBondContact O-N 3.08Å; L672-S674 PolarHBondContact O-N 2.84Å
673	N	43.7	Very low	42.7	Very low	133 Å²	133	126.2 Å²	126.2	71%	0.711	68%	0.677	S	S	*	*			trans	-65.9	130.9	-179.5	-149.8	4.2	0	0	0	109.5	N675	N673-N675 PolarHBondContact O-N 3.41Å
674	S	43.5	Very low	42.5	Very low	108 Å²	108	124.8 Å²	124.8	76%	0.755	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	16	-155.6	34.8	0	0	0	0	118	L672	L672-S674 PolarHBondContact O-N 2.84Å
675	N	41.5	Very low	42.2	Very low	156 Å²	156	127.3 Å²	127.3	83%	0.834	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.8	21.9	-177.7	-72.9	-19.4	0	0	0	115	N673	N673-N675 PolarHBondContact O-N 3.41Å
676	L	35.8	Very low	42.4	Very low	158 Å²	158	127 Å²	127	83%	0.827	70%	0.702	S	S	*	*	S	Bend	trans	-123	128.2	170	-68.9	169.6	0	0	0	109
677	D	33.5	Very low	42.6	Very low	148 Å²	148	121.1 Å²	121.1	79%	0.791	69%	0.691	S	S	*	*			trans	-49.1	142.6	174.9	-76.4	-40.3	0	0	0	110.3	V679	D677-V679 PolarHBondContact O-N 2.8Å
678	P	35.8	Very low	42.7	Very low	117 Å²	117	124.1 Å²	124.1	76%	0.76	70%	0.699	S	S	*	*			trans	-61.7	104.4	-179.6	24.9	-32.2	0	0	0	109.3
679	V	34.2	Very low	43.4	Very low	129 Å²	129	115.7 Å²	115.7	78%	0.782	68%	0.681	S	S	*	*			trans	-61.2	126.7	163.6	179.1	0	0	0	0	106.1	D677 V681	D677-V679 PolarHBondContact O-N 2.8Å; V679-V681 PolarHBondContact O-N 2.93Å
680	P	37.2	Very low	43.5	Very low	109 Å²	109	119.1 Å²	119.1	71%	0.708	68%	0.684	S	S	*	*			trans	-56.1	137.5	-179.2	21.6	-31.2	0	0	0	109.4	P682	P680-P682 VanDerWaalsContact O-N 3.17Å
681	V	37.3	Very low	44.1	Very low	133 Å²	133	122.2 Å²	122.2	81%	0.806	69%	0.685	S	S	*	*			trans	-44.5	124.3	172.7	-175.6	0	0	0	0	107.6	V679	V679-V681 PolarHBondContact O-N 2.93Å
682	P	33.8	Very low	45	Very low	98 Å²	98	122.6 Å²	122.6	64%	0.636	69%	0.687	S	S	*	*			trans	-51.5	137.2	172.9	-22.9	31.6	0	0	0	108.2	P680	P680-P682 VanDerWaalsContact O-N 3.17Å
683	P	43.7	Very low	45.1	Very low	117 Å²	117	120.5 Å²	120.5	76%	0.76	68%	0.676	S	S	*	*			trans	-53.3	154.3	177.7	24.1	-33	0	0	0	109.7	V685	P683-V685 PolarHBondContact O-N 2.95Å
684	V	49.7	Very low	45.7	Very low	145 Å²	145	119.2 Å²	119.2	88%	0.879	67%	0.669	S	S	*	*			trans	-35.7	113	178.7	175.5	0	0	0	0	109	D686	V684-D686 PolarHBondContact O-N 3.23Å
685	V	44.4	Very low	46.7	Very low	74 Å²	74	114.8 Å²	114.8	45%	0.448	64%	0.638	S	S	.	*			trans	-55.3	117.6	179.6	168.5	0	0	0	0	107.3	P683 A687 W690	P683-V685 PolarHBondContact O-N 2.95Å; V685-A687 PolarHBondContact O-N 3.43Å; V685-W690 HydrophobicContact CB-CZ2 4.16Å; V685-W690 HydrophobicContact CG1-CD2 3.84Å; V685-W690 HydrophobicContact CG1-CE3 4.4Å; V685-W690 HydrophobicContact CG1-CG 4.42Å; V685-W690 HydrophobicContact CG1-CH2 3.87Å; V685-W690 HydrophobicContact CG1-CZ2 3.2Å; V685-W690 HydrophobicContact CG1-CZ3 4.41Å; V685-W690 HydrophobicContact CG2-CH2 4.39Å; V685-W690 HydrophobicContact CG2-CZ2 3.87Å
686	D	48.2	Very low	47.8	Very low	100 Å²	100	110.8 Å²	110.8	54%	0.535	62%	0.617	S	S	.	*			trans	-67.5	101.1	171.1	-170.2	0.1	0	0	0	108	V684 E688 A689	V684-D686 PolarHBondContact O-N 3.23Å; D686-E688 PolarHBondContact O-N 3.44Å; D686-E688 PolarHBondContact OD1-N 2.85Å; D686-A689 HydrophobicContact CB-CB 4.29Å; D686-A689 WeakPolarHBondContact O-CB 3.36Å; D686-A689 PolarHBondContact O-N 2.84Å
687	A	49.3	Very low	49.2	Very low	53 Å²	53	108 Å²	108	44%	0.438	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.1	-14.3	-179.6	0	0	0	0	0	112.4	V685	V685-A687 PolarHBondContact O-N 3.43Å
688	E	53.4	Low	50.5	Low	151 Å²	151	105 Å²	105	71%	0.706	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-14.9	174.5	-59	-168.6	176	0	0	113.1	D686	D686-E688 PolarHBondContact O-N 3.44Å; D686-E688 PolarHBondContact OD1-N 2.85Å
689	A	55.6	Low	52.1	Low	64 Å²	64	101.9 Å²	101.9	53%	0.529	56%	0.558	S	S	.	*	S	Bend	trans	-82.1	-16.1	177.3	0	0	0	0	0	113.3	D686 R691	D686-A689 HydrophobicContact CB-CB 4.29Å; D686-A689 WeakPolarHBondContact O-CB 3.36Å; D686-A689 PolarHBondContact O-N 2.84Å; A689-R691 PolarHBondContact O-N 3.18Å
690	W	49.3	Very low	53.8	Low	132 Å²	132	97.6 Å²	97.6	50%	0.5	53%	0.532	S	S	.	.			trans	-94.4	98.3	-171.3	-71.8	23.2	0	0	0	110.1	V685 D692	V685-W690 HydrophobicContact CB-CZ2 4.16Å; V685-W690 HydrophobicContact CG1-CD2 3.84Å; V685-W690 HydrophobicContact CG1-CE3 4.4Å; V685-W690 HydrophobicContact CG1-CG 4.42Å; V685-W690 HydrophobicContact CG1-CH2 3.87Å; V685-W690 HydrophobicContact CG1-CZ2 3.2Å; V685-W690 HydrophobicContact CG1-CZ3 4.41Å; V685-W690 HydrophobicContact CG2-CH2 4.39Å; V685-W690 HydrophobicContact CG2-CZ2 3.87Å; W690-D692 WeakPolarHBondContact CB-OD1 3.42Å
691	R	55.4	Low	55	Low	226 Å²	226	94.4 Å²	94.4	85%	0.853	51%	0.514	S	S	*	.			trans	-93.5	9.2	-177.4	-57.2	-170.5	-160.4	-165.8	5	114.1	A689	A689-R691 PolarHBondContact O-N 3.18Å
692	D	65.1	Low	55.7	Low	72 Å²	72	98.5 Å²	98.5	39%	0.385	52%	0.516	S	S	.	.	S	Bend	trans	-75.2	146.5	178.8	56.6	-57.4	0	0	0	111.8	W690 L694 S695 N696	W690-D692 WeakPolarHBondContact CB-OD1 3.42Å; D692-L694 VanDerWaalsContact C-N 3.27Å; D692-L694 PolarHBondContact O-N 2.98Å; D692-S695 PolarHBondContact O-N 2.97Å; D692-S695 VanDerWaalsContact OD1-CB 3.28Å; D692-S695 WeakPolarHBondContact OD1-CB 3.34Å; D692-S695 PolarHBondContact OD1-OG 3.47Å; D692-S695 VanDerWaalsContact OD1-OG 3.09Å; D692-S695 WeakPolarHBondContact OD2-CB 3.47Å; D692-S695 PolarHBondContact OD2-N 3.35Å; D692-S695 PolarHBondContact OD2-OG 2.87Å; D692-N696 PolarHBondContact O-N 3.13Å; D692-N696 VanDerWaalsContact O-N 3.08Å
693	L	56.9	Low	56.8	Low	107 Å²	107	103 Å²	103	56%	0.56	52%	0.52	S	S	*	.	H	α-helix	trans	-59.1	-35.4	-173.4	-90.1	153.6	0	0	0	113.3	R697 W712 E716	L693-R697 WeakPolarHBondContact O-CB 3.4Å; L693-R697 PolarHBondContact O-N 3Å; L693-R697 VanDerWaalsContact O-N 3.07Å; L693-W712 HydrophobicContact CD2-CZ2 4.35Å; L693-E716 WeakPolarHBondContact CD2-OE1 3.31Å
694	L	56.7	Low	57.7	Low	107 Å²	107	99.3 Å²	99.3	56%	0.56	50%	0.503	S	S	*	.	H	α-helix	trans	-69.2	-42.7	179.4	-169.9	81.4	0	0	0	111.5	D692 R697 L698	D692-L694 VanDerWaalsContact C-N 3.27Å; D692-L694 PolarHBondContact O-N 2.98Å; L694-R697 WeakPolarHBondContact O-CB 3.45Å; L694-R697 PolarHBondContact O-N 3.45Å; L694-L698 HydrophobicContact CG-CD1 4.32Å; L694-L698 WeakPolarHBondContact O-CG 3.5Å; L694-L698 PolarHBondContact O-N 3.16Å
695	S	64.6	Low	58.4	Low	15 Å²	15	94.1 Å²	94.1	11%	0.105	48%	0.479	C	S	.	.	H	α-helix	trans	-69.3	-39.2	179.7	-62.2	0	0	0	0	112	D692 R697 L698 T699	D692-S695 PolarHBondContact O-N 2.97Å; D692-S695 VanDerWaalsContact OD1-CB 3.28Å; D692-S695 WeakPolarHBondContact OD1-CB 3.34Å; D692-S695 PolarHBondContact OD1-OG 3.47Å; D692-S695 VanDerWaalsContact OD1-OG 3.09Å; D692-S695 WeakPolarHBondContact OD2-CB 3.47Å; D692-S695 PolarHBondContact OD2-N 3.35Å; D692-S695 PolarHBondContact OD2-OG 2.87Å; S695-R697 PolarHBondContact O-N 2.84Å; S695-L698 PolarHBondContact O-N 3.04Å; S695-T699 VanDerWaalsContact O-CB 3.31Å; S695-T699 WeakPolarHBondContact O-CB 3.3Å; S695-T699 PolarHBondContact O-N 2.77Å; S695-T699 PolarHBondContact O-OG1 3.47Å
696	N	64.1	Low	59	Low	72 Å²	72	98.1 Å²	98.1	39%	0.385	49%	0.493	S	S	.	.	H	α-helix	trans	-61.2	-43.8	171.1	-79	-33	0	0	0	112	D692 L698 T699 T700	D692-N696 PolarHBondContact O-N 3.13Å; D692-N696 VanDerWaalsContact O-N 3.08Å; N696-L698 PolarHBondContact O-N 3.49Å; N696-T699 PolarHBondContact O-N 3.47Å; N696-T700 WeakPolarHBondContact O-CG2 3.05Å; N696-T700 PolarHBondContact O-N 2.66Å; N696-T700 PolarHBondContact O-OG1 3.34Å; N696-T700 VanDerWaalsContact O-OG1 3.06Å
697	R	66.3	Low	59.7	Low	98 Å²	98	101 Å²	101	37%	0.37	50%	0.503	S	S	.	.	H	α-helix	trans	-58.8	-46.1	176.2	178.8	178.7	151.9	-172.2	-5.7	112.7	L693 L694 S695 T700 A701 W712	L693-R697 WeakPolarHBondContact O-CB 3.4Å; L693-R697 PolarHBondContact O-N 3Å; L693-R697 VanDerWaalsContact O-N 3.07Å; L694-R697 WeakPolarHBondContact O-CB 3.45Å; L694-R697 PolarHBondContact O-N 3.45Å; S695-R697 PolarHBondContact O-N 2.84Å; R697-T700 PolarHBondContact O-OG1 3.39Å; R697-A701 WeakPolarHBondContact O-CB 3.41Å; R697-A701 PolarHBondContact O-N 3.24Å; R697-A701 VanDerWaalsContact O-N 3.13Å; R697-W712 HydrophobicContact CB-CE3 4.29Å; R697-W712 HydrophobicContact CB-CH2 3.43Å; R697-W712 VanDerWaalsContact CB-CH2 3.43Å; R697-W712 HydrophobicContact CB-CZ2 4.1Å; R697-W712 HydrophobicContact CB-CZ3 3.52Å; R697-W712 HydrophobicContact CG-CE3 4.17Å; R697-W712 HydrophobicContact CG-CH2 3.94Å; R697-W712 HydrophobicContact CG-CZ3 3.49Å; R697-W712 VanDerWaalsContact CG-CZ3 3.49Å
698	L	59.7	Low	60.5	Low	86 Å²	86	100.2 Å²	100.2	45%	0.45	50%	0.496	S	S	.	.	H	α-helix	trans	-70.3	-37.9	-178.8	-71.3	170.8	0	0	0	110.5	L694 S695 N696 A701 W702	L694-L698 HydrophobicContact CG-CD1 4.32Å; L694-L698 WeakPolarHBondContact O-CG 3.5Å; L694-L698 PolarHBondContact O-N 3.16Å; S695-L698 PolarHBondContact O-N 3.04Å; N696-L698 PolarHBondContact O-N 3.49Å; L698-A701 PolarHBondContact O-N 2.84Å; L698-W702 WeakPolarHBondContact O-CB 3.06Å; L698-W702 PolarHBondContact O-N 3.45Å
699	T	70.1	Confident	61.3	Low	52 Å²	52	96.6 Å²	96.6	32%	0.319	48%	0.476	S	S	.	.	H	α-helix	trans	-68.9	-39.2	178.9	-52.2	0	0	0	0	112.2	S695 N696 W702 R703	S695-T699 VanDerWaalsContact O-CB 3.31Å; S695-T699 WeakPolarHBondContact O-CB 3.3Å; S695-T699 PolarHBondContact O-N 2.77Å; S695-T699 PolarHBondContact O-OG1 3.47Å; N696-T699 PolarHBondContact O-N 3.47Å; T699-W702 PolarHBondContact O-N 2.54Å; T699-R703 PolarHBondContact O-N 2.93Å
700	T	68.3	Low	61.7	Low	39 Å²	39	97 Å²	97	24%	0.239	47%	0.469	C	S	.	.	H	α-helix	trans	-67.7	-39.6	174.8	53.6	0	0	0	0	111.9	N696 R697 W702 G704 W712	N696-T700 WeakPolarHBondContact O-CG2 3.05Å; N696-T700 PolarHBondContact O-N 2.66Å; N696-T700 PolarHBondContact O-OG1 3.34Å; N696-T700 VanDerWaalsContact O-OG1 3.06Å; R697-T700 PolarHBondContact O-OG1 3.39Å; T700-W702 VanDerWaalsContact C-N 3.31Å; T700-W702 PolarHBondContact O-N 2.97Å; T700-G704 WeakPolarHBondContact O-CA 3.49Å; T700-G704 PolarHBondContact O-N 3.2Å; T700-W712 HydrophobicContact CG2-CG 4.17Å
701	A	62.5	Low	62.5	Low	41 Å²	41	97.5 Å²	97.5	34%	0.339	48%	0.477	S	S	.	.	H	α-helix	trans	-62	-37.8	172.7	0	0	0	0	0	112.9	R697 L698 W709	R697-A701 WeakPolarHBondContact O-CB 3.41Å; R697-A701 PolarHBondContact O-N 3.24Å; R697-A701 VanDerWaalsContact O-N 3.13Å; L698-A701 PolarHBondContact O-N 2.84Å; A701-W709 HydrophobicContact CB-CB 4.34Å; A701-W709 HydrophobicContact CB-CG 4.09Å
702	W	52.7	Low	63.3	Low	220 Å²	220	88.9 Å²	88.9	83%	0.833	44%	0.444	S	S	*	.	H	α-helix	trans	-83.8	-39	-174.7	-134	-64.4	0	0	0	113.9	L698 T699 T700	L698-W702 WeakPolarHBondContact O-CB 3.06Å; L698-W702 PolarHBondContact O-N 3.45Å; T699-W702 PolarHBondContact O-N 2.54Å; T700-W702 VanDerWaalsContact C-N 3.31Å; T700-W702 PolarHBondContact O-N 2.97Å
703	R	58.1	Low	63.3	Low	192 Å²	192	89.5 Å²	89.5	73%	0.725	44%	0.442	S	S	*	.	H	α-helix	trans	-90.9	-34.4	-179	-75.7	-167.2	-171.6	-161.8	7.5	114	T699	T699-R703 PolarHBondContact O-N 2.93Å
704	G	61.1	Low	63.6	Low	39 Å²	39	89.1 Å²	89.1	40%	0.402	44%	0.437	S	S	.	.	S	Bend	trans	-98.1	-1.5	-171.4	0	0	0	0	0	114.9	T700 A708	T700-G704 WeakPolarHBondContact O-CA 3.49Å; T700-G704 PolarHBondContact O-N 3.2Å; G704-A708 WeakPolarHBondContact O-CB 3.35Å
705	G	65.6	Low	64	Low	37 Å²	37	88.6 Å²	88.6	38%	0.381	43%	0.432	S	S	.	.	H	α-helix	trans	66.9	-171.2	-176.4	0	0	0	0	0	113.4	E707 W709	G705-E707 VanDerWaalsContact C-N 3.32Å; G705-E707 PolarHBondContact O-N 3.18Å; G705-W709 PolarHBondContact O-N 3.06Å
706	Q	55.3	Low	64	Low	157 Å²	157	93 Å²	93	73%	0.734	45%	0.45	S	S	*	.	H	α-helix	trans	-64.6	-33.2	-172	-171.1	171.3	-9.4	0	0	113.1	L710	Q706-L710 HydrophobicContact CG-CD1 4.08Å; Q706-L710 WeakPolarHBondContact O-CB 3.3Å; Q706-L710 WeakPolarHBondContact O-CD1 3.26Å; Q706-L710 PolarHBondContact O-N 3.14Å; Q706-L710 VanDerWaalsContact O-N 3.11Å
707	E	64.3	Low	63.5	Low	162 Å²	162	98.8 Å²	98.8	76%	0.757	47%	0.467	S	S	*	.	H	α-helix	trans	-74.3	-46.2	-177.4	-66.9	-179.3	169.3	0	0	112.5	G705 W709 L710 E711	G705-E707 VanDerWaalsContact C-N 3.32Å; G705-E707 PolarHBondContact O-N 3.18Å; E707-W709 VanDerWaalsContact C-N 3.29Å; E707-W709 PolarHBondContact O-N 3.03Å; E707-L710 WeakPolarHBondContact O-CB 3.31Å; E707-L710 PolarHBondContact O-N 3.09Å; E707-L710 VanDerWaalsContact O-N 3.13Å; E707-E711 PolarHBondContact O-N 3.47Å
708	A	65.6	Low	63	Low	35 Å²	35	95 Å²	95	29%	0.289	46%	0.459	S	S	.	.	H	α-helix	trans	-66.5	-31.9	177.5	0	0	0	0	0	112.4	G704 W712	G704-A708 WeakPolarHBondContact O-CB 3.35Å; A708-W712 WeakPolarHBondContact O-CB 3.32Å; A708-W712 PolarHBondContact O-N 3.05Å
709	W	69.8	Low	62.9	Low	76 Å²	76	94.1 Å²	94.1	29%	0.288	46%	0.464	S	S	.	.	H	α-helix	trans	-67.2	-40.8	171.5	178.7	76	0	0	0	112.3	A701 G705 E707 W712 W713	A701-W709 HydrophobicContact CB-CB 4.34Å; A701-W709 HydrophobicContact CB-CG 4.09Å; G705-W709 PolarHBondContact O-N 3.06Å; E707-W709 VanDerWaalsContact C-N 3.29Å; E707-W709 PolarHBondContact O-N 3.03Å; W709-W712 PolarHBondContact O-N 2.83Å; W709-W713 HydrophobicContact CH2-CG 4.49Å; W709-W713 HydrophobicContact CZ2-CD2 4.44Å; W709-W713 HydrophobicContact CZ2-CG 4.37Å; W709-W713 WeakPolarHBondContact O-CB 3.43Å; W709-W713 PolarHBondContact O-N 3.2Å
710	L	64.9	Low	62.2	Low	73 Å²	73	94.3 Å²	94.3	38%	0.382	46%	0.463	S	S	.	.	H	α-helix	trans	-63	-41.9	176	-105.6	137.2	0	0	0	111.5	Q706 E707 W713 Q714	Q706-L710 HydrophobicContact CG-CD1 4.08Å; Q706-L710 WeakPolarHBondContact O-CB 3.3Å; Q706-L710 WeakPolarHBondContact O-CD1 3.26Å; Q706-L710 PolarHBondContact O-N 3.14Å; Q706-L710 VanDerWaalsContact O-N 3.11Å; E707-L710 WeakPolarHBondContact O-CB 3.31Å; E707-L710 PolarHBondContact O-N 3.09Å; E707-L710 VanDerWaalsContact O-N 3.13Å; L710-W713 PolarHBondContact O-N 3.23Å; L710-Q714 WeakPolarHBondContact O-CB 3.32Å; L710-Q714 WeakPolarHBondContact O-CG 3.28Å; L710-Q714 PolarHBondContact O-N 3.16Å
711	E	66	Low	61.8	Low	142 Å²	142	97.5 Å²	97.5	66%	0.664	48%	0.475	S	S	*	.	H	α-helix	trans	-64.7	-46.9	175.1	-73	-174.3	160.4	0	0	112.2	E707 W713 Q714 E715	E707-E711 PolarHBondContact O-N 3.47Å; E711-W713 VanDerWaalsContact C-N 3.32Å; E711-W713 PolarHBondContact O-N 2.78Å; E711-Q714 PolarHBondContact O-N 3.19Å; E711-E715 PolarHBondContact O-N 2.94Å
712	W	72.1	Confident	61.8	Low	44 Å²	44	99 Å²	99	17%	0.167	49%	0.487	C	S	.	.	H	α-helix	trans	-59.5	-42.7	175.3	-175.5	86.1	0	0	0	111.9	L693 R697 T700 A708 W709 E715 E716	L693-W712 HydrophobicContact CD2-CZ2 4.35Å; R697-W712 HydrophobicContact CB-CE3 4.29Å; R697-W712 HydrophobicContact CB-CH2 3.43Å; R697-W712 VanDerWaalsContact CB-CH2 3.43Å; R697-W712 HydrophobicContact CB-CZ2 4.1Å; R697-W712 HydrophobicContact CB-CZ3 3.52Å; R697-W712 HydrophobicContact CG-CE3 4.17Å; R697-W712 HydrophobicContact CG-CH2 3.94Å; R697-W712 HydrophobicContact CG-CZ3 3.49Å; R697-W712 VanDerWaalsContact CG-CZ3 3.49Å; T700-W712 HydrophobicContact CG2-CG 4.17Å; A708-W712 WeakPolarHBondContact O-CB 3.32Å; A708-W712 PolarHBondContact O-N 3.05Å; W709-W712 PolarHBondContact O-N 2.83Å; W712-E715 PolarHBondContact O-N 3.5Å; W712-E716 HydrophobicContact CD2-CG 4.44Å; W712-E716 HydrophobicContact CE3-CG 4.45Å; W712-E716 HydrophobicContact CH2-CG 3.79Å; W712-E716 HydrophobicContact CZ2-CG 3.81Å; W712-E716 HydrophobicContact CZ3-CG 4.14Å; W712-E716 PolarHBondContact O-N 2.7Å
713	W	64.1	Low	62.3	Low	86 Å²	86	95 Å²	95	33%	0.326	48%	0.479	S	S	.	.	H	α-helix	trans	-68.2	-35	178.4	-170.2	-117.2	0	0	0	112.8	W709 L710 E711 R717	W709-W713 HydrophobicContact CH2-CG 4.49Å; W709-W713 HydrophobicContact CZ2-CD2 4.44Å; W709-W713 HydrophobicContact CZ2-CG 4.37Å; W709-W713 WeakPolarHBondContact O-CB 3.43Å; W709-W713 PolarHBondContact O-N 3.2Å; L710-W713 PolarHBondContact O-N 3.23Å; E711-W713 VanDerWaalsContact C-N 3.32Å; E711-W713 PolarHBondContact O-N 2.78Å; W713-R717 WeakPolarHBondContact O-CB 3.33Å; W713-R717 WeakPolarHBondContact O-CG 3.43Å; W713-R717 PolarHBondContact O-N 3.43Å
714	Q	64.7	Low	62.5	Low	99 Å²	99	91 Å²	91	46%	0.463	47%	0.467	S	S	.	.	H	α-helix	trans	-71.4	-29.7	172.8	-74.9	-156	20.9	0	0	113	L710 E711 A719	L710-Q714 WeakPolarHBondContact O-CB 3.32Å; L710-Q714 WeakPolarHBondContact O-CG 3.28Å; L710-Q714 PolarHBondContact O-N 3.16Å; E711-Q714 PolarHBondContact O-N 3.19Å; Q714-A719 PolarHBondContact O-N 3.29Å
715	E	64.7	Low	62.8	Low	96 Å²	96	96.2 Å²	96.2	45%	0.449	48%	0.475	S	S	.	.	H	α-helix	trans	-68.1	-45.2	171.2	-76.9	-157.4	118.2	0	0	112.8	E711 W712 G718 K724	E711-E715 PolarHBondContact O-N 2.94Å; W712-E715 PolarHBondContact O-N 3.5Å; E715-G718 PolarHBondContact O-N 3.47Å; E715-K724 WeakPolarHBondContact OE1-CE 3.5Å; E715-K724 IonicContact OE1-NZ 2.95Å; E715-K724 PolarHBondContact OE1-NZ 2.94Å
716	E	64.1	Low	62.9	Low	106 Å²	106	99.2 Å²	99.2	50%	0.495	48%	0.479	S	S	.	.	H	α-helix	trans	-68.7	-35.2	178.2	-82.4	-67.5	150	0	0	112.9	L693 W712 G718	L693-E716 WeakPolarHBondContact CD2-OE1 3.31Å; W712-E716 HydrophobicContact CD2-CG 4.44Å; W712-E716 HydrophobicContact CE3-CG 4.45Å; W712-E716 HydrophobicContact CH2-CG 3.79Å; W712-E716 HydrophobicContact CZ2-CG 3.81Å; W712-E716 HydrophobicContact CZ3-CG 4.14Å; W712-E716 PolarHBondContact O-N 2.7Å; E716-G718 PolarHBondContact O-N 3.28Å; E716-G718 VanDerWaalsContact O-N 3.16Å
717	R	52.7	Low	63.7	Low	194 Å²	194	94.4 Å²	94.4	73%	0.732	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	0.5	172.8	-70.3	-164.3	114.5	-176.1	2.6	114.1	W713 A719	W713-R717 WeakPolarHBondContact O-CB 3.33Å; W713-R717 WeakPolarHBondContact O-CG 3.43Å; W713-R717 PolarHBondContact O-N 3.43Å; R717-A719 VanDerWaalsContact C-N 3.26Å; R717-A719 PolarHBondContact O-N 2.68Å
718	G	56.2	Low	63.9	Low	20 Å²	20	91 Å²	91	21%	0.206	45%	0.452	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.9	11.7	174.9	0	0	0	0	0	115.3	E715 E716 N720 Q721	E715-G718 PolarHBondContact O-N 3.47Å; E716-G718 PolarHBondContact O-N 3.28Å; E716-G718 VanDerWaalsContact O-N 3.16Å; G718-N720 PolarHBondContact O-N 2.72Å; G718-Q721 VanDerWaalsContact O-CB 3.29Å; G718-Q721 WeakPolarHBondContact O-CB 3.3Å; G718-Q721 VanDerWaalsContact O-CG 3.27Å; G718-Q721 WeakPolarHBondContact O-CG 3.23Å; G718-Q721 PolarHBondContact O-N 2.78Å
719	A	57.3	Low	64.3	Low	66 Å²	66	97.6 Å²	97.6	55%	0.545	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-26.3	-179.5	0	0	0	0	0	112.7	Q714 R717	Q714-A719 PolarHBondContact O-N 3.29Å; R717-A719 VanDerWaalsContact C-N 3.26Å; R717-A719 PolarHBondContact O-N 2.68Å
720	N	56.7	Low	64.5	Low	57 Å²	57	101.6 Å²	101.6	31%	0.305	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	5.7	175.6	-76.6	-25.1	0	0	0	114.6	G718 A722 M723 K724	G718-N720 PolarHBondContact O-N 2.72Å; N720-A722 VanDerWaalsContact C-N 3.32Å; N720-A722 PolarHBondContact O-N 3.46Å; N720-M723 PolarHBondContact O-N 3.13Å; N720-K724 PolarHBondContact O-N 3.35Å
721	Q	58.9	Low	65	Low	106 Å²	106	104.1 Å²	104.1	50%	0.495	49%	0.492	S	S	.	.	H	α-helix	trans	-60.1	-39.1	-179.1	-80.4	-170.8	17.1	0	0	112.7	G718 R725	G718-Q721 VanDerWaalsContact O-CB 3.29Å; G718-Q721 WeakPolarHBondContact O-CB 3.3Å; G718-Q721 VanDerWaalsContact O-CG 3.27Å; G718-Q721 WeakPolarHBondContact O-CG 3.23Å; G718-Q721 PolarHBondContact O-N 2.78Å; Q721-R725 VanDerWaalsContact O-CB 3.31Å; Q721-R725 WeakPolarHBondContact O-CB 3.43Å; Q721-R725 WeakPolarHBondContact O-CG 3.44Å; Q721-R725 PolarHBondContact O-N 2.9Å
722	A	62	Low	65.4	Low	71 Å²	71	104.9 Å²	104.9	59%	0.587	49%	0.489	S	S	*	.	H	α-helix	trans	-63.4	-44.6	177.5	0	0	0	0	0	111.5	N720 R725 E726	N720-A722 VanDerWaalsContact C-N 3.32Å; N720-A722 PolarHBondContact O-N 3.46Å; A722-R725 PolarHBondContact O-N 3.37Å; A722-E726 PolarHBondContact O-N 3.31Å
723	M	63.8	Low	65.5	Low	137 Å²	137	111.3 Å²	111.3	68%	0.675	51%	0.514	S	S	*	.	H	α-helix	trans	-68.6	-40.2	179.6	-150	-177.9	-172.4	0	0	112	N720 E726 A727	N720-M723 PolarHBondContact O-N 3.13Å; M723-E726 PolarHBondContact O-N 3.34Å; M723-A727 WeakPolarHBondContact O-CB 3.23Å; M723-A727 PolarHBondContact O-N 3.4Å
724	K	62.7	Low	66	Low	109 Å²	109	116 Å²	116	47%	0.474	53%	0.531	S	S	.	.	H	α-helix	trans	-66.1	-38.7	172.8	-78.2	-178.1	179	172.7	0	112	E715 N720 A727 L728	E715-K724 WeakPolarHBondContact OE1-CE 3.5Å; E715-K724 IonicContact OE1-NZ 2.95Å; E715-K724 PolarHBondContact OE1-NZ 2.94Å; N720-K724 PolarHBondContact O-N 3.35Å; K724-A727 PolarHBondContact O-N 3.47Å; K724-L728 WeakPolarHBondContact O-CB 3.46Å; K724-L728 PolarHBondContact O-N 3.42Å
725	R	67.4	Low	66.3	Low	148 Å²	148	115.8 Å²	115.8	56%	0.558	53%	0.53	S	S	*	.	H	α-helix	trans	-63.5	-41.8	173.2	-75.5	174.6	-158.5	-179.4	7.5	111.5	Q721 A722 L728 R729	Q721-R725 VanDerWaalsContact O-CB 3.31Å; Q721-R725 WeakPolarHBondContact O-CB 3.43Å; Q721-R725 WeakPolarHBondContact O-CG 3.44Å; Q721-R725 PolarHBondContact O-N 2.9Å; A722-R725 PolarHBondContact O-N 3.37Å; R725-L728 PolarHBondContact O-N 2.88Å; R725-R729 WeakPolarHBondContact O-CB 3.4Å; R725-R729 VanDerWaalsContact O-CG 3.25Å; R725-R729 WeakPolarHBondContact O-CG 3.18Å; R725-R729 PolarHBondContact O-N 3.41Å
726	E	68.6	Low	66.5	Low	100 Å²	100	117.5 Å²	117.5	47%	0.467	54%	0.536	S	S	.	.	H	α-helix	trans	-66.2	-41.4	174.6	-78.8	-164	161.3	0	0	113	A722 M723 R729 R730	A722-E726 PolarHBondContact O-N 3.31Å; M723-E726 PolarHBondContact O-N 3.34Å; E726-R729 WeakPolarHBondContact O-CB 3.23Å; E726-R729 PolarHBondContact O-N 2.77Å; E726-R730 WeakPolarHBondContact O-CG 3.45Å; E726-R730 PolarHBondContact O-N 3.1Å
727	A	71	Confident	66.9	Low	55 Å²	55	118 Å²	118	46%	0.455	54%	0.539	S	S	.	.	H	α-helix	trans	-62.4	-42.5	175.3	0	0	0	0	0	111.8	M723 K724 R730 K731	M723-A727 WeakPolarHBondContact O-CB 3.23Å; M723-A727 PolarHBondContact O-N 3.4Å; K724-A727 PolarHBondContact O-N 3.47Å; A727-R730 PolarHBondContact O-N 3.11Å; A727-K731 WeakPolarHBondContact O-CB 3.41Å; A727-K731 PolarHBondContact O-N 3.32Å
728	L	68.5	Low	67.7	Low	90 Å²	90	111.7 Å²	111.7	47%	0.471	53%	0.527	S	S	.	.	H	α-helix	trans	-63.3	-39.8	172.5	-94.2	154.1	0	0	0	112.3	K724 R725 K731 R732	K724-L728 WeakPolarHBondContact O-CB 3.46Å; K724-L728 PolarHBondContact O-N 3.42Å; R725-L728 PolarHBondContact O-N 2.88Å; L728-K731 PolarHBondContact O-N 3.47Å; L728-R732 WeakPolarHBondContact O-CB 3.27Å; L728-R732 VanDerWaalsContact O-CG 3.3Å; L728-R732 WeakPolarHBondContact O-CG 3.49Å; L728-R732 PolarHBondContact O-N 2.88Å
729	R	73.4	Confident	67.8	Low	175 Å²	175	116.5 Å²	116.5	66%	0.66	55%	0.545	S	S	*	.	H	α-helix	trans	-63.4	-41.5	174.2	-76.3	171.8	177	-172.6	-1	111.5	R725 E726 R733	R725-R729 WeakPolarHBondContact O-CB 3.4Å; R725-R729 VanDerWaalsContact O-CG 3.25Å; R725-R729 WeakPolarHBondContact O-CG 3.18Å; R725-R729 PolarHBondContact O-N 3.41Å; E726-R729 WeakPolarHBondContact O-CB 3.23Å; E726-R729 PolarHBondContact O-N 2.77Å; R729-R733 WeakPolarHBondContact O-CB 3.47Å; R729-R733 WeakPolarHBondContact O-CG 3.12Å; R729-R733 PolarHBondContact O-N 2.94Å
730	R	74.7	Confident	68.1	Low	159 Å²	159	123 Å²	123	60%	0.6	56%	0.555	S	S	*	*	H	α-helix	trans	-64.8	-42.6	174.5	-73.6	-179.1	-178.4	131.3	6.2	111.9	E726 A727 R733 R734	E726-R730 WeakPolarHBondContact O-CG 3.45Å; E726-R730 PolarHBondContact O-N 3.1Å; A727-R730 PolarHBondContact O-N 3.11Å; R730-R733 PolarHBondContact O-N 2.95Å; R730-R734 WeakPolarHBondContact O-CG 3.4Å; R730-R734 PolarHBondContact O-N 3.44Å
731	K	74.4	Confident	68.3	Low	126 Å²	126	124.7 Å²	124.7	55%	0.548	58%	0.577	S	S	.	*	H	α-helix	trans	-63.1	-46.6	176.2	-170.1	178.4	177.6	-177.3	0	111.7	A727 L728 R733 R734 E735	A727-K731 WeakPolarHBondContact O-CB 3.41Å; A727-K731 PolarHBondContact O-N 3.32Å; L728-K731 PolarHBondContact O-N 3.47Å; K731-R733 VanDerWaalsContact C-N 3.31Å; K731-R733 PolarHBondContact O-N 3Å; K731-R734 PolarHBondContact O-N 3.47Å; K731-E735 VanDerWaalsContact CE-OE1 3.28Å; K731-E735 WeakPolarHBondContact CE-OE1 3.32Å; K731-E735 PolarHBondContact O-N 3.43Å
732	R	74.4	Confident	68.4	Low	158 Å²	158	122.9 Å²	122.9	60%	0.596	58%	0.58	S	S	*	*	H	α-helix	trans	-64.2	-32.5	175.5	-72.5	178.4	-177.9	-175.2	1.6	112.8	L728 K736	L728-R732 WeakPolarHBondContact O-CB 3.27Å; L728-R732 VanDerWaalsContact O-CG 3.3Å; L728-R732 WeakPolarHBondContact O-CG 3.49Å; L728-R732 PolarHBondContact O-N 2.88Å; R732-K736 WeakPolarHBondContact O-CB 3.2Å; R732-K736 VanDerWaalsContact O-CG 3.26Å; R732-K736 WeakPolarHBondContact O-CG 3.18Å; R732-K736 PolarHBondContact O-N 3.09Å
733	R	74.6	Confident	68.2	Low	180 Å²	180	122.6 Å²	122.6	68%	0.679	58%	0.584	S	S	*	*	H	α-helix	trans	-65.6	-47.3	171.9	-82.2	-174.5	-177.6	-169.7	1.1	111.3	R729 R730 K731 E735 K736 E737	R729-R733 WeakPolarHBondContact O-CB 3.47Å; R729-R733 WeakPolarHBondContact O-CG 3.12Å; R729-R733 PolarHBondContact O-N 2.94Å; R730-R733 PolarHBondContact O-N 2.95Å; K731-R733 VanDerWaalsContact C-N 3.31Å; K731-R733 PolarHBondContact O-N 3Å; R733-E735 VanDerWaalsContact C-N 3.34Å; R733-E735 PolarHBondContact O-N 2.83Å; R733-K736 PolarHBondContact O-N 3.45Å; R733-E737 WeakPolarHBondContact O-CB 3.32Å; R733-E737 WeakPolarHBondContact O-CG 3.24Å; R733-E737 PolarHBondContact O-N 3.16Å
734	R	74.4	Confident	67.8	Low	185 Å²	185	126.3 Å²	126.3	70%	0.698	59%	0.591	S	S	*	*	H	α-helix	trans	-61.5	-40.4	176	-71.4	179.6	179.7	174.6	-0.9	112.6	R730 K731 E737 A738	R730-R734 WeakPolarHBondContact O-CG 3.4Å; R730-R734 PolarHBondContact O-N 3.44Å; K731-R734 PolarHBondContact O-N 3.47Å; R734-E737 PolarHBondContact O-N 3.12Å; R734-A738 VanDerWaalsContact O-CB 3.28Å; R734-A738 WeakPolarHBondContact O-CB 3.23Å; R734-A738 PolarHBondContact O-N 3.14Å
735	E	71.4	Confident	67.1	Low	93 Å²	93	130 Å²	130	44%	0.435	61%	0.61	S	S	.	*	H	α-helix	trans	-67.3	-39.9	175.6	-76.4	169.9	-176.9	0	0	112	K731 R733 A738 Q739	K731-E735 VanDerWaalsContact CE-OE1 3.28Å; K731-E735 WeakPolarHBondContact CE-OE1 3.32Å; K731-E735 PolarHBondContact O-N 3.43Å; R733-E735 VanDerWaalsContact C-N 3.34Å; R733-E735 PolarHBondContact O-N 2.83Å; E735-A738 PolarHBondContact O-N 3.33Å; E735-Q739 VanDerWaalsContact O-CB 3.32Å; E735-Q739 WeakPolarHBondContact O-CB 3.39Å; E735-Q739 VanDerWaalsContact O-CG 3.31Å; E735-Q739 WeakPolarHBondContact O-CG 3.28Å; E735-Q739 PolarHBondContact O-N 3Å
736	K	70.1	Confident	66.2	Low	132 Å²	132	129.9 Å²	129.9	57%	0.574	62%	0.619	S	S	*	*	H	α-helix	trans	-66.1	-38.7	173.7	-78.6	-178.4	178.5	-170.1	0	112.4	R732 R733 Q739 R740	R732-K736 WeakPolarHBondContact O-CB 3.2Å; R732-K736 VanDerWaalsContact O-CG 3.26Å; R732-K736 WeakPolarHBondContact O-CG 3.18Å; R732-K736 PolarHBondContact O-N 3.09Å; R733-K736 PolarHBondContact O-N 3.45Å; K736-Q739 PolarHBondContact O-N 3.39Å; K736-R740 WeakPolarHBondContact O-CB 3.16Å; K736-R740 VanDerWaalsContact O-CG 3.24Å; K736-R740 WeakPolarHBondContact O-CG 3.49Å; K736-R740 PolarHBondContact O-N 3.08Å
737	E	71.6	Confident	64.8	Low	118 Å²	118	134.4 Å²	134.4	55%	0.551	64%	0.64	S	S	*	*	H	α-helix	trans	-66.6	-42.2	174.6	-75	164.2	-167.4	0	0	111.1	R733 R734 R740 A741	R733-E737 WeakPolarHBondContact O-CB 3.32Å; R733-E737 WeakPolarHBondContact O-CG 3.24Å; R733-E737 PolarHBondContact O-N 3.16Å; R734-E737 PolarHBondContact O-N 3.12Å; E737-R740 PolarHBondContact O-N 3.21Å; E737-A741 WeakPolarHBondContact O-CB 3.41Å; E737-A741 PolarHBondContact O-N 2.93Å
738	A	69	Low	63.3	Low	60 Å²	60	139.8 Å²	139.8	50%	0.496	66%	0.66	S	S	.	*	H	α-helix	trans	-64.5	-38.6	174	0	0	0	0	0	112.4	R734 E735 A741 A742	R734-A738 VanDerWaalsContact O-CB 3.28Å; R734-A738 WeakPolarHBondContact O-CB 3.23Å; R734-A738 PolarHBondContact O-N 3.14Å; E735-A738 PolarHBondContact O-N 3.33Å; A738-A741 PolarHBondContact O-N 3.25Å; A738-A742 VanDerWaalsContact O-CB 3.32Å; A738-A742 WeakPolarHBondContact O-CB 3.37Å; A738-A742 PolarHBondContact O-N 3.17Å
739	Q	59.8	Low	61.8	Low	121 Å²	121	141.2 Å²	141.2	57%	0.565	68%	0.678	S	S	*	*	H	α-helix	trans	-71.8	-33.3	176.2	-78.9	173.4	-17.4	0	0	112.9	E735 K736 A742 G743	E735-Q739 VanDerWaalsContact O-CB 3.32Å; E735-Q739 WeakPolarHBondContact O-CB 3.39Å; E735-Q739 VanDerWaalsContact O-CG 3.31Å; E735-Q739 WeakPolarHBondContact O-CG 3.28Å; E735-Q739 PolarHBondContact O-N 3Å; K736-Q739 PolarHBondContact O-N 3.39Å; Q739-A742 CarbonylContact O-C 3.52Å; Q739-A742 PolarHBondContact O-N 3.05Å; Q739-G743 PolarHBondContact O-N 3.19Å
740	R	63.5	Low	59.8	Low	203 Å²	203	135.9 Å²	135.9	77%	0.766	68%	0.678	S	S	*	*	H	α-helix	trans	-67.1	-42.2	170.1	-76.4	174.2	-177.8	-174.7	-1.5	111.5	K736 E737 A742 G743	K736-R740 WeakPolarHBondContact O-CB 3.16Å; K736-R740 VanDerWaalsContact O-CG 3.24Å; K736-R740 WeakPolarHBondContact O-CG 3.49Å; K736-R740 PolarHBondContact O-N 3.08Å; E737-R740 PolarHBondContact O-N 3.21Å; R740-A742 PolarHBondContact O-N 2.78Å; R740-G743 PolarHBondContact O-N 3.42Å
741	A	60.3	Low	57.9	Low	92 Å²	92	134.2 Å²	134.2	76%	0.76	69%	0.69	S	S	*	*	H	α-helix	trans	-64	-28.5	173.2	0	0	0	0	0	112.4	E737 A738 G743	E737-A741 WeakPolarHBondContact O-CB 3.41Å; E737-A741 PolarHBondContact O-N 2.93Å; A738-A741 PolarHBondContact O-N 3.25Å; A741-G743 VanDerWaalsContact C-N 3.35Å
742	A	60.3	Low	55.9	Low	68 Å²	68	138 Å²	138	56%	0.562	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	6.7	175.7	0	0	0	0	0	114.7	A738 Q739 R740 R744	A738-A742 VanDerWaalsContact O-CB 3.32Å; A738-A742 WeakPolarHBondContact O-CB 3.37Å; A738-A742 PolarHBondContact O-N 3.17Å; Q739-A742 CarbonylContact O-C 3.52Å; Q739-A742 PolarHBondContact O-N 3.05Å; R740-A742 PolarHBondContact O-N 2.78Å; A742-R744 VanDerWaalsContact C-N 3.34Å; A742-R744 PolarHBondContact O-N 2.78Å
743	G	58.6	Low	53.9	Low	66 Å²	66	137.5 Å²	137.5	68%	0.68	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	68	18.7	168.5	0	0	0	0	0	116.9	Q739 R740 A741	Q739-G743 PolarHBondContact O-N 3.19Å; R740-G743 PolarHBondContact O-N 3.42Å; A741-G743 VanDerWaalsContact C-N 3.35Å
744	R	56	Low	51.7	Low	214 Å²	214	134.1 Å²	134.1	81%	0.808	73%	0.726	S	S	*	*			trans	-92.5	112.3	179.5	-68.5	-172.8	-178.5	-161.2	0.4	111.5	A742	A742-R744 VanDerWaalsContact C-N 3.34Å; A742-R744 PolarHBondContact O-N 2.78Å
745	H	47.6	Very low	49.6	Very low	188 Å²	188	131 Å²	131	87%	0.87	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-76.8	139.2	175.3	-153	-89.7	0	0	0	111.2
746	L	48.1	Very low	47.6	Very low	144 Å²	144	133.7 Å²	133.7	75%	0.754	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-70.2	126.6	-179.7	-83.6	97.5	0	0	0	111.5
747	Q	39.3	Very low	45.7	Very low	195 Å²	195	132.3 Å²	132.3	91%	0.911	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-99.9	119.8	155.4	-75.2	-169.3	-14	0	0	108.6
748	L	39.8	Very low	43.5	Very low	168 Å²	168	137 Å²	137	88%	0.88	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-81	119.3	171.2	-70	163	0	0	0	108.1
749	S	35.7	Very low	41.6	Very low	120 Å²	120	142.8 Å²	142.8	84%	0.839	79%	0.793	S	S	*	*			trans	-115.1	115.8	163.6	175.9	0	0	0	0	107.8
750	G	31.8	Very low	40.2	Very low	64 Å²	64	142.7 Å²	142.7	66%	0.66	80%	0.8	S	S	*	*			trans	-86	143.9	179.2	0	0	0	0	0	111.6
751	S	34.9	Very low	38.6	Very low	123 Å²	123	141 Å²	141	86%	0.86	81%	0.807	S	S	*	*			trans	-159.2	99.9	155.2	-73.1	0	0	0	0	107.8
752	F	32	Very low	37.2	Very low	205 Å²	205	144.7 Å²	144.7	90%	0.899	81%	0.813	S	S	*	*			trans	-74.4	132.4	160.7	-86.4	-99	0	0	0	108.3
753	T	32	Very low	35.8	Very low	149 Å²	149	148.5 Å²	148.5	91%	0.914	82%	0.824	S	S	*	*			trans	-157	136.8	132.1	40.5	0	0	0	0	109.5
754	S	29.6	Very low	34.5	Very low	109 Å²	109	153.4 Å²	153.4	76%	0.762	83%	0.834	S	S	*	*			trans	-95.6	147.1	-175	46.2	0	0	0	0	111.6
755	S	30	Very low	33.2	Very low	118 Å²	118	151.6 Å²	151.6	83%	0.825	84%	0.84	S	S	*	*			trans	179.6	97.7	132.3	-77.5	0	0	0	0	110.4
756	V	30.1	Very low	32.3	Very low	151 Å²	151	148.6 Å²	148.6	92%	0.915	84%	0.84	S	S	*	*			trans	-140	112.5	152.4	-179.3	0	0	0	0	106.4
757	S	28.9	Very low	31.3	Very low	103 Å²	103	145.1 Å²	145.1	72%	0.72	84%	0.839	S	S	*	*			trans	-101.2	127.6	171.8	36.9	0	0	0	0	109
758	Y	25.9	Very low	30.7	Very low	217 Å²	217	147.9 Å²	147.9	85%	0.851	84%	0.841	S	S	*	*			trans	157.3	104.3	139	-104	-88.9	0	0	0	109.9
759	Q	30	Very low	30	Very low	181 Å²	181	145.1 Å²	145.1	85%	0.846	84%	0.836	S	S	*	*			trans	170.8	98.5	150.6	-99.3	167.7	-12.6	0	0	106
760	T	29	Very low	29.7	Very low	118 Å²	118	145.2 Å²	145.2	72%	0.724	84%	0.837	S	S	*	*				33.6	101	91.9	57.2	0	0	0	0	112.6
761	D	30.8	Very low	29.5	Very low	169 Å²	169	145.5 Å²	145.5	90%	0.904	84%	0.839	S	S	*	*			trans	-167.5	89.5	144	-85.8	-22.8	0	0	0	107.3
762	L	31.5	Very low	29.2	Very low	168 Å²	168	146.3 Å²	146.3	88%	0.88	84%	0.839	S	S	*	*			trans	-110.8	102.1	161.5	-105.1	160.6	0	0	0	104.2
763	D	29.4	Very low	29.1	Very low	149 Å²	149	141.9 Å²	141.9	80%	0.797	83%	0.834	S	S	*	*			trans	172	105.6	144.2	-85.6	-21.4	0	0	0	108.4
764	D	31.5	Very low	28.8	Very low	169 Å²	169	138.2 Å²	138.2	90%	0.904	83%	0.826	S	S	*	*			trans	-179.2	82.8	137.7	-94.5	-17.2	0	0	0	109.6
765	L	28.6	Very low	29.2	Very low	175 Å²	175	138.5 Å²	138.5	92%	0.916	83%	0.825	S	S	*	*			trans	-113.2	103.5	159.8	-84.5	169.9	0	0	0	108.1
766	S	30.2	Very low	29.2	Very low	125 Å²	125	140.6 Å²	140.6	87%	0.874	83%	0.826	S	S	*	*			trans	174.8	125.4	133.4	48.4	0	0	0	0	110.6
767	G	27.1	Very low	29.1	Very low	72 Å²	72	138 Å²	138	74%	0.742	82%	0.815	S	S	*	*			trans	170.7	44.3	180	0	0	0	0	0	116.4
768	W	26.4	Very low	29	Very low	252 Å²	252	140.2 Å²	140.2	96%	0.955	82%	0.819	S	S	*	*			trans	59.7	113.7	148.6	-64.6	6.3	0	0	0	120.4
769	S	25.8	Very low	29.1	Very low	111 Å²	111	134 Å²	134	78%	0.776	81%	0.807	S	S	*	*			trans	-63.6	142.8	151.4	50	0	0	0	0	113.4
770	S	28.8	Very low	29	Very low	122 Å²	122	133.3 Å²	133.3	85%	0.853	80%	0.804	S	S	*	*				152.3	110.8	129.6	58.4	0	0	0	0	108
771	G	27.2	Very low	29.2	Very low	69 Å²	69	142.7 Å²	142.7	71%	0.711	83%	0.826	S	S	*	*				128.4	132.2	81.7	0	0	0	0	0	103.8
772	T	27.8	Very low	29.1	Very low	140 Å²	140	141.4 Å²	141.4	86%	0.859	82%	0.822	S	S	*	*				171.2	150.3	60.5	35.8	0	0	0	0	101.9
773	S	30.8	Very low	29	Very low	113 Å²	113	139.9 Å²	139.9	79%	0.79	82%	0.819	S	S	*	*			cis	179.8	148.4	37.1	32.4	0	0	0	0	105.6
774	G	25.5	Very low	29	Very low	72 Å²	72	139.4 Å²	139.4	74%	0.742	82%	0.82	S	S	*	*			trans	-68.3	-151.9	177.3	0	0	0	0	0	114.8
775	P	39.3	Very low	28.9	Very low	115 Å²	115	137.7 Å²	137.7	75%	0.747	82%	0.815	S	S	*	*			cis	-137.2	169.1	19.7	32.6	-9.8	0	0	0	117.2
776	L	29.2	Very low	28.9	Very low	162 Å²	162	135.4 Å²	135.4	85%	0.848	81%	0.809	S	S	*	*			trans	30.3	134.9	136.9	-63.4	145.3	0	0	0	118.3
777	S	27.2	Very low	28.8	Very low	97 Å²	97	136.1 Å²	136.1	68%	0.678	81%	0.805	S	S	*	*				-171	150.9	58.2	55.2	0	0	0	0	112.5
778	D	27.7	Very low	28.9	Very low	148 Å²	148	140.6 Å²	140.6	79%	0.791	81%	0.809	S	S	*	*			trans	38.7	141.6	133.6	-65.8	-13.2	0	0	0	120.3
779	S	27.7	Very low	29.1	Very low	86 Å²	86	132.1 Å²	132.1	60%	0.601	80%	0.798	S	S	*	*			cis	174.8	159.7	6	48.2	0	0	0	0	106.9
780	Q	28.7	Very low	29.4	Very low	167 Å²	167	133.8 Å²	133.8	78%	0.78	80%	0.8	S	S	*	*			trans	64.6	120.4	155.8	-65	165.8	6.3	0	0	116
781	W	32.7	Very low	29.4	Very low	315 Å²	315	134.9 Å²	134.9	100%	1.193	80%	0.795	S	S	*	*			cis	-146.1	0	47.2	-80.2	76.5	0	0	0	112.1

Retrieved 781 of 781 residues in 859.3 ms (Link to these results)

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